A0A087X6P3_POEFO Loading...

Neurochondrin

AlphaFold DB , UniProt , Accession A0A087X6P3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 722 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	42.5	Very low	34.8	Very low	233 Å²	233	158.5 Å²	158.5	100%	1.148	74%	0.742	S	S	*	*				0	22.1	0	-84.7	172	105.1	0	0	114.8
2	K	37.2	Very low	35	Very low	189 Å²	189	153.8 Å²	153.8	82%	0.822	73%	0.732	S	S	*	*			trans	-110.6	-9.5	173.1	-91.2	-176.7	173.7	-177.9	0	115.3
3	R	33.2	Very low	35.9	Very low	220 Å²	220	146.5 Å²	146.5	83%	0.83	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-4.6	176	-90.7	-176.2	175.6	-179.6	-1.8	115.3
4	S	36	Very low	37	Very low	86 Å²	86	142.5 Å²	142.5	60%	0.601	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-4	-176.8	-48.6	0	0	0	0	113.9	Q8	S4-Q8 PolarHBondContact O-OE1 2.92Å
5	R	33.9	Very low	38.1	Very low	210 Å²	210	142.6 Å²	142.6	79%	0.792	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-30.5	175.3	-91.4	-177.3	171.8	177.5	-3.2	113.2	Q8	R5-Q8 PolarHBondContact O-N 3.46Å
6	E	33.1	Very low	39.5	Very low	148 Å²	148	137 Å²	137	69%	0.692	67%	0.67	S	S	*	*	H	α-helix	trans	-74.9	-28.3	178.2	-74	170	168.4	0	0	113.2	Q8	E6-Q8 VanDerWaalsContact C-N 3.28Å; E6-Q8 PolarHBondContact O-N 3.33Å
7	Q	31.3	Very low	40.7	Very low	159 Å²	159	132.8 Å²	132.8	74%	0.743	65%	0.645	S	S	*	*	H	α-helix	trans	-80.2	-6.9	173.5	-72.9	-175.3	-18.2	0	0	114
8	Q	33.3	Very low	42.1	Very low	139 Å²	139	133.2 Å²	133.2	65%	0.65	65%	0.645	S	S	*	*	H	α-helix	trans	-100.3	-13.3	-177.2	-144.6	157	10.8	0	0	112.8	S4 R5 E6 V12	S4-Q8 PolarHBondContact O-OE1 2.92Å; R5-Q8 PolarHBondContact O-N 3.46Å; E6-Q8 VanDerWaalsContact C-N 3.28Å; E6-Q8 PolarHBondContact O-N 3.33Å; Q8-V12 VanDerWaalsContact O-CG2 3.28Å; Q8-V12 WeakPolarHBondContact O-CG2 3.45Å
9	E	33.7	Very low	43.6	Very low	163 Å²	163	136.3 Å²	136.3	76%	0.762	65%	0.649	S	S	*	*	H	α-helix	trans	-88	-30.4	171.7	-80.1	-180	155.4	0	0	113.1	G11	E9-G11 PolarHBondContact O-N 3.22Å
10	E	34.8	Very low	45	Very low	159 Å²	159	129.9 Å²	129.9	74%	0.743	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-27.1	173	-78.2	-175	150.3	0	0	113.3
11	G	33.8	Very low	46.4	Very low	37 Å²	37	124.6 Å²	124.6	38%	0.381	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.3	-9.8	-176.8	0	0	0	0	0	116.2	E9	E9-G11 PolarHBondContact O-N 3.22Å
12	V	37.7	Very low	48.1	Very low	102 Å²	102	118.4 Å²	118.4	62%	0.618	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-26	-174.9	174.8	0	0	0	0	112.3	Q8 P16	Q8-V12 VanDerWaalsContact O-CG2 3.28Å; Q8-V12 WeakPolarHBondContact O-CG2 3.45Å; V12-P16 VanDerWaalsContact O-CD 3.29Å; V12-P16 WeakPolarHBondContact O-CD 3.24Å
13	S	46.8	Very low	50	Low	59 Å²	59	111.7 Å²	111.7	41%	0.413	54%	0.543	S	S	.	.	S	Bend	trans	-80.8	-21	178.8	-172.1	0	0	0	0	114.2	P16 R17	S13-P16 WeakPolarHBondContact O-CD 3.34Å; S13-R17 WeakPolarHBondContact O-CD 3.43Å; S13-R17 WeakPolarHBondContact O-CG 3.44Å
14	V	51	Low	52.3	Low	91 Å²	91	101.4 Å²	101.4	55%	0.552	50%	0.504	S	S	*	.	H	α-helix	trans	-81.5	-32.2	-175.3	-177.5	0	0	0	0	113.2	R17 H18	V14-R17 PolarHBondContact O-N 3.49Å; V14-H18 PolarHBondContact O-N 3Å
15	K	53.3	Low	54.5	Low	144 Å²	144	104.3 Å²	104.3	63%	0.626	50%	0.502	S	S	*	.	H	α-helix	trans	-67.9	-39.5	-176.4	-72.4	178.9	179.8	174.7	0	114.9	R19	K15-R19 WeakPolarHBondContact O-CG 3.29Å; K15-R19 PolarHBondContact O-N 3.06Å
16	P	60.3	Low	56.8	Low	53 Å²	53	99.8 Å²	99.8	34%	0.344	49%	0.49	S	S	.	.	H	α-helix	trans	-63.9	-43.1	174.4	-19.6	31	0	0	0	111.6	V12 S13 H18 R19 C20	V12-P16 VanDerWaalsContact O-CD 3.29Å; V12-P16 WeakPolarHBondContact O-CD 3.24Å; S13-P16 WeakPolarHBondContact O-CD 3.34Å; P16-H18 PolarHBondContact O-N 3.02Å; P16-R19 PolarHBondContact O-N 3.3Å; P16-C20 PolarHBondContact O-N 3.2Å; P16-C20 PolarHBondContact O-SG 3.35Å
17	R	59.7	Low	59.2	Low	65 Å²	65	94 Å²	94	25%	0.245	47%	0.467	C	S	.	.	H	α-helix	trans	-58.9	-49.3	-176.6	-68.2	173.9	-178.7	-167.6	-3.9	113	S13 V14 R19 C20 L21 C44 Q48	S13-R17 WeakPolarHBondContact O-CD 3.43Å; S13-R17 WeakPolarHBondContact O-CG 3.44Å; V14-R17 PolarHBondContact O-N 3.49Å; R17-R19 VanDerWaalsContact C-N 3.32Å; R17-R19 PolarHBondContact O-N 3.45Å; R17-C20 PolarHBondContact O-N 3.08Å; R17-L21 PolarHBondContact O-N 3.35Å; R17-C44 VanDerWaalsContact CG-SG 3.54Å; R17-Q48 PolarHBondContact NH2-O 2.87Å
18	H	66.8	Low	61.4	Low	141 Å²	141	95.5 Å²	95.5	65%	0.653	47%	0.471	S	S	*	.	H	α-helix	trans	-66.8	-32.8	179.5	-164.3	-75.5	0	0	0	112.5	V14 P16 H22	V14-H18 PolarHBondContact O-N 3Å; P16-H18 PolarHBondContact O-N 3.02Å; H18-H22 VanDerWaalsContact O-CB 3.24Å; H18-H22 WeakPolarHBondContact O-CB 3.49Å; H18-H22 PolarHBondContact O-N 3.26Å
19	R	69.3	Low	63.7	Low	191 Å²	191	92.4 Å²	92.4	72%	0.721	46%	0.459	S	S	*	.	H	α-helix	trans	-70.3	-39.4	175.9	-73.4	178	176.6	-177.2	-1.7	112.1	K15 P16 R17 H22 A23	K15-R19 WeakPolarHBondContact O-CG 3.29Å; K15-R19 PolarHBondContact O-N 3.06Å; P16-R19 PolarHBondContact O-N 3.3Å; R17-R19 VanDerWaalsContact C-N 3.32Å; R17-R19 PolarHBondContact O-N 3.45Å; R19-H22 PolarHBondContact O-N 3.33Å; R19-A23 WeakPolarHBondContact O-CB 3.32Å; R19-A23 PolarHBondContact O-N 3.46Å
20	C	72	Confident	66	Low	9 Å²	9	87.2 Å²	87.2	6%	0.061	44%	0.436	C	S	.	.	H	α-helix	trans	-68.5	-43	177.4	-59.3	0	0	0	0	112.3	P16 R17 H22 A23 L24 I40	P16-C20 PolarHBondContact O-N 3.2Å; P16-C20 PolarHBondContact O-SG 3.35Å; R17-C20 PolarHBondContact O-N 3.08Å; C20-H22 VanDerWaalsContact C-N 3.34Å; C20-H22 PolarHBondContact O-N 3.33Å; C20-A23 PolarHBondContact O-N 2.94Å; C20-L24 PolarHBondContact O-N 3.4Å; C20-I40 HydrophobicContact CB-CD1 4.26Å; C20-I40 HydrophobicContact CB-CG1 3.5Å; C20-I40 VanDerWaalsContact CB-CG1 3.5Å
21	L	74.3	Confident	68.2	Low	19 Å²	19	83.9 Å²	83.9	10%	0.099	43%	0.431	C	S	.	.	H	α-helix	trans	-62.9	-39.4	173.2	-83.4	169.1	0	0	0	112.3	R17 L24 R25 T53 Q56 V57	R17-L21 PolarHBondContact O-N 3.35Å; L21-L24 PolarHBondContact O-N 3Å; L21-R25 WeakPolarHBondContact O-CG 3.39Å; L21-R25 PolarHBondContact O-N 3.48Å; L21-T53 HydrophobicContact CD1-CG2 4.18Å; L21-Q56 HydrophobicContact CD2-CB 4.25Å; L21-V57 HydrophobicContact CD2-CB 4.5Å; L21-V57 HydrophobicContact CD2-CG2 3.62Å
22	H	77.8	Confident	70.5	Confident	102 Å²	102	86.4 Å²	86.4	47%	0.472	43%	0.432	S	S	.	.	H	α-helix	trans	-62.1	-45.9	174	-176.9	-76.4	0	0	0	111.5	H18 R19 C20 L24 R25 H26	H18-H22 VanDerWaalsContact O-CB 3.24Å; H18-H22 WeakPolarHBondContact O-CB 3.49Å; H18-H22 PolarHBondContact O-N 3.26Å; R19-H22 PolarHBondContact O-N 3.33Å; C20-H22 VanDerWaalsContact C-N 3.34Å; C20-H22 PolarHBondContact O-N 3.33Å; H22-L24 VanDerWaalsContact C-N 3.32Å; H22-L24 PolarHBondContact O-N 2.96Å; H22-R25 PolarHBondContact O-N 3.2Å; H22-H26 AromaticContact CD2-CE1 3.67Å; H22-H26 AromaticContact CE1-CD2 3.92Å; H22-H26 AromaticContact CE1-CE1 3.59Å; H22-H26 AromaticContact CE1-CG 3.87Å; H22-H26 AromaticContact CE1-ND1 3.66Å; H22-H26 AromaticContact CE1-NE2 3.75Å; H22-H26 AromaticContact CG-ND1 3.99Å; H22-H26 AromaticContact ND1-ND1 3.76Å; H22-H26 AromaticContact NE2-CE1 3.36Å; H22-H26 PolarHBondContact NE2-CE1 3.33Å; H22-H26 AromaticContact NE2-ND1 3.86Å; H22-H26 AromaticContact NE2-NE2 3.6Å; H22-H26 PolarHBondContact O-N 2.92Å; H22-H26 VanDerWaalsContact O-N 3.14Å; H22-H26 PolarHBondContact O-ND1 3.16Å
23	A	79.1	Confident	72.7	Confident	48 Å²	48	82.2 Å²	82.2	40%	0.397	41%	0.407	S	S	.	.	H	α-helix	trans	-60.7	-40.4	176.5	0	0	0	0	0	112.2	R19 C20 H26 A27 A36	R19-A23 WeakPolarHBondContact O-CB 3.32Å; R19-A23 PolarHBondContact O-N 3.46Å; C20-A23 PolarHBondContact O-N 2.94Å; A23-H26 PolarHBondContact O-N 3.17Å; A23-A27 PolarHBondContact O-N 3.3Å; A23-A36 HydrophobicContact CB-CB 4.46Å
24	L	81.6	Confident	74.3	Confident	4 Å²	4	80.8 Å²	80.8	2%	0.021	40%	0.395	C	S	.	.	H	α-helix	trans	-65.1	-44.4	177.4	-171.2	65.3	0	0	0	112.1	C20 L21 H22 H26 A27 T33 A36 L37 I40 V57 A60 V61	C20-L24 PolarHBondContact O-N 3.4Å; L21-L24 PolarHBondContact O-N 3Å; H22-L24 VanDerWaalsContact C-N 3.32Å; H22-L24 PolarHBondContact O-N 2.96Å; L24-H26 VanDerWaalsContact C-N 3.26Å; L24-H26 PolarHBondContact O-N 3.48Å; L24-A27 WeakPolarHBondContact O-CB 3.43Å; L24-A27 PolarHBondContact O-N 3.14Å; L24-T33 HydrophobicContact CD1-CG2 3.81Å; L24-A36 HydrophobicContact CB-CB 4.2Å; L24-A36 HydrophobicContact CD1-CB 3.91Å; L24-L37 HydrophobicContact CD1-CD2 4.33Å; L24-L37 HydrophobicContact CD1-CG 3.91Å; L24-L37 HydrophobicContact CD2-CD2 4.4Å; L24-I40 HydrophobicContact CB-CD1 4.22Å; L24-I40 HydrophobicContact CD2-CD1 3.79Å; L24-I40 HydrophobicContact CG-CD1 4.48Å; L24-V57 HydrophobicContact CD2-CG1 4.02Å; L24-A60 HydrophobicContact CB-CB 4.45Å; L24-A60 HydrophobicContact CD2-CB 3.57Å; L24-A60 HydrophobicContact CG-CB 3.78Å; L24-V61 HydrophobicContact CD1-CG2 4.3Å; L24-V61 HydrophobicContact CD2-CG2 3.98Å
25	R	81.3	Confident	75.8	Confident	147 Å²	147	79.3 Å²	79.3	56%	0.555	39%	0.392	S	S	*	.	H	α-helix	trans	-67.2	-23.7	178	-74.2	-179.7	175.9	169.3	0	114.2	L21 H22 A60	L21-R25 WeakPolarHBondContact O-CG 3.39Å; L21-R25 PolarHBondContact O-N 3.48Å; H22-R25 PolarHBondContact O-N 3.2Å; R25-A60 HydrophobicContact CG-CB 3.96Å
26	H	81.1	Confident	77.2	Confident	116 Å²	116	72.9 Å²	72.9	54%	0.537	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	7.7	-177.2	-66.2	67.1	0	0	0	112.9	H22 A23 L24 K28	H22-H26 AromaticContact CD2-CE1 3.67Å; H22-H26 AromaticContact CE1-CD2 3.92Å; H22-H26 AromaticContact CE1-CE1 3.59Å; H22-H26 AromaticContact CE1-CG 3.87Å; H22-H26 AromaticContact CE1-ND1 3.66Å; H22-H26 AromaticContact CE1-NE2 3.75Å; H22-H26 AromaticContact CG-ND1 3.99Å; H22-H26 AromaticContact ND1-ND1 3.76Å; H22-H26 AromaticContact NE2-CE1 3.36Å; H22-H26 PolarHBondContact NE2-CE1 3.33Å; H22-H26 AromaticContact NE2-ND1 3.86Å; H22-H26 AromaticContact NE2-NE2 3.6Å; H22-H26 PolarHBondContact O-N 2.92Å; H22-H26 VanDerWaalsContact O-N 3.14Å; H22-H26 PolarHBondContact O-ND1 3.16Å; A23-H26 PolarHBondContact O-N 3.17Å; L24-H26 VanDerWaalsContact C-N 3.26Å; L24-H26 PolarHBondContact O-N 3.48Å; H26-K28 PolarHBondContact O-N 3.43Å
27	A	83.5	Confident	78.2	Confident	26 Å²	26	71.3 Å²	71.3	22%	0.215	36%	0.355	C	S	.	.			trans	-64.1	128.5	174.3	0	0	0	0	0	110.2	A23 L24 Q32 T33	A23-A27 PolarHBondContact O-N 3.3Å; L24-A27 WeakPolarHBondContact O-CB 3.43Å; L24-A27 PolarHBondContact O-N 3.14Å; A27-Q32 HydrophobicContact CB-CB 3.84Å; A27-T33 WeakPolarHBondContact CB-OG1 3.41Å
28	K	78.4	Confident	79.2	Confident	191 Å²	191	73.5 Å²	73.5	83%	0.83	37%	0.371	S	S	*	.			trans	-94.6	-14.9	-177	-61.8	-176.3	179.8	-178.9	0	113.3	H26	H26-K28 PolarHBondContact O-N 3.43Å
29	N	81.7	Confident	79.8	Confident	74 Å²	74	71.2 Å²	71.2	40%	0.396	36%	0.363	S	S	.	.	S	Bend	trans	-148.3	168.1	-179.2	62.2	32.4	0	0	0	111.6	S31 Q32 T33	N29-S31 VanDerWaalsContact C-N 3.29Å; N29-S31 PolarHBondContact O-N 3Å; N29-S31 PolarHBondContact OD1-N 3.19Å; N29-Q32 PolarHBondContact O-N 3.23Å; N29-Q32 VanDerWaalsContact OD1-CB 3.31Å; N29-Q32 WeakPolarHBondContact OD1-CB 3.48Å; N29-Q32 WeakPolarHBondContact OD1-CG 3.31Å; N29-Q32 PolarHBondContact OD1-N 3.23Å; N29-T33 PolarHBondContact O-N 3.01Å; N29-T33 PolarHBondContact O-OG1 2.95Å
30	D	81.5	Confident	80.3	Confident	53 Å²	53	62.7 Å²	62.7	28%	0.283	33%	0.331	S	S	.	.	H	α-helix	trans	-61.5	-37.5	-175.3	-69.3	-1.4	0	0	0	111.7	T33 L34 L65 R68	D30-T33 WeakPolarHBondContact O-CB 3.25Å; D30-T33 PolarHBondContact O-N 3.04Å; D30-L34 WeakPolarHBondContact O-CG 3.14Å; D30-L34 PolarHBondContact O-N 3.31Å; D30-L65 HydrophobicContact CB-CD1 3.52Å; D30-R68 VanDerWaalsContact CG-NH2 3.3Å; D30-R68 IonicContact OD1-CZ 2.92Å; D30-R68 IonicContact OD1-NE 2.72Å; D30-R68 IonicContact OD1-NH2 3.38Å; D30-R68 PolarHBondContact OD1-NH2 3.12Å; D30-R68 IonicContact OD2-CZ 2.82Å; D30-R68 IonicContact OD2-NE 2.87Å; D30-R68 PolarHBondContact OD2-NE 3.15Å; D30-R68 IonicContact OD2-NH2 2.68Å; D30-R68 PolarHBondContact OD2-NH2 2.6Å
31	S	81.2	Confident	80.4	Confident	89 Å²	89	66.5 Å²	66.5	62%	0.622	35%	0.354	S	S	*	.	H	α-helix	trans	-63.4	-42.4	176.3	-50.4	0	0	0	0	113	N29 T33 L34 A35	N29-S31 VanDerWaalsContact C-N 3.29Å; N29-S31 PolarHBondContact O-N 3Å; N29-S31 PolarHBondContact OD1-N 3.19Å; S31-T33 VanDerWaalsContact C-N 3.32Å; S31-L34 PolarHBondContact O-N 2.58Å; S31-A35 WeakPolarHBondContact O-CB 3.15Å; S31-A35 PolarHBondContact O-N 2.67Å
32	Q	82.2	Confident	80.5	Confident	90 Å²	90	76 Å²	76	42%	0.421	39%	0.389	S	S	.	.	H	α-helix	trans	-66.9	-36	175.1	-75.4	173.7	1.6	0	0	111.5	A27 N29 A36	A27-Q32 HydrophobicContact CB-CB 3.84Å; N29-Q32 PolarHBondContact O-N 3.23Å; N29-Q32 VanDerWaalsContact OD1-CB 3.31Å; N29-Q32 WeakPolarHBondContact OD1-CB 3.48Å; N29-Q32 WeakPolarHBondContact OD1-CG 3.31Å; N29-Q32 PolarHBondContact OD1-N 3.23Å; Q32-A36 WeakPolarHBondContact O-CB 3.41Å; Q32-A36 PolarHBondContact O-N 3.44Å
33	T	83.1	Confident	80.3	Confident	15 Å²	15	75.6 Å²	75.6	9%	0.092	39%	0.39	C	S	.	.	H	α-helix	trans	-65.7	-45.9	177.2	-51.6	0	0	0	0	110.7	L24 A27 N29 D30 S31 A36 L37 L65	L24-T33 HydrophobicContact CD1-CG2 3.81Å; A27-T33 WeakPolarHBondContact CB-OG1 3.41Å; N29-T33 PolarHBondContact O-N 3.01Å; N29-T33 PolarHBondContact O-OG1 2.95Å; D30-T33 WeakPolarHBondContact O-CB 3.25Å; D30-T33 PolarHBondContact O-N 3.04Å; S31-T33 VanDerWaalsContact C-N 3.32Å; T33-A36 PolarHBondContact O-N 3.14Å; T33-L37 HydrophobicContact CG2-CD1 4.36Å; T33-L37 WeakPolarHBondContact O-CB 3.49Å; T33-L37 WeakPolarHBondContact O-CG 3.37Å; T33-L37 PolarHBondContact O-N 2.96Å; T33-L65 HydrophobicContact CG2-CD2 3.73Å
34	L	82.1	Confident	79.8	Confident	29 Å²	29	73.8 Å²	73.8	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-65.4	-41.7	176.2	-69.6	175.8	0	0	0	112.5	D30 S31 A36 L37 L38 L65 L90 L94	D30-L34 WeakPolarHBondContact O-CG 3.14Å; D30-L34 PolarHBondContact O-N 3.31Å; S31-L34 PolarHBondContact O-N 2.58Å; L34-A36 PolarHBondContact O-N 3.36Å; L34-L37 HydrophobicContact CD2-CD1 4.38Å; L34-L37 PolarHBondContact O-N 2.9Å; L34-L38 WeakPolarHBondContact O-CG 3.42Å; L34-L38 PolarHBondContact O-N 3Å; L34-L65 HydrophobicContact CD2-CD2 4.08Å; L34-L65 HydrophobicContact CG-CD2 4.43Å; L34-L90 HydrophobicContact CD1-CD2 3.68Å; L34-L90 HydrophobicContact CD2-CD1 4.25Å; L34-L90 HydrophobicContact CD2-CD2 3.64Å; L34-L90 HydrophobicContact CD2-CG 4.17Å; L34-L90 HydrophobicContact CG-CD2 4.28Å; L34-L94 HydrophobicContact CD2-CD1 4.08Å
35	A	82	Confident	79	Confident	59 Å²	59	76.1 Å²	76.1	49%	0.488	39%	0.389	S	S	.	.	H	α-helix	trans	-62.6	-41.8	175.6	0	0	0	0	0	111.9	S31 L39	S31-A35 WeakPolarHBondContact O-CB 3.15Å; S31-A35 PolarHBondContact O-N 2.67Å; A35-L39 PolarHBondContact O-N 3.48Å; A35-L39 VanDerWaalsContact O-N 3.1Å
36	A	82.6	Confident	78.1	Confident	10 Å²	10	72.7 Å²	72.7	8%	0.083	39%	0.392	C	S	.	.	H	α-helix	trans	-64.6	-40.4	174.7	0	0	0	0	0	111.9	A23 L24 Q32 T33 L34 L39 I40	A23-A36 HydrophobicContact CB-CB 4.46Å; L24-A36 HydrophobicContact CB-CB 4.2Å; L24-A36 HydrophobicContact CD1-CB 3.91Å; Q32-A36 WeakPolarHBondContact O-CB 3.41Å; Q32-A36 PolarHBondContact O-N 3.44Å; T33-A36 PolarHBondContact O-N 3.14Å; L34-A36 PolarHBondContact O-N 3.36Å; A36-L39 WeakPolarHBondContact O-CB 3.2Å; A36-L39 PolarHBondContact O-N 3.26Å; A36-I40 VanDerWaalsContact O-CG1 3.31Å; A36-I40 WeakPolarHBondContact O-CG1 3.44Å; A36-I40 PolarHBondContact O-N 3.28Å
37	L	81.6	Confident	77.3	Confident	20 Å²	20	72.4 Å²	72.4	11%	0.105	40%	0.404	C	S	.	.	H	α-helix	trans	-63.1	-45.8	175.7	-81.6	166.4	0	0	0	113	L24 T33 L34 L39 I40 T41 V57 V61 L94	L24-L37 HydrophobicContact CD1-CD2 4.33Å; L24-L37 HydrophobicContact CD1-CG 3.91Å; L24-L37 HydrophobicContact CD2-CD2 4.4Å; T33-L37 HydrophobicContact CG2-CD1 4.36Å; T33-L37 WeakPolarHBondContact O-CB 3.49Å; T33-L37 WeakPolarHBondContact O-CG 3.37Å; T33-L37 PolarHBondContact O-N 2.96Å; L34-L37 HydrophobicContact CD2-CD1 4.38Å; L34-L37 PolarHBondContact O-N 2.9Å; L37-L39 PolarHBondContact O-N 2.95Å; L37-I40 WeakPolarHBondContact O-CB 3.26Å; L37-I40 PolarHBondContact O-N 3.47Å; L37-I40 VanDerWaalsContact O-N 3.12Å; L37-T41 WeakPolarHBondContact O-CG2 3.42Å; L37-T41 PolarHBondContact O-N 3.49Å; L37-T41 PolarHBondContact O-OG1 3.21Å; L37-V57 HydrophobicContact CD2-CG1 4.1Å; L37-V61 HydrophobicContact CD1-CG1 4.01Å; L37-V61 HydrophobicContact CD1-CG2 3.68Å; L37-V61 HydrophobicContact CD2-CG2 3.31Å; L37-V61 HydrophobicContact CG-CG2 3.83Å; L37-L94 HydrophobicContact CD1-CD2 4.09Å
38	L	80.3	Confident	76.4	Confident	111 Å²	111	76.5 Å²	76.5	58%	0.581	42%	0.418	S	S	*	.	H	α-helix	trans	-62.1	-34.1	176	-71.9	172.1	0	0	0	112.1	L34 T41 R42	L34-L38 WeakPolarHBondContact O-CG 3.42Å; L34-L38 PolarHBondContact O-N 3Å; L38-T41 WeakPolarHBondContact CA-OG1 3.38Å; L38-T41 PolarHBondContact O-OG1 3.38Å; L38-T41 VanDerWaalsContact O-OG1 3.13Å; L38-R42 WeakPolarHBondContact O-CB 3.36Å; L38-R42 WeakPolarHBondContact O-CG 3.5Å; L38-R42 PolarHBondContact O-N 3.12Å; L38-R42 VanDerWaalsContact O-N 3.14Å
39	L	80.1	Confident	76.1	Confident	93 Å²	93	68.9 Å²	68.9	49%	0.487	39%	0.386	S	S	.	.	H	α-helix	trans	-67.8	-40.8	174.5	-147.6	104.3	0	0	0	111.2	A35 A36 L37 L43	A35-L39 PolarHBondContact O-N 3.48Å; A35-L39 VanDerWaalsContact O-N 3.1Å; A36-L39 WeakPolarHBondContact O-CB 3.2Å; A36-L39 PolarHBondContact O-N 3.26Å; L37-L39 PolarHBondContact O-N 2.95Å; L39-L43 HydrophobicContact CD2-CD1 3.62Å; L39-L43 HydrophobicContact CG-CD1 3.85Å; L39-L43 VanDerWaalsContact O-CB 3.3Å; L39-L43 WeakPolarHBondContact O-CB 3.33Å; L39-L43 VanDerWaalsContact O-CG 3.23Å; L39-L43 WeakPolarHBondContact O-CG 3.43Å; L39-L43 PolarHBondContact O-N 3.36Å
40	I	77.9	Confident	75.7	Confident	12 Å²	12	68.4 Å²	68.4	6%	0.062	38%	0.384	C	S	.	.	H	α-helix	trans	-63.2	-49.7	176.1	-69.3	164.6	0	0	0	110.6	C20 L24 A36 L37 R42 L43 C44	C20-I40 HydrophobicContact CB-CD1 4.26Å; C20-I40 HydrophobicContact CB-CG1 3.5Å; C20-I40 VanDerWaalsContact CB-CG1 3.5Å; L24-I40 HydrophobicContact CB-CD1 4.22Å; L24-I40 HydrophobicContact CD2-CD1 3.79Å; L24-I40 HydrophobicContact CG-CD1 4.48Å; A36-I40 VanDerWaalsContact O-CG1 3.31Å; A36-I40 WeakPolarHBondContact O-CG1 3.44Å; A36-I40 PolarHBondContact O-N 3.28Å; L37-I40 WeakPolarHBondContact O-CB 3.26Å; L37-I40 PolarHBondContact O-N 3.47Å; L37-I40 VanDerWaalsContact O-N 3.12Å; I40-R42 VanDerWaalsContact C-N 3.27Å; I40-R42 PolarHBondContact O-N 3.42Å; I40-L43 PolarHBondContact O-N 3.33Å; I40-C44 PolarHBondContact O-N 2.9Å
41	T	74.1	Confident	75.4	Confident	88 Å²	88	70.4 Å²	70.4	54%	0.54	40%	0.4	S	S	.	.	H	α-helix	trans	-65.7	-29.2	-178	56.9	0	0	0	0	112.8	L37 L38	L37-T41 WeakPolarHBondContact O-CG2 3.42Å; L37-T41 PolarHBondContact O-N 3.49Å; L37-T41 PolarHBondContact O-OG1 3.21Å; L38-T41 WeakPolarHBondContact CA-OG1 3.38Å; L38-T41 PolarHBondContact O-OG1 3.38Å; L38-T41 VanDerWaalsContact O-OG1 3.13Å
42	R	77.3	Confident	75.2	Confident	218 Å²	218	68.7 Å²	68.7	82%	0.823	39%	0.391	S	S	*	.	H	α-helix	trans	-77.4	-38.9	174.2	-78.5	-177	163.9	-176.4	-2.8	114.1	L38 I40	L38-R42 WeakPolarHBondContact O-CB 3.36Å; L38-R42 WeakPolarHBondContact O-CG 3.5Å; L38-R42 PolarHBondContact O-N 3.12Å; L38-R42 VanDerWaalsContact O-N 3.14Å; I40-R42 VanDerWaalsContact C-N 3.27Å; I40-R42 PolarHBondContact O-N 3.42Å
43	L	72.8	Confident	74.9	Confident	95 Å²	95	65.6 Å²	65.6	50%	0.497	38%	0.378	S	S	.	.	H	α-helix	trans	-88.2	-20.7	-175.2	-66.5	172.5	0	0	0	113	L39 I40	L39-L43 HydrophobicContact CD2-CD1 3.62Å; L39-L43 HydrophobicContact CG-CD1 3.85Å; L39-L43 VanDerWaalsContact O-CB 3.3Å; L39-L43 WeakPolarHBondContact O-CB 3.33Å; L39-L43 VanDerWaalsContact O-CG 3.23Å; L39-L43 WeakPolarHBondContact O-CG 3.43Å; L39-L43 PolarHBondContact O-N 3.36Å; I40-L43 PolarHBondContact O-N 3.33Å
44	C	68.8	Low	74.6	Confident	10 Å²	10	67.3 Å²	67.3	7%	0.068	39%	0.386	C	S	.	.	S	Bend	trans	-141.8	96.7	-179.2	-68.5	0	0	0	0	109.5	R17 I40 L49	R17-C44 VanDerWaalsContact CG-SG 3.54Å; I40-C44 PolarHBondContact O-N 2.9Å; C44-L49 HydrophobicContact CB-CD1 4.46Å; C44-L49 HydrophobicContact CB-CD2 3.93Å; C44-L49 HydrophobicContact CB-CG 4.17Å
45	P	66	Low	74.5	Confident	52 Å²	52	71.7 Å²	71.7	34%	0.338	40%	0.4	S	S	.	.			trans	-56	145.8	173	-19.9	30	0	0	0	110.9	S47 Q48	P45-S47 PolarHBondContact O-N 3Å; P45-Q48 HydrophobicContact CB-CG 4.47Å; P45-Q48 HydrophobicContact CG-CG 4.47Å; P45-Q48 PolarHBondContact O-N 3.37Å
46	A	63	Low	74.5	Confident	75 Å²	75	72.6 Å²	72.6	62%	0.62	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-55	-28.8	-177.7	0	0	0	0	0	113.8	Q48	A46-Q48 PolarHBondContact O-N 3.45Å
47	S	62.6	Low	74.4	Confident	111 Å²	111	72.8 Å²	72.8	78%	0.776	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-71.9	-11	176.4	54.6	0	0	0	0	114.9	P45	P45-S47 PolarHBondContact O-N 3Å
48	Q	66.2	Low	74.5	Confident	112 Å²	112	73.1 Å²	73.1	52%	0.523	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-112.2	3.3	-177	-60.1	-177	0.5	0	0	113.2	R17 P45 A46	R17-Q48 PolarHBondContact NH2-O 2.87Å; P45-Q48 HydrophobicContact CB-CG 4.47Å; P45-Q48 HydrophobicContact CG-CG 4.47Å; P45-Q48 PolarHBondContact O-N 3.37Å; A46-Q48 PolarHBondContact O-N 3.45Å
49	L	70.7	Confident	74.6	Confident	30 Å²	30	73 Å²	73	16%	0.157	39%	0.392	C	S	.	.	S	Bend	trans	-96.8	128.2	177.3	-72.4	167.8	0	0	0	109.7	C44 T53 M54	C44-L49 HydrophobicContact CB-CD1 4.46Å; C44-L49 HydrophobicContact CB-CD2 3.93Å; C44-L49 HydrophobicContact CB-CG 4.17Å; L49-T53 HydrophobicContact CD2-CG2 3.79Å; L49-M54 HydrophobicContact CB-CE 4.15Å
50	D	74.8	Confident	74.7	Confident	65 Å²	65	70 Å²	70	35%	0.348	38%	0.38	S	S	.	.			trans	-72	154.9	172.1	66	-80.3	0	0	0	111	A52 T53 M54	D50-A52 PolarHBondContact O-N 3.02Å; D50-A52 VanDerWaalsContact O-N 3.11Å; D50-A52 WeakPolarHBondContact OD2-CB 3.37Å; D50-A52 PolarHBondContact OD2-N 3.16Å; D50-A52 VanDerWaalsContact OD2-N 3.12Å; D50-T53 VanDerWaalsContact CG-OG1 3.27Å; D50-T53 PolarHBondContact O-N 3.34Å; D50-T53 WeakPolarHBondContact OD1-CB 3.48Å; D50-T53 PolarHBondContact OD1-OG1 2.86Å; D50-T53 PolarHBondContact OD2-N 2.9Å; D50-T53 PolarHBondContact OD2-OG1 3.34Å; D50-M54 PolarHBondContact O-N 2.94Å
51	P	74.6	Confident	74.9	Confident	94 Å²	94	70.1 Å²	70.1	61%	0.61	38%	0.381	S	S	*	.	H	α-helix	trans	-61.5	-21.1	-176.6	-25.4	34.7	0	0	0	115.3	R55	P51-R55 WeakPolarHBondContact O-CG 3.34Å; P51-R55 PolarHBondContact O-N 3.2Å; P51-R55 PolarHBondContact O-NE 2.82Å; P51-R55 VanDerWaalsContact O-NE 3.1Å
52	A	77.4	Confident	75.4	Confident	53 Å²	53	66.7 Å²	66.7	44%	0.438	36%	0.364	S	S	.	.	H	α-helix	trans	-80.4	-43.9	177.6	0	0	0	0	0	110.6	D50 M54 R55 Q56	D50-A52 PolarHBondContact O-N 3.02Å; D50-A52 VanDerWaalsContact O-N 3.11Å; D50-A52 WeakPolarHBondContact OD2-CB 3.37Å; D50-A52 PolarHBondContact OD2-N 3.16Å; D50-A52 VanDerWaalsContact OD2-N 3.12Å; A52-M54 VanDerWaalsContact C-N 3.35Å; A52-R55 PolarHBondContact O-N 2.8Å; A52-Q56 WeakPolarHBondContact O-CG 3.47Å; A52-Q56 PolarHBondContact O-N 2.9Å; A52-Q56 VanDerWaalsContact O-N 3.11Å
53	T	76.1	Confident	75.8	Confident	26 Å²	26	56.5 Å²	56.5	16%	0.16	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-41.4	173.5	-60	0	0	0	0	111.6	L21 L49 D50 R55 Q56 V57	L21-T53 HydrophobicContact CD1-CG2 4.18Å; L49-T53 HydrophobicContact CD2-CG2 3.79Å; D50-T53 VanDerWaalsContact CG-OG1 3.27Å; D50-T53 PolarHBondContact O-N 3.34Å; D50-T53 WeakPolarHBondContact OD1-CB 3.48Å; D50-T53 PolarHBondContact OD1-OG1 2.86Å; D50-T53 PolarHBondContact OD2-N 2.9Å; D50-T53 PolarHBondContact OD2-OG1 3.34Å; T53-R55 VanDerWaalsContact C-N 3.34Å; T53-R55 PolarHBondContact O-N 3.41Å; T53-Q56 WeakPolarHBondContact O-CB 3.38Å; T53-Q56 PolarHBondContact O-N 3.3Å; T53-V57 WeakPolarHBondContact O-CG2 3.31Å; T53-V57 PolarHBondContact O-N 3.43Å
54	M	76.1	Confident	76.4	Confident	51 Å²	51	54.4 Å²	54.4	25%	0.251	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-41.1	177.6	-170.4	173.5	-74.2	0	0	112.2	L49 D50 A52 Q56 V57 F58	L49-M54 HydrophobicContact CB-CE 4.15Å; D50-M54 PolarHBondContact O-N 2.94Å; A52-M54 VanDerWaalsContact C-N 3.35Å; M54-Q56 PolarHBondContact O-N 3.37Å; M54-V57 WeakPolarHBondContact O-CB 3.39Å; M54-V57 PolarHBondContact O-N 2.89Å; M54-F58 HydrophobicContact CG-CD2 4.35Å; M54-F58 HydrophobicContact CG-CE1 4.08Å; M54-F58 HydrophobicContact CG-CE2 3.79Å; M54-F58 HydrophobicContact CG-CZ 3.63Å; M54-F58 WeakPolarHBondContact O-CG 3.45Å; M54-F58 PolarHBondContact O-N 3.09Å; M54-F58 HydrophobicContact SD-CE2 4.2Å; M54-F58 HydrophobicContact SD-CZ 3.95Å
55	R	80.1	Confident	77.2	Confident	121 Å²	121	54.1 Å²	54.1	46%	0.457	32%	0.32	S	S	.	.	H	α-helix	trans	-60.7	-42.4	172.5	-85.7	-177.7	-89	174.8	-13.6	112.8	P51 A52 T53 V57 F58 E59 D101	P51-R55 WeakPolarHBondContact O-CG 3.34Å; P51-R55 PolarHBondContact O-N 3.2Å; P51-R55 PolarHBondContact O-NE 2.82Å; P51-R55 VanDerWaalsContact O-NE 3.1Å; A52-R55 PolarHBondContact O-N 2.8Å; T53-R55 VanDerWaalsContact C-N 3.34Å; T53-R55 PolarHBondContact O-N 3.41Å; R55-V57 VanDerWaalsContact C-N 3.3Å; R55-V57 PolarHBondContact O-N 2.81Å; R55-F58 PolarHBondContact O-N 3.38Å; R55-E59 WeakPolarHBondContact O-CG 3.41Å; R55-E59 PolarHBondContact O-N 3.25Å; R55-D101 WeakPolarHBondContact CG-OD2 3.44Å
56	Q	80.9	Confident	78.2	Confident	78 Å²	78	51.6 Å²	51.6	36%	0.364	30%	0.304	S	S	.	.	H	α-helix	trans	-64.1	-35.1	176.4	-69.3	-179.9	2.1	0	0	112.8	L21 A52 T53 M54 A60	L21-Q56 HydrophobicContact CD2-CB 4.25Å; A52-Q56 WeakPolarHBondContact O-CG 3.47Å; A52-Q56 PolarHBondContact O-N 2.9Å; A52-Q56 VanDerWaalsContact O-N 3.11Å; T53-Q56 WeakPolarHBondContact O-CB 3.38Å; T53-Q56 PolarHBondContact O-N 3.3Å; M54-Q56 PolarHBondContact O-N 3.37Å; Q56-A60 VanDerWaalsContact O-CB 3.31Å; Q56-A60 WeakPolarHBondContact O-CB 3.21Å; Q56-A60 PolarHBondContact O-N 3.01Å; Q56-A60 VanDerWaalsContact O-N 3.12Å
57	V	81.5	Confident	79.2	Confident	14 Å²	14	49.2 Å²	49.2	9%	0.085	28%	0.284	C	S	.	.	H	α-helix	trans	-64.3	-50.5	171.8	174.6	0	0	0	0	109.6	L21 L24 L37 T53 M54 R55 E59 A60 V61	L21-V57 HydrophobicContact CD2-CB 4.5Å; L21-V57 HydrophobicContact CD2-CG2 3.62Å; L24-V57 HydrophobicContact CD2-CG1 4.02Å; L37-V57 HydrophobicContact CD2-CG1 4.1Å; T53-V57 WeakPolarHBondContact O-CG2 3.31Å; T53-V57 PolarHBondContact O-N 3.43Å; M54-V57 WeakPolarHBondContact O-CB 3.39Å; M54-V57 PolarHBondContact O-N 2.89Å; R55-V57 VanDerWaalsContact C-N 3.3Å; R55-V57 PolarHBondContact O-N 2.81Å; V57-E59 VanDerWaalsContact C-N 3.34Å; V57-E59 PolarHBondContact O-N 3.48Å; V57-A60 PolarHBondContact O-N 3.39Å; V57-A60 VanDerWaalsContact O-N 3.07Å; V57-V61 HydrophobicContact CG1-CG2 4.31Å; V57-V61 WeakPolarHBondContact O-CG2 3.21Å; V57-V61 PolarHBondContact O-N 2.88Å
58	F	82.8	Confident	80.4	Confident	26 Å²	26	49 Å²	49	11%	0.114	27%	0.266	C	S	.	.	H	α-helix	trans	-59.3	-41.1	179.8	-68.2	-13.4	0	0	0	113.3	M54 R55 A60 V61 G62 A97 L98 D101 M104	M54-F58 HydrophobicContact CG-CD2 4.35Å; M54-F58 HydrophobicContact CG-CE1 4.08Å; M54-F58 HydrophobicContact CG-CE2 3.79Å; M54-F58 HydrophobicContact CG-CZ 3.63Å; M54-F58 WeakPolarHBondContact O-CG 3.45Å; M54-F58 PolarHBondContact O-N 3.09Å; M54-F58 HydrophobicContact SD-CE2 4.2Å; M54-F58 HydrophobicContact SD-CZ 3.95Å; R55-F58 PolarHBondContact O-N 3.38Å; F58-A60 VanDerWaalsContact C-N 3.34Å; F58-V61 PolarHBondContact O-N 2.85Å; F58-G62 PolarHBondContact O-N 2.65Å; F58-A97 HydrophobicContact CE1-CB 4.45Å; F58-A97 WeakPolarHBondContact CE2-O 3.44Å; F58-A97 VanDerWaalsContact CZ-O 3.26Å; F58-A97 WeakPolarHBondContact CZ-O 3.39Å; F58-L98 HydrophobicContact CB-CD2 3.47Å; F58-L98 VanDerWaalsContact CB-CD2 3.47Å; F58-L98 HydrophobicContact CD1-CD2 3.66Å; F58-L98 HydrophobicContact CD2-CD2 4.48Å; F58-L98 HydrophobicContact CG-CD2 3.64Å; F58-D101 HydrophobicContact CD2-CB 4.06Å; F58-D101 HydrophobicContact CE2-CB 4.41Å; F58-M104 HydrophobicContact CB-CE 4.12Å
59	E	82.3	Confident	81.3	Confident	110 Å²	110	44.4 Å²	44.4	51%	0.514	25%	0.245	S	C	.	.	H	α-helix	trans	-62.5	-40	173.3	-76	-179.5	165.8	0	0	112.8	R55 V57 M104	R55-E59 WeakPolarHBondContact O-CG 3.41Å; R55-E59 PolarHBondContact O-N 3.25Å; V57-E59 VanDerWaalsContact C-N 3.34Å; V57-E59 PolarHBondContact O-N 3.48Å; E59-M104 HydrophobicContact CB-CE 4.16Å; E59-M104 HydrophobicContact CG-CE 3.38Å
60	A	82.3	Confident	81.9	Confident	28 Å²	28	43 Å²	43	23%	0.231	24%	0.237	C	C	.	.	H	α-helix	trans	-74	-31.4	-179.4	0	0	0	0	0	113	L24 R25 Q56 V57 F58	L24-A60 HydrophobicContact CB-CB 4.45Å; L24-A60 HydrophobicContact CD2-CB 3.57Å; L24-A60 HydrophobicContact CG-CB 3.78Å; R25-A60 HydrophobicContact CG-CB 3.96Å; Q56-A60 VanDerWaalsContact O-CB 3.31Å; Q56-A60 WeakPolarHBondContact O-CB 3.21Å; Q56-A60 PolarHBondContact O-N 3.01Å; Q56-A60 VanDerWaalsContact O-N 3.12Å; V57-A60 PolarHBondContact O-N 3.39Å; V57-A60 VanDerWaalsContact O-N 3.07Å; F58-A60 VanDerWaalsContact C-N 3.34Å
61	V	83.6	Confident	82.4	Confident	15 Å²	15	42.2 Å²	42.2	9%	0.091	24%	0.235	C	C	.	.	H	α-helix	trans	-71.1	-47.2	171.9	178.5	0	0	0	0	111.1	L24 L37 V57 F58 L65 L98	L24-V61 HydrophobicContact CD1-CG2 4.3Å; L24-V61 HydrophobicContact CD2-CG2 3.98Å; L37-V61 HydrophobicContact CD1-CG1 4.01Å; L37-V61 HydrophobicContact CD1-CG2 3.68Å; L37-V61 HydrophobicContact CD2-CG2 3.31Å; L37-V61 HydrophobicContact CG-CG2 3.83Å; V57-V61 HydrophobicContact CG1-CG2 4.31Å; V57-V61 WeakPolarHBondContact O-CG2 3.21Å; V57-V61 PolarHBondContact O-N 2.88Å; F58-V61 PolarHBondContact O-N 2.85Å; V61-L65 HydrophobicContact CG1-CD2 4.24Å; V61-L98 HydrophobicContact CG1-CD1 4.46Å
62	G	83.6	Confident	82.8	Confident	17 Å²	17	40.8 Å²	40.8	18%	0.175	22%	0.224	C	C	.	.			trans	67.8	165.7	-176.7	0	0	0	0	0	114.4	F58 P66	F58-G62 PolarHBondContact O-N 2.65Å; G62-P66 VanDerWaalsContact O-CD 3.3Å; G62-P66 WeakPolarHBondContact O-CD 3.31Å
63	L	85.4	Confident	83	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.016	21%	0.205	C	C	.	.	S	Bend	trans	-84.9	-11.2	-176.6	-68.4	165.1	0	0	0	113.6	A67 L95 L98 R107 Q109 L110	L63-A67 WeakPolarHBondContact O-CB 3.26Å; L63-A67 PolarHBondContact O-N 2.76Å; L63-L95 HydrophobicContact CD2-CD2 4.13Å; L63-L98 HydrophobicContact CD2-CB 4.08Å; L63-L98 HydrophobicContact CD2-CD1 3.83Å; L63-R107 HydrophobicContact CD1-CB 3.6Å; L63-R107 HydrophobicContact CD1-CG 4.2Å; L63-Q109 HydrophobicContact CB-CB 3.79Å; L63-Q109 HydrophobicContact CD1-CB 3.94Å; L63-L110 HydrophobicContact CD1-CB 3.91Å; L63-L110 HydrophobicContact CD2-CB 3.92Å; L63-L110 HydrophobicContact CD2-CD1 3.77Å; L63-L110 HydrophobicContact CD2-CG 4.32Å
64	A	85.3	Confident	82.9	Confident	52 Å²	52	40.7 Å²	40.7	43%	0.43	22%	0.216	S	C	.	.	H	α-helix	trans	-73.8	-36.5	-176.4	0	0	0	0	0	112.6	R68	A64-R68 WeakPolarHBondContact O-CB 3.46Å; A64-R68 WeakPolarHBondContact O-CG 3.46Å; A64-R68 PolarHBondContact O-N 3.03Å; A64-R68 PolarHBondContact O-NH1 2.74Å
65	L	86.6	Confident	82.8	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-64.1	-53.7	178.1	166.4	70.9	0	0	0	111.4	D30 T33 L34 V61 A67 R68 L69 L94	D30-L65 HydrophobicContact CB-CD1 3.52Å; T33-L65 HydrophobicContact CG2-CD2 3.73Å; L34-L65 HydrophobicContact CD2-CD2 4.08Å; L34-L65 HydrophobicContact CG-CD2 4.43Å; V61-L65 HydrophobicContact CG1-CD2 4.24Å; L65-A67 VanDerWaalsContact C-N 3.34Å; L65-A67 PolarHBondContact O-N 2.78Å; L65-R68 PolarHBondContact O-N 3.12Å; L65-L69 HydrophobicContact CD1-CD1 4.19Å; L65-L69 HydrophobicContact CD1-CG 4.21Å; L65-L69 HydrophobicContact CG-CD1 4.21Å; L65-L69 WeakPolarHBondContact O-CG 3.46Å; L65-L69 PolarHBondContact O-N 2.88Å; L65-L94 HydrophobicContact CD2-CD1 4.37Å
66	P	86.1	Confident	81.9	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-38.6	179.5	-23.8	35.3	0	0	0	113.4	G62 R68 L69 L70 L94 L95 L98	G62-P66 VanDerWaalsContact O-CD 3.3Å; G62-P66 WeakPolarHBondContact O-CD 3.31Å; P66-R68 PolarHBondContact O-N 2.96Å; P66-L69 PolarHBondContact O-N 3.07Å; P66-L70 WeakPolarHBondContact O-CG 3.39Å; P66-L70 PolarHBondContact O-N 3.47Å; P66-L94 HydrophobicContact CB-CB 4.07Å; P66-L94 HydrophobicContact CG-CB 3.66Å; P66-L94 HydrophobicContact CG-CD1 4.29Å; P66-L95 HydrophobicContact CB-CD2 3.62Å; P66-L95 HydrophobicContact CB-CG 3.56Å; P66-L95 HydrophobicContact CG-CD2 4.29Å; P66-L98 HydrophobicContact CG-CD1 3.8Å
67	A	84.4	Confident	80.7	Confident	24 Å²	24	45.1 Å²	45.1	20%	0.198	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-42.2	175.1	0	0	0	0	0	112.2	L63 L65 V71 T113	L63-A67 WeakPolarHBondContact O-CB 3.26Å; L63-A67 PolarHBondContact O-N 2.76Å; L65-A67 VanDerWaalsContact C-N 3.34Å; L65-A67 PolarHBondContact O-N 2.78Å; A67-V71 VanDerWaalsContact O-CG2 3.3Å; A67-V71 WeakPolarHBondContact O-CG2 3.46Å; A67-V71 PolarHBondContact O-N 3.1Å; A67-T113 HydrophobicContact CB-CG2 3.7Å
68	R	86.6	Confident	79.4	Confident	108 Å²	108	48.6 Å²	48.6	41%	0.408	28%	0.277	S	S	.	.	H	α-helix	trans	-64.1	-41.9	174.5	-77.4	-168	-59.5	-84.9	2.6	112.2	D30 A64 L65 P66 L70 V71 T72	D30-R68 VanDerWaalsContact CG-NH2 3.3Å; D30-R68 IonicContact OD1-CZ 2.92Å; D30-R68 IonicContact OD1-NE 2.72Å; D30-R68 IonicContact OD1-NH2 3.38Å; D30-R68 PolarHBondContact OD1-NH2 3.12Å; D30-R68 IonicContact OD2-CZ 2.82Å; D30-R68 IonicContact OD2-NE 2.87Å; D30-R68 PolarHBondContact OD2-NE 3.15Å; D30-R68 IonicContact OD2-NH2 2.68Å; D30-R68 PolarHBondContact OD2-NH2 2.6Å; A64-R68 WeakPolarHBondContact O-CB 3.46Å; A64-R68 WeakPolarHBondContact O-CG 3.46Å; A64-R68 PolarHBondContact O-N 3.03Å; A64-R68 PolarHBondContact O-NH1 2.74Å; L65-R68 PolarHBondContact O-N 3.12Å; P66-R68 PolarHBondContact O-N 2.96Å; R68-L70 PolarHBondContact O-N 3.36Å; R68-V71 PolarHBondContact O-N 3.25Å; R68-T72 VanDerWaalsContact O-CB 3.26Å; R68-T72 WeakPolarHBondContact O-CB 3.24Å; R68-T72 PolarHBondContact O-N 3.4Å; R68-T72 PolarHBondContact O-OG1 3.29Å
69	L	86.1	Confident	78.1	Confident	14 Å²	14	51.3 Å²	51.3	7%	0.073	31%	0.313	C	S	.	.	H	α-helix	trans	-58.6	-47.8	177.9	-69.9	172	0	0	0	111.1	L65 P66 T72 A73 L87 L90 L94	L65-L69 HydrophobicContact CD1-CD1 4.19Å; L65-L69 HydrophobicContact CD1-CG 4.21Å; L65-L69 HydrophobicContact CG-CD1 4.21Å; L65-L69 WeakPolarHBondContact O-CG 3.46Å; L65-L69 PolarHBondContact O-N 2.88Å; P66-L69 PolarHBondContact O-N 3.07Å; L69-T72 PolarHBondContact O-N 2.87Å; L69-A73 WeakPolarHBondContact O-CB 3.23Å; L69-A73 PolarHBondContact O-N 3.35Å; L69-L87 HydrophobicContact CD2-CD2 3.69Å; L69-L90 HydrophobicContact CD1-CD2 4.13Å; L69-L90 HydrophobicContact CD1-CG 4Å; L69-L94 HydrophobicContact CD1-CD1 4Å
70	L	83.8	Confident	77	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.2	-46.9	177.9	-68.5	-177.4	0	0	0	112.9	P66 R68 T72 A73 L74 L88 L95 L117	P66-L70 WeakPolarHBondContact O-CG 3.39Å; P66-L70 PolarHBondContact O-N 3.47Å; R68-L70 PolarHBondContact O-N 3.36Å; L70-T72 VanDerWaalsContact C-N 3.33Å; L70-T72 PolarHBondContact O-N 3.05Å; L70-A73 PolarHBondContact O-N 3.01Å; L70-L74 WeakPolarHBondContact O-CG 3.43Å; L70-L74 PolarHBondContact O-N 3.45Å; L70-L88 HydrophobicContact CD2-CD2 3.99Å; L70-L95 HydrophobicContact CD1-CD1 3.42Å; L70-L95 VanDerWaalsContact CD1-CD1 3.42Å; L70-L117 HydrophobicContact CD1-CD2 3.91Å
71	V	84.4	Confident	76.1	Confident	49 Å²	49	50.6 Å²	50.6	30%	0.297	34%	0.335	S	S	.	.	H	α-helix	trans	-64.2	-39.7	179.6	172.1	0	0	0	0	111.3	A67 R68 L74 R75 L116	A67-V71 VanDerWaalsContact O-CG2 3.3Å; A67-V71 WeakPolarHBondContact O-CG2 3.46Å; A67-V71 PolarHBondContact O-N 3.1Å; R68-V71 PolarHBondContact O-N 3.25Å; V71-L74 PolarHBondContact O-N 2.92Å; V71-R75 HydrophobicContact CG1-CG 4.4Å; V71-R75 WeakPolarHBondContact O-CB 3.27Å; V71-R75 WeakPolarHBondContact O-CG 3.31Å; V71-R75 PolarHBondContact O-N 2.9Å; V71-R75 VanDerWaalsContact O-N 3.12Å; V71-L116 HydrophobicContact CG2-CD1 3.74Å
