A0A077YWV6_TRITR Loading...

Tetratricopeptide repeat containing

AlphaFold DB , UniProt , Accession A0A077YWV6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 272 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.7	Very low	35.9	Very low	162 Å²	162	105.2 Å²	105.2	80%	0.798	62%	0.616	S	S	*	*				0	-26.8	0	-91.5	-100.2	-92.3	0	0	115.4
2	V	34.6	Very low	35.5	Very low	140 Å²	140	110.3 Å²	110.3	85%	0.848	63%	0.626	S	S	*	*			trans	-74.7	-32.5	-178.2	-175.9	0	0	0	0	113.4
3	G	31.8	Very low	35.4	Very low	43 Å²	43	116.2 Å²	116.2	44%	0.443	64%	0.644	S	S	.	*	S	Bend	trans	-72.8	-35.5	-178.9	0	0	0	0	0	115.7	V5 A6	G3-V5 PolarHBondContact O-N 3.42Å; G3-V5 VanDerWaalsContact O-N 3.13Å; G3-A6 PolarHBondContact O-N 3.01Å
4	I	42.2	Very low	35.8	Very low	60 Å²	60	111.8 Å²	111.8	31%	0.308	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.9	-23.6	-171.2	-64.5	167.9	0	0	0	113.4
5	V	36.5	Very low	36.7	Very low	111 Å²	111	112.5 Å²	112.5	67%	0.673	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-24.6	-173.6	-178.1	0	0	0	0	112.8	G3	G3-V5 PolarHBondContact O-N 3.42Å; G3-V5 VanDerWaalsContact O-N 3.13Å
6	A	31.8	Very low	37.5	Very low	81 Å²	81	117.1 Å²	117.1	67%	0.669	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-34.6	-173.3	0	0	0	0	0	113.4	G3	G3-A6 PolarHBondContact O-N 3.01Å
7	T	34.2	Very low	38.4	Very low	89 Å²	89	115.6 Å²	115.6	55%	0.546	63%	0.632	S	S	.	*	G	3₁₀ helix	trans	-81.6	-19.9	-166.9	-44.7	0	0	0	0	114	K9	T7-K9 PolarHBondContact O-N 3.16Å
8	V	36	Very low	40.1	Very low	91 Å²	91	113.1 Å²	113.1	55%	0.552	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-70	-18	-175.1	-178.9	0	0	0	0	113.1
9	K	32.8	Very low	42.1	Very low	189 Å²	189	111.6 Å²	111.6	82%	0.822	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-88.6	-12.6	-164.9	-124.7	179.2	-176.2	-179.4	0	116.7	T7	T7-K9 PolarHBondContact O-N 3.16Å
10	S	34.3	Very low	44	Very low	108 Å²	108	111.6 Å²	111.6	76%	0.755	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-99.9	12.8	-169.5	72	0	0	0	0	116.2
11	F	41.6	Very low	45.7	Very low	83 Å²	83	109.8 Å²	109.8	36%	0.364	59%	0.592	S	S	.	*			trans	-100.7	10.4	-156.4	-142.8	-99.3	0	0	0	117.8	R21 K61	F11-R21 VanDerWaalsContact CE1-NH1 3.34Å; F11-K61 HydrophobicContact CE2-CB 4.41Å; F11-K61 HydrophobicContact CE2-CD 4.2Å
12	F	30.8	Very low	47.8	Very low	166 Å²	166	108.5 Å²	108.5	73%	0.728	58%	0.582	S	S	*	*			trans	-91.6	121.4	-175.1	-65.3	-76.7	0	0	0	112.4
13	H	34.3	Very low	50.4	Low	187 Å²	187	108 Å²	108	87%	0.866	57%	0.568	S	S	*	*			trans	160.5	101.5	138.9	-84.1	92	0	0	0	111.3
14	S	40.8	Very low	53.2	Low	55 Å²	55	106.2 Å²	106.2	39%	0.385	55%	0.549	S	S	.	.			trans	160.1	129.2	156.7	167.6	0	0	0	0	112.3	E17 D18	S14-E17 VanDerWaalsContact CB-OE2 3.26Å; S14-E17 WeakPolarHBondContact CB-OE2 2.96Å; S14-E17 PolarHBondContact OG-OE2 3.47Å; S14-D18 WeakPolarHBondContact O-CB 3.43Å; S14-D18 VanDerWaalsContact O-CG 3.31Å; S14-D18 PolarHBondContact O-N 3.36Å
15	T	49.9	Very low	55.4	Low	122 Å²	122	104.6 Å²	104.6	75%	0.748	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-30.2	-156.6	49	0	0	0	0	118.9
16	K	48.3	Very low	58	Low	186 Å²	186	103 Å²	103	81%	0.809	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-41	174.9	-90.4	-172.6	176.7	-177.5	0	111.6	D18 V19	K16-D18 PolarHBondContact O-N 2.77Å; K16-V19 PolarHBondContact O-N 3.33Å
17	E	53.8	Low	60.9	Low	92 Å²	92	100.1 Å²	100.1	43%	0.43	51%	0.505	S	S	.	.	H	α-helix	trans	-58.2	-31.9	167.9	-66.1	179.7	113.7	0	0	110.9	S14 V19 R21	S14-E17 VanDerWaalsContact CB-OE2 3.26Å; S14-E17 WeakPolarHBondContact CB-OE2 2.96Å; S14-E17 PolarHBondContact OG-OE2 3.47Å; E17-V19 VanDerWaalsContact C-N 3.35Å; E17-V19 PolarHBondContact O-N 3.1Å; E17-R21 VanDerWaalsContact CD-NH2 3.34Å; E17-R21 WeakPolarHBondContact O-CB 3.48Å; E17-R21 WeakPolarHBondContact O-CG 3.49Å; E17-R21 PolarHBondContact O-N 3.17Å; E17-R21 IonicContact OE1-CZ 3.97Å; E17-R21 IonicContact OE1-NH2 3.77Å; E17-R21 PolarHBondContact OE1-NH2 3.01Å; E17-R21 IonicContact OE2-NH2 2.74Å
18	D	68.7	Low	63.6	Low	71 Å²	71	96.6 Å²	96.6	38%	0.38	48%	0.483	S	S	.	.	H	α-helix	trans	-59.9	-36.5	177.9	-113.5	-22.1	0	0	0	114	S14 K16 K22	S14-D18 WeakPolarHBondContact O-CB 3.43Å; S14-D18 VanDerWaalsContact O-CG 3.31Å; S14-D18 PolarHBondContact O-N 3.36Å; K16-D18 PolarHBondContact O-N 2.77Å; D18-K22 WeakPolarHBondContact O-CA 3.41Å; D18-K22 WeakPolarHBondContact O-CB 3.5Å; D18-K22 PolarHBondContact O-N 3.37Å
19	V	78.9	Confident	66.3	Low	85 Å²	85	98.4 Å²	98.4	52%	0.515	48%	0.48	S	S	.	.	H	α-helix	trans	-72	-47.8	-175.2	179.8	0	0	0	0	110.9	K16 E17 K22 K23	K16-V19 PolarHBondContact O-N 3.33Å; E17-V19 VanDerWaalsContact C-N 3.35Å; E17-V19 PolarHBondContact O-N 3.1Å; V19-K22 PolarHBondContact O-N 3.01Å; V19-K23 WeakPolarHBondContact O-CG 3.5Å; V19-K23 PolarHBondContact O-N 3.29Å
20	E	78.9	Confident	69.2	Low	111 Å²	111	93.9 Å²	93.9	52%	0.519	46%	0.462	S	S	.	.	H	α-helix	trans	-66.9	-45.8	177.4	-74.1	176.5	-179.4	0	0	111	K22 K23 I24	E20-K22 VanDerWaalsContact C-N 3.29Å; E20-K22 PolarHBondContact O-N 3.19Å; E20-K23 WeakPolarHBondContact O-CB 3.34Å; E20-K23 PolarHBondContact O-N 3.41Å; E20-K23 VanDerWaalsContact O-N 3.13Å; E20-I24 WeakPolarHBondContact O-CG1 3.45Å; E20-I24 PolarHBondContact O-N 3.49Å
21	R	79.4	Confident	72.1	Confident	74 Å²	74	88.8 Å²	88.8	28%	0.279	43%	0.426	S	S	.	.	H	α-helix	trans	-63.5	-34.6	176	-65.9	-169.1	-154.8	-169.4	3.1	112.4	F11 E17 I24 A25 D59	F11-R21 VanDerWaalsContact CE1-NH1 3.34Å; E17-R21 VanDerWaalsContact CD-NH2 3.34Å; E17-R21 WeakPolarHBondContact O-CB 3.48Å; E17-R21 WeakPolarHBondContact O-CG 3.49Å; E17-R21 PolarHBondContact O-N 3.17Å; E17-R21 IonicContact OE1-CZ 3.97Å; E17-R21 IonicContact OE1-NH2 3.77Å; E17-R21 PolarHBondContact OE1-NH2 3.01Å; E17-R21 IonicContact OE2-NH2 2.74Å; R21-I24 PolarHBondContact O-N 2.97Å; R21-A25 VanDerWaalsContact O-CB 3.26Å; R21-A25 WeakPolarHBondContact O-CB 3.37Å; R21-A25 PolarHBondContact O-N 3.4Å; R21-D59 WeakPolarHBondContact CD-OD2 3.43Å; R21-D59 IonicContact CZ-OD2 3.9Å; R21-D59 IonicContact NE-OD2 2.83Å; R21-D59 PolarHBondContact NE-OD2 3.11Å; R21-D59 IonicContact NH1-OD2 3.74Å
22	K	85.2	Confident	74.3	Confident	134 Å²	134	86.4 Å²	86.4	58%	0.583	42%	0.417	S	S	*	.	H	α-helix	trans	-66	-42.4	173.2	-177.3	176.1	-178.5	-179.4	0	111.7	D18 V19 E20 A25 D26	D18-K22 WeakPolarHBondContact O-CA 3.41Å; D18-K22 WeakPolarHBondContact O-CB 3.5Å; D18-K22 PolarHBondContact O-N 3.37Å; V19-K22 PolarHBondContact O-N 3.01Å; E20-K22 VanDerWaalsContact C-N 3.29Å; E20-K22 PolarHBondContact O-N 3.19Å; K22-A25 PolarHBondContact O-N 3.04Å; K22-D26 WeakPolarHBondContact O-CB 3.39Å; K22-D26 PolarHBondContact O-N 3.48Å
23	K	88.5	Confident	77.2	Confident	129 Å²	129	83.1 Å²	83.1	56%	0.561	41%	0.406	S	S	*	.	H	α-helix	trans	-59.4	-48.2	173.9	-73.3	173.7	-178.6	178.2	0	111.2	V19 E20 A25 D26 I27	V19-K23 WeakPolarHBondContact O-CG 3.5Å; V19-K23 PolarHBondContact O-N 3.29Å; E20-K23 WeakPolarHBondContact O-CB 3.34Å; E20-K23 PolarHBondContact O-N 3.41Å; E20-K23 VanDerWaalsContact O-N 3.13Å; K23-A25 VanDerWaalsContact C-N 3.33Å; K23-A25 PolarHBondContact O-N 3.46Å; K23-D26 PolarHBondContact O-N 3.01Å; K23-I27 WeakPolarHBondContact O-CG1 3.21Å; K23-I27 PolarHBondContact O-N 3.37Å
24	I	90.1	Very high	80	Confident	6 Å²	6	74.7 Å²	74.7	3%	0.031	37%	0.368	C	S	.	.	H	α-helix	trans	-59.1	-46.5	176.4	-65.9	165.4	0	0	0	110.1	E20 R21 D26 I27 I28 A50 D53 A54 A62 I66	E20-I24 WeakPolarHBondContact O-CG1 3.45Å; E20-I24 PolarHBondContact O-N 3.49Å; R21-I24 PolarHBondContact O-N 2.97Å; I24-D26 VanDerWaalsContact C-N 3.32Å; I24-D26 PolarHBondContact O-N 3.38Å; I24-I27 PolarHBondContact O-N 2.89Å; I24-I28 HydrophobicContact CG2-CD1 3.79Å; I24-I28 HydrophobicContact CG2-CG1 4.41Å; I24-I28 VanDerWaalsContact O-CG1 3.27Å; I24-I28 WeakPolarHBondContact O-CG1 3.23Å; I24-I28 PolarHBondContact O-N 3.44Å; I24-A50 HydrophobicContact CG2-CB 4.47Å; I24-D53 HydrophobicContact CD1-CB 4.31Å; I24-D53 HydrophobicContact CG1-CB 3.9Å; I24-A54 HydrophobicContact CD1-CB 4.12Å; I24-A62 HydrophobicContact CG2-CB 4.44Å; I24-I66 HydrophobicContact CG2-CD1 3.99Å
25	A	88.9	Confident	82.5	Confident	27 Å²	27	74.5 Å²	74.5	22%	0.223	36%	0.359	C	S	.	.	H	α-helix	trans	-62.7	-36	178.1	0	0	0	0	0	113.1	R21 K22 K23 R29	R21-A25 VanDerWaalsContact O-CB 3.26Å; R21-A25 WeakPolarHBondContact O-CB 3.37Å; R21-A25 PolarHBondContact O-N 3.4Å; K22-A25 PolarHBondContact O-N 3.04Å; K23-A25 VanDerWaalsContact C-N 3.33Å; K23-A25 PolarHBondContact O-N 3.46Å; A25-R29 VanDerWaalsContact O-CG 3.32Å; A25-R29 WeakPolarHBondContact O-CG 3.29Å; A25-R29 PolarHBondContact O-N 3.34Å
26	D	90.5	Very high	84.3	Confident	76 Å²	76	75.9 Å²	75.9	41%	0.406	35%	0.351	S	S	.	.	H	α-helix	trans	-67.1	-43.2	175.8	-71.4	-23.4	0	0	0	111.1	K22 K23 I24 I28 R29 E30	K22-D26 WeakPolarHBondContact O-CB 3.39Å; K22-D26 PolarHBondContact O-N 3.48Å; K23-D26 PolarHBondContact O-N 3.01Å; I24-D26 VanDerWaalsContact C-N 3.32Å; I24-D26 PolarHBondContact O-N 3.38Å; D26-I28 PolarHBondContact O-N 2.96Å; D26-R29 PolarHBondContact O-N 3.14Å; D26-R29 IonicContact OD1-CZ 3.1Å; D26-R29 IonicContact OD1-NH1 3.79Å; D26-R29 PolarHBondContact OD1-NH1 3.49Å; D26-E30 PolarHBondContact O-N 3.24Å
27	I	93.2	Very high	86.4	Confident	21 Å²	21	73.4 Å²	73.4	11%	0.108	35%	0.346	C	S	.	.	H	α-helix	trans	-62.3	-43.7	174.6	-62.5	168.4	0	0	0	110.7	K23 I24 R29 E30 A31 L46 K49 A50 D53	K23-I27 WeakPolarHBondContact O-CG1 3.21Å; K23-I27 PolarHBondContact O-N 3.37Å; I24-I27 PolarHBondContact O-N 2.89Å; I27-R29 VanDerWaalsContact C-N 3.34Å; I27-R29 PolarHBondContact O-N 2.73Å; I27-E30 PolarHBondContact O-N 3.09Å; I27-A31 WeakPolarHBondContact O-CB 3.42Å; I27-A31 PolarHBondContact O-N 3.25Å; I27-L46 HydrophobicContact CG2-CB 4.11Å; I27-L46 HydrophobicContact CG2-CD2 4.19Å; I27-L46 WeakPolarHBondContact CG2-O 3.47Å; I27-K49 HydrophobicContact CD1-CD 4.46Å; I27-A50 HydrophobicContact CB-CB 4.26Å; I27-A50 HydrophobicContact CG2-CB 3.8Å; I27-D53 WeakPolarHBondContact CD1-OD2 3.38Å
28	I	91.3	Very high	88.1	Confident	16 Å²	16	72.1 Å²	72.1	8%	0.082	36%	0.358	C	S	.	.	H	α-helix	trans	-59.5	-44.4	176.2	-70.9	168.2	0	0	0	110.9	I24 D26 E30 A31 I32 A50 Y65 I66 L69	I24-I28 HydrophobicContact CG2-CD1 3.79Å; I24-I28 HydrophobicContact CG2-CG1 4.41Å; I24-I28 VanDerWaalsContact O-CG1 3.27Å; I24-I28 WeakPolarHBondContact O-CG1 3.23Å; I24-I28 PolarHBondContact O-N 3.44Å; D26-I28 PolarHBondContact O-N 2.96Å; I28-E30 VanDerWaalsContact C-N 3.35Å; I28-E30 PolarHBondContact O-N 3Å; I28-A31 WeakPolarHBondContact O-CB 3.5Å; I28-A31 PolarHBondContact O-N 2.97Å; I28-I32 HydrophobicContact CG2-CD1 3.84Å; I28-I32 HydrophobicContact CG2-CG1 4.48Å; I28-I32 VanDerWaalsContact O-CG1 3.31Å; I28-I32 WeakPolarHBondContact O-CG1 3.41Å; I28-I32 PolarHBondContact O-N 3.48Å; I28-A50 HydrophobicContact CG1-CB 4.15Å; I28-Y65 HydrophobicContact CD1-CD1 4.12Å; I28-Y65 HydrophobicContact CD1-CE1 4.34Å; I28-Y65 HydrophobicContact CG2-CE1 3.73Å; I28-I66 HydrophobicContact CD1-CD1 3.99Å; I28-I66 HydrophobicContact CD1-CG1 3.67Å; I28-I66 HydrophobicContact CG1-CD1 4.41Å; I28-I66 HydrophobicContact CG1-CG1 4.03Å; I28-L69 HydrophobicContact CG2-CD2 4.4Å
29	R	91.9	Very high	89.3	Confident	129 Å²	129	71.7 Å²	71.7	49%	0.487	36%	0.356	S	S	.	.	H	α-helix	trans	-62.3	-43.6	177.5	-73.8	178.7	-161.3	104.4	6.7	111.4	A25 D26 I27 A31 I32 L33	A25-R29 VanDerWaalsContact O-CG 3.32Å; A25-R29 WeakPolarHBondContact O-CG 3.29Å; A25-R29 PolarHBondContact O-N 3.34Å; D26-R29 PolarHBondContact O-N 3.14Å; D26-R29 IonicContact OD1-CZ 3.1Å; D26-R29 IonicContact OD1-NH1 3.79Å; D26-R29 PolarHBondContact OD1-NH1 3.49Å; I27-R29 VanDerWaalsContact C-N 3.34Å; I27-R29 PolarHBondContact O-N 2.73Å; R29-A31 VanDerWaalsContact C-N 3.31Å; R29-A31 PolarHBondContact O-N 3.11Å; R29-I32 PolarHBondContact O-N 2.7Å; R29-L33 WeakPolarHBondContact O-CB 3.29Å; R29-L33 VanDerWaalsContact O-CG 3.31Å; R29-L33 WeakPolarHBondContact O-CG 3.28Å; R29-L33 PolarHBondContact O-N 3.3Å
30	E	94.3	Very high	89.9	Confident	94 Å²	94	68.3 Å²	68.3	44%	0.439	34%	0.337	S	S	.	.	H	α-helix	trans	-62.2	-40.1	175.9	-167.9	-177.8	167.3	0	0	111.6	D26 I27 I28 L33 S34 L46	D26-E30 PolarHBondContact O-N 3.24Å; I27-E30 PolarHBondContact O-N 3.09Å; I28-E30 VanDerWaalsContact C-N 3.35Å; I28-E30 PolarHBondContact O-N 3Å; E30-L33 PolarHBondContact O-N 3.29Å; E30-S34 WeakPolarHBondContact O-CB 3.44Å; E30-S34 PolarHBondContact O-N 3.18Å; E30-S34 PolarHBondContact O-OG 3.05Å; E30-L46 HydrophobicContact CB-CD1 4.12Å; E30-L46 HydrophobicContact CG-CD1 3.75Å
31	A	94	Very high	90.6	Very high	0 Å²	0	67 Å²	67	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-44.9	176.5	0	0	0	0	0	112.4	I27 I28 R29 L33 S34 Y35 S43 L46 L47	I27-A31 WeakPolarHBondContact O-CB 3.42Å; I27-A31 PolarHBondContact O-N 3.25Å; I28-A31 WeakPolarHBondContact O-CB 3.5Å; I28-A31 PolarHBondContact O-N 2.97Å; R29-A31 VanDerWaalsContact C-N 3.31Å; R29-A31 PolarHBondContact O-N 3.11Å; A31-L33 VanDerWaalsContact C-N 3.34Å; A31-L33 PolarHBondContact O-N 3Å; A31-S34 PolarHBondContact O-N 2.74Å; A31-Y35 PolarHBondContact O-N 3.48Å; A31-S43 VanDerWaalsContact O-CB 3.31Å; A31-S43 WeakPolarHBondContact O-CB 3.43Å; A31-S43 PolarHBondContact O-OG 3.22Å; A31-L46 HydrophobicContact CB-CB 3.68Å; A31-L46 HydrophobicContact CB-CD1 4.28Å; A31-L47 HydrophobicContact CB-CD2 3.73Å; A31-L47 HydrophobicContact CB-CG 3.71Å
32	I	89.7	Confident	91.3	Very high	34 Å²	34	67.1 Å²	67.1	17%	0.174	34%	0.342	C	S	.	.	H	α-helix	trans	-63.1	-41.7	176.9	-67.9	167.6	0	0	0	110.6	I28 R29 Y35 R36 L69	I28-I32 HydrophobicContact CG2-CD1 3.84Å; I28-I32 HydrophobicContact CG2-CG1 4.48Å; I28-I32 VanDerWaalsContact O-CG1 3.31Å; I28-I32 WeakPolarHBondContact O-CG1 3.41Å; I28-I32 PolarHBondContact O-N 3.48Å; R29-I32 PolarHBondContact O-N 2.7Å; I32-Y35 PolarHBondContact O-N 3.06Å; I32-R36 WeakPolarHBondContact O-CB 3.47Å; I32-R36 VanDerWaalsContact O-CG 3.31Å; I32-R36 WeakPolarHBondContact O-CG 3.44Å; I32-R36 PolarHBondContact O-N 3.06Å; I32-L69 HydrophobicContact CD1-CD2 4.08Å; I32-L69 HydrophobicContact CG1-CD2 3.8Å
33	L	91	Very high	91.8	Very high	96 Å²	96	60.8 Å²	60.8	50%	0.503	31%	0.314	S	S	.	.	H	α-helix	trans	-65	-43.8	175.8	-72.1	172.8	0	0	0	111.6	R29 E30 A31 Y35 R36 N37	R29-L33 WeakPolarHBondContact O-CB 3.29Å; R29-L33 VanDerWaalsContact O-CG 3.31Å; R29-L33 WeakPolarHBondContact O-CG 3.28Å; R29-L33 PolarHBondContact O-N 3.3Å; E30-L33 PolarHBondContact O-N 3.29Å; A31-L33 VanDerWaalsContact C-N 3.34Å; A31-L33 PolarHBondContact O-N 3Å; L33-Y35 VanDerWaalsContact C-N 3.3Å; L33-Y35 PolarHBondContact O-N 2.93Å; L33-R36 PolarHBondContact O-N 2.99Å; L33-N37 WeakPolarHBondContact O-CB 3.5Å; L33-N37 PolarHBondContact O-N 3.4Å; L33-N37 PolarHBondContact O-ND2 3.39Å
34	S	93.3	Very high	92.2	Very high	10 Å²	10	55.7 Å²	55.7	7%	0.07	29%	0.293	C	S	.	.	H	α-helix	trans	-58.4	-43.8	176.7	-61.4	0	0	0	0	111.2	E30 A31 N37 G38 N39	E30-S34 WeakPolarHBondContact O-CB 3.44Å; E30-S34 PolarHBondContact O-N 3.18Å; E30-S34 PolarHBondContact O-OG 3.05Å; A31-S34 PolarHBondContact O-N 2.74Å; S34-N37 PolarHBondContact O-N 3.5Å; S34-G38 PolarHBondContact O-N 2.92Å; S34-N39 WeakPolarHBondContact O-CA 3.5Å; S34-N39 WeakPolarHBondContact O-CB 3.37Å; S34-N39 PolarHBondContact O-N 2.91Å
35	Y	92	Very high	92.5	Very high	51 Å²	51	60.6 Å²	60.6	20%	0.2	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-47.4	177	-170.4	-110.4	0	0	0	112.5	A31 I32 L33 N37 G38 A40 S43 I73 E76	A31-Y35 PolarHBondContact O-N 3.48Å; I32-Y35 PolarHBondContact O-N 3.06Å; L33-Y35 VanDerWaalsContact C-N 3.3Å; L33-Y35 PolarHBondContact O-N 2.93Å; Y35-N37 PolarHBondContact O-N 3.11Å; Y35-G38 WeakPolarHBondContact O-CA 3.33Å; Y35-G38 PolarHBondContact O-N 3.12Å; Y35-A40 HydrophobicContact CD2-CB 4.14Å; Y35-A40 HydrophobicContact CE2-CB 4.11Å; Y35-S43 WeakPolarHBondContact CB-OG 3.33Å; Y35-I73 HydrophobicContact CD1-CG1 4.26Å; Y35-I73 HydrophobicContact CD2-CD1 4.25Å; Y35-I73 HydrophobicContact CD2-CG1 4.1Å; Y35-I73 HydrophobicContact CD2-CG2 3.97Å; Y35-I73 HydrophobicContact CE1-CG1 4.2Å; Y35-I73 HydrophobicContact CE2-CB 4.33Å; Y35-I73 HydrophobicContact CE2-CG1 4.06Å; Y35-I73 HydrophobicContact CE2-CG2 3.64Å; Y35-I73 HydrophobicContact CG-CD1 4.21Å; Y35-I73 HydrophobicContact CG-CG1 4.22Å; Y35-E76 WeakPolarHBondContact CE1-OE2 3.29Å; Y35-E76 VanDerWaalsContact CZ-OE2 3.23Å; Y35-E76 WeakPolarHBondContact OH-CB 3.46Å; Y35-E76 PolarHBondContact OH-OE2 2.99Å
36	R	88.9	Confident	92.9	Very high	152 Å²	152	60.4 Å²	60.4	57%	0.574	31%	0.314	S	S	*	.	H	α-helix	trans	-60	-30.1	176.8	-76.1	176.2	174	-177.4	-0.3	113	I32 L33 G38	I32-R36 WeakPolarHBondContact O-CB 3.47Å; I32-R36 VanDerWaalsContact O-CG 3.31Å; I32-R36 WeakPolarHBondContact O-CG 3.44Å; I32-R36 PolarHBondContact O-N 3.06Å; L33-R36 PolarHBondContact O-N 2.99Å; R36-G38 PolarHBondContact O-N 3.03Å
37	N	92.9	Very high	93.2	Very high	133 Å²	133	56.8 Å²	56.8	71%	0.711	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	5.4	175	-66.5	-21.1	0	0	0	113	L33 S34 Y35 N39	L33-N37 WeakPolarHBondContact O-CB 3.5Å; L33-N37 PolarHBondContact O-N 3.4Å; L33-N37 PolarHBondContact O-ND2 3.39Å; S34-N37 PolarHBondContact O-N 3.5Å; Y35-N37 PolarHBondContact O-N 3.11Å; N37-N39 VanDerWaalsContact C-N 3.34Å
38	G	88.7	Confident	93.4	Very high	65 Å²	65	59.7 Å²	59.7	67%	0.67	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	5.3	179.4	0	0	0	0	0	114.8	S34 Y35 R36 A40	S34-G38 PolarHBondContact O-N 2.92Å; Y35-G38 WeakPolarHBondContact O-CA 3.33Å; Y35-G38 PolarHBondContact O-N 3.12Å; R36-G38 PolarHBondContact O-N 3.03Å; G38-A40 PolarHBondContact O-N 3.38Å
39	N	93.8	Very high	93.6	Very high	63 Å²	63	64.6 Å²	64.6	34%	0.337	33%	0.328	S	S	.	.			trans	-93	73	177.2	-164	-10.5	0	0	0	111.1	S34 N37 Q42 S43	S34-N39 WeakPolarHBondContact O-CA 3.5Å; S34-N39 WeakPolarHBondContact O-CB 3.37Å; S34-N39 PolarHBondContact O-N 2.91Å; N37-N39 VanDerWaalsContact C-N 3.34Å; N39-Q42 HydrophobicContact CB-CB 4.26Å; N39-Q42 VanDerWaalsContact CG-CB 3.4Å; N39-Q42 VanDerWaalsContact ND2-CB 3.35Å; N39-Q42 WeakPolarHBondContact ND2-CB 3.42Å; N39-Q42 PolarHBondContact ND2-OE1 3.29Å; N39-Q42 WeakPolarHBondContact OD1-CB 3.44Å; N39-Q42 PolarHBondContact OD1-N 3.45Å; N39-S43 PolarHBondContact O-N 3.41Å; N39-S43 VanDerWaalsContact O-N 3.08Å
40	A	91	Very high	93.7	Very high	14 Å²	14	58.4 Å²	58.4	12%	0.116	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-43.7	178.7	0	0	0	0	0	114	Y35 G38 Q42 S43 I44 L77	Y35-A40 HydrophobicContact CD2-CB 4.14Å; Y35-A40 HydrophobicContact CE2-CB 4.11Å; G38-A40 PolarHBondContact O-N 3.38Å; A40-Q42 PolarHBondContact O-N 3.07Å; A40-S43 WeakPolarHBondContact O-CB 3.33Å; A40-S43 PolarHBondContact O-N 3.48Å; A40-I44 WeakPolarHBondContact O-CG1 3.32Å; A40-I44 PolarHBondContact O-N 2.98Å; A40-L77 HydrophobicContact CB-CD1 3.93Å; A40-L77 HydrophobicContact CB-CD2 3.91Å
41	P	94	Very high	93.7	Very high	84 Å²	84	55.1 Å²	55.1	55%	0.545	29%	0.29	S	S	.	.	H	α-helix	trans	-57.3	-48.2	177.3	-26.5	35.7	0	0	0	113	S43 I44 D45	P41-S43 VanDerWaalsContact C-N 3.33Å; P41-S43 PolarHBondContact O-N 3.16Å; P41-I44 PolarHBondContact O-N 3.24Å; P41-D45 PolarHBondContact O-N 3.02Å
42	Q	94.8	Very high	93.8	Very high	76 Å²	76	58 Å²	58	36%	0.355	31%	0.31	S	S	.	.	H	α-helix	trans	-62.8	-40.8	177.8	-177.4	-179.1	6.6	0	0	111.9	N39 A40 D45 L46	N39-Q42 HydrophobicContact CB-CB 4.26Å; N39-Q42 VanDerWaalsContact CG-CB 3.4Å; N39-Q42 VanDerWaalsContact ND2-CB 3.35Å; N39-Q42 WeakPolarHBondContact ND2-CB 3.42Å; N39-Q42 PolarHBondContact ND2-OE1 3.29Å; N39-Q42 WeakPolarHBondContact OD1-CB 3.44Å; N39-Q42 PolarHBondContact OD1-N 3.45Å; A40-Q42 PolarHBondContact O-N 3.07Å; Q42-D45 PolarHBondContact O-N 3.09Å; Q42-L46 HydrophobicContact CG-CD1 4.04Å; Q42-L46 HydrophobicContact CG-CG 4.46Å; Q42-L46 WeakPolarHBondContact O-CB 3.49Å; Q42-L46 VanDerWaalsContact O-CG 3.27Å; Q42-L46 WeakPolarHBondContact O-CG 3.49Å; Q42-L46 PolarHBondContact O-N 3.3Å
43	S	95	Very high	93.9	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.2	-47.6	176.3	-175.1	0	0	0	0	111.8	A31 Y35 N39 A40 P41 D45 L46 L47	A31-S43 VanDerWaalsContact O-CB 3.31Å; A31-S43 WeakPolarHBondContact O-CB 3.43Å; A31-S43 PolarHBondContact O-OG 3.22Å; Y35-S43 WeakPolarHBondContact CB-OG 3.33Å; N39-S43 PolarHBondContact O-N 3.41Å; N39-S43 VanDerWaalsContact O-N 3.08Å; A40-S43 WeakPolarHBondContact O-CB 3.33Å; A40-S43 PolarHBondContact O-N 3.48Å; P41-S43 VanDerWaalsContact C-N 3.33Å; P41-S43 PolarHBondContact O-N 3.16Å; S43-D45 PolarHBondContact O-N 2.8Å; S43-L46 PolarHBondContact O-N 3.21Å; S43-L47 WeakPolarHBondContact O-CG 3.45Å; S43-L47 PolarHBondContact O-N 2.98Å
44	I	96.6	Very high	94	Very high	22 Å²	22	54.2 Å²	54.2	11%	0.113	29%	0.291	C	S	.	.	H	α-helix	trans	-61.1	-45	179.3	-71.3	165.6	0	0	0	110.9	A40 P41 L46 L47 H48 I73 Y74 L77	A40-I44 WeakPolarHBondContact O-CG1 3.32Å; A40-I44 PolarHBondContact O-N 2.98Å; P41-I44 PolarHBondContact O-N 3.24Å; I44-L46 VanDerWaalsContact C-N 3.35Å; I44-L46 PolarHBondContact O-N 2.64Å; I44-L47 PolarHBondContact O-N 3.47Å; I44-H48 PolarHBondContact O-CD2 3.14Å; I44-H48 VanDerWaalsContact O-CD2 3.31Å; I44-H48 PolarHBondContact O-N 3.27Å; I44-I73 HydrophobicContact CD1-CG2 4.33Å; I44-I73 HydrophobicContact CG1-CG2 4.05Å; I44-Y74 HydrophobicContact CD1-CD1 4.44Å; I44-Y74 HydrophobicContact CD1-CE1 3.82Å; I44-Y74 HydrophobicContact CG1-CE1 4.49Å; I44-Y74 VanDerWaalsContact CG2-OH 3.25Å; I44-Y74 WeakPolarHBondContact CG2-OH 3.46Å; I44-L77 HydrophobicContact CD1-CD1 3.83Å
45	D	96.9	Very high	94	Very high	109 Å²	109	58.1 Å²	58.1	58%	0.583	31%	0.311	S	S	*	.	H	α-helix	trans	-61.4	-43.1	177.9	-71.2	-20.2	0	0	0	111.7	P41 Q42 S43 H48 K49	P41-D45 PolarHBondContact O-N 3.02Å; Q42-D45 PolarHBondContact O-N 3.09Å; S43-D45 PolarHBondContact O-N 2.8Å; D45-H48 PolarHBondContact O-N 3.14Å; D45-K49 PolarHBondContact O-N 3.02Å
46	L	96.7	Very high	94	Very high	23 Å²	23	63.2 Å²	63.2	12%	0.12	34%	0.337	C	S	.	.	H	α-helix	trans	-64.6	-39.6	176.3	-71.9	169.7	0	0	0	111.9	I27 E30 A31 Q42 S43 I44 K49 A50	I27-L46 HydrophobicContact CG2-CB 4.11Å; I27-L46 HydrophobicContact CG2-CD2 4.19Å; I27-L46 WeakPolarHBondContact CG2-O 3.47Å; E30-L46 HydrophobicContact CB-CD1 4.12Å; E30-L46 HydrophobicContact CG-CD1 3.75Å; A31-L46 HydrophobicContact CB-CB 3.68Å; A31-L46 HydrophobicContact CB-CD1 4.28Å; Q42-L46 HydrophobicContact CG-CD1 4.04Å; Q42-L46 HydrophobicContact CG-CG 4.46Å; Q42-L46 WeakPolarHBondContact O-CB 3.49Å; Q42-L46 VanDerWaalsContact O-CG 3.27Å; Q42-L46 WeakPolarHBondContact O-CG 3.49Å; Q42-L46 PolarHBondContact O-N 3.3Å; S43-L46 PolarHBondContact O-N 3.21Å; I44-L46 VanDerWaalsContact C-N 3.35Å; I44-L46 PolarHBondContact O-N 2.64Å; L46-K49 WeakPolarHBondContact O-CB 3.42Å; L46-K49 PolarHBondContact O-N 3.4Å; L46-A50 WeakPolarHBondContact O-CB 3.32Å; L46-A50 PolarHBondContact O-N 3.18Å