72	T	83.8	Confident	75.5	Confident	64 Å²	64	53.3 Å²	53.3	39%	0.393	35%	0.348	S	S	.	.	H	α-helix	trans	-66.5	-40.3	179.3	-55.3	0	0	0	0	111.1	R68 L69 L70 L74 A80 L87	R68-T72 VanDerWaalsContact O-CB 3.26Å; R68-T72 WeakPolarHBondContact O-CB 3.24Å; R68-T72 PolarHBondContact O-N 3.4Å; R68-T72 PolarHBondContact O-OG1 3.29Å; L69-T72 PolarHBondContact O-N 2.87Å; L70-T72 VanDerWaalsContact C-N 3.33Å; L70-T72 PolarHBondContact O-N 3.05Å; T72-L74 VanDerWaalsContact C-N 3.29Å; T72-L74 PolarHBondContact O-N 3.41Å; T72-A80 HydrophobicContact CG2-CB 4.43Å; T72-L87 HydrophobicContact CG2-CD1 4.31Å
73	A	81.2	Confident	75.3	Confident	4 Å²	4	55.5 Å²	55.5	3%	0.033	36%	0.359	C	S	.	.	H	α-helix	trans	-65.7	-32.7	177.6	0	0	0	0	0	113.1	L69 L70 P84 L87 L88	L69-A73 WeakPolarHBondContact O-CB 3.23Å; L69-A73 PolarHBondContact O-N 3.35Å; L70-A73 PolarHBondContact O-N 3.01Å; A73-P84 HydrophobicContact CB-CB 4.39Å; A73-P84 WeakPolarHBondContact CB-O 3.48Å; A73-L87 HydrophobicContact CB-CB 3.79Å; A73-L88 HydrophobicContact CB-CD2 3.72Å; A73-L88 HydrophobicContact CB-CG 3.58Å
74	L	74.2	Confident	75	Confident	73 Å²	73	57.2 Å²	57.2	38%	0.382	37%	0.371	S	S	.	.	H	α-helix	trans	-81.8	-26.5	-179.2	-72.2	170.8	0	0	0	114.3	L70 V71 T72 L88 L116 L120	L70-L74 WeakPolarHBondContact O-CG 3.43Å; L70-L74 PolarHBondContact O-N 3.45Å; V71-L74 PolarHBondContact O-N 2.92Å; T72-L74 VanDerWaalsContact C-N 3.29Å; T72-L74 PolarHBondContact O-N 3.41Å; L74-L88 HydrophobicContact CG-CD2 4.49Å; L74-L116 HydrophobicContact CD1-CD2 4Å; L74-L120 HydrophobicContact CD2-CD2 3.85Å
75	R	72.8	Confident	74.7	Confident	209 Å²	209	57.1 Å²	57.1	79%	0.789	36%	0.361	S	S	*	.	S	Bend	trans	-94.4	17.4	-173.6	-74.8	-173	172.9	-172	-2	115.7	V71	V71-R75 HydrophobicContact CG1-CG 4.4Å; V71-R75 WeakPolarHBondContact O-CB 3.27Å; V71-R75 WeakPolarHBondContact O-CG 3.31Å; V71-R75 PolarHBondContact O-N 2.9Å; V71-R75 VanDerWaalsContact O-N 3.12Å
76	D	61.3	Low	74.5	Confident	116 Å²	116	62.1 Å²	62.1	62%	0.62	39%	0.385	S	S	*	.			trans	80.9	122	-178.2	-141.6	15.9	0	0	0	114.4	G78 R132	D76-G78 VanDerWaalsContact C-N 3.31Å; D76-G78 PolarHBondContact O-N 3.49Å; D76-R132 IonicContact OD1-NH2 3.23Å; D76-R132 PolarHBondContact OD1-NH2 3.33Å; D76-R132 VanDerWaalsContact OD1-NH2 3.08Å
77	A	56.8	Low	74.3	Confident	18 Å²	18	62.6 Å²	62.6	15%	0.149	39%	0.387	C	S	.	.			trans	-86.9	16	-161.3	0	0	0	0	0	115.1	G79 A80 P84	A77-G79 PolarHBondContact O-N 2.98Å; A77-A80 PolarHBondContact O-N 2.97Å; A77-P84 HydrophobicContact CB-CB 3.94Å; A77-P84 HydrophobicContact CB-CG 3.59Å
78	G	53.4	Low	74.4	Confident	87 Å²	87	62.1 Å²	62.1	90%	0.897	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-4.2	-169.5	0	0	0	0	0	116.8	D76	D76-G78 VanDerWaalsContact C-N 3.31Å; D76-G78 PolarHBondContact O-N 3.49Å
79	G	56	Low	74.4	Confident	84 Å²	84	59 Å²	59	87%	0.866	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.7	8.4	175.9	0	0	0	0	0	115.4	A77	A77-G79 PolarHBondContact O-N 2.98Å
80	A	59.4	Low	74.5	Confident	35 Å²	35	61 Å²	61	29%	0.289	39%	0.386	S	S	.	.			trans	-95	141.9	179.7	0	0	0	0	0	111.4	T72 A77 L82 L87	T72-A80 HydrophobicContact CG2-CB 4.43Å; A77-A80 PolarHBondContact O-N 2.97Å; A80-L82 PolarHBondContact O-N 3.22Å; A80-L87 HydrophobicContact CB-CD1 3.84Å
81	G	63.4	Low	74.7	Confident	88 Å²	88	61 Å²	61	91%	0.907	39%	0.386	S	S	*	.	S	Bend	trans	-72.1	-0.5	177.4	0	0	0	0	0	115.1
82	L	71.1	Confident	74.9	Confident	71 Å²	71	58.7 Å²	58.7	37%	0.372	37%	0.372	S	S	.	.	S	Bend	trans	-132.3	149.5	-179.1	-66.3	172.3	0	0	0	110.3	A80 E86 L87	A80-L82 PolarHBondContact O-N 3.22Å; L82-E86 WeakPolarHBondContact CD2-OE2 3.45Å; L82-L87 HydrophobicContact CB-CD2 4.01Å; L82-L87 HydrophobicContact CB-CG 4.13Å; L82-L87 HydrophobicContact CD1-CD2 4.07Å
83	P	79.7	Confident	75.2	Confident	63 Å²	63	57.4 Å²	57.4	41%	0.409	37%	0.369	S	S	.	.			trans	-64.4	148.8	175.5	27.4	-33.8	0	0	0	111.4	Q85 E86 L87	P83-Q85 PolarHBondContact O-N 3.44Å; P83-Q85 VanDerWaalsContact O-N 3.12Å; P83-E86 HydrophobicContact CG-CB 4.01Å; P83-E86 VanDerWaalsContact CG-CD 3.41Å; P83-E86 HydrophobicContact CG-CG 3.7Å; P83-E86 WeakPolarHBondContact CG-OE1 3.42Å; P83-E86 PolarHBondContact O-N 3.44Å; P83-E86 VanDerWaalsContact O-N 3.07Å; P83-L87 PolarHBondContact O-N 3.44Å
84	P	78.2	Confident	75.6	Confident	40 Å²	40	58.5 Å²	58.5	26%	0.26	37%	0.374	S	S	.	.	H	α-helix	trans	-56.8	-31.6	-176.1	6.1	-13.8	0	0	0	113.9	A73 A77 L87 L88	A73-P84 HydrophobicContact CB-CB 4.39Å; A73-P84 WeakPolarHBondContact CB-O 3.48Å; A77-P84 HydrophobicContact CB-CB 3.94Å; A77-P84 HydrophobicContact CB-CG 3.59Å; P84-L87 PolarHBondContact O-N 3.4Å; P84-L88 WeakPolarHBondContact O-CG 3.44Å; P84-L88 PolarHBondContact O-N 3.34Å
85	Q	78.9	Confident	76.3	Confident	50 Å²	50	55 Å²	55	23%	0.234	36%	0.356	C	S	.	.	H	α-helix	trans	-66.2	-39.8	177.7	-169	69.5	-2	0	0	112.9	P83 L87 L88 S89	P83-Q85 PolarHBondContact O-N 3.44Å; P83-Q85 VanDerWaalsContact O-N 3.12Å; Q85-L87 VanDerWaalsContact C-N 3.35Å; Q85-L88 PolarHBondContact O-N 3.23Å; Q85-S89 WeakPolarHBondContact O-CB 3.26Å; Q85-S89 PolarHBondContact O-N 2.99Å
86	E	82.4	Confident	77.2	Confident	107 Å²	107	45.4 Å²	45.4	50%	0.5	32%	0.321	S	S	.	.	H	α-helix	trans	-69.7	-35.5	176.4	-72.5	177.5	-160.9	0	0	111.3	L82 P83 S89 L90	L82-E86 WeakPolarHBondContact CD2-OE2 3.45Å; P83-E86 HydrophobicContact CG-CB 4.01Å; P83-E86 VanDerWaalsContact CG-CD 3.41Å; P83-E86 HydrophobicContact CG-CG 3.7Å; P83-E86 WeakPolarHBondContact CG-OE1 3.42Å; P83-E86 PolarHBondContact O-N 3.44Å; P83-E86 VanDerWaalsContact O-N 3.07Å; E86-S89 PolarHBondContact O-N 2.86Å; E86-L90 VanDerWaalsContact O-CB 3.22Å; E86-L90 WeakPolarHBondContact O-CB 3.47Å; E86-L90 PolarHBondContact O-N 2.93Å
87	L	83.1	Confident	78.5	Confident	11 Å²	11	41.9 Å²	41.9	6%	0.058	31%	0.307	C	S	.	.	H	α-helix	trans	-65.4	-40.5	173.5	-65	174.5	0	0	0	111.9	L69 T72 A73 A80 L82 P83 P84 Q85 G91	L69-L87 HydrophobicContact CD2-CD2 3.69Å; T72-L87 HydrophobicContact CG2-CD1 4.31Å; A73-L87 HydrophobicContact CB-CB 3.79Å; A80-L87 HydrophobicContact CB-CD1 3.84Å; L82-L87 HydrophobicContact CB-CD2 4.01Å; L82-L87 HydrophobicContact CB-CG 4.13Å; L82-L87 HydrophobicContact CD1-CD2 4.07Å; P83-L87 PolarHBondContact O-N 3.44Å; P84-L87 PolarHBondContact O-N 3.4Å; Q85-L87 VanDerWaalsContact C-N 3.35Å; L87-G91 PolarHBondContact O-N 2.98Å
88	L	85.9	Confident	80	Confident	14 Å²	14	41.1 Å²	41.1	7%	0.073	30%	0.301	C	S	.	.	H	α-helix	trans	-63.5	-48.8	173.7	-76.4	172.5	0	0	0	111.5	L70 A73 L74 P84 Q85 G91 A92 L120 L136	L70-L88 HydrophobicContact CD2-CD2 3.99Å; A73-L88 HydrophobicContact CB-CD2 3.72Å; A73-L88 HydrophobicContact CB-CG 3.58Å; L74-L88 HydrophobicContact CG-CD2 4.49Å; P84-L88 WeakPolarHBondContact O-CG 3.44Å; P84-L88 PolarHBondContact O-N 3.34Å; Q85-L88 PolarHBondContact O-N 3.23Å; L88-G91 PolarHBondContact O-N 3.2Å; L88-A92 VanDerWaalsContact O-CB 3.29Å; L88-A92 WeakPolarHBondContact O-CB 3.2Å; L88-A92 PolarHBondContact O-N 3.48Å; L88-L120 HydrophobicContact CD2-CD1 4.2Å; L88-L120 HydrophobicContact CD2-CD2 4.06Å; L88-L136 HydrophobicContact CD1-CD2 4.16Å
89	S	87.3	Confident	81.7	Confident	41 Å²	41	37 Å²	37	29%	0.287	26%	0.258	S	S	.	.	H	α-helix	trans	-59.9	-49.3	-180	179.2	0	0	0	0	111.9	Q85 E86 G91 A92 A93	Q85-S89 WeakPolarHBondContact O-CB 3.26Å; Q85-S89 PolarHBondContact O-N 2.99Å; E86-S89 PolarHBondContact O-N 2.86Å; S89-G91 PolarHBondContact O-N 3.33Å; S89-A92 PolarHBondContact O-N 3.15Å; S89-A93 VanDerWaalsContact O-CB 3.24Å; S89-A93 WeakPolarHBondContact O-CB 3.36Å; S89-A93 PolarHBondContact O-N 3.44Å
90	L	87.1	Confident	83.2	Confident	56 Å²	56	36.8 Å²	36.8	29%	0.293	24%	0.24	S	C	.	.	H	α-helix	trans	-65.3	-41.3	178.2	-174.5	60.5	0	0	0	112.4	L34 L69 E86 L94	L34-L90 HydrophobicContact CD1-CD2 3.68Å; L34-L90 HydrophobicContact CD2-CD1 4.25Å; L34-L90 HydrophobicContact CD2-CD2 3.64Å; L34-L90 HydrophobicContact CD2-CG 4.17Å; L34-L90 HydrophobicContact CG-CD2 4.28Å; L69-L90 HydrophobicContact CD1-CD2 4.13Å; L69-L90 HydrophobicContact CD1-CG 4Å; E86-L90 VanDerWaalsContact O-CB 3.22Å; E86-L90 WeakPolarHBondContact O-CB 3.47Å; E86-L90 PolarHBondContact O-N 2.93Å; L90-L94 HydrophobicContact CD1-CD1 4.1Å; L90-L94 HydrophobicContact CD1-CG 4.25Å; L90-L94 HydrophobicContact CG-CD1 4.06Å; L90-L94 WeakPolarHBondContact O-CB 3.41Å; L90-L94 WeakPolarHBondContact O-CG 3.4Å; L90-L94 PolarHBondContact O-N 3.02Å
91	G	88.3	Confident	84.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.1	-46.6	177.3	0	0	0	0	0	112.6	L87 L88 S89 L95	L87-G91 PolarHBondContact O-N 2.98Å; L88-G91 PolarHBondContact O-N 3.2Å; S89-G91 PolarHBondContact O-N 3.33Å; G91-L95 WeakPolarHBondContact O-CG 3.31Å; G91-L95 PolarHBondContact O-N 3.09Å
92	A	89.3	Confident	85.3	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-66.3	-47	178.7	0	0	0	0	0	111.6	L88 S89 L94 L95 A96 V140 D143	L88-A92 VanDerWaalsContact O-CB 3.29Å; L88-A92 WeakPolarHBondContact O-CB 3.2Å; L88-A92 PolarHBondContact O-N 3.48Å; S89-A92 PolarHBondContact O-N 3.15Å; A92-L94 PolarHBondContact O-N 2.71Å; A92-L95 PolarHBondContact O-N 2.87Å; A92-A96 WeakPolarHBondContact O-CB 3.37Å; A92-A96 PolarHBondContact O-N 3.37Å; A92-V140 HydrophobicContact CB-CG1 3.92Å; A92-D143 HydrophobicContact CB-CB 3.87Å
93	A	89.7	Confident	86	Confident	38 Å²	38	37.5 Å²	37.5	31%	0.314	22%	0.224	S	C	.	.	H	α-helix	trans	-61.5	-41.5	178.8	0	0	0	0	0	112.4	S89 A96 A97 D143	S89-A93 VanDerWaalsContact O-CB 3.24Å; S89-A93 WeakPolarHBondContact O-CB 3.36Å; S89-A93 PolarHBondContact O-N 3.44Å; A93-A96 PolarHBondContact O-N 2.95Å; A93-A97 WeakPolarHBondContact O-CB 3.35Å; A93-A97 PolarHBondContact O-N 3.03Å; A93-D143 VanDerWaalsContact CA-OD2 3.24Å; A93-D143 WeakPolarHBondContact CA-OD2 3.42Å; A93-D143 WeakPolarHBondContact CB-OD2 3.27Å; A93-D143 PolarHBondContact N-OD2 3.37Å
94	L	88.6	Confident	86.2	Confident	27 Å²	27	34.6 Å²	34.6	14%	0.141	20%	0.204	C	C	.	.	H	α-helix	trans	-66.9	-40.7	175.7	-72.3	172.1	0	0	0	111.9	L34 L37 L65 P66 L69 L90 A92 A97 L98	L34-L94 HydrophobicContact CD2-CD1 4.08Å; L37-L94 HydrophobicContact CD1-CD2 4.09Å; L65-L94 HydrophobicContact CD2-CD1 4.37Å; P66-L94 HydrophobicContact CB-CB 4.07Å; P66-L94 HydrophobicContact CG-CB 3.66Å; P66-L94 HydrophobicContact CG-CD1 4.29Å; L69-L94 HydrophobicContact CD1-CD1 4Å; L90-L94 HydrophobicContact CD1-CD1 4.1Å; L90-L94 HydrophobicContact CD1-CG 4.25Å; L90-L94 HydrophobicContact CG-CD1 4.06Å; L90-L94 WeakPolarHBondContact O-CB 3.41Å; L90-L94 WeakPolarHBondContact O-CG 3.4Å; L90-L94 PolarHBondContact O-N 3.02Å; A92-L94 PolarHBondContact O-N 2.71Å; L94-A97 PolarHBondContact O-N 2.77Å; L94-L98 WeakPolarHBondContact O-CB 3.44Å; L94-L98 WeakPolarHBondContact O-CD1 3.32Å; L94-L98 WeakPolarHBondContact O-CG 3.24Å; L94-L98 PolarHBondContact O-N 3.05Å
95	L	90.3	Very high	86.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.4	-42.4	174.4	-77.8	-177.4	0	0	0	112.2	L63 P66 L70 G91 A92 A97 L98 S99 T113 L117 V147	L63-L95 HydrophobicContact CD2-CD2 4.13Å; P66-L95 HydrophobicContact CB-CD2 3.62Å; P66-L95 HydrophobicContact CB-CG 3.56Å; P66-L95 HydrophobicContact CG-CD2 4.29Å; L70-L95 HydrophobicContact CD1-CD1 3.42Å; L70-L95 VanDerWaalsContact CD1-CD1 3.42Å; G91-L95 WeakPolarHBondContact O-CG 3.31Å; G91-L95 PolarHBondContact O-N 3.09Å; A92-L95 PolarHBondContact O-N 2.87Å; L95-A97 VanDerWaalsContact C-N 3.35Å; L95-L98 PolarHBondContact O-N 2.96Å; L95-S99 WeakPolarHBondContact O-CB 3.44Å; L95-S99 PolarHBondContact O-N 3.42Å; L95-T113 HydrophobicContact CD1-CG2 4.18Å; L95-L117 HydrophobicContact CD1-CD2 4.4Å; L95-V147 HydrophobicContact CB-CG2 3.9Å
96	A	90.8	Very high	87	Confident	7 Å²	7	32.8 Å²	32.8	6%	0.058	20%	0.201	C	C	.	.	H	α-helix	trans	-63	-41.7	177.2	0	0	0	0	0	111.6	A92 A93 S99 D143 Q146 V147	A92-A96 WeakPolarHBondContact O-CB 3.37Å; A92-A96 PolarHBondContact O-N 3.37Å; A93-A96 PolarHBondContact O-N 2.95Å; A96-S99 PolarHBondContact O-N 3.01Å; A96-S99 PolarHBondContact O-OG 2.98Å; A96-D143 HydrophobicContact CB-CB 3.77Å; A96-Q146 HydrophobicContact CB-CB 4.29Å; A96-Q146 HydrophobicContact CB-CG 4.28Å; A96-V147 HydrophobicContact CB-CG2 4.06Å
97	A	88.4	Confident	87.3	Confident	41 Å²	41	31.6 Å²	31.6	34%	0.339	19%	0.192	S	C	.	.	H	α-helix	trans	-63.2	-48.2	173.8	0	0	0	0	0	111.6	F58 A93 L94 L95 S99 T100	F58-A97 HydrophobicContact CE1-CB 4.45Å; F58-A97 WeakPolarHBondContact CE2-O 3.44Å; F58-A97 VanDerWaalsContact CZ-O 3.26Å; F58-A97 WeakPolarHBondContact CZ-O 3.39Å; A93-A97 WeakPolarHBondContact O-CB 3.35Å; A93-A97 PolarHBondContact O-N 3.03Å; L94-A97 PolarHBondContact O-N 2.77Å; L95-A97 VanDerWaalsContact C-N 3.35Å; A97-S99 VanDerWaalsContact C-N 3.3Å; A97-S99 PolarHBondContact O-N 3.26Å; A97-T100 WeakPolarHBondContact O-CB 3.26Å; A97-T100 PolarHBondContact O-N 3.14Å; A97-T100 PolarHBondContact O-OG1 3.23Å
98	L	88.2	Confident	87.5	Confident	3 Å²	3	36 Å²	36	2%	0.016	22%	0.222	C	C	.	.	H	α-helix	trans	-65.2	-32.4	179.4	-70.6	168.6	0	0	0	112.5	F58 V61 L63 P66 L94 L95 T100 D101 M104	F58-L98 HydrophobicContact CB-CD2 3.47Å; F58-L98 VanDerWaalsContact CB-CD2 3.47Å; F58-L98 HydrophobicContact CD1-CD2 3.66Å; F58-L98 HydrophobicContact CD2-CD2 4.48Å; F58-L98 HydrophobicContact CG-CD2 3.64Å; V61-L98 HydrophobicContact CG1-CD1 4.46Å; L63-L98 HydrophobicContact CD2-CB 4.08Å; L63-L98 HydrophobicContact CD2-CD1 3.83Å; P66-L98 HydrophobicContact CG-CD1 3.8Å; L94-L98 WeakPolarHBondContact O-CB 3.44Å; L94-L98 WeakPolarHBondContact O-CD1 3.32Å; L94-L98 WeakPolarHBondContact O-CG 3.24Å; L94-L98 PolarHBondContact O-N 3.05Å; L95-L98 PolarHBondContact O-N 2.96Å; L98-T100 PolarHBondContact O-N 2.99Å; L98-D101 PolarHBondContact O-N 2.86Å; L98-M104 VanDerWaalsContact O-CB 3.26Å; L98-M104 WeakPolarHBondContact O-CB 3.42Å
99	S	89.9	Confident	87.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.9	-20.4	179.2	76.7	0	0	0	0	112.5	L95 A96 A97 D101 T150	L95-S99 WeakPolarHBondContact O-CB 3.44Å; L95-S99 PolarHBondContact O-N 3.42Å; A96-S99 PolarHBondContact O-N 3.01Å; A96-S99 PolarHBondContact O-OG 2.98Å; A97-S99 VanDerWaalsContact C-N 3.3Å; A97-S99 PolarHBondContact O-N 3.26Å; S99-D101 PolarHBondContact O-N 3.46Å; S99-D101 VanDerWaalsContact O-N 3.15Å; S99-T150 WeakPolarHBondContact O-CG2 3.27Å; S99-T150 PolarHBondContact OG-OG1 3.38Å
100	T	87.5	Confident	87.6	Confident	80 Å²	80	38.6 Å²	38.6	49%	0.491	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.9	176.6	64.9	0	0	0	0	113.7	A97 L98 P102	A97-T100 WeakPolarHBondContact O-CB 3.26Å; A97-T100 PolarHBondContact O-N 3.14Å; A97-T100 PolarHBondContact O-OG1 3.23Å; L98-T100 PolarHBondContact O-N 2.99Å; T100-P102 WeakPolarHBondContact O-CD 2.99Å
101	D	85.3	Confident	87.8	Confident	16 Å²	16	37.4 Å²	37.4	9%	0.086	22%	0.223	C	C	.	.	S	Bend	trans	-88.1	115.6	168.6	-179.9	0.5	0	0	0	110.4	R55 F58 L98 S99 N103 M104 A105	R55-D101 WeakPolarHBondContact CG-OD2 3.44Å; F58-D101 HydrophobicContact CD2-CB 4.06Å; F58-D101 HydrophobicContact CE2-CB 4.41Å; L98-D101 PolarHBondContact O-N 2.86Å; S99-D101 PolarHBondContact O-N 3.46Å; S99-D101 VanDerWaalsContact O-N 3.15Å; D101-N103 PolarHBondContact O-N 3.13Å; D101-N103 VanDerWaalsContact O-N 3.11Å; D101-N103 WeakPolarHBondContact OD1-CB 3.46Å; D101-N103 PolarHBondContact OD1-N 3.07Å; D101-N103 PolarHBondContact OD1-ND2 3.37Å; D101-M104 HydrophobicContact CB-CB 4.13Å; D101-M104 HydrophobicContact CB-CG 3.92Å; D101-M104 WeakPolarHBondContact O-CB 3.39Å; D101-M104 PolarHBondContact O-N 3.33Å; D101-A105 PolarHBondContact O-N 2.83Å
102	P	82.1	Confident	87.8	Confident	87 Å²	87	40.5 Å²	40.5	57%	0.565	25%	0.249	S	C	*	.	H	α-helix	trans	-55	-32.6	179.6	-25.4	34	0	0	0	113.7	T100 M104 A105 A106	T100-P102 WeakPolarHBondContact O-CD 2.99Å; P102-M104 VanDerWaalsContact C-N 3.32Å; P102-M104 PolarHBondContact O-N 3Å; P102-A105 PolarHBondContact O-N 3.47Å; P102-A106 WeakPolarHBondContact O-CB 3.47Å; P102-A106 PolarHBondContact O-N 3.05Å; P102-A106 VanDerWaalsContact O-N 3.1Å
103	N	84.6	Confident	87.8	Confident	106 Å²	106	40.7 Å²	40.7	57%	0.567	25%	0.249	S	C	*	.	H	α-helix	trans	-69.1	-32.5	178.9	-65.6	-52.7	0	0	0	112.1	D101 R107	D101-N103 PolarHBondContact O-N 3.13Å; D101-N103 VanDerWaalsContact O-N 3.11Å; D101-N103 WeakPolarHBondContact OD1-CB 3.46Å; D101-N103 PolarHBondContact OD1-N 3.07Å; D101-N103 PolarHBondContact OD1-ND2 3.37Å; N103-R107 WeakPolarHBondContact O-CG 3.32Å
104	M	85.3	Confident	88	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-78.3	-42.1	176.4	-67.1	-66.1	177.9	0	0	110.9	F58 E59 L98 D101 P102 A106 R107	F58-M104 HydrophobicContact CB-CE 4.12Å; E59-M104 HydrophobicContact CB-CE 4.16Å; E59-M104 HydrophobicContact CG-CE 3.38Å; L98-M104 VanDerWaalsContact O-CB 3.26Å; L98-M104 WeakPolarHBondContact O-CB 3.42Å; D101-M104 HydrophobicContact CB-CB 4.13Å; D101-M104 HydrophobicContact CB-CG 3.92Å; D101-M104 WeakPolarHBondContact O-CB 3.39Å; D101-M104 PolarHBondContact O-N 3.33Å; P102-M104 VanDerWaalsContact C-N 3.32Å; P102-M104 PolarHBondContact O-N 3Å; M104-A106 PolarHBondContact O-N 3.21Å; M104-R107 WeakPolarHBondContact O-CB 3.38Å; M104-R107 PolarHBondContact O-N 2.91Å; M104-R107 PolarHBondContact SD-NE 3.29Å
105	A	87	Confident	88.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57.5	-35.7	176	0	0	0	0	0	112.8	D101 P102 R107 T150 L154	D101-A105 PolarHBondContact O-N 2.83Å; P102-A105 PolarHBondContact O-N 3.47Å; A105-R107 VanDerWaalsContact C-N 3.31Å; A105-R107 PolarHBondContact O-N 3.13Å; A105-T150 HydrophobicContact CB-CG2 3.83Å; A105-L154 HydrophobicContact CB-CD1 4.32Å; A105-L154 HydrophobicContact CB-CD2 4.28Å
106	A	86.8	Confident	88	Confident	52 Å²	52	42.8 Å²	42.8	43%	0.43	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-10	178.1	0	0	0	0	0	114.5	P102 M104 L154	P102-A106 WeakPolarHBondContact O-CB 3.47Å; P102-A106 PolarHBondContact O-N 3.05Å; P102-A106 VanDerWaalsContact O-N 3.1Å; M104-A106 PolarHBondContact O-N 3.21Å; A106-L154 HydrophobicContact CB-CD1 4.38Å; A106-L154 HydrophobicContact CB-CD2 4.29Å
107	R	89.1	Confident	88	Confident	82 Å²	82	42.4 Å²	42.4	31%	0.309	26%	0.256	S	S	.	.	S	Bend	trans	-70.4	138.9	-176.8	-69.4	-177.3	-177.6	-171.5	3.1	111.1	L63 N103 M104 A105 Q109 L110 L111	L63-R107 HydrophobicContact CD1-CB 3.6Å; L63-R107 HydrophobicContact CD1-CG 4.2Å; N103-R107 WeakPolarHBondContact O-CG 3.32Å; M104-R107 WeakPolarHBondContact O-CB 3.38Å; M104-R107 PolarHBondContact O-N 2.91Å; M104-R107 PolarHBondContact SD-NE 3.29Å; A105-R107 VanDerWaalsContact C-N 3.31Å; A105-R107 PolarHBondContact O-N 3.13Å; R107-Q109 PolarHBondContact O-N 3.35Å; R107-L110 PolarHBondContact O-N 3.41Å; R107-L111 PolarHBondContact O-N 3.17Å
108	P	86.7	Confident	88.1	Confident	104 Å²	104	40.7 Å²	40.7	68%	0.675	24%	0.241	S	C	*	.	H	α-helix	trans	-54.2	-29.4	177.9	-26.9	34.1	0	0	0	114.3	L111 A112	P108-L111 PolarHBondContact O-N 2.92Å; P108-A112 WeakPolarHBondContact O-CB 3.24Å; P108-A112 PolarHBondContact O-N 3Å
109	Q	86.4	Confident	88.1	Confident	110 Å²	110	42.8 Å²	42.8	51%	0.514	26%	0.256	S	S	.	.	H	α-helix	trans	-65.9	-39.5	179.9	-65.7	147.1	-7.1	0	0	112.6	L63 R107	L63-Q109 HydrophobicContact CB-CB 3.79Å; L63-Q109 HydrophobicContact CD1-CB 3.94Å; R107-Q109 PolarHBondContact O-N 3.35Å
110	L	89.6	Confident	88	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-74.9	-41.9	174.7	-173.3	146.3	0	0	0	110.2	L63 R107 A112 T113 V147 V151	L63-L110 HydrophobicContact CD1-CB 3.91Å; L63-L110 HydrophobicContact CD2-CB 3.92Å; L63-L110 HydrophobicContact CD2-CD1 3.77Å; L63-L110 HydrophobicContact CD2-CG 4.32Å; R107-L110 PolarHBondContact O-N 3.41Å; L110-A112 PolarHBondContact O-N 3.35Å; L110-T113 PolarHBondContact O-N 3.33Å; L110-T113 PolarHBondContact O-OG1 3.07Å; L110-V147 HydrophobicContact CD2-CG1 4.01Å; L110-V151 HydrophobicContact CD2-CG2 3.65Å
111	L	89.4	Confident	88	Confident	30 Å²	30	39.8 Å²	39.8	16%	0.157	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-27.6	176.9	-60.6	178.8	0	0	0	112.5	R107 P108 T113 V114 V151 L154 Q164	R107-L111 PolarHBondContact O-N 3.17Å; P108-L111 PolarHBondContact O-N 2.92Å; L111-T113 VanDerWaalsContact C-N 3.28Å; L111-T113 PolarHBondContact O-N 3.12Å; L111-V114 WeakPolarHBondContact O-CB 3.37Å; L111-V114 PolarHBondContact O-N 3.17Å; L111-V151 HydrophobicContact CD2-CG1 3.79Å; L111-V151 HydrophobicContact CD2-CG2 4.05Å; L111-L154 HydrophobicContact CD2-CD1 4.41Å; L111-Q164 PolarHBondContact O-NE2 3.41Å
112	A	89.5	Confident	87.8	Confident	66 Å²	66	39.2 Å²	39.2	55%	0.545	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-20.1	174.4	0	0	0	0	0	113.6	P108 L110	P108-A112 WeakPolarHBondContact O-CB 3.24Å; P108-A112 PolarHBondContact O-N 3Å; L110-A112 PolarHBondContact O-N 3.35Å
113	T	89.6	Confident	87.3	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.025	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-14.5	176.9	63.8	0	0	0	0	113	A67 L95 L110 L111 L116 L117	A67-T113 HydrophobicContact CB-CG2 3.7Å; L95-T113 HydrophobicContact CD1-CG2 4.18Å; L110-T113 PolarHBondContact O-N 3.33Å; L110-T113 PolarHBondContact O-OG1 3.07Å; L111-T113 VanDerWaalsContact C-N 3.28Å; L111-T113 PolarHBondContact O-N 3.12Å; T113-L116 WeakPolarHBondContact O-CB 3.41Å; T113-L116 PolarHBondContact O-N 3.39Å; T113-L117 WeakPolarHBondContact O-CG 3.12Å; T113-L117 PolarHBondContact O-N 2.91Å; T113-L117 VanDerWaalsContact O-N 3.1Å
114	V	92.3	Very high	85.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-52.9	-47.5	-177.9	167.8	0	0	0	0	113.3	L111 L116 L117 L118 L148 V151 L161 Q164	L111-V114 WeakPolarHBondContact O-CB 3.37Å; L111-V114 PolarHBondContact O-N 3.17Å; V114-L116 PolarHBondContact O-N 3.36Å; V114-L117 PolarHBondContact O-N 2.88Å; V114-L117 VanDerWaalsContact O-N 3.14Å; V114-L118 HydrophobicContact CG1-CD1 3.72Å; V114-L118 HydrophobicContact CG1-CG 4.16Å; V114-L118 WeakPolarHBondContact O-CG 3.31Å; V114-L118 PolarHBondContact O-N 3.23Å; V114-L148 HydrophobicContact CG1-CD2 3.94Å; V114-L148 HydrophobicContact CG2-CD2 4.47Å; V114-V151 HydrophobicContact CG2-CG2 4.28Å; V114-L161 HydrophobicContact CG1-CD2 3.68Å; V114-L161 HydrophobicContact CG2-CD2 4.43Å; V114-Q164 HydrophobicContact CG1-CB 4.29Å
115	P	91.2	Very high	83.3	Confident	60 Å²	60	44.8 Å²	44.8	39%	0.39	28%	0.276	S	S	.	.	H	α-helix	trans	-58.6	-34.9	177.8	-25.3	35.4	0	0	0	113.5	L118 S119 Q164	P115-L118 PolarHBondContact O-N 3.16Å; P115-S119 PolarHBondContact O-N 2.95Å; P115-S119 PolarHBondContact O-OG 3.27Å; P115-Q164 HydrophobicContact CG-CB 4.33Å; P115-Q164 HydrophobicContact CG-CG 4.34Å
116	L	88.3	Confident	81	Confident	49 Å²	49	48.4 Å²	48.4	26%	0.257	31%	0.313	S	S	.	.	H	α-helix	trans	-69.6	-40.6	177.4	-60.9	171.1	0	0	0	111.5	V71 L74 T113 V114 L118 S119 L120	V71-L116 HydrophobicContact CG2-CD1 3.74Å; L74-L116 HydrophobicContact CD1-CD2 4Å; T113-L116 WeakPolarHBondContact O-CB 3.41Å; T113-L116 PolarHBondContact O-N 3.39Å; V114-L116 PolarHBondContact O-N 3.36Å; L116-L118 VanDerWaalsContact C-N 3.34Å; L116-S119 WeakPolarHBondContact CA-OG 3.25Å; L116-S119 PolarHBondContact O-N 3.22Å; L116-S119 PolarHBondContact O-OG 3.48Å; L116-L120 VanDerWaalsContact O-CG 3.28Å; L116-L120 WeakPolarHBondContact O-CG 3.46Å; L116-L120 PolarHBondContact O-N 3.21Å; L116-L120 VanDerWaalsContact O-N 3.07Å
117	L	91.1	Very high	78.5	Confident	0 Å²	0	51 Å²	51	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64.9	-41.3	175.5	-60.4	177	0	0	0	111	L70 L95 T113 V114 L120 L121 V147	L70-L117 HydrophobicContact CD1-CD2 3.91Å; L95-L117 HydrophobicContact CD1-CD2 4.4Å; T113-L117 WeakPolarHBondContact O-CG 3.12Å; T113-L117 PolarHBondContact O-N 2.91Å; T113-L117 VanDerWaalsContact O-N 3.1Å; V114-L117 PolarHBondContact O-N 2.88Å; V114-L117 VanDerWaalsContact O-N 3.14Å; L117-L120 PolarHBondContact O-N 3.44Å; L117-L121 WeakPolarHBondContact O-CG 3.41Å; L117-L121 PolarHBondContact O-N 2.84Å; L117-V147 HydrophobicContact CD1-CB 3.85Å; L117-V147 HydrophobicContact CD1-CG1 3.55Å; L117-V147 HydrophobicContact CD1-CG2 4.39Å
118	L	91	Very high	76	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-65.3	-40.4	176.9	-70.5	171.8	0	0	0	112.2	V114 P115 L116 L121 A122 L148 A166 A169	V114-L118 HydrophobicContact CG1-CD1 3.72Å; V114-L118 HydrophobicContact CG1-CG 4.16Å; V114-L118 WeakPolarHBondContact O-CG 3.31Å; V114-L118 PolarHBondContact O-N 3.23Å; P115-L118 PolarHBondContact O-N 3.16Å; L116-L118 VanDerWaalsContact C-N 3.34Å; L118-L121 PolarHBondContact O-N 3.07Å; L118-A122 VanDerWaalsContact O-CB 3.26Å; L118-A122 WeakPolarHBondContact O-CB 3Å; L118-A122 PolarHBondContact O-N 2.85Å; L118-L148 HydrophobicContact CD2-CD1 3.82Å; L118-L148 HydrophobicContact CD2-CD2 4.13Å; L118-L148 HydrophobicContact CG-CD2 4.29Å; L118-A166 HydrophobicContact CD1-CB 3.94Å; L118-A166 HydrophobicContact CD2-CB 4.07Å; L118-A169 HydrophobicContact CB-CB 3.81Å; L118-A169 HydrophobicContact CD2-CB 4.09Å; L118-A169 HydrophobicContact CG-CB 4.41Å
119	S	87.7	Confident	73.6	Confident	47 Å²	47	60.1 Å²	60.1	33%	0.329	37%	0.365	S	S	.	.	H	α-helix	trans	-64.8	-42.8	175.9	59.2	0	0	0	0	112	P115 L116 L121 A122 D123	P115-S119 PolarHBondContact O-N 2.95Å; P115-S119 PolarHBondContact O-OG 3.27Å; L116-S119 WeakPolarHBondContact CA-OG 3.25Å; L116-S119 PolarHBondContact O-N 3.22Å; L116-S119 PolarHBondContact O-OG 3.48Å; S119-L121 PolarHBondContact O-N 3.17Å; S119-A122 PolarHBondContact O-N 3.25Å; S119-A122 VanDerWaalsContact O-N 3.16Å; S119-D123 PolarHBondContact O-N 3.49Å
120	L	87	Confident	71.2	Confident	12 Å²	12	64.3 Å²	64.3	6%	0.063	39%	0.385	C	S	.	.	H	α-helix	trans	-56.9	-38	176.2	-76.1	169	0	0	0	112.4	L74 L88 L116 L117 L136	L74-L120 HydrophobicContact CD2-CD2 3.85Å; L88-L120 HydrophobicContact CD2-CD1 4.2Å; L88-L120 HydrophobicContact CD2-CD2 4.06Å; L116-L120 VanDerWaalsContact O-CG 3.28Å; L116-L120 WeakPolarHBondContact O-CG 3.46Å; L116-L120 PolarHBondContact O-N 3.21Å; L116-L120 VanDerWaalsContact O-N 3.07Å; L117-L120 PolarHBondContact O-N 3.44Å; L120-L136 HydrophobicContact CD2-CD2 4.31Å; L120-L136 VanDerWaalsContact O-CD1 3.31Å; L120-L136 WeakPolarHBondContact O-CD1 3.44Å
121	L	87.4	Confident	68.7	Low	4 Å²	4	72 Å²	72	2%	0.021	43%	0.426	C	S	.	.	H	α-helix	trans	-79.1	-32.2	178.6	-66.5	175	0	0	0	113.1	L117 L118 S119 V141 C144 F145 L148 A173 Q176	L117-L121 WeakPolarHBondContact O-CG 3.41Å; L117-L121 PolarHBondContact O-N 2.84Å; L118-L121 PolarHBondContact O-N 3.07Å; S119-L121 PolarHBondContact O-N 3.17Å; L121-V141 HydrophobicContact CD2-CG1 4.16Å; L121-C144 HydrophobicContact CD1-CB 4.05Å; L121-C144 HydrophobicContact CD2-CB 3.98Å; L121-C144 HydrophobicContact CG-CB 4.11Å; L121-F145 HydrophobicContact CD1-CD1 4.4Å; L121-F145 HydrophobicContact CD1-CE1 4.1Å; L121-F145 HydrophobicContact CD1-CE2 4.25Å; L121-F145 HydrophobicContact CD1-CZ 4.02Å; L121-F145 HydrophobicContact CD2-CD2 4.23Å; L121-F145 HydrophobicContact CD2-CE2 3.81Å; L121-F145 HydrophobicContact CD2-CZ 4.24Å; L121-L148 HydrophobicContact CD1-CD1 3.56Å; L121-A173 HydrophobicContact CB-CB 4.4Å; L121-A173 WeakPolarHBondContact O-CB 3.34Å; L121-Q176 PolarHBondContact O-NE2 3.4Å
122	A	82.1	Confident	66.2	Low	5 Å²	5	79 Å²	79	4%	0.041	45%	0.45	C	S	.	.	H	α-helix	trans	-79.4	-23.1	-174.2	0	0	0	0	0	113.8	L118 S119 A124 A169 R172 Q176	L118-A122 VanDerWaalsContact O-CB 3.26Å; L118-A122 WeakPolarHBondContact O-CB 3Å; L118-A122 PolarHBondContact O-N 2.85Å; S119-A122 PolarHBondContact O-N 3.25Å; S119-A122 VanDerWaalsContact O-N 3.16Å; A122-A124 PolarHBondContact O-N 3.22Å; A122-A169 HydrophobicContact CB-CB 3.99Å; A122-R172 HydrophobicContact CB-CB 4.27Å; A122-Q176 PolarHBondContact O-NE2 3.3Å
123	D	70.9	Confident	63.7	Low	106 Å²	106	80.9 Å²	80.9	57%	0.567	47%	0.465	S	S	*	.			trans	-72.5	115.7	-176.1	-76.6	-20.9	0	0	0	112.2	S119 Q176 R178	S119-D123 PolarHBondContact O-N 3.49Å; D123-Q176 PolarHBondContact O-NE2 3.48Å; D123-R178 PolarHBondContact O-NH2 3.15Å
124	A	46.8	Very low	61.9	Low	63 Å²	63	87.7 Å²	87.7	52%	0.521	50%	0.497	S	S	.	.			trans	-104.8	143.5	161.5	0	0	0	0	0	108.5	A122 G126 Q176	A122-A124 PolarHBondContact O-N 3.22Å; A124-G126 PolarHBondContact O-N 3.19Å; A124-Q176 HydrophobicContact CB-CG 4.35Å
125	P	38.5	Very low	60.3	Low	142 Å²	142	92.4 Å²	92.4	92%	0.922	53%	0.53	S	S	*	.	S	Bend	trans	-67.9	101.1	-172.1	28.6	-33.6	0	0	0	110.2
126	G	38.8	Very low	59.3	Low	75 Å²	75	91.2 Å²	91.2	77%	0.773	52%	0.52	S	S	*	.			trans	-164.7	22.6	-171.4	0	0	0	0	0	116.3	A124	A124-G126 PolarHBondContact O-N 3.19Å
127	S	34	Very low	58.8	Low	108 Å²	108	92.6 Å²	92.6	76%	0.755	53%	0.528	S	S	*	.	S	Bend	trans	-146	105.3	165.8	50.2	0	0	0	0	110.7	Q129	S127-Q129 PolarHBondContact O-N 3.27Å; S127-Q129 VanDerWaalsContact O-N 3.08Å
128	Q	37.1	Very low	58.5	Low	193 Å²	193	99.1 Å²	99.1	90%	0.902	56%	0.558	S	S	*	*	S	Bend	trans	35.2	58.4	158.8	-62.7	-172.5	-13.2	0	0	118.2
129	Q	37	Very low	58.2	Low	183 Å²	183	101 Å²	101	86%	0.855	58%	0.575	S	S	*	*			trans	-156.3	77.3	151.8	-110.5	146.5	-10.2	0	0	109	S127 N131	S127-Q129 PolarHBondContact O-N 3.27Å; S127-Q129 VanDerWaalsContact O-N 3.08Å; Q129-N131 PolarHBondContact O-N 3.49Å
130	Q	35.9	Very low	58.2	Low	199 Å²	199	98.9 Å²	98.9	93%	0.93	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	80.9	163.5	-89.8	157.6	-35.3	0	0	108.8
131	N	36.4	Very low	58.3	Low	161 Å²	161	98.6 Å²	98.6	86%	0.861	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-178.3	27.4	153	-98.2	-8.3	0	0	0	115.8	Q129	Q129-N131 PolarHBondContact O-N 3.49Å
132	R	37.8	Very low	58.4	Low	177 Å²	177	100 Å²	100	67%	0.668	57%	0.571	S	S	*	*			trans	-120.5	71.1	163.1	-74.7	-170.3	-179.3	171.7	3.7	111	D76 E134	D76-R132 IonicContact OD1-NH2 3.23Å; D76-R132 PolarHBondContact OD1-NH2 3.33Å; D76-R132 VanDerWaalsContact OD1-NH2 3.08Å; R132-E134 PolarHBondContact O-N 3.43Å
133	A	37.2	Very low	58.9	Low	105 Å²	105	101.5 Å²	101.5	87%	0.868	58%	0.578	S	S	*	*			trans	-82	70.2	161.9	0	0	0	0	0	109.3
134	E	50.7	Low	60	Low	147 Å²	147	96.5 Å²	96.5	69%	0.687	55%	0.551	S	S	*	*			trans	-131.9	103.2	153.1	-76.2	-175.1	178.2	0	0	105.7	R132 L136	R132-E134 PolarHBondContact O-N 3.43Å; E134-L136 PolarHBondContact O-N 3Å
135	S	59.8	Low	62.2	Low	100 Å²	100	94 Å²	94	70%	0.699	53%	0.528	S	S	*	.			trans	-54.9	129.5	173.2	50.6	0	0	0	0	109.2	D137	S135-D137 PolarHBondContact O-N 2.98Å
136	L	68.7	Low	64.9	Low	34 Å²	34	91.6 Å²	91.6	18%	0.178	51%	0.505	C	S	.	.			trans	-43	128.1	166.1	-76.1	154.3	0	0	0	109.9	L88 L120 E134 V140	L88-L136 HydrophobicContact CD1-CD2 4.16Å; L120-L136 HydrophobicContact CD2-CD2 4.31Å; L120-L136 VanDerWaalsContact O-CD1 3.31Å; L120-L136 WeakPolarHBondContact O-CD1 3.44Å; E134-L136 PolarHBondContact O-N 3Å; L136-V140 HydrophobicContact CD2-CG1 4.35Å
137	D	79.6	Confident	67.5	Low	79 Å²	79	88 Å²	88	42%	0.422	47%	0.468	S	S	.	.			trans	-63.5	143.5	-178.9	176.3	18.5	0	0	0	110.7	S135 A139 V140 V141	S135-D137 PolarHBondContact O-N 2.98Å; D137-A139 PolarHBondContact O-N 2.83Å; D137-A139 PolarHBondContact OD1-N 3.32Å; D137-V140 HydrophobicContact CB-CG2 4.11Å; D137-V140 WeakPolarHBondContact O-CB 3.19Å; D137-V140 PolarHBondContact O-N 3.22Å; D137-V141 PolarHBondContact O-N 2.9Å; D137-V141 VanDerWaalsContact O-N 3.17Å
138	E	83	Confident	70.5	Confident	137 Å²	137	83 Å²	83	64%	0.64	43%	0.433	S	S	*	.	H	α-helix	trans	-60.8	-31.3	-178.1	-172.1	177.4	175.2	0	0	111.7	V141 A142	E138-V141 PolarHBondContact O-N 2.72Å; E138-A142 WeakPolarHBondContact O-CB 3.38Å; E138-A142 PolarHBondContact O-N 2.91Å
139	A	85.7	Confident	73.2	Confident	45 Å²	45	77.2 Å²	77.2	37%	0.372	41%	0.411	S	S	.	.	H	α-helix	trans	-61.6	-45.5	173.4	0	0	0	0	0	111.7	D137 V141 A142 D143	D137-A139 PolarHBondContact O-N 2.83Å; D137-A139 PolarHBondContact OD1-N 3.32Å; A139-V141 VanDerWaalsContact C-N 3.31Å; A139-V141 PolarHBondContact O-N 3.37Å; A139-A142 WeakPolarHBondContact O-CB 3.5Å; A139-A142 PolarHBondContact O-N 3.49Å; A139-A142 VanDerWaalsContact O-N 3.12Å; A139-D143 VanDerWaalsContact O-CG 3.31Å; A139-D143 PolarHBondContact O-N 3.04Å
140	V	88	Confident	75.9	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.012	38%	0.379	C	S	.	.	H	α-helix	trans	-63	-40.8	178.2	-176.9	0	0	0	0	111	A92 L136 D137 D143 C144	A92-V140 HydrophobicContact CB-CG1 3.92Å; L136-V140 HydrophobicContact CD2-CG1 4.35Å; D137-V140 HydrophobicContact CB-CG2 4.11Å; D137-V140 WeakPolarHBondContact O-CB 3.19Å; D137-V140 PolarHBondContact O-N 3.22Å; V140-D143 PolarHBondContact O-N 3.44Å; V140-C144 WeakPolarHBondContact O-CB 3.44Å; V140-C144 PolarHBondContact O-N 3.26Å; V140-C144 PolarHBondContact O-SG 2.74Å
141	V	89.1	Confident	78.7	Confident	6 Å²	6	60.4 Å²	60.4	4%	0.036	33%	0.334	C	S	.	.	H	α-helix	trans	-62	-45.2	174.5	172.6	0	0	0	0	110.6	L121 D137 E138 A139 C144 F145 C179	L121-V141 HydrophobicContact CD2-CG1 4.16Å; D137-V141 PolarHBondContact O-N 2.9Å; D137-V141 VanDerWaalsContact O-N 3.17Å; E138-V141 PolarHBondContact O-N 2.72Å; A139-V141 VanDerWaalsContact C-N 3.31Å; A139-V141 PolarHBondContact O-N 3.37Å; V141-C144 PolarHBondContact O-N 3.48Å; V141-F145 HydrophobicContact CG1-CD2 3.74Å; V141-F145 HydrophobicContact CG1-CE2 3.69Å; V141-F145 VanDerWaalsContact O-CD2 3.23Å; V141-F145 WeakPolarHBondContact O-CD2 3.5Å; V141-F145 PolarHBondContact O-N 3.48Å; V141-C179 WeakPolarHBondContact CG1-SG 3.46Å
142	A	90.1	Very high	81.3	Confident	33 Å²	33	53.4 Å²	53.4	27%	0.273	30%	0.297	S	S	.	.	H	α-helix	trans	-59	-47.2	176.9	0	0	0	0	0	111.8	E138 A139 C144 F145 Q146	E138-A142 WeakPolarHBondContact O-CB 3.38Å; E138-A142 PolarHBondContact O-N 2.91Å; A139-A142 WeakPolarHBondContact O-CB 3.5Å; A139-A142 PolarHBondContact O-N 3.49Å; A139-A142 VanDerWaalsContact O-N 3.12Å; A142-C144 PolarHBondContact O-N 3.45Å; A142-F145 PolarHBondContact O-N 3.42Å; A142-Q146 WeakPolarHBondContact O-CB 3.48Å; A142-Q146 PolarHBondContact O-N 3.44Å
143	D	92.6	Very high	83.8	Confident	36 Å²	36	48.1 Å²	48.1	19%	0.193	30%	0.297	C	S	.	.	H	α-helix	trans	-62.6	-42.7	179.5	-71.3	-26.5	0	0	0	111.8	A92 A93 A96 A139 V140 F145 Q146 V147	A92-D143 HydrophobicContact CB-CB 3.87Å; A93-D143 VanDerWaalsContact CA-OD2 3.24Å; A93-D143 WeakPolarHBondContact CA-OD2 3.42Å; A93-D143 WeakPolarHBondContact CB-OD2 3.27Å; A93-D143 PolarHBondContact N-OD2 3.37Å; A96-D143 HydrophobicContact CB-CB 3.77Å; A139-D143 VanDerWaalsContact O-CG 3.31Å; A139-D143 PolarHBondContact O-N 3.04Å; V140-D143 PolarHBondContact O-N 3.44Å; D143-F145 PolarHBondContact O-N 3Å; D143-Q146 WeakPolarHBondContact O-CB 3.34Å; D143-Q146 PolarHBondContact O-N 3.29Å; D143-V147 WeakPolarHBondContact O-CG2 3.27Å; D143-V147 PolarHBondContact O-N 3.46Å
144	C	92.8	Very high	86.3	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	26%	0.264	C	S	.	.	H	α-helix	trans	-60.4	-47.6	175.3	-68	0	0	0	0	111.6	L121 V140 V141 A142 Q146 V147 L148	L121-C144 HydrophobicContact CD1-CB 4.05Å; L121-C144 HydrophobicContact CD2-CB 3.98Å; L121-C144 HydrophobicContact CG-CB 4.11Å; V140-C144 WeakPolarHBondContact O-CB 3.44Å; V140-C144 PolarHBondContact O-N 3.26Å; V140-C144 PolarHBondContact O-SG 2.74Å; V141-C144 PolarHBondContact O-N 3.48Å; A142-C144 PolarHBondContact O-N 3.45Å; C144-Q146 VanDerWaalsContact C-N 3.31Å; C144-Q146 PolarHBondContact O-N 3.28Å; C144-V147 PolarHBondContact O-N 2.95Å; C144-L148 VanDerWaalsContact O-CG 3.32Å; C144-L148 WeakPolarHBondContact O-CG 3.24Å; C144-L148 PolarHBondContact O-N 2.92Å
145	F	94.3	Very high	87.9	Confident	10 Å²	10	44.8 Å²	44.8	4%	0.044	27%	0.269	C	S	.	.	H	α-helix	trans	-64.5	-35.2	176.9	-82.7	-66.1	0	0	0	112.5	L121 V141 A142 D143 L148 T149 L170 C179 R182 A183 L186	L121-F145 HydrophobicContact CD1-CD1 4.4Å; L121-F145 HydrophobicContact CD1-CE1 4.1Å; L121-F145 HydrophobicContact CD1-CE2 4.25Å; L121-F145 HydrophobicContact CD1-CZ 4.02Å; L121-F145 HydrophobicContact CD2-CD2 4.23Å; L121-F145 HydrophobicContact CD2-CE2 3.81Å; L121-F145 HydrophobicContact CD2-CZ 4.24Å; V141-F145 HydrophobicContact CG1-CD2 3.74Å; V141-F145 HydrophobicContact CG1-CE2 3.69Å; V141-F145 VanDerWaalsContact O-CD2 3.23Å; V141-F145 WeakPolarHBondContact O-CD2 3.5Å; V141-F145 PolarHBondContact O-N 3.48Å; A142-F145 PolarHBondContact O-N 3.42Å; D143-F145 PolarHBondContact O-N 3Å; F145-L148 PolarHBondContact O-N 3.08Å; F145-T149 VanDerWaalsContact O-CB 3.27Å; F145-T149 WeakPolarHBondContact O-CB 3.26Å; F145-T149 PolarHBondContact O-N 3.05Å; F145-T149 PolarHBondContact O-OG1 3.27Å; F145-L170 HydrophobicContact CE1-CD2 3.96Å; F145-C179 HydrophobicContact CE2-CB 4.12Å; F145-C179 HydrophobicContact CZ-CB 4.27Å; F145-R182 HydrophobicContact CD1-CB 4.06Å; F145-R182 HydrophobicContact CD2-CB 3.64Å; F145-R182 HydrophobicContact CD2-CG 4.34Å; F145-R182 HydrophobicContact CE1-CB 4.05Å; F145-R182 HydrophobicContact CE2-CB 3.61Å; F145-R182 HydrophobicContact CG-CB 3.89Å; F145-R182 HydrophobicContact CZ-CB 3.83Å; F145-A183 HydrophobicContact CE1-CB 4.24Å; F145-A183 HydrophobicContact CZ-CB 3.91Å; F145-L186 HydrophobicContact CD1-CB 4.35Å; F145-L186 HydrophobicContact CD1-CD2 3.81Å; F145-L186 HydrophobicContact CE1-CB 4.43Å; F145-L186 HydrophobicContact CE1-CD2 4.08Å
146	Q	94.3	Very high	89.2	Confident	92 Å²	92	47.9 Å²	47.9	43%	0.43	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-47.8	175.8	-179.1	62	27.4	0	0	111.2	A96 A142 D143 C144 L148 T149 T150	A96-Q146 HydrophobicContact CB-CB 4.29Å; A96-Q146 HydrophobicContact CB-CG 4.28Å; A142-Q146 WeakPolarHBondContact O-CB 3.48Å; A142-Q146 PolarHBondContact O-N 3.44Å; D143-Q146 WeakPolarHBondContact O-CB 3.34Å; D143-Q146 PolarHBondContact O-N 3.29Å; C144-Q146 VanDerWaalsContact C-N 3.31Å; C144-Q146 PolarHBondContact O-N 3.28Å; Q146-L148 PolarHBondContact O-N 3.11Å; Q146-T149 PolarHBondContact O-N 3.04Å; Q146-T150 WeakPolarHBondContact O-CB 3.41Å; Q146-T150 PolarHBondContact O-N 3.23Å; Q146-T150 PolarHBondContact O-OG1 3.06Å
147	V	94.5	Very high	90.1	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-60	-49.1	176.9	178.3	0	0	0	0	110.5	L95 A96 L110 L117 D143 C144 T149 T150 V151	L95-V147 HydrophobicContact CB-CG2 3.9Å; A96-V147 HydrophobicContact CB-CG2 4.06Å; L110-V147 HydrophobicContact CD2-CG1 4.01Å; L117-V147 HydrophobicContact CD1-CB 3.85Å; L117-V147 HydrophobicContact CD1-CG1 3.55Å; L117-V147 HydrophobicContact CD1-CG2 4.39Å; D143-V147 WeakPolarHBondContact O-CG2 3.27Å; D143-V147 PolarHBondContact O-N 3.46Å; C144-V147 PolarHBondContact O-N 2.95Å; V147-T149 PolarHBondContact O-N 3.25Å; V147-T150 WeakPolarHBondContact O-CB 3.24Å; V147-T150 PolarHBondContact O-N 3.28Å; V147-V151 HydrophobicContact CG1-CG2 4.46Å; V147-V151 WeakPolarHBondContact O-CG2 3.47Å; V147-V151 PolarHBondContact O-N 2.91Å
148	L	95.3	Very high	90.7	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-64.2	-39.6	-178.8	-65.6	173.7	0	0	0	112.6	V114 L118 L121 C144 F145 Q146 T150 V151 L152 L161 L186	V114-L148 HydrophobicContact CG1-CD2 3.94Å; V114-L148 HydrophobicContact CG2-CD2 4.47Å; L118-L148 HydrophobicContact CD2-CD1 3.82Å; L118-L148 HydrophobicContact CD2-CD2 4.13Å; L118-L148 HydrophobicContact CG-CD2 4.29Å; L121-L148 HydrophobicContact CD1-CD1 3.56Å; C144-L148 VanDerWaalsContact O-CG 3.32Å; C144-L148 WeakPolarHBondContact O-CG 3.24Å; C144-L148 PolarHBondContact O-N 2.92Å; F145-L148 PolarHBondContact O-N 3.08Å; Q146-L148 PolarHBondContact O-N 3.11Å; L148-T150 VanDerWaalsContact C-N 3.31Å; L148-T150 PolarHBondContact O-N 3.35Å; L148-V151 PolarHBondContact O-N 3.01Å; L148-L152 WeakPolarHBondContact O-CB 3.34Å; L148-L152 PolarHBondContact O-N 3.2Å; L148-L161 HydrophobicContact CD2-CD2 3.97Å; L148-L186 HydrophobicContact CB-CD2 3.55Å; L148-L186 HydrophobicContact CD1-CD2 3.9Å; L148-L186 HydrophobicContact CG-CD2 4.38Å
149	T	95	Very high	91.1	Very high	72 Å²	72	40.5 Å²	40.5	44%	0.442	23%	0.228	S	C	.	.	H	α-helix	trans	-63.1	-40.3	174.8	-56.8	0	0	0	0	110.8	F145 Q146 V147 L152 G153	F145-T149 VanDerWaalsContact O-CB 3.27Å; F145-T149 WeakPolarHBondContact O-CB 3.26Å; F145-T149 PolarHBondContact O-N 3.05Å; F145-T149 PolarHBondContact O-OG1 3.27Å; Q146-T149 PolarHBondContact O-N 3.04Å; V147-T149 PolarHBondContact O-N 3.25Å; T149-L152 WeakPolarHBondContact O-CB 3.42Å; T149-L152 PolarHBondContact O-N 3.21Å; T149-G153 PolarHBondContact O-N 3.43Å; T149-G153 VanDerWaalsContact O-N 3.15Å
150	T	94.1	Very high	91.3	Very high	29 Å²	29	43.9 Å²	43.9	18%	0.178	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-44.2	176.4	-48.5	0	0	0	0	111.3	S99 A105 Q146 V147 L148 L152 G153	S99-T150 WeakPolarHBondContact O-CG2 3.27Å; S99-T150 PolarHBondContact OG-OG1 3.38Å; A105-T150 HydrophobicContact CB-CG2 3.83Å; Q146-T150 WeakPolarHBondContact O-CB 3.41Å; Q146-T150 PolarHBondContact O-N 3.23Å; Q146-T150 PolarHBondContact O-OG1 3.06Å; V147-T150 WeakPolarHBondContact O-CB 3.24Å; V147-T150 PolarHBondContact O-N 3.28Å; L148-T150 VanDerWaalsContact C-N 3.31Å; L148-T150 PolarHBondContact O-N 3.35Å; T150-L152 VanDerWaalsContact C-N 3.3Å; T150-L152 PolarHBondContact O-N 3.15Å; T150-G153 PolarHBondContact O-N 3.36Å; T150-G153 VanDerWaalsContact O-N 3.14Å
151	V	93.3	Very high	91.6	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-42.1	175.5	173.4	0	0	0	0	110.6	L110 L111 V114 V147 L148 G153 L154 G157 L161	L110-V151 HydrophobicContact CD2-CG2 3.65Å; L111-V151 HydrophobicContact CD2-CG1 3.79Å; L111-V151 HydrophobicContact CD2-CG2 4.05Å; V114-V151 HydrophobicContact CG2-CG2 4.28Å; V147-V151 HydrophobicContact CG1-CG2 4.46Å; V147-V151 WeakPolarHBondContact O-CG2 3.47Å; V147-V151 PolarHBondContact O-N 2.91Å; L148-V151 PolarHBondContact O-N 3.01Å; V151-G153 PolarHBondContact O-N 3.27Å; V151-L154 VanDerWaalsContact O-CB 3.31Å; V151-L154 WeakPolarHBondContact O-CB 3.19Å; V151-L154 WeakPolarHBondContact O-CG 3.19Å; V151-L154 PolarHBondContact O-N 3.44Å; V151-G157 WeakPolarHBondContact O-CA 3.35Å; V151-L161 HydrophobicContact CB-CD2 4.32Å; V151-L161 HydrophobicContact CG1-CD1 4.32Å; V151-L161 HydrophobicContact CG1-CD2 3.76Å; V151-L161 HydrophobicContact CG1-CG 3.89Å
152	L	92.3	Very high	91.7	Very high	14 Å²	14	44 Å²	44	7%	0.073	23%	0.231	C	C	.	.	H	α-helix	trans	-60	-32.4	177.1	-177	66.6	0	0	0	112.9	L148 T149 T150 L154 P158 L161 L186 C189 L190 R193	L148-L152 WeakPolarHBondContact O-CB 3.34Å; L148-L152 PolarHBondContact O-N 3.2Å; T149-L152 WeakPolarHBondContact O-CB 3.42Å; T149-L152 PolarHBondContact O-N 3.21Å; T150-L152 VanDerWaalsContact C-N 3.3Å; T150-L152 PolarHBondContact O-N 3.15Å; L152-L154 PolarHBondContact O-N 3.1Å; L152-P158 HydrophobicContact CD1-CB 4Å; L152-P158 HydrophobicContact CD1-CG 3.83Å; L152-L161 HydrophobicContact CB-CD1 3.77Å; L152-L161 HydrophobicContact CD1-CD1 3.94Å; L152-L161 HydrophobicContact CG-CD1 4.44Å; L152-L186 HydrophobicContact CB-CD1 4.4Å; L152-L186 HydrophobicContact CD2-CD1 3.77Å; L152-C189 HydrophobicContact CD2-CB 3.46Å; L152-C189 VanDerWaalsContact CD2-CB 3.46Å; L152-L190 HydrophobicContact CD1-CB 4.19Å; L152-L190 HydrophobicContact CD1-CD1 3.81Å; L152-R193 PolarHBondContact O-NH1 2.68Å
153	G	89.6	Confident	91.8	Very high	66 Å²	66	45.5 Å²	45.5	68%	0.68	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.9	176.4	0	0	0	0	0	114.8	T149 T150 V151	T149-G153 PolarHBondContact O-N 3.43Å; T149-G153 VanDerWaalsContact O-N 3.15Å; T150-G153 PolarHBondContact O-N 3.36Å; T150-G153 VanDerWaalsContact O-N 3.14Å; V151-G153 PolarHBondContact O-N 3.27Å
154	L	89.5	Confident	91.8	Very high	32 Å²	32	46.6 Å²	46.6	17%	0.168	25%	0.248	C	C	.	.	S	Bend	trans	-73.1	155.5	176.8	-60.1	173.5	0	0	0	111.6	A105 A106 L111 V151 L152 R156 G157 R193	A105-L154 HydrophobicContact CB-CD1 4.32Å; A105-L154 HydrophobicContact CB-CD2 4.28Å; A106-L154 HydrophobicContact CB-CD1 4.38Å; A106-L154 HydrophobicContact CB-CD2 4.29Å; L111-L154 HydrophobicContact CD2-CD1 4.41Å; V151-L154 VanDerWaalsContact O-CB 3.31Å; V151-L154 WeakPolarHBondContact O-CB 3.19Å; V151-L154 WeakPolarHBondContact O-CG 3.19Å; V151-L154 PolarHBondContact O-N 3.44Å; L152-L154 PolarHBondContact O-N 3.1Å; L154-R156 VanDerWaalsContact C-N 3.32Å; L154-R156 PolarHBondContact O-N 3Å; L154-G157 PolarHBondContact O-N 3.36Å; L154-G157 VanDerWaalsContact O-N 3.08Å; L154-R193 PolarHBondContact O-NH1 3.44Å
155	L	84.7	Confident	91.7	Very high	150 Å²	150	47.7 Å²	47.7	79%	0.785	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-46.7	-179.8	-178.8	62.5	0	0	0	112.5	R193	L155-R193 PolarHBondContact O-NH2 3.19Å
156	R	86.7	Confident	91.7	Very high	165 Å²	165	47.3 Å²	47.3	62%	0.623	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	15.9	177.4	-60.9	-175.8	66.2	-178.1	4.9	113.4	L154 E159 R160	L154-R156 VanDerWaalsContact C-N 3.32Å; L154-R156 PolarHBondContact O-N 3Å; R156-E159 WeakPolarHBondContact CA-OE2 3.49Å; R156-R160 WeakPolarHBondContact O-CB 3.33Å; R156-R160 WeakPolarHBondContact O-CG 3.32Å; R156-R160 PolarHBondContact O-N 3.42Å
157	G	88.8	Confident	91.8	Very high	2 Å²	2	42.9 Å²	42.9	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-62	-53.6	-176.8	0	0	0	0	0	113.8	V151 L154 E159 R160 L161	V151-G157 WeakPolarHBondContact O-CA 3.35Å; L154-G157 PolarHBondContact O-N 3.36Å; L154-G157 VanDerWaalsContact O-N 3.08Å; G157-E159 PolarHBondContact O-N 2.92Å; G157-R160 PolarHBondContact O-N 3.38Å; G157-L161 WeakPolarHBondContact O-CG 3.32Å; G157-L161 PolarHBondContact O-N 3.46Å
158	P	91.1	Very high	91.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-57.2	-45.5	-177.7	-22.3	30.3	0	0	0	113.3	L152 R160 L161 L162 L190 R193 T194	L152-P158 HydrophobicContact CD1-CB 4Å; L152-P158 HydrophobicContact CD1-CG 3.83Å; P158-R160 VanDerWaalsContact C-N 3.28Å; P158-R160 PolarHBondContact O-N 3.49Å; P158-L161 PolarHBondContact O-N 3.32Å; P158-L162 WeakPolarHBondContact O-CB 3.32Å; P158-L162 PolarHBondContact O-N 2.87Å; P158-L190 HydrophobicContact CB-CD1 3.95Å; P158-L190 WeakPolarHBondContact O-CD1 3.28Å; P158-R193 HydrophobicContact CB-CB 4.22Å; P158-R193 HydrophobicContact CG-CB 4.15Å; P158-R193 VanDerWaalsContact CG-CZ 3.49Å; P158-R193 VanDerWaalsContact CG-NH1 3.3Å; P158-T194 HydrophobicContact CB-CG2 3.45Å; P158-T194 VanDerWaalsContact CB-CG2 3.45Å
159	E	91.8	Very high	91.7	Very high	94 Å²	94	43.8 Å²	43.8	44%	0.439	24%	0.244	S	C	.	.	H	α-helix	trans	-66.5	-34	-179	-55.4	79.5	-174.2	0	0	111.3	R156 G157 A163	R156-E159 WeakPolarHBondContact CA-OE2 3.49Å; G157-E159 PolarHBondContact O-N 2.92Å; E159-A163 VanDerWaalsContact O-CB 3.28Å; E159-A163 WeakPolarHBondContact O-CB 3.16Å; E159-A163 PolarHBondContact O-N 3.46Å
160	R	89.5	Confident	91.6	Very high	116 Å²	116	40.5 Å²	40.5	44%	0.438	22%	0.223	S	C	.	.	H	α-helix	trans	-70.1	-46.4	176.2	-67.8	-73.1	-173.2	-178.5	3.5	111.5	R156 G157 P158 L162 A163 Q164	R156-R160 WeakPolarHBondContact O-CB 3.33Å; R156-R160 WeakPolarHBondContact O-CG 3.32Å; R156-R160 PolarHBondContact O-N 3.42Å; G157-R160 PolarHBondContact O-N 3.38Å; P158-R160 VanDerWaalsContact C-N 3.28Å; P158-R160 PolarHBondContact O-N 3.49Å; R160-L162 VanDerWaalsContact C-N 3.3Å; R160-L162 PolarHBondContact O-N 3.16Å; R160-A163 PolarHBondContact O-N 2.9Å; R160-Q164 WeakPolarHBondContact O-CB 3.27Å; R160-Q164 VanDerWaalsContact O-CG 3.31Å; R160-Q164 WeakPolarHBondContact O-CG 3.43Å; R160-Q164 PolarHBondContact O-N 3.21Å
161	L	93.6	Very high	91.6	Very high	4 Å²	4	40 Å²	40	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-58.2	-45.7	175.2	-71.7	179.6	0	0	0	110.7	V114 L148 V151 L152 G157 P158 Q164 G165 A166 L190	V114-L161 HydrophobicContact CG1-CD2 3.68Å; V114-L161 HydrophobicContact CG2-CD2 4.43Å; L148-L161 HydrophobicContact CD2-CD2 3.97Å; V151-L161 HydrophobicContact CB-CD2 4.32Å; V151-L161 HydrophobicContact CG1-CD1 4.32Å; V151-L161 HydrophobicContact CG1-CD2 3.76Å; V151-L161 HydrophobicContact CG1-CG 3.89Å; L152-L161 HydrophobicContact CB-CD1 3.77Å; L152-L161 HydrophobicContact CD1-CD1 3.94Å; L152-L161 HydrophobicContact CG-CD1 4.44Å; G157-L161 WeakPolarHBondContact O-CG 3.32Å; G157-L161 PolarHBondContact O-N 3.46Å; P158-L161 PolarHBondContact O-N 3.32Å; L161-Q164 PolarHBondContact O-N 3.46Å; L161-G165 PolarHBondContact O-N 3.08Å; L161-A166 HydrophobicContact CB-CB 3.92Å; L161-A166 WeakPolarHBondContact O-CB 3.37Å; L161-A166 PolarHBondContact O-N 3.07Å; L161-L190 HydrophobicContact CB-CD1 4.12Å
162	L	93.1	Very high	91.5	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-46.8	176.7	-177.4	59.9	0	0	0	111.9	P158 R160 Q164 G165 V167 T194 E197 A198	P158-L162 WeakPolarHBondContact O-CB 3.32Å; P158-L162 PolarHBondContact O-N 2.87Å; R160-L162 VanDerWaalsContact C-N 3.3Å; R160-L162 PolarHBondContact O-N 3.16Å; L162-Q164 PolarHBondContact O-N 2.94Å; L162-G165 PolarHBondContact O-N 2.68Å; L162-V167 HydrophobicContact CD1-CG2 3.53Å; L162-T194 HydrophobicContact CD2-CG2 4.46Å; L162-E197 HydrophobicContact CD2-CB 3.67Å; L162-E197 HydrophobicContact CD2-CG 3.39Å; L162-A198 HydrophobicContact CD1-CB 3.98Å; L162-A198 HydrophobicContact CD2-CB 4.49Å
163	A	91.3	Very high	91.4	Very high	65 Å²	65	45.8 Å²	45.8	54%	0.537	24%	0.241	S	C	.	.	H	α-helix	trans	-63.9	-24.6	177.6	0	0	0	0	0	113.8	E159 R160	E159-A163 VanDerWaalsContact O-CB 3.28Å; E159-A163 WeakPolarHBondContact O-CB 3.16Å; E159-A163 PolarHBondContact O-N 3.46Å; R160-A163 PolarHBondContact O-N 2.9Å
164	Q	91.5	Very high	91.3	Very high	59 Å²	59	43 Å²	43	28%	0.276	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	11.6	179.5	-71.1	177.3	-31.6	0	0	113.6	L111 V114 P115 R160 L161 L162	L111-Q164 PolarHBondContact O-NE2 3.41Å; V114-Q164 HydrophobicContact CG1-CB 4.29Å; P115-Q164 HydrophobicContact CG-CB 4.33Å; P115-Q164 HydrophobicContact CG-CG 4.34Å; R160-Q164 WeakPolarHBondContact O-CB 3.27Å; R160-Q164 VanDerWaalsContact O-CG 3.31Å; R160-Q164 WeakPolarHBondContact O-CG 3.43Å; R160-Q164 PolarHBondContact O-N 3.21Å; L161-Q164 PolarHBondContact O-N 3.46Å; L162-Q164 PolarHBondContact O-N 2.94Å
165	G	91	Very high	90.9	Very high	24 Å²	24	44.8 Å²	44.8	25%	0.247	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	27.1	174.9	0	0	0	0	0	114.4	L161 L162 V167 P168 A169	L161-G165 PolarHBondContact O-N 3.08Å; L162-G165 PolarHBondContact O-N 2.68Å; G165-V167 VanDerWaalsContact C-N 3.32Å; G165-V167 PolarHBondContact O-N 3.38Å; G165-P168 WeakPolarHBondContact O-CD 3.25Å; G165-P168 WeakPolarHBondContact O-CG 3.33Å; G165-A169 WeakPolarHBondContact O-CB 3.32Å; G165-A169 PolarHBondContact O-N 2.94Å
166	A	94.9	Very high	90.7	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-60.4	-39.1	178.4	0	0	0	0	0	113	L118 L161 A169 L170 L190	L118-A166 HydrophobicContact CD1-CB 3.94Å; L118-A166 HydrophobicContact CD2-CB 4.07Å; L161-A166 HydrophobicContact CB-CB 3.92Å; L161-A166 WeakPolarHBondContact O-CB 3.37Å; L161-A166 PolarHBondContact O-N 3.07Å; A166-A169 PolarHBondContact O-N 3.26Å; A166-L170 HydrophobicContact CB-CD1 4.37Å; A166-L170 VanDerWaalsContact O-CB 3.3Å; A166-L170 WeakPolarHBondContact O-CB 3.31Å; A166-L170 WeakPolarHBondContact O-CG 3.35Å; A166-L170 PolarHBondContact O-N 3.28Å; A166-L190 HydrophobicContact CB-CD2 3.97Å
167	V	95.4	Very high	90.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.7	-60.2	-178.5	174.1	0	0	0	0	112.2	L162 G165 A169 L170 C171 L187 L190 A198 H202 L206	L162-V167 HydrophobicContact CD1-CG2 3.53Å; G165-V167 VanDerWaalsContact C-N 3.32Å; G165-V167 PolarHBondContact O-N 3.38Å; V167-A169 VanDerWaalsContact C-N 3.27Å; V167-A169 PolarHBondContact O-N 2.75Å; V167-L170 PolarHBondContact O-N 2.98Å; V167-C171 WeakPolarHBondContact O-CB 3.44Å; V167-C171 PolarHBondContact O-N 3.5Å; V167-C171 PolarHBondContact O-SG 3.49Å; V167-C171 VanDerWaalsContact O-SG 3.34Å; V167-L187 HydrophobicContact CB-CD1 4.49Å; V167-L187 HydrophobicContact CG1-CD1 4.46Å; V167-L187 HydrophobicContact CG2-CD1 4.17Å; V167-L190 HydrophobicContact CG2-CD2 3.95Å; V167-A198 HydrophobicContact CG2-CB 4.14Å; V167-H202 HydrophobicContact CB-CB 4.35Å; V167-H202 HydrophobicContact CG1-CB 3.73Å; V167-L206 HydrophobicContact CG1-CD1 4.09Å; V167-L206 HydrophobicContact CG1-CD2 3.73Å; V167-L206 HydrophobicContact CG1-CG 3.74Å
168	P	94.6	Very high	89.7	Confident	15 Å²	15	43 Å²	43	10%	0.097	23%	0.232	C	C	.	.	H	α-helix	trans	-63	-33	-179.4	21.9	-32.6	0	0	0	112.9	G165 R172 E205	G165-P168 WeakPolarHBondContact O-CD 3.25Å; G165-P168 WeakPolarHBondContact O-CG 3.33Å; P168-R172 WeakPolarHBondContact O-CG 3.44Å; P168-R172 PolarHBondContact O-N 3.03Å; P168-R172 PolarHBondContact O-NH1 2.94Å; P168-E205 HydrophobicContact CB-CG 4.11Å
169	A	93.3	Very high	89.3	Confident	6 Å²	6	43 Å²	43	5%	0.05	23%	0.232	C	C	.	.	H	α-helix	trans	-66.3	-46	175.8	0	0	0	0	0	112.5	L118 A122 G165 A166 V167 R172 A173	L118-A169 HydrophobicContact CB-CB 3.81Å; L118-A169 HydrophobicContact CD2-CB 4.09Å; L118-A169 HydrophobicContact CG-CB 4.41Å; A122-A169 HydrophobicContact CB-CB 3.99Å; G165-A169 WeakPolarHBondContact O-CB 3.32Å; G165-A169 PolarHBondContact O-N 2.94Å; A166-A169 PolarHBondContact O-N 3.26Å; V167-A169 VanDerWaalsContact C-N 3.27Å; V167-A169 PolarHBondContact O-N 2.75Å; A169-R172 PolarHBondContact O-N 2.92Å; A169-A173 PolarHBondContact O-N 3.16Å
170	L	94.7	Very high	89.1	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	22%	0.222	C	C	.	.	H	α-helix	trans	-68.5	-39.9	178.8	-67.9	171.5	0	0	0	111.7	F145 A166 V167 R172 A173 T174 A183 L186 L187	F145-L170 HydrophobicContact CE1-CD2 3.96Å; A166-L170 HydrophobicContact CB-CD1 4.37Å; A166-L170 VanDerWaalsContact O-CB 3.3Å; A166-L170 WeakPolarHBondContact O-CB 3.31Å; A166-L170 WeakPolarHBondContact O-CG 3.35Å; A166-L170 PolarHBondContact O-N 3.28Å; V167-L170 PolarHBondContact O-N 2.98Å; L170-R172 PolarHBondContact O-N 3.48Å; L170-A173 WeakPolarHBondContact O-CB 3.46Å; L170-A173 PolarHBondContact O-N 2.91Å; L170-A173 VanDerWaalsContact O-N 3.08Å; L170-T174 WeakPolarHBondContact O-CG2 3.1Å; L170-T174 PolarHBondContact O-N 3.34Å; L170-A183 HydrophobicContact CD2-CB 4.46Å; L170-L186 HydrophobicContact CD1-CD2 4.05Å; L170-L186 HydrophobicContact CD1-CG 4.16Å; L170-L186 HydrophobicContact CD2-CD2 3.9Å; L170-L187 HydrophobicContact CB-CB 4.13Å; L170-L187 HydrophobicContact CB-CD1 4.3Å; L170-L187 HydrophobicContact CB-CD2 4.25Å; L170-L187 HydrophobicContact CB-CG 4.46Å; L170-L187 HydrophobicContact CD1-CB 4.06Å; L170-L187 HydrophobicContact CD1-CD1 4.2Å
171	C	93.9	Very high	89.1	Confident	18 Å²	18	41.1 Å²	41.1	12%	0.122	23%	0.228	C	C	.	.	H	α-helix	trans	-59	-33.4	172.7	-71.4	0	0	0	0	112.9	V167 T174 E205	V167-C171 WeakPolarHBondContact O-CB 3.44Å; V167-C171 PolarHBondContact O-N 3.5Å; V167-C171 PolarHBondContact O-SG 3.49Å; V167-C171 VanDerWaalsContact O-SG 3.34Å; C171-T174 PolarHBondContact O-OG1 3.02Å; C171-E205 HydrophobicContact CB-CB 4.16Å
172	R	90.7	Very high	89	Confident	135 Å²	135	45.6 Å²	45.6	51%	0.509	25%	0.245	S	C	.	.	H	α-helix	trans	-74	-41.1	172	-72	-168.9	-61.5	-85.2	0.8	111.9	A122 P168 A169 L170 T174 G175	A122-R172 HydrophobicContact CB-CB 4.27Å; P168-R172 WeakPolarHBondContact O-CG 3.44Å; P168-R172 PolarHBondContact O-N 3.03Å; P168-R172 PolarHBondContact O-NH1 2.94Å; A169-R172 PolarHBondContact O-N 2.92Å; L170-R172 PolarHBondContact O-N 3.48Å; R172-T174 PolarHBondContact O-N 2.85Å; R172-G175 PolarHBondContact O-N 3.02Å
173	A	89.3	Confident	89.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.4	-29.8	177.9	0	0	0	0	0	112.8	L121 A169 L170 G175 Q176 C179 A183	L121-A173 HydrophobicContact CB-CB 4.4Å; L121-A173 WeakPolarHBondContact O-CB 3.34Å; A169-A173 PolarHBondContact O-N 3.16Å; L170-A173 WeakPolarHBondContact O-CB 3.46Å; L170-A173 PolarHBondContact O-N 2.91Å; L170-A173 VanDerWaalsContact O-N 3.08Å; A173-G175 PolarHBondContact O-N 3.46Å; A173-Q176 WeakPolarHBondContact O-CB 3.32Å; A173-Q176 PolarHBondContact O-N 3.31Å; A173-Q176 VanDerWaalsContact O-N 3.11Å; A173-C179 HydrophobicContact CB-CB 4.35Å; A173-A183 HydrophobicContact CB-CB 3.9Å
174	T	87.6	Confident	89.2	Confident	9 Å²	9	42.4 Å²	42.4	6%	0.055	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.3	174.3	53.7	0	0	0	0	113.2	L170 C171 R172 Q176 H180 A183 L184 L209	L170-T174 WeakPolarHBondContact O-CG2 3.1Å; L170-T174 PolarHBondContact O-N 3.34Å; C171-T174 PolarHBondContact O-OG1 3.02Å; R172-T174 PolarHBondContact O-N 2.85Å; T174-Q176 PolarHBondContact O-N 2.8Å; T174-H180 PolarHBondContact O-ND1 3.04Å; T174-A183 HydrophobicContact CG2-CB 3.6Å; T174-L184 HydrophobicContact CG2-CB 4.49Å; T174-L184 HydrophobicContact CG2-CD2 3.74Å; T174-L184 HydrophobicContact CG2-CG 3.64Å; T174-L209 HydrophobicContact CG2-CD1 4.34Å; T174-L209 HydrophobicContact CG2-CD2 4.5Å; T174-L209 WeakPolarHBondContact OG1-CD1 3.4Å
175	G	81.6	Confident	89.3	Confident	69 Å²	69	42.4 Å²	42.4	71%	0.711	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-7	173.7	0	0	0	0	0	114	R172 A173	R172-G175 PolarHBondContact O-N 3.02Å; A173-G175 PolarHBondContact O-N 3.46Å
176	Q	80.3	Confident	89.4	Confident	17 Å²	17	41.6 Å²	41.6	8%	0.079	22%	0.215	C	C	.	.	S	Bend	trans	-104.8	120.3	-179.2	-51.6	-179.4	21.5	0	0	110.5	L121 A122 D123 A124 A173 T174 R178 C179 H180	L121-Q176 PolarHBondContact O-NE2 3.4Å; A122-Q176 PolarHBondContact O-NE2 3.3Å; D123-Q176 PolarHBondContact O-NE2 3.48Å; A124-Q176 HydrophobicContact CB-CG 4.35Å; A173-Q176 WeakPolarHBondContact O-CB 3.32Å; A173-Q176 PolarHBondContact O-N 3.31Å; A173-Q176 VanDerWaalsContact O-N 3.11Å; T174-Q176 PolarHBondContact O-N 2.8Å; Q176-R178 HydrophobicContact CB-CG 4.19Å; Q176-R178 PolarHBondContact O-N 3.47Å; Q176-R178 VanDerWaalsContact OE1-CZ 3.32Å; Q176-C179 PolarHBondContact O-N 3.34Å; Q176-H180 PolarHBondContact O-N 3.45Å
177	N	77.7	Confident	89.5	Confident	160 Å²	160	41.5 Å²	41.5	86%	0.856	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-37.1	-178.3	-77.6	-6.6	0	0	0	114	C179	N177-C179 VanDerWaalsContact C-N 3.34Å; N177-C179 PolarHBondContact O-N 2.88Å
178	R	78	Confident	89.3	Confident	101 Å²	101	41.6 Å²	41.6	38%	0.381	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-28.7	179.8	57.6	172.6	-177.1	-172.3	0.3	114.7	D123 Q176	D123-R178 PolarHBondContact O-NH2 3.15Å; Q176-R178 HydrophobicContact CB-CG 4.19Å; Q176-R178 PolarHBondContact O-N 3.47Å; Q176-R178 VanDerWaalsContact OE1-CZ 3.32Å
179	C	82.1	Confident	89.2	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.007	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-11.8	-174.2	-69	0	0	0	0	112.4	V141 F145 A173 Q176 N177 Q181 R182 A183	V141-C179 WeakPolarHBondContact CG1-SG 3.46Å; F145-C179 HydrophobicContact CE2-CB 4.12Å; F145-C179 HydrophobicContact CZ-CB 4.27Å; A173-C179 HydrophobicContact CB-CB 4.35Å; Q176-C179 PolarHBondContact O-N 3.34Å; N177-C179 VanDerWaalsContact C-N 3.34Å; N177-C179 PolarHBondContact O-N 2.88Å; C179-Q181 PolarHBondContact O-N 3.16Å; C179-R182 PolarHBondContact O-N 3.36Å; C179-R182 VanDerWaalsContact O-N 3.13Å; C179-A183 VanDerWaalsContact O-CB 3.27Å; C179-A183 WeakPolarHBondContact O-CB 3.28Å; C179-A183 PolarHBondContact O-N 2.98Å
180	H	87.7	Confident	89.2	Confident	47 Å²	47	43 Å²	43	22%	0.218	23%	0.225	C	C	.	.	H	α-helix	trans	-43.8	-61.1	-169	-176.5	82.4	0	0	0	113.4	T174 Q176 R182 A183 L184	T174-H180 PolarHBondContact O-ND1 3.04Å; Q176-H180 PolarHBondContact O-N 3.45Å; H180-R182 PolarHBondContact O-N 3.47Å; H180-A183 PolarHBondContact O-N 3Å; H180-L184 WeakPolarHBondContact NE2-CD1 3.46Å; H180-L184 WeakPolarHBondContact O-CB 3.33Å; H180-L184 VanDerWaalsContact O-CG 3.3Å; H180-L184 WeakPolarHBondContact O-CG 3.4Å; H180-L184 PolarHBondContact O-N 3.47Å
181	Q	90	Very high	89	Confident	123 Å²	123	43 Å²	43	58%	0.575	23%	0.225	S	C	*	.	H	α-helix	trans	-69.2	-36.7	-175.3	-168	63.4	8.8	0	0	113.4	C179 S185	C179-Q181 PolarHBondContact O-N 3.16Å; Q181-S185 VanDerWaalsContact O-CB 3.28Å; Q181-S185 WeakPolarHBondContact O-CB 3.14Å; Q181-S185 PolarHBondContact O-N 3.44Å
182	R	91.4	Very high	88.7	Confident	98 Å²	98	46 Å²	46	37%	0.37	25%	0.246	S	C	.	.	H	α-helix	trans	-70.3	-40.9	178.9	-68.9	-176.4	179.8	165.8	3.4	111.3	F145 C179 H180 S185 L186	F145-R182 HydrophobicContact CD1-CB 4.06Å; F145-R182 HydrophobicContact CD2-CB 3.64Å; F145-R182 HydrophobicContact CD2-CG 4.34Å; F145-R182 HydrophobicContact CE1-CB 4.05Å; F145-R182 HydrophobicContact CE2-CB 3.61Å; F145-R182 HydrophobicContact CG-CB 3.89Å; F145-R182 HydrophobicContact CZ-CB 3.83Å; C179-R182 PolarHBondContact O-N 3.36Å; C179-R182 VanDerWaalsContact O-N 3.13Å; H180-R182 PolarHBondContact O-N 3.47Å; R182-S185 PolarHBondContact O-N 3.23Å; R182-L186 WeakPolarHBondContact O-CB 3.44Å; R182-L186 PolarHBondContact O-N 2.9Å
183	A	93.3	Very high	88.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.8	-46.7	175.1	0	0	0	0	0	111.4	F145 L170 A173 T174 C179 H180 L186 L187	F145-A183 HydrophobicContact CE1-CB 4.24Å; F145-A183 HydrophobicContact CZ-CB 3.91Å; L170-A183 HydrophobicContact CD2-CB 4.46Å; A173-A183 HydrophobicContact CB-CB 3.9Å; T174-A183 HydrophobicContact CG2-CB 3.6Å; C179-A183 VanDerWaalsContact O-CB 3.27Å; C179-A183 WeakPolarHBondContact O-CB 3.28Å; C179-A183 PolarHBondContact O-N 2.98Å; H180-A183 PolarHBondContact O-N 3Å; A183-L186 PolarHBondContact O-N 3.46Å; A183-L187 WeakPolarHBondContact O-CB 3.45Å; A183-L187 PolarHBondContact O-N 3.45Å
184	L	93.4	Very high	88.5	Confident	5 Å²	5	46 Å²	46	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-43.6	175.5	-76.4	167.1	0	0	0	112.3	T174 H180 G188 L209 L213 F235	T174-L184 HydrophobicContact CG2-CB 4.49Å; T174-L184 HydrophobicContact CG2-CD2 3.74Å; T174-L184 HydrophobicContact CG2-CG 3.64Å; H180-L184 WeakPolarHBondContact NE2-CD1 3.46Å; H180-L184 WeakPolarHBondContact O-CB 3.33Å; H180-L184 VanDerWaalsContact O-CG 3.3Å; H180-L184 WeakPolarHBondContact O-CG 3.4Å; H180-L184 PolarHBondContact O-N 3.47Å; L184-G188 PolarHBondContact O-N 2.87Å; L184-L209 HydrophobicContact CD2-CD1 4.22Å; L184-L209 HydrophobicContact CD2-CD2 4.31Å; L184-L213 HydrophobicContact CD1-CD2 4.44Å; L184-L213 HydrophobicContact CD2-CD1 4.16Å; L184-L213 HydrophobicContact CD2-CD2 4.12Å; L184-F235 HydrophobicContact CB-CZ 4.4Å; L184-F235 HydrophobicContact CD2-CE1 4.32Å; L184-F235 HydrophobicContact CD2-CE2 3.99Å; L184-F235 HydrophobicContact CD2-CZ 3.62Å; L184-F235 WeakPolarHBondContact O-CZ 3.28Å
185	S	93.4	Very high	88.5	Confident	58 Å²	58	50.8 Å²	50.8	41%	0.406	26%	0.264	S	S	.	.	H	α-helix	trans	-61.3	-52	178.3	-172.1	0	0	0	0	111.2	Q181 R182 L187 G188 C189	Q181-S185 VanDerWaalsContact O-CB 3.28Å; Q181-S185 WeakPolarHBondContact O-CB 3.14Å; Q181-S185 PolarHBondContact O-N 3.44Å; R182-S185 PolarHBondContact O-N 3.23Å; S185-L187 PolarHBondContact O-N 3.4Å; S185-G188 PolarHBondContact O-N 3.4Å; S185-C189 PolarHBondContact O-N 2.93Å; S185-C189 PolarHBondContact O-SG 3.22Å; S185-C189 VanDerWaalsContact O-SG 3.34Å
186	L	94.4	Very high	88.9	Confident	7 Å²	7	52.6 Å²	52.6	4%	0.037	26%	0.255	C	S	.	.	H	α-helix	trans	-64.1	-43.3	-179.5	-177.4	67.3	0	0	0	112	F145 L148 L152 L170 R182 A183 C189 L190	F145-L186 HydrophobicContact CD1-CB 4.35Å; F145-L186 HydrophobicContact CD1-CD2 3.81Å; F145-L186 HydrophobicContact CE1-CB 4.43Å; F145-L186 HydrophobicContact CE1-CD2 4.08Å; L148-L186 HydrophobicContact CB-CD2 3.55Å; L148-L186 HydrophobicContact CD1-CD2 3.9Å; L148-L186 HydrophobicContact CG-CD2 4.38Å; L152-L186 HydrophobicContact CB-CD1 4.4Å; L152-L186 HydrophobicContact CD2-CD1 3.77Å; L170-L186 HydrophobicContact CD1-CD2 4.05Å; L170-L186 HydrophobicContact CD1-CG 4.16Å; L170-L186 HydrophobicContact CD2-CD2 3.9Å; R182-L186 WeakPolarHBondContact O-CB 3.44Å; R182-L186 PolarHBondContact O-N 2.9Å; A183-L186 PolarHBondContact O-N 3.46Å; L186-C189 PolarHBondContact O-N 3.31Å; L186-L190 PolarHBondContact O-N 3.44Å
187	L	95.7	Very high	89.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.5	-41.8	177.3	-176.6	57.3	0	0	0	111.2	V167 L170 A183 S185 C189 L190 L191 L206 L209 F235	V167-L187 HydrophobicContact CB-CD1 4.49Å; V167-L187 HydrophobicContact CG1-CD1 4.46Å; V167-L187 HydrophobicContact CG2-CD1 4.17Å; L170-L187 HydrophobicContact CB-CB 4.13Å; L170-L187 HydrophobicContact CB-CD1 4.3Å; L170-L187 HydrophobicContact CB-CD2 4.25Å; L170-L187 HydrophobicContact CB-CG 4.46Å; L170-L187 HydrophobicContact CD1-CB 4.06Å; L170-L187 HydrophobicContact CD1-CD1 4.2Å; A183-L187 WeakPolarHBondContact O-CB 3.45Å; A183-L187 PolarHBondContact O-N 3.45Å; S185-L187 PolarHBondContact O-N 3.4Å; L187-C189 VanDerWaalsContact C-N 3.33Å; L187-C189 PolarHBondContact O-N 2.91Å; L187-L190 HydrophobicContact CD1-CD2 4.34Å; L187-L190 WeakPolarHBondContact O-CB 3.24Å; L187-L190 PolarHBondContact O-N 3.28Å; L187-L191 HydrophobicContact CD1-CD1 4.43Å; L187-L191 HydrophobicContact CD1-CG 4.27Å; L187-L191 HydrophobicContact CG-CD1 4.19Å; L187-L191 HydrophobicContact CG-CG 4.45Å; L187-L191 WeakPolarHBondContact O-CB 3.35Å; L187-L191 VanDerWaalsContact O-CG 3.29Å; L187-L191 WeakPolarHBondContact O-CG 3.37Å; L187-L191 PolarHBondContact O-N 2.74Å; L187-L206 HydrophobicContact CD2-CD2 4.49Å; L187-L209 HydrophobicContact CD2-CD2 3.55Å; L187-F235 HydrophobicContact CB-CE1 4.2Å; L187-F235 HydrophobicContact CD2-CE1 3.75Å; L187-F235 HydrophobicContact CG-CE1 3.77Å
188	G	92.5	Very high	90.1	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-61.1	-39.7	174.6	0	0	0	0	0	112.8	L184 S185 L191 S192	L184-G188 PolarHBondContact O-N 2.87Å; S185-G188 PolarHBondContact O-N 3.4Å; G188-L191 PolarHBondContact O-N 3.3Å; G188-S192 PolarHBondContact O-N 3.17Å
189	C	91.8	Very high	90.8	Very high	51 Å²	51	42.5 Å²	42.5	35%	0.345	21%	0.206	S	C	.	.	H	α-helix	trans	-71	-30	174.3	-67.4	0	0	0	0	113.2	L152 S185 L186 L187 S192	L152-C189 HydrophobicContact CD2-CB 3.46Å; L152-C189 VanDerWaalsContact CD2-CB 3.46Å; S185-C189 PolarHBondContact O-N 2.93Å; S185-C189 PolarHBondContact O-SG 3.22Å; S185-C189 VanDerWaalsContact O-SG 3.34Å; L186-C189 PolarHBondContact O-N 3.31Å; L187-C189 VanDerWaalsContact C-N 3.33Å; L187-C189 PolarHBondContact O-N 2.91Å; C189-S192 PolarHBondContact O-OG 3.47Å
190	L	92.9	Very high	91.3	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-67.3	-49.4	171.5	178.3	63.3	0	0	0	110.2	L152 P158 L161 A166 V167 L186 L187 S192 R193 T194	L152-L190 HydrophobicContact CD1-CB 4.19Å; L152-L190 HydrophobicContact CD1-CD1 3.81Å; P158-L190 HydrophobicContact CB-CD1 3.95Å; P158-L190 WeakPolarHBondContact O-CD1 3.28Å; L161-L190 HydrophobicContact CB-CD1 4.12Å; A166-L190 HydrophobicContact CB-CD2 3.97Å; V167-L190 HydrophobicContact CG2-CD2 3.95Å; L186-L190 PolarHBondContact O-N 3.44Å; L187-L190 HydrophobicContact CD1-CD2 4.34Å; L187-L190 WeakPolarHBondContact O-CB 3.24Å; L187-L190 PolarHBondContact O-N 3.28Å; L190-S192 VanDerWaalsContact C-N 3.27Å; L190-S192 PolarHBondContact O-N 3.1Å; L190-R193 PolarHBondContact O-N 3.14Å; L190-R193 VanDerWaalsContact O-N 3.12Å; L190-T194 HydrophobicContact CD1-CG2 4.36Å; L190-T194 PolarHBondContact O-N 3.46Å; L190-T194 PolarHBondContact O-OG1 3.29Å; L190-T194 VanDerWaalsContact O-OG1 3.1Å
191	L	91.6	Very high	91.6	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-63.9	-28.3	-179.3	-68.8	176.2	0	0	0	113.1	L187 G188 R193 R195 A198 L206 F235	L187-L191 HydrophobicContact CD1-CD1 4.43Å; L187-L191 HydrophobicContact CD1-CG 4.27Å; L187-L191 HydrophobicContact CG-CD1 4.19Å; L187-L191 HydrophobicContact CG-CG 4.45Å; L187-L191 WeakPolarHBondContact O-CB 3.35Å; L187-L191 VanDerWaalsContact O-CG 3.29Å; L187-L191 WeakPolarHBondContact O-CG 3.37Å; L187-L191 PolarHBondContact O-N 2.74Å; G188-L191 PolarHBondContact O-N 3.3Å; L191-R193 PolarHBondContact O-N 3.16Å; L191-R193 VanDerWaalsContact O-N 3.17Å; L191-R195 WeakPolarHBondContact O-CA 3.43Å; L191-R195 VanDerWaalsContact O-CB 3.28Å; L191-R195 WeakPolarHBondContact O-CB 3.42Å; L191-R195 PolarHBondContact O-N 3.18Å; L191-A198 HydrophobicContact CD2-CB 3.48Å; L191-A198 VanDerWaalsContact CD2-CB 3.48Å; L191-L206 HydrophobicContact CD1-CD2 4.03Å; L191-L206 HydrophobicContact CD2-CD1 4.29Å; L191-L206 HydrophobicContact CD2-CD2 4.24Å; L191-F235 HydrophobicContact CD1-CD1 3.55Å; L191-F235 HydrophobicContact CD1-CE1 3.91Å; L191-F235 HydrophobicContact CD1-CG 4.41Å
192	S	86.6	Confident	91.8	Very high	81 Å²	81	50.6 Å²	50.6	57%	0.566	23%	0.23	S	C	*	.	H	α-helix	trans	-63.5	-19.9	176	68.6	0	0	0	0	113.7	G188 C189 L190	G188-S192 PolarHBondContact O-N 3.17Å; C189-S192 PolarHBondContact O-OG 3.47Å; L190-S192 VanDerWaalsContact C-N 3.27Å; L190-S192 PolarHBondContact O-N 3.1Å
193	R	85.4	Confident	91.9	Very high	123 Å²	123	49 Å²	49	46%	0.464	23%	0.233	S	C	.	.	H	α-helix	trans	-112.4	-20.9	179.4	-60.9	-179.9	71.6	-166.6	-3	113.7	L152 L154 L155 P158 L190 L191	L152-R193 PolarHBondContact O-NH1 2.68Å; L154-R193 PolarHBondContact O-NH1 3.44Å; L155-R193 PolarHBondContact O-NH2 3.19Å; P158-R193 HydrophobicContact CB-CB 4.22Å; P158-R193 HydrophobicContact CG-CB 4.15Å; P158-R193 VanDerWaalsContact CG-CZ 3.49Å; P158-R193 VanDerWaalsContact CG-NH1 3.3Å; L190-R193 PolarHBondContact O-N 3.14Å; L190-R193 VanDerWaalsContact O-N 3.12Å; L191-R193 PolarHBondContact O-N 3.16Å; L191-R193 VanDerWaalsContact O-N 3.17Å
194	T	90.1	Very high	91.9	Very high	13 Å²	13	52.2 Å²	52.2	8%	0.08	26%	0.26	C	S	.	.	H	α-helix	trans	-129.8	27.4	-174.3	69.8	0	0	0	0	113.6	P158 L162 L190 E196 E197 A198	P158-T194 HydrophobicContact CB-CG2 3.45Å; P158-T194 VanDerWaalsContact CB-CG2 3.45Å; L162-T194 HydrophobicContact CD2-CG2 4.46Å; L190-T194 HydrophobicContact CD1-CG2 4.36Å; L190-T194 PolarHBondContact O-N 3.46Å; L190-T194 PolarHBondContact O-OG1 3.29Å; L190-T194 VanDerWaalsContact O-OG1 3.1Å; T194-E196 PolarHBondContact O-N 3.08Å; T194-E197 PolarHBondContact O-N 3.31Å; T194-A198 WeakPolarHBondContact O-CB 3.49Å; T194-A198 PolarHBondContact O-N 3.06Å
195	R	88.4	Confident	92	Very high	109 Å²	109	55.4 Å²	55.4	41%	0.411	27%	0.274	S	S	.	.	H	α-helix	trans	-50.3	-57	-171.8	-171.1	-178.3	-67.5	149.6	-2.3	113.1	L191 A198 W199 P238	L191-R195 WeakPolarHBondContact O-CA 3.43Å; L191-R195 VanDerWaalsContact O-CB 3.28Å; L191-R195 WeakPolarHBondContact O-CB 3.42Å; L191-R195 PolarHBondContact O-N 3.18Å; R195-A198 PolarHBondContact O-N 2.89Å; R195-W199 PolarHBondContact O-N 3.13Å; R195-P238 HydrophobicContact CG-CG 4.26Å
196	E	90	Very high	92.1	Very high	108 Å²	108	52.8 Å²	52.8	51%	0.505	26%	0.256	S	S	.	.	H	α-helix	trans	-61.6	-50.3	-174.7	-67.7	174.7	-170.9	0	0	111.6	T194 A198 W199 R200 P238	T194-E196 PolarHBondContact O-N 3.08Å; E196-A198 VanDerWaalsContact C-N 3.31Å; E196-A198 PolarHBondContact O-N 3.08Å; E196-W199 PolarHBondContact O-N 3.15Å; E196-R200 WeakPolarHBondContact O-CB 3.39Å; E196-R200 PolarHBondContact O-N 2.8Å; E196-P238 HydrophobicContact CG-CG 4Å
197	E	90.6	Very high	92.1	Very high	49 Å²	49	53.9 Å²	53.9	23%	0.229	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-38.1	179.9	-171.1	62.1	-166.2	0	0	112.4	L162 T194 R200 R201	L162-E197 HydrophobicContact CD2-CB 3.67Å; L162-E197 HydrophobicContact CD2-CG 3.39Å; T194-E197 PolarHBondContact O-N 3.31Å; E197-R200 PolarHBondContact O-N 3Å; E197-R200 IonicContact OE1-CZ 3.67Å; E197-R200 IonicContact OE1-NE 3.01Å; E197-R200 IonicContact OE1-NH2 3.87Å; E197-R200 PolarHBondContact OE1-NH2 2.94Å; E197-R200 IonicContact OE2-CZ 2.82Å; E197-R200 IonicContact OE2-NE 3.13Å; E197-R200 PolarHBondContact OE2-NE 3.16Å; E197-R200 VanDerWaalsContact OE2-NE 3.12Å; E197-R200 IonicContact OE2-NH2 3.18Å; E197-R200 PolarHBondContact OE2-NH2 3.45Å; E197-R201 WeakPolarHBondContact O-CG 3.45Å; E197-R201 PolarHBondContact O-N 2.91Å; E197-R201 IonicContact OE1-CZ 3.68Å; E197-R201 IonicContact OE1-NE 3.67Å; E197-R201 PolarHBondContact OE1-NE 3.22Å; E197-R201 IonicContact OE1-NH2 3.57Å; E197-R201 PolarHBondContact OE1-NH2 2.9Å