47	L	96.8	Very high	94	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-69.4	-39.8	178	-71	171.6	0	0	0	112.5	A31 S43 I44 K49 A50 L51 I66 L69 L70 I73	A31-L47 HydrophobicContact CB-CD2 3.73Å; A31-L47 HydrophobicContact CB-CG 3.71Å; S43-L47 WeakPolarHBondContact O-CG 3.45Å; S43-L47 PolarHBondContact O-N 2.98Å; I44-L47 PolarHBondContact O-N 3.47Å; L47-K49 VanDerWaalsContact C-N 3.29Å; L47-K49 PolarHBondContact O-N 3.04Å; L47-A50 PolarHBondContact O-N 3.16Å; L47-L51 VanDerWaalsContact O-CB 3.29Å; L47-L51 WeakPolarHBondContact O-CB 3.31Å; L47-L51 PolarHBondContact O-N 2.96Å; L47-I66 HydrophobicContact CB-CG2 4.3Å; L47-I66 HydrophobicContact CD2-CG2 4.25Å; L47-I66 WeakPolarHBondContact O-CG2 3.26Å; L47-L69 HydrophobicContact CD1-CD2 4.2Å; L47-L69 HydrophobicContact CD1-CG 4.02Å; L47-L69 HydrophobicContact CD2-CD2 3.57Å; L47-L69 HydrophobicContact CD2-CG 4.21Å; L47-L70 HydrophobicContact CB-CD1 4.18Å; L47-L70 HydrophobicContact CB-CD2 3.54Å; L47-L70 HydrophobicContact CB-CG 3.71Å; L47-L70 HydrophobicContact CD1-CD2 3.82Å; L47-L70 HydrophobicContact CD1-CG 4.02Å; L47-L70 HydrophobicContact CG-CD2 4.33Å; L47-L70 HydrophobicContact CG-CG 4.45Å; L47-I73 HydrophobicContact CD1-CD1 3.39Å
48	H	97	Very high	93.7	Very high	82 Å²	82	54.1 Å²	54.1	38%	0.38	32%	0.315	S	S	.	.	H	α-helix	trans	-62.3	-39.1	173	-81	-57	0	0	0	111.8	I44 D45 L51 S52 Y74	I44-H48 PolarHBondContact O-CD2 3.14Å; I44-H48 VanDerWaalsContact O-CD2 3.31Å; I44-H48 PolarHBondContact O-N 3.27Å; D45-H48 PolarHBondContact O-N 3.14Å; H48-L51 PolarHBondContact O-N 3.11Å; H48-S52 PolarHBondContact O-N 3.09Å; H48-Y74 PolarHBondContact NE2-OH 3.19Å
49	K	95.4	Very high	93.6	Very high	119 Å²	119	51.7 Å²	51.7	52%	0.517	29%	0.287	S	S	.	.	H	α-helix	trans	-62.3	-49.6	172.9	-174.5	-178.4	177.8	-176	0	111.6	I27 D45 L46 L47 L51 S52 D53	I27-K49 HydrophobicContact CD1-CD 4.46Å; D45-K49 PolarHBondContact O-N 3.02Å; L46-K49 WeakPolarHBondContact O-CB 3.42Å; L46-K49 PolarHBondContact O-N 3.4Å; L47-K49 VanDerWaalsContact C-N 3.29Å; L47-K49 PolarHBondContact O-N 3.04Å; K49-L51 PolarHBondContact O-N 3.13Å; K49-S52 WeakPolarHBondContact O-CB 3.46Å; K49-S52 PolarHBondContact O-N 3.46Å; K49-D53 PolarHBondContact O-N 3.16Å
50	A	95	Very high	93.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.4	-37.4	176.6	0	0	0	0	0	112.1	I24 I27 I28 L46 L47 D53 A54 I66	I24-A50 HydrophobicContact CG2-CB 4.47Å; I27-A50 HydrophobicContact CB-CB 4.26Å; I27-A50 HydrophobicContact CG2-CB 3.8Å; I28-A50 HydrophobicContact CG1-CB 4.15Å; L46-A50 WeakPolarHBondContact O-CB 3.32Å; L46-A50 PolarHBondContact O-N 3.18Å; L47-A50 PolarHBondContact O-N 3.16Å; A50-D53 PolarHBondContact O-N 3.26Å; A50-A54 VanDerWaalsContact O-CB 3.27Å; A50-A54 WeakPolarHBondContact O-CB 3.44Å; A50-A54 PolarHBondContact O-N 3.31Å; A50-I66 HydrophobicContact CB-CD1 3.84Å; A50-I66 HydrophobicContact CB-CG1 4.46Å; A50-I66 WeakPolarHBondContact O-CD1 3.25Å
51	L	94.8	Very high	93.1	Very high	25 Å²	25	60 Å²	60	13%	0.131	32%	0.319	C	S	.	.	H	α-helix	trans	-66.4	-41.4	178	-174	61.2	0	0	0	111.3	L47 H48 K49 A54 N55 V63 I66 L70	L47-L51 VanDerWaalsContact O-CB 3.29Å; L47-L51 WeakPolarHBondContact O-CB 3.31Å; L47-L51 PolarHBondContact O-N 2.96Å; H48-L51 PolarHBondContact O-N 3.11Å; K49-L51 PolarHBondContact O-N 3.13Å; L51-A54 PolarHBondContact O-N 3.32Å; L51-N55 WeakPolarHBondContact O-CB 3.48Å; L51-N55 PolarHBondContact O-N 3.27Å; L51-N55 PolarHBondContact O-ND2 3.44Å; L51-V63 HydrophobicContact CD1-CB 4.29Å; L51-V63 HydrophobicContact CD1-CG1 3.67Å; L51-I66 HydrophobicContact CB-CG2 3.75Å; L51-I66 HydrophobicContact CD1-CB 4.16Å; L51-I66 HydrophobicContact CD1-CG2 4.13Å; L51-I66 HydrophobicContact CG-CG2 4.44Å; L51-L70 HydrophobicContact CD2-CD1 4Å
52	S	94.8	Very high	92.8	Very high	59 Å²	59	56.5 Å²	56.5	41%	0.413	30%	0.297	S	S	.	.	H	α-helix	trans	-60.1	-50.9	173.5	-164.5	0	0	0	0	110.7	H48 K49 A54 N55 E56	H48-S52 PolarHBondContact O-N 3.09Å; K49-S52 WeakPolarHBondContact O-CB 3.46Å; K49-S52 PolarHBondContact O-N 3.46Å; S52-A54 VanDerWaalsContact C-N 3.31Å; S52-A54 PolarHBondContact O-N 3.28Å; S52-N55 PolarHBondContact O-N 3.02Å; S52-E56 WeakPolarHBondContact O-CG 3.43Å; S52-E56 PolarHBondContact O-N 3.46Å
53	D	92.8	Very high	92.6	Very high	52 Å²	52	53.2 Å²	53.2	28%	0.278	28%	0.282	S	S	.	.	H	α-helix	trans	-60.1	-40.5	179.5	-66.9	-11.6	0	0	0	111.6	I24 I27 K49 A50 E56 S57	I24-D53 HydrophobicContact CD1-CB 4.31Å; I24-D53 HydrophobicContact CG1-CB 3.9Å; I27-D53 WeakPolarHBondContact CD1-OD2 3.38Å; K49-D53 PolarHBondContact O-N 3.16Å; A50-D53 PolarHBondContact O-N 3.26Å; D53-E56 PolarHBondContact O-N 2.97Å; D53-S57 PolarHBondContact O-N 3.16Å; D53-S57 PolarHBondContact O-OG 2.9Å
54	A	92.9	Very high	92.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-68.9	-35.7	178.6	0	0	0	0	0	113.4	I24 A50 L51 S52 S57 G58 D59 A62 V63 I66	I24-A54 HydrophobicContact CD1-CB 4.12Å; A50-A54 VanDerWaalsContact O-CB 3.27Å; A50-A54 WeakPolarHBondContact O-CB 3.44Å; A50-A54 PolarHBondContact O-N 3.31Å; L51-A54 PolarHBondContact O-N 3.32Å; S52-A54 VanDerWaalsContact C-N 3.31Å; S52-A54 PolarHBondContact O-N 3.28Å; A54-S57 PolarHBondContact O-OG 3.19Å; A54-S57 VanDerWaalsContact O-OG 3.11Å; A54-G58 PolarHBondContact O-N 3.26Å; A54-D59 PolarHBondContact O-N 3.07Å; A54-A62 HydrophobicContact CB-CB 3.87Å; A54-V63 HydrophobicContact CB-CG2 3.65Å; A54-I66 HydrophobicContact CB-CD1 3.83Å
55	N	92.6	Very high	91.9	Very high	92 Å²	92	55.9 Å²	55.9	49%	0.492	29%	0.294	S	S	.	.	H	α-helix	trans	-67.2	-42.8	173	-79.3	-51.8	0	0	0	111	L51 S52 S57 G58 V63	L51-N55 WeakPolarHBondContact O-CB 3.48Å; L51-N55 PolarHBondContact O-N 3.27Å; L51-N55 PolarHBondContact O-ND2 3.44Å; S52-N55 PolarHBondContact O-N 3.02Å; N55-S57 VanDerWaalsContact C-N 3.31Å; N55-S57 PolarHBondContact O-N 3.21Å; N55-G58 PolarHBondContact O-N 3.01Å; N55-G58 VanDerWaalsContact O-N 3.14Å; N55-V63 WeakPolarHBondContact OD1-CG2 3.39Å
56	E	91.8	Very high	91.7	Very high	157 Å²	157	50.7 Å²	50.7	73%	0.734	27%	0.266	S	S	*	.	H	α-helix	trans	-63	-36.5	176.9	-73.3	-179.2	-168.6	0	0	112.4	S52 D53 G58	S52-E56 WeakPolarHBondContact O-CG 3.43Å; S52-E56 PolarHBondContact O-N 3.46Å; D53-E56 PolarHBondContact O-N 2.97Å; E56-G58 VanDerWaalsContact C-N 3.27Å; E56-G58 PolarHBondContact O-N 2.9Å
57	S	89.4	Confident	91.4	Very high	42 Å²	42	50.1 Å²	50.1	29%	0.294	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-7.8	176.3	74.3	0	0	0	0	114	D53 A54 N55 D59	D53-S57 PolarHBondContact O-N 3.16Å; D53-S57 PolarHBondContact O-OG 2.9Å; A54-S57 PolarHBondContact O-OG 3.19Å; A54-S57 VanDerWaalsContact O-OG 3.11Å; N55-S57 VanDerWaalsContact C-N 3.31Å; N55-S57 PolarHBondContact O-N 3.21Å; S57-D59 PolarHBondContact O-N 3.48Å; S57-D59 PolarHBondContact OG-N 3.09Å
58	G	86.5	Confident	90.9	Very high	52 Å²	52	52.1 Å²	52.1	54%	0.536	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	64	23.5	-173.5	0	0	0	0	0	114.2	A54 N55 E56 E60	A54-G58 PolarHBondContact O-N 3.26Å; N55-G58 PolarHBondContact O-N 3.01Å; N55-G58 VanDerWaalsContact O-N 3.14Å; E56-G58 VanDerWaalsContact C-N 3.27Å; E56-G58 PolarHBondContact O-N 2.9Å; G58-E60 PolarHBondContact O-N 3.48Å; G58-E60 VanDerWaalsContact O-N 3.1Å
59	D	87.3	Confident	90.5	Very high	14 Å²	14	48.8 Å²	48.8	8%	0.075	26%	0.259	C	S	.	.			trans	-85	82.9	179.4	-171.8	-18.3	0	0	0	110.1	R21 A54 S57 K61 A62 V63	R21-D59 WeakPolarHBondContact CD-OD2 3.43Å; R21-D59 IonicContact CZ-OD2 3.9Å; R21-D59 IonicContact NE-OD2 2.83Å; R21-D59 PolarHBondContact NE-OD2 3.11Å; R21-D59 IonicContact NH1-OD2 3.74Å; A54-D59 PolarHBondContact O-N 3.07Å; S57-D59 PolarHBondContact O-N 3.48Å; S57-D59 PolarHBondContact OG-N 3.09Å; D59-K61 PolarHBondContact O-N 3.41Å; D59-K61 VanDerWaalsContact O-N 3.08Å; D59-K61 WeakPolarHBondContact OD1-CB 3.28Å; D59-K61 PolarHBondContact OD1-N 2.87Å; D59-K61 VanDerWaalsContact OD1-N 3.15Å; D59-A62 HydrophobicContact CB-CB 3.87Å; D59-A62 VanDerWaalsContact CG-CB 3.48Å; D59-A62 PolarHBondContact O-N 3.49Å; D59-A62 PolarHBondContact OD1-N 2.99Å; D59-V63 WeakPolarHBondContact O-CG2 3.42Å; D59-V63 PolarHBondContact O-N 3.03Å
60	E	87.3	Confident	90.5	Very high	105 Å²	105	43.1 Å²	43.1	49%	0.491	23%	0.234	S	C	.	.	H	α-helix	trans	-52.2	-33.9	-179.8	-72	-63	156.8	0	0	113.4	G58 N64 R93	G58-E60 PolarHBondContact O-N 3.48Å; G58-E60 VanDerWaalsContact O-N 3.1Å; E60-N64 WeakPolarHBondContact O-CB 3.3Å; E60-N64 VanDerWaalsContact O-CG 3.25Å; E60-N64 PolarHBondContact O-N 3.5Å; E60-N64 PolarHBondContact O-ND2 2.94Å; E60-R93 PolarHBondContact O-NH1 2.96Å; E60-R93 IonicContact OE2-CZ 2.61Å; E60-R93 IonicContact OE2-NH1 2.81Å; E60-R93 PolarHBondContact OE2-NH1 3.46Å
61	K	85.8	Confident	90	Very high	146 Å²	146	43.1 Å²	43.1	64%	0.635	23%	0.234	S	C	*	.	H	α-helix	trans	-70.5	-44.7	178.5	-67.7	-177.3	-180	178.7	0	111.1	F11 D59 N64 Y65	F11-K61 HydrophobicContact CE2-CB 4.41Å; F11-K61 HydrophobicContact CE2-CD 4.2Å; D59-K61 PolarHBondContact O-N 3.41Å; D59-K61 VanDerWaalsContact O-N 3.08Å; D59-K61 WeakPolarHBondContact OD1-CB 3.28Å; D59-K61 PolarHBondContact OD1-N 2.87Å; D59-K61 VanDerWaalsContact OD1-N 3.15Å; K61-N64 PolarHBondContact O-N 3.46Å; K61-Y65 WeakPolarHBondContact O-CB 3.35Å; K61-Y65 PolarHBondContact O-N 2.91Å
62	A	88.6	Confident	89.6	Confident	12 Å²	12	43.6 Å²	43.6	10%	0.099	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-44.7	175.2	0	0	0	0	0	110.9	I24 A54 D59 N64 Y65 I66	I24-A62 HydrophobicContact CG2-CB 4.44Å; A54-A62 HydrophobicContact CB-CB 3.87Å; D59-A62 HydrophobicContact CB-CB 3.87Å; D59-A62 VanDerWaalsContact CG-CB 3.48Å; D59-A62 PolarHBondContact O-N 3.49Å; D59-A62 PolarHBondContact OD1-N 2.99Å; A62-N64 VanDerWaalsContact C-N 3.32Å; A62-N64 PolarHBondContact O-N 3.24Å; A62-Y65 PolarHBondContact O-N 3.35Å; A62-I66 WeakPolarHBondContact O-CB 3.48Å; A62-I66 WeakPolarHBondContact O-CD1 3.45Å; A62-I66 WeakPolarHBondContact O-CG1 3.42Å; A62-I66 PolarHBondContact O-N 3.2Å
63	V	91.5	Very high	89.3	Confident	6 Å²	6	41 Å²	41	4%	0.036	22%	0.218	C	C	.	.	H	α-helix	trans	-57.5	-45.7	174.5	-179.1	0	0	0	0	110	L51 A54 N55 D59 Y65 I66 T67 R93	L51-V63 HydrophobicContact CD1-CB 4.29Å; L51-V63 HydrophobicContact CD1-CG1 3.67Å; A54-V63 HydrophobicContact CB-CG2 3.65Å; N55-V63 WeakPolarHBondContact OD1-CG2 3.39Å; D59-V63 WeakPolarHBondContact O-CG2 3.42Å; D59-V63 PolarHBondContact O-N 3.03Å; V63-Y65 PolarHBondContact O-N 2.91Å; V63-I66 PolarHBondContact O-N 3.49Å; V63-T67 WeakPolarHBondContact O-CB 3.43Å; V63-T67 PolarHBondContact O-N 3.11Å; V63-T67 PolarHBondContact O-OG1 3.35Å; V63-R93 VanDerWaalsContact CG1-CZ 3.46Å; V63-R93 VanDerWaalsContact CG1-NH1 3.35Å; V63-R93 VanDerWaalsContact CG1-NH2 3.3Å; V63-R93 PolarHBondContact O-NH2 3.43Å
64	N	87.7	Confident	89	Confident	30 Å²	30	39.3 Å²	39.3	16%	0.16	21%	0.208	C	C	.	.	H	α-helix	trans	-58.5	-48.4	177.8	-79.8	-44.7	0	0	0	111.9	E60 K61 A62 T67 D68 L90 R93	E60-N64 WeakPolarHBondContact O-CB 3.3Å; E60-N64 VanDerWaalsContact O-CG 3.25Å; E60-N64 PolarHBondContact O-N 3.5Å; E60-N64 PolarHBondContact O-ND2 2.94Å; K61-N64 PolarHBondContact O-N 3.46Å; A62-N64 VanDerWaalsContact C-N 3.32Å; A62-N64 PolarHBondContact O-N 3.24Å; N64-T67 PolarHBondContact O-N 2.96Å; N64-D68 WeakPolarHBondContact O-CB 3.49Å; N64-D68 PolarHBondContact O-N 3.42Å; N64-L90 HydrophobicContact CB-CD1 4.06Å; N64-L90 WeakPolarHBondContact OD1-CD1 3.38Å; N64-R93 VanDerWaalsContact CG-NH2 3.31Å; N64-R93 PolarHBondContact OD1-NE 3.22Å; N64-R93 PolarHBondContact OD1-NH1 3.48Å; N64-R93 PolarHBondContact OD1-NH2 2.82Å
65	Y	87.8	Confident	88.3	Confident	49 Å²	49	42 Å²	42	19%	0.192	22%	0.219	C	C	.	.	H	α-helix	trans	-63.6	-42.5	-180	-178.9	-93.8	0	0	0	112.8	I28 K61 A62 V63 D68 L69	I28-Y65 HydrophobicContact CD1-CD1 4.12Å; I28-Y65 HydrophobicContact CD1-CE1 4.34Å; I28-Y65 HydrophobicContact CG2-CE1 3.73Å; K61-Y65 WeakPolarHBondContact O-CB 3.35Å; K61-Y65 PolarHBondContact O-N 2.91Å; A62-Y65 PolarHBondContact O-N 3.35Å; V63-Y65 PolarHBondContact O-N 2.91Å; Y65-D68 PolarHBondContact O-N 3.42Å; Y65-L69 HydrophobicContact CE1-CD2 4.32Å; Y65-L69 WeakPolarHBondContact O-CB 3.48Å; Y65-L69 PolarHBondContact O-N 3.4Å
66	I	92.7	Very high	87.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-70.7	-40.7	-178.9	-62.1	159.7	0	0	0	110.7	I24 I28 L47 A50 L51 A54 A62 V63 L69 L70	I24-I66 HydrophobicContact CG2-CD1 3.99Å; I28-I66 HydrophobicContact CD1-CD1 3.99Å; I28-I66 HydrophobicContact CD1-CG1 3.67Å; I28-I66 HydrophobicContact CG1-CD1 4.41Å; I28-I66 HydrophobicContact CG1-CG1 4.03Å; L47-I66 HydrophobicContact CB-CG2 4.3Å; L47-I66 HydrophobicContact CD2-CG2 4.25Å; L47-I66 WeakPolarHBondContact O-CG2 3.26Å; A50-I66 HydrophobicContact CB-CD1 3.84Å; A50-I66 HydrophobicContact CB-CG1 4.46Å; A50-I66 WeakPolarHBondContact O-CD1 3.25Å; L51-I66 HydrophobicContact CB-CG2 3.75Å; L51-I66 HydrophobicContact CD1-CB 4.16Å; L51-I66 HydrophobicContact CD1-CG2 4.13Å; L51-I66 HydrophobicContact CG-CG2 4.44Å; A54-I66 HydrophobicContact CB-CD1 3.83Å; A62-I66 WeakPolarHBondContact O-CB 3.48Å; A62-I66 WeakPolarHBondContact O-CD1 3.45Å; A62-I66 WeakPolarHBondContact O-CG1 3.42Å; A62-I66 PolarHBondContact O-N 3.2Å; V63-I66 PolarHBondContact O-N 3.49Å; I66-L69 PolarHBondContact O-N 3.32Å; I66-L70 HydrophobicContact CG2-CD1 4.18Å; I66-L70 WeakPolarHBondContact O-CB 3.42Å; I66-L70 PolarHBondContact O-N 3.43Å
67	T	91.2	Very high	87.5	Confident	10 Å²	10	39.6 Å²	39.6	6%	0.061	21%	0.207	C	C	.	.	H	α-helix	trans	-60.6	-44.7	174.8	-60.7	0	0	0	0	111.4	V63 N64 L70 A71 L86 L90	V63-T67 WeakPolarHBondContact O-CB 3.43Å; V63-T67 PolarHBondContact O-N 3.11Å; V63-T67 PolarHBondContact O-OG1 3.35Å; N64-T67 PolarHBondContact O-N 2.96Å; T67-L70 PolarHBondContact O-N 2.93Å; T67-A71 WeakPolarHBondContact O-CB 3.34Å; T67-A71 PolarHBondContact O-N 3.23Å; T67-L86 HydrophobicContact CG2-CB 4.3Å; T67-L86 HydrophobicContact CG2-CD2 4.08Å; T67-L90 HydrophobicContact CG2-CB 3.96Å
68	D	85	Confident	87.1	Confident	42 Å²	42	45.1 Å²	45.1	23%	0.225	23%	0.229	C	C	.	.	H	α-helix	trans	-59.8	-47.5	175.3	179.7	60.2	0	0	0	111.7	N64 Y65 L70 A71 N72 L90	N64-D68 WeakPolarHBondContact O-CB 3.49Å; N64-D68 PolarHBondContact O-N 3.42Å; Y65-D68 PolarHBondContact O-N 3.42Å; D68-L70 PolarHBondContact O-N 3.47Å; D68-A71 PolarHBondContact O-N 3.18Å; D68-N72 WeakPolarHBondContact O-CB 3.34Å; D68-N72 PolarHBondContact O-N 2.85Å; D68-N72 PolarHBondContact O-ND2 2.95Å; D68-N72 VanDerWaalsContact O-ND2 3.1Å; D68-N72 PolarHBondContact OD1-ND2 3.28Å; D68-N72 PolarHBondContact OD2-ND2 3.44Å; D68-L90 HydrophobicContact CB-CD2 3.7Å
69	L	90.2	Very high	86.9	Confident	12 Å²	12	44.8 Å²	44.8	6%	0.063	22%	0.216	C	C	.	.	H	α-helix	trans	-63.2	-41.5	178.9	-175.9	58.6	0	0	0	112.5	I28 I32 L47 Y65 I66 I73	I28-L69 HydrophobicContact CG2-CD2 4.4Å; I32-L69 HydrophobicContact CD1-CD2 4.08Å; I32-L69 HydrophobicContact CG1-CD2 3.8Å; L47-L69 HydrophobicContact CD1-CD2 4.2Å; L47-L69 HydrophobicContact CD1-CG 4.02Å; L47-L69 HydrophobicContact CD2-CD2 3.57Å; L47-L69 HydrophobicContact CD2-CG 4.21Å; Y65-L69 HydrophobicContact CE1-CD2 4.32Å; Y65-L69 WeakPolarHBondContact O-CB 3.48Å; Y65-L69 PolarHBondContact O-N 3.4Å; I66-L69 PolarHBondContact O-N 3.32Å; L69-I73 HydrophobicContact CD1-CD1 4.21Å; L69-I73 HydrophobicContact CG-CD1 4.12Å; L69-I73 WeakPolarHBondContact O-CG1 3.34Å; L69-I73 PolarHBondContact O-N 3.15Å
70	L	94.3	Very high	86.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-45.6	173.2	-83.7	168.1	0	0	0	111.4	L47 L51 I66 T67 D68 N72 I73 Y74 L86	L47-L70 HydrophobicContact CB-CD1 4.18Å; L47-L70 HydrophobicContact CB-CD2 3.54Å; L47-L70 HydrophobicContact CB-CG 3.71Å; L47-L70 HydrophobicContact CD1-CD2 3.82Å; L47-L70 HydrophobicContact CD1-CG 4.02Å; L47-L70 HydrophobicContact CG-CD2 4.33Å; L47-L70 HydrophobicContact CG-CG 4.45Å; L51-L70 HydrophobicContact CD2-CD1 4Å; I66-L70 HydrophobicContact CG2-CD1 4.18Å; I66-L70 WeakPolarHBondContact O-CB 3.42Å; I66-L70 PolarHBondContact O-N 3.43Å; T67-L70 PolarHBondContact O-N 2.93Å; D68-L70 PolarHBondContact O-N 3.47Å; L70-N72 PolarHBondContact O-N 2.98Å; L70-I73 PolarHBondContact O-N 3.35Å; L70-Y74 HydrophobicContact CB-CE2 4.47Å; L70-Y74 HydrophobicContact CD2-CE2 4.1Å; L70-Y74 WeakPolarHBondContact O-CD2 3.39Å; L70-Y74 PolarHBondContact O-N 2.88Å; L70-L86 HydrophobicContact CB-CD1 3.83Å
71	A	85.9	Confident	86.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.3	-46.2	179.9	0	0	0	0	0	111.4	T67 D68 Y74 Y75 L86 F87	T67-A71 WeakPolarHBondContact O-CB 3.34Å; T67-A71 PolarHBondContact O-N 3.23Å; D68-A71 PolarHBondContact O-N 3.18Å; A71-Y74 PolarHBondContact O-N 3.03Å; A71-Y75 WeakPolarHBondContact O-CB 3.49Å; A71-Y75 PolarHBondContact O-N 3.11Å; A71-L86 HydrophobicContact CB-CB 3.71Å; A71-L86 HydrophobicContact CB-CD1 4.4Å; A71-F87 HydrophobicContact CB-CD1 3.63Å; A71-F87 HydrophobicContact CB-CD2 4.01Å; A71-F87 HydrophobicContact CB-CE1 3.49Å; A71-F87 VanDerWaalsContact CB-CE1 3.49Å; A71-F87 HydrophobicContact CB-CE2 3.89Å; A71-F87 HydrophobicContact CB-CG 3.89Å; A71-F87 HydrophobicContact CB-CZ 3.63Å
72	N	84.7	Confident	86.2	Confident	35 Å²	35	43.3 Å²	43.3	19%	0.187	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-42.2	176.2	-75.2	-41.5	0	0	0	112.7	D68 L70 Y75 E76 F87	D68-N72 WeakPolarHBondContact O-CB 3.34Å; D68-N72 PolarHBondContact O-N 2.85Å; D68-N72 PolarHBondContact O-ND2 2.95Å; D68-N72 VanDerWaalsContact O-ND2 3.1Å; D68-N72 PolarHBondContact OD1-ND2 3.28Å; D68-N72 PolarHBondContact OD2-ND2 3.44Å; L70-N72 PolarHBondContact O-N 2.98Å; N72-Y75 WeakPolarHBondContact O-CB 3.44Å; N72-Y75 PolarHBondContact O-N 3.28Å; N72-E76 WeakPolarHBondContact O-CG 3.32Å; N72-E76 PolarHBondContact O-N 2.97Å; N72-F87 WeakPolarHBondContact OD1-CZ 3.48Å
73	I	89.1	Confident	85.8	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-64.9	-45.2	176	-74.9	166.1	0	0	0	111.2	Y35 I44 L47 L69 L70 Y75 E76 L77	Y35-I73 HydrophobicContact CD1-CG1 4.26Å; Y35-I73 HydrophobicContact CD2-CD1 4.25Å; Y35-I73 HydrophobicContact CD2-CG1 4.1Å; Y35-I73 HydrophobicContact CD2-CG2 3.97Å; Y35-I73 HydrophobicContact CE1-CG1 4.2Å; Y35-I73 HydrophobicContact CE2-CB 4.33Å; Y35-I73 HydrophobicContact CE2-CG1 4.06Å; Y35-I73 HydrophobicContact CE2-CG2 3.64Å; Y35-I73 HydrophobicContact CG-CD1 4.21Å; Y35-I73 HydrophobicContact CG-CG1 4.22Å; I44-I73 HydrophobicContact CD1-CG2 4.33Å; I44-I73 HydrophobicContact CG1-CG2 4.05Å; L47-I73 HydrophobicContact CD1-CD1 3.39Å; L69-I73 HydrophobicContact CD1-CD1 4.21Å; L69-I73 HydrophobicContact CG-CD1 4.12Å; L69-I73 WeakPolarHBondContact O-CG1 3.34Å; L69-I73 PolarHBondContact O-N 3.15Å; L70-I73 PolarHBondContact O-N 3.35Å; I73-Y75 VanDerWaalsContact C-N 3.25Å; I73-Y75 PolarHBondContact O-N 3.46Å; I73-E76 PolarHBondContact O-N 3.26Å; I73-L77 HydrophobicContact CG2-CD1 3.81Å; I73-L77 HydrophobicContact CG2-CG 4.44Å; I73-L77 WeakPolarHBondContact O-CB 3.25Å; I73-L77 VanDerWaalsContact O-CG 3.24Å; I73-L77 WeakPolarHBondContact O-CG 3.45Å; I73-L77 PolarHBondContact O-N 3.41Å
74	Y	87.5	Confident	85.2	Confident	17 Å²	17	47.3 Å²	47.3	7%	0.067	23%	0.233	C	C	.	.	H	α-helix	trans	-63.3	-35.2	175.8	-76.2	-60.1	0	0	0	112.2	I44 H48 L70 A71 L77 M78 D79 K82 L86	I44-Y74 HydrophobicContact CD1-CD1 4.44Å; I44-Y74 HydrophobicContact CD1-CE1 3.82Å; I44-Y74 HydrophobicContact CG1-CE1 4.49Å; I44-Y74 VanDerWaalsContact CG2-OH 3.25Å; I44-Y74 WeakPolarHBondContact CG2-OH 3.46Å; H48-Y74 PolarHBondContact NE2-OH 3.19Å; L70-Y74 HydrophobicContact CB-CE2 4.47Å; L70-Y74 HydrophobicContact CD2-CE2 4.1Å; L70-Y74 WeakPolarHBondContact O-CD2 3.39Å; L70-Y74 PolarHBondContact O-N 2.88Å; A71-Y74 PolarHBondContact O-N 3.03Å; Y74-L77 PolarHBondContact O-N 3.41Å; Y74-M78 PolarHBondContact O-N 2.95Å; Y74-D79 HydrophobicContact CD1-CB 3.93Å; Y74-D79 PolarHBondContact O-N 3.44Å; Y74-K82 HydrophobicContact CD1-CB 4.02Å; Y74-K82 HydrophobicContact CD1-CD 3.91Å; Y74-K82 HydrophobicContact CD2-CB 3.99Å; Y74-K82 HydrophobicContact CE1-CB 4.35Å; Y74-K82 HydrophobicContact CE1-CD 3.48Å; Y74-K82 VanDerWaalsContact CE1-CD 3.48Å; Y74-K82 HydrophobicContact CE2-CB 4.31Å; Y74-K82 HydrophobicContact CE2-CD 4.28Å; Y74-K82 HydrophobicContact CG-CB 3.83Å; Y74-K82 HydrophobicContact CG-CD 4.46Å; Y74-L86 HydrophobicContact CD2-CD1 3.47Å; Y74-L86 VanDerWaalsContact CD2-CD1 3.47Å; Y74-L86 HydrophobicContact CE2-CD1 3.74Å
75	Y	78.4	Confident	85.1	Confident	57 Å²	57	48.8 Å²	48.8	22%	0.224	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-49.7	174.5	179.9	-105.5	0	0	0	111.6	A71 N72 I73 L77 M78 Q116	A71-Y75 WeakPolarHBondContact O-CB 3.49Å; A71-Y75 PolarHBondContact O-N 3.11Å; N72-Y75 WeakPolarHBondContact O-CB 3.44Å; N72-Y75 PolarHBondContact O-N 3.28Å; I73-Y75 VanDerWaalsContact C-N 3.25Å; I73-Y75 PolarHBondContact O-N 3.46Å; Y75-L77 PolarHBondContact O-N 3.33Å; Y75-M78 PolarHBondContact O-N 3.24Å; Y75-Q116 HydrophobicContact CD2-CG 3.6Å; Y75-Q116 HydrophobicContact CE2-CG 3.24Å
76	E	81.5	Confident	85.1	Confident	119 Å²	119	47.9 Å²	47.9	56%	0.556	25%	0.247	S	C	*	.	H	α-helix	trans	-62.6	-30.2	176.9	-72.7	-175.2	-174.6	0	0	113.1	Y35 N72 I73 M78	Y35-E76 WeakPolarHBondContact CE1-OE2 3.29Å; Y35-E76 VanDerWaalsContact CZ-OE2 3.23Å; Y35-E76 WeakPolarHBondContact OH-CB 3.46Å; Y35-E76 PolarHBondContact OH-OE2 2.99Å; N72-E76 WeakPolarHBondContact O-CG 3.32Å; N72-E76 PolarHBondContact O-N 2.97Å; I73-E76 PolarHBondContact O-N 3.26Å; E76-M78 PolarHBondContact O-N 3.12Å
77	L	85.9	Confident	84.8	Confident	79 Å²	79	47.9 Å²	47.9	41%	0.414	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	2	174.3	-65.7	171.7	0	0	0	113.9	A40 I44 I73 Y74 Y75 D79	A40-L77 HydrophobicContact CB-CD1 3.93Å; A40-L77 HydrophobicContact CB-CD2 3.91Å; I44-L77 HydrophobicContact CD1-CD1 3.83Å; I73-L77 HydrophobicContact CG2-CD1 3.81Å; I73-L77 HydrophobicContact CG2-CG 4.44Å; I73-L77 WeakPolarHBondContact O-CB 3.25Å; I73-L77 VanDerWaalsContact O-CG 3.24Å; I73-L77 WeakPolarHBondContact O-CG 3.45Å; I73-L77 PolarHBondContact O-N 3.41Å; Y74-L77 PolarHBondContact O-N 3.41Å; Y75-L77 PolarHBondContact O-N 3.33Å; L77-D79 PolarHBondContact O-N 3.44Å
78	M	80.2	Confident	84.4	Confident	157 Å²	157	51.1 Å²	51.1	77%	0.773	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	18.9	-174.8	-52.1	-175.1	68.4	0	0	114.8	Y74 Y75 E76 T80	Y74-M78 PolarHBondContact O-N 2.95Å; Y75-M78 PolarHBondContact O-N 3.24Å; E76-M78 PolarHBondContact O-N 3.12Å; M78-T80 PolarHBondContact O-N 2.92Å
79	D	82.8	Confident	84.5	Confident	46 Å²	46	51.9 Å²	51.9	25%	0.246	27%	0.272	C	S	.	.			trans	-83.6	69.2	170.3	-167	-20.7	0	0	0	109.5	Y74 L77 V81 K82 A83	Y74-D79 HydrophobicContact CD1-CB 3.93Å; Y74-D79 PolarHBondContact O-N 3.44Å; L77-D79 PolarHBondContact O-N 3.44Å; D79-V81 PolarHBondContact O-N 2.94Å; D79-K82 PolarHBondContact O-N 2.88Å; D79-K82 WeakPolarHBondContact OD1-CG 3.41Å; D79-K82 PolarHBondContact OD1-N 3.2Å; D79-K82 VanDerWaalsContact OD2-CD 3.23Å; D79-K82 WeakPolarHBondContact OD2-CD 3.28Å; D79-K82 VanDerWaalsContact OD2-CE 3.26Å; D79-K82 WeakPolarHBondContact OD2-CE 3.31Å; D79-K82 IonicContact OD2-NZ 3.36Å; D79-K82 PolarHBondContact OD2-NZ 3.28Å; D79-A83 PolarHBondContact O-N 3.32Å
80	T	76.9	Confident	84.3	Confident	28 Å²	28	51.4 Å²	51.4	17%	0.172	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-26.2	-171.4	57.9	0	0	0	0	113.1	M78 K84 L120	M78-T80 PolarHBondContact O-N 2.92Å; T80-K84 WeakPolarHBondContact O-CB 3.49Å; T80-K84 PolarHBondContact O-N 3.16Å; T80-L120 HydrophobicContact CG2-CD1 3.93Å; T80-L120 HydrophobicContact CG2-CD2 4.41Å; T80-L120 HydrophobicContact CG2-CG 4.49Å
81	V	81.4	Confident	83.6	Confident	108 Å²	108	52.4 Å²	52.4	66%	0.655	28%	0.276	S	S	*	.	H	α-helix	trans	-64.3	-49.3	175.2	178	0	0	0	0	110.4	D79 A85	D79-V81 PolarHBondContact O-N 2.94Å; V81-A85 WeakPolarHBondContact O-CB 3.3Å; V81-A85 PolarHBondContact O-N 3.4Å; V81-A85 VanDerWaalsContact O-N 3.17Å
82	K	86.3	Confident	83.4	Confident	98 Å²	98	57.9 Å²	57.9	43%	0.426	31%	0.305	S	S	.	.	H	α-helix	trans	-72.5	-41.5	179	-68.7	-174.9	-164.4	137.2	0	112.2	Y74 D79 K84 A85 L86	Y74-K82 HydrophobicContact CD1-CB 4.02Å; Y74-K82 HydrophobicContact CD1-CD 3.91Å; Y74-K82 HydrophobicContact CD2-CB 3.99Å; Y74-K82 HydrophobicContact CE1-CB 4.35Å; Y74-K82 HydrophobicContact CE1-CD 3.48Å; Y74-K82 VanDerWaalsContact CE1-CD 3.48Å; Y74-K82 HydrophobicContact CE2-CB 4.31Å; Y74-K82 HydrophobicContact CE2-CD 4.28Å; Y74-K82 HydrophobicContact CG-CB 3.83Å; Y74-K82 HydrophobicContact CG-CD 4.46Å; D79-K82 PolarHBondContact O-N 2.88Å; D79-K82 WeakPolarHBondContact OD1-CG 3.41Å; D79-K82 PolarHBondContact OD1-N 3.2Å; D79-K82 VanDerWaalsContact OD2-CD 3.23Å; D79-K82 WeakPolarHBondContact OD2-CD 3.28Å; D79-K82 VanDerWaalsContact OD2-CE 3.26Å; D79-K82 WeakPolarHBondContact OD2-CE 3.31Å; D79-K82 IonicContact OD2-NZ 3.36Å; D79-K82 PolarHBondContact OD2-NZ 3.28Å; K82-K84 PolarHBondContact O-N 3.19Å; K82-A85 PolarHBondContact O-N 3.09Å; K82-L86 WeakPolarHBondContact O-CG 3.37Å; K82-L86 PolarHBondContact O-N 2.89Å
83	A	79.9	Confident	83.4	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-56.3	-52.1	176.8	0	0	0	0	0	110.9	D79 A85 L86 F87	D79-A83 PolarHBondContact O-N 3.32Å; A83-A85 PolarHBondContact O-N 3.36Å; A83-L86 PolarHBondContact O-N 3.35Å; A83-F87 HydrophobicContact CB-CD2 4.39Å; A83-F87 HydrophobicContact CB-CE2 4.27Å; A83-F87 WeakPolarHBondContact O-CD2 3.32Å; A83-F87 PolarHBondContact O-N 2.88Å
84	K	79.5	Confident	83	Confident	102 Å²	102	59.6 Å²	59.6	44%	0.443	31%	0.31	S	S	.	.	H	α-helix	trans	-59.3	-44	178	-178.6	176.1	178.9	-178	0	112.7	T80 K82 L86 F87 L88 L113	T80-K84 WeakPolarHBondContact O-CB 3.49Å; T80-K84 PolarHBondContact O-N 3.16Å; K82-K84 PolarHBondContact O-N 3.19Å; K84-L86 VanDerWaalsContact C-N 3.32Å; K84-L86 PolarHBondContact O-N 2.95Å; K84-F87 PolarHBondContact O-N 2.9Å; K84-L88 HydrophobicContact CG-CD1 3.98Å; K84-L88 HydrophobicContact CG-CG 4.4Å; K84-L88 WeakPolarHBondContact O-CB 3.44Å; K84-L88 WeakPolarHBondContact O-CG 3.38Å; K84-L88 PolarHBondContact O-N 2.82Å; K84-L113 HydrophobicContact CB-CD2 4.32Å; K84-L113 HydrophobicContact CG-CD2 3.91Å
85	A	85.2	Confident	82.6	Confident	60 Å²	60	62 Å²	62	50%	0.496	32%	0.323	S	S	.	.	H	α-helix	trans	-60.3	-42.9	178.7	0	0	0	0	0	111.8	V81 K82 A83 S89	V81-A85 WeakPolarHBondContact O-CB 3.3Å; V81-A85 PolarHBondContact O-N 3.4Å; V81-A85 VanDerWaalsContact O-N 3.17Å; K82-A85 PolarHBondContact O-N 3.09Å; A83-A85 PolarHBondContact O-N 3.36Å; A85-S89 WeakPolarHBondContact O-CB 3.47Å; A85-S89 PolarHBondContact O-N 2.93Å; A85-S89 VanDerWaalsContact O-N 3.07Å; A85-S89 PolarHBondContact O-OG 3.43Å
86	L	88.3	Confident	82.7	Confident	31 Å²	31	62.7 Å²	62.7	16%	0.162	35%	0.348	C	S	.	.	H	α-helix	trans	-69.1	-45.9	178.1	-70.7	165.1	0	0	0	112.2	T67 L70 A71 Y74 K82 A83 K84 L88 S89 L90	T67-L86 HydrophobicContact CG2-CB 4.3Å; T67-L86 HydrophobicContact CG2-CD2 4.08Å; L70-L86 HydrophobicContact CB-CD1 3.83Å; A71-L86 HydrophobicContact CB-CB 3.71Å; A71-L86 HydrophobicContact CB-CD1 4.4Å; Y74-L86 HydrophobicContact CD2-CD1 3.47Å; Y74-L86 VanDerWaalsContact CD2-CD1 3.47Å; Y74-L86 HydrophobicContact CE2-CD1 3.74Å; K82-L86 WeakPolarHBondContact O-CG 3.37Å; K82-L86 PolarHBondContact O-N 2.89Å; A83-L86 PolarHBondContact O-N 3.35Å; K84-L86 VanDerWaalsContact C-N 3.32Å; K84-L86 PolarHBondContact O-N 2.95Å; L86-L88 PolarHBondContact O-N 3.45Å; L86-S89 PolarHBondContact O-N 3.02Å; L86-S89 PolarHBondContact O-OG 3.45Å; L86-L90 WeakPolarHBondContact O-CB 3.49Å; L86-L90 PolarHBondContact O-N 3.06Å
87	F	87	Confident	82.9	Confident	0 Å²	0	61 Å²	61	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-57.9	-46.8	176.7	-78.2	-51.5	0	0	0	112.1	A71 N72 A83 K84 S89 L90 T91 I109 D112 L113	A71-F87 HydrophobicContact CB-CD1 3.63Å; A71-F87 HydrophobicContact CB-CD2 4.01Å; A71-F87 HydrophobicContact CB-CE1 3.49Å; A71-F87 VanDerWaalsContact CB-CE1 3.49Å; A71-F87 HydrophobicContact CB-CE2 3.89Å; A71-F87 HydrophobicContact CB-CG 3.89Å; A71-F87 HydrophobicContact CB-CZ 3.63Å; N72-F87 WeakPolarHBondContact OD1-CZ 3.48Å; A83-F87 HydrophobicContact CB-CD2 4.39Å; A83-F87 HydrophobicContact CB-CE2 4.27Å; A83-F87 WeakPolarHBondContact O-CD2 3.32Å; A83-F87 PolarHBondContact O-N 2.88Å; K84-F87 PolarHBondContact O-N 2.9Å; F87-S89 PolarHBondContact O-N 2.88Å; F87-L90 PolarHBondContact O-N 3.3Å; F87-T91 PolarHBondContact O-N 2.84Å; F87-T91 PolarHBondContact O-OG1 3.47Å; F87-I109 HydrophobicContact CB-CG2 3.77Å; F87-I109 HydrophobicContact CD1-CB 4.37Å; F87-I109 HydrophobicContact CD1-CG1 4.07Å; F87-I109 HydrophobicContact CD1-CG2 3.7Å; F87-I109 HydrophobicContact CE1-CG1 4.43Å; F87-I109 HydrophobicContact CG-CG2 4.02Å; F87-D112 HydrophobicContact CE2-CB 4.47Å; F87-D112 HydrophobicContact CZ-CB 4.37Å; F87-L113 HydrophobicContact CB-CD1 4.24Å; F87-L113 HydrophobicContact CB-CD2 3.86Å; F87-L113 HydrophobicContact CB-CG 4.06Å; F87-L113 HydrophobicContact CD2-CD2 4.34Å; F87-L113 HydrophobicContact CG-CD2 4.48Å
88	L	82.5	Confident	82.7	Confident	78 Å²	78	60.2 Å²	60.2	41%	0.408	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-46	176.1	-71.5	173.6	0	0	0	111.8	K84 L86 L90 T91 D92 L113	K84-L88 HydrophobicContact CG-CD1 3.98Å; K84-L88 HydrophobicContact CG-CG 4.4Å; K84-L88 WeakPolarHBondContact O-CB 3.44Å; K84-L88 WeakPolarHBondContact O-CG 3.38Å; K84-L88 PolarHBondContact O-N 2.82Å; L86-L88 PolarHBondContact O-N 3.45Å; L88-L90 VanDerWaalsContact C-N 3.26Å; L88-L90 PolarHBondContact O-N 3.48Å; L88-T91 PolarHBondContact O-N 3.47Å; L88-D92 PolarHBondContact O-N 3.31Å; L88-L113 HydrophobicContact CD2-CD1 4.03Å
89	S	86.5	Confident	82.8	Confident	57 Å²	57	54.4 Å²	54.4	40%	0.399	33%	0.333	S	S	.	.	H	α-helix	trans	-61.7	-35.3	178.1	75.4	0	0	0	0	112.8	A85 L86 F87 R93	A85-S89 WeakPolarHBondContact O-CB 3.47Å; A85-S89 PolarHBondContact O-N 2.93Å; A85-S89 VanDerWaalsContact O-N 3.07Å; A85-S89 PolarHBondContact O-OG 3.43Å; L86-S89 PolarHBondContact O-N 3.02Å; L86-S89 PolarHBondContact O-OG 3.45Å; F87-S89 PolarHBondContact O-N 2.88Å; S89-R93 WeakPolarHBondContact O-CB 3.27Å; S89-R93 PolarHBondContact O-N 2.87Å; S89-R93 VanDerWaalsContact O-N 3.14Å
90	L	86.7	Confident	82.7	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	36%	0.355	C	S	.	.	H	α-helix	trans	-70.2	-46	176.3	179.7	59.1	0	0	0	111	N64 T67 D68 L86 F87 L88 R93 L94 I109	N64-L90 HydrophobicContact CB-CD1 4.06Å; N64-L90 WeakPolarHBondContact OD1-CD1 3.38Å; T67-L90 HydrophobicContact CG2-CB 3.96Å; D68-L90 HydrophobicContact CB-CD2 3.7Å; L86-L90 WeakPolarHBondContact O-CB 3.49Å; L86-L90 PolarHBondContact O-N 3.06Å; F87-L90 PolarHBondContact O-N 3.3Å; L88-L90 VanDerWaalsContact C-N 3.26Å; L88-L90 PolarHBondContact O-N 3.48Å; L90-R93 PolarHBondContact O-N 3.19Å; L90-L94 HydrophobicContact CD1-CD1 4.19Å; L90-L94 HydrophobicContact CD1-CG 4.2Å; L90-L94 HydrophobicContact CG-CD1 4.09Å; L90-L94 WeakPolarHBondContact O-CB 3.38Å; L90-L94 WeakPolarHBondContact O-CG 3.48Å; L90-L94 PolarHBondContact O-N 2.85Å; L90-I109 HydrophobicContact CD2-CD1 3.56Å; L90-I109 HydrophobicContact CD2-CG1 4.48Å; L90-I109 HydrophobicContact CG-CD1 3.85Å
91	T	79.2	Confident	82.6	Confident	22 Å²	22	65.5 Å²	65.5	14%	0.135	38%	0.379	C	S	.	.	H	α-helix	trans	-58.3	-49	176	-57	0	0	0	0	111.4	F87 L88 R93 L94 I95 I106 I109	F87-T91 PolarHBondContact O-N 2.84Å; F87-T91 PolarHBondContact O-OG1 3.47Å; L88-T91 PolarHBondContact O-N 3.47Å; T91-R93 VanDerWaalsContact C-N 3.3Å; T91-R93 PolarHBondContact O-N 3.27Å; T91-L94 PolarHBondContact O-N 2.85Å; T91-I95 HydrophobicContact CG2-CD1 3.72Å; T91-I95 HydrophobicContact CG2-CG1 4.38Å; T91-I95 WeakPolarHBondContact O-CG1 3.48Å; T91-I95 PolarHBondContact O-N 2.72Å; T91-I106 HydrophobicContact CG2-CG2 4.39Å; T91-I109 VanDerWaalsContact OG1-CG2 3.32Å; T91-I109 WeakPolarHBondContact OG1-CG2 3.43Å
92	D	82.2	Confident	82.3	Confident	114 Å²	114	65.9 Å²	65.9	61%	0.61	38%	0.382	S	S	*	.	H	α-helix	trans	-58.9	-42.5	178.8	-74.2	-19.8	0	0	0	111.5	L88 G96	L88-D92 PolarHBondContact O-N 3.31Å; D92-G96 PolarHBondContact O-N 3.4Å
93	R	84.2	Confident	81.9	Confident	59 Å²	59	63.8 Å²	63.8	22%	0.223	38%	0.375	C	S	.	.	H	α-helix	trans	-67.3	-42.6	178.1	-173.8	164	59.3	119.2	-5.6	112.6	E60 V63 N64 S89 L90 T91 G96 S97	E60-R93 PolarHBondContact O-NH1 2.96Å; E60-R93 IonicContact OE2-CZ 2.61Å; E60-R93 IonicContact OE2-NH1 2.81Å; E60-R93 PolarHBondContact OE2-NH1 3.46Å; V63-R93 VanDerWaalsContact CG1-CZ 3.46Å; V63-R93 VanDerWaalsContact CG1-NH1 3.35Å; V63-R93 VanDerWaalsContact CG1-NH2 3.3Å; V63-R93 PolarHBondContact O-NH2 3.43Å; N64-R93 VanDerWaalsContact CG-NH2 3.31Å; N64-R93 PolarHBondContact OD1-NE 3.22Å; N64-R93 PolarHBondContact OD1-NH1 3.48Å; N64-R93 PolarHBondContact OD1-NH2 2.82Å; S89-R93 WeakPolarHBondContact O-CB 3.27Å; S89-R93 PolarHBondContact O-N 2.87Å; S89-R93 VanDerWaalsContact O-N 3.14Å; L90-R93 PolarHBondContact O-N 3.19Å; T91-R93 VanDerWaalsContact C-N 3.3Å; T91-R93 PolarHBondContact O-N 3.27Å; R93-G96 PolarHBondContact O-N 3.33Å; R93-S97 WeakPolarHBondContact O-CB 3.23Å; R93-S97 PolarHBondContact O-N 2.9Å; R93-S97 PolarHBondContact O-OG 3.42Å
94	L	81.6	Confident	81.8	Confident	17 Å²	17	68.4 Å²	68.4	9%	0.089	41%	0.405	C	S	.	.	H	α-helix	trans	-62.7	-47.7	177.5	-72.1	173.1	0	0	0	111	L90 T91 G96 S97 G98 T99 T105 I106 I109	L90-L94 HydrophobicContact CD1-CD1 4.19Å; L90-L94 HydrophobicContact CD1-CG 4.2Å; L90-L94 HydrophobicContact CG-CD1 4.09Å; L90-L94 WeakPolarHBondContact O-CB 3.38Å; L90-L94 WeakPolarHBondContact O-CG 3.48Å; L90-L94 PolarHBondContact O-N 2.85Å; T91-L94 PolarHBondContact O-N 2.85Å; L94-G96 PolarHBondContact O-N 2.93Å; L94-S97 PolarHBondContact O-N 2.99Å; L94-S97 PolarHBondContact O-OG 3.33Å; L94-G98 PolarHBondContact O-N 3.32Å; L94-T99 HydrophobicContact CB-CG2 4.48Å; L94-T99 WeakPolarHBondContact O-CB 3.49Å; L94-T99 PolarHBondContact O-N 3.18Å; L94-T99 PolarHBondContact O-OG1 3.01Å; L94-T105 HydrophobicContact CD1-CG2 4.03Å; L94-I106 HydrophobicContact CB-CD1 4.19Å; L94-I106 HydrophobicContact CB-CG1 4.35Å; L94-I106 HydrophobicContact CD1-CG1 4.21Å; L94-I109 HydrophobicContact CD1-CD1 4.19Å
95	I	79.2	Confident	81.8	Confident	68 Å²	68	66.4 Å²	66.4	35%	0.349	40%	0.402	S	S	.	.	H	α-helix	trans	-61.6	-45.8	177	-66.4	173.1	0	0	0	110.5	T91 S97 G98 E101 I106	T91-I95 HydrophobicContact CG2-CD1 3.72Å; T91-I95 HydrophobicContact CG2-CG1 4.38Å; T91-I95 WeakPolarHBondContact O-CG1 3.48Å; T91-I95 PolarHBondContact O-N 2.72Å; I95-S97 PolarHBondContact O-N 2.9Å; I95-G98 PolarHBondContact O-N 3.23Å; I95-E101 HydrophobicContact CD1-CG 4.39Å; I95-I106 HydrophobicContact CG1-CD1 3.8Å
96	G	80.3	Confident	81.3	Confident	71 Å²	71	64 Å²	64	73%	0.732	38%	0.38	S	S	*	.	H	α-helix	trans	-60.1	-30.3	176.7	0	0	0	0	0	113.8	D92 R93 L94 G98	D92-G96 PolarHBondContact O-N 3.4Å; R93-G96 PolarHBondContact O-N 3.33Å; L94-G96 PolarHBondContact O-N 2.93Å; G96-G98 VanDerWaalsContact C-N 3.26Å; G96-G98 PolarHBondContact O-N 3.28Å
97	S	84.8	Confident	80.8	Confident	84 Å²	84	66 Å²	66	59%	0.587	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-2.3	174.7	74.1	0	0	0	0	114.5	R93 L94 I95	R93-S97 WeakPolarHBondContact O-CB 3.23Å; R93-S97 PolarHBondContact O-N 2.9Å; R93-S97 PolarHBondContact O-OG 3.42Å; L94-S97 PolarHBondContact O-N 2.99Å; L94-S97 PolarHBondContact O-OG 3.33Å; I95-S97 PolarHBondContact O-N 2.9Å
98	G	82.2	Confident	80.4	Confident	62 Å²	62	71.5 Å²	71.5	64%	0.639	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.7	7.6	179.3	0	0	0	0	0	114.9	L94 I95 G96 K100	L94-G98 PolarHBondContact O-N 3.32Å; I95-G98 PolarHBondContact O-N 3.23Å; G96-G98 VanDerWaalsContact C-N 3.26Å; G96-G98 PolarHBondContact O-N 3.28Å; G98-K100 PolarHBondContact O-N 2.97Å
99	T	82.1	Confident	80	Confident	35 Å²	35	67.9 Å²	67.9	22%	0.215	40%	0.4	C	S	.	.			trans	-65.4	127.8	171.4	-55.4	0	0	0	0	109	L94 D103 I106	L94-T99 HydrophobicContact CB-CG2 4.48Å; L94-T99 WeakPolarHBondContact O-CB 3.49Å; L94-T99 PolarHBondContact O-N 3.18Å; L94-T99 PolarHBondContact O-OG1 3.01Å; T99-D103 HydrophobicContact CG2-CB 3.42Å; T99-D103 VanDerWaalsContact CG2-CB 3.42Å; T99-I106 HydrophobicContact CG2-CD1 3.7Å; T99-I106 HydrophobicContact CG2-CG1 4.26Å
100	K	80.5	Confident	79.5	Confident	160 Å²	160	67.6 Å²	67.6	70%	0.696	40%	0.398	S	S	*	.			trans	-70.7	144.5	179.8	-63.8	-178.5	-179.5	179.6	0	109.9	G98 T102 D103 I106	G98-K100 PolarHBondContact O-N 2.97Å; K100-T102 PolarHBondContact O-N 3.13Å; K100-D103 WeakPolarHBondContact O-CB 3.45Å; K100-D103 PolarHBondContact O-N 3.47Å; K100-I106 WeakPolarHBondContact O-CD1 3.48Å
101	E	75.2	Confident	78.8	Confident	148 Å²	148	69.9 Å²	69.9	69%	0.692	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-23.2	175.1	-64.5	178.8	177	0	0	113.9	I95 D103	I95-E101 HydrophobicContact CD1-CG 4.39Å; E101-D103 VanDerWaalsContact C-N 3.29Å; E101-D103 PolarHBondContact O-N 3.36Å
102	T	75.7	Confident	78.4	Confident	115 Å²	115	70.7 Å²	70.7	71%	0.706	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-1.4	175.6	61.1	0	0	0	0	114.4	K100	K100-T102 PolarHBondContact O-N 3.13Å
103	D	77.9	Confident	78	Confident	54 Å²	54	66.4 Å²	66.4	29%	0.289	40%	0.398	S	S	.	.	S	Bend	trans	-62.6	134.9	177.8	-172.6	-86.7	0	0	0	110.2	T99 K100 E101 T105 I106 V107	T99-D103 HydrophobicContact CG2-CB 3.42Å; T99-D103 VanDerWaalsContact CG2-CB 3.42Å; K100-D103 WeakPolarHBondContact O-CB 3.45Å; K100-D103 PolarHBondContact O-N 3.47Å; E101-D103 VanDerWaalsContact C-N 3.29Å; E101-D103 PolarHBondContact O-N 3.36Å; D103-T105 PolarHBondContact O-N 3.27Å; D103-T105 WeakPolarHBondContact OD1-CB 3.47Å; D103-T105 PolarHBondContact OD1-N 3.47Å; D103-T105 PolarHBondContact OD1-OG1 2.83Å; D103-I106 HydrophobicContact CB-CG1 4.46Å; D103-I106 PolarHBondContact O-N 3.22Å; D103-V107 WeakPolarHBondContact O-CG2 3.22Å; D103-V107 PolarHBondContact O-N 2.91Å
104	P	77.3	Confident	77.2	Confident	98 Å²	98	67.4 Å²	67.4	64%	0.636	41%	0.408	S	S	*	.	H	α-helix	trans	-51.1	-34.3	-179.9	-29	36	0	0	0	114.1	V107 E108	P104-V107 PolarHBondContact O-N 2.92Å; P104-E108 WeakPolarHBondContact O-CB 3.37Å; P104-E108 PolarHBondContact O-N 3.39Å
105	T	78.4	Confident	76.3	Confident	59 Å²	59	68.2 Å²	68.2	36%	0.362	42%	0.417	S	S	.	.	H	α-helix	trans	-66	-44	177.9	-39.7	0	0	0	0	111.2	L94 D103 E108 I109	L94-T105 HydrophobicContact CD1-CG2 4.03Å; D103-T105 PolarHBondContact O-N 3.27Å; D103-T105 WeakPolarHBondContact OD1-CB 3.47Å; D103-T105 PolarHBondContact OD1-N 3.47Å; D103-T105 PolarHBondContact OD1-OG1 2.83Å; T105-E108 PolarHBondContact O-N 3.43Å; T105-I109 HydrophobicContact CG2-CD1 4.16Å; T105-I109 WeakPolarHBondContact O-CD1 3.39Å; T105-I109 VanDerWaalsContact O-CG1 3.23Å; T105-I109 WeakPolarHBondContact O-CG1 3.14Å; T105-I109 PolarHBondContact O-N 3.44Å
106	I	75.1	Confident	75.5	Confident	10 Å²	10	65.3 Å²	65.3	5%	0.051	40%	0.402	C	S	.	.	H	α-helix	trans	-69	-39.5	177.8	-65.9	-179.9	0	0	0	110	T91 L94 I95 T99 K100 D103 S110	T91-I106 HydrophobicContact CG2-CG2 4.39Å; L94-I106 HydrophobicContact CB-CD1 4.19Å; L94-I106 HydrophobicContact CB-CG1 4.35Å; L94-I106 HydrophobicContact CD1-CG1 4.21Å; I95-I106 HydrophobicContact CG1-CD1 3.8Å; T99-I106 HydrophobicContact CG2-CD1 3.7Å; T99-I106 HydrophobicContact CG2-CG1 4.26Å; K100-I106 WeakPolarHBondContact O-CD1 3.48Å; D103-I106 HydrophobicContact CB-CG1 4.46Å; D103-I106 PolarHBondContact O-N 3.22Å; I106-S110 VanDerWaalsContact O-CB 3.25Å; I106-S110 WeakPolarHBondContact O-CB 3.37Å; I106-S110 PolarHBondContact O-N 2.88Å; I106-S110 PolarHBondContact O-OG 3.39Å
107	V	77.7	Confident	74.5	Confident	73 Å²	73	67.5 Å²	67.5	44%	0.442	39%	0.391	S	S	.	.	H	α-helix	trans	-61.7	-46.1	175.8	175.8	0	0	0	0	110.9	D103 P104 S110 A111	D103-V107 WeakPolarHBondContact O-CG2 3.22Å; D103-V107 PolarHBondContact O-N 2.91Å; P104-V107 PolarHBondContact O-N 2.92Å; V107-S110 WeakPolarHBondContact CA-OG 3.5Å; V107-S110 PolarHBondContact O-N 3.45Å; V107-S110 PolarHBondContact O-OG 2.94Å; V107-A111 WeakPolarHBondContact O-CB 3.46Å; V107-A111 PolarHBondContact O-N 3.08Å
108	E	78.8	Confident	73.4	Confident	115 Å²	115	69.4 Å²	69.4	54%	0.537	40%	0.395	S	S	.	.	H	α-helix	trans	-60.9	-51	176.8	-173.2	169.7	-166	0	0	111.5	P104 T105 S110 A111 D112	P104-E108 WeakPolarHBondContact O-CB 3.37Å; P104-E108 PolarHBondContact O-N 3.39Å; T105-E108 PolarHBondContact O-N 3.43Å; E108-S110 VanDerWaalsContact C-N 3.27Å; E108-S110 PolarHBondContact O-N 3.21Å; E108-A111 WeakPolarHBondContact O-CA 3.49Å; E108-A111 WeakPolarHBondContact O-CB 3.42Å; E108-A111 PolarHBondContact O-N 3.19Å; E108-D112 PolarHBondContact O-N 2.94Å
109	I	74.4	Confident	72.3	Confident	2 Å²	2	72.5 Å²	72.5	1%	0.01	39%	0.393	C	S	.	.	H	α-helix	trans	-58.2	-41.6	176.6	-65.7	164	0	0	0	111.2	F87 L90 T91 L94 T105 A111 D112 L113	F87-I109 HydrophobicContact CB-CG2 3.77Å; F87-I109 HydrophobicContact CD1-CB 4.37Å; F87-I109 HydrophobicContact CD1-CG1 4.07Å; F87-I109 HydrophobicContact CD1-CG2 3.7Å; F87-I109 HydrophobicContact CE1-CG1 4.43Å; F87-I109 HydrophobicContact CG-CG2 4.02Å; L90-I109 HydrophobicContact CD2-CD1 3.56Å; L90-I109 HydrophobicContact CD2-CG1 4.48Å; L90-I109 HydrophobicContact CG-CD1 3.85Å; T91-I109 VanDerWaalsContact OG1-CG2 3.32Å; T91-I109 WeakPolarHBondContact OG1-CG2 3.43Å; L94-I109 HydrophobicContact CD1-CD1 4.19Å; T105-I109 HydrophobicContact CG2-CD1 4.16Å; T105-I109 WeakPolarHBondContact O-CD1 3.39Å; T105-I109 VanDerWaalsContact O-CG1 3.23Å; T105-I109 WeakPolarHBondContact O-CG1 3.14Å; T105-I109 PolarHBondContact O-N 3.44Å; I109-A111 VanDerWaalsContact C-N 3.3Å; I109-A111 PolarHBondContact O-N 3.31Å; I109-D112 PolarHBondContact O-N 3.49Å; I109-L113 HydrophobicContact CG2-CD1 4.05Å; I109-L113 HydrophobicContact CG2-CG 4.4Å; I109-L113 WeakPolarHBondContact O-CB 3.4Å; I109-L113 VanDerWaalsContact O-CG 3.31Å; I109-L113 WeakPolarHBondContact O-CG 3.38Å; I109-L113 PolarHBondContact O-N 2.96Å
110	S	75.4	Confident	71.2	Confident	51 Å²	51	73.1 Å²	73.1	36%	0.357	40%	0.395	S	S	.	.	H	α-helix	trans	-65.3	-35.2	177.7	77.5	0	0	0	0	112.3	I106 V107 E108 N114	I106-S110 VanDerWaalsContact O-CB 3.25Å; I106-S110 WeakPolarHBondContact O-CB 3.37Å; I106-S110 PolarHBondContact O-N 2.88Å; I106-S110 PolarHBondContact O-OG 3.39Å; V107-S110 WeakPolarHBondContact CA-OG 3.5Å; V107-S110 PolarHBondContact O-N 3.45Å; V107-S110 PolarHBondContact O-OG 2.94Å; E108-S110 VanDerWaalsContact C-N 3.27Å; E108-S110 PolarHBondContact O-N 3.21Å; S110-N114 WeakPolarHBondContact O-CB 3.4Å; S110-N114 PolarHBondContact O-N 3.2Å; S110-N114 PolarHBondContact O-ND2 3.4Å; S110-N114 VanDerWaalsContact O-ND2 3.15Å
111	A	71.6	Confident	70.6	Confident	51 Å²	51	67.2 Å²	67.2	42%	0.421	37%	0.374	S	S	.	.	H	α-helix	trans	-68.4	-43.6	175.7	0	0	0	0	0	111.1	V107 E108 I109 L113 N114 A115	V107-A111 WeakPolarHBondContact O-CB 3.46Å; V107-A111 PolarHBondContact O-N 3.08Å; E108-A111 WeakPolarHBondContact O-CA 3.49Å; E108-A111 WeakPolarHBondContact O-CB 3.42Å; E108-A111 PolarHBondContact O-N 3.19Å; I109-A111 VanDerWaalsContact C-N 3.3Å; I109-A111 PolarHBondContact O-N 3.31Å; A111-L113 PolarHBondContact O-N 2.95Å; A111-N114 PolarHBondContact O-N 3.08Å; A111-N114 VanDerWaalsContact O-N 3.16Å; A111-A115 WeakPolarHBondContact O-CB 3.36Å; A111-A115 PolarHBondContact O-N 2.93Å
112	D	72.1	Confident	70.5	Confident	38 Å²	38	66.5 Å²	66.5	20%	0.203	37%	0.374	C	S	.	.	H	α-helix	trans	-64.9	-39.3	176.9	-69.9	-21.6	0	0	0	112.1	F87 E108 I109 N114 A115 Q116	F87-D112 HydrophobicContact CE2-CB 4.47Å; F87-D112 HydrophobicContact CZ-CB 4.37Å; E108-D112 PolarHBondContact O-N 2.94Å; I109-D112 PolarHBondContact O-N 3.49Å; D112-N114 VanDerWaalsContact C-N 3.31Å; D112-N114 PolarHBondContact O-N 3.23Å; D112-A115 PolarHBondContact O-N 3.38Å; D112-Q116 WeakPolarHBondContact O-CG 3.34Å; D112-Q116 PolarHBondContact O-N 3.42Å
113	L	72.7	Confident	70.5	Confident	25 Å²	25	64.6 Å²	64.6	13%	0.131	36%	0.364	C	S	.	.	H	α-helix	trans	-64.4	-34.7	172.9	-75.8	174.3	0	0	0	112.5	K84 F87 L88 I109 A111 K117	K84-L113 HydrophobicContact CB-CD2 4.32Å; K84-L113 HydrophobicContact CG-CD2 3.91Å; F87-L113 HydrophobicContact CB-CD1 4.24Å; F87-L113 HydrophobicContact CB-CD2 3.86Å; F87-L113 HydrophobicContact CB-CG 4.06Å; F87-L113 HydrophobicContact CD2-CD2 4.34Å; F87-L113 HydrophobicContact CG-CD2 4.48Å; L88-L113 HydrophobicContact CD2-CD1 4.03Å; I109-L113 HydrophobicContact CG2-CD1 4.05Å; I109-L113 HydrophobicContact CG2-CG 4.4Å; I109-L113 WeakPolarHBondContact O-CB 3.4Å; I109-L113 VanDerWaalsContact O-CG 3.31Å; I109-L113 WeakPolarHBondContact O-CG 3.38Å; I109-L113 PolarHBondContact O-N 2.96Å; A111-L113 PolarHBondContact O-N 2.95Å; L113-K117 WeakPolarHBondContact O-CG 3.4Å; L113-K117 PolarHBondContact O-N 3.06Å
114	N	67.4	Low	70.4	Confident	79 Å²	79	66.4 Å²	66.4	42%	0.422	37%	0.368	S	S	.	.	H	α-helix	trans	-75.3	-41.1	175.9	-72.9	-26.1	0	0	0	111.8	S110 A111 D112 Q116 K117 D118	S110-N114 WeakPolarHBondContact O-CB 3.4Å; S110-N114 PolarHBondContact O-N 3.2Å; S110-N114 PolarHBondContact O-ND2 3.4Å; S110-N114 VanDerWaalsContact O-ND2 3.15Å; A111-N114 PolarHBondContact O-N 3.08Å; A111-N114 VanDerWaalsContact O-N 3.16Å; D112-N114 VanDerWaalsContact C-N 3.31Å; D112-N114 PolarHBondContact O-N 3.23Å; N114-Q116 VanDerWaalsContact C-N 3.29Å; N114-Q116 PolarHBondContact O-N 3.18Å; N114-K117 WeakPolarHBondContact O-CA 3.34Å; N114-K117 WeakPolarHBondContact O-CB 3.38Å; N114-K117 PolarHBondContact O-N 3.29Å; N114-D118 PolarHBondContact O-N 3.1Å
115	A	63.3	Low	70.4	Confident	34 Å²	34	62.5 Å²	62.5	28%	0.281	34%	0.344	S	S	.	.	H	α-helix	trans	-58.6	-41.6	174.1	0	0	0	0	0	111.5	A111 D112 K117 D118 E119	A111-A115 WeakPolarHBondContact O-CB 3.36Å; A111-A115 PolarHBondContact O-N 2.93Å; D112-A115 PolarHBondContact O-N 3.38Å; A115-K117 VanDerWaalsContact C-N 3.35Å; A115-K117 PolarHBondContact O-N 3.24Å; A115-D118 PolarHBondContact O-N 2.68Å; A115-E119 PolarHBondContact O-N 3.13Å
116	Q	61.7	Low	70.3	Confident	7 Å²	7	64.8 Å²	64.8	3%	0.033	35%	0.353	C	S	.	.	H	α-helix	trans	-59.1	-44	171.7	-79.9	179.8	62.7	0	0	112.8	Y75 D112 N114 D118 L120	Y75-Q116 HydrophobicContact CD2-CG 3.6Å; Y75-Q116 HydrophobicContact CE2-CG 3.24Å; D112-Q116 WeakPolarHBondContact O-CG 3.34Å; D112-Q116 PolarHBondContact O-N 3.42Å; N114-Q116 VanDerWaalsContact C-N 3.29Å; N114-Q116 PolarHBondContact O-N 3.18Å; Q116-D118 VanDerWaalsContact C-N 3.3Å; Q116-D118 PolarHBondContact O-N 3.07Å; Q116-L120 HydrophobicContact CB-CD1 4.5Å; Q116-L120 WeakPolarHBondContact O-CB 3.31Å; Q116-L120 WeakPolarHBondContact O-CD1 3.27Å; Q116-L120 WeakPolarHBondContact O-CG 3.37Å; Q116-L120 PolarHBondContact O-N 3.3Å