198	A	93.3	Very high	92.1	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66.2	-46.2	179	0	0	0	0	0	111.8	L162 V167 L191 T194 R195 E196 R200 R201 H202 L206	L162-A198 HydrophobicContact CD1-CB 3.98Å; L162-A198 HydrophobicContact CD2-CB 4.49Å; V167-A198 HydrophobicContact CG2-CB 4.14Å; L191-A198 HydrophobicContact CD2-CB 3.48Å; L191-A198 VanDerWaalsContact CD2-CB 3.48Å; T194-A198 WeakPolarHBondContact O-CB 3.49Å; T194-A198 PolarHBondContact O-N 3.06Å; R195-A198 PolarHBondContact O-N 2.89Å; E196-A198 VanDerWaalsContact C-N 3.31Å; E196-A198 PolarHBondContact O-N 3.08Å; A198-R200 VanDerWaalsContact C-N 3.31Å; A198-R200 PolarHBondContact O-N 2.86Å; A198-R201 PolarHBondContact O-N 2.86Å; A198-H202 PolarHBondContact O-N 3.08Å; A198-L206 HydrophobicContact CB-CD1 4.17Å
199	W	92.9	Very high	92.3	Very high	16 Å²	16	58.8 Å²	58.8	6%	0.061	29%	0.294	C	S	.	.	H	α-helix	trans	-66.8	-32.1	176.6	-85.8	100	0	0	0	112.9	R195 E196 P203 L206 L207 L210 F235 P237	R195-W199 PolarHBondContact O-N 3.13Å; E196-W199 PolarHBondContact O-N 3.15Å; W199-P203 WeakPolarHBondContact O-CB 3.47Å; W199-P203 WeakPolarHBondContact O-CD 3.31Å; W199-L206 HydrophobicContact CD2-CB 4.12Å; W199-L206 HydrophobicContact CD2-CD1 3.84Å; W199-L206 HydrophobicContact CE3-CB 4.05Å; W199-L206 HydrophobicContact CE3-CD1 4.35Å; W199-L206 HydrophobicContact CG-CD1 3.93Å; W199-L206 HydrophobicContact CH2-CB 3.67Å; W199-L206 HydrophobicContact CZ2-CB 3.7Å; W199-L206 HydrophobicContact CZ3-CB 3.84Å; W199-L207 HydrophobicContact CH2-CB 4.35Å; W199-L207 HydrophobicContact CZ3-CB 4.14Å; W199-L210 HydrophobicContact CH2-CD2 4.15Å; W199-L210 HydrophobicContact CZ2-CD2 4.21Å; W199-F235 VanDerWaalsContact CZ2-O 3.25Å; W199-F235 WeakPolarHBondContact CZ2-O 3.35Å; W199-P237 HydrophobicContact CD2-CB 3.63Å; W199-P237 HydrophobicContact CE3-CB 3.88Å; W199-P237 HydrophobicContact CG-CB 4.17Å; W199-P237 HydrophobicContact CH2-CB 4.02Å; W199-P237 HydrophobicContact CH2-CG 4.26Å; W199-P237 HydrophobicContact CZ2-CB 3.8Å; W199-P237 HydrophobicContact CZ2-CG 4.22Å; W199-P237 HydrophobicContact CZ3-CB 4.06Å
200	R	92.3	Very high	92.5	Very high	182 Å²	182	56.4 Å²	56.4	69%	0.687	28%	0.277	S	S	*	.	H	α-helix	trans	-67.5	-40.2	173.9	-172.6	174.6	70.7	160.1	6.3	112.8	E196 E197 A198	E196-R200 WeakPolarHBondContact O-CB 3.39Å; E196-R200 PolarHBondContact O-N 2.8Å; E197-R200 PolarHBondContact O-N 3Å; E197-R200 IonicContact OE1-CZ 3.67Å; E197-R200 IonicContact OE1-NE 3.01Å; E197-R200 IonicContact OE1-NH2 3.87Å; E197-R200 PolarHBondContact OE1-NH2 2.94Å; E197-R200 IonicContact OE2-CZ 2.82Å; E197-R200 IonicContact OE2-NE 3.13Å; E197-R200 PolarHBondContact OE2-NE 3.16Å; E197-R200 VanDerWaalsContact OE2-NE 3.12Å; E197-R200 IonicContact OE2-NH2 3.18Å; E197-R200 PolarHBondContact OE2-NH2 3.45Å; A198-R200 VanDerWaalsContact C-N 3.31Å; A198-R200 PolarHBondContact O-N 2.86Å
201	R	93.6	Very high	92.7	Very high	124 Å²	124	58.3 Å²	58.3	47%	0.468	29%	0.288	S	S	.	.	H	α-helix	trans	-85.5	-36.2	-176.5	-70.8	-173.3	-174.4	-167.4	4.1	114.4	E197 A198 P203	E197-R201 WeakPolarHBondContact O-CG 3.45Å; E197-R201 PolarHBondContact O-N 2.91Å; E197-R201 IonicContact OE1-CZ 3.68Å; E197-R201 IonicContact OE1-NE 3.67Å; E197-R201 PolarHBondContact OE1-NE 3.22Å; E197-R201 IonicContact OE1-NH2 3.57Å; E197-R201 PolarHBondContact OE1-NH2 2.9Å; A198-R201 PolarHBondContact O-N 2.86Å; R201-P203 VanDerWaalsContact C-CD 3.41Å
202	H	94	Very high	92.9	Very high	35 Å²	35	59.7 Å²	59.7	16%	0.162	30%	0.302	C	S	.	.			trans	-132	52.5	-170.4	-57	-65.2	0	0	0	112.4	V167 A198 A204 L206	V167-H202 HydrophobicContact CB-CB 4.35Å; V167-H202 HydrophobicContact CG1-CB 3.73Å; A198-H202 PolarHBondContact O-N 3.08Å; H202-A204 VanDerWaalsContact C-N 3.34Å; H202-A204 PolarHBondContact O-N 3.26Å; H202-L206 WeakPolarHBondContact O-CB 3.32Å; H202-L206 WeakPolarHBondContact O-CG 3.42Å; H202-L206 PolarHBondContact O-N 3.11Å
203	P	93.6	Very high	93.3	Very high	65 Å²	65	56 Å²	56	42%	0.422	28%	0.276	S	S	.	.	H	α-helix	trans	-64.9	-36.5	-175.6	25	-33.2	0	0	0	112.6	W199 R201 L207	W199-P203 WeakPolarHBondContact O-CB 3.47Å; W199-P203 WeakPolarHBondContact O-CD 3.31Å; R201-P203 VanDerWaalsContact C-CD 3.41Å; P203-L207 WeakPolarHBondContact O-CB 3.34Å; P203-L207 PolarHBondContact O-N 3.07Å
204	A	93.3	Very high	93.9	Very high	68 Å²	68	50.3 Å²	50.3	56%	0.562	26%	0.255	S	S	*	.	H	α-helix	trans	-67.9	-46.8	-175.2	0	0	0	0	0	112.4	H202 S208	H202-A204 VanDerWaalsContact C-N 3.34Å; H202-A204 PolarHBondContact O-N 3.26Å; A204-S208 WeakPolarHBondContact O-CB 3.29Å; A204-S208 PolarHBondContact O-N 2.97Å
205	E	95.1	Very high	94.2	Very high	71 Å²	71	51.2 Å²	51.2	33%	0.332	26%	0.262	S	S	.	.	H	α-helix	trans	-67.5	-40.5	-179.9	-62	91.8	152.8	0	0	111.9	P168 C171 L209	P168-E205 HydrophobicContact CB-CG 4.11Å; C171-E205 HydrophobicContact CB-CB 4.16Å; E205-L209 WeakPolarHBondContact O-CB 3.41Å; E205-L209 PolarHBondContact O-N 3.43Å; E205-L209 VanDerWaalsContact O-N 3.08Å
206	L	95.7	Very high	94.5	Very high	3 Å²	3	50 Å²	50	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-69.5	-42	177.2	-71.3	172.7	0	0	0	111.9	V167 L187 L191 A198 W199 H202 L209 L210	V167-L206 HydrophobicContact CG1-CD1 4.09Å; V167-L206 HydrophobicContact CG1-CD2 3.73Å; V167-L206 HydrophobicContact CG1-CG 3.74Å; L187-L206 HydrophobicContact CD2-CD2 4.49Å; L191-L206 HydrophobicContact CD1-CD2 4.03Å; L191-L206 HydrophobicContact CD2-CD1 4.29Å; L191-L206 HydrophobicContact CD2-CD2 4.24Å; A198-L206 HydrophobicContact CB-CD1 4.17Å; W199-L206 HydrophobicContact CD2-CB 4.12Å; W199-L206 HydrophobicContact CD2-CD1 3.84Å; W199-L206 HydrophobicContact CE3-CB 4.05Å; W199-L206 HydrophobicContact CE3-CD1 4.35Å; W199-L206 HydrophobicContact CG-CD1 3.93Å; W199-L206 HydrophobicContact CH2-CB 3.67Å; W199-L206 HydrophobicContact CZ2-CB 3.7Å; W199-L206 HydrophobicContact CZ3-CB 3.84Å; H202-L206 WeakPolarHBondContact O-CB 3.32Å; H202-L206 WeakPolarHBondContact O-CG 3.42Å; H202-L206 PolarHBondContact O-N 3.11Å; L206-L209 PolarHBondContact O-N 3.47Å; L206-L210 VanDerWaalsContact O-CB 3.32Å; L206-L210 WeakPolarHBondContact O-CB 3.33Å; L206-L210 PolarHBondContact O-N 3.39Å
207	L	95.4	Very high	94.9	Very high	30 Å²	30	44.8 Å²	44.8	16%	0.157	24%	0.237	C	C	.	.	H	α-helix	trans	-62	-46.9	175.4	-179.9	61	0	0	0	110.9	W199 P203 L209 L210 L211 L248	W199-L207 HydrophobicContact CH2-CB 4.35Å; W199-L207 HydrophobicContact CZ3-CB 4.14Å; P203-L207 WeakPolarHBondContact O-CB 3.34Å; P203-L207 PolarHBondContact O-N 3.07Å; L207-L209 VanDerWaalsContact C-N 3.32Å; L207-L209 PolarHBondContact O-N 3.29Å; L207-L210 PolarHBondContact O-N 2.89Å; L207-L211 HydrophobicContact CD1-CD1 4.21Å; L207-L211 HydrophobicContact CD1-CD2 4.45Å; L207-L211 HydrophobicContact CD1-CG 4.07Å; L207-L211 HydrophobicContact CG-CD1 4.07Å; L207-L211 HydrophobicContact CG-CG 4.35Å; L207-L211 WeakPolarHBondContact O-CB 3.43Å; L207-L211 VanDerWaalsContact O-CG 3.27Å; L207-L211 WeakPolarHBondContact O-CG 3.45Å; L207-L211 PolarHBondContact O-N 3.22Å; L207-L248 HydrophobicContact CD1-CB 3.91Å; L207-L248 HydrophobicContact CD1-CD1 4.48Å; L207-L248 HydrophobicContact CD1-CD2 4.44Å
208	S	95.4	Very high	95.1	Very high	83 Å²	83	44.5 Å²	44.5	58%	0.58	24%	0.24	S	C	*	.	H	α-helix	trans	-58.9	-43.2	177.4	-176.8	0	0	0	0	112.1	A204 G212	A204-S208 WeakPolarHBondContact O-CB 3.29Å; A204-S208 PolarHBondContact O-N 2.97Å; S208-G212 PolarHBondContact O-N 3.27Å
209	L	95.9	Very high	95.2	Very high	22 Å²	22	54 Å²	54	12%	0.115	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-47.4	176.6	177.4	60.8	0	0	0	111.2	T174 L184 L187 E205 L206 L207 L211 G212 L213 F235	T174-L209 HydrophobicContact CG2-CD1 4.34Å; T174-L209 HydrophobicContact CG2-CD2 4.5Å; T174-L209 WeakPolarHBondContact OG1-CD1 3.4Å; L184-L209 HydrophobicContact CD2-CD1 4.22Å; L184-L209 HydrophobicContact CD2-CD2 4.31Å; L187-L209 HydrophobicContact CD2-CD2 3.55Å; E205-L209 WeakPolarHBondContact O-CB 3.41Å; E205-L209 PolarHBondContact O-N 3.43Å; E205-L209 VanDerWaalsContact O-N 3.08Å; L206-L209 PolarHBondContact O-N 3.47Å; L207-L209 VanDerWaalsContact C-N 3.32Å; L207-L209 PolarHBondContact O-N 3.29Å; L209-L211 PolarHBondContact O-N 3.14Å; L209-G212 WeakPolarHBondContact O-CA 3.42Å; L209-G212 PolarHBondContact O-N 3.46Å; L209-G212 VanDerWaalsContact O-N 3.16Å; L209-L213 HydrophobicContact CD1-CD1 4.48Å; L209-L213 HydrophobicContact CD1-CG 4.36Å; L209-L213 HydrophobicContact CG-CD1 4.21Å; L209-L213 WeakPolarHBondContact O-CG 3.26Å; L209-L213 PolarHBondContact O-N 2.95Å; L209-F235 HydrophobicContact CD2-CD1 4.06Å; L209-F235 HydrophobicContact CD2-CE1 3.8Å
210	L	96.4	Very high	95.3	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-44	-179.3	178.8	58.8	0	0	0	111.9	W199 L206 L207 G212 L213 C214 L232 F235 L236 L248	W199-L210 HydrophobicContact CH2-CD2 4.15Å; W199-L210 HydrophobicContact CZ2-CD2 4.21Å; L206-L210 VanDerWaalsContact O-CB 3.32Å; L206-L210 WeakPolarHBondContact O-CB 3.33Å; L206-L210 PolarHBondContact O-N 3.39Å; L207-L210 PolarHBondContact O-N 2.89Å; L210-G212 VanDerWaalsContact C-N 3.28Å; L210-G212 PolarHBondContact O-N 2.94Å; L210-L213 PolarHBondContact O-N 3.32Å; L210-C214 PolarHBondContact O-N 3.06Å; L210-C214 PolarHBondContact O-SG 2.85Å; L210-L232 HydrophobicContact CD1-CD2 4.32Å; L210-F235 HydrophobicContact CD1-CB 4.09Å; L210-L236 HydrophobicContact CD1-CD2 4.19Å; L210-L236 HydrophobicContact CD2-CD2 4.35Å; L210-L248 HydrophobicContact CD2-CD1 3.56Å; L210-L248 HydrophobicContact CD2-CD2 4.24Å; L210-L248 HydrophobicContact CG-CD1 4.07Å
211	L	96.7	Very high	95.4	Very high	42 Å²	42	48.5 Å²	48.5	22%	0.22	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-39.1	175.6	-69.1	175.9	0	0	0	111.7	L207 L209 S215 E247 A251	L207-L211 HydrophobicContact CD1-CD1 4.21Å; L207-L211 HydrophobicContact CD1-CD2 4.45Å; L207-L211 HydrophobicContact CD1-CG 4.07Å; L207-L211 HydrophobicContact CG-CD1 4.07Å; L207-L211 HydrophobicContact CG-CG 4.35Å; L207-L211 WeakPolarHBondContact O-CB 3.43Å; L207-L211 VanDerWaalsContact O-CG 3.27Å; L207-L211 WeakPolarHBondContact O-CG 3.45Å; L207-L211 PolarHBondContact O-N 3.22Å; L209-L211 PolarHBondContact O-N 3.14Å; L211-S215 WeakPolarHBondContact O-CB 3.28Å; L211-S215 PolarHBondContact O-N 2.93Å; L211-E247 HydrophobicContact CD1-CB 4.23Å; L211-A251 HydrophobicContact CD2-CB 3.51Å
212	G	95.8	Very high	95.1	Very high	30 Å²	30	47 Å²	47	31%	0.309	27%	0.269	S	S	.	.	H	α-helix	trans	-59.6	-51.5	172	0	0	0	0	0	112.2	S208 L209 L210 C214 S215 E216	S208-G212 PolarHBondContact O-N 3.27Å; L209-G212 WeakPolarHBondContact O-CA 3.42Å; L209-G212 PolarHBondContact O-N 3.46Å; L209-G212 VanDerWaalsContact O-N 3.16Å; L210-G212 VanDerWaalsContact C-N 3.28Å; L210-G212 PolarHBondContact O-N 2.94Å; G212-C214 PolarHBondContact O-N 3.34Å; G212-S215 WeakPolarHBondContact O-CA 3.47Å; G212-S215 WeakPolarHBondContact O-CB 3.41Å; G212-S215 PolarHBondContact O-N 2.98Å; G212-E216 WeakPolarHBondContact O-CG 3.39Å; G212-E216 PolarHBondContact O-N 3.06Å
213	L	95.9	Very high	94.8	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-61.5	-40.2	178.4	-66.7	174.6	0	0	0	112.6	L184 L209 L210 S215 E216 F217 L232 F235	L184-L213 HydrophobicContact CD1-CD2 4.44Å; L184-L213 HydrophobicContact CD2-CD1 4.16Å; L184-L213 HydrophobicContact CD2-CD2 4.12Å; L209-L213 HydrophobicContact CD1-CD1 4.48Å; L209-L213 HydrophobicContact CD1-CG 4.36Å; L209-L213 HydrophobicContact CG-CD1 4.21Å; L209-L213 WeakPolarHBondContact O-CG 3.26Å; L209-L213 PolarHBondContact O-N 2.95Å; L210-L213 PolarHBondContact O-N 3.32Å; L213-S215 VanDerWaalsContact C-N 3.31Å; L213-S215 PolarHBondContact O-N 3.39Å; L213-E216 PolarHBondContact O-N 3.41Å; L213-F217 VanDerWaalsContact O-CB 3.32Å; L213-F217 WeakPolarHBondContact O-CB 3.48Å; L213-F217 PolarHBondContact O-N 3.32Å; L213-L232 HydrophobicContact CB-CD2 3.65Å; L213-F235 HydrophobicContact CD1-CB 4.36Å; L213-F235 HydrophobicContact CD1-CD1 4.49Å; L213-F235 HydrophobicContact CD1-CD2 3.64Å; L213-F235 HydrophobicContact CD1-CE2 4.03Å; L213-F235 HydrophobicContact CD1-CG 3.92Å
214	C	97.3	Very high	94.7	Very high	5 Å²	5	49 Å²	49	3%	0.034	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-42.2	173.1	-70.1	0	0	0	0	111.2	L210 G212 F217 C218 A251 V255	L210-C214 PolarHBondContact O-N 3.06Å; L210-C214 PolarHBondContact O-SG 2.85Å; G212-C214 PolarHBondContact O-N 3.34Å; C214-F217 WeakPolarHBondContact O-CB 3.33Å; C214-F217 PolarHBondContact O-N 3.46Å; C214-C218 PolarHBondContact O-N 2.91Å; C214-C218 PolarHBondContact O-SG 2.91Å; C214-A251 HydrophobicContact CB-CB 4.23Å; C214-V255 HydrophobicContact CB-CG2 3.81Å
215	S	96.6	Very high	94.8	Very high	31 Å²	31	47 Å²	47	22%	0.217	26%	0.262	C	S	.	.	H	α-helix	trans	-66.9	-38.6	177.9	-173.5	0	0	0	0	112.7	L211 G212 L213 R219	L211-S215 WeakPolarHBondContact O-CB 3.28Å; L211-S215 PolarHBondContact O-N 2.93Å; G212-S215 WeakPolarHBondContact O-CA 3.47Å; G212-S215 WeakPolarHBondContact O-CB 3.41Å; G212-S215 PolarHBondContact O-N 2.98Å; L213-S215 VanDerWaalsContact C-N 3.31Å; L213-S215 PolarHBondContact O-N 3.39Å; S215-R219 WeakPolarHBondContact O-CG 3.47Å; S215-R219 PolarHBondContact O-N 3.09Å; S215-R219 PolarHBondContact OG-NH1 3.47Å; S215-R219 PolarHBondContact OG-NH2 3.03Å
216	E	95.3	Very high	94.6	Very high	83 Å²	83	44.7 Å²	44.7	39%	0.388	25%	0.252	S	S	.	.	H	α-helix	trans	-64	-45.2	173.9	-73.4	173.2	-165.2	0	0	110.6	G212 L213 C218 R219 A220 M228	G212-E216 WeakPolarHBondContact O-CG 3.39Å; G212-E216 PolarHBondContact O-N 3.06Å; L213-E216 PolarHBondContact O-N 3.41Å; E216-C218 VanDerWaalsContact C-N 3.33Å; E216-C218 PolarHBondContact O-N 2.93Å; E216-R219 PolarHBondContact O-N 3.27Å; E216-R219 VanDerWaalsContact O-N 3.08Å; E216-A220 WeakPolarHBondContact O-CB 3.42Å; E216-A220 PolarHBondContact O-N 2.94Å; E216-M228 HydrophobicContact CB-CE 3.71Å
217	F	96.8	Very high	94.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-56.7	-45	177.1	179.6	-86.7	0	0	0	112.5	L213 C214 R219 A220 R225 M228 L232 V255 A258 L259 L278	L213-F217 VanDerWaalsContact O-CB 3.32Å; L213-F217 WeakPolarHBondContact O-CB 3.48Å; L213-F217 PolarHBondContact O-N 3.32Å; C214-F217 WeakPolarHBondContact O-CB 3.33Å; C214-F217 PolarHBondContact O-N 3.46Å; F217-R219 VanDerWaalsContact C-N 3.26Å; F217-R219 PolarHBondContact O-N 3.35Å; F217-A220 PolarHBondContact O-N 3.06Å; F217-R225 HydrophobicContact CD1-CG 4.09Å; F217-R225 HydrophobicContact CD2-CG 3.71Å; F217-R225 HydrophobicContact CE1-CG 3.69Å; F217-R225 HydrophobicContact CE2-CB 4.43Å; F217-R225 HydrophobicContact CE2-CG 3.28Å; F217-R225 WeakPolarHBondContact CE2-O 3.46Å; F217-R225 HydrophobicContact CG-CG 4.1Å; F217-R225 HydrophobicContact CZ-CG 3.26Å; F217-M228 HydrophobicContact CB-CE 4.04Å; F217-M228 HydrophobicContact CB-SD 4.41Å; F217-M228 HydrophobicContact CD2-CB 3.75Å; F217-M228 HydrophobicContact CE2-CB 4.37Å; F217-L232 HydrophobicContact CB-CD1 3.88Å; F217-L232 HydrophobicContact CD1-CD1 4.29Å; F217-L232 HydrophobicContact CD2-CD1 3.38Å; F217-L232 HydrophobicContact CD2-CG 4.37Å; F217-L232 HydrophobicContact CE2-CD1 3.91Å; F217-L232 HydrophobicContact CG-CD1 3.6Å; F217-V255 HydrophobicContact CD1-CG1 4.04Å; F217-V255 HydrophobicContact CD1-CG2 4.3Å; F217-V255 HydrophobicContact CE1-CG1 3.8Å; F217-V255 HydrophobicContact CZ-CG1 4.43Å; F217-A258 HydrophobicContact CD1-CB 4.33Å; F217-A258 HydrophobicContact CE1-CB 4.05Å; F217-L259 HydrophobicContact CE1-CD2 4.24Å; F217-L259 HydrophobicContact CE1-CG 4.05Å; F217-L259 HydrophobicContact CZ-CD2 3.63Å; F217-L259 HydrophobicContact CZ-CG 3.92Å; F217-L278 HydrophobicContact CE2-CD2 4.15Å; F217-L278 HydrophobicContact CZ-CD2 4.13Å
218	C	96.3	Very high	94.3	Very high	43 Å²	43	50.9 Å²	50.9	29%	0.291	28%	0.281	S	S	.	.	H	α-helix	trans	-65.4	-27.1	178.8	-68.2	0	0	0	0	113.3	C214 E216 R254	C214-C218 PolarHBondContact O-N 2.91Å; C214-C218 PolarHBondContact O-SG 2.91Å; E216-C218 VanDerWaalsContact C-N 3.33Å; E216-C218 PolarHBondContact O-N 2.93Å; C218-R254 VanDerWaalsContact SG-C 3.6Å; C218-R254 PolarHBondContact SG-O 2.69Å
219	R	95.7	Very high	94.3	Very high	199 Å²	199	47 Å²	47	75%	0.751	25%	0.253	S	S	*	.	H	α-helix	trans	-93.8	-13.1	178.8	-64.4	-177.7	-166.6	119.5	4.3	113.4	S215 E216 F217	S215-R219 WeakPolarHBondContact O-CG 3.47Å; S215-R219 PolarHBondContact O-N 3.09Å; S215-R219 PolarHBondContact OG-NH1 3.47Å; S215-R219 PolarHBondContact OG-NH2 3.03Å; E216-R219 PolarHBondContact O-N 3.27Å; E216-R219 VanDerWaalsContact O-N 3.08Å; F217-R219 VanDerWaalsContact C-N 3.26Å; F217-R219 PolarHBondContact O-N 3.35Å
220	A	94.8	Very high	94.1	Very high	18 Å²	18	49.1 Å²	49.1	15%	0.149	27%	0.268	C	S	.	.	S	Bend	trans	-68.4	150.5	-175.4	0	0	0	0	0	112.7	E216 F217 T224 R225 M228	E216-A220 WeakPolarHBondContact O-CB 3.42Å; E216-A220 PolarHBondContact O-N 2.94Å; F217-A220 PolarHBondContact O-N 3.06Å; A220-T224 HydrophobicContact CB-CG2 4.17Å; A220-R225 HydrophobicContact CB-CB 4.25Å; A220-R225 PolarHBondContact O-NH2 3.08Å; A220-M228 HydrophobicContact CB-SD 3.96Å
221	S	92.9	Very high	93.9	Very high	64 Å²	64	50.9 Å²	50.9	45%	0.448	28%	0.276	S	S	.	.			trans	-66.2	156	167.2	62.9	0	0	0	0	110.9	T224 R225	S221-T224 PolarHBondContact O-N 2.85Å; S221-T224 VanDerWaalsContact O-N 3.1Å; S221-T224 PolarHBondContact OG-OG1 2.76Å; S221-R225 WeakPolarHBondContact O-CB 3.43Å; S221-R225 PolarHBondContact O-N 3Å
222	D	87.6	Confident	93.8	Very high	92 Å²	92	49.1 Å²	49.1	49%	0.492	27%	0.266	S	S	.	.	H	α-helix	trans	-48.8	-48.9	-179.1	-66.2	-3.8	0	0	0	115	T224 R225 L226	D222-T224 VanDerWaalsContact C-N 3.35Å; D222-T224 PolarHBondContact O-N 3.5Å; D222-R225 PolarHBondContact O-N 2.81Å; D222-R225 IonicContact OD1-CZ 3.73Å; D222-R225 VanDerWaalsContact OD1-CZ 3.23Å; D222-R225 IonicContact OD1-NH1 2.68Å; D222-R225 PolarHBondContact OD1-NH1 3.41Å; D222-R225 IonicContact OD1-NH2 3.78Å; D222-R225 PolarHBondContact OD1-NH2 3.1Å; D222-L226 WeakPolarHBondContact O-CG 3.39Å; D222-L226 PolarHBondContact O-N 2.66Å
223	P	89.2	Confident	93.7	Very high	84 Å²	84	49 Å²	49	55%	0.545	26%	0.259	S	S	.	.	H	α-helix	trans	-64.8	-38.3	179.5	25	-34.5	0	0	0	112.8	Q227	P223-Q227 WeakPolarHBondContact O-CG 3.43Å; P223-Q227 PolarHBondContact O-N 3Å
224	T	91.3	Very high	93.5	Very high	59 Å²	59	53.9 Å²	53.9	36%	0.362	28%	0.278	S	S	.	.	H	α-helix	trans	-68.8	-42.2	177.6	-48.3	0	0	0	0	110.4	A220 S221 D222 L226 Q227 M228	A220-T224 HydrophobicContact CB-CG2 4.17Å; S221-T224 PolarHBondContact O-N 2.85Å; S221-T224 VanDerWaalsContact O-N 3.1Å; S221-T224 PolarHBondContact OG-OG1 2.76Å; D222-T224 VanDerWaalsContact C-N 3.35Å; D222-T224 PolarHBondContact O-N 3.5Å; T224-L226 VanDerWaalsContact C-N 3.32Å; T224-L226 PolarHBondContact O-N 2.88Å; T224-Q227 WeakPolarHBondContact O-CB 3.41Å; T224-Q227 PolarHBondContact O-N 3.04Å; T224-Q227 VanDerWaalsContact O-N 3.11Å; T224-M228 HydrophobicContact CG2-CG 4.5Å; T224-M228 HydrophobicContact CG2-SD 4.28Å; T224-M228 WeakPolarHBondContact O-CG 3.1Å; T224-M228 PolarHBondContact O-N 3.28Å
225	R	93.8	Very high	93.4	Very high	25 Å²	25	53.9 Å²	53.9	9%	0.094	28%	0.277	C	S	.	.	H	α-helix	trans	-58.8	-43.5	178	-166.6	-175.1	-49.2	118.5	12.9	111.4	F217 A220 S221 D222 Q227 M228 C229 T262	F217-R225 HydrophobicContact CD1-CG 4.09Å; F217-R225 HydrophobicContact CD2-CG 3.71Å; F217-R225 HydrophobicContact CE1-CG 3.69Å; F217-R225 HydrophobicContact CE2-CB 4.43Å; F217-R225 HydrophobicContact CE2-CG 3.28Å; F217-R225 WeakPolarHBondContact CE2-O 3.46Å; F217-R225 HydrophobicContact CG-CG 4.1Å; F217-R225 HydrophobicContact CZ-CG 3.26Å; A220-R225 HydrophobicContact CB-CB 4.25Å; A220-R225 PolarHBondContact O-NH2 3.08Å; S221-R225 WeakPolarHBondContact O-CB 3.43Å; S221-R225 PolarHBondContact O-N 3Å; D222-R225 PolarHBondContact O-N 2.81Å; D222-R225 IonicContact OD1-CZ 3.73Å; D222-R225 VanDerWaalsContact OD1-CZ 3.23Å; D222-R225 IonicContact OD1-NH1 2.68Å; D222-R225 PolarHBondContact OD1-NH1 3.41Å; D222-R225 IonicContact OD1-NH2 3.78Å; D222-R225 PolarHBondContact OD1-NH2 3.1Å; R225-Q227 VanDerWaalsContact C-N 3.31Å; R225-Q227 PolarHBondContact O-N 3.31Å; R225-M228 PolarHBondContact O-N 2.88Å; R225-M228 VanDerWaalsContact O-N 3.16Å; R225-C229 PolarHBondContact O-N 3.11Å; R225-C229 PolarHBondContact O-SG 3.42Å; R225-C229 VanDerWaalsContact O-SG 3.41Å; R225-T262 PolarHBondContact NH1-OG1 2.77Å
226	L	92.6	Very high	93.2	Very high	23 Å²	23	53 Å²	53	12%	0.12	27%	0.27	C	S	.	.	H	α-helix	trans	-60.1	-39.6	175.9	-70.6	171.6	0	0	0	112.4	D222 T224 C229 T262 L267 Q271 V275	D222-L226 WeakPolarHBondContact O-CG 3.39Å; D222-L226 PolarHBondContact O-N 2.66Å; T224-L226 VanDerWaalsContact C-N 3.32Å; T224-L226 PolarHBondContact O-N 2.88Å; L226-C229 WeakPolarHBondContact O-CB 3.24Å; L226-C229 PolarHBondContact O-N 2.97Å; L226-T262 HydrophobicContact CD2-CG2 3.79Å; L226-L267 HydrophobicContact CD1-CD2 4.47Å; L226-L267 HydrophobicContact CD2-CD2 4.21Å; L226-Q271 HydrophobicContact CD1-CB 4.24Å; L226-Q271 HydrophobicContact CD1-CG 4.03Å; L226-V275 HydrophobicContact CD2-CG2 3.4Å; L226-V275 VanDerWaalsContact CD2-CG2 3.4Å
227	Q	90.5	Very high	93.1	Very high	148 Å²	148	49.3 Å²	49.3	69%	0.692	25%	0.253	S	S	*	.	H	α-helix	trans	-67.7	-37	175.7	-67.2	173.5	-12.2	0	0	111.9	P223 T224 R225 C229	P223-Q227 WeakPolarHBondContact O-CG 3.43Å; P223-Q227 PolarHBondContact O-N 3Å; T224-Q227 WeakPolarHBondContact O-CB 3.41Å; T224-Q227 PolarHBondContact O-N 3.04Å; T224-Q227 VanDerWaalsContact O-N 3.11Å; R225-Q227 VanDerWaalsContact C-N 3.31Å; R225-Q227 PolarHBondContact O-N 3.31Å; Q227-C229 VanDerWaalsContact C-N 3.26Å; Q227-C229 PolarHBondContact O-N 3.4Å
228	M	94.5	Very high	92.7	Very high	16 Å²	16	50.5 Å²	50.5	8%	0.079	26%	0.261	C	S	.	.	H	α-helix	trans	-70.5	-17.6	179.4	-68.6	-179.9	78.9	0	0	113.6	E216 F217 A220 T224 R225 T230 Q231 L232	E216-M228 HydrophobicContact CB-CE 3.71Å; F217-M228 HydrophobicContact CB-CE 4.04Å; F217-M228 HydrophobicContact CB-SD 4.41Å; F217-M228 HydrophobicContact CD2-CB 3.75Å; F217-M228 HydrophobicContact CE2-CB 4.37Å; A220-M228 HydrophobicContact CB-SD 3.96Å; T224-M228 HydrophobicContact CG2-CG 4.5Å; T224-M228 HydrophobicContact CG2-SD 4.28Å; T224-M228 WeakPolarHBondContact O-CG 3.1Å; T224-M228 PolarHBondContact O-N 3.28Å; R225-M228 PolarHBondContact O-N 2.88Å; R225-M228 VanDerWaalsContact O-N 3.16Å; M228-T230 PolarHBondContact O-N 2.99Å; M228-Q231 WeakPolarHBondContact O-CB 3.29Å; M228-Q231 PolarHBondContact O-N 3.07Å; M228-Q231 VanDerWaalsContact O-N 3.14Å; M228-L232 PolarHBondContact O-N 3.46Å
229	C	95.3	Very high	92	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.007	27%	0.269	C	S	.	.	H	α-helix	trans	-55.3	-51.9	178.4	-69.4	0	0	0	0	112.2	R225 L226 Q227 Q231 L232 V233 P274 L278	R225-C229 PolarHBondContact O-N 3.11Å; R225-C229 PolarHBondContact O-SG 3.42Å; R225-C229 VanDerWaalsContact O-SG 3.41Å; L226-C229 WeakPolarHBondContact O-CB 3.24Å; L226-C229 PolarHBondContact O-N 2.97Å; Q227-C229 VanDerWaalsContact C-N 3.26Å; Q227-C229 PolarHBondContact O-N 3.4Å; C229-Q231 VanDerWaalsContact C-N 3.25Å; C229-Q231 PolarHBondContact O-N 3.24Å; C229-L232 PolarHBondContact O-N 3.22Å; C229-V233 WeakPolarHBondContact O-CG2 3.09Å; C229-V233 PolarHBondContact O-N 2.87Å; C229-P274 HydrophobicContact CB-CB 3.88Å; C229-P274 WeakPolarHBondContact CB-O 3.49Å; C229-L278 HydrophobicContact CB-CB 4.3Å; C229-L278 HydrophobicContact CB-CD2 4.16Å
230	T	91.1	Very high	91.2	Very high	67 Å²	67	48.1 Å²	48.1	41%	0.411	26%	0.26	S	S	.	.	H	α-helix	trans	-64	-33.3	178.4	-53	0	0	0	0	112	M228	M228-T230 PolarHBondContact O-N 2.99Å
231	Q	92	Very high	90.6	Very high	37 Å²	37	49 Å²	49	17%	0.173	27%	0.267	C	S	.	.	H	α-helix	trans	-68.1	-49.6	178.5	-176	179.1	-22.3	0	0	110.9	M228 C229 V233 R234 F235	M228-Q231 WeakPolarHBondContact O-CB 3.29Å; M228-Q231 PolarHBondContact O-N 3.07Å; M228-Q231 VanDerWaalsContact O-N 3.14Å; C229-Q231 VanDerWaalsContact C-N 3.25Å; C229-Q231 PolarHBondContact O-N 3.24Å; Q231-V233 VanDerWaalsContact C-N 3.31Å; Q231-V233 PolarHBondContact O-N 2.96Å; Q231-R234 WeakPolarHBondContact O-CB 3.41Å; Q231-R234 PolarHBondContact O-N 3.39Å; Q231-R234 VanDerWaalsContact O-N 3.12Å; Q231-F235 HydrophobicContact CG-CD2 4.43Å; Q231-F235 HydrophobicContact CG-CE2 4.04Å; Q231-F235 VanDerWaalsContact O-CD2 3.23Å; Q231-F235 WeakPolarHBondContact O-CD2 3.44Å
232	L	95.3	Very high	90.2	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-55.9	-44.4	-179.6	-79.1	178.4	0	0	0	112.3	L210 L213 F217 M228 C229 R234 F235 L236 L278	L210-L232 HydrophobicContact CD1-CD2 4.32Å; L213-L232 HydrophobicContact CB-CD2 3.65Å; F217-L232 HydrophobicContact CB-CD1 3.88Å; F217-L232 HydrophobicContact CD1-CD1 4.29Å; F217-L232 HydrophobicContact CD2-CD1 3.38Å; F217-L232 HydrophobicContact CD2-CG 4.37Å; F217-L232 HydrophobicContact CE2-CD1 3.91Å; F217-L232 HydrophobicContact CG-CD1 3.6Å; M228-L232 PolarHBondContact O-N 3.46Å; C229-L232 PolarHBondContact O-N 3.22Å; L232-R234 PolarHBondContact O-N 3.49Å; L232-R234 VanDerWaalsContact O-N 3.17Å; L232-F235 PolarHBondContact O-N 3.18Å; L232-L236 PolarHBondContact O-N 3.34Å; L232-L278 HydrophobicContact CB-CD1 3.99Å; L232-L278 HydrophobicContact CD1-CD2 4.08Å
233	V	93.4	Very high	89.8	Confident	27 Å²	27	46.6 Å²	46.6	16%	0.164	25%	0.246	C	C	.	.	H	α-helix	trans	-53.5	-38	179.1	171.6	0	0	0	0	112.4	C229 Q231 F235 L236 V277 L278	C229-V233 WeakPolarHBondContact O-CG2 3.09Å; C229-V233 PolarHBondContact O-N 2.87Å; Q231-V233 VanDerWaalsContact C-N 3.31Å; Q231-V233 PolarHBondContact O-N 2.96Å; V233-F235 PolarHBondContact O-N 2.9Å; V233-L236 PolarHBondContact O-N 3.37Å; V233-V277 HydrophobicContact CG1-CG1 4.38Å; V233-V277 HydrophobicContact CG2-CG1 4.24Å; V233-L278 HydrophobicContact CG2-CB 3.91Å; V233-L278 HydrophobicContact CG2-CD1 3.8Å; V233-L278 HydrophobicContact CG2-CG 4.47Å
234	R	91.5	Very high	89.3	Confident	106 Å²	106	50.7 Å²	50.7	40%	0.4	26%	0.258	S	S	.	.	H	α-helix	trans	-65.7	-24.6	-178.7	-64.8	176.7	-174.6	-175.7	0.1	113.4	Q231 L232	Q231-R234 WeakPolarHBondContact O-CB 3.41Å; Q231-R234 PolarHBondContact O-N 3.39Å; Q231-R234 VanDerWaalsContact O-N 3.12Å; L232-R234 PolarHBondContact O-N 3.49Å; L232-R234 VanDerWaalsContact O-N 3.17Å
235	F	94.6	Very high	89.1	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-102.9	-1.7	-175.8	-66.9	-82.4	0	0	0	113.3	L184 L187 L191 W199 L209 L210 L213 Q231 L232 V233	L184-F235 HydrophobicContact CB-CZ 4.4Å; L184-F235 HydrophobicContact CD2-CE1 4.32Å; L184-F235 HydrophobicContact CD2-CE2 3.99Å; L184-F235 HydrophobicContact CD2-CZ 3.62Å; L184-F235 WeakPolarHBondContact O-CZ 3.28Å; L187-F235 HydrophobicContact CB-CE1 4.2Å; L187-F235 HydrophobicContact CD2-CE1 3.75Å; L187-F235 HydrophobicContact CG-CE1 3.77Å; L191-F235 HydrophobicContact CD1-CD1 3.55Å; L191-F235 HydrophobicContact CD1-CE1 3.91Å; L191-F235 HydrophobicContact CD1-CG 4.41Å; W199-F235 VanDerWaalsContact CZ2-O 3.25Å; W199-F235 WeakPolarHBondContact CZ2-O 3.35Å; L209-F235 HydrophobicContact CD2-CD1 4.06Å; L209-F235 HydrophobicContact CD2-CE1 3.8Å; L210-F235 HydrophobicContact CD1-CB 4.09Å; L213-F235 HydrophobicContact CD1-CB 4.36Å; L213-F235 HydrophobicContact CD1-CD1 4.49Å; L213-F235 HydrophobicContact CD1-CD2 3.64Å; L213-F235 HydrophobicContact CD1-CE2 4.03Å; L213-F235 HydrophobicContact CD1-CG 3.92Å; Q231-F235 HydrophobicContact CG-CD2 4.43Å; Q231-F235 HydrophobicContact CG-CE2 4.04Å; Q231-F235 VanDerWaalsContact O-CD2 3.23Å; Q231-F235 WeakPolarHBondContact O-CD2 3.44Å; L232-F235 PolarHBondContact O-N 3.18Å; V233-F235 PolarHBondContact O-N 2.9Å
236	L	93.6	Very high	88.9	Confident	12 Å²	12	51 Å²	51	6%	0.063	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-66.2	139.1	178.9	-64.3	176.5	0	0	0	111.2	L210 L232 V233 L278 C281 L282 L285	L210-L236 HydrophobicContact CD1-CD2 4.19Å; L210-L236 HydrophobicContact CD2-CD2 4.35Å; L232-L236 PolarHBondContact O-N 3.34Å; V233-L236 PolarHBondContact O-N 3.37Å; L236-L278 HydrophobicContact CD1-CD1 4.38Å; L236-C281 HydrophobicContact CD1-CB 3.39Å; L236-L282 HydrophobicContact CD1-CD2 4.31Å; L236-L282 HydrophobicContact CD2-CD2 4.24Å; L236-L285 HydrophobicContact CB-CD1 4.35Å; L236-L285 HydrophobicContact CD1-CD1 4.44Å; L236-L285 HydrophobicContact CD2-CD1 3.91Å; L236-L285 HydrophobicContact CG-CD1 4.44Å
237	P	92.4	Very high	89	Confident	7 Å²	7	55.5 Å²	55.5	5%	0.045	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-70.7	160.8	175.6	28.1	-34.4	0	0	0	112.4	W199 A241 A242 L248 L285	W199-P237 HydrophobicContact CD2-CB 3.63Å; W199-P237 HydrophobicContact CE3-CB 3.88Å; W199-P237 HydrophobicContact CG-CB 4.17Å; W199-P237 HydrophobicContact CH2-CB 4.02Å; W199-P237 HydrophobicContact CH2-CG 4.26Å; W199-P237 HydrophobicContact CZ2-CB 3.8Å; W199-P237 HydrophobicContact CZ2-CG 4.22Å; W199-P237 HydrophobicContact CZ3-CB 4.06Å; P237-A241 HydrophobicContact CB-CB 4.1Å; P237-A242 HydrophobicContact CG-CB 3.82Å; P237-L248 HydrophobicContact CG-CD2 3.56Å; P237-L285 WeakPolarHBondContact O-CD2 3.23Å
238	P	88.3	Confident	89.1	Confident	24 Å²	24	48.6 Å²	48.6	16%	0.156	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-55.7	148.5	161.1	-19.9	31.7	0	0	0	111.1	R195 E196 E240 A241 A242	R195-P238 HydrophobicContact CG-CG 4.26Å; E196-P238 HydrophobicContact CG-CG 4Å; P238-E240 VanDerWaalsContact C-N 3.27Å; P238-E240 PolarHBondContact O-N 3.41Å; P238-A241 PolarHBondContact O-N 2.88Å; P238-A242 PolarHBondContact O-N 3.39Å; P238-A242 VanDerWaalsContact O-N 3.09Å
239	P	81.4	Confident	89.1	Confident	70 Å²	70	52.7 Å²	52.7	46%	0.455	27%	0.273	S	S	.	.	H	α-helix	trans	-53.4	-39.9	-176.4	-28.3	35.1	0	0	0	114.1	A241 A242 Q243	P239-A241 VanDerWaalsContact C-N 3.35Å; P239-A241 PolarHBondContact O-N 2.94Å; P239-A242 WeakPolarHBondContact O-CB 3.39Å; P239-A242 PolarHBondContact O-N 3.16Å; P239-A242 VanDerWaalsContact O-N 3.11Å; P239-Q243 WeakPolarHBondContact O-CG 3.29Å; P239-Q243 PolarHBondContact O-N 3.46Å
240	E	80	Confident	89.1	Confident	123 Å²	123	58.6 Å²	58.6	58%	0.575	30%	0.301	S	S	*	.	H	α-helix	trans	-60.6	-41	178.9	-63.8	173.3	-174.5	0	0	112.9	P238 Q244	P238-E240 VanDerWaalsContact C-N 3.27Å; P238-E240 PolarHBondContact O-N 3.41Å; E240-Q244 PolarHBondContact O-NE2 3.34Å
241	A	82.3	Confident	89.3	Confident	35 Å²	35	55.4 Å²	55.4	29%	0.289	28%	0.281	S	S	.	.	H	α-helix	trans	-72.9	-31.5	175.9	0	0	0	0	0	111.7	P237 P238 P239	P237-A241 HydrophobicContact CB-CB 4.1Å; P238-A241 PolarHBondContact O-N 2.88Å; P239-A241 VanDerWaalsContact C-N 3.35Å; P239-A241 PolarHBondContact O-N 2.94Å
242	A	83	Confident	89.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-70.3	-38.4	-179.3	0	0	0	0	0	113.4	P237 P238 P239 Q244 S245 L248 L285 Y286	P237-A242 HydrophobicContact CG-CB 3.82Å; P238-A242 PolarHBondContact O-N 3.39Å; P238-A242 VanDerWaalsContact O-N 3.09Å; P239-A242 WeakPolarHBondContact O-CB 3.39Å; P239-A242 PolarHBondContact O-N 3.16Å; P239-A242 VanDerWaalsContact O-N 3.11Å; A242-Q244 PolarHBondContact O-N 3.34Å; A242-Q244 VanDerWaalsContact O-N 3.12Å; A242-S245 PolarHBondContact O-N 2.96Å; A242-L248 HydrophobicContact CB-CD2 4.31Å; A242-L285 HydrophobicContact CB-CB 4.33Å; A242-L285 HydrophobicContact CB-CD2 3.72Å; A242-L285 HydrophobicContact CB-CG 4.39Å; A242-Y286 PolarHBondContact O-OH 3.16Å
243	Q	80.2	Confident	89.5	Confident	106 Å²	106	54.6 Å²	54.6	50%	0.495	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.2	-177.5	-73.8	-69.8	-16.5	0	0	113.2	P239 L285	P239-Q243 WeakPolarHBondContact O-CG 3.29Å; P239-Q243 PolarHBondContact O-N 3.46Å; Q243-L285 PolarHBondContact NE2-O 3.21Å
244	Q	77.8	Confident	89.6	Confident	171 Å²	171	58.4 Å²	58.4	80%	0.799	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-13	-177	-59.1	175.9	18.1	0	0	113.6	E240 A242	E240-Q244 PolarHBondContact O-NE2 3.34Å; A242-Q244 PolarHBondContact O-N 3.34Å; A242-Q244 VanDerWaalsContact O-N 3.12Å
245	S	87.3	Confident	89.9	Confident	15 Å²	15	53.4 Å²	53.4	11%	0.105	28%	0.277	C	S	.	.			trans	-108.8	110.8	-175	179.7	0	0	0	0	112.7	A242 L248 R249 Y286	A242-S245 PolarHBondContact O-N 2.96Å; S245-L248 WeakPolarHBondContact OG-CB 3.43Å; S245-L248 PolarHBondContact OG-N 3.34Å; S245-L248 VanDerWaalsContact OG-N 3.15Å; S245-R249 PolarHBondContact O-N 3.28Å; S245-Y286 PolarHBondContact O-OH 3.05Å
246	A	89.9	Confident	90	Very high	75 Å²	75	53.2 Å²	53.2	62%	0.62	28%	0.276	S	S	*	.	H	α-helix	trans	-68.7	-35.5	172.7	0	0	0	0	0	112.4	R249 E250	A246-R249 WeakPolarHBondContact O-CB 3.36Å; A246-R249 PolarHBondContact O-N 2.89Å; A246-E250 PolarHBondContact O-N 3.44Å
247	E	94	Very high	90	Very high	118 Å²	118	54.7 Å²	54.7	55%	0.551	29%	0.29	S	S	*	.	H	α-helix	trans	-64.5	-41.4	179.7	-61.6	152	160.2	0	0	111.2	L211 E250 A251	L211-E247 HydrophobicContact CD1-CB 4.23Å; E247-E250 PolarHBondContact O-N 3.14Å; E247-A251 WeakPolarHBondContact O-CB 3.33Å; E247-A251 PolarHBondContact O-N 3.15Å
248	L	94.3	Very high	90.2	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-66.7	-40.6	175.6	-177.9	59.3	0	0	0	111.4	L207 L210 P237 A242 S245 E250 A251 V252 Y286	L207-L248 HydrophobicContact CD1-CB 3.91Å; L207-L248 HydrophobicContact CD1-CD1 4.48Å; L207-L248 HydrophobicContact CD1-CD2 4.44Å; L210-L248 HydrophobicContact CD2-CD1 3.56Å; L210-L248 HydrophobicContact CD2-CD2 4.24Å; L210-L248 HydrophobicContact CG-CD1 4.07Å; P237-L248 HydrophobicContact CG-CD2 3.56Å; A242-L248 HydrophobicContact CB-CD2 4.31Å; S245-L248 WeakPolarHBondContact OG-CB 3.43Å; S245-L248 PolarHBondContact OG-N 3.34Å; S245-L248 VanDerWaalsContact OG-N 3.15Å; L248-E250 VanDerWaalsContact C-N 3.32Å; L248-E250 PolarHBondContact O-N 2.71Å; L248-A251 PolarHBondContact O-N 3.28Å; L248-V252 HydrophobicContact CD1-CG2 4.21Å; L248-V252 HydrophobicContact CG-CG2 4.42Å; L248-V252 WeakPolarHBondContact O-CG2 3.37Å; L248-V252 PolarHBondContact O-N 3.48Å; L248-Y286 WeakPolarHBondContact CB-OH 3.48Å; L248-Y286 WeakPolarHBondContact CD2-OH 3.4Å; L248-Y286 HydrophobicContact CG-CE2 4.1Å; L248-Y286 VanDerWaalsContact CG-OH 3.25Å; L248-Y286 WeakPolarHBondContact CG-OH 3.42Å
249	R	93.5	Very high	90.5	Very high	102 Å²	102	54 Å²	54	39%	0.385	29%	0.287	S	S	.	.	H	α-helix	trans	-57	-46.2	174.7	-173.4	179.2	-67	157.1	-0.5	111.5	S245 A246 V252 G253 Y286	S245-R249 PolarHBondContact O-N 3.28Å; A246-R249 WeakPolarHBondContact O-CB 3.36Å; A246-R249 PolarHBondContact O-N 2.89Å; R249-V252 PolarHBondContact O-N 3.21Å; R249-G253 PolarHBondContact O-N 3.05Å; R249-Y286 HydrophobicContact CB-CD1 4.24Å; R249-Y286 HydrophobicContact CB-CE1 3.84Å; R249-Y286 HydrophobicContact CB-CE2 4.2Å; R249-Y286 HydrophobicContact CG-CD1 4.02Å; R249-Y286 HydrophobicContact CG-CE1 4.14Å; R249-Y286 HydrophobicContact CG-CG 4.23Å; R249-Y286 PolarHBondContact N-OH 3.01Å
250	E	94.5	Very high	91.1	Very high	125 Å²	125	54.7 Å²	54.7	58%	0.584	28%	0.28	S	S	*	.	H	α-helix	trans	-63.9	-43.2	176.3	-162.3	-160.3	152.1	0	0	111.8	A246 E247 L248 V252 G253 R254	A246-E250 PolarHBondContact O-N 3.44Å; E247-E250 PolarHBondContact O-N 3.14Å; L248-E250 VanDerWaalsContact C-N 3.32Å; L248-E250 PolarHBondContact O-N 2.71Å; E250-V252 PolarHBondContact O-N 3.17Å; E250-G253 PolarHBondContact O-N 3.43Å; E250-R254 PolarHBondContact O-N 3.3Å; E250-R254 IonicContact OE1-NH1 2.69Å; E250-R254 PolarHBondContact OE1-NH1 3.42Å; E250-R254 IonicContact OE2-NH1 2.94Å