117	K	60.9	Low	70.6	Confident	117 Å²	117	69.3 Å²	69.3	51%	0.509	37%	0.37	S	S	.	.	H	α-helix	trans	-60.5	-44.8	176.5	-75.2	175.1	-177.7	173.5	0	110	L113 N114 A115 S121	L113-K117 WeakPolarHBondContact O-CG 3.4Å; L113-K117 PolarHBondContact O-N 3.06Å; N114-K117 WeakPolarHBondContact O-CA 3.34Å; N114-K117 WeakPolarHBondContact O-CB 3.38Å; N114-K117 PolarHBondContact O-N 3.29Å; A115-K117 VanDerWaalsContact C-N 3.35Å; A115-K117 PolarHBondContact O-N 3.24Å; K117-S121 WeakPolarHBondContact O-CA 3.46Å; K117-S121 WeakPolarHBondContact O-CB 3.47Å; K117-S121 PolarHBondContact O-N 3.29Å; K117-S121 PolarHBondContact O-OG 2.97Å
118	D	60.7	Low	70.9	Confident	124 Å²	124	66.2 Å²	66.2	66%	0.663	35%	0.353	S	S	*	.	H	α-helix	trans	-66.4	-46.1	-178.9	-70.4	-12.5	0	0	0	112	N114 A115 Q116 L120 S121	N114-D118 PolarHBondContact O-N 3.1Å; A115-D118 PolarHBondContact O-N 2.68Å; Q116-D118 VanDerWaalsContact C-N 3.3Å; Q116-D118 PolarHBondContact O-N 3.07Å; D118-L120 PolarHBondContact O-N 3.02Å; D118-S121 PolarHBondContact O-N 3.46Å
119	E	58.8	Low	71.1	Confident	128 Å²	128	66 Å²	66	60%	0.598	35%	0.354	S	S	*	.	H	α-helix	trans	-65.9	-38.8	178.9	-74.4	-172.8	179.5	0	0	113	A115 P123	A115-E119 PolarHBondContact O-N 3.13Å; E119-P123 WeakPolarHBondContact O-CD 3.33Å
120	L	60.5	Low	71.6	Confident	47 Å²	47	70.6 Å²	70.6	25%	0.246	38%	0.377	C	S	.	.	H	α-helix	trans	-84	-18.9	-179.9	-70.1	165.4	0	0	0	113.1	T80 Q116 D118 D122 P123 Y124	T80-L120 HydrophobicContact CG2-CD1 3.93Å; T80-L120 HydrophobicContact CG2-CD2 4.41Å; T80-L120 HydrophobicContact CG2-CG 4.49Å; Q116-L120 HydrophobicContact CB-CD1 4.5Å; Q116-L120 WeakPolarHBondContact O-CB 3.31Å; Q116-L120 WeakPolarHBondContact O-CD1 3.27Å; Q116-L120 WeakPolarHBondContact O-CG 3.37Å; Q116-L120 PolarHBondContact O-N 3.3Å; D118-L120 PolarHBondContact O-N 3.02Å; L120-D122 VanDerWaalsContact C-N 3.26Å; L120-D122 PolarHBondContact O-N 3.38Å; L120-P123 WeakPolarHBondContact O-CD 3.29Å; L120-Y124 HydrophobicContact CB-CD2 3.72Å; L120-Y124 HydrophobicContact CB-CE2 3.7Å; L120-Y124 HydrophobicContact CD1-CE2 4.19Å; L120-Y124 HydrophobicContact CD2-CE2 3.87Å; L120-Y124 HydrophobicContact CG-CE2 4.15Å; L120-Y124 WeakPolarHBondContact O-CB 3.38Å; L120-Y124 WeakPolarHBondContact O-CD2 3.2Å; L120-Y124 PolarHBondContact O-N 2.84Å
121	S	67.7	Low	72.1	Confident	37 Å²	37	68.5 Å²	68.5	26%	0.259	36%	0.362	S	S	.	.	H	α-helix	trans	-57.7	-41.4	-179.9	-77.2	0	0	0	0	111.2	K117 D118 A125	K117-S121 WeakPolarHBondContact O-CA 3.46Å; K117-S121 WeakPolarHBondContact O-CB 3.47Å; K117-S121 PolarHBondContact O-N 3.29Å; K117-S121 PolarHBondContact O-OG 2.97Å; D118-S121 PolarHBondContact O-N 3.46Å; S121-A125 WeakPolarHBondContact O-CB 3.49Å; S121-A125 PolarHBondContact O-N 3.46Å
122	D	72	Confident	72.8	Confident	132 Å²	132	67.6 Å²	67.6	71%	0.706	35%	0.349	S	S	*	.	H	α-helix	trans	-69.5	-50.7	-176.5	-120.9	10.3	0	0	0	113	L120 Y124 A125 L126	L120-D122 VanDerWaalsContact C-N 3.26Å; L120-D122 PolarHBondContact O-N 3.38Å; D122-Y124 PolarHBondContact O-N 2.9Å; D122-A125 PolarHBondContact O-N 2.98Å; D122-L126 WeakPolarHBondContact O-CB 3.08Å; D122-L126 PolarHBondContact O-N 3.31Å
123	P	75.2	Confident	73.6	Confident	76 Å²	76	69.4 Å²	69.4	49%	0.494	36%	0.362	S	S	.	.	H	α-helix	trans	-62.8	-39.3	175.3	-24.7	34.7	0	0	0	113.6	E119 L120 L126 Y127	E119-P123 WeakPolarHBondContact O-CD 3.33Å; L120-P123 WeakPolarHBondContact O-CD 3.29Å; P123-L126 PolarHBondContact O-N 3.23Å; P123-Y127 WeakPolarHBondContact O-CB 3.47Å; P123-Y127 PolarHBondContact O-N 3.21Å
124	Y	77.4	Confident	74.6	Confident	91 Å²	91	72.4 Å²	72.4	36%	0.357	37%	0.372	S	S	.	.	H	α-helix	trans	-70.6	-36.4	177	-75.1	-56.2	0	0	0	112.2	L120 D122 Y127 G128 L157	L120-Y124 HydrophobicContact CB-CD2 3.72Å; L120-Y124 HydrophobicContact CB-CE2 3.7Å; L120-Y124 HydrophobicContact CD1-CE2 4.19Å; L120-Y124 HydrophobicContact CD2-CE2 3.87Å; L120-Y124 HydrophobicContact CG-CE2 4.15Å; L120-Y124 WeakPolarHBondContact O-CB 3.38Å; L120-Y124 WeakPolarHBondContact O-CD2 3.2Å; L120-Y124 PolarHBondContact O-N 2.84Å; D122-Y124 PolarHBondContact O-N 2.9Å; Y124-Y127 PolarHBondContact O-N 3.37Å; Y124-G128 PolarHBondContact O-N 3.42Å; Y124-L157 HydrophobicContact CD1-CD2 3.83Å; Y124-L157 HydrophobicContact CG-CD2 4.35Å
125	A	76.6	Confident	75.8	Confident	17 Å²	17	68.6 Å²	68.6	14%	0.14	35%	0.352	C	S	.	.	H	α-helix	trans	-61.4	-47.8	172.1	0	0	0	0	0	110.5	S121 D122 Y127 G128 M129 I161	S121-A125 WeakPolarHBondContact O-CB 3.49Å; S121-A125 PolarHBondContact O-N 3.46Å; D122-A125 PolarHBondContact O-N 2.98Å; A125-Y127 PolarHBondContact O-N 2.91Å; A125-G128 PolarHBondContact O-N 3.32Å; A125-M129 WeakPolarHBondContact O-CG 3.48Å; A125-M129 PolarHBondContact O-N 3.37Å; A125-I161 HydrophobicContact CB-CD1 4.06Å
126	L	76.7	Confident	77.2	Confident	106 Å²	106	71.8 Å²	71.8	56%	0.555	36%	0.356	S	S	*	.	H	α-helix	trans	-61.4	-44.4	177	-177.1	60.9	0	0	0	111.9	D122 P123 G128 M129 I130	D122-L126 WeakPolarHBondContact O-CB 3.08Å; D122-L126 PolarHBondContact O-N 3.31Å; P123-L126 PolarHBondContact O-N 3.23Å; L126-G128 VanDerWaalsContact C-N 3.32Å; L126-G128 PolarHBondContact O-N 3.38Å; L126-M129 PolarHBondContact O-N 2.7Å; L126-I130 HydrophobicContact CD1-CD1 4.48Å; L126-I130 HydrophobicContact CG-CD1 4.16Å; L126-I130 VanDerWaalsContact O-CG1 3.32Å; L126-I130 WeakPolarHBondContact O-CG1 3.49Å; L126-I130 PolarHBondContact O-N 3.44Å
127	Y	81.6	Confident	78.6	Confident	105 Å²	105	77.7 Å²	77.7	41%	0.412	38%	0.379	S	S	.	.	H	α-helix	trans	-61.4	-41.5	175.5	179	-132.4	0	0	0	111.8	P123 Y124 A125 I130 L131 L157	P123-Y127 WeakPolarHBondContact O-CB 3.47Å; P123-Y127 PolarHBondContact O-N 3.21Å; Y124-Y127 PolarHBondContact O-N 3.37Å; A125-Y127 PolarHBondContact O-N 2.91Å; Y127-I130 PolarHBondContact O-N 3.49Å; Y127-L131 HydrophobicContact CD1-CD1 4.1Å; Y127-L131 HydrophobicContact CD2-CD1 4.26Å; Y127-L131 HydrophobicContact CD2-CG 4.14Å; Y127-L131 HydrophobicContact CE1-CD1 3.7Å; Y127-L131 HydrophobicContact CE2-CD1 3.86Å; Y127-L131 HydrophobicContact CE2-CD2 3.99Å; Y127-L131 HydrophobicContact CE2-CG 3.75Å; Y127-L131 HydrophobicContact CG-CD1 4.36Å; Y127-L131 WeakPolarHBondContact O-CG 3.47Å; Y127-L131 PolarHBondContact O-N 3.46Å; Y127-L157 HydrophobicContact CD1-CD1 3.42Å; Y127-L157 VanDerWaalsContact CD1-CD1 3.42Å; Y127-L157 HydrophobicContact CE1-CD1 3.87Å; Y127-L157 HydrophobicContact CG-CD1 4.26Å
128	G	82.4	Confident	80.2	Confident	8 Å²	8	72.1 Å²	72.1	8%	0.082	36%	0.355	C	S	.	.	H	α-helix	trans	-57.9	-47.5	172.7	0	0	0	0	0	112.6	Y124 A125 L126 I130 L131 E132 A154	Y124-G128 PolarHBondContact O-N 3.42Å; A125-G128 PolarHBondContact O-N 3.32Å; L126-G128 VanDerWaalsContact C-N 3.32Å; L126-G128 PolarHBondContact O-N 3.38Å; G128-I130 VanDerWaalsContact C-N 3.34Å; G128-I130 PolarHBondContact O-N 2.66Å; G128-L131 PolarHBondContact O-N 3.23Å; G128-E132 PolarHBondContact O-N 2.96Å; G128-A154 WeakPolarHBondContact O-CB 3.23Å
129	M	83.8	Confident	81.9	Confident	111 Å²	111	66.2 Å²	66.2	55%	0.547	32%	0.323	S	S	.	.	H	α-helix	trans	-62.4	-38.7	177.2	-69.7	177.2	67.6	0	0	112.9	A125 L126 T133	A125-M129 WeakPolarHBondContact O-CG 3.48Å; A125-M129 PolarHBondContact O-N 3.37Å; L126-M129 PolarHBondContact O-N 2.7Å; M129-T133 WeakPolarHBondContact O-CB 3.29Å; M129-T133 PolarHBondContact O-N 3.19Å; M129-T133 PolarHBondContact O-OG1 2.86Å
130	I	85.2	Confident	83.5	Confident	98 Å²	98	62.9 Å²	62.9	50%	0.503	31%	0.314	S	S	.	.	H	α-helix	trans	-64.5	-46.3	175.3	-69.2	166.6	0	0	0	110	L126 Y127 G128 E132 T133 Y134	L126-I130 HydrophobicContact CD1-CD1 4.48Å; L126-I130 HydrophobicContact CG-CD1 4.16Å; L126-I130 VanDerWaalsContact O-CG1 3.32Å; L126-I130 WeakPolarHBondContact O-CG1 3.49Å; L126-I130 PolarHBondContact O-N 3.44Å; Y127-I130 PolarHBondContact O-N 3.49Å; G128-I130 VanDerWaalsContact C-N 3.34Å; G128-I130 PolarHBondContact O-N 2.66Å; I130-E132 PolarHBondContact O-N 3.08Å; I130-T133 PolarHBondContact O-N 3.27Å; I130-Y134 VanDerWaalsContact O-CB 3.32Å; I130-Y134 WeakPolarHBondContact O-CB 3.46Å; I130-Y134 PolarHBondContact O-N 3.25Å
131	L	86.4	Confident	85.2	Confident	8 Å²	8	68.4 Å²	68.4	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-62	-41.2	177.7	-74.4	172.5	0	0	0	112.3	Y127 G128 Y134 S135 H150 R153 A154 L157	Y127-L131 HydrophobicContact CD1-CD1 4.1Å; Y127-L131 HydrophobicContact CD2-CD1 4.26Å; Y127-L131 HydrophobicContact CD2-CG 4.14Å; Y127-L131 HydrophobicContact CE1-CD1 3.7Å; Y127-L131 HydrophobicContact CE2-CD1 3.86Å; Y127-L131 HydrophobicContact CE2-CD2 3.99Å; Y127-L131 HydrophobicContact CE2-CG 3.75Å; Y127-L131 HydrophobicContact CG-CD1 4.36Å; Y127-L131 WeakPolarHBondContact O-CG 3.47Å; Y127-L131 PolarHBondContact O-N 3.46Å; G128-L131 PolarHBondContact O-N 3.23Å; L131-Y134 PolarHBondContact O-N 3.15Å; L131-S135 WeakPolarHBondContact O-CB 3.4Å; L131-S135 PolarHBondContact O-N 3.36Å; L131-H150 HydrophobicContact CD2-CB 4.3Å; L131-H150 WeakPolarHBondContact CD2-ND1 3.46Å; L131-R153 HydrophobicContact CD1-CB 4.01Å; L131-R153 HydrophobicContact CD1-CG 3.59Å; L131-A154 HydrophobicContact CB-CB 3.71Å; L131-L157 HydrophobicContact CD1-CD1 3.93Å
132	E	86.4	Confident	86.5	Confident	32 Å²	32	72.3 Å²	72.3	15%	0.15	34%	0.344	C	S	.	.	H	α-helix	trans	-63.1	-43.5	175	-172.3	-159.9	156.4	0	0	111.9	G128 I130 Y134 S135 R136 F151 A154 M172	G128-E132 PolarHBondContact O-N 2.96Å; I130-E132 PolarHBondContact O-N 3.08Å; E132-Y134 VanDerWaalsContact C-N 3.35Å; E132-S135 PolarHBondContact O-N 3.18Å; E132-S135 PolarHBondContact O-OG 2.88Å; E132-R136 PolarHBondContact O-N 2.81Å; E132-F151 HydrophobicContact CG-CD2 4.36Å; E132-F151 HydrophobicContact CG-CE2 4.22Å; E132-A154 HydrophobicContact CB-CB 4.27Å; E132-M172 HydrophobicContact CB-CE 4.1Å; E132-M172 HydrophobicContact CG-CE 4.04Å; E132-M172 HydrophobicContact CG-CG 4.36Å
133	T	88.7	Confident	87.7	Confident	76 Å²	76	71.6 Å²	71.6	47%	0.466	33%	0.331	S	S	.	.	H	α-helix	trans	-66.8	-41	178.3	-58.5	0	0	0	0	111	M129 I130 R136 Y137	M129-T133 WeakPolarHBondContact O-CB 3.29Å; M129-T133 PolarHBondContact O-N 3.19Å; M129-T133 PolarHBondContact O-OG1 2.86Å; I130-T133 PolarHBondContact O-N 3.27Å; T133-R136 PolarHBondContact O-N 2.85Å; T133-R136 PolarHBondContact OG1-NH2 3.47Å; T133-Y137 PolarHBondContact O-N 3.43Å; T133-Y137 VanDerWaalsContact O-N 3.09Å
134	Y	92.5	Very high	88.7	Confident	87 Å²	87	69 Å²	69	34%	0.341	32%	0.315	S	S	.	.	H	α-helix	trans	-68.4	-36.7	177.6	-175.2	-127.8	0	0	0	112.5	I130 L131 E132 Y137 L138 H150	I130-Y134 VanDerWaalsContact O-CB 3.32Å; I130-Y134 WeakPolarHBondContact O-CB 3.46Å; I130-Y134 PolarHBondContact O-N 3.25Å; L131-Y134 PolarHBondContact O-N 3.15Å; E132-Y134 VanDerWaalsContact C-N 3.35Å; Y134-Y137 AromaticContact CD2-CD1 3.98Å; Y134-Y137 HydrophobicContact CD2-CD1 3.98Å; Y134-Y137 AromaticContact CE2-CD1 3.89Å; Y134-Y137 HydrophobicContact CE2-CD1 3.89Å; Y134-Y137 HydrophobicContact CE2-CE1 4.33Å; Y134-Y137 WeakPolarHBondContact O-CB 3.2Å; Y134-Y137 PolarHBondContact O-N 2.88Å; Y134-L138 HydrophobicContact CD1-CD1 3.82Å; Y134-L138 HydrophobicContact CD1-CG 4.46Å; Y134-L138 HydrophobicContact CD2-CG 4.35Å; Y134-L138 HydrophobicContact CE1-CD1 3.52Å; Y134-L138 HydrophobicContact CE1-CG 4.16Å; Y134-L138 HydrophobicContact CE2-CD1 4.29Å; Y134-L138 HydrophobicContact CE2-CD2 4.13Å; Y134-L138 HydrophobicContact CE2-CG 4.01Å; Y134-L138 HydrophobicContact CG-CD1 4.34Å; Y134-L138 WeakPolarHBondContact O-CG 3.28Å; Y134-L138 PolarHBondContact O-N 3.35Å; Y134-H150 AromaticContact CD1-CD2 3.89Å; Y134-H150 AromaticContact CD1-CG 3.94Å; Y134-H150 AromaticContact CE1-CD2 3.75Å; Y134-H150 AromaticContact CE1-CE1 3.97Å; Y134-H150 AromaticContact CE1-NE2 3.58Å
135	S	93.3	Very high	89.6	Confident	0 Å²	0	71 Å²	71	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61.8	-46.7	174.5	70.9	0	0	0	0	111.1	L131 E132 Y137 L138 M139 S147	L131-S135 WeakPolarHBondContact O-CB 3.4Å; L131-S135 PolarHBondContact O-N 3.36Å; E132-S135 PolarHBondContact O-N 3.18Å; E132-S135 PolarHBondContact O-OG 2.88Å; S135-Y137 VanDerWaalsContact C-N 3.29Å; S135-Y137 PolarHBondContact O-N 3.46Å; S135-L138 WeakPolarHBondContact O-CB 3.42Å; S135-L138 PolarHBondContact O-N 2.83Å; S135-M139 WeakPolarHBondContact O-CB 3.2Å; S135-M139 PolarHBondContact O-N 3.46Å; S135-S147 VanDerWaalsContact CB-O 3.25Å; S135-S147 WeakPolarHBondContact CB-O 3.45Å; S135-S147 WeakPolarHBondContact O-CB 3.41Å; S135-S147 PolarHBondContact O-OG 2.98Å
136	R	92.4	Very high	90.3	Very high	101 Å²	101	73 Å²	73	38%	0.381	34%	0.335	S	S	.	.	H	α-helix	trans	-58.1	-41	174.9	-70.7	-176.7	-70.9	133.1	-4	112.4	E132 T133 M139 S140	E132-R136 PolarHBondContact O-N 2.81Å; T133-R136 PolarHBondContact O-N 2.85Å; T133-R136 PolarHBondContact OG1-NH2 3.47Å; R136-M139 PolarHBondContact O-N 2.9Å; R136-S140 PolarHBondContact O-N 2.97Å
137	Y	91.7	Very high	91.3	Very high	130 Å²	130	68 Å²	68	51%	0.51	31%	0.309	S	S	.	.	H	α-helix	trans	-59.3	-50.3	172.1	171.1	-103.6	0	0	0	111.5	T133 Y134 S135 M139 S140 R141	T133-Y137 PolarHBondContact O-N 3.43Å; T133-Y137 VanDerWaalsContact O-N 3.09Å; Y134-Y137 AromaticContact CD2-CD1 3.98Å; Y134-Y137 HydrophobicContact CD2-CD1 3.98Å; Y134-Y137 AromaticContact CE2-CD1 3.89Å; Y134-Y137 HydrophobicContact CE2-CD1 3.89Å; Y134-Y137 HydrophobicContact CE2-CE1 4.33Å; Y134-Y137 WeakPolarHBondContact O-CB 3.2Å; Y134-Y137 PolarHBondContact O-N 2.88Å; S135-Y137 VanDerWaalsContact C-N 3.29Å; S135-Y137 PolarHBondContact O-N 3.46Å; Y137-M139 VanDerWaalsContact C-N 3.34Å; Y137-M139 PolarHBondContact O-N 3.46Å; Y137-S140 WeakPolarHBondContact O-CB 3.36Å; Y137-S140 PolarHBondContact O-N 2.92Å; Y137-S140 PolarHBondContact O-OG 3.29Å; Y137-R141 HydrophobicContact CD2-CG 4.41Å; Y137-R141 HydrophobicContact CE1-CG 4.18Å; Y137-R141 HydrophobicContact CE2-CG 3.99Å; Y137-R141 WeakPolarHBondContact O-CG 3.09Å; Y137-R141 PolarHBondContact O-N 2.82Å; Y137-R141 VanDerWaalsContact O-N 3.14Å
138	L	93.9	Very high	92.1	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-40.9	178.7	-70.7	170.4	0	0	0	112.9	Y134 S135 S140 R141 K142 R143 D146 H150	Y134-L138 HydrophobicContact CD1-CD1 3.82Å; Y134-L138 HydrophobicContact CD1-CG 4.46Å; Y134-L138 HydrophobicContact CD2-CG 4.35Å; Y134-L138 HydrophobicContact CE1-CD1 3.52Å; Y134-L138 HydrophobicContact CE1-CG 4.16Å; Y134-L138 HydrophobicContact CE2-CD1 4.29Å; Y134-L138 HydrophobicContact CE2-CD2 4.13Å; Y134-L138 HydrophobicContact CE2-CG 4.01Å; Y134-L138 HydrophobicContact CG-CD1 4.34Å; Y134-L138 WeakPolarHBondContact O-CG 3.28Å; Y134-L138 PolarHBondContact O-N 3.35Å; S135-L138 WeakPolarHBondContact O-CB 3.42Å; S135-L138 PolarHBondContact O-N 2.83Å; L138-S140 VanDerWaalsContact C-N 3.34Å; L138-S140 PolarHBondContact O-N 3.36Å; L138-R141 CarbonylContact O-C 3.4Å; L138-R141 WeakPolarHBondContact O-CA 3.48Å; L138-R141 PolarHBondContact O-N 3.48Å; L138-K142 PolarHBondContact O-N 3.49Å; L138-R143 HydrophobicContact CB-CB 4.23Å; L138-R143 HydrophobicContact CD2-CB 4.11Å; L138-R143 PolarHBondContact O-N 3.2Å; L138-D146 HydrophobicContact CD1-CB 3.85Å; L138-D146 HydrophobicContact CD2-CB 4.47Å; L138-H150 VanDerWaalsContact CD1-CD2 3.5Å; L138-H150 WeakPolarHBondContact CD1-CD2 3.17Å
139	M	96.1	Very high	92.7	Very high	0 Å²	0	73 Å²	73	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-57.7	-46.4	174.6	-173.1	50.3	77	0	0	110.9	S135 R136 Y137 R141 K142 V144 S147 Y176 E179 Q183 E185 L188	S135-M139 WeakPolarHBondContact O-CB 3.2Å; S135-M139 PolarHBondContact O-N 3.46Å; R136-M139 PolarHBondContact O-N 2.9Å; Y137-M139 VanDerWaalsContact C-N 3.34Å; Y137-M139 PolarHBondContact O-N 3.46Å; M139-R141 PolarHBondContact O-N 3.25Å; M139-K142 PolarHBondContact O-N 2.98Å; M139-V144 HydrophobicContact CE-CG1 4.24Å; M139-V144 HydrophobicContact SD-CG2 4.36Å; M139-S147 WeakPolarHBondContact CB-OG 3.26Å; M139-Y176 HydrophobicContact CE-CE2 4.41Å; M139-Y176 VanDerWaalsContact CE-OH 3.28Å; M139-Y176 WeakPolarHBondContact CE-OH 3.41Å; M139-E179 HydrophobicContact CB-CG 4.41Å; M139-E179 HydrophobicContact CG-CG 3.89Å; M139-Q183 HydrophobicContact CG-CB 4.39Å; M139-Q183 HydrophobicContact CG-CG 3.62Å; M139-Q183 HydrophobicContact SD-CB 4.01Å; M139-Q183 HydrophobicContact SD-CG 3.86Å; M139-E185 HydrophobicContact SD-CG 4.12Å; M139-L188 HydrophobicContact CE-CD2 4.11Å
140	S	93.6	Very high	92.9	Very high	58 Å²	58	70 Å²	70	41%	0.406	32%	0.315	S	S	.	.	H	α-helix	trans	-63.4	-24.1	175.1	81.4	0	0	0	0	113.8	R136 Y137 L138 K142	R136-S140 PolarHBondContact O-N 2.97Å; Y137-S140 WeakPolarHBondContact O-CB 3.36Å; Y137-S140 PolarHBondContact O-N 2.92Å; Y137-S140 PolarHBondContact O-OG 3.29Å; L138-S140 VanDerWaalsContact C-N 3.34Å; L138-S140 PolarHBondContact O-N 3.36Å; S140-K142 VanDerWaalsContact C-N 3.32Å
141	R	95.5	Very high	93.4	Very high	163 Å²	163	65.3 Å²	65.3	62%	0.615	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	12	175.2	-58.1	-55.4	-66	-178.9	-4.2	113	Y137 L138 M139 R143	Y137-R141 HydrophobicContact CD2-CG 4.41Å; Y137-R141 HydrophobicContact CE1-CG 4.18Å; Y137-R141 HydrophobicContact CE2-CG 3.99Å; Y137-R141 WeakPolarHBondContact O-CG 3.09Å; Y137-R141 PolarHBondContact O-N 2.82Å; Y137-R141 VanDerWaalsContact O-N 3.14Å; L138-R141 CarbonylContact O-C 3.4Å; L138-R141 WeakPolarHBondContact O-CA 3.48Å; L138-R141 PolarHBondContact O-N 3.48Å; M139-R141 PolarHBondContact O-N 3.25Å; R141-R143 PolarHBondContact O-N 3.06Å; R141-R143 VanDerWaalsContact O-N 3.14Å
142	K	94.9	Very high	93.9	Very high	119 Å²	119	67.4 Å²	67.4	52%	0.517	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	22.2	-176.4	-56.8	-58.9	-166.5	-173.5	0	114	L138 M139 S140 V144 Q183	L138-K142 PolarHBondContact O-N 3.49Å; M139-K142 PolarHBondContact O-N 2.98Å; S140-K142 VanDerWaalsContact C-N 3.32Å; K142-V144 VanDerWaalsContact C-N 3.27Å; K142-V144 PolarHBondContact O-N 3.47Å; K142-Q183 PolarHBondContact NZ-O 3.33Å
143	R	96.9	Very high	94.2	Very high	117 Å²	117	70.6 Å²	70.6	44%	0.442	31%	0.313	S	S	.	.			trans	-89.7	67.1	171.6	-69.2	178.9	62.1	-173.1	1.3	109.1	L138 R141 D146 S147	L138-R143 HydrophobicContact CB-CB 4.23Å; L138-R143 HydrophobicContact CD2-CB 4.11Å; L138-R143 PolarHBondContact O-N 3.2Å; R141-R143 PolarHBondContact O-N 3.06Å; R141-R143 VanDerWaalsContact O-N 3.14Å; R143-D146 HydrophobicContact CB-CB 4.33Å; R143-D146 IonicContact CZ-OD2 2.74Å; R143-D146 IonicContact NE-OD2 3.02Å; R143-D146 PolarHBondContact NE-OD2 2.84Å; R143-D146 IonicContact NH2-OD2 3.73Å; R143-D146 PolarHBondContact NH2-OD2 3.46Å; R143-D146 PolarHBondContact O-N 3.41Å; R143-S147 WeakPolarHBondContact O-CB 3.38Å; R143-S147 PolarHBondContact O-N 3.26Å
144	V	96.1	Very high	94.2	Very high	23 Å²	23	67 Å²	67	14%	0.139	29%	0.291	C	S	.	.	H	α-helix	trans	-62.2	-47.6	-168.1	-179.6	0	0	0	0	112.1	M139 K142 S147 K148 E185 L188	M139-V144 HydrophobicContact CE-CG1 4.24Å; M139-V144 HydrophobicContact SD-CG2 4.36Å; K142-V144 VanDerWaalsContact C-N 3.27Å; K142-V144 PolarHBondContact O-N 3.47Å; V144-S147 WeakPolarHBondContact O-CB 3.13Å; V144-S147 PolarHBondContact O-N 3.35Å; V144-K148 WeakPolarHBondContact O-CB 3.39Å; V144-K148 PolarHBondContact O-N 2.8Å; V144-E185 HydrophobicContact CG1-CG 4.08Å; V144-E185 HydrophobicContact CG2-CG 3.94Å; V144-E185 WeakPolarHBondContact CG2-OE1 3.33Å; V144-L188 HydrophobicContact CG1-CD2 4.07Å
145	E	96.5	Very high	94.3	Very high	133 Å²	133	63 Å²	63	62%	0.621	28%	0.275	S	S	*	.	H	α-helix	trans	-65.8	-42.1	-178.9	-69.3	-54.9	143.5	0	0	112.7	K148 K149	E145-K148 PolarHBondContact O-N 3.49Å; E145-K149 WeakPolarHBondContact O-CB 3.31Å; E145-K149 PolarHBondContact O-N 3.26Å
146	D	92.8	Very high	94.2	Very high	59 Å²	59	67.1 Å²	67.1	32%	0.316	30%	0.295	S	S	.	.	H	α-helix	trans	-64.1	-43.6	175.3	-66.2	-37.2	0	0	0	110.8	L138 R143 K148 K149 H150	L138-D146 HydrophobicContact CD1-CB 3.85Å; L138-D146 HydrophobicContact CD2-CB 4.47Å; R143-D146 HydrophobicContact CB-CB 4.33Å; R143-D146 IonicContact CZ-OD2 2.74Å; R143-D146 IonicContact NE-OD2 3.02Å; R143-D146 PolarHBondContact NE-OD2 2.84Å; R143-D146 IonicContact NH2-OD2 3.73Å; R143-D146 PolarHBondContact NH2-OD2 3.46Å; R143-D146 PolarHBondContact O-N 3.41Å; D146-K148 PolarHBondContact O-N 2.96Å; D146-K149 WeakPolarHBondContact O-CB 3.48Å; D146-K149 PolarHBondContact O-N 3.16Å; D146-H150 PolarHBondContact O-CD2 2.89Å; D146-H150 PolarHBondContact O-N 3.41Å
147	S	96.7	Very high	93.9	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-55.6	-51.8	175.4	177.1	0	0	0	0	111.2	S135 M139 R143 V144 K149 H150 F151 Y176	S135-S147 VanDerWaalsContact CB-O 3.25Å; S135-S147 WeakPolarHBondContact CB-O 3.45Å; S135-S147 WeakPolarHBondContact O-CB 3.41Å; S135-S147 PolarHBondContact O-OG 2.98Å; M139-S147 WeakPolarHBondContact CB-OG 3.26Å; R143-S147 WeakPolarHBondContact O-CB 3.38Å; R143-S147 PolarHBondContact O-N 3.26Å; V144-S147 WeakPolarHBondContact O-CB 3.13Å; V144-S147 PolarHBondContact O-N 3.35Å; S147-K149 VanDerWaalsContact C-N 3.32Å; S147-K149 PolarHBondContact O-N 3.22Å; S147-H150 PolarHBondContact O-N 3.17Å; S147-F151 WeakPolarHBondContact O-CB 3.19Å; S147-F151 PolarHBondContact O-N 3.07Å; S147-Y176 WeakPolarHBondContact OG-CE2 3.45Å; S147-Y176 PolarHBondContact OG-OH 3Å
148	K	97.4	Very high	93.7	Very high	71 Å²	71	56.8 Å²	56.8	31%	0.309	26%	0.257	S	S	.	.	H	α-helix	trans	-58.4	-43.7	179.4	-179.5	-176.1	175.1	-173.3	0	111.6	V144 E145 D146 F151 N152 Y176 L188	V144-K148 WeakPolarHBondContact O-CB 3.39Å; V144-K148 PolarHBondContact O-N 2.8Å; E145-K148 PolarHBondContact O-N 3.49Å; D146-K148 PolarHBondContact O-N 2.96Å; K148-F151 PolarHBondContact O-N 3.08Å; K148-N152 WeakPolarHBondContact O-CB 3.41Å; K148-N152 VanDerWaalsContact O-CG 3.3Å; K148-N152 PolarHBondContact O-N 3.04Å; K148-N152 PolarHBondContact O-ND2 3.35Å; K148-Y176 WeakPolarHBondContact CA-OH 3.1Å; K148-Y176 PolarHBondContact N-OH 3.16Å; K148-L188 HydrophobicContact CD-CD1 3.89Å; K148-L188 HydrophobicContact CG-CD1 4.34Å
149	K	96.4	Very high	93.4	Very high	147 Å²	147	59.9 Å²	59.9	64%	0.639	27%	0.268	S	S	*	.	H	α-helix	trans	-58	-50.3	176.4	-180	-177.7	176.6	-178.3	0	111.8	E145 D146 S147 R153	E145-K149 WeakPolarHBondContact O-CB 3.31Å; E145-K149 PolarHBondContact O-N 3.26Å; D146-K149 WeakPolarHBondContact O-CB 3.48Å; D146-K149 PolarHBondContact O-N 3.16Å; S147-K149 VanDerWaalsContact C-N 3.32Å; S147-K149 PolarHBondContact O-N 3.22Å; K149-R153 PolarHBondContact O-N 3.11Å
150	H	87.5	Confident	92.8	Very high	47 Å²	47	66.2 Å²	66.2	22%	0.218	30%	0.302	C	S	.	.	H	α-helix	trans	-69.4	-38.6	-179.2	-73.7	-70.2	0	0	0	112.4	L131 Y134 L138 D146 S147 R153 A154	L131-H150 HydrophobicContact CD2-CB 4.3Å; L131-H150 WeakPolarHBondContact CD2-ND1 3.46Å; Y134-H150 AromaticContact CD1-CD2 3.89Å; Y134-H150 AromaticContact CD1-CG 3.94Å; Y134-H150 AromaticContact CE1-CD2 3.75Å; Y134-H150 AromaticContact CE1-CE1 3.97Å; Y134-H150 AromaticContact CE1-NE2 3.58Å; L138-H150 VanDerWaalsContact CD1-CD2 3.5Å; L138-H150 WeakPolarHBondContact CD1-CD2 3.17Å; D146-H150 PolarHBondContact O-CD2 2.89Å; D146-H150 PolarHBondContact O-N 3.41Å; S147-H150 PolarHBondContact O-N 3.17Å; H150-R153 PolarHBondContact O-N 3.22Å; H150-A154 PolarHBondContact O-N 3.45Å
151	F	96	Very high	92.3	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.7	-44.4	176.7	-175.6	-106.5	0	0	0	112.1	E132 S147 K148 R153 A154 L155 M172 Y176 Y192	E132-F151 HydrophobicContact CG-CD2 4.36Å; E132-F151 HydrophobicContact CG-CE2 4.22Å; S147-F151 WeakPolarHBondContact O-CB 3.19Å; S147-F151 PolarHBondContact O-N 3.07Å; K148-F151 PolarHBondContact O-N 3.08Å; F151-R153 VanDerWaalsContact C-N 3.27Å; F151-R153 PolarHBondContact O-N 3.25Å; F151-A154 WeakPolarHBondContact O-CB 3.48Å; F151-A154 PolarHBondContact O-N 3.4Å; F151-A154 VanDerWaalsContact O-N 3.15Å; F151-L155 HydrophobicContact CE1-CD2 4.29Å; F151-L155 WeakPolarHBondContact O-CB 3.24Å; F151-L155 PolarHBondContact O-N 2.61Å; F151-M172 HydrophobicContact CD2-CE 4.08Å; F151-M172 HydrophobicContact CE2-CE 3.56Å; F151-M172 HydrophobicContact CE2-CG 3.85Å; F151-M172 HydrophobicContact CZ-CE 4.13Å; F151-M172 HydrophobicContact CZ-CG 4.06Å; F151-Y176 HydrophobicContact CB-CD1 4.4Å; F151-Y176 HydrophobicContact CB-CD2 4.02Å; F151-Y176 HydrophobicContact CB-CE1 4.06Å; F151-Y176 HydrophobicContact CB-CE2 3.65Å; F151-Y176 HydrophobicContact CB-CG 4.38Å; F151-Y176 AromaticContact CD1-CD1 3.28Å; F151-Y176 HydrophobicContact CD1-CD1 3.28Å; F151-Y176 HydrophobicContact CD1-CD2 4.04Å; F151-Y176 AromaticContact CD1-CE1 3.58Å; F151-Y176 HydrophobicContact CD1-CE1 3.58Å; F151-Y176 HydrophobicContact CD1-CE2 4.29Å; F151-Y176 AromaticContact CD1-CG 3.53Å; F151-Y176 HydrophobicContact CD1-CG 3.53Å; F151-Y176 HydrophobicContact CD2-CD1 4.19Å; F151-Y176 AromaticContact CD2-CD2 3.41Å; F151-Y176 HydrophobicContact CD2-CD2 3.41Å; F151-Y176 VanDerWaalsContact CD2-CD2 3.41Å; F151-Y176 AromaticContact CD2-CE2 3.96Å; F151-Y176 HydrophobicContact CD2-CE2 3.96Å; F151-Y176 AromaticContact CD2-CG 3.55Å; F151-Y176 HydrophobicContact CD2-CG 3.55Å; F151-Y176 AromaticContact CE1-CD1 3.48Å; F151-Y176 HydrophobicContact CE1-CD1 3.48Å; F151-Y176 VanDerWaalsContact CE1-CD1 3.48Å; F151-Y176 HydrophobicContact CE1-CD2 4.42Å; F151-Y176 HydrophobicContact CE1-CE1 4.23Å; F151-Y176 AromaticContact CE1-CG 3.59Å; F151-Y176 HydrophobicContact CE1-CG 3.59Å; F151-Y176 HydrophobicContact CE2-CD1 4.34Å; F151-Y176 AromaticContact CE2-CD2 3.87Å; F151-Y176 HydrophobicContact CE2-CD2 3.87Å; F151-Y176 AromaticContact CE2-CG 3.61Å; F151-Y176 HydrophobicContact CE2-CG 3.61Å; F151-Y176 AromaticContact CG-CD1 3.67Å; F151-Y176 HydrophobicContact CG-CD1 3.67Å; F151-Y176 AromaticContact CG-CD2 3.52Å; F151-Y176 HydrophobicContact CG-CD2 3.52Å; F151-Y176 AromaticContact CG-CE1 3.82Å; F151-Y176 HydrophobicContact CG-CE1 3.82Å; F151-Y176 AromaticContact CG-CE2 3.68Å; F151-Y176 HydrophobicContact CG-CE2 3.68Å; F151-Y176 AromaticContact CG-CG 3.51Å; F151-Y176 HydrophobicContact CG-CG 3.51Å; F151-Y176 AromaticContact CG-CZ 3.83Å; F151-Y176 HydrophobicContact CZ-CD1 4.03Å; F151-Y176 HydrophobicContact CZ-CD2 4.35Å; F151-Y176 AromaticContact CZ-CG 3.64Å; F151-Y176 HydrophobicContact CZ-CG 3.64Å; F151-Y192 HydrophobicContact CD1-CE1 4.03Å; F151-Y192 AromaticContact CD1-CZ 3.89Å; F151-Y192 HydrophobicContact CE1-CD1 4.29Å; F151-Y192 AromaticContact CE1-CE1 3.79Å; F151-Y192 HydrophobicContact CE1-CE1 3.79Å
152	N	96.5	Very high	91.6	Very high	52 Å²	52	63.1 Å²	63.1	28%	0.278	29%	0.285	S	S	.	.	H	α-helix	trans	-61.9	-37.2	176.4	-75.8	-21.8	0	0	0	111.7	K148 L155 E156 Y192	K148-N152 WeakPolarHBondContact O-CB 3.41Å; K148-N152 VanDerWaalsContact O-CG 3.3Å; K148-N152 PolarHBondContact O-N 3.04Å; K148-N152 PolarHBondContact O-ND2 3.35Å; N152-L155 WeakPolarHBondContact O-CB 3.46Å; N152-L155 PolarHBondContact O-N 3.1Å; N152-E156 WeakPolarHBondContact O-CG 3.44Å; N152-E156 PolarHBondContact O-N 3.42Å; N152-Y192 PolarHBondContact OD1-OH 3.32Å
153	R	93.1	Very high	91.2	Very high	100 Å²	100	60.4 Å²	60.4	38%	0.377	28%	0.281	S	S	.	.	H	α-helix	trans	-65.9	-40.4	174.3	-175	57.4	-179.6	158.7	5.5	112.4	L131 K149 H150 F151 L155 E156 L157	L131-R153 HydrophobicContact CD1-CB 4.01Å; L131-R153 HydrophobicContact CD1-CG 3.59Å; K149-R153 PolarHBondContact O-N 3.11Å; H150-R153 PolarHBondContact O-N 3.22Å; F151-R153 VanDerWaalsContact C-N 3.27Å; F151-R153 PolarHBondContact O-N 3.25Å; R153-L155 VanDerWaalsContact C-N 3.28Å; R153-L155 PolarHBondContact O-N 2.96Å; R153-E156 VanDerWaalsContact CD-OE2 3.26Å; R153-E156 WeakPolarHBondContact CD-OE2 3.19Å; R153-E156 IonicContact CZ-OE2 3.98Å; R153-E156 IonicContact NE-OE2 3.11Å; R153-E156 IonicContact NH1-OE2 3.07Å; R153-E156 PolarHBondContact NH1-OE2 3.19Å; R153-E156 PolarHBondContact O-N 3.49Å; R153-L157 WeakPolarHBondContact O-CG 3.33Å; R153-L157 PolarHBondContact O-N 3.02Å
154	A	89.1	Confident	90.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-41.6	173.1	0	0	0	0	0	111.1	G128 L131 E132 H150 F151 L157 A158 M172	G128-A154 WeakPolarHBondContact O-CB 3.23Å; L131-A154 HydrophobicContact CB-CB 3.71Å; E132-A154 HydrophobicContact CB-CB 4.27Å; H150-A154 PolarHBondContact O-N 3.45Å; F151-A154 WeakPolarHBondContact O-CB 3.48Å; F151-A154 PolarHBondContact O-N 3.4Å; F151-A154 VanDerWaalsContact O-N 3.15Å; A154-L157 PolarHBondContact O-N 2.97Å; A154-A158 WeakPolarHBondContact O-CB 3.43Å; A154-A158 PolarHBondContact O-N 3.07Å; A154-M172 HydrophobicContact CB-CE 3.38Å
155	L	93.8	Very high	90.5	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-67.7	-37.7	-179.8	-171.6	61.8	0	0	0	112.7	F151 N152 R153 A158 R159 V169 M172 M173 Y192	F151-L155 HydrophobicContact CE1-CD2 4.29Å; F151-L155 WeakPolarHBondContact O-CB 3.24Å; F151-L155 PolarHBondContact O-N 2.61Å; N152-L155 WeakPolarHBondContact O-CB 3.46Å; N152-L155 PolarHBondContact O-N 3.1Å; R153-L155 VanDerWaalsContact C-N 3.28Å; R153-L155 PolarHBondContact O-N 2.96Å; L155-A158 PolarHBondContact O-N 2.84Å; L155-R159 VanDerWaalsContact CD2-NH2 3.3Å; L155-R159 WeakPolarHBondContact O-CB 3.47Å; L155-R159 WeakPolarHBondContact O-CD 3.37Å; L155-R159 WeakPolarHBondContact O-CG 3.43Å; L155-R159 PolarHBondContact O-N 3.49Å; L155-V169 HydrophobicContact CD1-CG1 3.74Å; L155-M172 HydrophobicContact CB-CE 4.41Å; L155-M172 HydrophobicContact CD1-SD 4.38Å; L155-M173 HydrophobicContact CD1-CG 3.47Å; L155-M173 VanDerWaalsContact CD1-CG 3.47Å; L155-M173 HydrophobicContact CD1-SD 3.89Å; L155-M173 HydrophobicContact CD2-CG 3.77Å; L155-M173 HydrophobicContact CD2-SD 3.96Å; L155-M173 HydrophobicContact CG-CG 4.28Å; L155-Y192 HydrophobicContact CD2-CE1 4.45Å
156	E	91.1	Very high	90.2	Very high	87 Å²	87	54.9 Å²	54.9	41%	0.407	27%	0.269	S	S	.	.	H	α-helix	trans	-58.2	-50.9	171.1	-74.9	165.9	-167	0	0	111.1	N152 R153 A158 R159 D160	N152-E156 WeakPolarHBondContact O-CG 3.44Å; N152-E156 PolarHBondContact O-N 3.42Å; R153-E156 VanDerWaalsContact CD-OE2 3.26Å; R153-E156 WeakPolarHBondContact CD-OE2 3.19Å; R153-E156 IonicContact CZ-OE2 3.98Å; R153-E156 IonicContact NE-OE2 3.11Å; R153-E156 IonicContact NH1-OE2 3.07Å; R153-E156 PolarHBondContact NH1-OE2 3.19Å; R153-E156 PolarHBondContact O-N 3.49Å; E156-A158 VanDerWaalsContact C-N 3.35Å; E156-A158 PolarHBondContact O-N 3.13Å; E156-R159 WeakPolarHBondContact O-CB 3.5Å; E156-R159 PolarHBondContact O-N 2.55Å; E156-D160 PolarHBondContact O-N 2.86Å
157	L	85.8	Confident	90.2	Very high	8 Å²	8	53.2 Å²	53.2	4%	0.042	26%	0.263	C	S	.	.	H	α-helix	trans	-60.1	-45.2	178.5	-65.7	168.2	0	0	0	111.6	Y124 Y127 L131 R153 A154 R159 D160 I161	Y124-L157 HydrophobicContact CD1-CD2 3.83Å; Y124-L157 HydrophobicContact CG-CD2 4.35Å; Y127-L157 HydrophobicContact CD1-CD1 3.42Å; Y127-L157 VanDerWaalsContact CD1-CD1 3.42Å; Y127-L157 HydrophobicContact CE1-CD1 3.87Å; Y127-L157 HydrophobicContact CG-CD1 4.26Å; L131-L157 HydrophobicContact CD1-CD1 3.93Å; R153-L157 WeakPolarHBondContact O-CG 3.33Å; R153-L157 PolarHBondContact O-N 3.02Å; A154-L157 PolarHBondContact O-N 2.97Å; L157-R159 VanDerWaalsContact C-N 3.31Å; L157-R159 PolarHBondContact O-N 3.42Å; L157-D160 PolarHBondContact O-N 2.89Å; L157-I161 VanDerWaalsContact O-CG1 3.31Å; L157-I161 WeakPolarHBondContact O-CG1 3.48Å; L157-I161 PolarHBondContact O-N 3.02Å; L157-I161 VanDerWaalsContact O-N 3.08Å
158	A	87.2	Confident	89.8	Confident	7 Å²	7	57.2 Å²	57.2	6%	0.058	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-35.5	178.7	0	0	0	0	0	112.4	A154 L155 E156 Y162 V169 M172	A154-A158 WeakPolarHBondContact O-CB 3.43Å; A154-A158 PolarHBondContact O-N 3.07Å; L155-A158 PolarHBondContact O-N 2.84Å; E156-A158 VanDerWaalsContact C-N 3.35Å; E156-A158 PolarHBondContact O-N 3.13Å; A158-Y162 HydrophobicContact CB-CD2 4.47Å; A158-Y162 WeakPolarHBondContact O-CB 3.2Å; A158-Y162 WeakPolarHBondContact O-CD2 3.38Å; A158-Y162 PolarHBondContact O-N 2.91Å; A158-V169 HydrophobicContact CB-CG2 3.82Å; A158-V169 WeakPolarHBondContact O-CG2 3.47Å; A158-M172 HydrophobicContact CB-SD 4.07Å
159	R	88.8	Confident	89.5	Confident	64 Å²	64	53.9 Å²	53.9	24%	0.242	27%	0.267	C	S	.	.	H	α-helix	trans	-66.6	-40.5	175.2	-74.7	165.7	-180	-177.2	0.4	111.9	L155 E156 L157 I161 S163 P164 V169 E195 R199	L155-R159 VanDerWaalsContact CD2-NH2 3.3Å; L155-R159 WeakPolarHBondContact O-CB 3.47Å; L155-R159 WeakPolarHBondContact O-CD 3.37Å; L155-R159 WeakPolarHBondContact O-CG 3.43Å; L155-R159 PolarHBondContact O-N 3.49Å; E156-R159 WeakPolarHBondContact O-CB 3.5Å; E156-R159 PolarHBondContact O-N 2.55Å; L157-R159 VanDerWaalsContact C-N 3.31Å; L157-R159 PolarHBondContact O-N 3.42Å; R159-I161 VanDerWaalsContact C-N 3.32Å; R159-S163 VanDerWaalsContact O-CA 3.24Å; R159-S163 WeakPolarHBondContact O-CA 3.48Å; R159-S163 PolarHBondContact O-N 3.1Å; R159-P164 HydrophobicContact CB-CG 4.21Å; R159-P164 HydrophobicContact CG-CB 4.32Å; R159-P164 HydrophobicContact CG-CG 4.19Å; R159-V169 HydrophobicContact CG-CG1 3.97Å; R159-V169 HydrophobicContact CG-CG2 4.42Å; R159-E195 IonicContact NH2-OE1 3.09Å; R159-E195 PolarHBondContact NH2-OE1 2.88Å; R159-E195 VanDerWaalsContact NH2-OE1 3.07Å; R159-E195 IonicContact NH2-OE2 2.68Å; R159-R199 VanDerWaalsContact CZ-NH2 3.35Å
160	D	83.1	Confident	89.5	Confident	133 Å²	133	46.9 Å²	46.9	71%	0.711	24%	0.236	S	C	*	.	H	α-helix	trans	-67.7	-33.8	179.1	-69.9	-16.4	0	0	0	112	E156 L157	E156-D160 PolarHBondContact O-N 2.86Å; L157-D160 PolarHBondContact O-N 2.89Å
161	I	82.3	Confident	89.9	Confident	47 Å²	47	47.1 Å²	47.1	24%	0.241	24%	0.239	C	C	.	.	H	α-helix	trans	-83.5	-49.9	-179.7	-62.6	166.7	0	0	0	111.8	A125 L157 R159	A125-I161 HydrophobicContact CB-CD1 4.06Å; L157-I161 VanDerWaalsContact O-CG1 3.31Å; L157-I161 WeakPolarHBondContact O-CG1 3.48Å; L157-I161 PolarHBondContact O-N 3.02Å; L157-I161 VanDerWaalsContact O-N 3.08Å; R159-I161 VanDerWaalsContact C-N 3.32Å
162	Y	82.7	Confident	89.7	Confident	109 Å²	109	47.5 Å²	47.5	43%	0.427	24%	0.241	S	C	.	.	H	α-helix	trans	-106.2	-4.9	-167.8	-58.9	-67	0	0	0	115	A158 S166 H168	A158-Y162 HydrophobicContact CB-CD2 4.47Å; A158-Y162 WeakPolarHBondContact O-CB 3.2Å; A158-Y162 WeakPolarHBondContact O-CD2 3.38Å; A158-Y162 PolarHBondContact O-N 2.91Å; Y162-S166 VanDerWaalsContact CB-OG 3.29Å; Y162-S166 WeakPolarHBondContact CB-OG 3.43Å; Y162-S166 WeakPolarHBondContact O-CB 3.14Å; Y162-S166 PolarHBondContact O-OG 3.01Å; Y162-H168 HydrophobicContact CD2-CB 4.48Å; Y162-H168 AromaticContact CD2-CD2 3.48Å; Y162-H168 VanDerWaalsContact CD2-CD2 3.48Å; Y162-H168 WeakPolarHBondContact CD2-CD2 3.42Å; Y162-H168 AromaticContact CE2-CD2 3.55Å; Y162-H168 AromaticContact CE2-NE2 3.88Å
163	S	86.3	Confident	89.8	Confident	62 Å²	62	45 Å²	45	43%	0.434	23%	0.228	S	C	.	.			trans	77	143	-164.8	176.7	0	0	0	0	114.4	R159 L165 S166	R159-S163 VanDerWaalsContact O-CA 3.24Å; R159-S163 WeakPolarHBondContact O-CA 3.48Å; R159-S163 PolarHBondContact O-N 3.1Å; S163-L165 PolarHBondContact O-N 3.21Å; S163-L165 VanDerWaalsContact O-N 3.13Å; S163-S166 WeakPolarHBondContact O-CB 3.44Å; S163-S166 PolarHBondContact O-N 2.81Å; S163-S166 VanDerWaalsContact O-N 3.1Å; S163-S166 PolarHBondContact O-OG 3.38Å
164	P	87.4	Confident	90	Very high	54 Å²	54	40.7 Å²	40.7	35%	0.351	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-23.5	175.8	-27.9	35.3	0	0	0	116.9	R159 R199	R159-P164 HydrophobicContact CB-CG 4.21Å; R159-P164 HydrophobicContact CG-CB 4.32Å; R159-P164 HydrophobicContact CG-CG 4.19Å; P164-R199 PolarHBondContact O-NH1 3.32Å
165	L	91.1	Very high	90.4	Very high	82 Å²	82	44.3 Å²	44.3	43%	0.429	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	3.1	-179.8	-68.3	177.4	0	0	0	113.5	S163 R199 H202 C203	S163-L165 PolarHBondContact O-N 3.21Å; S163-L165 VanDerWaalsContact O-N 3.13Å; L165-R199 HydrophobicContact CD2-CB 4.17Å; L165-R199 HydrophobicContact CD2-CG 4.3Å; L165-H202 HydrophobicContact CD2-CB 4.3Å; L165-C203 PolarHBondContact O-SG 3.49Å
166	S	89.9	Confident	90.5	Very high	22 Å²	22	44.3 Å²	44.3	15%	0.154	23%	0.231	C	C	.	.	S	Bend	trans	-66	147.3	177.1	59.1	0	0	0	0	112.5	Y162 S163 H168 V169 I170	Y162-S166 VanDerWaalsContact CB-OG 3.29Å; Y162-S166 WeakPolarHBondContact CB-OG 3.43Å; Y162-S166 WeakPolarHBondContact O-CB 3.14Å; Y162-S166 PolarHBondContact O-OG 3.01Å; S163-S166 WeakPolarHBondContact O-CB 3.44Å; S163-S166 PolarHBondContact O-N 2.81Å; S163-S166 VanDerWaalsContact O-N 3.1Å; S163-S166 PolarHBondContact O-OG 3.38Å; S166-H168 PolarHBondContact O-N 3.45Å; S166-V169 PolarHBondContact O-N 3.04Å; S166-V169 WeakPolarHBondContact OG-CB 3.37Å; S166-V169 VanDerWaalsContact OG-CG2 3.23Å; S166-V169 WeakPolarHBondContact OG-CG2 3.47Å; S166-V169 PolarHBondContact OG-N 3.24Å; S166-I170 WeakPolarHBondContact O-CG1 3.31Å; S166-I170 PolarHBondContact O-N 3.15Å
167	A	91.2	Very high	90.9	Very high	23 Å²	23	40.2 Å²	40.2	19%	0.19	21%	0.212	C	C	.	.	H	α-helix	trans	-53.8	-40.7	174.4	0	0	0	0	0	112	I170 I171 D205 L206	A167-I170 PolarHBondContact O-N 3.46Å; A167-I171 WeakPolarHBondContact O-CB 3.25Å; A167-I171 WeakPolarHBondContact O-CD1 3.23Å; A167-I171 VanDerWaalsContact O-CG1 3.22Å; A167-I171 WeakPolarHBondContact O-CG1 3.47Å; A167-I171 PolarHBondContact O-N 3.23Å; A167-D205 HydrophobicContact CB-CB 4.18Å; A167-L206 HydrophobicContact CB-CD1 4.36Å; A167-L206 HydrophobicContact CB-CD2 3.79Å; A167-L206 HydrophobicContact CB-CG 3.94Å
168	H	88.5	Confident	91.4	Very high	85 Å²	85	42.1 Å²	42.1	39%	0.394	22%	0.221	S	C	.	.	H	α-helix	trans	-58.7	-52.8	179	-178.5	76	0	0	0	112.5	Y162 S166 I170 I171 M172	Y162-H168 HydrophobicContact CD2-CB 4.48Å; Y162-H168 AromaticContact CD2-CD2 3.48Å; Y162-H168 VanDerWaalsContact CD2-CD2 3.48Å; Y162-H168 WeakPolarHBondContact CD2-CD2 3.42Å; Y162-H168 AromaticContact CE2-CD2 3.55Å; Y162-H168 AromaticContact CE2-NE2 3.88Å; S166-H168 PolarHBondContact O-N 3.45Å; H168-I170 VanDerWaalsContact C-N 3.32Å; H168-I170 PolarHBondContact O-N 2.81Å; H168-I171 PolarHBondContact O-N 2.89Å; H168-M172 VanDerWaalsContact O-CB 3.27Å; H168-M172 WeakPolarHBondContact O-CB 3.26Å; H168-M172 PolarHBondContact O-N 3.24Å
169	V	92.6	Very high	91.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-41.5	-179.3	168.3	0	0	0	0	111.4	L155 A158 R159 S166 M173	L155-V169 HydrophobicContact CD1-CG1 3.74Å; A158-V169 HydrophobicContact CB-CG2 3.82Å; A158-V169 WeakPolarHBondContact O-CG2 3.47Å; R159-V169 HydrophobicContact CG-CG1 3.97Å; R159-V169 HydrophobicContact CG-CG2 4.42Å; S166-V169 PolarHBondContact O-N 3.04Å; S166-V169 WeakPolarHBondContact OG-CB 3.37Å; S166-V169 VanDerWaalsContact OG-CG2 3.23Å; S166-V169 WeakPolarHBondContact OG-CG2 3.47Å; S166-V169 PolarHBondContact OG-N 3.24Å; V169-M173 HydrophobicContact CG1-SD 4.27Å; V169-M173 WeakPolarHBondContact O-CG 3.44Å; V169-M173 PolarHBondContact O-N 3.43Å; V169-M173 VanDerWaalsContact O-N 3.08Å
170	I	96	Very high	92.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-70.3	-44.2	-178.2	-63.5	164.8	0	0	0	111.2	S166 A167 H168 M172 M173 N174 V196 R199 A200 C203 L206 F213	S166-I170 WeakPolarHBondContact O-CG1 3.31Å; S166-I170 PolarHBondContact O-N 3.15Å; A167-I170 PolarHBondContact O-N 3.46Å; H168-I170 VanDerWaalsContact C-N 3.32Å; H168-I170 PolarHBondContact O-N 2.81Å; I170-M172 VanDerWaalsContact C-N 3.33Å; I170-M172 PolarHBondContact O-N 2.97Å; I170-M173 PolarHBondContact O-N 3.37Å; I170-N174 PolarHBondContact O-N 3.21Å; I170-V196 HydrophobicContact CG2-CG1 4.01Å; I170-R199 HydrophobicContact CD1-CB 3.77Å; I170-R199 HydrophobicContact CG1-CB 3.83Å; I170-A200 HydrophobicContact CG2-CB 4.09Å; I170-C203 HydrophobicContact CD1-CB 3.81Å; I170-L206 HydrophobicContact CB-CD1 3.62Å; I170-L206 HydrophobicContact CD1-CD1 3.62Å; I170-L206 HydrophobicContact CG1-CD1 4.22Å; I170-L206 HydrophobicContact CG2-CD1 3.49Å; I170-L206 VanDerWaalsContact CG2-CD1 3.49Å; I170-F213 HydrophobicContact CG2-CE2 4.28Å; I170-F213 HydrophobicContact CG2-CZ 4.41Å
171	I	94.7	Very high	92.9	Very high	53 Å²	53	34.8 Å²	34.8	27%	0.272	19%	0.186	S	C	.	.	H	α-helix	trans	-62.8	-42.6	176.6	-70.8	167.1	0	0	0	110.5	A167 H168 M173 N174 N175 L206 F213	A167-I171 WeakPolarHBondContact O-CB 3.25Å; A167-I171 WeakPolarHBondContact O-CD1 3.23Å; A167-I171 VanDerWaalsContact O-CG1 3.22Å; A167-I171 WeakPolarHBondContact O-CG1 3.47Å; A167-I171 PolarHBondContact O-N 3.23Å; H168-I171 PolarHBondContact O-N 2.89Å; I171-M173 PolarHBondContact O-N 3.25Å; I171-N174 PolarHBondContact O-N 3.02Å; I171-N175 WeakPolarHBondContact O-CB 3.09Å; I171-N175 VanDerWaalsContact O-CG 3.22Å; I171-N175 PolarHBondContact O-N 3.29Å; I171-N175 PolarHBondContact O-ND2 3.5Å; I171-L206 HydrophobicContact CD1-CD2 3.81Å; I171-L206 HydrophobicContact CG1-CD2 3.95Å; I171-F213 HydrophobicContact CG1-CZ 4.39Å
172	M	93.4	Very high	93.6	Very high	8 Å²	8	39.3 Å²	39.3	4%	0.039	20%	0.204	C	C	.	.	H	α-helix	trans	-57.6	-46.7	176.2	-179.7	-171.7	167.1	0	0	111.5	E132 F151 A154 L155 A158 H168 I170 N175 Y176	E132-M172 HydrophobicContact CB-CE 4.1Å; E132-M172 HydrophobicContact CG-CE 4.04Å; E132-M172 HydrophobicContact CG-CG 4.36Å; F151-M172 HydrophobicContact CD2-CE 4.08Å; F151-M172 HydrophobicContact CE2-CE 3.56Å; F151-M172 HydrophobicContact CE2-CG 3.85Å; F151-M172 HydrophobicContact CZ-CE 4.13Å; F151-M172 HydrophobicContact CZ-CG 4.06Å; A154-M172 HydrophobicContact CB-CE 3.38Å; L155-M172 HydrophobicContact CB-CE 4.41Å; L155-M172 HydrophobicContact CD1-SD 4.38Å; A158-M172 HydrophobicContact CB-SD 4.07Å; H168-M172 VanDerWaalsContact O-CB 3.27Å; H168-M172 WeakPolarHBondContact O-CB 3.26Å; H168-M172 PolarHBondContact O-N 3.24Å; I170-M172 VanDerWaalsContact C-N 3.33Å; I170-M172 PolarHBondContact O-N 2.97Å; M172-N175 PolarHBondContact O-N 2.94Å; M172-Y176 PolarHBondContact O-N 2.94Å; M172-Y176 VanDerWaalsContact O-N 3.13Å
173	M	97.8	Very high	94.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.7	-45.9	174.3	-71.3	172.2	62.5	0	0	112.6	L155 V169 I170 I171 N175 Y176 A177 Y192 E195 V196	L155-M173 HydrophobicContact CD1-CG 3.47Å; L155-M173 VanDerWaalsContact CD1-CG 3.47Å; L155-M173 HydrophobicContact CD1-SD 3.89Å; L155-M173 HydrophobicContact CD2-CG 3.77Å; L155-M173 HydrophobicContact CD2-SD 3.96Å; L155-M173 HydrophobicContact CG-CG 4.28Å; V169-M173 HydrophobicContact CG1-SD 4.27Å; V169-M173 WeakPolarHBondContact O-CG 3.44Å; V169-M173 PolarHBondContact O-N 3.43Å; V169-M173 VanDerWaalsContact O-N 3.08Å; I170-M173 PolarHBondContact O-N 3.37Å; I171-M173 PolarHBondContact O-N 3.25Å; M173-N175 PolarHBondContact O-N 3.37Å; M173-Y176 PolarHBondContact O-N 3.47Å; M173-A177 WeakPolarHBondContact O-CB 3.36Å; M173-A177 PolarHBondContact O-N 2.93Å; M173-Y192 HydrophobicContact CE-CD1 4.21Å; M173-E195 HydrophobicContact CE-CB 3.64Å; M173-E195 HydrophobicContact CE-CG 3.6Å; M173-E195 VanDerWaalsContact CE-OE2 3.29Å; M173-E195 WeakPolarHBondContact CE-OE2 3.43Å; M173-V196 HydrophobicContact CB-CG2 3.61Å; M173-V196 HydrophobicContact CE-CG2 4.44Å
174	N	97.8	Very high	94.7	Very high	9 Å²	9	34.6 Å²	34.6	5%	0.048	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-43.4	179	178.5	75.3	0	0	0	111.9	I170 I171 Y176 A177 I178 H193 V196 F213 N216	I170-N174 PolarHBondContact O-N 3.21Å; I171-N174 PolarHBondContact O-N 3.02Å; N174-Y176 VanDerWaalsContact C-N 3.35Å; N174-Y176 PolarHBondContact O-N 3.03Å; N174-A177 PolarHBondContact O-N 3.37Å; N174-I178 WeakPolarHBondContact ND2-CD1 3.33Å; N174-I178 VanDerWaalsContact O-CG1 3.32Å; N174-I178 WeakPolarHBondContact O-CG1 3.4Å; N174-I178 PolarHBondContact O-N 3.27Å; N174-H193 PolarHBondContact OD1-CE1 2.98Å; N174-V196 HydrophobicContact CB-CG1 4.05Å; N174-V196 HydrophobicContact CB-CG2 3.98Å; N174-F213 HydrophobicContact CB-CD1 4.15Å; N174-F213 HydrophobicContact CB-CE1 3.88Å; N174-F213 WeakPolarHBondContact OD1-CD1 3.24Å; N174-N216 PolarHBondContact OD1-ND2 3Å; N174-N216 VanDerWaalsContact OD1-ND2 3.11Å
175	N	95.9	Very high	95.1	Very high	76 Å²	76	35.1 Å²	35.1	41%	0.406	18%	0.184	S	C	.	.	H	α-helix	trans	-63.2	-41.4	179.1	-70.8	-14.1	0	0	0	112.1	I171 M172 M173 I178 E179	I171-N175 WeakPolarHBondContact O-CB 3.09Å; I171-N175 VanDerWaalsContact O-CG 3.22Å; I171-N175 PolarHBondContact O-N 3.29Å; I171-N175 PolarHBondContact O-ND2 3.5Å; M172-N175 PolarHBondContact O-N 2.94Å; M173-N175 PolarHBondContact O-N 3.37Å; N175-I178 PolarHBondContact O-N 3.32Å; N175-E179 PolarHBondContact O-N 2.96Å; N175-E179 VanDerWaalsContact O-N 3.09Å
176	Y	97.6	Very high	95.5	Very high	2 Å²	2	35 Å²	35	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-67.7	-39.4	175.4	-174.1	-101.6	0	0	0	112.2	M139 S147 K148 F151 M172 M173 N174 I178 E179 C180 Y192	M139-Y176 HydrophobicContact CE-CE2 4.41Å; M139-Y176 VanDerWaalsContact CE-OH 3.28Å; M139-Y176 WeakPolarHBondContact CE-OH 3.41Å; S147-Y176 WeakPolarHBondContact OG-CE2 3.45Å; S147-Y176 PolarHBondContact OG-OH 3Å; K148-Y176 WeakPolarHBondContact CA-OH 3.1Å; K148-Y176 PolarHBondContact N-OH 3.16Å; F151-Y176 HydrophobicContact CB-CD1 4.4Å; F151-Y176 HydrophobicContact CB-CD2 4.02Å; F151-Y176 HydrophobicContact CB-CE1 4.06Å; F151-Y176 HydrophobicContact CB-CE2 3.65Å; F151-Y176 HydrophobicContact CB-CG 4.38Å; F151-Y176 AromaticContact CD1-CD1 3.28Å; F151-Y176 HydrophobicContact CD1-CD1 3.28Å; F151-Y176 HydrophobicContact CD1-CD2 4.04Å; F151-Y176 AromaticContact CD1-CE1 3.58Å; F151-Y176 HydrophobicContact CD1-CE1 3.58Å; F151-Y176 HydrophobicContact CD1-CE2 4.29Å; F151-Y176 AromaticContact CD1-CG 3.53Å; F151-Y176 HydrophobicContact CD1-CG 3.53Å; F151-Y176 HydrophobicContact CD2-CD1 4.19Å; F151-Y176 AromaticContact CD2-CD2 3.41Å; F151-Y176 HydrophobicContact CD2-CD2 3.41Å; F151-Y176 VanDerWaalsContact CD2-CD2 3.41Å; F151-Y176 AromaticContact CD2-CE2 3.96Å; F151-Y176 HydrophobicContact CD2-CE2 3.96Å; F151-Y176 AromaticContact CD2-CG 3.55Å; F151-Y176 HydrophobicContact CD2-CG 3.55Å; F151-Y176 AromaticContact CE1-CD1 3.48Å; F151-Y176 HydrophobicContact CE1-CD1 3.48Å; F151-Y176 VanDerWaalsContact CE1-CD1 3.48Å; F151-Y176 HydrophobicContact CE1-CD2 4.42Å; F151-Y176 HydrophobicContact CE1-CE1 4.23Å; F151-Y176 AromaticContact CE1-CG 3.59Å; F151-Y176 HydrophobicContact CE1-CG 3.59Å; F151-Y176 HydrophobicContact CE2-CD1 4.34Å; F151-Y176 AromaticContact CE2-CD2 3.87Å; F151-Y176 HydrophobicContact CE2-CD2 3.87Å; F151-Y176 AromaticContact CE2-CG 3.61Å; F151-Y176 HydrophobicContact CE2-CG 3.61Å; F151-Y176 AromaticContact CG-CD1 3.67Å; F151-Y176 HydrophobicContact CG-CD1 3.67Å; F151-Y176 AromaticContact CG-CD2 3.52Å; F151-Y176 HydrophobicContact CG-CD2 3.52Å; F151-Y176 AromaticContact CG-CE1 3.82Å; F151-Y176 HydrophobicContact CG-CE1 3.82Å; F151-Y176 AromaticContact CG-CE2 3.68Å; F151-Y176 HydrophobicContact CG-CE2 3.68Å; F151-Y176 AromaticContact CG-CG 3.51Å; F151-Y176 HydrophobicContact CG-CG 3.51Å; F151-Y176 AromaticContact CG-CZ 3.83Å; F151-Y176 HydrophobicContact CZ-CD1 4.03Å; F151-Y176 HydrophobicContact CZ-CD2 4.35Å; F151-Y176 AromaticContact CZ-CG 3.64Å; F151-Y176 HydrophobicContact CZ-CG 3.64Å; M172-Y176 PolarHBondContact O-N 2.94Å; M172-Y176 VanDerWaalsContact O-N 3.13Å; M173-Y176 PolarHBondContact O-N 3.47Å; N174-Y176 VanDerWaalsContact C-N 3.35Å; N174-Y176 PolarHBondContact O-N 3.03Å; Y176-I178 VanDerWaalsContact C-N 3.35Å; Y176-I178 PolarHBondContact O-N 3.01Å; Y176-E179 WeakPolarHBondContact O-CB 3.45Å; Y176-E179 PolarHBondContact O-N 3.45Å; Y176-E179 VanDerWaalsContact O-N 3.11Å; Y176-C180 VanDerWaalsContact CE1-SG 3.56Å; Y176-C180 PolarHBondContact O-N 2.68Å; Y176-C180 PolarHBondContact O-SG 3.45Å; Y176-Y192 AromaticContact CD1-CD2 4Å; Y176-Y192 HydrophobicContact CD1-CD2 4Å; Y176-Y192 AromaticContact CD1-CE2 3.71Å; Y176-Y192 HydrophobicContact CD1-CE2 3.71Å; Y176-Y192 HydrophobicContact CE1-CD2 4.24Å; Y176-Y192 AromaticContact CE1-CE2 3.57Å; Y176-Y192 HydrophobicContact CE1-CE2 3.57Å