251	A	96	Very high	91.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-42.9	177.1	0	0	0	0	0	112.4	L211 C214 E247 L248 G253 R254 V255	L211-A251 HydrophobicContact CD2-CB 3.51Å; C214-A251 HydrophobicContact CB-CB 4.23Å; E247-A251 WeakPolarHBondContact O-CB 3.33Å; E247-A251 PolarHBondContact O-N 3.15Å; L248-A251 PolarHBondContact O-N 3.28Å; A251-G253 VanDerWaalsContact C-N 3.32Å; A251-G253 PolarHBondContact O-N 3.43Å; A251-R254 WeakPolarHBondContact O-CB 3.26Å; A251-R254 PolarHBondContact O-N 3.48Å; A251-R254 VanDerWaalsContact O-N 3.13Å; A251-V255 WeakPolarHBondContact O-CG2 3.44Å; A251-V255 PolarHBondContact O-N 3.34Å
252	V	95.4	Very high	92.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-39.1	174.5	169	0	0	0	0	111.2	L248 R249 E250 R254 V255 W256 L282 Y286	L248-V252 HydrophobicContact CD1-CG2 4.21Å; L248-V252 HydrophobicContact CG-CG2 4.42Å; L248-V252 WeakPolarHBondContact O-CG2 3.37Å; L248-V252 PolarHBondContact O-N 3.48Å; R249-V252 PolarHBondContact O-N 3.21Å; E250-V252 PolarHBondContact O-N 3.17Å; V252-R254 VanDerWaalsContact C-N 3.3Å; V252-R254 PolarHBondContact O-N 3.23Å; V252-V255 PolarHBondContact O-N 2.87Å; V252-V255 VanDerWaalsContact O-N 3.15Å; V252-W256 PolarHBondContact O-N 3.14Å; V252-L282 HydrophobicContact CG1-CB 4.3Å; V252-L282 HydrophobicContact CG1-CD2 3.9Å; V252-L282 HydrophobicContact CG1-CG 4.46Å; V252-L282 HydrophobicContact CG2-CD2 3.91Å; V252-Y286 HydrophobicContact CB-CD2 3.8Å; V252-Y286 HydrophobicContact CB-CE2 3.94Å; V252-Y286 HydrophobicContact CG1-CD2 3.83Å; V252-Y286 HydrophobicContact CG1-CE2 4.44Å; V252-Y286 HydrophobicContact CG2-CD2 3.92Å; V252-Y286 HydrophobicContact CG2-CE2 3.68Å
253	G	95.2	Very high	92.6	Very high	25 Å²	25	51 Å²	51	26%	0.258	26%	0.264	S	S	.	.	H	α-helix	trans	-57	-41.4	171.5	0	0	0	0	0	113	R249 E250 A251 W256 A257	R249-G253 PolarHBondContact O-N 3.05Å; E250-G253 PolarHBondContact O-N 3.43Å; A251-G253 VanDerWaalsContact C-N 3.32Å; A251-G253 PolarHBondContact O-N 3.43Å; G253-W256 PolarHBondContact O-N 3.17Å; G253-A257 PolarHBondContact O-N 3.15Å
254	R	96.4	Very high	93.2	Very high	106 Å²	106	51.7 Å²	51.7	40%	0.4	27%	0.267	S	S	.	.	H	α-helix	trans	-68.2	-37.5	174.4	-64.9	-172.9	-64.1	-103.6	0.1	112.7	C218 E250 A251 V252 A257 A258	C218-R254 VanDerWaalsContact SG-C 3.6Å; C218-R254 PolarHBondContact SG-O 2.69Å; E250-R254 PolarHBondContact O-N 3.3Å; E250-R254 IonicContact OE1-NH1 2.69Å; E250-R254 PolarHBondContact OE1-NH1 3.42Å; E250-R254 IonicContact OE2-NH1 2.94Å; A251-R254 WeakPolarHBondContact O-CB 3.26Å; A251-R254 PolarHBondContact O-N 3.48Å; A251-R254 VanDerWaalsContact O-N 3.13Å; V252-R254 VanDerWaalsContact C-N 3.3Å; V252-R254 PolarHBondContact O-N 3.23Å; R254-A257 WeakPolarHBondContact O-CB 3.41Å; R254-A257 PolarHBondContact O-N 2.81Å; R254-A258 PolarHBondContact O-N 3.16Å; R254-A258 VanDerWaalsContact O-N 3.08Å
255	V	97.2	Very high	93.8	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.012	25%	0.247	C	C	.	.	H	α-helix	trans	-62.9	-45.7	174.7	172.3	0	0	0	0	110.5	C214 F217 A251 V252 A257 A258 L259 L278 L282	C214-V255 HydrophobicContact CB-CG2 3.81Å; F217-V255 HydrophobicContact CD1-CG1 4.04Å; F217-V255 HydrophobicContact CD1-CG2 4.3Å; F217-V255 HydrophobicContact CE1-CG1 3.8Å; F217-V255 HydrophobicContact CZ-CG1 4.43Å; A251-V255 WeakPolarHBondContact O-CG2 3.44Å; A251-V255 PolarHBondContact O-N 3.34Å; V252-V255 PolarHBondContact O-N 2.87Å; V252-V255 VanDerWaalsContact O-N 3.15Å; V255-A257 VanDerWaalsContact C-N 3.31Å; V255-A257 PolarHBondContact O-N 3.27Å; V255-A258 PolarHBondContact O-N 2.91Å; V255-A258 VanDerWaalsContact O-N 3.12Å; V255-L259 HydrophobicContact CG1-CD1 3.94Å; V255-L259 HydrophobicContact CG1-CG 4.31Å; V255-L259 WeakPolarHBondContact O-CB 3.49Å; V255-L259 WeakPolarHBondContact O-CG 3.36Å; V255-L259 PolarHBondContact O-N 2.91Å; V255-L278 HydrophobicContact CG1-CD2 4.49Å; V255-L282 HydrophobicContact CB-CD1 4.49Å; V255-L282 HydrophobicContact CG1-CD1 3.68Å
256	W	96.7	Very high	93.9	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-57.9	-42.9	172.6	-84.8	119	0	0	0	112.2	V252 G253 A258 L259 R260 L282 L283 S290 V291 F296 L300	V252-W256 PolarHBondContact O-N 3.14Å; G253-W256 PolarHBondContact O-N 3.17Å; W256-A258 VanDerWaalsContact C-N 3.27Å; W256-A258 PolarHBondContact O-N 3.01Å; W256-L259 HydrophobicContact CE3-CB 4.37Å; W256-L259 HydrophobicContact CE3-CD1 4.27Å; W256-L259 HydrophobicContact CZ3-CD1 4.48Å; W256-L259 PolarHBondContact O-N 2.69Å; W256-L259 VanDerWaalsContact O-N 3.14Å; W256-R260 WeakPolarHBondContact O-CG 3.36Å; W256-R260 PolarHBondContact O-N 2.83Å; W256-L282 HydrophobicContact CD2-CD1 4.41Å; W256-L282 HydrophobicContact CZ2-CB 3.69Å; W256-L282 HydrophobicContact CZ2-CD1 4.35Å; W256-L283 HydrophobicContact CZ2-CD2 4.4Å; W256-L283 HydrophobicContact CZ2-CG 4.15Å; W256-S290 VanDerWaalsContact CB-O 3.26Å; W256-S290 WeakPolarHBondContact CB-O 3.15Å; W256-V291 HydrophobicContact CD2-CB 4.39Å; W256-V291 HydrophobicContact CD2-CG2 4.09Å; W256-V291 HydrophobicContact CE3-CG1 4.26Å; W256-V291 HydrophobicContact CE3-CG2 4.46Å; W256-V291 HydrophobicContact CH2-CG1 4.26Å; W256-V291 HydrophobicContact CH2-CG2 3.92Å; W256-V291 HydrophobicContact CZ2-CG2 3.51Å; W256-V291 HydrophobicContact CZ3-CG1 4.09Å; W256-V291 HydrophobicContact CZ3-CG2 4.39Å; W256-F296 HydrophobicContact CE3-CE1 4.39Å; W256-F296 HydrophobicContact CZ3-CE1 4.29Å; W256-L300 HydrophobicContact CH2-CD2 3.77Å; W256-L300 HydrophobicContact CZ3-CD2 4.12Å
257	A	95.1	Very high	93.9	Very high	43 Å²	43	52.8 Å²	52.8	36%	0.355	26%	0.263	S	S	.	.	H	α-helix	trans	-58.3	-38.2	176.2	0	0	0	0	0	112.8	G253 R254 V255 P261	G253-A257 PolarHBondContact O-N 3.15Å; R254-A257 WeakPolarHBondContact O-CB 3.41Å; R254-A257 PolarHBondContact O-N 2.81Å; V255-A257 VanDerWaalsContact C-N 3.31Å; V255-A257 PolarHBondContact O-N 3.27Å; A257-P261 VanDerWaalsContact O-CD 3.26Å; A257-P261 WeakPolarHBondContact O-CD 3.47Å
258	A	95.3	Very high	93.7	Very high	16 Å²	16	50.4 Å²	50.4	13%	0.132	26%	0.257	C	S	.	.	H	α-helix	trans	-77	-29.9	175.2	0	0	0	0	0	113.6	F217 R254 V255 W256 P261 T262	F217-A258 HydrophobicContact CD1-CB 4.33Å; F217-A258 HydrophobicContact CE1-CB 4.05Å; R254-A258 PolarHBondContact O-N 3.16Å; R254-A258 VanDerWaalsContact O-N 3.08Å; V255-A258 PolarHBondContact O-N 2.91Å; V255-A258 VanDerWaalsContact O-N 3.12Å; W256-A258 VanDerWaalsContact C-N 3.27Å; W256-A258 PolarHBondContact O-N 3.01Å; A258-P261 WeakPolarHBondContact O-CD 3.18Å; A258-P261 WeakPolarHBondContact O-CG 3.44Å; A258-T262 PolarHBondContact O-OG1 3.28Å; A258-T262 VanDerWaalsContact O-OG1 3.11Å
259	L	94.8	Very high	93	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-73.5	-36.1	177.6	-80.9	175.6	0	0	0	113.2	F217 V255 W256 T262 L263 V275 L278 L282	F217-L259 HydrophobicContact CE1-CD2 4.24Å; F217-L259 HydrophobicContact CE1-CG 4.05Å; F217-L259 HydrophobicContact CZ-CD2 3.63Å; F217-L259 HydrophobicContact CZ-CG 3.92Å; V255-L259 HydrophobicContact CG1-CD1 3.94Å; V255-L259 HydrophobicContact CG1-CG 4.31Å; V255-L259 WeakPolarHBondContact O-CB 3.49Å; V255-L259 WeakPolarHBondContact O-CG 3.36Å; V255-L259 PolarHBondContact O-N 2.91Å; W256-L259 HydrophobicContact CE3-CB 4.37Å; W256-L259 HydrophobicContact CE3-CD1 4.27Å; W256-L259 HydrophobicContact CZ3-CD1 4.48Å; W256-L259 PolarHBondContact O-N 2.69Å; W256-L259 VanDerWaalsContact O-N 3.14Å; L259-T262 WeakPolarHBondContact O-CA 3.41Å; L259-T262 VanDerWaalsContact O-CB 3.25Å; L259-T262 WeakPolarHBondContact O-CB 3.37Å; L259-T262 PolarHBondContact O-N 2.95Å; L259-L263 PolarHBondContact O-N 3.42Å; L259-V275 HydrophobicContact CD2-CG1 4.05Å; L259-L278 HydrophobicContact CD1-CD2 3.98Å; L259-L278 HydrophobicContact CD1-CG 4.28Å; L259-L278 HydrophobicContact CD2-CD2 4.34Å; L259-L282 HydrophobicContact CD1-CD1 3.78Å
260	R	94.4	Very high	92.5	Very high	84 Å²	84	59.8 Å²	59.8	32%	0.317	31%	0.311	S	S	.	.	H	α-helix	trans	-48.4	-56.1	-179.3	-78.6	-175.1	-61.9	-162.6	2	114.5	W256 T262 L263 Q264 F296	W256-R260 WeakPolarHBondContact O-CG 3.36Å; W256-R260 PolarHBondContact O-N 2.83Å; R260-T262 PolarHBondContact O-N 3.24Å; R260-L263 PolarHBondContact O-N 3.05Å; R260-Q264 VanDerWaalsContact O-CG 3.32Å; R260-Q264 WeakPolarHBondContact O-CG 3.2Å; R260-Q264 PolarHBondContact O-N 2.72Å; R260-Q264 VanDerWaalsContact O-N 3.1Å; R260-F296 HydrophobicContact CB-CD2 4.39Å; R260-F296 HydrophobicContact CB-CE2 3.97Å; R260-F296 HydrophobicContact CB-CZ 4.1Å; R260-F296 HydrophobicContact CG-CD1 3.86Å; R260-F296 HydrophobicContact CG-CD2 4Å; R260-F296 HydrophobicContact CG-CE1 3.59Å; R260-F296 HydrophobicContact CG-CE2 3.73Å; R260-F296 HydrophobicContact CG-CG 4.07Å; R260-F296 HydrophobicContact CG-CZ 3.52Å
261	P	93.3	Very high	92.4	Very high	72 Å²	72	57.4 Å²	57.4	47%	0.468	30%	0.3	S	S	.	.	H	α-helix	trans	-64	-31.7	177.9	24.6	-33.5	0	0	0	112.3	A257 A258 Q264 A265	A257-P261 VanDerWaalsContact O-CD 3.26Å; A257-P261 WeakPolarHBondContact O-CD 3.47Å; A258-P261 WeakPolarHBondContact O-CD 3.18Å; A258-P261 WeakPolarHBondContact O-CG 3.44Å; P261-Q264 PolarHBondContact O-N 3.48Å; P261-A265 PolarHBondContact O-N 2.82Å; P261-A265 VanDerWaalsContact O-N 3.08Å
262	T	92.1	Very high	92.3	Very high	6 Å²	6	57.6 Å²	57.6	4%	0.037	30%	0.301	C	S	.	.	H	α-helix	trans	-64.6	-44	177.7	-49.1	0	0	0	0	111.4	R225 L226 A258 L259 R260 A265 L267	R225-T262 PolarHBondContact NH1-OG1 2.77Å; L226-T262 HydrophobicContact CD2-CG2 3.79Å; A258-T262 PolarHBondContact O-OG1 3.28Å; A258-T262 VanDerWaalsContact O-OG1 3.11Å; L259-T262 WeakPolarHBondContact O-CA 3.41Å; L259-T262 VanDerWaalsContact O-CB 3.25Å; L259-T262 WeakPolarHBondContact O-CB 3.37Å; L259-T262 PolarHBondContact O-N 2.95Å; R260-T262 PolarHBondContact O-N 3.24Å; T262-A265 WeakPolarHBondContact O-CB 3.4Å; T262-A265 PolarHBondContact O-N 3.33Å; T262-L267 HydrophobicContact CG2-CD2 4.39Å
263	L	91.8	Very high	92.2	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-72.7	-26.1	177.7	-84.7	165.2	0	0	0	113.7	L259 R260 A265 V275 L276 F296 L300	L259-L263 PolarHBondContact O-N 3.42Å; R260-L263 PolarHBondContact O-N 3.05Å; L263-A265 VanDerWaalsContact C-N 3.34Å; L263-V275 HydrophobicContact CD1-CG1 4.17Å; L263-V275 HydrophobicContact CD2-CG1 3.62Å; L263-V275 HydrophobicContact CG-CG1 3.64Å; L263-L276 HydrophobicContact CD2-CD2 4.22Å; L263-F296 HydrophobicContact CB-CE2 3.99Å; L263-F296 HydrophobicContact CB-CZ 4.09Å; L263-F296 HydrophobicContact CD1-CE2 4.41Å; L263-F296 HydrophobicContact CD1-CZ 3.67Å; L263-L300 HydrophobicContact CD1-CD1 3.98Å
264	Q	92.1	Very high	92.1	Very high	122 Å²	122	58.1 Å²	58.1	57%	0.57	30%	0.3	S	S	*	.	H	α-helix	trans	-78.1	-20.4	173.9	-71.3	173.9	-35.1	0	0	112.6	R260 P261 F296 L299	R260-Q264 VanDerWaalsContact O-CG 3.32Å; R260-Q264 WeakPolarHBondContact O-CG 3.2Å; R260-Q264 PolarHBondContact O-N 2.72Å; R260-Q264 VanDerWaalsContact O-N 3.1Å; P261-Q264 PolarHBondContact O-N 3.48Å; Q264-F296 HydrophobicContact CG-CD2 4.35Å; Q264-F296 HydrophobicContact CG-CE2 4.34Å; Q264-L299 HydrophobicContact CG-CD2 3.77Å
265	A	90.9	Very high	92.1	Very high	44 Å²	44	53.1 Å²	53.1	36%	0.364	28%	0.281	S	S	.	.	S	Bend	trans	-73.4	166.7	175.7	0	0	0	0	0	112.4	P261 T262 L263 L267	P261-A265 PolarHBondContact O-N 2.82Å; P261-A265 VanDerWaalsContact O-N 3.08Å; T262-A265 WeakPolarHBondContact O-CB 3.4Å; T262-A265 PolarHBondContact O-N 3.33Å; L263-A265 VanDerWaalsContact C-N 3.34Å; A265-L267 PolarHBondContact O-N 3.09Å
266	K	89.4	Confident	92.1	Very high	208 Å²	208	53 Å²	53	90%	0.904	28%	0.281	S	S	*	.			trans	-80.4	104	173.3	-170.9	176.5	-177.9	179.1	0	109.4
267	L	90.4	Very high	92.1	Very high	31 Å²	31	53.6 Å²	53.6	16%	0.162	28%	0.284	C	S	.	.			trans	-96.2	148.1	176.3	-60.1	175.9	0	0	0	110.8	L226 T262 A265 Q271 I272 V275	L226-L267 HydrophobicContact CD1-CD2 4.47Å; L226-L267 HydrophobicContact CD2-CD2 4.21Å; T262-L267 HydrophobicContact CG2-CD2 4.39Å; A265-L267 PolarHBondContact O-N 3.09Å; L267-Q271 HydrophobicContact CB-CB 4.35Å; L267-Q271 HydrophobicContact CD2-CB 4.4Å; L267-I272 HydrophobicContact CB-CB 4.18Å; L267-I272 HydrophobicContact CD1-CB 4.28Å; L267-I272 HydrophobicContact CD1-CG1 4.27Å; L267-V275 HydrophobicContact CD1-CG2 4.38Å
268	T	88.3	Confident	92.2	Very high	69 Å²	69	51.6 Å²	51.6	42%	0.423	27%	0.267	S	S	.	.			trans	-79.5	160.1	167.8	62.5	0	0	0	0	110.8	K270 Q271 I272	T268-K270 PolarHBondContact O-N 2.71Å; T268-K270 VanDerWaalsContact O-N 3.16Å; T268-Q271 PolarHBondContact O-N 3.43Å; T268-Q271 VanDerWaalsContact OG1-CG 3.24Å; T268-Q271 WeakPolarHBondContact OG1-CG 3.3Å; T268-Q271 PolarHBondContact OG1-OE1 2.9Å; T268-I272 PolarHBondContact O-N 3.43Å
269	P	79.6	Confident	92.3	Very high	106 Å²	106	50.8 Å²	50.8	69%	0.688	26%	0.261	S	S	*	.	H	α-helix	trans	-54.6	-34.5	176.7	-28.2	36	0	0	0	113.7	Q271 I272	P269-Q271 VanDerWaalsContact C-N 3.31Å; P269-Q271 PolarHBondContact O-N 3.12Å; P269-I272 WeakPolarHBondContact O-CG2 3.08Å
270	K	84.3	Confident	92.3	Very high	194 Å²	194	51 Å²	51	84%	0.843	26%	0.263	S	S	*	.	H	α-helix	trans	-71.5	-24.1	176.6	-67.2	-172.4	176.7	-175.5	0	113.9	T268	T268-K270 PolarHBondContact O-N 2.71Å; T268-K270 VanDerWaalsContact O-N 3.16Å
271	Q	91.5	Very high	92.3	Very high	75 Å²	75	48.6 Å²	48.6	35%	0.35	26%	0.259	S	S	.	.	H	α-helix	trans	-92.8	-32.6	-176.8	-71.3	167	-36.2	0	0	112.4	L226 L267 T268 P269 V275	L226-Q271 HydrophobicContact CD1-CB 4.24Å; L226-Q271 HydrophobicContact CD1-CG 4.03Å; L267-Q271 HydrophobicContact CB-CB 4.35Å; L267-Q271 HydrophobicContact CD2-CB 4.4Å; T268-Q271 PolarHBondContact O-N 3.43Å; T268-Q271 VanDerWaalsContact OG1-CG 3.24Å; T268-Q271 WeakPolarHBondContact OG1-CG 3.3Å; T268-Q271 PolarHBondContact OG1-OE1 2.9Å; P269-Q271 VanDerWaalsContact C-N 3.31Å; P269-Q271 PolarHBondContact O-N 3.12Å; Q271-V275 WeakPolarHBondContact O-CG2 3.01Å
272	I	93.2	Very high	92.4	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-69.7	-35.4	-175.7	-167.3	168.6	0	0	0	112.3	L267 T268 P269 V275 L276 R303 E307	L267-I272 HydrophobicContact CB-CB 4.18Å; L267-I272 HydrophobicContact CD1-CB 4.28Å; L267-I272 HydrophobicContact CD1-CG1 4.27Å; T268-I272 PolarHBondContact O-N 3.43Å; P269-I272 WeakPolarHBondContact O-CG2 3.08Å; I272-V275 WeakPolarHBondContact O-CB 3.48Å; I272-V275 PolarHBondContact O-N 3.29Å; I272-V275 VanDerWaalsContact O-N 3.1Å; I272-L276 HydrophobicContact CD1-CD1 4.19Å; I272-L276 HydrophobicContact CG1-CD1 3.82Å; I272-L276 HydrophobicContact CG1-CG 3.94Å; I272-L276 PolarHBondContact O-N 3.26Å; I272-R303 HydrophobicContact CD1-CB 4.37Å; I272-E307 HydrophobicContact CD1-CG 4.15Å; I272-E307 VanDerWaalsContact CG2-CD 3.47Å; I272-E307 HydrophobicContact CG2-CG 4.12Å; I272-E307 WeakPolarHBondContact CG2-OE2 3.44Å
273	G	93.7	Very high	92.4	Very high	2 Å²	2	45.3 Å²	45.3	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-54.9	-57.1	-176.8	0	0	0	0	0	114.4	V275 L276 V277 T327	G273-V275 PolarHBondContact O-N 3.07Å; G273-L276 PolarHBondContact O-N 2.99Å; G273-L276 VanDerWaalsContact O-N 3.14Å; G273-V277 VanDerWaalsContact O-CG2 3.31Å; G273-V277 WeakPolarHBondContact O-CG2 3.37Å; G273-V277 PolarHBondContact O-N 2.71Å; G273-T327 VanDerWaalsContact CA-CG2 3.43Å; G273-T327 WeakPolarHBondContact CA-OG1 3.49Å
274	P	94.3	Very high	92.2	Very high	35 Å²	35	48.3 Å²	48.3	23%	0.227	25%	0.253	C	S	.	.	H	α-helix	trans	-56.2	-33.5	176.2	-28.4	36.1	0	0	0	114.2	C229 L278	C229-P274 HydrophobicContact CB-CB 3.88Å; C229-P274 WeakPolarHBondContact CB-O 3.49Å; P274-L278 WeakPolarHBondContact O-CB 3.47Å; P274-L278 PolarHBondContact O-N 3.1Å; P274-L278 VanDerWaalsContact O-N 3.07Å
275	V	96.8	Very high	92.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-70.1	-43.1	179.1	-179.8	0	0	0	0	110.9	L226 L259 L263 L267 Q271 I272 G273 S279	L226-V275 HydrophobicContact CD2-CG2 3.4Å; L226-V275 VanDerWaalsContact CD2-CG2 3.4Å; L259-V275 HydrophobicContact CD2-CG1 4.05Å; L263-V275 HydrophobicContact CD1-CG1 4.17Å; L263-V275 HydrophobicContact CD2-CG1 3.62Å; L263-V275 HydrophobicContact CG-CG1 3.64Å; L267-V275 HydrophobicContact CD1-CG2 4.38Å; Q271-V275 WeakPolarHBondContact O-CG2 3.01Å; I272-V275 WeakPolarHBondContact O-CB 3.48Å; I272-V275 PolarHBondContact O-N 3.29Å; I272-V275 VanDerWaalsContact O-N 3.1Å; G273-V275 PolarHBondContact O-N 3.07Å; V275-S279 WeakPolarHBondContact O-CB 3.48Å; V275-S279 PolarHBondContact O-N 3.08Å; V275-S279 PolarHBondContact O-OG 3.42Å
276	L	97.1	Very high	92	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.6	-40.4	177.3	-67.3	177.4	0	0	0	111.8	L263 I272 G273 L278 S279 A280 L300 R303 E307 C331 I334	L263-L276 HydrophobicContact CD2-CD2 4.22Å; I272-L276 HydrophobicContact CD1-CD1 4.19Å; I272-L276 HydrophobicContact CG1-CD1 3.82Å; I272-L276 HydrophobicContact CG1-CG 3.94Å; I272-L276 PolarHBondContact O-N 3.26Å; G273-L276 PolarHBondContact O-N 2.99Å; G273-L276 VanDerWaalsContact O-N 3.14Å; L276-L278 PolarHBondContact O-N 2.96Å; L276-S279 WeakPolarHBondContact O-CB 3.4Å; L276-S279 PolarHBondContact O-N 3.07Å; L276-S279 VanDerWaalsContact O-N 3.16Å; L276-A280 WeakPolarHBondContact O-CB 3.29Å; L276-A280 PolarHBondContact O-N 3.39Å; L276-L300 HydrophobicContact CD2-CD1 3.87Å; L276-R303 HydrophobicContact CD2-CB 4.15Å; L276-E307 HydrophobicContact CD1-CB 4.23Å; L276-E307 HydrophobicContact CD1-CG 3.6Å; L276-C331 VanDerWaalsContact CD1-SG 3.58Å; L276-I334 HydrophobicContact CB-CD1 4.25Å; L276-I334 HydrophobicContact CD2-CD1 4.08Å
277	V	95.8	Very high	92	Very high	13 Å²	13	33.1 Å²	33.1	8%	0.079	19%	0.185	C	C	.	.	H	α-helix	trans	-61.1	-45.8	175.6	175.7	0	0	0	0	110.9	V233 G273 S279 A280 C281	V233-V277 HydrophobicContact CG1-CG1 4.38Å; V233-V277 HydrophobicContact CG2-CG1 4.24Å; G273-V277 VanDerWaalsContact O-CG2 3.31Å; G273-V277 WeakPolarHBondContact O-CG2 3.37Å; G273-V277 PolarHBondContact O-N 2.71Å; V277-S279 VanDerWaalsContact C-N 3.34Å; V277-S279 PolarHBondContact O-N 2.82Å; V277-A280 PolarHBondContact O-N 2.92Å; V277-C281 PolarHBondContact O-N 3.14Å; V277-C281 VanDerWaalsContact O-N 3.09Å; V277-C281 PolarHBondContact O-SG 3.15Å
278	L	96.9	Very high	91.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.2	-44.7	174	177.1	61.4	0	0	0	111.1	F217 C229 L232 V233 L236 V255 L259 P274 L276 A280 C281 L282	F217-L278 HydrophobicContact CE2-CD2 4.15Å; F217-L278 HydrophobicContact CZ-CD2 4.13Å; C229-L278 HydrophobicContact CB-CB 4.3Å; C229-L278 HydrophobicContact CB-CD2 4.16Å; L232-L278 HydrophobicContact CB-CD1 3.99Å; L232-L278 HydrophobicContact CD1-CD2 4.08Å; V233-L278 HydrophobicContact CG2-CB 3.91Å; V233-L278 HydrophobicContact CG2-CD1 3.8Å; V233-L278 HydrophobicContact CG2-CG 4.47Å; L236-L278 HydrophobicContact CD1-CD1 4.38Å; V255-L278 HydrophobicContact CG1-CD2 4.49Å; L259-L278 HydrophobicContact CD1-CD2 3.98Å; L259-L278 HydrophobicContact CD1-CG 4.28Å; L259-L278 HydrophobicContact CD2-CD2 4.34Å; P274-L278 WeakPolarHBondContact O-CB 3.47Å; P274-L278 PolarHBondContact O-N 3.1Å; P274-L278 VanDerWaalsContact O-N 3.07Å; L276-L278 PolarHBondContact O-N 2.96Å; L278-A280 VanDerWaalsContact C-N 3.33Å; L278-A280 PolarHBondContact O-N 3.29Å; L278-C281 PolarHBondContact O-N 3.34Å; L278-L282 HydrophobicContact CD1-CD1 4.14Å; L278-L282 HydrophobicContact CD1-CD2 4.23Å; L278-L282 HydrophobicContact CD1-CG 3.95Å; L278-L282 HydrophobicContact CG-CD1 4.01Å; L278-L282 HydrophobicContact CG-CG 4.24Å; L278-L282 VanDerWaalsContact O-CG 3.29Å; L278-L282 WeakPolarHBondContact O-CG 3.42Å; L278-L282 PolarHBondContact O-N 3.4Å
279	S	97.4	Very high	91.7	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-57.4	-44.8	178.7	-61.6	0	0	0	0	112.1	V275 L276 V277 L282 L283	V275-S279 WeakPolarHBondContact O-CB 3.48Å; V275-S279 PolarHBondContact O-N 3.08Å; V275-S279 PolarHBondContact O-OG 3.42Å; L276-S279 WeakPolarHBondContact O-CB 3.4Å; L276-S279 PolarHBondContact O-N 3.07Å; L276-S279 VanDerWaalsContact O-N 3.16Å; V277-S279 VanDerWaalsContact C-N 3.34Å; V277-S279 PolarHBondContact O-N 2.82Å; S279-L282 PolarHBondContact O-N 2.68Å; S279-L283 WeakPolarHBondContact O-CG 3.49Å; S279-L283 PolarHBondContact O-N 3.17Å
280	A	95.9	Very high	92.1	Very high	4 Å²	4	31.9 Å²	31.9	3%	0.033	17%	0.167	C	C	.	.	H	α-helix	trans	-59.6	-48.3	175.6	0	0	0	0	0	111.8	L276 V277 L278 L282 L283 D284 G330 R333 I334	L276-A280 WeakPolarHBondContact O-CB 3.29Å; L276-A280 PolarHBondContact O-N 3.39Å; V277-A280 PolarHBondContact O-N 2.92Å; L278-A280 VanDerWaalsContact C-N 3.33Å; L278-A280 PolarHBondContact O-N 3.29Å; A280-L282 VanDerWaalsContact C-N 3.31Å; A280-L282 PolarHBondContact O-N 3.09Å; A280-L283 WeakPolarHBondContact O-CB 3.44Å; A280-L283 PolarHBondContact O-N 3.12Å; A280-D284 PolarHBondContact O-N 2.95Å; A280-D284 VanDerWaalsContact O-N 3.1Å; A280-G330 VanDerWaalsContact CB-O 3.28Å; A280-G330 WeakPolarHBondContact CB-O 3.46Å; A280-R333 HydrophobicContact CB-CB 4.27Å; A280-R333 HydrophobicContact CB-CG 4.48Å; A280-I334 HydrophobicContact CB-CD1 4.3Å; A280-I334 HydrophobicContact CB-CG1 3.9Å
281	C	94.3	Very high	92.4	Very high	34 Å²	34	22.6 Å²	22.6	23%	0.23	13%	0.127	C	C	.	.	H	α-helix	trans	-64.6	-36.1	179.7	-60.4	0	0	0	0	112.2	L236 V277 L278 D284 L285	L236-C281 HydrophobicContact CD1-CB 3.39Å; V277-C281 PolarHBondContact O-N 3.14Å; V277-C281 VanDerWaalsContact O-N 3.09Å; V277-C281 PolarHBondContact O-SG 3.15Å; L278-C281 PolarHBondContact O-N 3.34Å; C281-D284 PolarHBondContact O-N 3.02Å; C281-L285 WeakPolarHBondContact O-CG 3.45Å; C281-L285 PolarHBondContact O-N 2.98Å
282	L	94.8	Very high	92.3	Very high	3 Å²	3	19.9 Å²	19.9	2%	0.016	12%	0.118	C	C	.	.	H	α-helix	trans	-70.4	-33.2	176.6	-65.4	179	0	0	0	112.4	L236 V252 V255 W256 L259 L278 S279 A280 D284 L285 Y286	L236-L282 HydrophobicContact CD1-CD2 4.31Å; L236-L282 HydrophobicContact CD2-CD2 4.24Å; V252-L282 HydrophobicContact CG1-CB 4.3Å; V252-L282 HydrophobicContact CG1-CD2 3.9Å; V252-L282 HydrophobicContact CG1-CG 4.46Å; V252-L282 HydrophobicContact CG2-CD2 3.91Å; V255-L282 HydrophobicContact CB-CD1 4.49Å; V255-L282 HydrophobicContact CG1-CD1 3.68Å; W256-L282 HydrophobicContact CD2-CD1 4.41Å; W256-L282 HydrophobicContact CZ2-CB 3.69Å; W256-L282 HydrophobicContact CZ2-CD1 4.35Å; L259-L282 HydrophobicContact CD1-CD1 3.78Å; L278-L282 HydrophobicContact CD1-CD1 4.14Å; L278-L282 HydrophobicContact CD1-CD2 4.23Å; L278-L282 HydrophobicContact CD1-CG 3.95Å; L278-L282 HydrophobicContact CG-CD1 4.01Å; L278-L282 HydrophobicContact CG-CG 4.24Å; L278-L282 VanDerWaalsContact O-CG 3.29Å; L278-L282 WeakPolarHBondContact O-CG 3.42Å; L278-L282 PolarHBondContact O-N 3.4Å; S279-L282 PolarHBondContact O-N 2.68Å; A280-L282 VanDerWaalsContact C-N 3.31Å; A280-L282 PolarHBondContact O-N 3.09Å; L282-D284 VanDerWaalsContact C-N 3.32Å; L282-L285 PolarHBondContact O-N 2.77Å; L282-Y286 PolarHBondContact O-N 3.44Å
283	L	91.4	Very high	92.1	Very high	6 Å²	6	23.3 Å²	23.3	3%	0.031	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-39.7	171.1	-75.5	170.5	0	0	0	111.1	W256 S279 A280 L285 G287 W288 V291 L300 I334 A337	W256-L283 HydrophobicContact CZ2-CD2 4.4Å; W256-L283 HydrophobicContact CZ2-CG 4.15Å; S279-L283 WeakPolarHBondContact O-CG 3.49Å; S279-L283 PolarHBondContact O-N 3.17Å; A280-L283 WeakPolarHBondContact O-CB 3.44Å; A280-L283 PolarHBondContact O-N 3.12Å; L283-L285 VanDerWaalsContact C-N 3.26Å; L283-L285 PolarHBondContact O-N 3.49Å; L283-G287 WeakPolarHBondContact O-CA 3.3Å; L283-G287 PolarHBondContact O-N 3.22Å; L283-W288 HydrophobicContact CD1-CH2 3.91Å; L283-W288 HydrophobicContact CD1-CZ2 3.98Å; L283-W288 HydrophobicContact CD1-CZ3 4.35Å; L283-W288 HydrophobicContact CD2-CD2 3.66Å; L283-W288 HydrophobicContact CD2-CE3 3.72Å; L283-W288 HydrophobicContact CD2-CG 4.2Å; L283-W288 HydrophobicContact CD2-CH2 4.24Å; L283-W288 HydrophobicContact CD2-CZ2 4.17Å; L283-W288 HydrophobicContact CD2-CZ3 4.03Å; L283-V291 HydrophobicContact CD2-CG2 3.46Å; L283-V291 VanDerWaalsContact CD2-CG2 3.46Å; L283-V291 HydrophobicContact CG-CG2 4.45Å; L283-L300 HydrophobicContact CD1-CD2 4.22Å; L283-I334 HydrophobicContact CD1-CB 4.44Å; L283-I334 HydrophobicContact CD1-CG1 3.97Å; L283-I334 HydrophobicContact CD1-CG2 4.42Å; L283-A337 HydrophobicContact CD1-CB 4.42Å
284	D	89.2	Confident	91.7	Very high	65 Å²	65	24.1 Å²	24.1	35%	0.348	15%	0.148	S	C	.	.	H	α-helix	trans	-64.4	-28.7	177.6	-77.9	-27.3	0	0	0	114.1	A280 C281 L282 R333	A280-D284 PolarHBondContact O-N 2.95Å; A280-D284 VanDerWaalsContact O-N 3.1Å; C281-D284 PolarHBondContact O-N 3.02Å; L282-D284 VanDerWaalsContact C-N 3.32Å; D284-R333 IonicContact OD1-CZ 3.48Å; D284-R333 IonicContact OD1-NE 2.6Å; D284-R333 PolarHBondContact OD1-NE 2.88Å; D284-R333 IonicContact OD1-NH2 3.65Å; D284-R333 PolarHBondContact OD1-NH2 3.28Å; D284-R333 IonicContact OD2-NE 2.95Å
285	L	89.3	Confident	91.4	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-77.8	-45.3	179.5	-60.9	-172.8	0	0	0	112.8	L236 P237 A242 Q243 C281 L282 L283	L236-L285 HydrophobicContact CB-CD1 4.35Å; L236-L285 HydrophobicContact CD1-CD1 4.44Å; L236-L285 HydrophobicContact CD2-CD1 3.91Å; L236-L285 HydrophobicContact CG-CD1 4.44Å; P237-L285 WeakPolarHBondContact O-CD2 3.23Å; A242-L285 HydrophobicContact CB-CB 4.33Å; A242-L285 HydrophobicContact CB-CD2 3.72Å; A242-L285 HydrophobicContact CB-CG 4.39Å; Q243-L285 PolarHBondContact NE2-O 3.21Å; C281-L285 WeakPolarHBondContact O-CG 3.45Å; C281-L285 PolarHBondContact O-N 2.98Å; L282-L285 PolarHBondContact O-N 2.77Å; L283-L285 VanDerWaalsContact C-N 3.26Å; L283-L285 PolarHBondContact O-N 3.49Å
286	Y	89.1	Confident	91.2	Very high	21 Å²	21	32.3 Å²	32.3	8%	0.082	17%	0.174	C	C	.	.	H	α-helix	trans	-137.8	11.7	-167.8	-60.4	-60	0	0	0	114.9	A242 S245 L248 R249 V252 L282	A242-Y286 PolarHBondContact O-OH 3.16Å; S245-Y286 PolarHBondContact O-OH 3.05Å; L248-Y286 WeakPolarHBondContact CB-OH 3.48Å; L248-Y286 WeakPolarHBondContact CD2-OH 3.4Å; L248-Y286 HydrophobicContact CG-CE2 4.1Å; L248-Y286 VanDerWaalsContact CG-OH 3.25Å; L248-Y286 WeakPolarHBondContact CG-OH 3.42Å; R249-Y286 HydrophobicContact CB-CD1 4.24Å; R249-Y286 HydrophobicContact CB-CE1 3.84Å; R249-Y286 HydrophobicContact CB-CE2 4.2Å; R249-Y286 HydrophobicContact CG-CD1 4.02Å; R249-Y286 HydrophobicContact CG-CE1 4.14Å; R249-Y286 HydrophobicContact CG-CG 4.23Å; R249-Y286 PolarHBondContact N-OH 3.01Å; V252-Y286 HydrophobicContact CB-CD2 3.8Å; V252-Y286 HydrophobicContact CB-CE2 3.94Å; V252-Y286 HydrophobicContact CG1-CD2 3.83Å; V252-Y286 HydrophobicContact CG1-CE2 4.44Å; V252-Y286 HydrophobicContact CG2-CD2 3.92Å; V252-Y286 HydrophobicContact CG2-CE2 3.68Å; L282-Y286 PolarHBondContact O-N 3.44Å
287	G	88.5	Confident	90.9	Very high	28 Å²	28	32.3 Å²	32.3	29%	0.289	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	-155.2	178	0	0	0	0	0	113.8	L283 E289	L283-G287 WeakPolarHBondContact O-CA 3.3Å; L283-G287 PolarHBondContact O-N 3.22Å; G287-E289 PolarHBondContact O-N 3.34Å
288	W	89.3	Confident	90.7	Very high	9 Å²	9	32.6 Å²	32.6	3%	0.034	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-13.1	-170.9	-69	100.1	0	0	0	115.4	L283 S290 V291 C297 L300 V301 I334 A337 A338 Q341 L356	L283-W288 HydrophobicContact CD1-CH2 3.91Å; L283-W288 HydrophobicContact CD1-CZ2 3.98Å; L283-W288 HydrophobicContact CD1-CZ3 4.35Å; L283-W288 HydrophobicContact CD2-CD2 3.66Å; L283-W288 HydrophobicContact CD2-CE3 3.72Å; L283-W288 HydrophobicContact CD2-CG 4.2Å; L283-W288 HydrophobicContact CD2-CH2 4.24Å; L283-W288 HydrophobicContact CD2-CZ2 4.17Å; L283-W288 HydrophobicContact CD2-CZ3 4.03Å; W288-S290 PolarHBondContact O-N 3.05Å; W288-V291 HydrophobicContact CE3-CB 4.4Å; W288-V291 HydrophobicContact CE3-CG1 4.32Å; W288-V291 HydrophobicContact CE3-CG2 4.16Å; W288-V291 HydrophobicContact CZ3-CG1 4.43Å; W288-V291 PolarHBondContact O-N 2.99Å; W288-C297 HydrophobicContact CE3-CB 4.03Å; W288-C297 HydrophobicContact CZ3-CB 3.94Å; W288-L300 HydrophobicContact CH2-CD2 4.43Å; W288-L300 HydrophobicContact CZ3-CD2 4.11Å; W288-V301 HydrophobicContact CH2-CG2 3.83Å; W288-I334 HydrophobicContact CH2-CG2 4.39Å; W288-A337 HydrophobicContact CZ2-CB 3.92Å; W288-A337 PolarHBondContact NE1-O 3.38Å; W288-A338 HydrophobicContact CH2-CB 4.4Å; W288-A338 HydrophobicContact CZ2-CB 3.91Å; W288-Q341 HydrophobicContact CG-CG 4.38Å; W288-L356 HydrophobicContact CD2-CD1 3.27Å; W288-L356 HydrophobicContact CD2-CG 4.14Å; W288-L356 HydrophobicContact CE3-CD1 3.6Å; W288-L356 HydrophobicContact CE3-CG 4.16Å; W288-L356 HydrophobicContact CG-CD1 3.73Å; W288-L356 HydrophobicContact CG-CG 4.44Å; W288-L356 HydrophobicContact CH2-CD1 3.98Å; W288-L356 HydrophobicContact CZ2-CD1 3.69Å; W288-L356 HydrophobicContact CZ3-CD1 3.93Å
289	E	84.4	Confident	90.6	Very high	139 Å²	139	34.9 Å²	34.9	65%	0.65	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-42.3	-170.6	-171.1	177.3	-171.4	0	0	112.5	G287	G287-E289 PolarHBondContact O-N 3.34Å
290	S	86.9	Confident	90.5	Very high	31 Å²	31	35 Å²	35	22%	0.217	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-9.4	-176	-64.6	0	0	0	0	114.4	W256 W288	W256-S290 VanDerWaalsContact CB-O 3.26Å; W256-S290 WeakPolarHBondContact CB-O 3.15Å; W288-S290 PolarHBondContact O-N 3.05Å
291	V	91.6	Very high	90.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-39.4	-172.3	174.8	0	0	0	0	111.3	W256 L283 W288 F296 L300	W256-V291 HydrophobicContact CD2-CB 4.39Å; W256-V291 HydrophobicContact CD2-CG2 4.09Å; W256-V291 HydrophobicContact CE3-CG1 4.26Å; W256-V291 HydrophobicContact CE3-CG2 4.46Å; W256-V291 HydrophobicContact CH2-CG1 4.26Å; W256-V291 HydrophobicContact CH2-CG2 3.92Å; W256-V291 HydrophobicContact CZ2-CG2 3.51Å; W256-V291 HydrophobicContact CZ3-CG1 4.09Å; W256-V291 HydrophobicContact CZ3-CG2 4.39Å; L283-V291 HydrophobicContact CD2-CG2 3.46Å; L283-V291 VanDerWaalsContact CD2-CG2 3.46Å; L283-V291 HydrophobicContact CG-CG2 4.45Å; W288-V291 HydrophobicContact CE3-CB 4.4Å; W288-V291 HydrophobicContact CE3-CG1 4.32Å; W288-V291 HydrophobicContact CE3-CG2 4.16Å; W288-V291 HydrophobicContact CZ3-CG1 4.43Å; W288-V291 PolarHBondContact O-N 2.99Å; V291-F296 HydrophobicContact CG1-CD1 3.77Å; V291-F296 HydrophobicContact CG1-CE1 3.76Å; V291-F296 WeakPolarHBondContact O-CD1 3.25Å; V291-L300 HydrophobicContact CG1-CD2 4.24Å
292	G	88.1	Confident	90.5	Very high	17 Å²	17	35.9 Å²	35.9	18%	0.175	19%	0.191	C	C	.	.			trans	126.8	-154.2	174.5	0	0	0	0	0	113.9	A355	G292-A355 WeakPolarHBondContact O-CB 3.38Å
293	P	88.7	Confident	90.6	Very high	76 Å²	76	39.3 Å²	39.3	49%	0.494	20%	0.203	S	C	.	.			trans	-67	155	-172.2	28.2	-34.6	0	0	0	112	R295 F296 C297	P293-R295 PolarHBondContact O-N 3.05Å; P293-R295 VanDerWaalsContact O-N 3.12Å; P293-F296 HydrophobicContact CG-CB 3.98Å; P293-F296 WeakPolarHBondContact O-CA 3.37Å; P293-F296 WeakPolarHBondContact O-CB 3.41Å; P293-F296 PolarHBondContact O-N 3.2Å; P293-C297 PolarHBondContact O-N 3.31Å; P293-C297 VanDerWaalsContact O-N 3.1Å
294	A	85.9	Confident	90.8	Very high	20 Å²	20	39 Å²	39	17%	0.165	20%	0.202	C	C	.	.	H	α-helix	trans	-50.5	-42	-178	0	0	0	0	0	113.4	F296 C297 C298 A355 L359	A294-F296 VanDerWaalsContact C-N 3.29Å; A294-F296 PolarHBondContact O-N 2.67Å; A294-C297 WeakPolarHBondContact O-CB 3.4Å; A294-C297 PolarHBondContact O-N 2.98Å; A294-C297 VanDerWaalsContact O-N 3.16Å; A294-C298 PolarHBondContact O-N 3.4Å; A294-C298 PolarHBondContact O-SG 3.44Å; A294-C298 VanDerWaalsContact O-SG 3.36Å; A294-A355 WeakPolarHBondContact CB-O 3.5Å; A294-L359 HydrophobicContact CB-CD2 3.72Å
295	R	88	Confident	91.2	Very high	202 Å²	202	35.9 Å²	35.9	76%	0.762	19%	0.185	S	C	*	.	H	α-helix	trans	-59.1	-37.6	176	-69.4	-176.9	-179.6	-178.3	0.4	113.3	P293 L299	P293-R295 PolarHBondContact O-N 3.05Å; P293-R295 VanDerWaalsContact O-N 3.12Å; R295-L299 PolarHBondContact O-N 3.05Å; R295-L299 VanDerWaalsContact O-N 3.16Å
296	F	91.9	Very high	91.5	Very high	5 Å²	5	38 Å²	38	2%	0.022	20%	0.198	C	C	.	.	H	α-helix	trans	-74	-37.5	177.2	179.5	-96.9	0	0	0	111.2	W256 R260 L263 Q264 V291 P293 A294 C298 L299 L300	W256-F296 HydrophobicContact CE3-CE1 4.39Å; W256-F296 HydrophobicContact CZ3-CE1 4.29Å; R260-F296 HydrophobicContact CB-CD2 4.39Å; R260-F296 HydrophobicContact CB-CE2 3.97Å; R260-F296 HydrophobicContact CB-CZ 4.1Å; R260-F296 HydrophobicContact CG-CD1 3.86Å; R260-F296 HydrophobicContact CG-CD2 4Å; R260-F296 HydrophobicContact CG-CE1 3.59Å; R260-F296 HydrophobicContact CG-CE2 3.73Å; R260-F296 HydrophobicContact CG-CG 4.07Å; R260-F296 HydrophobicContact CG-CZ 3.52Å; L263-F296 HydrophobicContact CB-CE2 3.99Å; L263-F296 HydrophobicContact CB-CZ 4.09Å; L263-F296 HydrophobicContact CD1-CE2 4.41Å; L263-F296 HydrophobicContact CD1-CZ 3.67Å; Q264-F296 HydrophobicContact CG-CD2 4.35Å; Q264-F296 HydrophobicContact CG-CE2 4.34Å; V291-F296 HydrophobicContact CG1-CD1 3.77Å; V291-F296 HydrophobicContact CG1-CE1 3.76Å; V291-F296 WeakPolarHBondContact O-CD1 3.25Å; P293-F296 HydrophobicContact CG-CB 3.98Å; P293-F296 WeakPolarHBondContact O-CA 3.37Å; P293-F296 WeakPolarHBondContact O-CB 3.41Å; P293-F296 PolarHBondContact O-N 3.2Å; A294-F296 VanDerWaalsContact C-N 3.29Å; A294-F296 PolarHBondContact O-N 2.67Å; F296-C298 VanDerWaalsContact C-N 3.33Å; F296-C298 PolarHBondContact O-N 2.91Å; F296-L299 HydrophobicContact CD2-CD2 4.23Å; F296-L299 HydrophobicContact CE2-CD2 4.35Å; F296-L299 WeakPolarHBondContact O-CB 3.44Å; F296-L299 PolarHBondContact O-N 2.85Å; F296-L299 VanDerWaalsContact O-N 3.12Å; F296-L300 PolarHBondContact O-N 3.25Å
297	C	92.3	Very high	91.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.7	-44.7	173.4	-57.1	0	0	0	0	111	W288 P293 A294 L299 L300 V301 L356	W288-C297 HydrophobicContact CE3-CB 4.03Å; W288-C297 HydrophobicContact CZ3-CB 3.94Å; P293-C297 PolarHBondContact O-N 3.31Å; P293-C297 VanDerWaalsContact O-N 3.1Å; A294-C297 WeakPolarHBondContact O-CB 3.4Å; A294-C297 PolarHBondContact O-N 2.98Å; A294-C297 VanDerWaalsContact O-N 3.16Å; C297-L299 VanDerWaalsContact C-N 3.32Å; C297-L299 PolarHBondContact O-N 3.36Å; C297-L300 PolarHBondContact O-N 2.9Å; C297-V301 WeakPolarHBondContact O-CG2 3.37Å; C297-V301 PolarHBondContact O-N 3.38Å; C297-V301 VanDerWaalsContact O-N 3.07Å; C297-L356 HydrophobicContact CB-CD2 3.51Å; C297-L356 HydrophobicContact CB-CG 3.89Å
298	C	91.5	Very high	92.1	Very high	18 Å²	18	37 Å²	37	12%	0.122	19%	0.187	C	C	.	.	H	α-helix	trans	-59.1	-40.3	172.8	-63.7	0	0	0	0	112.9	A294 F296 L300 V301 N302 L359 V367	A294-C298 PolarHBondContact O-N 3.4Å; A294-C298 PolarHBondContact O-SG 3.44Å; A294-C298 VanDerWaalsContact O-SG 3.36Å; F296-C298 VanDerWaalsContact C-N 3.33Å; F296-C298 PolarHBondContact O-N 2.91Å; C298-L300 VanDerWaalsContact C-N 3.35Å; C298-V301 PolarHBondContact O-N 2.82Å; C298-N302 VanDerWaalsContact O-CB 3.27Å; C298-N302 WeakPolarHBondContact O-CB 3.38Å; C298-N302 PolarHBondContact O-N 2.88Å; C298-L359 WeakPolarHBondContact SG-CD2 3.46Å; C298-V367 HydrophobicContact CB-CG2 4.08Å
299	L	93.6	Very high	92.3	Very high	49 Å²	49	39.9 Å²	39.9	26%	0.257	20%	0.198	S	C	.	.	H	α-helix	trans	-61.8	-43.9	176.4	175.9	66.9	0	0	0	111.1	Q264 R295 F296 C297 N302 R303	Q264-L299 HydrophobicContact CG-CD2 3.77Å; R295-L299 PolarHBondContact O-N 3.05Å; R295-L299 VanDerWaalsContact O-N 3.16Å; F296-L299 HydrophobicContact CD2-CD2 4.23Å; F296-L299 HydrophobicContact CE2-CD2 4.35Å; F296-L299 WeakPolarHBondContact O-CB 3.44Å; F296-L299 PolarHBondContact O-N 2.85Å; F296-L299 VanDerWaalsContact O-N 3.12Å; C297-L299 VanDerWaalsContact C-N 3.32Å; C297-L299 PolarHBondContact O-N 3.36Å; L299-N302 PolarHBondContact O-N 3.29Å; L299-R303 HydrophobicContact CD1-CG 4.28Å; L299-R303 HydrophobicContact CG-CG 4.46Å; L299-R303 VanDerWaalsContact O-CG 3.31Å; L299-R303 WeakPolarHBondContact O-CG 3.45Å; L299-R303 PolarHBondContact O-N 3.03Å
300	L	95.8	Very high	92.6	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-61.1	-46.9	178.6	178.3	60.8	0	0	0	111.4	W256 L263 L276 L283 W288 V291 F296 C297 C298 R303 A304 I334	W256-L300 HydrophobicContact CH2-CD2 3.77Å; W256-L300 HydrophobicContact CZ3-CD2 4.12Å; L263-L300 HydrophobicContact CD1-CD1 3.98Å; L276-L300 HydrophobicContact CD2-CD1 3.87Å; L283-L300 HydrophobicContact CD1-CD2 4.22Å; W288-L300 HydrophobicContact CH2-CD2 4.43Å; W288-L300 HydrophobicContact CZ3-CD2 4.11Å; V291-L300 HydrophobicContact CG1-CD2 4.24Å; F296-L300 PolarHBondContact O-N 3.25Å; C297-L300 PolarHBondContact O-N 2.9Å; C298-L300 VanDerWaalsContact C-N 3.35Å; L300-R303 PolarHBondContact O-N 2.9Å; L300-A304 PolarHBondContact O-N 3.14Å; L300-I334 HydrophobicContact CD1-CD1 4.07Å; L300-I334 HydrophobicContact CG-CD1 4.46Å; L300-I334 HydrophobicContact CG-CG2 4.05Å
301	V	95.8	Very high	92.9	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-60.9	-47.3	176.2	178.1	0	0	0	0	110.6	W288 C297 C298 R303 A304 C305 I334 A338 V367 L371	W288-V301 HydrophobicContact CH2-CG2 3.83Å; C297-V301 WeakPolarHBondContact O-CG2 3.37Å; C297-V301 PolarHBondContact O-N 3.38Å; C297-V301 VanDerWaalsContact O-N 3.07Å; C298-V301 PolarHBondContact O-N 2.82Å; V301-R303 VanDerWaalsContact C-N 3.34Å; V301-R303 PolarHBondContact O-N 3.17Å; V301-A304 WeakPolarHBondContact O-CB 3.35Å; V301-A304 PolarHBondContact O-N 2.96Å; V301-A304 VanDerWaalsContact O-N 3.15Å; V301-C305 PolarHBondContact O-N 3.2Å; V301-C305 PolarHBondContact O-SG 2.89Å; V301-I334 HydrophobicContact CG2-CG2 4.38Å; V301-A338 HydrophobicContact CG1-CB 4.38Å; V301-A338 HydrophobicContact CG2-CB 3.66Å; V301-V367 HydrophobicContact CG1-CG1 4.04Å; V301-L371 HydrophobicContact CG1-CD2 4.1Å; V301-L371 HydrophobicContact CG1-CG 4.26Å
302	N	95.3	Very high	92.9	Very high	55 Å²	55	38.5 Å²	38.5	29%	0.294	19%	0.192	S	C	.	.	H	α-helix	trans	-58.5	-44.6	178	-174.5	-10.4	0	0	0	111.8	C298 L299 A304 C305 V306 V370	C298-N302 VanDerWaalsContact O-CB 3.27Å; C298-N302 WeakPolarHBondContact O-CB 3.38Å; C298-N302 PolarHBondContact O-N 2.88Å; L299-N302 PolarHBondContact O-N 3.29Å; N302-A304 PolarHBondContact O-N 3.1Å; N302-C305 PolarHBondContact O-N 3.29Å; N302-V306 WeakPolarHBondContact O-CG2 3.48Å; N302-V306 PolarHBondContact O-N 3.43Å; N302-V306 WeakPolarHBondContact OD1-CG2 3.45Å; N302-V370 HydrophobicContact CB-CG1 4.36Å
303	R	95.7	Very high	92.6	Very high	75 Å²	75	42 Å²	42	28%	0.283	20%	0.203	S	C	.	.	H	α-helix	trans	-59.5	-44.2	175.6	-72.7	-61.3	-166	175.9	1	112.2	I272 L276 L299 L300 V301 V306 E307	I272-R303 HydrophobicContact CD1-CB 4.37Å; L276-R303 HydrophobicContact CD2-CB 4.15Å; L299-R303 HydrophobicContact CD1-CG 4.28Å; L299-R303 HydrophobicContact CG-CG 4.46Å; L299-R303 VanDerWaalsContact O-CG 3.31Å; L299-R303 WeakPolarHBondContact O-CG 3.45Å; L299-R303 PolarHBondContact O-N 3.03Å; L300-R303 PolarHBondContact O-N 2.9Å; V301-R303 VanDerWaalsContact C-N 3.34Å; V301-R303 PolarHBondContact O-N 3.17Å; R303-V306 PolarHBondContact O-N 2.93Å; R303-E307 WeakPolarHBondContact O-CG 3.45Å; R303-E307 PolarHBondContact O-N 3.38Å; R303-E307 VanDerWaalsContact O-N 3.16Å
304	A	97.1	Very high	91.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.1	-47.1	176.8	0	0	0	0	0	111.8	L300 V301 N302 V306 E307 V308 C331 I334 M335	L300-A304 PolarHBondContact O-N 3.14Å; V301-A304 WeakPolarHBondContact O-CB 3.35Å; V301-A304 PolarHBondContact O-N 2.96Å; V301-A304 VanDerWaalsContact O-N 3.15Å; N302-A304 PolarHBondContact O-N 3.1Å; A304-V306 PolarHBondContact O-N 3.43Å; A304-E307 PolarHBondContact O-N 3.34Å; A304-V308 WeakPolarHBondContact O-CG2 3.12Å; A304-V308 PolarHBondContact O-N 3.13Å; A304-C331 HydrophobicContact CB-CB 3.9Å; A304-I334 HydrophobicContact CB-CB 3.96Å; A304-I334 HydrophobicContact CB-CD1 4.09Å; A304-I334 HydrophobicContact CB-CG2 3.83Å; A304-M335 HydrophobicContact CB-CG 4.48Å
305	C	97.3	Very high	90.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.5	-42.9	177.5	-68.2	0	0	0	0	113	V301 N302 E307 V308 R309 V370 A374	V301-C305 PolarHBondContact O-N 3.2Å; V301-C305 PolarHBondContact O-SG 2.89Å; N302-C305 PolarHBondContact O-N 3.29Å; C305-E307 PolarHBondContact O-N 3.22Å; C305-V308 PolarHBondContact O-N 3.13Å; C305-R309 WeakPolarHBondContact O-CG 3.36Å; C305-R309 PolarHBondContact O-N 3.38Å; C305-V370 HydrophobicContact CB-CG1 3.34Å; C305-V370 WeakPolarHBondContact CB-O 3.48Å; C305-A374 HydrophobicContact CB-CB 3.77Å
306	V	94.6	Very high	89.6	Confident	49 Å²	49	40.6 Å²	40.6	30%	0.297	21%	0.213	S	C	.	.	H	α-helix	trans	-61.2	-44.7	177.7	169.4	0	0	0	0	110.8	N302 R303 A304 V308 R309 M310	N302-V306 WeakPolarHBondContact O-CG2 3.48Å; N302-V306 PolarHBondContact O-N 3.43Å; N302-V306 WeakPolarHBondContact OD1-CG2 3.45Å; R303-V306 PolarHBondContact O-N 2.93Å; A304-V306 PolarHBondContact O-N 3.43Å; V306-V308 VanDerWaalsContact C-N 3.33Å; V306-V308 PolarHBondContact O-N 2.68Å; V306-R309 PolarHBondContact O-N 3.39Å; V306-M310 HydrophobicContact CG1-CG 4.23Å; V306-M310 WeakPolarHBondContact O-CB 3.03Å; V306-M310 VanDerWaalsContact O-CG 3.25Å; V306-M310 WeakPolarHBondContact O-CG 3.48Å; V306-M310 PolarHBondContact O-N 3.5Å
307	E	95	Very high	88.3	Confident	29 Å²	29	44.3 Å²	44.3	14%	0.136	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-37.1	177.5	-66.1	-57.7	128.2	0	0	112.1	I272 L276 R303 A304 C305 G311 L328	I272-E307 HydrophobicContact CD1-CG 4.15Å; I272-E307 VanDerWaalsContact CG2-CD 3.47Å; I272-E307 HydrophobicContact CG2-CG 4.12Å; I272-E307 WeakPolarHBondContact CG2-OE2 3.44Å; L276-E307 HydrophobicContact CD1-CB 4.23Å; L276-E307 HydrophobicContact CD1-CG 3.6Å; R303-E307 WeakPolarHBondContact O-CG 3.45Å; R303-E307 PolarHBondContact O-N 3.38Å; R303-E307 VanDerWaalsContact O-N 3.16Å; A304-E307 PolarHBondContact O-N 3.34Å; C305-E307 PolarHBondContact O-N 3.22Å; E307-G311 PolarHBondContact O-N 3.49Å; E307-L328 WeakPolarHBondContact O-CD2 3.5Å
308	V	96.1	Very high	87.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-47.3	174.2	168.7	0	0	0	0	111.9	A304 C305 V306 G311 L312 L328 C331 Y332 M335 A374 V378	A304-V308 WeakPolarHBondContact O-CG2 3.12Å; A304-V308 PolarHBondContact O-N 3.13Å; C305-V308 PolarHBondContact O-N 3.13Å; V306-V308 VanDerWaalsContact C-N 3.33Å; V306-V308 PolarHBondContact O-N 2.68Å; V308-G311 PolarHBondContact O-N 3.38Å; V308-L312 HydrophobicContact CG1-CD1 3.83Å; V308-L312 WeakPolarHBondContact O-CB 3.37Å; V308-L312 WeakPolarHBondContact O-CG 3.39Å; V308-L312 PolarHBondContact O-N 3.02Å; V308-L312 VanDerWaalsContact O-N 3.13Å; V308-L328 HydrophobicContact CB-CD2 4.49Å; V308-L328 HydrophobicContact CG2-CD2 4.15Å; V308-C331 HydrophobicContact CG2-CB 3.53Å; V308-Y332 HydrophobicContact CB-CE1 4.5Å; V308-Y332 HydrophobicContact CG1-CE1 3.89Å; V308-Y332 HydrophobicContact CG2-CD1 3.91Å; V308-Y332 HydrophobicContact CG2-CE1 3.75Å; V308-M335 HydrophobicContact CB-SD 4.43Å; V308-M335 HydrophobicContact CG2-SD 3.83Å; V308-A374 HydrophobicContact CB-CB 4.24Å; V308-A374 HydrophobicContact CG1-CB 4.06Å; V308-V378 HydrophobicContact CG1-CG2 3.81Å
309	R	93.8	Very high	86.8	Confident	70 Å²	70	52.6 Å²	52.6	26%	0.264	30%	0.295	S	S	.	.	H	α-helix	trans	-61.4	-53.5	177.3	-68	175.2	62.7	-163.5	4.5	111.6	C305 V306 G311 L312 E313 E373 A374 A377	C305-R309 WeakPolarHBondContact O-CG 3.36Å; C305-R309 PolarHBondContact O-N 3.38Å; V306-R309 PolarHBondContact O-N 3.39Å; R309-G311 PolarHBondContact O-N 3.29Å; R309-L312 PolarHBondContact O-N 2.64Å; R309-E313 IonicContact NE-OE1 3.16Å; R309-E313 PolarHBondContact NE-OE1 3.26Å; R309-E313 VanDerWaalsContact O-CB 3.28Å; R309-E313 WeakPolarHBondContact O-CB 3.46Å; R309-E313 VanDerWaalsContact O-CG 3.25Å; R309-E313 WeakPolarHBondContact O-CG 3.19Å; R309-E313 PolarHBondContact O-N 2.89Å; R309-E373 IonicContact CZ-OE2 3.65Å; R309-E373 IonicContact NH1-OE2 2.83Å; R309-E373 PolarHBondContact NH1-OE2 2.74Å; R309-E373 IonicContact NH2-OE2 2.75Å; R309-A374 HydrophobicContact CG-CB 4.19Å; R309-A377 HydrophobicContact CB-CB 4.42Å; R309-A377 HydrophobicContact CG-CB 4.2Å
310	M	90.7	Very high	86.5	Confident	126 Å²	126	50.8 Å²	50.8	62%	0.621	29%	0.287	S	S	*	.	H	α-helix	trans	-62.6	-31.9	-177.7	-67	-56.7	-51.4	0	0	112.7	V306	V306-M310 HydrophobicContact CG1-CG 4.23Å; V306-M310 WeakPolarHBondContact O-CB 3.03Å; V306-M310 VanDerWaalsContact O-CG 3.25Å; V306-M310 WeakPolarHBondContact O-CG 3.48Å; V306-M310 PolarHBondContact O-N 3.5Å
311	G	91.6	Very high	86.2	Confident	8 Å²	8	53.3 Å²	53.3	8%	0.082	30%	0.304	C	S	.	.	H	α-helix	trans	-84.3	-16.7	-179	0	0	0	0	0	115.3	E307 V308 R309	E307-G311 PolarHBondContact O-N 3.49Å; V308-G311 PolarHBondContact O-N 3.38Å; R309-G311 PolarHBondContact O-N 3.29Å
312	L	92.3	Very high	85.9	Confident	6 Å²	6	57.7 Å²	57.7	3%	0.031	33%	0.332	C	S	.	.	H	α-helix	trans	-115.4	-19.5	-176.5	-64.3	-179	0	0	0	114.4	V308 R309 E314 L328 Y332 A377 V378 Y381 F394	V308-L312 HydrophobicContact CG1-CD1 3.83Å; V308-L312 WeakPolarHBondContact O-CB 3.37Å; V308-L312 WeakPolarHBondContact O-CG 3.39Å; V308-L312 PolarHBondContact O-N 3.02Å; V308-L312 VanDerWaalsContact O-N 3.13Å; R309-L312 PolarHBondContact O-N 2.64Å; L312-E314 PolarHBondContact O-N 3.37Å; L312-L328 HydrophobicContact CD2-CD1 3.7Å; L312-L328 HydrophobicContact CG-CD1 4.04Å; L312-Y332 HydrophobicContact CD1-CE1 4.47Å; L312-Y332 WeakPolarHBondContact CD1-OH 3.36Å; L312-A377 HydrophobicContact CB-CB 4.18Å; L312-V378 HydrophobicContact CD1-CB 4.4Å; L312-V378 HydrophobicContact CD1-CG2 3.74Å; L312-Y381 HydrophobicContact CD2-CD1 4.39Å; L312-Y381 HydrophobicContact CD2-CD2 4.01Å; L312-Y381 HydrophobicContact CD2-CG 3.9Å; L312-F394 HydrophobicContact CD2-CE1 4.23Å; L312-F394 HydrophobicContact CD2-CZ 4.06Å
313	E	81.3	Confident	85.6	Confident	91 Å²	91	61.2 Å²	61.2	43%	0.425	35%	0.347	S	S	.	.			trans	-79.4	13.1	177.1	-68.4	174.4	-174.7	0	0	112.9	R309 A377	R309-E313 IonicContact NE-OE1 3.16Å; R309-E313 PolarHBondContact NE-OE1 3.26Å; R309-E313 VanDerWaalsContact O-CB 3.28Å; R309-E313 WeakPolarHBondContact O-CB 3.46Å; R309-E313 VanDerWaalsContact O-CG 3.25Å; R309-E313 WeakPolarHBondContact O-CG 3.19Å; R309-E313 PolarHBondContact O-N 2.89Å; E313-A377 HydrophobicContact CG-CB 3.75Å
314	E	72.9	Confident	85.4	Confident	74 Å²	74	59.6 Å²	59.6	35%	0.346	34%	0.344	S	S	.	.	S	Bend	trans	-69.3	149.3	173.6	-70.3	-159.8	164.2	0	0	111.7	L312 N318	L312-E314 PolarHBondContact O-N 3.37Å; E314-N318 PolarHBondContact OE2-ND2 3.47Å
315	P	66.2	Low	85.2	Confident	94 Å²	94	61.7 Å²	61.7	61%	0.61	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-62.1	152.2	-177.5	24.5	-33.7	0	0	0	112.5	G317 N318	P315-G317 PolarHBondContact O-N 2.88Å; P315-N318 PolarHBondContact O-N 2.72Å
316	P	62.1	Low	84.8	Confident	101 Å²	101	66.2 Å²	66.2	66%	0.656	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	134.5	-177.8	15.4	-28.6	0	0	0	112.4	Q384	P316-Q384 VanDerWaalsContact CB-OE1 3.3Å
317	G	64.3	Low	84.8	Confident	83 Å²	83	64.6 Å²	64.6	86%	0.856	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.7	-1.1	178.6	0	0	0	0	0	115.4	P315	P315-G317 PolarHBondContact O-N 2.88Å
318	N	73.2	Confident	84.9	Confident	100 Å²	100	63.2 Å²	63.2	54%	0.535	36%	0.362	S	S	.	.			trans	-102.5	96.5	168.1	-154.4	25.8	0	0	0	110.2	E314 P315	E314-N318 PolarHBondContact OE2-ND2 3.47Å; P315-N318 PolarHBondContact O-N 2.72Å
319	D	78.7	Confident	84.8	Confident	92 Å²	92	66 Å²	66	49%	0.492	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-70.6	137.4	176.1	-82.1	-45.8	0	0	0	111	S321 R389	D319-S321 PolarHBondContact O-N 3.25Å; D319-R389 IonicContact OD1-CZ 2.64Å; D319-R389 IonicContact OD1-NH1 2.62Å; D319-R389 PolarHBondContact OD1-NH1 3.19Å; D319-R389 IonicContact OD1-NH2 3.83Å; D319-R389 PolarHBondContact OD1-NH2 2.9Å; D319-R389 IonicContact OD2-NH1 2.89Å
320	P	86.3	Confident	84.8	Confident	11 Å²	11	63 Å²	63	7%	0.071	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-61.3	135.8	178.5	23.3	-31.4	0	0	0	110.2	L324 Q325 F394	P320-L324 HydrophobicContact CB-CB 4.36Å; P320-L324 HydrophobicContact CB-CD2 3.79Å; P320-L324 HydrophobicContact CB-CG 4.07Å; P320-Q325 HydrophobicContact CB-CG 3.94Å; P320-Q325 HydrophobicContact CG-CG 3.79Å; P320-Q325 PolarHBondContact O-NE2 3.16Å; P320-F394 HydrophobicContact CG-CD1 4.07Å; P320-F394 HydrophobicContact CG-CE1 3.6Å; P320-F394 HydrophobicContact CG-CZ 4.2Å
321	S	90	Very high	85.1	Confident	54 Å²	54	57 Å²	57	38%	0.378	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-61	156.1	177.4	90.4	0	0	0	0	111.2	D319 E323 L324 Q325	D319-S321 PolarHBondContact O-N 3.25Å; S321-E323 WeakPolarHBondContact CB-OE2 3.43Å; S321-E323 PolarHBondContact O-N 3.4Å; S321-E323 VanDerWaalsContact O-N 3.14Å; S321-E323 PolarHBondContact OG-N 2.89Å; S321-E323 PolarHBondContact OG-OE2 3.41Å; S321-L324 CarbonylContact O-C 3.58Å; S321-L324 WeakPolarHBondContact O-CA 3.47Å; S321-L324 WeakPolarHBondContact O-CB 3.45Å; S321-L324 PolarHBondContact O-N 3.28Å; S321-L324 PolarHBondContact OG-N 3.32Å; S321-Q325 WeakPolarHBondContact O-CG 3.46Å; S321-Q325 PolarHBondContact O-N 3.33Å
322	P	89.1	Confident	85.4	Confident	93 Å²	93	56.9 Å²	56.9	60%	0.604	34%	0.338	S	S	*	.	H	α-helix	trans	-54.6	-35	178.6	-26.9	35.3	0	0	0	113.9	N326	P322-N326 WeakPolarHBondContact O-CB 3.49Å; P322-N326 PolarHBondContact O-N 3Å
323	E	88.8	Confident	85.5	Confident	130 Å²	130	59 Å²	59	61%	0.607	35%	0.345	S	S	*	.	H	α-helix	trans	-68.7	-39.4	176.2	-57.9	76.9	-165.8	0	0	112.2	S321 T327	S321-E323 WeakPolarHBondContact CB-OE2 3.43Å; S321-E323 PolarHBondContact O-N 3.4Å; S321-E323 VanDerWaalsContact O-N 3.14Å; S321-E323 PolarHBondContact OG-N 2.89Å; S321-E323 PolarHBondContact OG-OE2 3.41Å; E323-T327 PolarHBondContact O-N 2.95Å; E323-T327 PolarHBondContact O-OG1 3.35Å
324	L	91.8	Very high	86.2	Confident	41 Å²	41	54.7 Å²	54.7	22%	0.215	33%	0.325	C	S	.	.	H	α-helix	trans	-68.5	-46.2	174.9	179.3	58.4	0	0	0	110.3	P320 S321 N326 T327 L328	P320-L324 HydrophobicContact CB-CB 4.36Å; P320-L324 HydrophobicContact CB-CD2 3.79Å; P320-L324 HydrophobicContact CB-CG 4.07Å; S321-L324 CarbonylContact O-C 3.58Å; S321-L324 WeakPolarHBondContact O-CA 3.47Å; S321-L324 WeakPolarHBondContact O-CB 3.45Å; S321-L324 PolarHBondContact O-N 3.28Å; S321-L324 PolarHBondContact OG-N 3.32Å; L324-N326 VanDerWaalsContact C-N 3.29Å; L324-N326 PolarHBondContact O-N 3.43Å; L324-T327 CarbonylContact O-C 3.54Å; L324-T327 WeakPolarHBondContact O-CA 3.49Å; L324-T327 WeakPolarHBondContact O-CB 3.34Å; L324-T327 PolarHBondContact O-N 3.17Å; L324-L328 HydrophobicContact CD1-CD1 4.24Å; L324-L328 HydrophobicContact CD1-CD2 4.18Å; L324-L328 HydrophobicContact CD1-CG 3.91Å; L324-L328 HydrophobicContact CG-CD1 4.02Å; L324-L328 HydrophobicContact CG-CG 4.13Å; L324-L328 WeakPolarHBondContact O-CB 3.44Å; L324-L328 VanDerWaalsContact O-CG 3.31Å; L324-L328 WeakPolarHBondContact O-CG 3.45Å; L324-L328 PolarHBondContact O-N 3.05Å
325	Q	92.6	Very high	87.2	Confident	44 Å²	44	51.2 Å²	51.2	21%	0.206	31%	0.309	C	S	.	.	H	α-helix	trans	-54.6	-44.6	175.3	-69.4	-178.4	6.3	0	0	112.2	P320 S321 T327 L328 T329 F394	P320-Q325 HydrophobicContact CB-CG 3.94Å; P320-Q325 HydrophobicContact CG-CG 3.79Å; P320-Q325 PolarHBondContact O-NE2 3.16Å; S321-Q325 WeakPolarHBondContact O-CG 3.46Å; S321-Q325 PolarHBondContact O-N 3.33Å; Q325-T327 VanDerWaalsContact C-N 3.34Å; Q325-T327 PolarHBondContact O-N 2.96Å; Q325-L328 PolarHBondContact O-N 3.15Å; Q325-T329 WeakPolarHBondContact O-CB 3.12Å; Q325-T329 PolarHBondContact O-N 3.18Å; Q325-T329 PolarHBondContact O-OG1 3.26Å; Q325-F394 HydrophobicContact CB-CD2 3.57Å; Q325-F394 HydrophobicContact CB-CE2 3.94Å; Q325-F394 HydrophobicContact CB-CG 4.01Å; Q325-F394 HydrophobicContact CG-CB 4.21Å; Q325-F394 HydrophobicContact CG-CD1 3.94Å; Q325-F394 HydrophobicContact CG-CD2 3.69Å; Q325-F394 HydrophobicContact CG-CE1 4.26Å; Q325-F394 HydrophobicContact CG-CE2 4.04Å; Q325-F394 HydrophobicContact CG-CG 3.64Å; Q325-F394 HydrophobicContact CG-CZ 4.31Å
326	N	90.3	Very high	88.4	Confident	95 Å²	95	47.1 Å²	47.1	51%	0.508	28%	0.282	S	S	.	.	H	α-helix	trans	-63.4	-39.8	175.6	-178.8	68	0	0	0	112.1	P322 L324 G330	P322-N326 WeakPolarHBondContact O-CB 3.49Å; P322-N326 PolarHBondContact O-N 3Å; L324-N326 VanDerWaalsContact C-N 3.29Å; L324-N326 PolarHBondContact O-N 3.43Å; N326-G330 PolarHBondContact O-N 3.41Å; N326-G330 VanDerWaalsContact O-N 3.14Å
327	T	94.1	Very high	89.7	Confident	15 Å²	15	42.5 Å²	42.5	9%	0.092	25%	0.252	C	S	.	.	H	α-helix	trans	-62.7	-50.4	174.9	-62.1	0	0	0	0	111.4	G273 E323 L324 Q325 T329 G330 C331	G273-T327 VanDerWaalsContact CA-CG2 3.43Å; G273-T327 WeakPolarHBondContact CA-OG1 3.49Å; E323-T327 PolarHBondContact O-N 2.95Å; E323-T327 PolarHBondContact O-OG1 3.35Å; L324-T327 CarbonylContact O-C 3.54Å; L324-T327 WeakPolarHBondContact O-CA 3.49Å; L324-T327 WeakPolarHBondContact O-CB 3.34Å; L324-T327 PolarHBondContact O-N 3.17Å; Q325-T327 VanDerWaalsContact C-N 3.34Å; Q325-T327 PolarHBondContact O-N 2.96Å; T327-T329 VanDerWaalsContact C-N 3.31Å; T327-T329 PolarHBondContact O-N 3.45Å; T327-G330 WeakPolarHBondContact O-CA 3.36Å; T327-G330 PolarHBondContact O-N 3.1Å; T327-G330 VanDerWaalsContact O-N 3.09Å; T327-C331 PolarHBondContact O-N 3.15Å; T327-C331 PolarHBondContact O-SG 3.4Å
328	L	96	Very high	90.8	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-39.3	179.8	-67.4	-174.3	0	0	0	111.9	E307 V308 L312 L324 Q325 G330 C331 Y332 F394	E307-L328 WeakPolarHBondContact O-CD2 3.5Å; V308-L328 HydrophobicContact CB-CD2 4.49Å; V308-L328 HydrophobicContact CG2-CD2 4.15Å; L312-L328 HydrophobicContact CD2-CD1 3.7Å; L312-L328 HydrophobicContact CG-CD1 4.04Å; L324-L328 HydrophobicContact CD1-CD1 4.24Å; L324-L328 HydrophobicContact CD1-CD2 4.18Å; L324-L328 HydrophobicContact CD1-CG 3.91Å; L324-L328 HydrophobicContact CG-CD1 4.02Å; L324-L328 HydrophobicContact CG-CG 4.13Å; L324-L328 WeakPolarHBondContact O-CB 3.44Å; L324-L328 VanDerWaalsContact O-CG 3.31Å; L324-L328 WeakPolarHBondContact O-CG 3.45Å; L324-L328 PolarHBondContact O-N 3.05Å; Q325-L328 PolarHBondContact O-N 3.15Å; L328-G330 VanDerWaalsContact C-N 3.33Å; L328-G330 PolarHBondContact O-N 2.91Å; L328-C331 CarbonylContact O-C 3.57Å; L328-C331 WeakPolarHBondContact O-CA 3.37Å; L328-C331 WeakPolarHBondContact O-CB 3.35Å; L328-C331 PolarHBondContact O-N 3.27Å; L328-C331 VanDerWaalsContact O-N 3.09Å; L328-Y332 HydrophobicContact CB-CE2 4.46Å; L328-Y332 WeakPolarHBondContact O-CD2 3.42Å; L328-Y332 VanDerWaalsContact O-CG 3.23Å; L328-Y332 PolarHBondContact O-N 3.24Å; L328-F394 HydrophobicContact CB-CE2 3.9Å; L328-F394 HydrophobicContact CB-CZ 4.16Å; L328-F394 HydrophobicContact CD1-CE2 4.27Å; L328-F394 HydrophobicContact CD1-CZ 3.72Å
329	T	94.4	Very high	91.4	Very high	58 Å²	58	35 Å²	35	36%	0.356	19%	0.193	S	C	.	.	H	α-helix	trans	-61.6	-41.5	174	-55.4	0	0	0	0	111.6	Q325 T327 C331 Y332 R333 A397	Q325-T329 WeakPolarHBondContact O-CB 3.12Å; Q325-T329 PolarHBondContact O-N 3.18Å; Q325-T329 PolarHBondContact O-OG1 3.26Å; T327-T329 VanDerWaalsContact C-N 3.31Å; T327-T329 PolarHBondContact O-N 3.45Å; T329-C331 VanDerWaalsContact C-N 3.34Å; T329-Y332 PolarHBondContact O-N 2.92Å; T329-R333 PolarHBondContact O-N 2.85Å; T329-R333 VanDerWaalsContact O-N 3.14Å; T329-A397 HydrophobicContact CG2-CB 4.28Å
330	G	94.1	Very high	91.6	Very high	8 Å²	8	35 Å²	35	8%	0.082	19%	0.19	C	C	.	.	H	α-helix	trans	-62.1	-40.9	171.5	0	0	0	0	0	112.5	A280 N326 T327 L328 R333 I334	A280-G330 VanDerWaalsContact CB-O 3.28Å; A280-G330 WeakPolarHBondContact CB-O 3.46Å; N326-G330 PolarHBondContact O-N 3.41Å; N326-G330 VanDerWaalsContact O-N 3.14Å; T327-G330 WeakPolarHBondContact O-CA 3.36Å; T327-G330 PolarHBondContact O-N 3.1Å; T327-G330 VanDerWaalsContact O-N 3.09Å; L328-G330 VanDerWaalsContact C-N 3.33Å; L328-G330 PolarHBondContact O-N 2.91Å; G330-R333 PolarHBondContact O-N 3.27Å; G330-I334 WeakPolarHBondContact O-CG1 3.38Å; G330-I334 PolarHBondContact O-N 3.24Å; G330-I334 VanDerWaalsContact O-N 3.11Å
331	C	97.8	Very high	91.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-44.5	175.9	-63.1	0	0	0	0	112.5	L276 A304 V308 T327 L328 T329 R333 I334 M335	L276-C331 VanDerWaalsContact CD1-SG 3.58Å; A304-C331 HydrophobicContact CB-CB 3.9Å; V308-C331 HydrophobicContact CG2-CB 3.53Å; T327-C331 PolarHBondContact O-N 3.15Å; T327-C331 PolarHBondContact O-SG 3.4Å; L328-C331 CarbonylContact O-C 3.57Å; L328-C331 WeakPolarHBondContact O-CA 3.37Å; L328-C331 WeakPolarHBondContact O-CB 3.35Å; L328-C331 PolarHBondContact O-N 3.27Å; L328-C331 VanDerWaalsContact O-N 3.09Å; T329-C331 VanDerWaalsContact C-N 3.34Å; C331-R333 PolarHBondContact O-N 3.35Å; C331-I334 WeakPolarHBondContact O-CB 3.44Å; C331-I334 PolarHBondContact O-N 2.81Å; C331-I334 VanDerWaalsContact O-N 3.14Å; C331-M335 WeakPolarHBondContact O-CG 3.15Å; C331-M335 PolarHBondContact O-N 3.4Å
332	Y	96.7	Very high	90.4	Very high	5 Å²	5	37.3 Å²	37.3	2%	0.02	21%	0.206	C	C	.	.	H	α-helix	trans	-55	-43.9	174.2	-62.2	-28	0	0	0	110.8	V308 L312 L328 T329 I334 M335 E336 V378 F394 A397 T398 A401	V308-Y332 HydrophobicContact CB-CE1 4.5Å; V308-Y332 HydrophobicContact CG1-CE1 3.89Å; V308-Y332 HydrophobicContact CG2-CD1 3.91Å; V308-Y332 HydrophobicContact CG2-CE1 3.75Å; L312-Y332 HydrophobicContact CD1-CE1 4.47Å; L312-Y332 WeakPolarHBondContact CD1-OH 3.36Å; L328-Y332 HydrophobicContact CB-CE2 4.46Å; L328-Y332 WeakPolarHBondContact O-CD2 3.42Å; L328-Y332 VanDerWaalsContact O-CG 3.23Å; L328-Y332 PolarHBondContact O-N 3.24Å; T329-Y332 PolarHBondContact O-N 2.92Å; Y332-I334 PolarHBondContact O-N 3.38Å; Y332-M335 WeakPolarHBondContact O-CB 3.43Å; Y332-M335 PolarHBondContact O-N 3.06Å; Y332-E336 WeakPolarHBondContact O-CG 3.29Å; Y332-E336 PolarHBondContact O-N 3.32Å; Y332-V378 HydrophobicContact CE1-CG2 3.87Å; Y332-F394 HydrophobicContact CE2-CE2 4.08Å; Y332-F394 HydrophobicContact CE2-CZ 4.46Å; Y332-A397 HydrophobicContact CD2-CB 4.45Å; Y332-T398 HydrophobicContact CE2-CG2 4.45Å; Y332-T398 WeakPolarHBondContact CE2-OG1 3.44Å; Y332-T398 PolarHBondContact OH-OG1 3.28Å; Y332-T398 VanDerWaalsContact OH-OG1 3.13Å; Y332-A401 HydrophobicContact CD1-CB 4.04Å; Y332-A401 HydrophobicContact CD2-CB 4.15Å; Y332-A401 HydrophobicContact CG-CB 3.72Å
333	R	94.5	Very high	89.3	Confident	50 Å²	50	35.9 Å²	35.9	19%	0.189	20%	0.198	C	C	.	.	H	α-helix	trans	-65.7	-37.5	179	-176.5	58.5	-164.5	125.5	7.1	113.3	A280 D284 T329 G330 C331 M335 E336 A337 E340	A280-R333 HydrophobicContact CB-CB 4.27Å; A280-R333 HydrophobicContact CB-CG 4.48Å; D284-R333 IonicContact OD1-CZ 3.48Å; D284-R333 IonicContact OD1-NE 2.6Å; D284-R333 PolarHBondContact OD1-NE 2.88Å; D284-R333 IonicContact OD1-NH2 3.65Å; D284-R333 PolarHBondContact OD1-NH2 3.28Å; D284-R333 IonicContact OD2-NE 2.95Å; T329-R333 PolarHBondContact O-N 2.85Å; T329-R333 VanDerWaalsContact O-N 3.14Å; G330-R333 PolarHBondContact O-N 3.27Å; C331-R333 PolarHBondContact O-N 3.35Å; R333-M335 VanDerWaalsContact C-N 3.32Å; R333-E336 IonicContact NH1-OE2 3.08Å; R333-E336 PolarHBondContact O-N 3.04Å; R333-A337 WeakPolarHBondContact O-CB 3.37Å; R333-A337 PolarHBondContact O-N 3.34Å; R333-E340 IonicContact CZ-OE1 3.47Å; R333-E340 IonicContact CZ-OE2 3.33Å; R333-E340 VanDerWaalsContact NH1-CD 3.3Å; R333-E340 IonicContact NH1-OE1 3.62Å; R333-E340 PolarHBondContact NH1-OE1 3.17Å; R333-E340 IonicContact NH1-OE2 3.93Å; R333-E340 PolarHBondContact NH1-OE2 2.96Å; R333-E340 IonicContact NH2-OE2 3.73Å; R333-E340 PolarHBondContact NH2-OE2 3.08Å
334	I	95.7	Very high	88	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-43.3	172.8	-67.7	164.6	0	0	0	110.6	L276 A280 L283 W288 L300 V301 A304 G330 C331 Y332 A338	L276-I334 HydrophobicContact CB-CD1 4.25Å; L276-I334 HydrophobicContact CD2-CD1 4.08Å; A280-I334 HydrophobicContact CB-CD1 4.3Å; A280-I334 HydrophobicContact CB-CG1 3.9Å; L283-I334 HydrophobicContact CD1-CB 4.44Å; L283-I334 HydrophobicContact CD1-CG1 3.97Å; L283-I334 HydrophobicContact CD1-CG2 4.42Å; W288-I334 HydrophobicContact CH2-CG2 4.39Å; L300-I334 HydrophobicContact CD1-CD1 4.07Å; L300-I334 HydrophobicContact CG-CD1 4.46Å; L300-I334 HydrophobicContact CG-CG2 4.05Å; V301-I334 HydrophobicContact CG2-CG2 4.38Å; A304-I334 HydrophobicContact CB-CB 3.96Å; A304-I334 HydrophobicContact CB-CD1 4.09Å; A304-I334 HydrophobicContact CB-CG2 3.83Å; G330-I334 WeakPolarHBondContact O-CG1 3.38Å; G330-I334 PolarHBondContact O-N 3.24Å; G330-I334 VanDerWaalsContact O-N 3.11Å; C331-I334 WeakPolarHBondContact O-CB 3.44Å; C331-I334 PolarHBondContact O-N 2.81Å; C331-I334 VanDerWaalsContact O-N 3.14Å; Y332-I334 PolarHBondContact O-N 3.38Å; I334-A338 PolarHBondContact O-N 3.13Å; I334-A338 VanDerWaalsContact O-N 3.1Å
335	M	94.6	Very high	86.2	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-64.7	-47.3	177.9	-66.2	164.1	58.4	0	0	111.1	A304 V308 C331 Y332 R333 A337 A338 M339 L371 A374 F375	A304-M335 HydrophobicContact CB-CG 4.48Å; V308-M335 HydrophobicContact CB-SD 4.43Å; V308-M335 HydrophobicContact CG2-SD 3.83Å; C331-M335 WeakPolarHBondContact O-CG 3.15Å; C331-M335 PolarHBondContact O-N 3.4Å; Y332-M335 WeakPolarHBondContact O-CB 3.43Å; Y332-M335 PolarHBondContact O-N 3.06Å; R333-M335 VanDerWaalsContact C-N 3.32Å; M335-A337 PolarHBondContact O-N 2.94Å; M335-A338 WeakPolarHBondContact O-CB 3.38Å; M335-A338 PolarHBondContact O-N 3.38Å; M335-A338 VanDerWaalsContact O-N 3.16Å; M335-M339 WeakPolarHBondContact O-CG 3.18Å; M335-M339 PolarHBondContact O-N 3.46Å; M335-M339 VanDerWaalsContact O-N 3.13Å; M335-L371 HydrophobicContact CB-CD2 3.84Å; M335-L371 HydrophobicContact CE-CD2 4.02Å; M335-L371 HydrophobicContact CG-CD2 3.76Å; M335-A374 HydrophobicContact CE-CB 3.68Å; M335-A374 HydrophobicContact SD-CB 4.3Å; M335-F375 HydrophobicContact CE-CD2 3.87Å; M335-F375 HydrophobicContact CE-CE1 4.15Å; M335-F375 HydrophobicContact CE-CE2 3.36Å; M335-F375 HydrophobicContact CE-CG 4.44Å; M335-F375 HydrophobicContact CE-CZ 3.52Å
336	E	91	Very high	83.9	Confident	9 Å²	9	35.4 Å²	35.4	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-54.7	-50.8	173.7	-73.5	-179.2	-175.9	0	0	111.6	Y332 R333 A338 M339 E340 R400 A401 A404	Y332-E336 WeakPolarHBondContact O-CG 3.29Å; Y332-E336 PolarHBondContact O-N 3.32Å; R333-E336 IonicContact NH1-OE2 3.08Å; R333-E336 PolarHBondContact O-N 3.04Å; E336-A338 PolarHBondContact O-N 2.95Å; E336-M339 HydrophobicContact CB-CE 4.41Å; E336-M339 HydrophobicContact CG-CE 4.2Å; E336-M339 WeakPolarHBondContact O-CB 3.31Å; E336-M339 PolarHBondContact O-N 3.19Å; E336-M339 VanDerWaalsContact O-N 3.1Å; E336-E340 WeakPolarHBondContact O-CG 3.32Å; E336-E340 PolarHBondContact O-N 3.1Å; E336-R400 IonicContact OE1-NE 3.02Å; E336-R400 PolarHBondContact OE1-NE 3.35Å; E336-R400 IonicContact OE2-CZ 3.37Å; E336-R400 IonicContact OE2-NE 3.29Å; E336-R400 IonicContact OE2-NH2 3.85Å; E336-R400 PolarHBondContact OE2-NH2 3Å; E336-A401 WeakPolarHBondContact OE1-CA 3.5Å; E336-A404 HydrophobicContact CG-CB 4.06Å
337	A	89	Confident	81.7	Confident	4 Å²	4	38 Å²	38	3%	0.033	24%	0.24	C	C	.	.	H	α-helix	trans	-61.1	-31.6	179.5	0	0	0	0	0	112.6	L283 W288 R333 M335 Q341	L283-A337 HydrophobicContact CD1-CB 4.42Å; W288-A337 HydrophobicContact CZ2-CB 3.92Å; W288-A337 PolarHBondContact NE1-O 3.38Å; R333-A337 WeakPolarHBondContact O-CB 3.37Å; R333-A337 PolarHBondContact O-N 3.34Å; M335-A337 PolarHBondContact O-N 2.94Å; A337-Q341 WeakPolarHBondContact O-CB 3.31Å; A337-Q341 PolarHBondContact O-N 3.01Å
338	A	89	Confident	79.2	Confident	10 Å²	10	44.2 Å²	44.2	8%	0.083	28%	0.278	C	S	.	.	H	α-helix	trans	-71.6	-38.5	177.5	0	0	0	0	0	111.6	W288 V301 I334 M335 E336 A342	W288-A338 HydrophobicContact CH2-CB 4.4Å; W288-A338 HydrophobicContact CZ2-CB 3.91Å; V301-A338 HydrophobicContact CG1-CB 4.38Å; V301-A338 HydrophobicContact CG2-CB 3.66Å; I334-A338 PolarHBondContact O-N 3.13Å; I334-A338 VanDerWaalsContact O-N 3.1Å; M335-A338 WeakPolarHBondContact O-CB 3.38Å; M335-A338 PolarHBondContact O-N 3.38Å; M335-A338 VanDerWaalsContact O-N 3.16Å; E336-A338 PolarHBondContact O-N 2.95Å; A338-A342 PolarHBondContact O-N 2.94Å
339	M	84.8	Confident	76.3	Confident	15 Å²	15	47.9 Å²	47.9	7%	0.074	31%	0.308	C	S	.	.	H	α-helix	trans	-66.8	-50.5	175.4	-66	-176.5	-76.9	0	0	111.7	M335 E336 Q341 A342 C343 F375 A404 W405	M335-M339 WeakPolarHBondContact O-CG 3.18Å; M335-M339 PolarHBondContact O-N 3.46Å; M335-M339 VanDerWaalsContact O-N 3.13Å; E336-M339 HydrophobicContact CB-CE 4.41Å; E336-M339 HydrophobicContact CG-CE 4.2Å; E336-M339 WeakPolarHBondContact O-CB 3.31Å; E336-M339 PolarHBondContact O-N 3.19Å; E336-M339 VanDerWaalsContact O-N 3.1Å; M339-Q341 PolarHBondContact O-N 3.2Å; M339-Q341 VanDerWaalsContact O-N 3.15Å; M339-A342 WeakPolarHBondContact O-CB 3.42Å; M339-A342 PolarHBondContact O-N 2.62Å; M339-C343 PolarHBondContact O-N 3.5Å; M339-C343 VanDerWaalsContact O-N 3.16Å; M339-C343 PolarHBondContact O-SG 2.87Å; M339-F375 HydrophobicContact CE-CE2 4.27Å; M339-F375 HydrophobicContact CE-CZ 3.96Å; M339-F375 HydrophobicContact SD-CE2 4.33Å; M339-A404 HydrophobicContact CE-CB 4.28Å; M339-W405 HydrophobicContact CE-CB 4.24Å; M339-W405 HydrophobicContact CG-CE3 4.31Å; M339-W405 VanDerWaalsContact SD-CA 3.58Å; M339-W405 HydrophobicContact SD-CB 3.87Å; M339-W405 HydrophobicContact SD-CD2 4.17Å; M339-W405 HydrophobicContact SD-CE3 3.39Å; M339-W405 HydrophobicContact SD-CG 4.4Å; M339-W405 HydrophobicContact SD-CZ3 4.25Å
340	E	82.5	Confident	73.7	Confident	93 Å²	93	49.7 Å²	49.7	44%	0.435	32%	0.321	S	S	.	.	H	α-helix	trans	-52.1	-40.7	177.5	-71.4	164.5	-173.9	0	0	111.7	R333 E336 T344	R333-E340 IonicContact CZ-OE1 3.47Å; R333-E340 IonicContact CZ-OE2 3.33Å; R333-E340 VanDerWaalsContact NH1-CD 3.3Å; R333-E340 IonicContact NH1-OE1 3.62Å; R333-E340 PolarHBondContact NH1-OE1 3.17Å; R333-E340 IonicContact NH1-OE2 3.93Å; R333-E340 PolarHBondContact NH1-OE2 2.96Å; R333-E340 IonicContact NH2-OE2 3.73Å; R333-E340 PolarHBondContact NH2-OE2 3.08Å; E336-E340 WeakPolarHBondContact O-CG 3.32Å; E336-E340 PolarHBondContact O-N 3.1Å; E340-T344 WeakPolarHBondContact O-CG2 3.4Å; E340-T344 PolarHBondContact O-N 3.47Å; E340-T344 PolarHBondContact O-OG1 3.44Å
341	Q	78.4	Confident	71.2	Confident	40 Å²	40	55.2 Å²	55.2	19%	0.187	36%	0.356	C	S	.	.	H	α-helix	trans	-73.2	-29.5	179.8	-174.3	57.6	77.9	0	0	113.6	W288 A337 M339 T344 S354 L356	W288-Q341 HydrophobicContact CG-CG 4.38Å; A337-Q341 WeakPolarHBondContact O-CB 3.31Å; A337-Q341 PolarHBondContact O-N 3.01Å; M339-Q341 PolarHBondContact O-N 3.2Å; M339-Q341 VanDerWaalsContact O-N 3.15Å; Q341-T344 WeakPolarHBondContact CA-OG1 3.28Å; Q341-T344 PolarHBondContact O-OG1 3.1Å; Q341-S354 PolarHBondContact NE2-OG 3.06Å; Q341-S354 PolarHBondContact OE1-OG 3.39Å; Q341-L356 HydrophobicContact CB-CD1 4.2Å; Q341-L356 HydrophobicContact CG-CB 3.76Å; Q341-L356 HydrophobicContact CG-CD1 4.03Å
342	A	74	Confident	68.7	Low	72 Å²	72	62.5 Å²	62.5	60%	0.595	39%	0.389	S	S	*	.	H	α-helix	trans	-70.8	-39.2	176.3	0	0	0	0	0	111.1	A338 M339	A338-A342 PolarHBondContact O-N 2.94Å; M339-A342 WeakPolarHBondContact O-CB 3.42Å; M339-A342 PolarHBondContact O-N 2.62Å
343	C	65.6	Low	66.5	Low	63 Å²	63	72.9 Å²	72.9	43%	0.426	43%	0.428	S	S	.	.	H	α-helix	trans	-77	-34.8	-177.6	-56.7	0	0	0	0	113.1	M339 A345 E408	M339-C343 PolarHBondContact O-N 3.5Å; M339-C343 VanDerWaalsContact O-N 3.16Å; M339-C343 PolarHBondContact O-SG 2.87Å; C343-A345 PolarHBondContact O-N 3.29Å; C343-E408 PolarHBondContact SG-OE2 2.98Å
344	T	61.5	Low	64.6	Low	89 Å²	89	71.5 Å²	71.5	55%	0.546	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-9.6	179.5	46.4	0	0	0	0	114.9	E340 Q341 G346	E340-T344 WeakPolarHBondContact O-CG2 3.4Å; E340-T344 PolarHBondContact O-N 3.47Å; E340-T344 PolarHBondContact O-OG1 3.44Å; Q341-T344 WeakPolarHBondContact CA-OG1 3.28Å; Q341-T344 PolarHBondContact O-OG1 3.1Å; T344-G346 PolarHBondContact O-N 3.04Å
345	A	52.8	Low	62.8	Low	60 Å²	60	72.6 Å²	72.6	50%	0.496	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-9.6	178.7	0	0	0	0	0	114	C343	C343-A345 PolarHBondContact O-N 3.29Å
346	G	45.9	Very low	61	Low	56 Å²	56	73.5 Å²	73.5	58%	0.577	44%	0.44	S	S	*	.	S	Bend	trans	-77.8	-47.6	-170.9	0	0	0	0	0	116	T344	T344-G346 PolarHBondContact O-N 3.04Å
347	D	43.1	Very low	59.5	Low	150 Å²	150	75.2 Å²	75.2	80%	0.802	45%	0.454	S	S	*	.	S	Bend	trans	-126	-10	-150	-77.4	-29.7	0	0	0	119.5
348	T	41.5	Very low	58.4	Low	145 Å²	145	78.3 Å²	78.3	89%	0.89	48%	0.479	S	S	*	.			trans	-175.8	30.5	176.2	19.7	0	0	0	0	116.3
349	A	35.7	Very low	57.8	Low	77 Å²	77	79.7 Å²	79.7	64%	0.636	49%	0.485	S	S	*	.			trans	-77.5	139.9	-174.9	0	0	0	0	0	114.2
350	P	40.2	Very low	57.6	Low	97 Å²	97	81.6 Å²	81.6	63%	0.63	50%	0.499	S	S	*	.			trans	-59.8	170.2	168.7	16.7	-19	0	0	0	112	H352	P350-H352 PolarHBondContact O-N 3.29Å
351	P	41.4	Very low	57.5	Low	124 Å²	124	82.4 Å²	82.4	81%	0.805	51%	0.506	S	S	*	.	S	Bend	trans	-65.8	5.4	-167.4	26.5	-35.6	0	0	0	116.5	R353	P351-R353 PolarHBondContact O-N 3.45Å; P351-R353 VanDerWaalsContact O-N 3.17Å
352	H	45.1	Very low	57.8	Low	153 Å²	153	87.9 Å²	87.9	71%	0.708	53%	0.532	S	S	*	.			trans	-86.1	83	175.7	-68.8	-78.3	0	0	0	110.5	P350 S354	P350-H352 PolarHBondContact O-N 3.29Å; H352-S354 PolarHBondContact O-N 3.25Å
353	R	50.4	Low	58.2	Low	222 Å²	222	86.5 Å²	86.5	84%	0.838	51%	0.513	S	S	*	.			trans	-63.3	115.6	170.4	-67.9	-176	179.9	-179.3	-1.1	109.7	P351	P351-R353 PolarHBondContact O-N 3.45Å; P351-R353 VanDerWaalsContact O-N 3.17Å
354	S	53.9	Low	59.1	Low	21 Å²	21	86.1 Å²	86.1	15%	0.147	51%	0.511	C	S	.	.			trans	-68.4	156.5	172.5	76.4	0	0	0	0	111	Q341 H352 L356 S357	Q341-S354 PolarHBondContact NE2-OG 3.06Å; Q341-S354 PolarHBondContact OE1-OG 3.39Å; H352-S354 PolarHBondContact O-N 3.25Å; S354-L356 PolarHBondContact O-N 2.82Å; S354-L356 VanDerWaalsContact O-N 3.17Å; S354-S357 PolarHBondContact N-OG 3.36Å; S354-S357 PolarHBondContact O-N 3.48Å; S354-S357 VanDerWaalsContact O-N 3.1Å; S354-S357 PolarHBondContact O-OG 3.11Å
355	A	57.7	Low	60.2	Low	23 Å²	23	89.3 Å²	89.3	19%	0.19	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-28.4	-175.5	0	0	0	0	0	114.7	G292 A294	G292-A355 WeakPolarHBondContact O-CB 3.38Å; A294-A355 WeakPolarHBondContact CB-O 3.5Å
356	L	58.2	Low	61.9	Low	20 Å²	20	91.4 Å²	91.4	11%	0.105	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-28.6	176.8	-75.3	174.2	0	0	0	113.1	W288 C297 Q341 S354 A358 L359	W288-L356 HydrophobicContact CD2-CD1 3.27Å; W288-L356 HydrophobicContact CD2-CG 4.14Å; W288-L356 HydrophobicContact CE3-CD1 3.6Å; W288-L356 HydrophobicContact CE3-CG 4.16Å; W288-L356 HydrophobicContact CG-CD1 3.73Å; W288-L356 HydrophobicContact CG-CG 4.44Å; W288-L356 HydrophobicContact CH2-CD1 3.98Å; W288-L356 HydrophobicContact CZ2-CD1 3.69Å; W288-L356 HydrophobicContact CZ3-CD1 3.93Å; C297-L356 HydrophobicContact CB-CD2 3.51Å; C297-L356 HydrophobicContact CB-CG 3.89Å; Q341-L356 HydrophobicContact CB-CD1 4.2Å; Q341-L356 HydrophobicContact CG-CB 3.76Å; Q341-L356 HydrophobicContact CG-CD1 4.03Å; S354-L356 PolarHBondContact O-N 2.82Å; S354-L356 VanDerWaalsContact O-N 3.17Å; L356-A358 PolarHBondContact O-N 3.02Å; L356-L359 HydrophobicContact CB-CD1 4.48Å; L356-L359 HydrophobicContact CD2-CD1 3.71Å; L356-L359 HydrophobicContact CD2-CG 4.37Å; L356-L359 WeakPolarHBondContact O-CD1 3.37Å; L356-L359 WeakPolarHBondContact O-CG 3.44Å; L356-L359 PolarHBondContact O-N 2.95Å