177	A	98.1	Very high	95.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.5	-42.5	175.4	0	0	0	0	0	111.9	M173 N174 E179 C180 V181 A189 H193	M173-A177 WeakPolarHBondContact O-CB 3.36Å; M173-A177 PolarHBondContact O-N 2.93Å; N174-A177 PolarHBondContact O-N 3.37Å; A177-E179 VanDerWaalsContact C-N 3.3Å; A177-E179 PolarHBondContact O-N 2.92Å; A177-C180 VanDerWaalsContact O-CB 3.31Å; A177-C180 WeakPolarHBondContact O-CB 3.47Å; A177-C180 PolarHBondContact O-N 2.74Å; A177-C180 VanDerWaalsContact O-N 3.16Å; A177-V181 WeakPolarHBondContact O-CG2 3.47Å; A177-V181 PolarHBondContact O-N 3.4Å; A177-A189 WeakPolarHBondContact O-CB 3.49Å; A177-H193 VanDerWaalsContact CB-CD2 3.49Å; A177-H193 WeakPolarHBondContact CB-CD2 3.14Å; A177-H193 VanDerWaalsContact CB-NE2 3.3Å; A177-H193 WeakPolarHBondContact CB-NE2 3.44Å
178	I	97.5	Very high	96.1	Very high	48 Å²	48	39.5 Å²	39.5	25%	0.246	19%	0.194	C	C	.	.	H	α-helix	trans	-59.3	-41.8	172.2	-69.2	165.4	0	0	0	111	N174 N175 Y176 C180 V181 K182	N174-I178 WeakPolarHBondContact ND2-CD1 3.33Å; N174-I178 VanDerWaalsContact O-CG1 3.32Å; N174-I178 WeakPolarHBondContact O-CG1 3.4Å; N174-I178 PolarHBondContact O-N 3.27Å; N175-I178 PolarHBondContact O-N 3.32Å; Y176-I178 VanDerWaalsContact C-N 3.35Å; Y176-I178 PolarHBondContact O-N 3.01Å; I178-C180 VanDerWaalsContact C-N 3.35Å; I178-V181 PolarHBondContact O-N 2.86Å; I178-K182 WeakPolarHBondContact O-CG 3.44Å; I178-K182 PolarHBondContact O-N 2.89Å
179	E	95.7	Very high	96.6	Very high	32 Å²	32	35.4 Å²	35.4	15%	0.15	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-40.1	176.4	-170	56.2	-143.9	0	0	111.7	M139 N175 Y176 A177 V181 K182 Q183	M139-E179 HydrophobicContact CB-CG 4.41Å; M139-E179 HydrophobicContact CG-CG 3.89Å; N175-E179 PolarHBondContact O-N 2.96Å; N175-E179 VanDerWaalsContact O-N 3.09Å; Y176-E179 WeakPolarHBondContact O-CB 3.45Å; Y176-E179 PolarHBondContact O-N 3.45Å; Y176-E179 VanDerWaalsContact O-N 3.11Å; A177-E179 VanDerWaalsContact C-N 3.3Å; A177-E179 PolarHBondContact O-N 2.92Å; E179-V181 VanDerWaalsContact C-N 3.35Å; E179-V181 PolarHBondContact O-N 3.25Å; E179-K182 PolarHBondContact O-N 3.17Å; E179-K182 IonicContact OE2-NZ 2.7Å; E179-Q183 WeakPolarHBondContact O-CG 3.32Å; E179-Q183 PolarHBondContact O-N 3.23Å; E179-Q183 VanDerWaalsContact O-N 3.13Å; E179-Q183 PolarHBondContact OE1-NE2 3.3Å
180	C	97.6	Very high	96.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-57.7	-45.8	171.9	-66.2	0	0	0	0	111.6	Y176 A177 I178 K182 Q183 G184 E185 A189	Y176-C180 VanDerWaalsContact CE1-SG 3.56Å; Y176-C180 PolarHBondContact O-N 2.68Å; Y176-C180 PolarHBondContact O-SG 3.45Å; A177-C180 VanDerWaalsContact O-CB 3.31Å; A177-C180 WeakPolarHBondContact O-CB 3.47Å; A177-C180 PolarHBondContact O-N 2.74Å; A177-C180 VanDerWaalsContact O-N 3.16Å; I178-C180 VanDerWaalsContact C-N 3.35Å; C180-K182 PolarHBondContact O-N 2.96Å; C180-Q183 CarbonylContact O-C 3.59Å; C180-Q183 PolarHBondContact O-N 2.57Å; C180-Q183 VanDerWaalsContact O-N 3.11Å; C180-G184 PolarHBondContact O-N 2.88Å; C180-G184 VanDerWaalsContact O-N 3.16Å; C180-E185 HydrophobicContact CB-CB 4.06Å; C180-E185 PolarHBondContact O-N 2.93Å; C180-A189 HydrophobicContact CB-CB 3.76Å
181	V	97.6	Very high	97	Very high	18 Å²	18	41.4 Å²	41.4	11%	0.109	21%	0.212	C	C	.	.	H	α-helix	trans	-58.6	-47.2	176.5	175.8	0	0	0	0	111.1	A177 I178 E179 Q183 G184 Y186 A189 T220	A177-V181 WeakPolarHBondContact O-CG2 3.47Å; A177-V181 PolarHBondContact O-N 3.4Å; I178-V181 PolarHBondContact O-N 2.86Å; E179-V181 VanDerWaalsContact C-N 3.35Å; E179-V181 PolarHBondContact O-N 3.25Å; V181-Q183 PolarHBondContact O-N 3.39Å; V181-Q183 VanDerWaalsContact O-N 3.16Å; V181-G184 PolarHBondContact O-N 3.34Å; V181-Y186 HydrophobicContact CG1-CD1 4.35Å; V181-Y186 HydrophobicContact CG1-CE1 4.18Å; V181-A189 HydrophobicContact CG2-CB 3.55Å; V181-T220 HydrophobicContact CG2-CG2 4.36Å; V181-T220 VanDerWaalsContact CG2-OG1 3.32Å; V181-T220 WeakPolarHBondContact CG2-OG1 3.23Å
182	K	95.9	Very high	97.2	Very high	143 Å²	143	39.6 Å²	39.6	62%	0.622	20%	0.202	S	C	*	.	H	α-helix	trans	-58.1	-30.8	177.4	-70.2	174.4	-171.9	166.3	0	112.9	I178 E179 C180	I178-K182 WeakPolarHBondContact O-CG 3.44Å; I178-K182 PolarHBondContact O-N 2.89Å; E179-K182 PolarHBondContact O-N 3.17Å; E179-K182 IonicContact OE2-NZ 2.7Å; C180-K182 PolarHBondContact O-N 2.96Å
183	Q	95.4	Very high	97.4	Very high	42 Å²	42	39.3 Å²	39.3	20%	0.196	20%	0.2	C	C	.	.	H	α-helix	trans	-87.4	-4.7	178	-62.6	-49.5	-32.7	0	0	114.3	M139 K142 E179 C180 V181 E185	M139-Q183 HydrophobicContact CG-CB 4.39Å; M139-Q183 HydrophobicContact CG-CG 3.62Å; M139-Q183 HydrophobicContact SD-CB 4.01Å; M139-Q183 HydrophobicContact SD-CG 3.86Å; K142-Q183 PolarHBondContact NZ-O 3.33Å; E179-Q183 WeakPolarHBondContact O-CG 3.32Å; E179-Q183 PolarHBondContact O-N 3.23Å; E179-Q183 VanDerWaalsContact O-N 3.13Å; E179-Q183 PolarHBondContact OE1-NE2 3.3Å; C180-Q183 CarbonylContact O-C 3.59Å; C180-Q183 PolarHBondContact O-N 2.57Å; C180-Q183 VanDerWaalsContact O-N 3.11Å; V181-Q183 PolarHBondContact O-N 3.39Å; V181-Q183 VanDerWaalsContact O-N 3.16Å; Q183-E185 HydrophobicContact CB-CG 4.31Å
184	G	96.4	Very high	97.4	Very high	30 Å²	30	41.7 Å²	41.7	31%	0.309	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	8.1	-176.2	0	0	0	0	0	114.5	C180 V181 Y186	C180-G184 PolarHBondContact O-N 2.88Å; C180-G184 VanDerWaalsContact O-N 3.16Å; V181-G184 PolarHBondContact O-N 3.34Å; G184-Y186 WeakPolarHBondContact O-CD2 3.35Å; G184-Y186 PolarHBondContact O-N 2.99Å
185	E	97.5	Very high	97.4	Very high	64 Å²	64	44.1 Å²	44.1	30%	0.299	23%	0.228	S	C	.	.			trans	-84.7	59.6	-180	-60.5	-57.1	148	0	0	110.8	M139 V144 C180 Q183 E187 L188 A189	M139-E185 HydrophobicContact SD-CG 4.12Å; V144-E185 HydrophobicContact CG1-CG 4.08Å; V144-E185 HydrophobicContact CG2-CG 3.94Å; V144-E185 WeakPolarHBondContact CG2-OE1 3.33Å; C180-E185 HydrophobicContact CB-CB 4.06Å; C180-E185 PolarHBondContact O-N 2.93Å; Q183-E185 HydrophobicContact CB-CG 4.31Å; E185-E187 PolarHBondContact O-N 3.48Å; E185-L188 HydrophobicContact CB-CB 4.27Å; E185-L188 PolarHBondContact O-N 3.31Å; E185-A189 PolarHBondContact O-N 3.46Å
186	Y	98.1	Very high	97.6	Very high	79 Å²	79	40.5 Å²	40.5	31%	0.31	21%	0.209	S	C	.	.	H	α-helix	trans	-65.7	-39.9	-169.1	-50.5	-58.5	0	0	0	113.4	V181 G184 L188 A189 R190 H223	V181-Y186 HydrophobicContact CG1-CD1 4.35Å; V181-Y186 HydrophobicContact CG1-CE1 4.18Å; G184-Y186 WeakPolarHBondContact O-CD2 3.35Å; G184-Y186 PolarHBondContact O-N 2.99Å; Y186-L188 VanDerWaalsContact C-N 3.31Å; Y186-L188 PolarHBondContact O-N 3.48Å; Y186-A189 PolarHBondContact O-N 3.45Å; Y186-R190 WeakPolarHBondContact O-CB 3.43Å; Y186-R190 PolarHBondContact O-N 2.95Å; Y186-H223 HydrophobicContact CD1-CB 3.41Å; Y186-H223 VanDerWaalsContact CD1-CB 3.41Å; Y186-H223 AromaticContact CD1-CG 3.91Å; Y186-H223 HydrophobicContact CD2-CB 3.94Å; Y186-H223 HydrophobicContact CE1-CB 3.6Å; Y186-H223 AromaticContact CE1-CG 3.6Å; Y186-H223 AromaticContact CE1-ND1 4Å; Y186-H223 HydrophobicContact CE2-CB 4.11Å; Y186-H223 HydrophobicContact CG-CB 3.58Å; Y186-H223 AromaticContact CZ-CG 3.94Å; Y186-H223 AromaticContact CZ-ND1 3.91Å
187	E	97.6	Very high	97.6	Very high	109 Å²	109	41 Å²	41	51%	0.509	21%	0.212	S	C	.	.	H	α-helix	trans	-64.2	-38	178.3	-73.4	-62	160.7	0	0	112.2	E185 R190 G191	E185-E187 PolarHBondContact O-N 3.48Å; E187-R190 PolarHBondContact O-N 3.24Å; E187-R190 IonicContact OE2-CZ 3.65Å; E187-R190 IonicContact OE2-NE 3.18Å; E187-R190 PolarHBondContact OE2-NE 3.01Å; E187-R190 VanDerWaalsContact OE2-NE 3.08Å; E187-R190 IonicContact OE2-NH2 2.88Å; E187-R190 PolarHBondContact OE2-NH2 3.47Å; E187-G191 PolarHBondContact O-N 2.91Å
188	L	97.3	Very high	97.6	Very high	31 Å²	31	48.7 Å²	48.7	16%	0.162	24%	0.242	C	C	.	.	H	α-helix	trans	-68.3	-45.7	174.5	-176.9	61.1	0	0	0	110.9	M139 V144 K148 E185 Y186 R190 G191 Y192	M139-L188 HydrophobicContact CE-CD2 4.11Å; V144-L188 HydrophobicContact CG1-CD2 4.07Å; K148-L188 HydrophobicContact CD-CD1 3.89Å; K148-L188 HydrophobicContact CG-CD1 4.34Å; E185-L188 HydrophobicContact CB-CB 4.27Å; E185-L188 PolarHBondContact O-N 3.31Å; Y186-L188 VanDerWaalsContact C-N 3.31Å; Y186-L188 PolarHBondContact O-N 3.48Å; L188-R190 VanDerWaalsContact C-N 3.26Å; L188-R190 PolarHBondContact O-N 3.41Å; L188-G191 PolarHBondContact O-N 3.02Å; L188-Y192 HydrophobicContact CD1-CD2 4.3Å; L188-Y192 HydrophobicContact CD1-CE2 3.67Å; L188-Y192 HydrophobicContact CG-CD2 4.26Å; L188-Y192 HydrophobicContact CG-CE2 3.89Å; L188-Y192 VanDerWaalsContact O-CD2 3.31Å; L188-Y192 WeakPolarHBondContact O-CD2 3.41Å; L188-Y192 PolarHBondContact O-N 3.3Å
189	A	98.4	Very high	97.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.6	-39.1	175.9	0	0	0	0	0	112	A177 C180 V181 E185 Y186 G191 Y192 H193 T220	A177-A189 WeakPolarHBondContact O-CB 3.49Å; C180-A189 HydrophobicContact CB-CB 3.76Å; V181-A189 HydrophobicContact CG2-CB 3.55Å; E185-A189 PolarHBondContact O-N 3.46Å; Y186-A189 PolarHBondContact O-N 3.45Å; A189-G191 VanDerWaalsContact C-N 3.32Å; A189-G191 PolarHBondContact O-N 2.98Å; A189-Y192 PolarHBondContact O-N 3.34Å; A189-H193 WeakPolarHBondContact O-CB 3.31Å; A189-H193 PolarHBondContact O-CD2 2.84Å; A189-H193 PolarHBondContact O-N 3.1Å; A189-T220 HydrophobicContact CB-CG2 3.68Å
190	R	98.5	Very high	97.6	Very high	81 Å²	81	46.2 Å²	46.2	31%	0.306	23%	0.228	S	C	.	.	H	α-helix	trans	-58.6	-44.5	-179.7	-176	178.7	63.9	150.2	-0.7	111.4	Y186 E187 L188 S194 Y217 T220 L221	Y186-R190 WeakPolarHBondContact O-CB 3.43Å; Y186-R190 PolarHBondContact O-N 2.95Å; E187-R190 PolarHBondContact O-N 3.24Å; E187-R190 IonicContact OE2-CZ 3.65Å; E187-R190 IonicContact OE2-NE 3.18Å; E187-R190 PolarHBondContact OE2-NE 3.01Å; E187-R190 VanDerWaalsContact OE2-NE 3.08Å; E187-R190 IonicContact OE2-NH2 2.88Å; E187-R190 PolarHBondContact OE2-NH2 3.47Å; L188-R190 VanDerWaalsContact C-N 3.26Å; L188-R190 PolarHBondContact O-N 3.41Å; R190-S194 VanDerWaalsContact O-CB 3.27Å; R190-S194 WeakPolarHBondContact O-CB 3.4Å; R190-S194 PolarHBondContact O-N 3.3Å; R190-Y217 HydrophobicContact CG-CE2 4.15Å; R190-T220 HydrophobicContact CB-CG2 3.92Å; R190-L221 HydrophobicContact CG-CD2 4.1Å
191	G	98	Very high	97.5	Very high	44 Å²	44	49.3 Å²	49.3	45%	0.454	25%	0.247	S	C	.	.	H	α-helix	trans	-58.2	-50.5	176.1	0	0	0	0	0	112.1	E187 L188 A189 E195	E187-G191 PolarHBondContact O-N 2.91Å; L188-G191 PolarHBondContact O-N 3.02Å; A189-G191 VanDerWaalsContact C-N 3.32Å; A189-G191 PolarHBondContact O-N 2.98Å; G191-E195 PolarHBondContact O-N 2.87Å
192	Y	98.4	Very high	97.4	Very high	16 Å²	16	54.2 Å²	54.2	6%	0.063	27%	0.269	C	S	.	.	H	α-helix	trans	-67.5	-42.8	179.7	-71.1	-67	0	0	0	113	F151 N152 L155 M173 Y176 L188 A189 E195 V196	F151-Y192 HydrophobicContact CD1-CE1 4.03Å; F151-Y192 AromaticContact CD1-CZ 3.89Å; F151-Y192 HydrophobicContact CE1-CD1 4.29Å; F151-Y192 AromaticContact CE1-CE1 3.79Å; F151-Y192 HydrophobicContact CE1-CE1 3.79Å; N152-Y192 PolarHBondContact OD1-OH 3.32Å; L155-Y192 HydrophobicContact CD2-CE1 4.45Å; M173-Y192 HydrophobicContact CE-CD1 4.21Å; Y176-Y192 AromaticContact CD1-CD2 4Å; Y176-Y192 HydrophobicContact CD1-CD2 4Å; Y176-Y192 AromaticContact CD1-CE2 3.71Å; Y176-Y192 HydrophobicContact CD1-CE2 3.71Å; Y176-Y192 HydrophobicContact CE1-CD2 4.24Å; Y176-Y192 AromaticContact CE1-CE2 3.57Å; Y176-Y192 HydrophobicContact CE1-CE2 3.57Å; L188-Y192 HydrophobicContact CD1-CD2 4.3Å; L188-Y192 HydrophobicContact CD1-CE2 3.67Å; L188-Y192 HydrophobicContact CG-CD2 4.26Å; L188-Y192 HydrophobicContact CG-CE2 3.89Å; L188-Y192 VanDerWaalsContact O-CD2 3.31Å; L188-Y192 WeakPolarHBondContact O-CD2 3.41Å; L188-Y192 PolarHBondContact O-N 3.3Å; A189-Y192 PolarHBondContact O-N 3.34Å; Y192-E195 PolarHBondContact O-N 3.48Å; Y192-V196 WeakPolarHBondContact O-CB 3.46Å; Y192-V196 VanDerWaalsContact O-CG2 3.23Å; Y192-V196 WeakPolarHBondContact O-CG2 3.31Å; Y192-V196 PolarHBondContact O-N 3.43Å
193	H	98.7	Very high	97.3	Very high	1 Å²	1	48 Å²	48	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-38.6	179.2	-83.5	-56.3	0	0	0	112.8	N174 A177 A189 E195 V196 V197 N216 Y217 T220	N174-H193 PolarHBondContact OD1-CE1 2.98Å; A177-H193 VanDerWaalsContact CB-CD2 3.49Å; A177-H193 WeakPolarHBondContact CB-CD2 3.14Å; A177-H193 VanDerWaalsContact CB-NE2 3.3Å; A177-H193 WeakPolarHBondContact CB-NE2 3.44Å; A189-H193 WeakPolarHBondContact O-CB 3.31Å; A189-H193 PolarHBondContact O-CD2 2.84Å; A189-H193 PolarHBondContact O-N 3.1Å; H193-E195 VanDerWaalsContact C-N 3.31Å; H193-E195 PolarHBondContact O-N 2.8Å; H193-V196 WeakPolarHBondContact O-CB 3.46Å; H193-V196 PolarHBondContact O-N 2.99Å; H193-V197 WeakPolarHBondContact O-CG2 3.46Å; H193-V197 PolarHBondContact O-N 3.33Å; H193-N216 WeakPolarHBondContact CE1-CB 3.21Å; H193-Y217 HydrophobicContact CB-CD2 3.41Å; H193-Y217 VanDerWaalsContact CB-CD2 3.41Å; H193-Y217 HydrophobicContact CB-CE2 4.22Å; H193-Y217 HydrophobicContact CB-CG 3.91Å; H193-T220 PolarHBondContact CD2-OG1 3.41Å; H193-T220 PolarHBondContact NE2-OG1 2.8Å
194	S	98.4	Very high	97.2	Very high	50 Å²	50	53.7 Å²	53.7	35%	0.35	27%	0.269	S	S	.	.	H	α-helix	trans	-58.2	-45.8	172.4	-177.8	0	0	0	0	111.2	R190 V197 Y198	R190-S194 VanDerWaalsContact O-CB 3.27Å; R190-S194 WeakPolarHBondContact O-CB 3.4Å; R190-S194 PolarHBondContact O-N 3.3Å; S194-V197 WeakPolarHBondContact O-CG2 3.35Å; S194-V197 PolarHBondContact O-N 3.42Å; S194-Y198 WeakPolarHBondContact O-CB 3.34Å; S194-Y198 PolarHBondContact O-N 2.94Å
195	E	97.8	Very high	97	Very high	61 Å²	61	58.1 Å²	58.1	29%	0.285	29%	0.286	S	S	.	.	H	α-helix	trans	-69	-35.7	178.2	-161.9	-178.7	171.5	0	0	112.4	R159 M173 G191 Y192 H193 Y198 R199	R159-E195 IonicContact NH2-OE1 3.09Å; R159-E195 PolarHBondContact NH2-OE1 2.88Å; R159-E195 VanDerWaalsContact NH2-OE1 3.07Å; R159-E195 IonicContact NH2-OE2 2.68Å; M173-E195 HydrophobicContact CE-CB 3.64Å; M173-E195 HydrophobicContact CE-CG 3.6Å; M173-E195 VanDerWaalsContact CE-OE2 3.29Å; M173-E195 WeakPolarHBondContact CE-OE2 3.43Å; G191-E195 PolarHBondContact O-N 2.87Å; Y192-E195 PolarHBondContact O-N 3.48Å; H193-E195 VanDerWaalsContact C-N 3.31Å; H193-E195 PolarHBondContact O-N 2.8Å; E195-Y198 PolarHBondContact O-N 3.42Å; E195-R199 WeakPolarHBondContact O-CB 3.38Å; E195-R199 VanDerWaalsContact O-CG 3.28Å; E195-R199 WeakPolarHBondContact O-CG 3.25Å; E195-R199 PolarHBondContact O-N 3.08Å; E195-R199 IonicContact OE1-CZ 2.66Å; E195-R199 IonicContact OE1-NE 3.88Å; E195-R199 PolarHBondContact OE1-NE 3.25Å; E195-R199 VanDerWaalsContact OE1-NE 3.1Å; E195-R199 IonicContact OE1-NH2 3.08Å; E195-R199 PolarHBondContact OE1-NH2 3.3Å
196	V	98.5	Very high	96.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.7	-52.9	173.5	163.5	0	0	0	0	110.7	I170 M173 N174 Y192 H193 Y198 R199 A200 F213	I170-V196 HydrophobicContact CG2-CG1 4.01Å; M173-V196 HydrophobicContact CB-CG2 3.61Å; M173-V196 HydrophobicContact CE-CG2 4.44Å; N174-V196 HydrophobicContact CB-CG1 4.05Å; N174-V196 HydrophobicContact CB-CG2 3.98Å; Y192-V196 WeakPolarHBondContact O-CB 3.46Å; Y192-V196 VanDerWaalsContact O-CG2 3.23Å; Y192-V196 WeakPolarHBondContact O-CG2 3.31Å; Y192-V196 PolarHBondContact O-N 3.43Å; H193-V196 WeakPolarHBondContact O-CB 3.46Å; H193-V196 PolarHBondContact O-N 2.99Å; V196-Y198 VanDerWaalsContact C-N 3.3Å; V196-Y198 PolarHBondContact O-N 3.23Å; V196-R199 PolarHBondContact O-N 3.22Å; V196-A200 WeakPolarHBondContact O-CB 3.4Å; V196-A200 PolarHBondContact O-N 3.41Å; V196-F213 HydrophobicContact CG1-CB 4.06Å; V196-F213 HydrophobicContact CG1-CD1 3.95Å; V196-F213 HydrophobicContact CG1-CD2 4.14Å; V196-F213 HydrophobicContact CG1-CE1 4.41Å; V196-F213 HydrophobicContact CG1-CG 3.8Å
197	V	98.1	Very high	96.6	Very high	13 Å²	13	57.6 Å²	57.6	8%	0.079	29%	0.286	C	S	.	.	H	α-helix	trans	-65.4	-37	-178.8	-63.6	0	0	0	0	111.4	H193 S194 R199 V201 F213 Y214 Y217	H193-V197 WeakPolarHBondContact O-CG2 3.46Å; H193-V197 PolarHBondContact O-N 3.33Å; S194-V197 WeakPolarHBondContact O-CG2 3.35Å; S194-V197 PolarHBondContact O-N 3.42Å; V197-R199 PolarHBondContact O-N 2.95Å; V197-V201 WeakPolarHBondContact O-CG1 3.45Å; V197-V201 PolarHBondContact O-N 3.27Å; V197-F213 HydrophobicContact CG1-CB 4.16Å; V197-Y214 HydrophobicContact CB-CE1 4.18Å; V197-Y214 HydrophobicContact CG1-CD1 4.11Å; V197-Y214 HydrophobicContact CG1-CE1 4.22Å; V197-Y214 HydrophobicContact CG1-CG 4.39Å; V197-Y217 HydrophobicContact CG1-CD1 4.18Å; V197-Y217 HydrophobicContact CG2-CD1 3.82Å; V197-Y217 HydrophobicContact CG2-CE1 4.04Å
198	Y	97.7	Very high	96.4	Very high	160 Å²	160	61.3 Å²	61.3	63%	0.627	30%	0.296	S	S	*	.	H	α-helix	trans	-61.6	-42.2	175.4	174.1	-102.4	0	0	0	112.5	S194 E195 V196 V201 H202	S194-Y198 WeakPolarHBondContact O-CB 3.34Å; S194-Y198 PolarHBondContact O-N 2.94Å; E195-Y198 PolarHBondContact O-N 3.42Å; V196-Y198 VanDerWaalsContact C-N 3.3Å; V196-Y198 PolarHBondContact O-N 3.23Å; Y198-V201 WeakPolarHBondContact O-CG2 3.43Å; Y198-H202 PolarHBondContact O-CD2 3.33Å
199	R	97.2	Very high	96.3	Very high	28 Å²	28	61.6 Å²	61.6	11%	0.106	30%	0.296	C	S	.	.	H	α-helix	trans	-78.6	-40.2	179.5	-68.1	173.1	179.3	-133.5	-3.4	112.5	R159 P164 L165 I170 E195 V196 V197 V201 H202	R159-R199 VanDerWaalsContact CZ-NH2 3.35Å; P164-R199 PolarHBondContact O-NH1 3.32Å; L165-R199 HydrophobicContact CD2-CB 4.17Å; L165-R199 HydrophobicContact CD2-CG 4.3Å; I170-R199 HydrophobicContact CD1-CB 3.77Å; I170-R199 HydrophobicContact CG1-CB 3.83Å; E195-R199 WeakPolarHBondContact O-CB 3.38Å; E195-R199 VanDerWaalsContact O-CG 3.28Å; E195-R199 WeakPolarHBondContact O-CG 3.25Å; E195-R199 PolarHBondContact O-N 3.08Å; E195-R199 IonicContact OE1-CZ 2.66Å; E195-R199 IonicContact OE1-NE 3.88Å; E195-R199 PolarHBondContact OE1-NE 3.25Å; E195-R199 VanDerWaalsContact OE1-NE 3.1Å; E195-R199 IonicContact OE1-NH2 3.08Å; E195-R199 PolarHBondContact OE1-NH2 3.3Å; V196-R199 PolarHBondContact O-N 3.22Å; V197-R199 PolarHBondContact O-N 2.95Å; R199-V201 VanDerWaalsContact C-N 3.31Å; R199-V201 PolarHBondContact O-N 3.33Å; R199-H202 PolarHBondContact O-N 2.83Å
200	A	96.6	Very high	96.2	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.7	-34.3	-174.5	0	0	0	0	0	112.6	I170 V196 H202 C203 L206 L210 F213	I170-A200 HydrophobicContact CG2-CB 4.09Å; V196-A200 WeakPolarHBondContact O-CB 3.4Å; V196-A200 PolarHBondContact O-N 3.41Å; A200-H202 PolarHBondContact O-N 2.99Å; A200-H202 VanDerWaalsContact O-N 3.11Å; A200-C203 PolarHBondContact O-N 3.47Å; A200-L206 HydrophobicContact CB-CD1 4.37Å; A200-L210 HydrophobicContact CB-CD2 3.56Å; A200-F213 HydrophobicContact CB-CD2 3.65Å; A200-F213 HydrophobicContact CB-CE2 3.86Å
201	V	96.6	Very high	96.1	Very high	66 Å²	66	58.9 Å²	58.9	40%	0.4	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.4	176.3	-65.9	0	0	0	0	113.3	V197 Y198 R199 L210	V197-V201 WeakPolarHBondContact O-CG1 3.45Å; V197-V201 PolarHBondContact O-N 3.27Å; Y198-V201 WeakPolarHBondContact O-CG2 3.43Å; R199-V201 VanDerWaalsContact C-N 3.31Å; R199-V201 PolarHBondContact O-N 3.33Å; V201-L210 HydrophobicContact CG1-CD2 4.09Å
202	H	95.5	Very high	96	Very high	121 Å²	121	59.2 Å²	59.2	56%	0.56	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	9	176.8	-57.6	-53.2	0	0	0	112.7	L165 Y198 R199 A200	L165-H202 HydrophobicContact CD2-CB 4.3Å; Y198-H202 PolarHBondContact O-CD2 3.33Å; R199-H202 PolarHBondContact O-N 2.83Å; A200-H202 PolarHBondContact O-N 2.99Å; A200-H202 VanDerWaalsContact O-N 3.11Å
203	C	92.6	Very high	96	Very high	11 Å²	11	58.7 Å²	58.7	7%	0.074	29%	0.285	C	S	.	.			trans	-120	101.9	-178.3	-171.1	0	0	0	0	110.2	L165 I170 A200 D205 L206	L165-C203 PolarHBondContact O-SG 3.49Å; I170-C203 HydrophobicContact CD1-CB 3.81Å; A200-C203 PolarHBondContact O-N 3.47Å; C203-D205 VanDerWaalsContact C-N 3.27Å; C203-D205 PolarHBondContact O-N 2.95Å; C203-L206 HydrophobicContact CB-CB 4.27Å; C203-L206 HydrophobicContact CB-CD1 4.07Å; C203-L206 HydrophobicContact CB-CG 4.26Å; C203-L206 PolarHBondContact O-N 3.49Å
204	Q	92.9	Very high	96	Very high	163 Å²	163	59.6 Å²	59.6	76%	0.762	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-60.7	-35.2	-175.9	-170.5	174.8	10.2	0	0	112.7	L206 E207	Q204-L206 PolarHBondContact O-N 3.38Å; Q204-E207 WeakPolarHBondContact O-CB 3.42Å; Q204-E207 PolarHBondContact O-N 2.73Å; Q204-E207 VanDerWaalsContact O-N 3.1Å
205	D	92.4	Very high	96	Very high	122 Å²	122	57.9 Å²	57.9	65%	0.652	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-61.2	-19.1	178	-61.2	-27.7	0	0	0	113.5	A167 C203 W208	A167-D205 HydrophobicContact CB-CB 4.18Å; C203-D205 VanDerWaalsContact C-N 3.27Å; C203-D205 PolarHBondContact O-N 2.95Å; D205-W208 PolarHBondContact O-NE1 3.2Å
206	L	94.6	Very high	96	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.016	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-105.9	4.5	-178.3	-65.1	-177.8	0	0	0	113.8	A167 I170 I171 A200 C203 Q204 W208 Q209 L210 F213	A167-L206 HydrophobicContact CB-CD1 4.36Å; A167-L206 HydrophobicContact CB-CD2 3.79Å; A167-L206 HydrophobicContact CB-CG 3.94Å; I170-L206 HydrophobicContact CB-CD1 3.62Å; I170-L206 HydrophobicContact CD1-CD1 3.62Å; I170-L206 HydrophobicContact CG1-CD1 4.22Å; I170-L206 HydrophobicContact CG2-CD1 3.49Å; I170-L206 VanDerWaalsContact CG2-CD1 3.49Å; I171-L206 HydrophobicContact CD1-CD2 3.81Å; I171-L206 HydrophobicContact CG1-CD2 3.95Å; A200-L206 HydrophobicContact CB-CD1 4.37Å; C203-L206 HydrophobicContact CB-CB 4.27Å; C203-L206 HydrophobicContact CB-CD1 4.07Å; C203-L206 HydrophobicContact CB-CG 4.26Å; C203-L206 PolarHBondContact O-N 3.49Å; Q204-L206 PolarHBondContact O-N 3.38Å; L206-W208 PolarHBondContact O-N 2.97Å; L206-Q209 VanDerWaalsContact CD2-OE1 3.28Å; L206-Q209 WeakPolarHBondContact O-CA 3.5Å; L206-Q209 PolarHBondContact O-N 2.93Å; L206-L210 PolarHBondContact O-N 3.44Å; L206-L210 VanDerWaalsContact O-N 3.16Å; L206-F213 HydrophobicContact CB-CE2 4.19Å; L206-F213 HydrophobicContact CD1-CE2 4.01Å; L206-F213 HydrophobicContact CD1-CZ 4.39Å; L206-F213 HydrophobicContact CD2-CE2 4.43Å; L206-F213 HydrophobicContact CD2-CZ 4.39Å; L206-F213 HydrophobicContact CG-CE2 4.48Å