357	S	59.2	Low	63.9	Low	46 Å²	46	89.9 Å²	89.9	32%	0.322	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-13.3	174.2	70	0	0	0	0	113.4	S354	S354-S357 PolarHBondContact N-OG 3.36Å; S354-S357 PolarHBondContact O-N 3.48Å; S354-S357 VanDerWaalsContact O-N 3.1Å; S354-S357 PolarHBondContact O-OG 3.11Å
358	A	65.6	Low	66.1	Low	68 Å²	68	85.9 Å²	85.9	56%	0.562	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	13.1	178.8	0	0	0	0	0	113.9	L356	L356-A358 PolarHBondContact O-N 3.02Å
359	L	75.4	Confident	68.5	Low	40 Å²	40	84.5 Å²	84.5	21%	0.209	45%	0.454	C	S	.	.			trans	-66.6	143.4	179	-72.3	172.5	0	0	0	112.1	A294 C298 L356 Q363	A294-L359 HydrophobicContact CB-CD2 3.72Å; C298-L359 WeakPolarHBondContact SG-CD2 3.46Å; L356-L359 HydrophobicContact CB-CD1 4.48Å; L356-L359 HydrophobicContact CD2-CD1 3.71Å; L356-L359 HydrophobicContact CD2-CG 4.37Å; L356-L359 WeakPolarHBondContact O-CD1 3.37Å; L356-L359 WeakPolarHBondContact O-CG 3.44Å; L356-L359 PolarHBondContact O-N 2.95Å; L359-Q363 HydrophobicContact CB-CB 4.34Å; L359-Q363 HydrophobicContact CD2-CB 3.88Å
360	S	80.9	Confident	71.2	Confident	54 Å²	54	81.7 Å²	81.7	38%	0.378	43%	0.429	S	S	.	.			trans	-70.4	155.4	167.3	82.2	0	0	0	0	110.5	Q362 Q363 S364	S360-Q362 PolarHBondContact O-N 2.98Å; S360-Q363 WeakPolarHBondContact O-CB 3.39Å; S360-Q363 PolarHBondContact O-N 3.05Å; S360-Q363 WeakPolarHBondContact OG-CG 3.12Å; S360-Q363 PolarHBondContact OG-N 3.18Å; S360-Q363 PolarHBondContact OG-OE1 2.89Å; S360-S364 PolarHBondContact O-N 3.44Å
361	L	81.5	Confident	73.8	Confident	111 Å²	111	77.5 Å²	77.5	58%	0.581	40%	0.401	S	S	*	.	H	α-helix	trans	-55.7	-37.4	177.3	-174.7	147.2	0	0	0	112.1	S364 R365	L361-S364 WeakPolarHBondContact CA-OG 3.45Å; L361-S364 PolarHBondContact O-N 3.37Å; L361-S364 PolarHBondContact O-OG 2.94Å; L361-R365 HydrophobicContact CD2-CG 4.5Å; L361-R365 VanDerWaalsContact CD2-CZ 3.42Å; L361-R365 WeakPolarHBondContact O-CG 3.49Å; L361-R365 PolarHBondContact O-N 3.23Å; L361-R365 VanDerWaalsContact O-N 3.1Å
362	Q	83.6	Confident	76.4	Confident	154 Å²	154	74.8 Å²	74.8	72%	0.72	38%	0.378	S	S	*	.	H	α-helix	trans	-63.3	-42	174.6	-175.5	-179.2	-8	0	0	112.2	S360 R365 Q366	S360-Q362 PolarHBondContact O-N 2.98Å; Q362-R365 PolarHBondContact O-N 3.37Å; Q362-Q366 PolarHBondContact O-N 3.48Å; Q362-Q366 VanDerWaalsContact O-N 3.15Å
363	Q	83.1	Confident	78.8	Confident	43 Å²	43	71.7 Å²	71.7	20%	0.201	36%	0.363	C	S	.	.	H	α-helix	trans	-68.4	-38.3	178	-66.4	173.6	-59.4	0	0	111.7	L359 S360 R365 Q366 V367	L359-Q363 HydrophobicContact CB-CB 4.34Å; L359-Q363 HydrophobicContact CD2-CB 3.88Å; S360-Q363 WeakPolarHBondContact O-CB 3.39Å; S360-Q363 PolarHBondContact O-N 3.05Å; S360-Q363 WeakPolarHBondContact OG-CG 3.12Å; S360-Q363 PolarHBondContact OG-N 3.18Å; S360-Q363 PolarHBondContact OG-OE1 2.89Å; Q363-R365 VanDerWaalsContact C-N 3.34Å; Q363-R365 PolarHBondContact O-N 3.11Å; Q363-Q366 PolarHBondContact O-N 3.1Å; Q363-V367 WeakPolarHBondContact O-CG2 3.47Å; Q363-V367 PolarHBondContact O-N 3.39Å
364	S	83.8	Confident	81	Confident	55 Å²	55	61.1 Å²	61.1	39%	0.385	32%	0.323	S	S	.	.	H	α-helix	trans	-61.1	-42.2	175.8	69.2	0	0	0	0	112.1	S360 L361 V367 L368	S360-S364 PolarHBondContact O-N 3.44Å; L361-S364 WeakPolarHBondContact CA-OG 3.45Å; L361-S364 PolarHBondContact O-N 3.37Å; L361-S364 PolarHBondContact O-OG 2.94Å; S364-V367 PolarHBondContact O-N 3.44Å; S364-L368 PolarHBondContact O-N 3.2Å
365	R	85.3	Confident	83	Confident	156 Å²	156	60.1 Å²	60.1	59%	0.589	32%	0.316	S	S	*	.	H	α-helix	trans	-62.6	-44.6	175.7	-73.6	178.8	176.4	175	-1.1	112.2	L361 Q362 Q363 V367 L368 E369	L361-R365 HydrophobicContact CD2-CG 4.5Å; L361-R365 VanDerWaalsContact CD2-CZ 3.42Å; L361-R365 WeakPolarHBondContact O-CG 3.49Å; L361-R365 PolarHBondContact O-N 3.23Å; L361-R365 VanDerWaalsContact O-N 3.1Å; Q362-R365 PolarHBondContact O-N 3.37Å; Q363-R365 VanDerWaalsContact C-N 3.34Å; Q363-R365 PolarHBondContact O-N 3.11Å; R365-V367 VanDerWaalsContact C-N 3.32Å; R365-V367 PolarHBondContact O-N 3.5Å; R365-L368 WeakPolarHBondContact O-CB 3.31Å; R365-L368 PolarHBondContact O-N 3.17Å; R365-E369 WeakPolarHBondContact O-CG 3.31Å; R365-E369 PolarHBondContact O-N 3.12Å
366	Q	87.8	Confident	84.8	Confident	104 Å²	104	61.2 Å²	61.2	49%	0.486	32%	0.322	S	S	.	.	H	α-helix	trans	-62.6	-39.5	177.8	-173.8	178.6	11.7	0	0	112.2	Q362 Q363 V370	Q362-Q366 PolarHBondContact O-N 3.48Å; Q362-Q366 VanDerWaalsContact O-N 3.15Å; Q363-Q366 PolarHBondContact O-N 3.1Å; Q366-V370 WeakPolarHBondContact O-CG2 3.34Å; Q366-V370 PolarHBondContact O-N 3.13Å
367	V	88.5	Confident	86.6	Confident	24 Å²	24	60.3 Å²	60.3	15%	0.145	32%	0.318	C	S	.	.	H	α-helix	trans	-64.9	-43	175.4	170.9	0	0	0	0	110.7	C298 V301 Q363 S364 R365 V370 L371	C298-V367 HydrophobicContact CB-CG2 4.08Å; V301-V367 HydrophobicContact CG1-CG1 4.04Å; Q363-V367 WeakPolarHBondContact O-CG2 3.47Å; Q363-V367 PolarHBondContact O-N 3.39Å; S364-V367 PolarHBondContact O-N 3.44Å; R365-V367 VanDerWaalsContact C-N 3.32Å; R365-V367 PolarHBondContact O-N 3.5Å; V367-V370 PolarHBondContact O-N 2.95Å; V367-L371 HydrophobicContact CG1-CD1 3.7Å; V367-L371 HydrophobicContact CG1-CG 4.38Å; V367-L371 WeakPolarHBondContact O-CB 3.46Å; V367-L371 WeakPolarHBondContact O-CG 3.26Å; V367-L371 PolarHBondContact O-N 3.36Å
368	L	89	Confident	88.4	Confident	66 Å²	66	58.1 Å²	58.1	35%	0.346	30%	0.302	S	S	.	.	H	α-helix	trans	-60.7	-45.4	176.8	-171.2	75.3	0	0	0	112.1	S364 R365 V370 L371 Q372 W405	S364-L368 PolarHBondContact O-N 3.2Å; R365-L368 WeakPolarHBondContact O-CB 3.31Å; R365-L368 PolarHBondContact O-N 3.17Å; L368-V370 VanDerWaalsContact C-N 3.34Å; L368-V370 PolarHBondContact O-N 3.34Å; L368-L371 PolarHBondContact O-N 3.37Å; L368-Q372 WeakPolarHBondContact O-CB 3.35Å; L368-Q372 PolarHBondContact O-N 3.11Å; L368-W405 HydrophobicContact CD1-CH2 3.54Å; L368-W405 HydrophobicContact CD1-CZ2 4.38Å; L368-W405 HydrophobicContact CD1-CZ3 4.24Å; L368-W405 HydrophobicContact CG-CH2 4.44Å
369	E	91.6	Very high	89.8	Confident	116 Å²	116	55 Å²	55	54%	0.542	28%	0.277	S	S	.	.	H	α-helix	trans	-57.1	-46.7	177.3	-75.2	169.1	-174	0	0	111.5	R365 Q372 E373	R365-E369 WeakPolarHBondContact O-CG 3.31Å; R365-E369 PolarHBondContact O-N 3.12Å; E369-Q372 WeakPolarHBondContact O-CB 3.24Å; E369-Q372 PolarHBondContact O-N 3.41Å; E369-E373 WeakPolarHBondContact O-CG 3.45Å; E369-E373 PolarHBondContact O-N 2.66Å
370	V	94	Very high	90.7	Very high	19 Å²	19	57.1 Å²	57.1	12%	0.115	28%	0.284	C	S	.	.	H	α-helix	trans	-73.1	-31.9	-177.9	178.3	0	0	0	0	112.1	N302 C305 Q366 V367 L368 A374	N302-V370 HydrophobicContact CB-CG1 4.36Å; C305-V370 HydrophobicContact CB-CG1 3.34Å; C305-V370 WeakPolarHBondContact CB-O 3.48Å; Q366-V370 WeakPolarHBondContact O-CG2 3.34Å; Q366-V370 PolarHBondContact O-N 3.13Å; V367-V370 PolarHBondContact O-N 2.95Å; L368-V370 VanDerWaalsContact C-N 3.34Å; L368-V370 PolarHBondContact O-N 3.34Å; V370-A374 PolarHBondContact O-N 2.83Å
371	L	94.6	Very high	91.3	Very high	9 Å²	9	55.3 Å²	55.3	5%	0.047	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-43.5	170.1	-74.2	163.5	0	0	0	111.2	V301 M335 V367 L368 E373 A374 F375 W405	V301-L371 HydrophobicContact CG1-CD2 4.1Å; V301-L371 HydrophobicContact CG1-CG 4.26Å; M335-L371 HydrophobicContact CB-CD2 3.84Å; M335-L371 HydrophobicContact CE-CD2 4.02Å; M335-L371 HydrophobicContact CG-CD2 3.76Å; V367-L371 HydrophobicContact CG1-CD1 3.7Å; V367-L371 HydrophobicContact CG1-CG 4.38Å; V367-L371 WeakPolarHBondContact O-CB 3.46Å; V367-L371 WeakPolarHBondContact O-CG 3.26Å; V367-L371 PolarHBondContact O-N 3.36Å; L368-L371 PolarHBondContact O-N 3.37Å; L371-E373 VanDerWaalsContact C-N 3.32Å; L371-E373 PolarHBondContact O-N 2.72Å; L371-A374 PolarHBondContact O-N 3.39Å; L371-A374 VanDerWaalsContact O-N 3.12Å; L371-F375 HydrophobicContact CD2-CE2 4.34Å; L371-F375 VanDerWaalsContact O-CD2 3.27Å; L371-F375 WeakPolarHBondContact O-CD2 3.47Å; L371-F375 PolarHBondContact O-N 2.94Å; L371-W405 HydrophobicContact CB-CE3 4.27Å; L371-W405 HydrophobicContact CB-CH2 3.83Å; L371-W405 HydrophobicContact CB-CZ3 3.44Å; L371-W405 VanDerWaalsContact CB-CZ3 3.44Å; L371-W405 HydrophobicContact CD1-CZ3 3.91Å; L371-W405 HydrophobicContact CG-CZ3 4.18Å
372	Q	94.9	Very high	92	Very high	67 Å²	67	50 Å²	50	31%	0.313	24%	0.242	S	C	.	.	H	α-helix	trans	-57.9	-45.4	177	-177.2	-178.3	-26.7	0	0	111.2	L368 E369 A374 F375 S376 C412 L413	L368-Q372 WeakPolarHBondContact O-CB 3.35Å; L368-Q372 PolarHBondContact O-N 3.11Å; E369-Q372 WeakPolarHBondContact O-CB 3.24Å; E369-Q372 PolarHBondContact O-N 3.41Å; Q372-A374 VanDerWaalsContact C-N 3.32Å; Q372-A374 PolarHBondContact O-N 2.85Å; Q372-F375 PolarHBondContact O-N 3.44Å; Q372-S376 PolarHBondContact O-N 3.22Å; Q372-C412 HydrophobicContact CG-CB 4.27Å; Q372-C412 PolarHBondContact OE1-SG 3.44Å; Q372-L413 HydrophobicContact CG-CD1 4.01Å; Q372-L413 HydrophobicContact CG-CD2 3.94Å; Q372-L413 HydrophobicContact CG-CG 3.8Å
373	E	95.1	Very high	92.4	Very high	87 Å²	87	47.2 Å²	47.2	41%	0.407	23%	0.228	S	C	.	.	H	α-helix	trans	-61.7	-39.6	176.6	-67.6	177	170.7	0	0	112	R309 E369 L371 S376 A377	R309-E373 IonicContact CZ-OE2 3.65Å; R309-E373 IonicContact NH1-OE2 2.83Å; R309-E373 PolarHBondContact NH1-OE2 2.74Å; R309-E373 IonicContact NH2-OE2 2.75Å; E369-E373 WeakPolarHBondContact O-CG 3.45Å; E369-E373 PolarHBondContact O-N 2.66Å; L371-E373 VanDerWaalsContact C-N 3.32Å; L371-E373 PolarHBondContact O-N 2.72Å; E373-S376 WeakPolarHBondContact O-CB 3.46Å; E373-S376 PolarHBondContact O-N 3.19Å; E373-A377 PolarHBondContact O-N 3.29Å
374	A	96.9	Very high	92.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-41	175.8	0	0	0	0	0	113.2	C305 V308 R309 M335 V370 L371 Q372 S376 A377 V378	C305-A374 HydrophobicContact CB-CB 3.77Å; V308-A374 HydrophobicContact CB-CB 4.24Å; V308-A374 HydrophobicContact CG1-CB 4.06Å; R309-A374 HydrophobicContact CG-CB 4.19Å; M335-A374 HydrophobicContact CE-CB 3.68Å; M335-A374 HydrophobicContact SD-CB 4.3Å; V370-A374 PolarHBondContact O-N 2.83Å; L371-A374 PolarHBondContact O-N 3.39Å; L371-A374 VanDerWaalsContact O-N 3.12Å; Q372-A374 VanDerWaalsContact C-N 3.32Å; Q372-A374 PolarHBondContact O-N 2.85Å; A374-S376 VanDerWaalsContact C-N 3.31Å; A374-S376 PolarHBondContact O-N 2.99Å; A374-A377 WeakPolarHBondContact O-CB 3.43Å; A374-A377 PolarHBondContact O-N 2.94Å; A374-V378 WeakPolarHBondContact O-CG2 3.45Å; A374-V378 PolarHBondContact O-N 2.91Å
375	F	96.6	Very high	93.2	Very high	1 Å²	1	46.3 Å²	46.3	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-70.9	-26.9	176.7	-80	-67.1	0	0	0	113	M335 M339 L371 Q372 A377 V378 I379 A401 L402 W405 L413	M335-F375 HydrophobicContact CE-CD2 3.87Å; M335-F375 HydrophobicContact CE-CE1 4.15Å; M335-F375 HydrophobicContact CE-CE2 3.36Å; M335-F375 HydrophobicContact CE-CG 4.44Å; M335-F375 HydrophobicContact CE-CZ 3.52Å; M339-F375 HydrophobicContact CE-CE2 4.27Å; M339-F375 HydrophobicContact CE-CZ 3.96Å; M339-F375 HydrophobicContact SD-CE2 4.33Å; L371-F375 HydrophobicContact CD2-CE2 4.34Å; L371-F375 VanDerWaalsContact O-CD2 3.27Å; L371-F375 WeakPolarHBondContact O-CD2 3.47Å; L371-F375 PolarHBondContact O-N 2.94Å; Q372-F375 PolarHBondContact O-N 3.44Å; F375-A377 VanDerWaalsContact C-N 3.34Å; F375-V378 HydrophobicContact CD1-CB 4.24Å; F375-V378 HydrophobicContact CD1-CG1 4.36Å; F375-V378 HydrophobicContact CD1-CG2 4.33Å; F375-V378 PolarHBondContact O-N 3.37Å; F375-I379 VanDerWaalsContact O-CG1 3.28Å; F375-I379 WeakPolarHBondContact O-CG1 3.32Å; F375-I379 PolarHBondContact O-N 3.26Å; F375-A401 VanDerWaalsContact CE1-O 3.32Å; F375-A401 WeakPolarHBondContact CE1-O 3.42Å; F375-L402 HydrophobicContact CD1-CD1 3.9Å; F375-W405 HydrophobicContact CD1-CB 3.99Å; F375-W405 HydrophobicContact CD1-CG 4.15Å; F375-W405 HydrophobicContact CD2-CB 3.96Å; F375-W405 AromaticContact CD2-CD2 3.33Å; F375-W405 HydrophobicContact CD2-CD2 3.33Å; F375-W405 AromaticContact CD2-CE2 3.99Å; F375-W405 AromaticContact CD2-CE3 3.38Å; F375-W405 HydrophobicContact CD2-CE3 3.38Å; F375-W405 AromaticContact CD2-CG 3.58Å; F375-W405 HydrophobicContact CD2-CG 3.58Å; F375-W405 HydrophobicContact CD2-CZ3 4.09Å; F375-W405 HydrophobicContact CE1-CB 3.65Å; F375-W405 HydrophobicContact CE1-CG 4.24Å; F375-W405 HydrophobicContact CE2-CB 3.61Å; F375-W405 AromaticContact CE2-CD2 3.53Å; F375-W405 HydrophobicContact CE2-CD2 3.53Å; F375-W405 AromaticContact CE2-CE3 3.25Å; F375-W405 HydrophobicContact CE2-CE3 3.25Å; F375-W405 AromaticContact CE2-CG 3.68Å; F375-W405 HydrophobicContact CE2-CG 3.68Å; F375-W405 HydrophobicContact CE2-CZ3 4.15Å; F375-W405 HydrophobicContact CG-CB 4.15Å; F375-W405 HydrophobicContact CG-CD2 4.01Å; F375-W405 HydrophobicContact CG-CE3 4.46Å; F375-W405 AromaticContact CG-CG 3.83Å; F375-W405 HydrophobicContact CG-CG 3.83Å; F375-W405 HydrophobicContact CZ-CB 3.44Å; F375-W405 VanDerWaalsContact CZ-CB 3.44Å; F375-W405 HydrophobicContact CZ-CD2 4.33Å; F375-W405 HydrophobicContact CZ-CE3 4.26Å; F375-W405 HydrophobicContact CZ-CG 4.03Å; F375-L413 HydrophobicContact CB-CD1 4.23Å
376	S	95.9	Very high	93.4	Very high	45 Å²	45	45.2 Å²	45.2	32%	0.315	22%	0.22	S	C	.	.	H	α-helix	trans	-59.3	-45.5	168.2	-172.7	0	0	0	0	111.4	Q372 E373 A374 V378 I379 F380	Q372-S376 PolarHBondContact O-N 3.22Å; E373-S376 WeakPolarHBondContact O-CB 3.46Å; E373-S376 PolarHBondContact O-N 3.19Å; A374-S376 VanDerWaalsContact C-N 3.31Å; A374-S376 PolarHBondContact O-N 2.99Å; S376-V378 PolarHBondContact O-N 2.92Å; S376-I379 PolarHBondContact O-N 3.2Å; S376-F380 WeakPolarHBondContact O-CB 3.48Å; S376-F380 PolarHBondContact O-N 3.45Å
377	A	95.7	Very high	93.4	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-64.8	-37.5	174.9	0	0	0	0	0	112.9	R309 L312 E313 E373 A374 F375 F380 Y381	R309-A377 HydrophobicContact CB-CB 4.42Å; R309-A377 HydrophobicContact CG-CB 4.2Å; L312-A377 HydrophobicContact CB-CB 4.18Å; E313-A377 HydrophobicContact CG-CB 3.75Å; E373-A377 PolarHBondContact O-N 3.29Å; A374-A377 WeakPolarHBondContact O-CB 3.43Å; A374-A377 PolarHBondContact O-N 2.94Å; F375-A377 VanDerWaalsContact C-N 3.34Å; A377-F380 PolarHBondContact O-N 2.99Å; A377-Y381 PolarHBondContact O-N 3.34Å
378	V	96.4	Very high	93.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-46.5	173.2	166.9	0	0	0	0	111.5	V308 L312 Y332 A374 F375 S376 Y381 L382 T398 L402	V308-V378 HydrophobicContact CG1-CG2 3.81Å; L312-V378 HydrophobicContact CD1-CB 4.4Å; L312-V378 HydrophobicContact CD1-CG2 3.74Å; Y332-V378 HydrophobicContact CE1-CG2 3.87Å; A374-V378 WeakPolarHBondContact O-CG2 3.45Å; A374-V378 PolarHBondContact O-N 2.91Å; F375-V378 HydrophobicContact CD1-CB 4.24Å; F375-V378 HydrophobicContact CD1-CG1 4.36Å; F375-V378 HydrophobicContact CD1-CG2 4.33Å; F375-V378 PolarHBondContact O-N 3.37Å; S376-V378 PolarHBondContact O-N 2.92Å; V378-Y381 PolarHBondContact O-N 2.98Å; V378-L382 HydrophobicContact CG1-CD1 4.04Å; V378-L382 WeakPolarHBondContact O-CG 3.38Å; V378-L382 PolarHBondContact O-N 2.95Å; V378-T398 HydrophobicContact CB-CG2 4.48Å; V378-T398 HydrophobicContact CG1-CG2 3.67Å; V378-T398 HydrophobicContact CG2-CG2 4.47Å; V378-L402 HydrophobicContact CG1-CB 3.89Å; V378-L402 HydrophobicContact CG1-CD1 4.48Å
379	I	95.8	Very high	93.4	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-47.1	176.5	-69.5	166.8	0	0	0	109.9	F375 S376 Y381 L382 Q383 L402 L413 E416 V417 L420	F375-I379 VanDerWaalsContact O-CG1 3.28Å; F375-I379 WeakPolarHBondContact O-CG1 3.32Å; F375-I379 PolarHBondContact O-N 3.26Å; S376-I379 PolarHBondContact O-N 3.2Å; I379-Y381 VanDerWaalsContact C-N 3.32Å; I379-Y381 PolarHBondContact O-N 3.26Å; I379-L382 PolarHBondContact O-N 2.83Å; I379-Q383 HydrophobicContact CG2-CG 4.34Å; I379-Q383 VanDerWaalsContact O-CG 3.31Å; I379-Q383 WeakPolarHBondContact O-CG 3.22Å; I379-Q383 PolarHBondContact O-N 2.69Å; I379-L402 HydrophobicContact CD1-CD1 4.34Å; I379-L402 HydrophobicContact CG1-CD1 3.93Å; I379-L402 HydrophobicContact CG1-CD2 4.1Å; I379-L413 HydrophobicContact CD1-CB 4.31Å; I379-L413 HydrophobicContact CD1-CD1 3.96Å; I379-E416 HydrophobicContact CD1-CB 4.25Å; I379-E416 HydrophobicContact CG2-CB 4.13Å; I379-V417 HydrophobicContact CD1-CG2 3.77Å; I379-L420 HydrophobicContact CB-CD2 4.35Å; I379-L420 HydrophobicContact CG1-CD2 4.05Å; I379-L420 HydrophobicContact CG2-CB 4.27Å; I379-L420 HydrophobicContact CG2-CD2 4.08Å
380	F	93.8	Very high	93.3	Very high	83 Å²	83	43.6 Å²	43.6	36%	0.364	22%	0.219	S	C	.	.	H	α-helix	trans	-56.8	-44.1	177.8	177.1	-103.6	0	0	0	112.4	S376 A377 Q384	S376-F380 WeakPolarHBondContact O-CB 3.48Å; S376-F380 PolarHBondContact O-N 3.45Å; A377-F380 PolarHBondContact O-N 2.99Å; F380-Q384 VanDerWaalsContact CD1-NE2 3.27Å; F380-Q384 PolarHBondContact O-NE2 3.36Å
381	Y	94.5	Very high	92.8	Very high	17 Å²	17	47.2 Å²	47.2	7%	0.067	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-49.3	175.2	171	-98.7	0	0	0	111.8	L312 A377 V378 I379 Q383 Q384 V385 R389 F394 V395 T398	L312-Y381 HydrophobicContact CD2-CD1 4.39Å; L312-Y381 HydrophobicContact CD2-CD2 4.01Å; L312-Y381 HydrophobicContact CD2-CG 3.9Å; A377-Y381 PolarHBondContact O-N 3.34Å; V378-Y381 PolarHBondContact O-N 2.98Å; I379-Y381 VanDerWaalsContact C-N 3.32Å; I379-Y381 PolarHBondContact O-N 3.26Å; Y381-Q383 VanDerWaalsContact C-N 3.27Å; Y381-Q383 PolarHBondContact O-N 3.45Å; Y381-Q384 WeakPolarHBondContact O-CB 3.43Å; Y381-Q384 PolarHBondContact O-N 3.12Å; Y381-V385 HydrophobicContact CD1-CG2 4.3Å; Y381-V385 HydrophobicContact CE1-CG2 3.85Å; Y381-R389 PolarHBondContact OH-NH2 3.44Å; Y381-F394 HydrophobicContact CE1-CD1 4.33Å; Y381-F394 HydrophobicContact CE1-CE1 4.01Å; Y381-F394 HydrophobicContact CE2-CE1 4.36Å; Y381-F394 AromaticContact CZ-CE1 3.78Å; Y381-F394 WeakPolarHBondContact OH-CD1 3.44Å; Y381-V395 HydrophobicContact CE1-CG2 4.44Å; Y381-T398 HydrophobicContact CD1-CG2 3.82Å; Y381-T398 HydrophobicContact CE1-CG2 4.23Å
382	L	94.7	Very high	92.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-30.8	-178.3	-70.7	176.1	0	0	0	113	V378 I379 Q384 V385 V395 T398 L402 L420 F423	V378-L382 HydrophobicContact CG1-CD1 4.04Å; V378-L382 WeakPolarHBondContact O-CG 3.38Å; V378-L382 PolarHBondContact O-N 2.95Å; I379-L382 PolarHBondContact O-N 2.83Å; L382-Q384 PolarHBondContact O-N 2.95Å; L382-V385 HydrophobicContact CD2-CG2 4.45Å; L382-V385 PolarHBondContact O-N 3.37Å; L382-V395 HydrophobicContact CD2-CG1 4.39Å; L382-T398 HydrophobicContact CD1-CG2 4.27Å; L382-T398 HydrophobicContact CD2-CG2 3.91Å; L382-T398 HydrophobicContact CG-CG2 3.96Å; L382-L402 HydrophobicContact CD1-CB 4.3Å; L382-L402 HydrophobicContact CD1-CD2 3.64Å; L382-L420 HydrophobicContact CB-CD1 3.97Å; L382-L420 HydrophobicContact CB-CD2 4.4Å; L382-L420 HydrophobicContact CD1-CD2 4.4Å; L382-F423 HydrophobicContact CB-CD1 4.19Å; L382-F423 HydrophobicContact CB-CE1 3.75Å; L382-F423 HydrophobicContact CB-CZ 4.19Å; L382-F423 HydrophobicContact CD1-CE1 4.31Å; L382-F423 HydrophobicContact CD2-CE1 3.88Å; L382-F423 HydrophobicContact CD2-CZ 3.94Å; L382-F423 HydrophobicContact CG-CE1 4.19Å; L382-F423 WeakPolarHBondContact O-CD2 3.48Å; L382-F423 WeakPolarHBondContact O-CE2 3.48Å
383	Q	92.9	Very high	92.1	Very high	94 Å²	94	50.1 Å²	50.1	44%	0.439	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.9	173.5	-75.1	174.7	-13.5	0	0	113.5	I379 Y381 L420	I379-Q383 HydrophobicContact CG2-CG 4.34Å; I379-Q383 VanDerWaalsContact O-CG 3.31Å; I379-Q383 WeakPolarHBondContact O-CG 3.22Å; I379-Q383 PolarHBondContact O-N 2.69Å; Y381-Q383 VanDerWaalsContact C-N 3.27Å; Y381-Q383 PolarHBondContact O-N 3.45Å; Q383-L420 HydrophobicContact CB-CD1 4.42Å; Q383-L420 HydrophobicContact CG-CD1 3.56Å
384	Q	90.5	Very high	91.8	Very high	69 Å²	69	46.2 Å²	46.2	32%	0.322	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-6.4	-177.9	-61.4	169.5	74.2	0	0	112.9	P316 F380 Y381 L382 E386	P316-Q384 VanDerWaalsContact CB-OE1 3.3Å; F380-Q384 VanDerWaalsContact CD1-NE2 3.27Å; F380-Q384 PolarHBondContact O-NE2 3.36Å; Y381-Q384 WeakPolarHBondContact O-CB 3.43Å; Y381-Q384 PolarHBondContact O-N 3.12Å; L382-Q384 PolarHBondContact O-N 2.95Å; Q384-E386 PolarHBondContact O-N 3.42Å
385	V	91.8	Very high	91.6	Very high	11 Å²	11	46.2 Å²	46.2	7%	0.067	25%	0.25	C	S	.	.			trans	-78.5	121.4	-175.9	174.7	0	0	0	0	110.5	Y381 L382 R389 F390 V395 F423	Y381-V385 HydrophobicContact CD1-CG2 4.3Å; Y381-V385 HydrophobicContact CE1-CG2 3.85Å; L382-V385 HydrophobicContact CD2-CG2 4.45Å; L382-V385 PolarHBondContact O-N 3.37Å; V385-R389 HydrophobicContact CG1-CB 4.01Å; V385-F390 HydrophobicContact CG1-CD1 4.21Å; V385-F390 HydrophobicContact CG1-CE1 4.28Å; V385-V395 HydrophobicContact CG1-CG1 3.89Å; V385-V395 HydrophobicContact CG1-CG2 3.95Å; V385-V395 HydrophobicContact CG2-CG2 4.1Å; V385-F423 HydrophobicContact CB-CE2 3.72Å; V385-F423 HydrophobicContact CB-CZ 4.07Å; V385-F423 HydrophobicContact CG1-CE2 3.98Å; V385-F423 HydrophobicContact CG1-CZ 4.26Å
386	E	90.6	Very high	91.3	Very high	132 Å²	132	47.9 Å²	47.9	62%	0.617	26%	0.259	S	S	*	.			trans	-83.8	157.3	175.3	-68.5	-172.7	-177.2	0	0	112.4	Q384 D388 R389 F390	Q384-E386 PolarHBondContact O-N 3.42Å; E386-D388 VanDerWaalsContact C-N 3.29Å; E386-D388 WeakPolarHBondContact CB-OD1 3.49Å; E386-D388 PolarHBondContact O-N 3.17Å; E386-R389 WeakPolarHBondContact O-CB 3.33Å; E386-R389 PolarHBondContact O-N 2.65Å; E386-R389 VanDerWaalsContact O-N 3.08Å; E386-F390 WeakPolarHBondContact O-CD1 3.37Å
387	P	88.6	Confident	91	Very high	94 Å²	94	46.8 Å²	46.8	61%	0.61	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-59.3	-29.4	-175.6	-27.3	36.4	0	0	0	116.2	R389 F390	P387-R389 PolarHBondContact O-N 3.37Å; P387-F390 HydrophobicContact CB-CE1 4.48Å; P387-F390 HydrophobicContact CB-CE2 4.35Å; P387-F390 HydrophobicContact CB-CZ 4.31Å; P387-F390 HydrophobicContact CG-CZ 4.4Å; P387-F390 WeakPolarHBondContact O-CB 3.16Å; P387-F390 WeakPolarHBondContact O-CG 3.22Å; P387-F390 PolarHBondContact O-N 2.77Å; P387-F390 VanDerWaalsContact O-N 3.17Å
388	D	88.3	Confident	91	Very high	118 Å²	118	46.7 Å²	46.7	63%	0.631	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-62.3	-25.6	176.3	64.6	-39.7	0	0	0	112.6	E386	E386-D388 VanDerWaalsContact C-N 3.29Å; E386-D388 WeakPolarHBondContact CB-OD1 3.49Å; E386-D388 PolarHBondContact O-N 3.17Å
389	R	88.1	Confident	90.9	Very high	48 Å²	48	46.7 Å²	46.7	18%	0.181	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-90.2	3	177.8	-64.8	-167.9	61	-173.3	7.4	114.4	D319 Y381 V385 E386 P387 S391 D392	D319-R389 IonicContact OD1-CZ 2.64Å; D319-R389 IonicContact OD1-NH1 2.62Å; D319-R389 PolarHBondContact OD1-NH1 3.19Å; D319-R389 IonicContact OD1-NH2 3.83Å; D319-R389 PolarHBondContact OD1-NH2 2.9Å; D319-R389 IonicContact OD2-NH1 2.89Å; Y381-R389 PolarHBondContact OH-NH2 3.44Å; V385-R389 HydrophobicContact CG1-CB 4.01Å; E386-R389 WeakPolarHBondContact O-CB 3.33Å; E386-R389 PolarHBondContact O-N 2.65Å; E386-R389 VanDerWaalsContact O-N 3.08Å; P387-R389 PolarHBondContact O-N 3.37Å; R389-S391 PolarHBondContact O-N 2.93Å; R389-S391 VanDerWaalsContact O-N 3.1Å; R389-D392 IonicContact CZ-OD2 3.97Å; R389-D392 IonicContact NE-OD2 2.71Å; R389-D392 IonicContact NH2-OD2 3.95Å; R389-D392 PolarHBondContact NH2-OD2 2.91Å; R389-D392 WeakPolarHBondContact O-CB 3.28Å; R389-D392 PolarHBondContact O-N 3.34Å
390	F	88.8	Confident	90.8	Very high	16 Å²	16	50.5 Å²	50.5	7%	0.07	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.2	-176.9	-76.5	8.1	0	0	0	113.9	V385 E386 P387 F423 Y427 C430 H431	V385-F390 HydrophobicContact CG1-CD1 4.21Å; V385-F390 HydrophobicContact CG1-CE1 4.28Å; E386-F390 WeakPolarHBondContact O-CD1 3.37Å; P387-F390 HydrophobicContact CB-CE1 4.48Å; P387-F390 HydrophobicContact CB-CE2 4.35Å; P387-F390 HydrophobicContact CB-CZ 4.31Å; P387-F390 HydrophobicContact CG-CZ 4.4Å; P387-F390 WeakPolarHBondContact O-CB 3.16Å; P387-F390 WeakPolarHBondContact O-CG 3.22Å; P387-F390 PolarHBondContact O-N 2.77Å; P387-F390 VanDerWaalsContact O-N 3.17Å; F390-F423 HydrophobicContact CE1-CD2 4.36Å; F390-F423 AromaticContact CE1-CE2 3.71Å; F390-F423 HydrophobicContact CE1-CE2 3.71Å; F390-F423 HydrophobicContact CE1-CZ 4.44Å; F390-F423 HydrophobicContact CZ-CE2 4.24Å; F390-Y427 HydrophobicContact CB-CD2 4.09Å; F390-Y427 HydrophobicContact CB-CE2 3.94Å; F390-Y427 AromaticContact CD1-CD2 3.65Å; F390-Y427 HydrophobicContact CD1-CD2 3.65Å; F390-Y427 HydrophobicContact CD1-CE2 4.1Å; F390-Y427 AromaticContact CD2-CD2 3.96Å; F390-Y427 HydrophobicContact CD2-CD2 3.96Å; F390-Y427 AromaticContact CE1-CD2 3.99Å; F390-Y427 HydrophobicContact CE1-CD2 3.99Å; F390-Y427 HydrophobicContact CE2-CD2 4.28Å; F390-Y427 AromaticContact CG-CD2 3.63Å; F390-Y427 HydrophobicContact CG-CD2 3.63Å; F390-Y427 AromaticContact CG-CE2 3.99Å; F390-Y427 HydrophobicContact CG-CE2 3.99Å; F390-Y427 HydrophobicContact CZ-CD2 4.28Å; F390-Y427 WeakPolarHBondContact O-CE2 3.36Å; F390-Y427 PolarHBondContact O-OH 3.43Å; F390-C430 HydrophobicContact CD2-CB 3.58Å; F390-C430 HydrophobicContact CE2-CB 3.98Å; F390-H431 PolarHBondContact O-CE1 3.23Å; F390-H431 PolarHBondContact O-NE2 2.61Å
391	S	85.3	Confident	90.8	Very high	95 Å²	95	46.6 Å²	46.6	66%	0.664	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.4	175.2	62.2	0	0	0	0	114.3	R389 P393	R389-S391 PolarHBondContact O-N 2.93Å; R389-S391 VanDerWaalsContact O-N 3.1Å; S391-P393 WeakPolarHBondContact O-CD 3.23Å
392	D	86.6	Confident	90.9	Very high	34 Å²	34	45.8 Å²	45.8	18%	0.182	25%	0.246	C	C	.	.			trans	-66.6	120.1	179	-174.7	-15.3	0	0	0	110.4	R389 F394 V395 L396	R389-D392 IonicContact CZ-OD2 3.97Å; R389-D392 IonicContact NE-OD2 2.71Å; R389-D392 IonicContact NH2-OD2 3.95Å; R389-D392 PolarHBondContact NH2-OD2 2.91Å; R389-D392 WeakPolarHBondContact O-CB 3.28Å; R389-D392 PolarHBondContact O-N 3.34Å; D392-F394 PolarHBondContact O-N 3.18Å; D392-F394 VanDerWaalsContact O-N 3.17Å; D392-F394 WeakPolarHBondContact OD1-CB 3.2Å; D392-F394 PolarHBondContact OD1-N 3.4Å; D392-V395 HydrophobicContact CB-CB 4.14Å; D392-V395 HydrophobicContact CB-CG2 3.81Å; D392-V395 PolarHBondContact O-N 3.39Å; D392-V395 VanDerWaalsContact O-N 3.12Å; D392-L396 PolarHBondContact O-N 3.37Å; D392-L396 VanDerWaalsContact O-N 3.13Å
393	P	87.3	Confident	90.8	Very high	103 Å²	103	45.9 Å²	45.9	67%	0.669	25%	0.246	S	C	*	.	H	α-helix	trans	-57.6	-29.1	178.4	-25.2	34.8	0	0	0	113.8	S391 L396 A397	S391-P393 WeakPolarHBondContact O-CD 3.23Å; P393-L396 PolarHBondContact O-N 3.45Å; P393-A397 PolarHBondContact O-N 3.08Å
394	F	89.4	Confident	90.7	Very high	6 Å²	6	43 Å²	43	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-70.7	-43.4	177.4	-178.7	-111.5	0	0	0	111.4	L312 P320 Q325 L328 Y332 Y381 D392 L396 A397 T398	L312-F394 HydrophobicContact CD2-CE1 4.23Å; L312-F394 HydrophobicContact CD2-CZ 4.06Å; P320-F394 HydrophobicContact CG-CD1 4.07Å; P320-F394 HydrophobicContact CG-CE1 3.6Å; P320-F394 HydrophobicContact CG-CZ 4.2Å; Q325-F394 HydrophobicContact CB-CD2 3.57Å; Q325-F394 HydrophobicContact CB-CE2 3.94Å; Q325-F394 HydrophobicContact CB-CG 4.01Å; Q325-F394 HydrophobicContact CG-CB 4.21Å; Q325-F394 HydrophobicContact CG-CD1 3.94Å; Q325-F394 HydrophobicContact CG-CD2 3.69Å; Q325-F394 HydrophobicContact CG-CE1 4.26Å; Q325-F394 HydrophobicContact CG-CE2 4.04Å; Q325-F394 HydrophobicContact CG-CG 3.64Å; Q325-F394 HydrophobicContact CG-CZ 4.31Å; L328-F394 HydrophobicContact CB-CE2 3.9Å; L328-F394 HydrophobicContact CB-CZ 4.16Å; L328-F394 HydrophobicContact CD1-CE2 4.27Å; L328-F394 HydrophobicContact CD1-CZ 3.72Å; Y332-F394 HydrophobicContact CE2-CE2 4.08Å; Y332-F394 HydrophobicContact CE2-CZ 4.46Å; Y381-F394 HydrophobicContact CE1-CD1 4.33Å; Y381-F394 HydrophobicContact CE1-CE1 4.01Å; Y381-F394 HydrophobicContact CE2-CE1 4.36Å; Y381-F394 AromaticContact CZ-CE1 3.78Å; Y381-F394 WeakPolarHBondContact OH-CD1 3.44Å; D392-F394 PolarHBondContact O-N 3.18Å; D392-F394 VanDerWaalsContact O-N 3.17Å; D392-F394 WeakPolarHBondContact OD1-CB 3.2Å; D392-F394 PolarHBondContact OD1-N 3.4Å; F394-L396 PolarHBondContact O-N 2.98Å; F394-A397 PolarHBondContact O-N 3.49Å; F394-A397 VanDerWaalsContact O-N 3.16Å; F394-T398 PolarHBondContact O-N 3.18Å; F394-T398 PolarHBondContact O-OG1 3.2Å
395	V	92.4	Very high	90.7	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.1	-41.5	173.9	173.2	0	0	0	0	110.5	Y381 L382 V385 D392 T398 F399 Y427	Y381-V395 HydrophobicContact CE1-CG2 4.44Å; L382-V395 HydrophobicContact CD2-CG1 4.39Å; V385-V395 HydrophobicContact CG1-CG1 3.89Å; V385-V395 HydrophobicContact CG1-CG2 3.95Å; V385-V395 HydrophobicContact CG2-CG2 4.1Å; D392-V395 HydrophobicContact CB-CB 4.14Å; D392-V395 HydrophobicContact CB-CG2 3.81Å; D392-V395 PolarHBondContact O-N 3.39Å; D392-V395 VanDerWaalsContact O-N 3.12Å; V395-T398 PolarHBondContact O-N 3.42Å; V395-F399 VanDerWaalsContact O-CB 3.29Å; V395-F399 WeakPolarHBondContact O-CB 3.38Å; V395-F399 PolarHBondContact O-N 3.34Å; V395-Y427 HydrophobicContact CG1-CD2 4.38Å; V395-Y427 HydrophobicContact CG1-CE2 3.68Å
396	L	90	Very high	90.8	Very high	35 Å²	35	39.5 Å²	39.5	18%	0.183	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-47	175.9	173.8	63.2	0	0	0	112.3	D392 P393 F394 T398 F399 R400 Y427 W457	D392-L396 PolarHBondContact O-N 3.37Å; D392-L396 VanDerWaalsContact O-N 3.13Å; P393-L396 PolarHBondContact O-N 3.45Å; F394-L396 PolarHBondContact O-N 2.98Å; L396-T398 VanDerWaalsContact C-N 3.3Å; L396-T398 PolarHBondContact O-N 2.98Å; L396-F399 PolarHBondContact O-N 3.49Å; L396-R400 WeakPolarHBondContact O-CB 3.43Å; L396-R400 PolarHBondContact O-N 3.06Å; L396-Y427 WeakPolarHBondContact CA-OH 3.39Å; L396-W457 HydrophobicContact CD1-CE3 4Å; L396-W457 HydrophobicContact CD1-CH2 4.16Å; L396-W457 HydrophobicContact CD1-CZ3 3.45Å; L396-W457 VanDerWaalsContact CD1-CZ3 3.45Å; L396-W457 HydrophobicContact CD2-CD2 4.4Å; L396-W457 HydrophobicContact CD2-CE3 3.52Å; L396-W457 HydrophobicContact CD2-CZ3 3.89Å; L396-W457 HydrophobicContact CG-CE3 4.35Å; L396-W457 HydrophobicContact CG-CZ3 4.27Å
397	A	90.5	Very high	90.7	Very high	22 Å²	22	34 Å²	34	18%	0.182	20%	0.199	C	C	.	.	H	α-helix	trans	-60.3	-42.4	178	0	0	0	0	0	111.3	T329 Y332 P393 F394 R400 A401	T329-A397 HydrophobicContact CG2-CB 4.28Å; Y332-A397 HydrophobicContact CD2-CB 4.45Å; P393-A397 PolarHBondContact O-N 3.08Å; F394-A397 PolarHBondContact O-N 3.49Å; F394-A397 VanDerWaalsContact O-N 3.16Å; A397-R400 PolarHBondContact O-N 3.39Å; A397-A401 WeakPolarHBondContact O-CB 3.3Å; A397-A401 PolarHBondContact O-N 3.44Å
398	T	95.4	Very high	90.6	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.5	-43.9	177.7	-54	0	0	0	0	112.3	Y332 V378 Y381 L382 F394 V395 L396 A401 L402	Y332-T398 HydrophobicContact CE2-CG2 4.45Å; Y332-T398 WeakPolarHBondContact CE2-OG1 3.44Å; Y332-T398 PolarHBondContact OH-OG1 3.28Å; Y332-T398 VanDerWaalsContact OH-OG1 3.13Å; V378-T398 HydrophobicContact CB-CG2 4.48Å; V378-T398 HydrophobicContact CG1-CG2 3.67Å; V378-T398 HydrophobicContact CG2-CG2 4.47Å; Y381-T398 HydrophobicContact CD1-CG2 3.82Å; Y381-T398 HydrophobicContact CE1-CG2 4.23Å; L382-T398 HydrophobicContact CD1-CG2 4.27Å; L382-T398 HydrophobicContact CD2-CG2 3.91Å; L382-T398 HydrophobicContact CG-CG2 3.96Å; F394-T398 PolarHBondContact O-N 3.18Å; F394-T398 PolarHBondContact O-OG1 3.2Å; V395-T398 PolarHBondContact O-N 3.42Å; L396-T398 VanDerWaalsContact C-N 3.3Å; L396-T398 PolarHBondContact O-N 2.98Å; T398-A401 PolarHBondContact O-N 3.38Å; T398-L402 PolarHBondContact O-N 3.07Å; T398-L402 VanDerWaalsContact O-N 3.12Å
399	F	94.7	Very high	90.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.5	-45.4	174.5	174.1	-89.8	0	0	0	111.6	V395 L396 L402 C403 F423 L424 Y427 A462 L466	V395-F399 VanDerWaalsContact O-CB 3.29Å; V395-F399 WeakPolarHBondContact O-CB 3.38Å; V395-F399 PolarHBondContact O-N 3.34Å; L396-F399 PolarHBondContact O-N 3.49Å; F399-L402 PolarHBondContact O-N 3.37Å; F399-C403 WeakPolarHBondContact CE1-SG 3.35Å; F399-C403 VanDerWaalsContact CZ-SG 3.56Å; F399-C403 PolarHBondContact O-N 3.29Å; F399-C403 PolarHBondContact O-SG 3.07Å; F399-F423 HydrophobicContact CD2-CE1 4.45Å; F399-L424 HydrophobicContact CD2-CD2 3.76Å; F399-L424 HydrophobicContact CE2-CB 4.34Å; F399-L424 HydrophobicContact CE2-CD2 3.55Å; F399-Y427 HydrophobicContact CB-CE1 4.26Å; F399-Y427 HydrophobicContact CD1-CD1 4.04Å; F399-Y427 AromaticContact CD1-CE1 3.86Å; F399-Y427 HydrophobicContact CD1-CE1 3.86Å; F399-Y427 AromaticContact CD2-CD1 3.64Å; F399-Y427 HydrophobicContact CD2-CD1 3.64Å; F399-Y427 HydrophobicContact CD2-CE1 4.11Å; F399-Y427 HydrophobicContact CD2-CG 4.12Å; F399-Y427 HydrophobicContact CE1-CD1 4.06Å; F399-Y427 HydrophobicContact CE1-CE1 4.2Å; F399-Y427 AromaticContact CE2-CD1 3.65Å; F399-Y427 HydrophobicContact CE2-CD1 3.65Å; F399-Y427 HydrophobicContact CE2-CE1 4.42Å; F399-Y427 HydrophobicContact CE2-CG 4.21Å; F399-Y427 AromaticContact CG-CD1 3.84Å; F399-Y427 HydrophobicContact CG-CD1 3.84Å; F399-Y427 AromaticContact CG-CE1 3.81Å; F399-Y427 HydrophobicContact CG-CE1 3.81Å; F399-Y427 AromaticContact CZ-CD1 3.86Å; F399-Y427 HydrophobicContact CZ-CD1 3.86Å; F399-Y427 HydrophobicContact CZ-CE1 4.46Å; F399-A462 HydrophobicContact CE1-CB 4.18Å; F399-A462 WeakPolarHBondContact CE1-O 3.46Å; F399-L466 HydrophobicContact CZ-CB 4.08Å; F399-L466 HydrophobicContact CZ-CD2 4.32Å
400	R	92.9	Very high	90.3	Very high	84 Å²	84	30.3 Å²	30.3	32%	0.317	17%	0.173	S	C	.	.	H	α-helix	trans	-61.7	-47	178	177.5	-169.2	146	107	3.7	111.3	E336 L396 A397 L402 C403 A404 Y465	E336-R400 IonicContact OE1-NE 3.02Å; E336-R400 PolarHBondContact OE1-NE 3.35Å; E336-R400 IonicContact OE2-CZ 3.37Å; E336-R400 IonicContact OE2-NE 3.29Å; E336-R400 IonicContact OE2-NH2 3.85Å; E336-R400 PolarHBondContact OE2-NH2 3Å; L396-R400 WeakPolarHBondContact O-CB 3.43Å; L396-R400 PolarHBondContact O-N 3.06Å; A397-R400 PolarHBondContact O-N 3.39Å; R400-L402 VanDerWaalsContact C-N 3.28Å; R400-L402 PolarHBondContact O-N 3.14Å; R400-C403 WeakPolarHBondContact O-CB 3.37Å; R400-C403 PolarHBondContact O-N 2.94Å; R400-C403 VanDerWaalsContact O-N 3.12Å; R400-A404 PolarHBondContact O-N 3.12Å; R400-Y465 HydrophobicContact CB-CD2 4.31Å; R400-Y465 HydrophobicContact CB-CE2 4.28Å; R400-Y465 HydrophobicContact CG-CD1 4.31Å; R400-Y465 HydrophobicContact CG-CD2 4.13Å; R400-Y465 HydrophobicContact CG-CE1 4.21Å; R400-Y465 HydrophobicContact CG-CE2 3.9Å; R400-Y465 HydrophobicContact CG-CG 4.31Å; R400-Y465 PolarHBondContact NH1-OH 3.41Å
401	A	93.5	Very high	90.1	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.2	-43.3	179.3	0	0	0	0	0	111.3	Y332 E336 F375 A397 T398 A404 W405	Y332-A401 HydrophobicContact CD1-CB 4.04Å; Y332-A401 HydrophobicContact CD2-CB 4.15Å; Y332-A401 HydrophobicContact CG-CB 3.72Å; E336-A401 WeakPolarHBondContact OE1-CA 3.5Å; F375-A401 VanDerWaalsContact CE1-O 3.32Å; F375-A401 WeakPolarHBondContact CE1-O 3.42Å; A397-A401 WeakPolarHBondContact O-CB 3.3Å; A397-A401 PolarHBondContact O-N 3.44Å; T398-A401 PolarHBondContact O-N 3.38Å; A401-A404 PolarHBondContact O-N 3.37Å; A401-W405 PolarHBondContact O-N 2.95Å