207	E	93.8	Very high	96	Very high	129 Å²	129	57.8 Å²	57.8	60%	0.603	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-52.8	-43.4	-176.9	-174.6	178.3	173	0	0	111.9	Q204 Q209 L210	Q204-E207 WeakPolarHBondContact O-CB 3.42Å; Q204-E207 PolarHBondContact O-N 2.73Å; Q204-E207 VanDerWaalsContact O-N 3.1Å; E207-Q209 VanDerWaalsContact C-N 3.27Å; E207-Q209 PolarHBondContact O-N 2.89Å; E207-L210 HydrophobicContact CG-CD1 4.49Å; E207-L210 WeakPolarHBondContact O-CB 3.32Å; E207-L210 PolarHBondContact O-N 3.42Å
208	W	92.3	Very high	96.1	Very high	187 Å²	187	57.2 Å²	57.2	71%	0.708	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-69.2	-19.9	179	69.3	-85.8	0	0	0	114.1	D205 L206	D205-W208 PolarHBondContact O-NE1 3.2Å; L206-W208 PolarHBondContact O-N 2.97Å
209	Q	94.4	Very high	96.1	Very high	38 Å²	38	53.3 Å²	53.3	18%	0.178	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-92.6	-13.6	177.2	-62.8	-170.2	-14.6	0	0	113.1	L206 E207 P211 A212 F213	L206-Q209 VanDerWaalsContact CD2-OE1 3.28Å; L206-Q209 WeakPolarHBondContact O-CA 3.5Å; L206-Q209 PolarHBondContact O-N 2.93Å; E207-Q209 VanDerWaalsContact C-N 3.27Å; E207-Q209 PolarHBondContact O-N 2.89Å; Q209-P211 VanDerWaalsContact C-CD 3.48Å; Q209-A212 WeakPolarHBondContact O-CB 3.16Å; Q209-A212 PolarHBondContact O-N 2.74Å; Q209-F213 HydrophobicContact CB-CD2 4.3Å; Q209-F213 HydrophobicContact CB-CE1 4.4Å; Q209-F213 HydrophobicContact CB-CE2 3.73Å; Q209-F213 HydrophobicContact CB-CZ 3.8Å; Q209-F213 PolarHBondContact O-N 3.49Å; Q209-F213 VanDerWaalsContact O-N 3.11Å
210	L	96.6	Very high	96.1	Very high	16 Å²	16	52 Å²	52	8%	0.084	26%	0.255	C	S	.	.	H	α-helix	trans	-50.6	-46	-177.1	-74.6	173.4	0	0	0	113.7	A200 V201 L206 E207 A212 F213 Y214 L240	A200-L210 HydrophobicContact CB-CD2 3.56Å; V201-L210 HydrophobicContact CG1-CD2 4.09Å; L206-L210 PolarHBondContact O-N 3.44Å; L206-L210 VanDerWaalsContact O-N 3.16Å; E207-L210 HydrophobicContact CG-CD1 4.49Å; E207-L210 WeakPolarHBondContact O-CB 3.32Å; E207-L210 PolarHBondContact O-N 3.42Å; L210-A212 VanDerWaalsContact C-N 3.27Å; L210-A212 PolarHBondContact O-N 3.45Å; L210-F213 PolarHBondContact O-N 2.88Å; L210-Y214 VanDerWaalsContact O-CD2 3.25Å; L210-Y214 WeakPolarHBondContact O-CD2 3.35Å; L210-Y214 PolarHBondContact O-N 3.45Å; L210-L240 HydrophobicContact CB-CD1 3.99Å
211	P	97.3	Very high	96.2	Very high	7 Å²	7	52.1 Å²	52.1	5%	0.045	26%	0.255	C	S	.	.	H	α-helix	trans	-57.2	-39.9	177.7	-24.5	34.4	0	0	0	113.1	Q209 Y214 C215 A237 L240 A241 V248 V252	Q209-P211 VanDerWaalsContact C-CD 3.48Å; P211-Y214 PolarHBondContact O-N 2.99Å; P211-C215 PolarHBondContact O-N 3.01Å; P211-C215 PolarHBondContact O-SG 3.49Å; P211-C215 VanDerWaalsContact O-SG 3.38Å; P211-A237 WeakPolarHBondContact O-CB 3.5Å; P211-L240 HydrophobicContact CG-CB 3.95Å; P211-A241 HydrophobicContact CB-CB 4.15Å; P211-A241 HydrophobicContact CG-CB 4.2Å; P211-V248 HydrophobicContact CB-CG1 4.04Å; P211-V248 HydrophobicContact CG-CG1 4.21Å; P211-V252 HydrophobicContact CB-CG2 4.02Å
212	A	96.4	Very high	96.3	Very high	51 Å²	51	50.3 Å²	50.3	42%	0.421	24%	0.241	S	C	.	.	H	α-helix	trans	-67.9	-40.7	178.8	0	0	0	0	0	111.9	Q209 L210 Y214 C215 N216	Q209-A212 WeakPolarHBondContact O-CB 3.16Å; Q209-A212 PolarHBondContact O-N 2.74Å; L210-A212 VanDerWaalsContact C-N 3.27Å; L210-A212 PolarHBondContact O-N 3.45Å; A212-Y214 VanDerWaalsContact C-N 3.34Å; A212-Y214 PolarHBondContact O-N 3.23Å; A212-C215 PolarHBondContact O-N 3.07Å; A212-N216 PolarHBondContact O-N 2.89Å; A212-N216 PolarHBondContact O-ND2 3.26Å; A212-N216 PolarHBondContact O-OD1 3.32Å
213	F	98.2	Very high	96.4	Very high	6 Å²	6	48.5 Å²	48.5	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-41.2	175.2	-62.4	-33.1	0	0	0	112.4	I170 I171 N174 V196 V197 A200 L206 Q209 L210 N216 Y217	I170-F213 HydrophobicContact CG2-CE2 4.28Å; I170-F213 HydrophobicContact CG2-CZ 4.41Å; I171-F213 HydrophobicContact CG1-CZ 4.39Å; N174-F213 HydrophobicContact CB-CD1 4.15Å; N174-F213 HydrophobicContact CB-CE1 3.88Å; N174-F213 WeakPolarHBondContact OD1-CD1 3.24Å; V196-F213 HydrophobicContact CG1-CB 4.06Å; V196-F213 HydrophobicContact CG1-CD1 3.95Å; V196-F213 HydrophobicContact CG1-CD2 4.14Å; V196-F213 HydrophobicContact CG1-CE1 4.41Å; V196-F213 HydrophobicContact CG1-CG 3.8Å; V197-F213 HydrophobicContact CG1-CB 4.16Å; A200-F213 HydrophobicContact CB-CD2 3.65Å; A200-F213 HydrophobicContact CB-CE2 3.86Å; L206-F213 HydrophobicContact CB-CE2 4.19Å; L206-F213 HydrophobicContact CD1-CE2 4.01Å; L206-F213 HydrophobicContact CD1-CZ 4.39Å; L206-F213 HydrophobicContact CD2-CE2 4.43Å; L206-F213 HydrophobicContact CD2-CZ 4.39Å; L206-F213 HydrophobicContact CG-CE2 4.48Å; Q209-F213 HydrophobicContact CB-CD2 4.3Å; Q209-F213 HydrophobicContact CB-CE1 4.4Å; Q209-F213 HydrophobicContact CB-CE2 3.73Å; Q209-F213 HydrophobicContact CB-CZ 3.8Å; Q209-F213 PolarHBondContact O-N 3.49Å; Q209-F213 VanDerWaalsContact O-N 3.11Å; L210-F213 PolarHBondContact O-N 2.88Å; F213-N216 PolarHBondContact O-N 3.24Å; F213-Y217 WeakPolarHBondContact O-CB 3.48Å; F213-Y217 PolarHBondContact O-N 3Å
214	Y	98.5	Very high	96.6	Very high	19 Å²	19	49.2 Å²	49.2	8%	0.075	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-38.1	174.3	-82	-71	0	0	0	112.5	V197 L210 P211 A212 Y217 A218 M233 R236 L240	V197-Y214 HydrophobicContact CB-CE1 4.18Å; V197-Y214 HydrophobicContact CG1-CD1 4.11Å; V197-Y214 HydrophobicContact CG1-CE1 4.22Å; V197-Y214 HydrophobicContact CG1-CG 4.39Å; L210-Y214 VanDerWaalsContact O-CD2 3.25Å; L210-Y214 WeakPolarHBondContact O-CD2 3.35Å; L210-Y214 PolarHBondContact O-N 3.45Å; P211-Y214 PolarHBondContact O-N 2.99Å; A212-Y214 VanDerWaalsContact C-N 3.34Å; A212-Y214 PolarHBondContact O-N 3.23Å; Y214-Y217 PolarHBondContact O-N 2.92Å; Y214-A218 VanDerWaalsContact O-CB 3.3Å; Y214-A218 WeakPolarHBondContact O-CB 3.47Å; Y214-A218 PolarHBondContact O-N 3.24Å; Y214-M233 HydrophobicContact CD1-CB 4.41Å; Y214-M233 HydrophobicContact CD1-SD 3.8Å; Y214-M233 HydrophobicContact CE1-SD 3.85Å; Y214-R236 HydrophobicContact CD1-CB 4.01Å; Y214-R236 HydrophobicContact CE1-CB 4.09Å; Y214-R236 HydrophobicContact CG-CB 4.27Å; Y214-L240 HydrophobicContact CD2-CD1 3.57Å; Y214-L240 HydrophobicContact CE2-CD1 3.48Å; Y214-L240 VanDerWaalsContact CE2-CD1 3.48Å
215	C	98.3	Very high	96.7	Very high	14 Å²	14	44 Å²	44	10%	0.095	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-48.6	172.8	-74.8	0	0	0	0	112.1	P211 A212 Y217 A218 E219 F255	P211-C215 PolarHBondContact O-N 3.01Å; P211-C215 PolarHBondContact O-SG 3.49Å; P211-C215 VanDerWaalsContact O-SG 3.38Å; A212-C215 PolarHBondContact O-N 3.07Å; C215-Y217 VanDerWaalsContact C-N 3.27Å; C215-Y217 PolarHBondContact O-N 2.94Å; C215-A218 WeakPolarHBondContact O-CB 3.34Å; C215-A218 PolarHBondContact O-N 3.13Å; C215-E219 PolarHBondContact O-N 2.88Å; C215-F255 HydrophobicContact CB-CD1 4.12Å; C215-F255 HydrophobicContact CB-CE1 3.99Å; C215-F255 HydrophobicContact CB-CZ 4.28Å; C215-F255 VanDerWaalsContact O-CZ 3.28Å; C215-F255 WeakPolarHBondContact O-CZ 3.44Å
216	N	98.3	Very high	96.9	Very high	34 Å²	34	40.2 Å²	40.2	18%	0.182	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-39.2	178.3	-60.6	-20.6	0	0	0	111.4	N174 H193 A212 F213 E219 T220	N174-N216 PolarHBondContact OD1-ND2 3Å; N174-N216 VanDerWaalsContact OD1-ND2 3.11Å; H193-N216 WeakPolarHBondContact CE1-CB 3.21Å; A212-N216 PolarHBondContact O-N 2.89Å; A212-N216 PolarHBondContact O-ND2 3.26Å; A212-N216 PolarHBondContact O-OD1 3.32Å; F213-N216 PolarHBondContact O-N 3.24Å; N216-E219 PolarHBondContact O-N 2.91Å; N216-T220 WeakPolarHBondContact O-CB 3.27Å; N216-T220 PolarHBondContact O-N 3.3Å; N216-T220 PolarHBondContact O-OG1 3.26Å
217	Y	98.7	Very high	97	Very high	26 Å²	26	43.1 Å²	43.1	10%	0.102	22%	0.219	C	C	.	.	H	α-helix	trans	-67.9	-41.6	176.4	-172.5	-149.3	0	0	0	112	R190 H193 V197 F213 Y214 C215 E219 T220 L221 M233	R190-Y217 HydrophobicContact CG-CE2 4.15Å; H193-Y217 HydrophobicContact CB-CD2 3.41Å; H193-Y217 VanDerWaalsContact CB-CD2 3.41Å; H193-Y217 HydrophobicContact CB-CE2 4.22Å; H193-Y217 HydrophobicContact CB-CG 3.91Å; V197-Y217 HydrophobicContact CG1-CD1 4.18Å; V197-Y217 HydrophobicContact CG2-CD1 3.82Å; V197-Y217 HydrophobicContact CG2-CE1 4.04Å; F213-Y217 WeakPolarHBondContact O-CB 3.48Å; F213-Y217 PolarHBondContact O-N 3Å; Y214-Y217 PolarHBondContact O-N 2.92Å; C215-Y217 VanDerWaalsContact C-N 3.27Å; C215-Y217 PolarHBondContact O-N 2.94Å; Y217-E219 PolarHBondContact O-N 3.06Å; Y217-T220 WeakPolarHBondContact O-CB 3.49Å; Y217-T220 PolarHBondContact O-N 2.83Å; Y217-L221 HydrophobicContact CD1-CD1 4.2Å; Y217-L221 HydrophobicContact CD2-CD1 4.11Å; Y217-L221 HydrophobicContact CD2-CG 3.99Å; Y217-L221 HydrophobicContact CE1-CD1 3.95Å; Y217-L221 HydrophobicContact CE2-CD1 3.88Å; Y217-L221 HydrophobicContact CE2-CD2 3.9Å; Y217-L221 HydrophobicContact CE2-CG 3.7Å; Y217-L221 HydrophobicContact CG-CD1 4.27Å; Y217-L221 WeakPolarHBondContact O-CG 3.43Å; Y217-L221 PolarHBondContact O-N 2.92Å; Y217-M233 HydrophobicContact CD1-CG 3.62Å; Y217-M233 HydrophobicContact CD1-SD 3.66Å; Y217-M233 HydrophobicContact CE1-CG 3.94Å; Y217-M233 HydrophobicContact CE1-SD 3.78Å; Y217-M233 HydrophobicContact CG-CG 4.38Å
218	A	98.5	Very high	97	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59	-45.7	174.6	0	0	0	0	0	111.9	Y214 C215 T220 L221 W222 A230 M233 A234 F255 L259	Y214-A218 VanDerWaalsContact O-CB 3.3Å; Y214-A218 WeakPolarHBondContact O-CB 3.47Å; Y214-A218 PolarHBondContact O-N 3.24Å; C215-A218 WeakPolarHBondContact O-CB 3.34Å; C215-A218 PolarHBondContact O-N 3.13Å; A218-T220 VanDerWaalsContact C-N 3.32Å; A218-T220 PolarHBondContact O-N 2.97Å; A218-L221 PolarHBondContact O-N 3.39Å; A218-W222 WeakPolarHBondContact O-CB 3.36Å; A218-W222 PolarHBondContact O-N 2.75Å; A218-A230 VanDerWaalsContact CB-O 3.28Å; A218-A230 WeakPolarHBondContact CB-O 3.29Å; A218-A230 VanDerWaalsContact O-CB 3.26Å; A218-A230 WeakPolarHBondContact O-CB 3.31Å; A218-M233 HydrophobicContact CB-CB 3.82Å; A218-A234 HydrophobicContact CB-CB 4.18Å; A218-F255 HydrophobicContact CB-CE1 3.86Å; A218-F255 HydrophobicContact CB-CZ 4Å; A218-L259 HydrophobicContact CB-CD1 4.38Å
219	E	98	Very high	97.3	Very high	79 Å²	79	39.4 Å²	39.4	37%	0.369	21%	0.207	S	C	.	.	H	α-helix	trans	-59.6	-44	175.8	-177.7	175.3	-174.5	0	0	111.2	C215 N216 Y217 W222 H223 F255	C215-E219 PolarHBondContact O-N 2.88Å; N216-E219 PolarHBondContact O-N 2.91Å; Y217-E219 PolarHBondContact O-N 3.06Å; E219-W222 VanDerWaalsContact O-CB 3.31Å; E219-W222 WeakPolarHBondContact O-CB 3.5Å; E219-W222 PolarHBondContact O-N 2.96Å; E219-H223 PolarHBondContact O-CD2 3.31Å; E219-H223 PolarHBondContact O-N 3.05Å; E219-F255 HydrophobicContact CB-CE2 4.17Å; E219-F255 HydrophobicContact CB-CZ 4.11Å
220	T	98.5	Very high	97.4	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-62.5	-46.4	177.6	-59.3	0	0	0	0	112.3	V181 A189 R190 H193 N216 Y217 A218 W222 H223 C224	V181-T220 HydrophobicContact CG2-CG2 4.36Å; V181-T220 VanDerWaalsContact CG2-OG1 3.32Å; V181-T220 WeakPolarHBondContact CG2-OG1 3.23Å; A189-T220 HydrophobicContact CB-CG2 3.68Å; R190-T220 HydrophobicContact CB-CG2 3.92Å; H193-T220 PolarHBondContact CD2-OG1 3.41Å; H193-T220 PolarHBondContact NE2-OG1 2.8Å; N216-T220 WeakPolarHBondContact O-CB 3.27Å; N216-T220 PolarHBondContact O-N 3.3Å; N216-T220 PolarHBondContact O-OG1 3.26Å; Y217-T220 WeakPolarHBondContact O-CB 3.49Å; Y217-T220 PolarHBondContact O-N 2.83Å; A218-T220 VanDerWaalsContact C-N 3.32Å; A218-T220 PolarHBondContact O-N 2.97Å; T220-W222 VanDerWaalsContact C-N 3.27Å; T220-W222 PolarHBondContact O-N 3Å; T220-H223 PolarHBondContact O-N 3.48Å; T220-C224 PolarHBondContact O-N 2.93Å; T220-C224 PolarHBondContact O-SG 3.45Å
221	L	98.5	Very high	97.5	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-61.9	-36.6	176	-72.5	168.4	0	0	0	111.8	R190 Y217 A218 C224 G225 Q226 E229 A230 M233	R190-L221 HydrophobicContact CG-CD2 4.1Å; Y217-L221 HydrophobicContact CD1-CD1 4.2Å; Y217-L221 HydrophobicContact CD2-CD1 4.11Å; Y217-L221 HydrophobicContact CD2-CG 3.99Å; Y217-L221 HydrophobicContact CE1-CD1 3.95Å; Y217-L221 HydrophobicContact CE2-CD1 3.88Å; Y217-L221 HydrophobicContact CE2-CD2 3.9Å; Y217-L221 HydrophobicContact CE2-CG 3.7Å; Y217-L221 HydrophobicContact CG-CD1 4.27Å; Y217-L221 WeakPolarHBondContact O-CG 3.43Å; Y217-L221 PolarHBondContact O-N 2.92Å; A218-L221 PolarHBondContact O-N 3.39Å; L221-C224 CarbonylContact O-C 3.59Å; L221-C224 PolarHBondContact O-N 3.29Å; L221-G225 PolarHBondContact O-N 2.81Å; L221-Q226 HydrophobicContact CB-CB 4.33Å; L221-Q226 HydrophobicContact CD2-CB 4.15Å; L221-Q226 VanDerWaalsContact CD2-OE1 3.26Å; L221-Q226 PolarHBondContact O-N 3.38Å; L221-E229 HydrophobicContact CD1-CB 4Å; L221-E229 HydrophobicContact CD2-CB 4.5Å; L221-A230 HydrophobicContact CB-CB 3.84Å; L221-M233 HydrophobicContact CD1-CB 4.49Å; L221-M233 HydrophobicContact CD1-CG 3.59Å
222	W	97.7	Very high	97.5	Very high	28 Å²	28	41.9 Å²	41.9	11%	0.106	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-47.5	175.9	-171.1	-99.1	0	0	0	111.4	A218 E219 T220 C224 G225 K227 A230 L259 E262 M263	A218-W222 WeakPolarHBondContact O-CB 3.36Å; A218-W222 PolarHBondContact O-N 2.75Å; E219-W222 VanDerWaalsContact O-CB 3.31Å; E219-W222 WeakPolarHBondContact O-CB 3.5Å; E219-W222 PolarHBondContact O-N 2.96Å; T220-W222 VanDerWaalsContact C-N 3.27Å; T220-W222 PolarHBondContact O-N 3Å; W222-C224 VanDerWaalsContact C-N 3.3Å; W222-C224 PolarHBondContact O-N 3.47Å; W222-G225 PolarHBondContact O-N 3.28Å; W222-K227 HydrophobicContact CD2-CG 4.33Å; W222-K227 HydrophobicContact CE3-CB 3.98Å; W222-K227 HydrophobicContact CE3-CG 4.03Å; W222-K227 HydrophobicContact CH2-CB 4.47Å; W222-K227 HydrophobicContact CH2-CD 3.99Å; W222-K227 HydrophobicContact CH2-CG 4.37Å; W222-K227 HydrophobicContact CZ2-CD 4.21Å; W222-K227 HydrophobicContact CZ3-CB 3.85Å; W222-K227 HydrophobicContact CZ3-CD 4.18Å; W222-K227 HydrophobicContact CZ3-CG 4.08Å; W222-A230 HydrophobicContact CB-CB 4.1Å; W222-A230 HydrophobicContact CE3-CB 3.99Å; W222-L259 HydrophobicContact CB-CD2 4.38Å; W222-L259 HydrophobicContact CD2-CD2 3.69Å; W222-L259 HydrophobicContact CE3-CD2 3.84Å; W222-L259 HydrophobicContact CG-CD2 3.93Å; W222-L259 VanDerWaalsContact CH2-O 3.29Å; W222-L259 WeakPolarHBondContact CH2-O 3.43Å; W222-L259 HydrophobicContact CZ3-CB 4.31Å; W222-L259 HydrophobicContact CZ3-CD2 4.34Å; W222-E262 HydrophobicContact CH2-CB 4.1Å; W222-E262 HydrophobicContact CZ2-CB 3.51Å; W222-E262 WeakPolarHBondContact CZ2-OE2 3.15Å; W222-E262 PolarHBondContact NE1-OE2 3.11Å; W222-M263 HydrophobicContact CH2-CB 3.95Å; W222-M263 HydrophobicContact CH2-CE 4.35Å; W222-M263 HydrophobicContact CH2-SD 4.42Å; W222-M263 HydrophobicContact CZ3-CE 4.02Å
223	H	97.1	Very high	97.6	Very high	83 Å²	83	40.1 Å²	40.1	38%	0.384	20%	0.202	S	C	.	.	H	α-helix	trans	-67.4	-27.9	176.1	-74	-65.6	0	0	0	113.6	Y186 E219 T220 G225	Y186-H223 HydrophobicContact CD1-CB 3.41Å; Y186-H223 VanDerWaalsContact CD1-CB 3.41Å; Y186-H223 AromaticContact CD1-CG 3.91Å; Y186-H223 HydrophobicContact CD2-CB 3.94Å; Y186-H223 HydrophobicContact CE1-CB 3.6Å; Y186-H223 AromaticContact CE1-CG 3.6Å; Y186-H223 AromaticContact CE1-ND1 4Å; Y186-H223 HydrophobicContact CE2-CB 4.11Å; Y186-H223 HydrophobicContact CG-CB 3.58Å; Y186-H223 AromaticContact CZ-CG 3.94Å; Y186-H223 AromaticContact CZ-ND1 3.91Å; E219-H223 PolarHBondContact O-CD2 3.31Å; E219-H223 PolarHBondContact O-N 3.05Å; T220-H223 PolarHBondContact O-N 3.48Å; H223-G225 PolarHBondContact O-N 3.47Å
224	C	97.2	Very high	97.5	Very high	27 Å²	27	40 Å²	40	18%	0.182	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-0.3	170.4	-59.8	0	0	0	0	113.4	T220 L221 W222 Q226	T220-C224 PolarHBondContact O-N 2.93Å; T220-C224 PolarHBondContact O-SG 3.45Å; L221-C224 CarbonylContact O-C 3.59Å; L221-C224 PolarHBondContact O-N 3.29Å; W222-C224 VanDerWaalsContact C-N 3.3Å; W222-C224 PolarHBondContact O-N 3.47Å; C224-Q226 HydrophobicContact CB-CG 4.48Å; C224-Q226 PolarHBondContact O-N 2.93Å
225	G	95.5	Very high	97.5	Very high	53 Å²	53	43.8 Å²	43.8	55%	0.546	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	0.6	-176.8	0	0	0	0	0	114.3	L221 W222 H223 K227	L221-G225 PolarHBondContact O-N 2.81Å; W222-G225 PolarHBondContact O-N 3.28Å; H223-G225 PolarHBondContact O-N 3.47Å; G225-K227 PolarHBondContact O-N 2.85Å
226	Q	96.8	Very high	97.4	Very high	43 Å²	43	49 Å²	49	20%	0.201	24%	0.238	C	C	.	.			trans	-80.8	57.2	177.2	-64.4	-178.9	-84.2	0	0	111	L221 C224 K228 E229 A230	L221-Q226 HydrophobicContact CB-CB 4.33Å; L221-Q226 HydrophobicContact CD2-CB 4.15Å; L221-Q226 VanDerWaalsContact CD2-OE1 3.26Å; L221-Q226 PolarHBondContact O-N 3.38Å; C224-Q226 HydrophobicContact CB-CG 4.48Å; C224-Q226 PolarHBondContact O-N 2.93Å; Q226-K228 VanDerWaalsContact C-N 3.27Å; Q226-K228 PolarHBondContact O-N 3.49Å; Q226-E229 HydrophobicContact CB-CB 4.33Å; Q226-E229 PolarHBondContact NE2-OE1 2.99Å; Q226-E229 PolarHBondContact NE2-OE2 3.34Å; Q226-E229 PolarHBondContact O-N 3.25Å; Q226-A230 PolarHBondContact O-N 2.94Å
227	K	95.8	Very high	97.4	Very high	64 Å²	64	47.4 Å²	47.4	28%	0.278	23%	0.229	S	C	.	.	H	α-helix	trans	-62.3	-30.6	-169.3	-57.6	-171.7	177.2	-175.8	0	114.1	W222 G225 L231 M263 S266	W222-K227 HydrophobicContact CD2-CG 4.33Å; W222-K227 HydrophobicContact CE3-CB 3.98Å; W222-K227 HydrophobicContact CE3-CG 4.03Å; W222-K227 HydrophobicContact CH2-CB 4.47Å; W222-K227 HydrophobicContact CH2-CD 3.99Å; W222-K227 HydrophobicContact CH2-CG 4.37Å; W222-K227 HydrophobicContact CZ2-CD 4.21Å; W222-K227 HydrophobicContact CZ3-CB 3.85Å; W222-K227 HydrophobicContact CZ3-CD 4.18Å; W222-K227 HydrophobicContact CZ3-CG 4.08Å; G225-K227 PolarHBondContact O-N 2.85Å; K227-L231 WeakPolarHBondContact O-CG 3.31Å; K227-L231 PolarHBondContact O-N 3.49Å; K227-M263 HydrophobicContact CB-CE 3.39Å; K227-M263 HydrophobicContact CB-SD 4.17Å; K227-M263 HydrophobicContact CD-CE 4.2Å; K227-M263 HydrophobicContact CD-SD 3.9Å; K227-M263 HydrophobicContact CG-CE 4.45Å; K227-S266 PolarHBondContact NZ-OG 2.95Å
228	K	95.3	Very high	97.3	Very high	157 Å²	157	48 Å²	48	68%	0.683	23%	0.234	S	C	*	.	H	α-helix	trans	-66.9	-51.5	176.6	-175	-175.3	172.9	-170.3	0	110.8	Q226 A230 L231 E232	Q226-K228 VanDerWaalsContact C-N 3.27Å; Q226-K228 PolarHBondContact O-N 3.49Å; K228-A230 VanDerWaalsContact C-N 3.27Å; K228-A230 PolarHBondContact O-N 2.99Å; K228-L231 PolarHBondContact O-N 2.96Å; K228-L231 VanDerWaalsContact O-N 3.15Å; K228-E232 WeakPolarHBondContact CE-OE1 3.16Å; K228-E232 PolarHBondContact O-N 2.97Å; K228-E232 VanDerWaalsContact O-N 3.08Å
229	E	97.4	Very high	97.2	Very high	80 Å²	80	51.7 Å²	51.7	37%	0.374	26%	0.259	S	S	.	.	H	α-helix	trans	-63	-36	177.9	-64.8	168.8	-127.9	0	0	111.4	L221 Q226 L231 E232 M233	L221-E229 HydrophobicContact CD1-CB 4Å; L221-E229 HydrophobicContact CD2-CB 4.5Å; Q226-E229 HydrophobicContact CB-CB 4.33Å; Q226-E229 PolarHBondContact NE2-OE1 2.99Å; Q226-E229 PolarHBondContact NE2-OE2 3.34Å; Q226-E229 PolarHBondContact O-N 3.25Å; E229-L231 VanDerWaalsContact C-N 3.34Å; E229-L231 PolarHBondContact O-N 2.9Å; E229-E232 WeakPolarHBondContact O-CB 3.49Å; E229-E232 PolarHBondContact O-N 3.26Å; E229-M233 WeakPolarHBondContact O-CG 3.41Å; E229-M233 PolarHBondContact O-N 3.48Å
230	A	97.9	Very high	97.1	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.6	-45.2	173.1	0	0	0	0	0	112.2	A218 L221 W222 Q226 K228 M233 A234	A218-A230 VanDerWaalsContact CB-O 3.28Å; A218-A230 WeakPolarHBondContact CB-O 3.29Å; A218-A230 VanDerWaalsContact O-CB 3.26Å; A218-A230 WeakPolarHBondContact O-CB 3.31Å; L221-A230 HydrophobicContact CB-CB 3.84Å; W222-A230 HydrophobicContact CB-CB 4.1Å; W222-A230 HydrophobicContact CE3-CB 3.99Å; Q226-A230 PolarHBondContact O-N 2.94Å; K228-A230 VanDerWaalsContact C-N 3.27Å; K228-A230 PolarHBondContact O-N 2.99Å; A230-M233 PolarHBondContact O-N 3.48Å; A230-A234 WeakPolarHBondContact O-CB 3.16Å; A230-A234 PolarHBondContact O-N 2.77Å
231	L	97	Very high	96.9	Very high	34 Å²	34	51 Å²	51	18%	0.178	26%	0.258	C	S	.	.	H	α-helix	trans	-66.5	-37.5	176	-70.6	177.4	0	0	0	112.2	K227 K228 E229 M233 A234 E235 L259 R260 M263	K227-L231 WeakPolarHBondContact O-CG 3.31Å; K227-L231 PolarHBondContact O-N 3.49Å; K228-L231 PolarHBondContact O-N 2.96Å; K228-L231 VanDerWaalsContact O-N 3.15Å; E229-L231 VanDerWaalsContact C-N 3.34Å; E229-L231 PolarHBondContact O-N 2.9Å; L231-M233 VanDerWaalsContact C-N 3.33Å; L231-M233 PolarHBondContact O-N 3.41Å; L231-A234 PolarHBondContact O-N 3.3Å; L231-E235 WeakPolarHBondContact O-CB 3.18Å; L231-E235 WeakPolarHBondContact O-CG 3.48Å; L231-E235 PolarHBondContact O-N 3.26Å; L231-L259 HydrophobicContact CD2-CB 3.99Å; L231-R260 HydrophobicContact CD2-CG 4.02Å; L231-M263 HydrophobicContact CD1-CE 3.47Å; L231-M263 VanDerWaalsContact CD1-CE 3.47Å; L231-M263 HydrophobicContact CD1-CG 4.47Å; L231-M263 HydrophobicContact CG-CE 4.2Å
232	E	97.7	Very high	96.7	Very high	79 Å²	79	54.1 Å²	54.1	37%	0.369	28%	0.284	S	S	.	.	H	α-helix	trans	-61.1	-41.9	174.8	-68.2	173.4	-168.8	0	0	111.5	K228 E229 E235 R236	K228-E232 WeakPolarHBondContact CE-OE1 3.16Å; K228-E232 PolarHBondContact O-N 2.97Å; K228-E232 VanDerWaalsContact O-N 3.08Å; E229-E232 WeakPolarHBondContact O-CB 3.49Å; E229-E232 PolarHBondContact O-N 3.26Å; E232-E235 PolarHBondContact O-N 3.27Å; E232-R236 WeakPolarHBondContact O-CG 3.44Å; E232-R236 PolarHBondContact O-N 3.39Å; E232-R236 VanDerWaalsContact O-N 3.12Å
233	M	98.3	Very high	96.4	Very high	15 Å²	15	58.2 Å²	58.2	7%	0.074	32%	0.317	C	S	.	.	H	α-helix	trans	-68	-40.2	175.6	-66.6	-52.5	99	0	0	112	Y214 Y217 A218 L221 E229 A230 L231 E235 R236 A237	Y214-M233 HydrophobicContact CD1-CB 4.41Å; Y214-M233 HydrophobicContact CD1-SD 3.8Å; Y214-M233 HydrophobicContact CE1-SD 3.85Å; Y217-M233 HydrophobicContact CD1-CG 3.62Å; Y217-M233 HydrophobicContact CD1-SD 3.66Å; Y217-M233 HydrophobicContact CE1-CG 3.94Å; Y217-M233 HydrophobicContact CE1-SD 3.78Å; Y217-M233 HydrophobicContact CG-CG 4.38Å; A218-M233 HydrophobicContact CB-CB 3.82Å; L221-M233 HydrophobicContact CD1-CB 4.49Å; L221-M233 HydrophobicContact CD1-CG 3.59Å; E229-M233 WeakPolarHBondContact O-CG 3.41Å; E229-M233 PolarHBondContact O-N 3.48Å; A230-M233 PolarHBondContact O-N 3.48Å; L231-M233 VanDerWaalsContact C-N 3.33Å; L231-M233 PolarHBondContact O-N 3.41Å; M233-E235 VanDerWaalsContact C-N 3.31Å; M233-E235 PolarHBondContact O-N 3.27Å; M233-R236 WeakPolarHBondContact O-CB 3.39Å; M233-R236 PolarHBondContact O-N 3.29Å; M233-A237 PolarHBondContact O-N 3.14Å
234	A	97.8	Very high	95.9	Very high	2 Å²	2	56.6 Å²	56.6	2%	0.017	32%	0.323	C	S	.	.	H	α-helix	trans	-62.7	-37.9	175.8	0	0	0	0	0	111.9	A218 A230 L231 A237 L238 F255 C256 L259	A218-A234 HydrophobicContact CB-CB 4.18Å; A230-A234 WeakPolarHBondContact O-CB 3.16Å; A230-A234 PolarHBondContact O-N 2.77Å; L231-A234 PolarHBondContact O-N 3.3Å; A234-A237 WeakPolarHBondContact O-CB 3.47Å; A234-A237 PolarHBondContact O-N 3.36Å; A234-L238 PolarHBondContact O-N 3.42Å; A234-F255 HydrophobicContact CB-CE1 4.19Å; A234-C256 PolarHBondContact O-SG 2.74Å; A234-L259 HydrophobicContact CB-CD1 4.04Å
235	E	97.3	Very high	95.6	Very high	99 Å²	99	59.8 Å²	59.8	46%	0.463	34%	0.338	S	S	.	.	H	α-helix	trans	-67.7	-37.2	175.1	-74.6	180	170.5	0	0	112.5	L231 E232 M233 L238 S239 R260	L231-E235 WeakPolarHBondContact O-CB 3.18Å; L231-E235 WeakPolarHBondContact O-CG 3.48Å; L231-E235 PolarHBondContact O-N 3.26Å; E232-E235 PolarHBondContact O-N 3.27Å; M233-E235 VanDerWaalsContact C-N 3.31Å; M233-E235 PolarHBondContact O-N 3.27Å; E235-L238 PolarHBondContact O-N 3.26Å; E235-S239 PolarHBondContact O-N 2.9Å; E235-R260 IonicContact OE1-NH2 3.97Å; E235-R260 PolarHBondContact OE1-NH2 3.47Å
236	R	97.2	Very high	95.5	Very high	125 Å²	125	65.9 Å²	65.9	47%	0.472	35%	0.349	S	S	.	.	H	α-helix	trans	-63.3	-42.2	170.8	-70.2	-179.3	-174.5	-165.1	4.1	112.3	Y214 E232 M233 L238 S239 L240	Y214-R236 HydrophobicContact CD1-CB 4.01Å; Y214-R236 HydrophobicContact CE1-CB 4.09Å; Y214-R236 HydrophobicContact CG-CB 4.27Å; E232-R236 WeakPolarHBondContact O-CG 3.44Å; E232-R236 PolarHBondContact O-N 3.39Å; E232-R236 VanDerWaalsContact O-N 3.12Å; M233-R236 WeakPolarHBondContact O-CB 3.39Å; M233-R236 PolarHBondContact O-N 3.29Å; R236-L238 VanDerWaalsContact C-N 3.27Å; R236-L238 PolarHBondContact O-N 3.19Å; R236-S239 PolarHBondContact O-N 3.41Å; R236-S239 PolarHBondContact O-OG 2.88Å; R236-L240 WeakPolarHBondContact O-CG 3.44Å; R236-L240 PolarHBondContact O-N 2.97Å; R236-L240 VanDerWaalsContact O-N 3.09Å
237	A	97.5	Very high	95.2	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-57.5	-45	173.8	0	0	0	0	0	110.7	P211 M233 A234 L240 A241 V252	P211-A237 WeakPolarHBondContact O-CB 3.5Å; M233-A237 PolarHBondContact O-N 3.14Å; A234-A237 WeakPolarHBondContact O-CB 3.47Å; A234-A237 PolarHBondContact O-N 3.36Å; A237-L240 PolarHBondContact O-N 2.71Å; A237-A241 WeakPolarHBondContact O-CB 3.38Å; A237-A241 PolarHBondContact O-N 3.03Å; A237-V252 HydrophobicContact CB-CG1 3.82Å
238	L	97.1	Very high	95.1	Very high	38 Å²	38	68.2 Å²	68.2	20%	0.199	37%	0.368	C	S	.	.	H	α-helix	trans	-65.4	-41.1	-179.5	-174.4	64.7	0	0	0	112.5	A234 E235 R236 A241 A242 L249 V252 K253	A234-L238 PolarHBondContact O-N 3.42Å; E235-L238 PolarHBondContact O-N 3.26Å; R236-L238 VanDerWaalsContact C-N 3.27Å; R236-L238 PolarHBondContact O-N 3.19Å; L238-A241 PolarHBondContact O-N 2.95Å; L238-A242 WeakPolarHBondContact O-CB 3.2Å; L238-A242 PolarHBondContact O-N 3.5Å; L238-A242 VanDerWaalsContact O-N 3.07Å; L238-L249 HydrophobicContact CD1-CD1 3.89Å; L238-V252 HydrophobicContact CB-CG1 4.12Å; L238-V252 HydrophobicContact CD1-CG1 4.22Å; L238-K253 HydrophobicContact CD1-CD 4.49Å; L238-K253 HydrophobicContact CD1-CG 3.46Å; L238-K253 VanDerWaalsContact CD1-CG 3.46Å
239	S	96.4	Very high	95.1	Very high	77 Å²	77	62.4 Å²	62.4	54%	0.538	34%	0.344	S	S	.	.	H	α-helix	trans	-64.3	-40.7	177.5	65.1	0	0	0	0	112	E235 R236 A242	E235-S239 PolarHBondContact O-N 2.9Å; R236-S239 PolarHBondContact O-N 3.41Å; R236-S239 PolarHBondContact O-OG 2.88Å; S239-A242 PolarHBondContact O-N 3.41Å
240	L	95.2	Very high	95	Very high	65 Å²	65	64.3 Å²	64.3	34%	0.34	35%	0.351	S	S	.	.	H	α-helix	trans	-70.3	-39.3	178.2	-69.2	168.8	0	0	0	111.9	L210 P211 Y214 R236 A237 A242 S243	L210-L240 HydrophobicContact CB-CD1 3.99Å; P211-L240 HydrophobicContact CG-CB 3.95Å; Y214-L240 HydrophobicContact CD2-CD1 3.57Å; Y214-L240 HydrophobicContact CE2-CD1 3.48Å; Y214-L240 VanDerWaalsContact CE2-CD1 3.48Å; R236-L240 WeakPolarHBondContact O-CG 3.44Å; R236-L240 PolarHBondContact O-N 2.97Å; R236-L240 VanDerWaalsContact O-N 3.09Å; A237-L240 PolarHBondContact O-N 2.71Å; L240-A242 VanDerWaalsContact C-N 3.28Å; L240-A242 PolarHBondContact O-N 3.18Å; L240-S243 PolarHBondContact O-OG 3.41Å
241	A	95.3	Very high	94.9	Very high	2 Å²	2	70 Å²	70	2%	0.017	38%	0.378	C	S	.	.	H	α-helix	trans	-71.1	-22.4	178.5	0	0	0	0	0	113.1	P211 A237 L238 S243 G244 V248 L249 V252	P211-A241 HydrophobicContact CB-CB 4.15Å; P211-A241 HydrophobicContact CG-CB 4.2Å; A237-A241 WeakPolarHBondContact O-CB 3.38Å; A237-A241 PolarHBondContact O-N 3.03Å; L238-A241 PolarHBondContact O-N 2.95Å; A241-S243 VanDerWaalsContact C-N 3.26Å; A241-S243 PolarHBondContact O-N 3.21Å; A241-G244 PolarHBondContact O-N 2.89Å; A241-G244 VanDerWaalsContact O-N 3.09Å; A241-V248 HydrophobicContact CB-CG1 4.18Å; A241-L249 HydrophobicContact CB-CB 4.41Å; A241-L249 HydrophobicContact CB-CD1 4.07Å; A241-V252 HydrophobicContact CB-CB 4.2Å; A241-V252 HydrophobicContact CB-CG1 4.38Å; A241-V252 HydrophobicContact CB-CG2 4.05Å
242	A	94.2	Very high	94.9	Very high	66 Å²	66	68.7 Å²	68.7	55%	0.545	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-31.4	-176.9	0	0	0	0	0	113.5	L238 S239 L240	L238-A242 WeakPolarHBondContact O-CB 3.2Å; L238-A242 PolarHBondContact O-N 3.5Å; L238-A242 VanDerWaalsContact O-N 3.07Å; S239-A242 PolarHBondContact O-N 3.41Å; L240-A242 VanDerWaalsContact C-N 3.28Å; L240-A242 PolarHBondContact O-N 3.18Å
243	S	89.8	Confident	94.8	Very high	114 Å²	114	69.8 Å²	69.8	80%	0.797	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	0	176.3	49.9	0	0	0	0	114	L240 A241	L240-S243 PolarHBondContact O-OG 3.41Å; A241-S243 VanDerWaalsContact C-N 3.26Å; A241-S243 PolarHBondContact O-N 3.21Å
244	G	88.1	Confident	94.8	Very high	49 Å²	49	74 Å²	74	51%	0.505	39%	0.394	S	S	.	.	S	Bend	trans	-106.6	-153.3	-172.6	0	0	0	0	0	114.9	A241	A241-G244 PolarHBondContact O-N 2.89Å; A241-G244 VanDerWaalsContact O-N 3.09Å
245	D	90.1	Very high	94.8	Very high	93 Å²	93	76 Å²	76	50%	0.497	40%	0.403	S	S	.	.			trans	-61.6	132.9	178.3	-173.8	-53.4	0	0	0	111.7	N247 V248 L249	D245-N247 VanDerWaalsContact C-N 3.28Å; D245-N247 PolarHBondContact O-N 3.38Å; D245-N247 WeakPolarHBondContact OD1-CA 3.27Å; D245-N247 WeakPolarHBondContact OD1-CB 3.43Å; D245-N247 PolarHBondContact OD1-N 3.19Å; D245-N247 PolarHBondContact OD1-ND2 3.33Å; D245-V248 HydrophobicContact CB-CB 4.21Å; D245-V248 HydrophobicContact CB-CG2 3.89Å; D245-V248 WeakPolarHBondContact O-CB 3.35Å; D245-V248 PolarHBondContact O-N 3.36Å; D245-V248 VanDerWaalsContact O-N 3.11Å; D245-L249 PolarHBondContact O-N 3.5Å
246	K	92.8	Very high	94.7	Very high	182 Å²	182	71.4 Å²	71.4	79%	0.791	38%	0.381	S	S	*	.	H	α-helix	trans	-60.6	-33.8	-179.2	-67.6	-176.8	-179.1	177.4	0	113.3	K250	K246-K250 WeakPolarHBondContact O-CB 3.42Å; K246-K250 PolarHBondContact O-N 2.92Å
247	N	92.1	Very high	94.6	Very high	103 Å²	103	69 Å²	69	55%	0.551	38%	0.378	S	S	*	.	H	α-helix	trans	-67.8	-44.3	175.1	-62.3	-47.5	0	0	0	110.3	D245 L249 K250 H251	D245-N247 VanDerWaalsContact C-N 3.28Å; D245-N247 PolarHBondContact O-N 3.38Å; D245-N247 WeakPolarHBondContact OD1-CA 3.27Å; D245-N247 WeakPolarHBondContact OD1-CB 3.43Å; D245-N247 PolarHBondContact OD1-N 3.19Å; D245-N247 PolarHBondContact OD1-ND2 3.33Å; N247-L249 VanDerWaalsContact C-N 3.34Å; N247-L249 PolarHBondContact O-N 2.97Å; N247-K250 WeakPolarHBondContact O-CB 3.49Å; N247-K250 PolarHBondContact O-N 3Å; N247-H251 PolarHBondContact O-N 3.26Å; N247-H251 VanDerWaalsContact O-N 3.09Å; N247-H251 PolarHBondContact O-ND1 3.01Å
248	V	91.8	Very high	94.6	Very high	53 Å²	53	71.8 Å²	71.8	32%	0.321	40%	0.397	S	S	.	.	H	α-helix	trans	-60.4	-47.3	175.6	177.1	0	0	0	0	109.9	P211 A241 D245 K250 H251 V252	P211-V248 HydrophobicContact CB-CG1 4.04Å; P211-V248 HydrophobicContact CG-CG1 4.21Å; A241-V248 HydrophobicContact CB-CG1 4.18Å; D245-V248 HydrophobicContact CB-CB 4.21Å; D245-V248 HydrophobicContact CB-CG2 3.89Å; D245-V248 WeakPolarHBondContact O-CB 3.35Å; D245-V248 PolarHBondContact O-N 3.36Å; D245-V248 VanDerWaalsContact O-N 3.11Å; V248-K250 VanDerWaalsContact C-N 3.28Å; V248-K250 PolarHBondContact O-N 3.44Å; V248-H251 PolarHBondContact O-N 3.38Å; V248-V252 HydrophobicContact CG1-CG2 4.18Å; V248-V252 VanDerWaalsContact O-CG2 3.29Å; V248-V252 WeakPolarHBondContact O-CG2 3.32Å; V248-V252 PolarHBondContact O-N 3.47Å
249	L	95.8	Very high	94.5	Very high	34 Å²	34	70.5 Å²	70.5	18%	0.178	39%	0.39	C	S	.	.	H	α-helix	trans	-56.5	-40.9	176.1	-178.7	58.1	0	0	0	112.8	L238 A241 D245 N247 K253	L238-L249 HydrophobicContact CD1-CD1 3.89Å; A241-L249 HydrophobicContact CB-CB 4.41Å; A241-L249 HydrophobicContact CB-CD1 4.07Å; D245-L249 PolarHBondContact O-N 3.5Å; N247-L249 VanDerWaalsContact C-N 3.34Å; N247-L249 PolarHBondContact O-N 2.97Å; L249-K253 HydrophobicContact CD1-CD 4.27Å; L249-K253 HydrophobicContact CD1-CG 4.25Å; L249-K253 HydrophobicContact CG-CD 4.24Å; L249-K253 WeakPolarHBondContact O-CB 3.26Å; L249-K253 VanDerWaalsContact O-CG 3.29Å; L249-K253 WeakPolarHBondContact O-CG 3.27Å; L249-K253 PolarHBondContact O-N 2.84Å
250	K	96	Very high	94.4	Very high	120 Å²	120	71 Å²	71	52%	0.522	38%	0.381	S	S	.	.	H	α-helix	trans	-62.1	-51.7	177.4	-177.9	-176.3	170.1	-172.5	0	111.5	K246 N247 V248 V252 K253 E254	K246-K250 WeakPolarHBondContact O-CB 3.42Å; K246-K250 PolarHBondContact O-N 2.92Å; N247-K250 WeakPolarHBondContact O-CB 3.49Å; N247-K250 PolarHBondContact O-N 3Å; V248-K250 VanDerWaalsContact C-N 3.28Å; V248-K250 PolarHBondContact O-N 3.44Å; K250-V252 VanDerWaalsContact C-N 3.34Å; K250-V252 PolarHBondContact O-N 2.7Å; K250-K253 PolarHBondContact O-N 3.02Å; K250-E254 WeakPolarHBondContact CE-OE1 3.38Å; K250-E254 IonicContact NZ-OE1 3.97Å; K250-E254 WeakPolarHBondContact O-CG 3.36Å; K250-E254 PolarHBondContact O-N 3.26Å
251	H	94.9	Very high	94.3	Very high	121 Å²	121	74.4 Å²	74.4	56%	0.56	39%	0.392	S	S	*	.	H	α-helix	trans	-62.3	-42.2	-179.4	-68.2	90.8	0	0	0	111.7	N247 V248 K253 E254 F255	N247-H251 PolarHBondContact O-N 3.26Å; N247-H251 VanDerWaalsContact O-N 3.09Å; N247-H251 PolarHBondContact O-ND1 3.01Å; V248-H251 PolarHBondContact O-N 3.38Å; H251-K253 PolarHBondContact O-N 2.9Å; H251-E254 PolarHBondContact O-N 2.91Å; H251-F255 WeakPolarHBondContact O-CB 3.47Å; H251-F255 PolarHBondContact O-N 2.85Å
252	V	96.8	Very high	94.2	Very high	6 Å²	6	78.4 Å²	78.4	4%	0.036	41%	0.411	C	S	.	.	H	α-helix	trans	-64.3	-41.1	177.6	174.8	0	0	0	0	111.1	P211 A237 L238 A241 V248 K250 F255 C256	P211-V252 HydrophobicContact CB-CG2 4.02Å; A237-V252 HydrophobicContact CB-CG1 3.82Å; L238-V252 HydrophobicContact CB-CG1 4.12Å; L238-V252 HydrophobicContact CD1-CG1 4.22Å; A241-V252 HydrophobicContact CB-CB 4.2Å; A241-V252 HydrophobicContact CB-CG1 4.38Å; A241-V252 HydrophobicContact CB-CG2 4.05Å; V248-V252 HydrophobicContact CG1-CG2 4.18Å; V248-V252 VanDerWaalsContact O-CG2 3.29Å; V248-V252 WeakPolarHBondContact O-CG2 3.32Å; V248-V252 PolarHBondContact O-N 3.47Å; K250-V252 VanDerWaalsContact C-N 3.34Å; K250-V252 PolarHBondContact O-N 2.7Å; V252-F255 PolarHBondContact O-N 3.29Å; V252-C256 WeakPolarHBondContact O-CB 3.48Å; V252-C256 PolarHBondContact O-N 3.03Å; V252-C256 PolarHBondContact O-SG 2.92Å
253	K	97.3	Very high	94.1	Very high	101 Å²	101	77.4 Å²	77.4	44%	0.439	40%	0.395	S	S	.	.	H	α-helix	trans	-60.6	-47.9	174.4	-80.2	177.9	177.6	179	0	112.2	L238 L249 K250 H251 F255 C256 D257	L238-K253 HydrophobicContact CD1-CD 4.49Å; L238-K253 HydrophobicContact CD1-CG 3.46Å; L238-K253 VanDerWaalsContact CD1-CG 3.46Å; L249-K253 HydrophobicContact CD1-CD 4.27Å; L249-K253 HydrophobicContact CD1-CG 4.25Å; L249-K253 HydrophobicContact CG-CD 4.24Å; L249-K253 WeakPolarHBondContact O-CB 3.26Å; L249-K253 VanDerWaalsContact O-CG 3.29Å; L249-K253 WeakPolarHBondContact O-CG 3.27Å; L249-K253 PolarHBondContact O-N 2.84Å; K250-K253 PolarHBondContact O-N 3.02Å; H251-K253 PolarHBondContact O-N 2.9Å; K253-F255 VanDerWaalsContact C-N 3.29Å; K253-F255 PolarHBondContact O-N 3.01Å; K253-C256 PolarHBondContact O-N 2.98Å; K253-D257 WeakPolarHBondContact O-CB 3.4Å; K253-D257 VanDerWaalsContact O-CG 3.28Å; K253-D257 PolarHBondContact O-N 2.96Å
254	E	97.1	Very high	94.1	Very high	103 Å²	103	77 Å²	77	48%	0.481	39%	0.385	S	S	.	.	H	α-helix	trans	-59.2	-42.2	178.5	-72.4	172.3	179.3	0	0	111.5	K250 H251 S258	K250-E254 WeakPolarHBondContact CE-OE1 3.38Å; K250-E254 IonicContact NZ-OE1 3.97Å; K250-E254 WeakPolarHBondContact O-CG 3.36Å; K250-E254 PolarHBondContact O-N 3.26Å; H251-E254 PolarHBondContact O-N 2.91Å; E254-S258 WeakPolarHBondContact O-CB 3.43Å; E254-S258 PolarHBondContact O-N 3.15Å
255	F	97.1	Very high	94.2	Very high	46 Å²	46	81.9 Å²	81.9	20%	0.202	39%	0.392	C	S	.	.	H	α-helix	trans	-61.4	-52.3	174	175.4	-97.3	0	0	0	112.4	C215 A218 E219 A234 H251 V252 K253 D257 S258 L259	C215-F255 HydrophobicContact CB-CD1 4.12Å; C215-F255 HydrophobicContact CB-CE1 3.99Å; C215-F255 HydrophobicContact CB-CZ 4.28Å; C215-F255 VanDerWaalsContact O-CZ 3.28Å; C215-F255 WeakPolarHBondContact O-CZ 3.44Å; A218-F255 HydrophobicContact CB-CE1 3.86Å; A218-F255 HydrophobicContact CB-CZ 4Å; E219-F255 HydrophobicContact CB-CE2 4.17Å; E219-F255 HydrophobicContact CB-CZ 4.11Å; A234-F255 HydrophobicContact CB-CE1 4.19Å; H251-F255 WeakPolarHBondContact O-CB 3.47Å; H251-F255 PolarHBondContact O-N 2.85Å; V252-F255 PolarHBondContact O-N 3.29Å; K253-F255 VanDerWaalsContact C-N 3.29Å; K253-F255 PolarHBondContact O-N 3.01Å; F255-D257 VanDerWaalsContact C-N 3.32Å; F255-D257 PolarHBondContact O-N 3.08Å; F255-S258 WeakPolarHBondContact O-CB 2.92Å; F255-S258 PolarHBondContact O-N 3.44Å; F255-S258 VanDerWaalsContact O-N 3.14Å; F255-L259 HydrophobicContact CD1-CD1 4.24Å; F255-L259 HydrophobicContact CE1-CD1 3.5Å; F255-L259 HydrophobicContact CE1-CG 4.3Å; F255-L259 HydrophobicContact CE2-CD1 4.43Å; F255-L259 HydrophobicContact CZ-CD1 3.63Å; F255-L259 HydrophobicContact CZ-CG 4.22Å; F255-L259 PolarHBondContact O-N 3.21Å; F255-L259 VanDerWaalsContact O-N 3.11Å
256	C	96	Very high	93.7	Very high	2 Å²	2	80 Å²	80	1%	0.014	39%	0.386	C	S	.	.	H	α-helix	trans	-59.9	-41.8	179.6	-67.4	0	0	0	0	112.3	A234 V252 K253 S258 L259 R260	A234-C256 PolarHBondContact O-SG 2.74Å; V252-C256 WeakPolarHBondContact O-CB 3.48Å; V252-C256 PolarHBondContact O-N 3.03Å; V252-C256 PolarHBondContact O-SG 2.92Å; K253-C256 PolarHBondContact O-N 2.98Å; C256-S258 VanDerWaalsContact C-N 3.31Å; C256-S258 PolarHBondContact O-N 3.45Å; C256-L259 PolarHBondContact O-N 3.45Å; C256-R260 WeakPolarHBondContact O-CG 3.45Å; C256-R260 PolarHBondContact O-N 3.47Å
257	D	96.1	Very high	93	Very high	75 Å²	75	75.3 Å²	75.3	40%	0.401	38%	0.376	S	S	.	.	H	α-helix	trans	-66.5	-34.6	178.1	-73.1	-15.3	0	0	0	111.7	K253 F255 K261	K253-D257 WeakPolarHBondContact O-CB 3.4Å; K253-D257 VanDerWaalsContact O-CG 3.28Å; K253-D257 PolarHBondContact O-N 2.96Å; F255-D257 VanDerWaalsContact C-N 3.32Å; F255-D257 PolarHBondContact O-N 3.08Å; D257-K261 WeakPolarHBondContact O-CB 3.19Å; D257-K261 VanDerWaalsContact O-CG 3.23Å; D257-K261 WeakPolarHBondContact O-CG 3.2Å; D257-K261 PolarHBondContact O-N 3.01Å
258	S	95.9	Very high	92.1	Very high	58 Å²	58	74.4 Å²	74.4	41%	0.406	38%	0.378	S	S	.	.	H	α-helix	trans	-61.5	-51.7	173.4	-165.9	0	0	0	0	111.3	E254 F255 C256 R260 K261 E262	E254-S258 WeakPolarHBondContact O-CB 3.43Å; E254-S258 PolarHBondContact O-N 3.15Å; F255-S258 WeakPolarHBondContact O-CB 2.92Å; F255-S258 PolarHBondContact O-N 3.44Å; F255-S258 VanDerWaalsContact O-N 3.14Å; C256-S258 VanDerWaalsContact C-N 3.31Å; C256-S258 PolarHBondContact O-N 3.45Å; S258-R260 VanDerWaalsContact C-N 3.34Å; S258-R260 PolarHBondContact O-N 2.99Å; S258-K261 PolarHBondContact O-N 3.23Å; S258-E262 PolarHBondContact O-N 3.36Å
259	L	95.1	Very high	90.4	Very high	10 Å²	10	74.8 Å²	74.8	5%	0.052	39%	0.393	C	S	.	.	H	α-helix	trans	-59.3	-43.3	178.3	-68	-177.5	0	0	0	112.3	A218 W222 L231 A234 F255 C256 K261 E262 M263	A218-L259 HydrophobicContact CB-CD1 4.38Å; W222-L259 HydrophobicContact CB-CD2 4.38Å; W222-L259 HydrophobicContact CD2-CD2 3.69Å; W222-L259 HydrophobicContact CE3-CD2 3.84Å; W222-L259 HydrophobicContact CG-CD2 3.93Å; W222-L259 VanDerWaalsContact CH2-O 3.29Å; W222-L259 WeakPolarHBondContact CH2-O 3.43Å; W222-L259 HydrophobicContact CZ3-CB 4.31Å; W222-L259 HydrophobicContact CZ3-CD2 4.34Å; L231-L259 HydrophobicContact CD2-CB 3.99Å; A234-L259 HydrophobicContact CB-CD1 4.04Å; F255-L259 HydrophobicContact CD1-CD1 4.24Å; F255-L259 HydrophobicContact CE1-CD1 3.5Å; F255-L259 HydrophobicContact CE1-CG 4.3Å; F255-L259 HydrophobicContact CE2-CD1 4.43Å; F255-L259 HydrophobicContact CZ-CD1 3.63Å; F255-L259 HydrophobicContact CZ-CG 4.22Å; F255-L259 PolarHBondContact O-N 3.21Å; F255-L259 VanDerWaalsContact O-N 3.11Å; C256-L259 PolarHBondContact O-N 3.45Å; L259-K261 PolarHBondContact O-N 3.4Å; L259-E262 PolarHBondContact O-N 3.14Å; L259-M263 PolarHBondContact O-N 3Å
260	R	94.2	Very high	88.2	Confident	89 Å²	89	76.4 Å²	76.4	34%	0.336	42%	0.417	S	S	.	.	H	α-helix	trans	-62.9	-40.6	177.6	-73.6	171.8	175.1	166.1	-3.4	112.3	L231 E235 C256 S258 M263 N264	L231-R260 HydrophobicContact CD2-CG 4.02Å; E235-R260 IonicContact OE1-NH2 3.97Å; E235-R260 PolarHBondContact OE1-NH2 3.47Å; C256-R260 WeakPolarHBondContact O-CG 3.45Å; C256-R260 PolarHBondContact O-N 3.47Å; S258-R260 VanDerWaalsContact C-N 3.34Å; S258-R260 PolarHBondContact O-N 2.99Å; R260-M263 PolarHBondContact O-N 3.13Å; R260-N264 PolarHBondContact O-N 2.94Å; R260-N264 VanDerWaalsContact O-N 3.12Å; R260-N264 PolarHBondContact O-ND2 2.8Å
261	K	94.3	Very high	85.7	Confident	135 Å²	135	75.6 Å²	75.6	59%	0.587	43%	0.427	S	S	*	.	H	α-helix	trans	-63.6	-43.3	175.6	-75.6	169.6	-174	171.2	0	111.6	D257 S258 L259 M263 N264 K265	D257-K261 WeakPolarHBondContact O-CB 3.19Å; D257-K261 VanDerWaalsContact O-CG 3.23Å; D257-K261 WeakPolarHBondContact O-CG 3.2Å; D257-K261 PolarHBondContact O-N 3.01Å; S258-K261 PolarHBondContact O-N 3.23Å; L259-K261 PolarHBondContact O-N 3.4Å; K261-M263 VanDerWaalsContact C-N 3.34Å; K261-N264 PolarHBondContact O-N 3.44Å; K261-K265 WeakPolarHBondContact O-CG 3.37Å; K261-K265 PolarHBondContact O-N 3.36Å; K261-K265 VanDerWaalsContact O-N 3.1Å
262	E	92.9	Very high	82.9	Confident	86 Å²	86	82.6 Å²	82.6	40%	0.402	46%	0.456	S	S	.	.	H	α-helix	trans	-65.7	-37.1	177	-68	-171.7	176.2	0	0	112.5	W222 S258 L259 N264 K265 S266	W222-E262 HydrophobicContact CH2-CB 4.1Å; W222-E262 HydrophobicContact CZ2-CB 3.51Å; W222-E262 WeakPolarHBondContact CZ2-OE2 3.15Å; W222-E262 PolarHBondContact NE1-OE2 3.11Å; S258-E262 PolarHBondContact O-N 3.36Å; L259-E262 PolarHBondContact O-N 3.14Å; E262-N264 PolarHBondContact O-N 3.05Å; E262-K265 PolarHBondContact O-N 3.49Å; E262-S266 PolarHBondContact O-N 3.23Å
263	M	92.1	Very high	82.3	Confident	46 Å²	46	86.5 Å²	86.5	23%	0.227	48%	0.476	C	S	.	.	H	α-helix	trans	-58.3	-50.4	174.1	-173	67.4	89.7	0	0	111	W222 K227 L231 L259 R260 K261 K265 S266 S267	W222-M263 HydrophobicContact CH2-CB 3.95Å; W222-M263 HydrophobicContact CH2-CE 4.35Å; W222-M263 HydrophobicContact CH2-SD 4.42Å; W222-M263 HydrophobicContact CZ3-CE 4.02Å; K227-M263 HydrophobicContact CB-CE 3.39Å; K227-M263 HydrophobicContact CB-SD 4.17Å; K227-M263 HydrophobicContact CD-CE 4.2Å; K227-M263 HydrophobicContact CD-SD 3.9Å; K227-M263 HydrophobicContact CG-CE 4.45Å; L231-M263 HydrophobicContact CD1-CE 3.47Å; L231-M263 VanDerWaalsContact CD1-CE 3.47Å; L231-M263 HydrophobicContact CD1-CG 4.47Å; L231-M263 HydrophobicContact CG-CE 4.2Å; L259-M263 PolarHBondContact O-N 3Å; R260-M263 PolarHBondContact O-N 3.13Å; K261-M263 VanDerWaalsContact C-N 3.34Å; M263-K265 VanDerWaalsContact C-N 3.29Å; M263-K265 PolarHBondContact O-N 3.1Å; M263-S266 PolarHBondContact O-N 3.45Å; M263-S266 PolarHBondContact O-OG 3.34Å; M263-S267 PolarHBondContact O-N 3.3Å; M263-S267 PolarHBondContact O-OG 3.01Å
264	N	90.4	Very high	81.5	Confident	106 Å²	106	85.7 Å²	85.7	57%	0.567	48%	0.478	S	S	*	.	H	α-helix	trans	-64.3	-32.1	-179.3	-69.4	-16.3	0	0	0	113	R260 K261 E262 S267 S268	R260-N264 PolarHBondContact O-N 2.94Å; R260-N264 VanDerWaalsContact O-N 3.12Å; R260-N264 PolarHBondContact O-ND2 2.8Å; K261-N264 PolarHBondContact O-N 3.44Å; E262-N264 PolarHBondContact O-N 3.05Å; N264-S267 WeakPolarHBondContact CA-OG 3.16Å; N264-S267 PolarHBondContact O-OG 3.34Å; N264-S268 PolarHBondContact O-N 3.44Å; N264-S268 PolarHBondContact O-OG 2.83Å
265	K	88.3	Confident	80.6	Confident	150 Å²	150	84.7 Å²	84.7	65%	0.652	48%	0.478	S	S	*	.	H	α-helix	trans	-66.6	-40.7	171.7	-72.9	175.8	-178.2	178.2	0	111.6	K261 E262 M263 S268 G269	K261-K265 WeakPolarHBondContact O-CG 3.37Å; K261-K265 PolarHBondContact O-N 3.36Å; K261-K265 VanDerWaalsContact O-N 3.1Å; E262-K265 PolarHBondContact O-N 3.49Å; M263-K265 VanDerWaalsContact C-N 3.29Å; M263-K265 PolarHBondContact O-N 3.1Å; K265-S268 WeakPolarHBondContact CA-OG 3.26Å; K265-S268 PolarHBondContact O-N 3.34Å; K265-S268 PolarHBondContact O-OG 2.67Å; K265-G269 PolarHBondContact O-N 3.32Å
266	S	80.5	Confident	79.6	Confident	55 Å²	55	87 Å²	87	39%	0.385	50%	0.495	S	S	.	.	H	α-helix	trans	-69.8	-30.9	179.2	67.4	0	0	0	0	113.7	K227 E262 M263	K227-S266 PolarHBondContact NZ-OG 2.95Å; E262-S266 PolarHBondContact O-N 3.23Å; M263-S266 PolarHBondContact O-N 3.45Å; M263-S266 PolarHBondContact O-OG 3.34Å
267	S	77.8	Confident	78.6	Confident	82 Å²	82	92.3 Å²	92.3	57%	0.573	53%	0.525	S	S	*	.	H	α-helix	trans	-76.2	-33.6	174.9	56.4	0	0	0	0	113.2	M263 N264	M263-S267 PolarHBondContact O-N 3.3Å; M263-S267 PolarHBondContact O-OG 3.01Å; N264-S267 WeakPolarHBondContact CA-OG 3.16Å; N264-S267 PolarHBondContact O-OG 3.34Å
268	S	73.5	Confident	77.4	Confident	85 Å²	85	93.5 Å²	93.5	59%	0.594	53%	0.533	S	S	*	.	H	α-helix	trans	-78.6	-29.4	177	50	0	0	0	0	113.8	N264 K265	N264-S268 PolarHBondContact O-N 3.44Å; N264-S268 PolarHBondContact O-OG 2.83Å; K265-S268 WeakPolarHBondContact CA-OG 3.26Å; K265-S268 PolarHBondContact O-N 3.34Å; K265-S268 PolarHBondContact O-OG 2.67Å
269	G	56.2	Low	76.1	Confident	61 Å²	61	96 Å²	96	63%	0.629	54%	0.542	S	S	*	.	H	α-helix	trans	-74.9	-17	178.5	0	0	0	0	0	115.6	K265 S271	K265-G269 PolarHBondContact O-N 3.32Å; G269-S271 VanDerWaalsContact C-N 3.33Å
270	G	50.7	Low	74.7	Confident	67 Å²	67	102.6 Å²	102.6	69%	0.691	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	6.3	-179.8	0	0	0	0	0	115.1
271	S	42.2	Very low	73	Confident	104 Å²	104	103.8 Å²	103.8	73%	0.727	60%	0.6	S	S	*	*			trans	-107.8	27.1	-176.3	-174.5	0	0	0	0	114.2	G269	G269-S271 VanDerWaalsContact C-N 3.33Å
272	K	37.5	Very low	71.1	Confident	268 Å²	268	100.9 Å²	100.9	100%	1.165	60%	0.601	S	S	*	*			trans	-128	0	168.4	-77.3	-172.3	177.4	-177.8	0	109.7

Retrieved 272 of 272 residues in 1210.2 ms (Link to these results)

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