402	L	96	Very high	90.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.3	-44.1	174.9	-179.5	63.1	0	0	0	112	F375 V378 I379 L382 T398 F399 R400 A404 W405 L406 L420 L424	F375-L402 HydrophobicContact CD1-CD1 3.9Å; V378-L402 HydrophobicContact CG1-CB 3.89Å; V378-L402 HydrophobicContact CG1-CD1 4.48Å; I379-L402 HydrophobicContact CD1-CD1 4.34Å; I379-L402 HydrophobicContact CG1-CD1 3.93Å; I379-L402 HydrophobicContact CG1-CD2 4.1Å; L382-L402 HydrophobicContact CD1-CB 4.3Å; L382-L402 HydrophobicContact CD1-CD2 3.64Å; T398-L402 PolarHBondContact O-N 3.07Å; T398-L402 VanDerWaalsContact O-N 3.12Å; F399-L402 PolarHBondContact O-N 3.37Å; R400-L402 VanDerWaalsContact C-N 3.28Å; R400-L402 PolarHBondContact O-N 3.14Å; L402-A404 VanDerWaalsContact C-N 3.29Å; L402-A404 PolarHBondContact O-N 2.88Å; L402-W405 WeakPolarHBondContact O-CB 3.5Å; L402-W405 PolarHBondContact O-N 3.21Å; L402-W405 VanDerWaalsContact O-N 3.16Å; L402-L406 HydrophobicContact CD1-CD1 4.13Å; L402-L406 HydrophobicContact CD1-CG 4.06Å; L402-L406 HydrophobicContact CD2-CD1 4.33Å; L402-L406 HydrophobicContact CG-CD1 3.87Å; L402-L406 HydrophobicContact CG-CG 4.21Å; L402-L406 WeakPolarHBondContact O-CG 3.1Å; L402-L406 PolarHBondContact O-N 3.15Å; L402-L420 HydrophobicContact CD2-CD2 3.35Å; L402-L424 HydrophobicContact CD2-CD2 4.14Å
403	C	93.3	Very high	90.5	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.014	17%	0.165	C	C	.	.	H	α-helix	trans	-61.4	-38.7	178	-70.1	0	0	0	0	112.2	F399 R400 W405 L406 A407 Y465	F399-C403 WeakPolarHBondContact CE1-SG 3.35Å; F399-C403 VanDerWaalsContact CZ-SG 3.56Å; F399-C403 PolarHBondContact O-N 3.29Å; F399-C403 PolarHBondContact O-SG 3.07Å; R400-C403 WeakPolarHBondContact O-CB 3.37Å; R400-C403 PolarHBondContact O-N 2.94Å; R400-C403 VanDerWaalsContact O-N 3.12Å; C403-W405 VanDerWaalsContact C-N 3.33Å; C403-W405 PolarHBondContact O-N 3.48Å; C403-L406 PolarHBondContact O-N 2.92Å; C403-A407 WeakPolarHBondContact O-CB 3.41Å; C403-A407 PolarHBondContact O-N 3.29Å; C403-Y465 WeakPolarHBondContact CB-O 3.49Å
404	A	90	Very high	90.8	Very high	35 Å²	35	28 Å²	28	29%	0.289	15%	0.152	S	C	.	.	H	α-helix	trans	-62.5	-39.3	174.9	0	0	0	0	0	111.9	E336 M339 R400 A401 L402	E336-A404 HydrophobicContact CG-CB 4.06Å; M339-A404 HydrophobicContact CE-CB 4.28Å; R400-A404 PolarHBondContact O-N 3.12Å; A401-A404 PolarHBondContact O-N 3.37Å; L402-A404 VanDerWaalsContact C-N 3.29Å; L402-A404 PolarHBondContact O-N 2.88Å
405	W	91.9	Very high	91	Very high	6 Å²	6	35.5 Å²	35.5	2%	0.023	19%	0.187	C	C	.	.	H	α-helix	trans	-65.5	-49.3	172.5	172	-89	0	0	0	112.5	M339 L368 L371 F375 A401 L402 C403 A407 E408 E409 C412	M339-W405 HydrophobicContact CE-CB 4.24Å; M339-W405 HydrophobicContact CG-CE3 4.31Å; M339-W405 VanDerWaalsContact SD-CA 3.58Å; M339-W405 HydrophobicContact SD-CB 3.87Å; M339-W405 HydrophobicContact SD-CD2 4.17Å; M339-W405 HydrophobicContact SD-CE3 3.39Å; M339-W405 HydrophobicContact SD-CG 4.4Å; M339-W405 HydrophobicContact SD-CZ3 4.25Å; L368-W405 HydrophobicContact CD1-CH2 3.54Å; L368-W405 HydrophobicContact CD1-CZ2 4.38Å; L368-W405 HydrophobicContact CD1-CZ3 4.24Å; L368-W405 HydrophobicContact CG-CH2 4.44Å; L371-W405 HydrophobicContact CB-CE3 4.27Å; L371-W405 HydrophobicContact CB-CH2 3.83Å; L371-W405 HydrophobicContact CB-CZ3 3.44Å; L371-W405 VanDerWaalsContact CB-CZ3 3.44Å; L371-W405 HydrophobicContact CD1-CZ3 3.91Å; L371-W405 HydrophobicContact CG-CZ3 4.18Å; F375-W405 HydrophobicContact CD1-CB 3.99Å; F375-W405 HydrophobicContact CD1-CG 4.15Å; F375-W405 HydrophobicContact CD2-CB 3.96Å; F375-W405 AromaticContact CD2-CD2 3.33Å; F375-W405 HydrophobicContact CD2-CD2 3.33Å; F375-W405 AromaticContact CD2-CE2 3.99Å; F375-W405 AromaticContact CD2-CE3 3.38Å; F375-W405 HydrophobicContact CD2-CE3 3.38Å; F375-W405 AromaticContact CD2-CG 3.58Å; F375-W405 HydrophobicContact CD2-CG 3.58Å; F375-W405 HydrophobicContact CD2-CZ3 4.09Å; F375-W405 HydrophobicContact CE1-CB 3.65Å; F375-W405 HydrophobicContact CE1-CG 4.24Å; F375-W405 HydrophobicContact CE2-CB 3.61Å; F375-W405 AromaticContact CE2-CD2 3.53Å; F375-W405 HydrophobicContact CE2-CD2 3.53Å; F375-W405 AromaticContact CE2-CE3 3.25Å; F375-W405 HydrophobicContact CE2-CE3 3.25Å; F375-W405 AromaticContact CE2-CG 3.68Å; F375-W405 HydrophobicContact CE2-CG 3.68Å; F375-W405 HydrophobicContact CE2-CZ3 4.15Å; F375-W405 HydrophobicContact CG-CB 4.15Å; F375-W405 HydrophobicContact CG-CD2 4.01Å; F375-W405 HydrophobicContact CG-CE3 4.46Å; F375-W405 AromaticContact CG-CG 3.83Å; F375-W405 HydrophobicContact CG-CG 3.83Å; F375-W405 HydrophobicContact CZ-CB 3.44Å; F375-W405 VanDerWaalsContact CZ-CB 3.44Å; F375-W405 HydrophobicContact CZ-CD2 4.33Å; F375-W405 HydrophobicContact CZ-CE3 4.26Å; F375-W405 HydrophobicContact CZ-CG 4.03Å; A401-W405 PolarHBondContact O-N 2.95Å; L402-W405 WeakPolarHBondContact O-CB 3.5Å; L402-W405 PolarHBondContact O-N 3.21Å; L402-W405 VanDerWaalsContact O-N 3.16Å; C403-W405 VanDerWaalsContact C-N 3.33Å; C403-W405 PolarHBondContact O-N 3.48Å; W405-A407 PolarHBondContact O-N 3.14Å; W405-E408 PolarHBondContact O-N 3.15Å; W405-E409 HydrophobicContact CD2-CB 4.34Å; W405-E409 HydrophobicContact CH2-CB 4.47Å; W405-E409 HydrophobicContact CH2-CG 4.12Å; W405-E409 HydrophobicContact CZ2-CB 3.95Å; W405-E409 HydrophobicContact CZ2-CG 3.47Å; W405-E409 VanDerWaalsContact CZ2-CG 3.47Å; W405-E409 PolarHBondContact NE1-O 3.35Å; W405-E409 PolarHBondContact O-N 2.95Å; W405-C412 HydrophobicContact CZ2-CB 4.33Å
406	L	92.8	Very high	91.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-68.5	-17.6	-177.9	-65.2	177.3	0	0	0	113.7	L402 C403 E408 T410 V417 L424 A469	L402-L406 HydrophobicContact CD1-CD1 4.13Å; L402-L406 HydrophobicContact CD1-CG 4.06Å; L402-L406 HydrophobicContact CD2-CD1 4.33Å; L402-L406 HydrophobicContact CG-CD1 3.87Å; L402-L406 HydrophobicContact CG-CG 4.21Å; L402-L406 WeakPolarHBondContact O-CG 3.1Å; L402-L406 PolarHBondContact O-N 3.15Å; C403-L406 PolarHBondContact O-N 2.92Å; L406-E408 VanDerWaalsContact C-N 3.26Å; L406-T410 WeakPolarHBondContact O-CG2 3.35Å; L406-V417 HydrophobicContact CD1-CG1 4.14Å; L406-V417 HydrophobicContact CD2-CB 4.46Å; L406-V417 HydrophobicContact CD2-CG1 3.89Å; L406-V417 HydrophobicContact CD2-CG2 3.65Å; L406-L424 HydrophobicContact CD1-CD1 4.22Å; L406-A469 HydrophobicContact CB-CB 3.5Å; L406-A469 VanDerWaalsContact CB-CB 3.5Å; L406-A469 HydrophobicContact CD1-CB 4.5Å
407	A	89.2	Confident	91.4	Very high	16 Å²	16	37.7 Å²	37.7	13%	0.132	20%	0.196	C	C	.	.	H	α-helix	trans	-66	-31.8	170.9	0	0	0	0	0	111.9	C403 W405 P468	C403-A407 WeakPolarHBondContact O-CB 3.41Å; C403-A407 PolarHBondContact O-N 3.29Å; W405-A407 PolarHBondContact O-N 3.14Å; A407-P468 HydrophobicContact CB-CB 3.66Å; A407-P468 HydrophobicContact CB-CG 4.42Å
408	E	86.2	Confident	91.7	Very high	116 Å²	116	37.6 Å²	37.6	54%	0.542	19%	0.193	S	C	.	.	H	α-helix	trans	-108.3	-29.9	-173	-52.9	-59	153.8	0	0	112.8	C343 W405 L406	C343-E408 PolarHBondContact SG-OE2 2.98Å; W405-E408 PolarHBondContact O-N 3.15Å; L406-E408 VanDerWaalsContact C-N 3.26Å
409	E	87.3	Confident	91.8	Very high	41 Å²	41	40.7 Å²	40.7	19%	0.192	22%	0.219	C	C	.	.			trans	-137.9	99.4	-172.6	-179.2	52.3	-98.9	0	0	111.7	W405 S411 C412	W405-E409 HydrophobicContact CD2-CB 4.34Å; W405-E409 HydrophobicContact CH2-CB 4.47Å; W405-E409 HydrophobicContact CH2-CG 4.12Å; W405-E409 HydrophobicContact CZ2-CB 3.95Å; W405-E409 HydrophobicContact CZ2-CG 3.47Å; W405-E409 VanDerWaalsContact CZ2-CG 3.47Å; W405-E409 PolarHBondContact NE1-O 3.35Å; W405-E409 PolarHBondContact O-N 2.95Å; E409-S411 WeakPolarHBondContact OE1-CA 3.39Å; E409-S411 WeakPolarHBondContact OE1-CB 3.31Å; E409-S411 PolarHBondContact OE1-N 3.13Å; E409-S411 PolarHBondContact OE1-OG 3.35Å; E409-C412 HydrophobicContact CG-CB 4.14Å; E409-C412 PolarHBondContact OE1-N 3.49Å
410	T	83.1	Confident	91.9	Very high	25 Å²	25	40.8 Å²	40.8	15%	0.153	22%	0.22	C	C	.	.			trans	-106.7	1.5	175.3	64.4	0	0	0	0	113.8	L406 H472 L473	L406-T410 WeakPolarHBondContact O-CG2 3.35Å; T410-H472 HydrophobicContact CG2-CB 3.74Å; T410-L473 HydrophobicContact CG2-CD2 4.4Å; T410-L473 HydrophobicContact CG2-CG 4.46Å
411	S	84.9	Confident	92.1	Very high	74 Å²	74	36.8 Å²	36.8	52%	0.517	21%	0.205	S	C	.	.	S	Bend	trans	-88.4	-28.1	-177.5	83.2	0	0	0	0	113.7	E409 K414	E409-S411 WeakPolarHBondContact OE1-CA 3.39Å; E409-S411 WeakPolarHBondContact OE1-CB 3.31Å; E409-S411 PolarHBondContact OE1-N 3.13Å; E409-S411 PolarHBondContact OE1-OG 3.35Å; S411-K414 VanDerWaalsContact CA-CE 3.45Å; S411-K414 WeakPolarHBondContact O-CE 3.3Å; S411-K414 WeakPolarHBondContact O-CG 3.46Å
412	C	88.6	Confident	92.3	Very high	20 Å²	20	39.8 Å²	39.8	14%	0.135	22%	0.224	C	C	.	.	S	Bend	trans	-80.6	150.8	171.3	-69.9	0	0	0	0	112	Q372 W405 E409 K414	Q372-C412 HydrophobicContact CG-CB 4.27Å; Q372-C412 PolarHBondContact OE1-SG 3.44Å; W405-C412 HydrophobicContact CZ2-CB 4.33Å; E409-C412 HydrophobicContact CG-CB 4.14Å; E409-C412 PolarHBondContact OE1-N 3.49Å; C412-K414 PolarHBondContact O-N 2.98Å; C412-K414 VanDerWaalsContact O-N 3.16Å
413	L	91.4	Very high	92.4	Very high	17 Å²	17	41.2 Å²	41.2	9%	0.089	23%	0.23	C	C	.	.	S	Bend	trans	54.2	33.5	173.5	-55.6	171.3	0	0	0	114.3	Q372 F375 I379 E415 E416 V417	Q372-L413 HydrophobicContact CG-CD1 4.01Å; Q372-L413 HydrophobicContact CG-CD2 3.94Å; Q372-L413 HydrophobicContact CG-CG 3.8Å; F375-L413 HydrophobicContact CB-CD1 4.23Å; I379-L413 HydrophobicContact CD1-CB 4.31Å; I379-L413 HydrophobicContact CD1-CD1 3.96Å; L413-E415 VanDerWaalsContact C-N 3.28Å; L413-E415 PolarHBondContact O-N 3.02Å; L413-E416 WeakPolarHBondContact CA-OE2 3.21Å; L413-E416 HydrophobicContact CB-CB 4.39Å; L413-E416 PolarHBondContact O-N 3.06Å; L413-V417 HydrophobicContact CB-CG2 4.24Å; L413-V417 WeakPolarHBondContact O-CB 3.39Å; L413-V417 VanDerWaalsContact O-CG2 3.23Å; L413-V417 WeakPolarHBondContact O-CG2 3.47Å; L413-V417 PolarHBondContact O-N 3.34Å
414	K	92.4	Very high	92.5	Very high	89 Å²	89	41.1 Å²	41.1	39%	0.387	23%	0.229	S	C	.	.	H	α-helix	trans	-56	-41.8	-172.4	-72.5	-169.2	174.2	-153	0	113.4	S411 C412 T418 E476	S411-K414 VanDerWaalsContact CA-CE 3.45Å; S411-K414 WeakPolarHBondContact O-CE 3.3Å; S411-K414 WeakPolarHBondContact O-CG 3.46Å; C412-K414 PolarHBondContact O-N 2.98Å; C412-K414 VanDerWaalsContact O-N 3.16Å; K414-T418 WeakPolarHBondContact O-CB 3.33Å; K414-T418 PolarHBondContact O-N 3Å; K414-T418 PolarHBondContact O-OG1 3.36Å; K414-E476 IonicContact NZ-OE1 2.64Å; K414-E476 IonicContact NZ-OE2 3.19Å; K414-E476 PolarHBondContact NZ-OE2 3.47Å
415	E	94.3	Very high	92.9	Very high	164 Å²	164	39.5 Å²	39.5	77%	0.766	22%	0.216	S	C	*	.	H	α-helix	trans	-68.9	-44.6	-177	-64.3	-175.1	-179.9	0	0	110.4	L413 T418 A419	L413-E415 VanDerWaalsContact C-N 3.28Å; L413-E415 PolarHBondContact O-N 3.02Å; E415-T418 PolarHBondContact O-N 3.44Å; E415-A419 WeakPolarHBondContact O-CB 3.48Å; E415-A419 PolarHBondContact O-N 3.05Å
416	E	95.6	Very high	93	Very high	76 Å²	76	40.4 Å²	40.4	36%	0.355	23%	0.228	S	C	.	.	H	α-helix	trans	-66.7	-43.7	179.6	-58.4	89.4	156.7	0	0	111.7	I379 L413 A419 L420	I379-E416 HydrophobicContact CD1-CB 4.25Å; I379-E416 HydrophobicContact CG2-CB 4.13Å; L413-E416 WeakPolarHBondContact CA-OE2 3.21Å; L413-E416 HydrophobicContact CB-CB 4.39Å; L413-E416 PolarHBondContact O-N 3.06Å; E416-A419 PolarHBondContact O-N 3.16Å; E416-L420 WeakPolarHBondContact O-CB 3.2Å; E416-L420 PolarHBondContact O-N 3.49Å
417	V	96.2	Very high	93.1	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.03	23%	0.228	C	C	.	.	H	α-helix	trans	-63.7	-45.1	175.1	171.7	0	0	0	0	110.6	I379 L406 L413 A419 L420 L421 L473	I379-V417 HydrophobicContact CD1-CG2 3.77Å; L406-V417 HydrophobicContact CD1-CG1 4.14Å; L406-V417 HydrophobicContact CD2-CB 4.46Å; L406-V417 HydrophobicContact CD2-CG1 3.89Å; L406-V417 HydrophobicContact CD2-CG2 3.65Å; L413-V417 HydrophobicContact CB-CG2 4.24Å; L413-V417 WeakPolarHBondContact O-CB 3.39Å; L413-V417 VanDerWaalsContact O-CG2 3.23Å; L413-V417 WeakPolarHBondContact O-CG2 3.47Å; L413-V417 PolarHBondContact O-N 3.34Å; V417-A419 VanDerWaalsContact C-N 3.3Å; V417-A419 PolarHBondContact O-N 3.42Å; V417-L420 PolarHBondContact O-N 3.23Å; V417-L420 VanDerWaalsContact O-N 3.11Å; V417-L421 PolarHBondContact O-N 2.98Å; V417-L421 VanDerWaalsContact O-N 3.13Å; V417-L473 HydrophobicContact CG1-CD1 4.24Å; V417-L473 HydrophobicContact CG1-CD2 4.22Å
418	T	96.3	Very high	93.3	Very high	19 Å²	19	39.7 Å²	39.7	12%	0.117	22%	0.222	C	C	.	.	H	α-helix	trans	-60.7	-41.5	177.2	-62.1	0	0	0	0	111.1	K414 E415 L420 L421 T478 V482	K414-T418 WeakPolarHBondContact O-CB 3.33Å; K414-T418 PolarHBondContact O-N 3Å; K414-T418 PolarHBondContact O-OG1 3.36Å; E415-T418 PolarHBondContact O-N 3.44Å; T418-L420 VanDerWaalsContact C-N 3.3Å; T418-L420 PolarHBondContact O-N 3.36Å; T418-L421 WeakPolarHBondContact O-CB 3.28Å; T418-L421 PolarHBondContact O-N 3.43Å; T418-T478 HydrophobicContact CG2-CG2 4.14Å; T418-V482 HydrophobicContact CG2-CB 4.47Å; T418-V482 HydrophobicContact CG2-CG2 3.69Å
419	A	96.6	Very high	93.7	Very high	66 Å²	66	37.6 Å²	37.6	55%	0.545	21%	0.209	S	C	.	.	H	α-helix	trans	-66.8	-29.5	176.2	0	0	0	0	0	112.9	E415 E416 V417 P422	E415-A419 WeakPolarHBondContact O-CB 3.48Å; E415-A419 PolarHBondContact O-N 3.05Å; E416-A419 PolarHBondContact O-N 3.16Å; V417-A419 VanDerWaalsContact C-N 3.3Å; V417-A419 PolarHBondContact O-N 3.42Å; A419-P422 WeakPolarHBondContact O-CD 3.37Å
420	L	97.3	Very high	93.9	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-80.7	-17.1	178.2	-171.5	71.9	0	0	0	113.4	I379 L382 Q383 L402 E416 V417 T418 P422 F423 L424	I379-L420 HydrophobicContact CB-CD2 4.35Å; I379-L420 HydrophobicContact CG1-CD2 4.05Å; I379-L420 HydrophobicContact CG2-CB 4.27Å; I379-L420 HydrophobicContact CG2-CD2 4.08Å; L382-L420 HydrophobicContact CB-CD1 3.97Å; L382-L420 HydrophobicContact CB-CD2 4.4Å; L382-L420 HydrophobicContact CD1-CD2 4.4Å; Q383-L420 HydrophobicContact CB-CD1 4.42Å; Q383-L420 HydrophobicContact CG-CD1 3.56Å; L402-L420 HydrophobicContact CD2-CD2 3.35Å; E416-L420 WeakPolarHBondContact O-CB 3.2Å; E416-L420 PolarHBondContact O-N 3.49Å; V417-L420 PolarHBondContact O-N 3.23Å; V417-L420 VanDerWaalsContact O-N 3.11Å; T418-L420 VanDerWaalsContact C-N 3.3Å; T418-L420 PolarHBondContact O-N 3.36Å; L420-P422 VanDerWaalsContact C-CD 3.42Å; L420-P422 VanDerWaalsContact C-N 3.35Å; L420-P422 VanDerWaalsContact O-N 3.17Å; L420-F423 HydrophobicContact CD1-CB 3.94Å; L420-F423 HydrophobicContact CD1-CD1 3.8Å; L420-F423 HydrophobicContact CD1-CG 4.07Å; L420-F423 HydrophobicContact CG-CB 4.46Å; L420-F423 HydrophobicContact CG-CD1 4.23Å; L420-F423 WeakPolarHBondContact O-CA 3.33Å; L420-F423 WeakPolarHBondContact O-CB 3.4Å; L420-F423 PolarHBondContact O-N 3.43Å; L420-L424 HydrophobicContact CD2-CD1 4.22Å; L420-L424 HydrophobicContact CD2-CD2 3.94Å; L420-L424 HydrophobicContact CD2-CG 4.08Å; L420-L424 HydrophobicContact CG-CD1 4.4Å; L420-L424 HydrophobicContact CG-CD2 4.28Å; L420-L424 HydrophobicContact CG-CG 4.02Å; L420-L424 PolarHBondContact O-N 3.12Å; L420-L424 VanDerWaalsContact O-N 3.1Å
421	L	97.6	Very high	94.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-48.8	-43.2	-177.6	-78.5	176.5	0	0	0	115.3	V417 T418 F423 L424 I425 L473 P479 V482 L483	V417-L421 PolarHBondContact O-N 2.98Å; V417-L421 VanDerWaalsContact O-N 3.13Å; T418-L421 WeakPolarHBondContact O-CB 3.28Å; T418-L421 PolarHBondContact O-N 3.43Å; L421-F423 VanDerWaalsContact C-N 3.27Å; L421-F423 PolarHBondContact O-N 2.89Å; L421-L424 HydrophobicContact CD2-CD1 4.4Å; L421-L424 PolarHBondContact O-N 2.94Å; L421-I425 WeakPolarHBondContact O-CG1 3.17Å; L421-I425 PolarHBondContact O-N 3.17Å; L421-L473 HydrophobicContact CD2-CD1 3.9Å; L421-P479 HydrophobicContact CD1-CB 3.93Å; L421-V482 HydrophobicContact CB-CG1 3.83Å; L421-V482 HydrophobicContact CD1-CB 3.98Å; L421-V482 HydrophobicContact CD1-CG1 4.06Å; L421-L483 HydrophobicContact CD1-CD2 4.1Å; L421-L483 HydrophobicContact CD1-CG 4.09Å; L421-L483 HydrophobicContact CD2-CD2 3.82Å; L421-L483 HydrophobicContact CG-CD2 4.42Å
422	P	97.6	Very high	94.2	Very high	62 Å²	62	34.1 Å²	34.1	40%	0.403	19%	0.187	S	C	.	.	H	α-helix	trans	-58.1	-39.3	176.6	-24.9	35.8	0	0	0	113.1	A419 L420 G426 V482 V486	A419-P422 WeakPolarHBondContact O-CD 3.37Å; L420-P422 VanDerWaalsContact C-CD 3.42Å; L420-P422 VanDerWaalsContact C-N 3.35Å; L420-P422 VanDerWaalsContact O-N 3.17Å; P422-G426 PolarHBondContact O-N 3.37Å; P422-V482 HydrophobicContact CG-CG1 4.19Å; P422-V486 HydrophobicContact CB-CG1 4.02Å; P422-V486 HydrophobicContact CG-CG1 4.09Å
423	F	97.2	Very high	93.9	Very high	30 Å²	30	38.3 Å²	38.3	13%	0.132	20%	0.204	C	C	.	.	H	α-helix	trans	-65.4	-49.2	174.1	169.5	-90.9	0	0	0	111.1	L382 V385 F390 F399 L420 L421 I425 G426 Y427	L382-F423 HydrophobicContact CB-CD1 4.19Å; L382-F423 HydrophobicContact CB-CE1 3.75Å; L382-F423 HydrophobicContact CB-CZ 4.19Å; L382-F423 HydrophobicContact CD1-CE1 4.31Å; L382-F423 HydrophobicContact CD2-CE1 3.88Å; L382-F423 HydrophobicContact CD2-CZ 3.94Å; L382-F423 HydrophobicContact CG-CE1 4.19Å; L382-F423 WeakPolarHBondContact O-CD2 3.48Å; L382-F423 WeakPolarHBondContact O-CE2 3.48Å; V385-F423 HydrophobicContact CB-CE2 3.72Å; V385-F423 HydrophobicContact CB-CZ 4.07Å; V385-F423 HydrophobicContact CG1-CE2 3.98Å; V385-F423 HydrophobicContact CG1-CZ 4.26Å; F390-F423 HydrophobicContact CE1-CD2 4.36Å; F390-F423 AromaticContact CE1-CE2 3.71Å; F390-F423 HydrophobicContact CE1-CE2 3.71Å; F390-F423 HydrophobicContact CE1-CZ 4.44Å; F390-F423 HydrophobicContact CZ-CE2 4.24Å; F399-F423 HydrophobicContact CD2-CE1 4.45Å; L420-F423 HydrophobicContact CD1-CB 3.94Å; L420-F423 HydrophobicContact CD1-CD1 3.8Å; L420-F423 HydrophobicContact CD1-CG 4.07Å; L420-F423 HydrophobicContact CG-CB 4.46Å; L420-F423 HydrophobicContact CG-CD1 4.23Å; L420-F423 WeakPolarHBondContact O-CA 3.33Å; L420-F423 WeakPolarHBondContact O-CB 3.4Å; L420-F423 PolarHBondContact O-N 3.43Å; L421-F423 VanDerWaalsContact C-N 3.27Å; L421-F423 PolarHBondContact O-N 2.89Å; F423-I425 VanDerWaalsContact C-N 3.35Å; F423-I425 PolarHBondContact O-N 3.4Å; F423-G426 PolarHBondContact O-N 3.03Å; F423-G426 VanDerWaalsContact O-N 3.17Å; F423-Y427 HydrophobicContact CZ-CD2 4.28Å; F423-Y427 WeakPolarHBondContact O-CB 3.35Å; F423-Y427 PolarHBondContact O-N 2.9Å
424	L	97.1	Very high	92.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.3	-43.8	-177.5	-62.3	175.9	0	0	0	112.2	F399 L402 L406 L420 L421 A428 L466	F399-L424 HydrophobicContact CD2-CD2 3.76Å; F399-L424 HydrophobicContact CE2-CB 4.34Å; F399-L424 HydrophobicContact CE2-CD2 3.55Å; L402-L424 HydrophobicContact CD2-CD2 4.14Å; L406-L424 HydrophobicContact CD1-CD1 4.22Å; L420-L424 HydrophobicContact CD2-CD1 4.22Å; L420-L424 HydrophobicContact CD2-CD2 3.94Å; L420-L424 HydrophobicContact CD2-CG 4.08Å; L420-L424 HydrophobicContact CG-CD1 4.4Å; L420-L424 HydrophobicContact CG-CD2 4.28Å; L420-L424 HydrophobicContact CG-CG 4.02Å; L420-L424 PolarHBondContact O-N 3.12Å; L420-L424 VanDerWaalsContact O-N 3.1Å; L421-L424 HydrophobicContact CD2-CD1 4.4Å; L421-L424 PolarHBondContact O-N 2.94Å; L424-A428 WeakPolarHBondContact O-CB 3.46Å; L424-A428 PolarHBondContact O-N 3.16Å; L424-L466 HydrophobicContact CB-CD1 4.15Å; L424-L466 HydrophobicContact CB-CD2 3.94Å; L424-L466 HydrophobicContact CD1-CD1 4.07Å
425	I	96.9	Very high	91.1	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-68.2	-41.2	176.7	-63	-61.5	0	0	0	110.9	L421 F423 R429 L466 L470 L483 V486 A488 L491	L421-I425 WeakPolarHBondContact O-CG1 3.17Å; L421-I425 PolarHBondContact O-N 3.17Å; F423-I425 VanDerWaalsContact C-N 3.35Å; F423-I425 PolarHBondContact O-N 3.4Å; I425-R429 WeakPolarHBondContact O-CB 3.43Å; I425-R429 PolarHBondContact O-N 3.48Å; I425-L466 HydrophobicContact CD1-CD2 4.19Å; I425-L470 HydrophobicContact CD1-CD1 4.15Å; I425-L470 HydrophobicContact CD1-CD2 3.91Å; I425-L483 HydrophobicContact CD1-CD2 3.93Å; I425-L483 HydrophobicContact CG1-CD2 4Å; I425-V486 HydrophobicContact CB-CG2 4.02Å; I425-V486 HydrophobicContact CG1-CG2 3.91Å; I425-V486 HydrophobicContact CG2-CG2 3.93Å; I425-A488 HydrophobicContact CD1-CB 3.9Å; I425-A488 HydrophobicContact CG1-CB 4.3Å; I425-L491 HydrophobicContact CD1-CD2 4.47Å; I425-L491 HydrophobicContact CG2-CD2 3.95Å
426	G	95.3	Very high	89	Confident	26 Å²	26	35.9 Å²	35.9	27%	0.268	22%	0.217	S	C	.	.	H	α-helix	trans	-60.9	-45.5	175.9	0	0	0	0	0	112.8	P422 F423 R429 C430	P422-G426 PolarHBondContact O-N 3.37Å; F423-G426 PolarHBondContact O-N 3.03Å; F423-G426 VanDerWaalsContact O-N 3.17Å; G426-R429 PolarHBondContact O-N 3.42Å; G426-C430 PolarHBondContact O-N 3.46Å
427	Y	94.4	Very high	86.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-51.9	176.8	-172.9	-91.8	0	0	0	111.4	F390 V395 L396 F399 F423 R429 C430 H431 A462	F390-Y427 HydrophobicContact CB-CD2 4.09Å; F390-Y427 HydrophobicContact CB-CE2 3.94Å; F390-Y427 AromaticContact CD1-CD2 3.65Å; F390-Y427 HydrophobicContact CD1-CD2 3.65Å; F390-Y427 HydrophobicContact CD1-CE2 4.1Å; F390-Y427 AromaticContact CD2-CD2 3.96Å; F390-Y427 HydrophobicContact CD2-CD2 3.96Å; F390-Y427 AromaticContact CE1-CD2 3.99Å; F390-Y427 HydrophobicContact CE1-CD2 3.99Å; F390-Y427 HydrophobicContact CE2-CD2 4.28Å; F390-Y427 AromaticContact CG-CD2 3.63Å; F390-Y427 HydrophobicContact CG-CD2 3.63Å; F390-Y427 AromaticContact CG-CE2 3.99Å; F390-Y427 HydrophobicContact CG-CE2 3.99Å; F390-Y427 HydrophobicContact CZ-CD2 4.28Å; F390-Y427 WeakPolarHBondContact O-CE2 3.36Å; F390-Y427 PolarHBondContact O-OH 3.43Å; V395-Y427 HydrophobicContact CG1-CD2 4.38Å; V395-Y427 HydrophobicContact CG1-CE2 3.68Å; L396-Y427 WeakPolarHBondContact CA-OH 3.39Å; F399-Y427 HydrophobicContact CB-CE1 4.26Å; F399-Y427 HydrophobicContact CD1-CD1 4.04Å; F399-Y427 AromaticContact CD1-CE1 3.86Å; F399-Y427 HydrophobicContact CD1-CE1 3.86Å; F399-Y427 AromaticContact CD2-CD1 3.64Å; F399-Y427 HydrophobicContact CD2-CD1 3.64Å; F399-Y427 HydrophobicContact CD2-CE1 4.11Å; F399-Y427 HydrophobicContact CD2-CG 4.12Å; F399-Y427 HydrophobicContact CE1-CD1 4.06Å; F399-Y427 HydrophobicContact CE1-CE1 4.2Å; F399-Y427 AromaticContact CE2-CD1 3.65Å; F399-Y427 HydrophobicContact CE2-CD1 3.65Å; F399-Y427 HydrophobicContact CE2-CE1 4.42Å; F399-Y427 HydrophobicContact CE2-CG 4.21Å; F399-Y427 AromaticContact CG-CD1 3.84Å; F399-Y427 HydrophobicContact CG-CD1 3.84Å; F399-Y427 AromaticContact CG-CE1 3.81Å; F399-Y427 HydrophobicContact CG-CE1 3.81Å; F399-Y427 AromaticContact CZ-CD1 3.86Å; F399-Y427 HydrophobicContact CZ-CD1 3.86Å; F399-Y427 HydrophobicContact CZ-CE1 4.46Å; F423-Y427 HydrophobicContact CZ-CD2 4.28Å; F423-Y427 WeakPolarHBondContact O-CB 3.35Å; F423-Y427 PolarHBondContact O-N 2.9Å; Y427-R429 VanDerWaalsContact C-N 3.3Å; Y427-R429 PolarHBondContact O-N 3.2Å; Y427-C430 PolarHBondContact O-N 3.35Å; Y427-H431 AromaticContact CD1-CD2 3.9Å; Y427-H431 AromaticContact CE1-CD2 3.52Å; Y427-H431 AromaticContact CE1-NE2 3.78Å; Y427-H431 AromaticContact CE2-CD2 3.97Å; Y427-H431 AromaticContact CE2-NE2 3.66Å; Y427-H431 AromaticContact CZ-CD2 3.55Å; Y427-H431 AromaticContact CZ-NE2 3.3Å; Y427-H431 VanDerWaalsContact CZ-NE2 3.3Å; Y427-H431 PolarHBondContact O-CD2 2.87Å; Y427-H431 PolarHBondContact O-N 3Å; Y427-H431 PolarHBondContact OH-NE2 2.91Å; Y427-A462 HydrophobicContact CD1-CB 4.09Å; Y427-A462 HydrophobicContact CE1-CB 3.92Å
428	A	94.1	Very high	83.8	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-37.4	178.4	0	0	0	0	0	112.6	L424 L432 L463 L466 L491	L424-A428 WeakPolarHBondContact O-CB 3.46Å; L424-A428 PolarHBondContact O-N 3.16Å; A428-L432 WeakPolarHBondContact O-CB 3.46Å; A428-L432 PolarHBondContact O-N 3.2Å; A428-L463 HydrophobicContact CB-CB 4.12Å; A428-L463 HydrophobicContact CB-CD1 4.08Å; A428-L466 HydrophobicContact CB-CD2 4.09Å; A428-L491 HydrophobicContact CB-CD2 4.26Å
429	R	93.6	Very high	81.2	Confident	71 Å²	71	46.2 Å²	46.2	27%	0.268	28%	0.281	S	S	.	.	H	α-helix	trans	-65.8	-45.4	176.9	-178.5	179	-66	158.9	1	112.2	I425 G426 Y427 L432 Q433 V486 D487 L491	I425-R429 WeakPolarHBondContact O-CB 3.43Å; I425-R429 PolarHBondContact O-N 3.48Å; G426-R429 PolarHBondContact O-N 3.42Å; Y427-R429 VanDerWaalsContact C-N 3.3Å; Y427-R429 PolarHBondContact O-N 3.2Å; R429-L432 PolarHBondContact O-N 3.12Å; R429-Q433 HydrophobicContact CG-CG 4.46Å; R429-Q433 WeakPolarHBondContact O-CB 3.36Å; R429-Q433 WeakPolarHBondContact O-CG 3.47Å; R429-Q433 PolarHBondContact O-N 2.93Å; R429-V486 PolarHBondContact NH2-O 3.36Å; R429-D487 PolarHBondContact NH2-O 3.2Å; R429-L491 HydrophobicContact CB-CD1 3.99Å; R429-L491 HydrophobicContact CB-CD2 4.31Å; R429-L491 HydrophobicContact CG-CD1 4.25Å
430	C	91.4	Very high	78.5	Confident	33 Å²	33	46 Å²	46	22%	0.223	28%	0.275	C	S	.	.	H	α-helix	trans	-57.6	-52.3	179.6	-164.4	0	0	0	0	110.8	F390 G426 Y427 L432 Q433 E434	F390-C430 HydrophobicContact CD2-CB 3.58Å; F390-C430 HydrophobicContact CE2-CB 3.98Å; G426-C430 PolarHBondContact O-N 3.46Å; Y427-C430 PolarHBondContact O-N 3.35Å; C430-L432 PolarHBondContact O-N 3.11Å; C430-Q433 PolarHBondContact O-N 2.95Å; C430-Q433 VanDerWaalsContact O-N 3.11Å; C430-E434 WeakPolarHBondContact O-CG 3.36Å; C430-E434 PolarHBondContact O-N 3.13Å
431	H	87.5	Confident	75.7	Confident	13 Å²	13	53.3 Å²	53.3	6%	0.06	31%	0.313	C	S	.	.	H	α-helix	trans	-64.7	-34.8	179.5	-81.8	-72.5	0	0	0	113.8	F390 Y427 G435 G459 A462	F390-H431 PolarHBondContact O-CE1 3.23Å; F390-H431 PolarHBondContact O-NE2 2.61Å; Y427-H431 AromaticContact CD1-CD2 3.9Å; Y427-H431 AromaticContact CE1-CD2 3.52Å; Y427-H431 AromaticContact CE1-NE2 3.78Å; Y427-H431 AromaticContact CE2-CD2 3.97Å; Y427-H431 AromaticContact CE2-NE2 3.66Å; Y427-H431 AromaticContact CZ-CD2 3.55Å; Y427-H431 AromaticContact CZ-NE2 3.3Å; Y427-H431 VanDerWaalsContact CZ-NE2 3.3Å; Y427-H431 PolarHBondContact O-CD2 2.87Å; Y427-H431 PolarHBondContact O-N 3Å; Y427-H431 PolarHBondContact OH-NE2 2.91Å; H431-G435 PolarHBondContact O-N 3.12Å; H431-G459 WeakPolarHBondContact CB-O 3.48Å; H431-G459 WeakPolarHBondContact ND1-CA 3.4Å; H431-A462 HydrophobicContact CB-CB 3.99Å
432	L	86	Confident	73	Confident	22 Å²	22	56.5 Å²	56.5	12%	0.115	34%	0.336	C	S	.	.	H	α-helix	trans	-65.7	-42.1	173.5	-172	68.1	0	0	0	110.6	A428 R429 C430 L463 L491 D494 F495 R498	A428-L432 WeakPolarHBondContact O-CB 3.46Å; A428-L432 PolarHBondContact O-N 3.2Å; R429-L432 PolarHBondContact O-N 3.12Å; C430-L432 PolarHBondContact O-N 3.11Å; L432-L463 HydrophobicContact CD2-CD2 4.3Å; L432-L491 HydrophobicContact CB-CD1 4.48Å; L432-L491 HydrophobicContact CD2-CD1 3.58Å; L432-D494 HydrophobicContact CD2-CB 4.44Å; L432-F495 HydrophobicContact CD1-CD2 4.22Å; L432-F495 HydrophobicContact CD2-CB 4.21Å; L432-R498 PolarHBondContact O-NH1 3.43Å
433	Q	82.8	Confident	70.1	Confident	107 Å²	107	56.9 Å²	56.9	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-71.3	-41.3	-179.1	-72.3	176.9	-8.7	0	0	113.1	R429 C430 G435 A436	R429-Q433 HydrophobicContact CG-CG 4.46Å; R429-Q433 WeakPolarHBondContact O-CB 3.36Å; R429-Q433 WeakPolarHBondContact O-CG 3.47Å; R429-Q433 PolarHBondContact O-N 2.93Å; C430-Q433 PolarHBondContact O-N 2.95Å; C430-Q433 VanDerWaalsContact O-N 3.11Å; Q433-G435 VanDerWaalsContact C-N 3.28Å; Q433-G435 PolarHBondContact O-N 3.46Å; Q433-A436 WeakPolarHBondContact O-CB 3.31Å; Q433-A436 PolarHBondContact O-N 3.21Å
434	E	69.3	Low	67.3	Low	109 Å²	109	62.7 Å²	62.7	51%	0.509	36%	0.355	S	S	.	.	H	α-helix	trans	-60.8	-37.2	175.6	-73.3	179.2	175.4	0	0	111.9	C430 A436 A437	C430-E434 WeakPolarHBondContact O-CG 3.36Å; C430-E434 PolarHBondContact O-N 3.13Å; E434-A436 PolarHBondContact O-N 2.96Å; E434-A436 VanDerWaalsContact O-N 3.1Å; E434-A437 WeakPolarHBondContact O-CB 3.45Å; E434-A437 PolarHBondContact O-N 2.71Å; E434-A437 VanDerWaalsContact O-N 3.08Å
435	G	56.3	Low	64.5	Low	47 Å²	47	66.8 Å²	66.8	49%	0.485	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-9.6	172.9	0	0	0	0	0	115.5	H431 Q433	H431-G435 PolarHBondContact O-N 3.12Å; Q433-G435 VanDerWaalsContact C-N 3.28Å; Q433-G435 PolarHBondContact O-N 3.46Å
436	A	49.4	Very low	61.7	Low	63 Å²	63	68.8 Å²	68.8	52%	0.521	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-7.2	173.8	0	0	0	0	0	114.2	Q433 E434 R498	Q433-A436 WeakPolarHBondContact O-CB 3.31Å; Q433-A436 PolarHBondContact O-N 3.21Å; E434-A436 PolarHBondContact O-N 2.96Å; E434-A436 VanDerWaalsContact O-N 3.1Å; A436-R498 VanDerWaalsContact CB-NH1 3.34Å
437	A	46.1	Very low	58.6	Low	68 Å²	68	75.5 Å²	75.5	56%	0.562	42%	0.415	S	S	*	.	S	Bend	trans	-69.6	147.8	165.9	0	0	0	0	0	109.3	E434	E434-A437 WeakPolarHBondContact O-CB 3.45Å; E434-A437 PolarHBondContact O-N 2.71Å; E434-A437 VanDerWaalsContact O-N 3.08Å
438	E	37.6	Very low	55.6	Low	189 Å²	189	81.1 Å²	81.1	88%	0.883	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-50.5	131.8	-177.5	-86.3	-153.6	159.5	0	0	110.8	S440	E438-S440 PolarHBondContact O-N 2.55Å
439	P	40.4	Very low	52.5	Low	61 Å²	61	85.2 Å²	85.2	40%	0.396	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-59.5	119.2	-178.9	22.9	-31.3	0	0	0	108.6	D443	P439-D443 HydrophobicContact CB-CB 4.23Å
440	S	39.8	Very low	49.3	Very low	62 Å²	62	87.3 Å²	87.3	43%	0.434	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-50.5	148.6	168.2	163.4	0	0	0	0	109.5	E438 S442 D443 W444	E438-S440 PolarHBondContact O-N 2.55Å; S440-S442 WeakPolarHBondContact CB-OG 2.94Å; S440-S442 PolarHBondContact O-N 3.18Å; S440-S442 PolarHBondContact OG-N 3.18Å; S440-S442 VanDerWaalsContact OG-N 3.17Å; S440-S442 PolarHBondContact OG-OG 3.21Å; S440-D443 PolarHBondContact O-N 3.37Å; S440-W444 PolarHBondContact O-N 3.3Å
441	L	39.3	Very low	46.2	Very low	154 Å²	154	88.7 Å²	88.7	81%	0.806	50%	0.503	S	S	*	.	H	α-helix	trans	-50.8	-27.4	173	-139	86.1	0	0	0	111.9	T445	L441-T445 PolarHBondContact O-N 2.93Å; L441-T445 VanDerWaalsContact O-N 3.12Å; L441-T445 PolarHBondContact O-OG1 3.24Å; L441-T445 VanDerWaalsContact O-OG1 3.09Å
442	S	40.4	Very low	43.6	Very low	68 Å²	68	97 Å²	97	48%	0.476	54%	0.542	S	S	.	.	H	α-helix	trans	-68.6	-41.6	174.3	62.3	0	0	0	0	113.8	S440 T445 A446	S440-S442 WeakPolarHBondContact CB-OG 2.94Å; S440-S442 PolarHBondContact O-N 3.18Å; S440-S442 PolarHBondContact OG-N 3.18Å; S440-S442 VanDerWaalsContact OG-N 3.17Å; S440-S442 PolarHBondContact OG-OG 3.21Å; S442-T445 VanDerWaalsContact C-OG1 3.29Å; S442-T445 VanDerWaalsContact CA-OG1 3.28Å; S442-T445 WeakPolarHBondContact CA-OG1 3.5Å; S442-T445 PolarHBondContact O-N 3.16Å; S442-T445 PolarHBondContact O-OG1 3.49Å; S442-A446 PolarHBondContact O-N 2.99Å
443	D	37.6	Very low	40.9	Very low	70 Å²	70	98 Å²	98	37%	0.374	56%	0.558	S	S	.	*	H	α-helix	trans	-70.6	-36.7	176.4	-84.1	-5.5	0	0	0	110.9	P439 S440 T445 A446 R447	P439-D443 HydrophobicContact CB-CB 4.23Å; S440-D443 PolarHBondContact O-N 3.37Å; D443-T445 VanDerWaalsContact C-N 3.29Å; D443-T445 PolarHBondContact O-N 3.24Å; D443-A446 PolarHBondContact O-N 2.87Å; D443-R447 WeakPolarHBondContact O-CB 3.46Å; D443-R447 VanDerWaalsContact O-CG 3.23Å; D443-R447 WeakPolarHBondContact O-CG 3.26Å; D443-R447 PolarHBondContact O-N 2.68Å
444	W	37.9	Very low	38.5	Very low	151 Å²	151	95.3 Å²	95.3	57%	0.572	56%	0.559	S	S	*	*	H	α-helix	trans	-60.2	-41.1	172	-129.5	85.5	0	0	0	111.3	S440 R447 L448	S440-W444 PolarHBondContact O-N 3.3Å; W444-R447 PolarHBondContact O-N 2.88Å; W444-L448 HydrophobicContact CE3-CD1 3.48Å; W444-L448 VanDerWaalsContact CE3-CD1 3.48Å; W444-L448 HydrophobicContact CE3-CD2 4.32Å; W444-L448 HydrophobicContact CE3-CG 3.88Å; W444-L448 HydrophobicContact CZ3-CD1 3.65Å; W444-L448 HydrophobicContact CZ3-CD2 3.93Å; W444-L448 HydrophobicContact CZ3-CG 3.99Å; W444-L448 VanDerWaalsContact O-CG 3.29Å; W444-L448 WeakPolarHBondContact O-CG 3.49Å; W444-L448 PolarHBondContact O-N 3.38Å
445	T	38.7	Very low	36.7	Very low	87 Å²	87	93.1 Å²	93.1	53%	0.534	57%	0.565	S	S	.	*	H	α-helix	trans	-70.1	-33.6	175.3	43.4	0	0	0	0	114.1	L441 S442 D443 L448 S449	L441-T445 PolarHBondContact O-N 2.93Å; L441-T445 VanDerWaalsContact O-N 3.12Å; L441-T445 PolarHBondContact O-OG1 3.24Å; L441-T445 VanDerWaalsContact O-OG1 3.09Å; S442-T445 VanDerWaalsContact C-OG1 3.29Å; S442-T445 VanDerWaalsContact CA-OG1 3.28Å; S442-T445 WeakPolarHBondContact CA-OG1 3.5Å; S442-T445 PolarHBondContact O-N 3.16Å; S442-T445 PolarHBondContact O-OG1 3.49Å; D443-T445 VanDerWaalsContact C-N 3.29Å; D443-T445 PolarHBondContact O-N 3.24Å; T445-L448 PolarHBondContact O-N 2.9Å; T445-S449 PolarHBondContact O-N 3.36Å; T445-S449 PolarHBondContact O-OG 3.42Å
446	A	37.9	Very low	35.7	Very low	43 Å²	43	95.2 Å²	95.2	36%	0.355	58%	0.578	S	S	.	*	H	α-helix	trans	-70.2	-33.4	174	0	0	0	0	0	112.3	S442 D443 S449	S442-A446 PolarHBondContact O-N 2.99Å; D443-A446 PolarHBondContact O-N 2.87Å; A446-S449 WeakPolarHBondContact CA-OG 3.43Å; A446-S449 PolarHBondContact O-N 3.43Å; A446-S449 PolarHBondContact O-OG 2.9Å
447	R	30.7	Very low	35.6	Very low	167 Å²	167	97.3 Å²	97.3	63%	0.63	57%	0.572	S	S	*	*	H	α-helix	trans	-77	-19.1	174.6	-68.5	176.6	87	176.8	9.6	113.7	D443 W444 V450	D443-R447 WeakPolarHBondContact O-CB 3.46Å; D443-R447 VanDerWaalsContact O-CG 3.23Å; D443-R447 WeakPolarHBondContact O-CG 3.26Å; D443-R447 PolarHBondContact O-N 2.68Å; W444-R447 PolarHBondContact O-N 2.88Å; R447-V450 WeakPolarHBondContact O-CG2 3.49Å
448	L	31	Very low	35.6	Very low	117 Å²	117	96.7 Å²	96.7	61%	0.613	56%	0.562	S	S	*	*	H	α-helix	trans	-83.3	-14.2	173.1	-75.6	171.2	0	0	0	113.2	W444 T445 V450	W444-L448 HydrophobicContact CE3-CD1 3.48Å; W444-L448 VanDerWaalsContact CE3-CD1 3.48Å; W444-L448 HydrophobicContact CE3-CD2 4.32Å; W444-L448 HydrophobicContact CE3-CG 3.88Å; W444-L448 HydrophobicContact CZ3-CD1 3.65Å; W444-L448 HydrophobicContact CZ3-CD2 3.93Å; W444-L448 HydrophobicContact CZ3-CG 3.99Å; W444-L448 VanDerWaalsContact O-CG 3.29Å; W444-L448 WeakPolarHBondContact O-CG 3.49Å; W444-L448 PolarHBondContact O-N 3.38Å; T445-L448 PolarHBondContact O-N 2.9Å; L448-V450 VanDerWaalsContact C-N 3.25Å; L448-V450 PolarHBondContact O-N 3.5Å
449	S	28.7	Very low	36.1	Very low	88 Å²	88	88.6 Å²	88.6	62%	0.615	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	23.8	175.6	37.3	0	0	0	0	114.1	T445 A446 S451	T445-S449 PolarHBondContact O-N 3.36Å; T445-S449 PolarHBondContact O-OG 3.42Å; A446-S449 WeakPolarHBondContact CA-OG 3.43Å; A446-S449 PolarHBondContact O-N 3.43Å; A446-S449 PolarHBondContact O-OG 2.9Å; S449-S451 PolarHBondContact O-N 3.34Å
450	V	27.2	Very low	36.8	Very low	114 Å²	114	89 Å²	89	69%	0.691	53%	0.531	S	S	*	.			trans	-57.2	106.3	-179.6	170.7	0	0	0	0	111.4	R447 L448	R447-V450 WeakPolarHBondContact O-CG2 3.49Å; L448-V450 VanDerWaalsContact C-N 3.25Å; L448-V450 PolarHBondContact O-N 3.5Å
451	S	25.9	Very low	38.4	Very low	63 Å²	63	86.5 Å²	86.5	44%	0.441	52%	0.515	S	S	.	.			trans	-88.7	136	139.2	177.1	0	0	0	0	107.2	S449 G453	S449-S451 PolarHBondContact O-N 3.34Å; S451-G453 VanDerWaalsContact C-N 3.32Å; S451-G453 PolarHBondContact O-N 3.06Å; S451-G453 PolarHBondContact OG-O 3.44Å
452	E	32.1	Very low	40.7	Very low	188 Å²	188	79.2 Å²	79.2	88%	0.879	48%	0.476	S	S	*	.	S	Bend	trans	-66.1	94.4	167.3	-72.8	-169.8	155.1	0	0	108.2
453	G	30.3	Very low	43.2	Very low	42 Å²	42	76.1 Å²	76.1	43%	0.433	46%	0.455	S	S	.	.	S	Bend	trans	112.2	106.8	-175.9	0	0	0	0	0	111.1	S451	S451-G453 VanDerWaalsContact C-N 3.32Å; S451-G453 PolarHBondContact O-N 3.06Å; S451-G453 PolarHBondContact OG-O 3.44Å
454	G	31.5	Very low	45.7	Very low	51 Å²	51	77.2 Å²	77.2	53%	0.526	45%	0.453	S	S	.	.			trans	98	45.3	170.8	0	0	0	0	0	116.9
455	G	31.2	Very low	48.2	Very low	62 Å²	62	72.8 Å²	72.8	64%	0.639	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-79.3	141.6	165.7	0	0	0	0	0	112.1	W457	G455-W457 PolarHBondContact O-N 2.91Å
456	A	37.1	Very low	50.9	Low	92 Å²	92	68.7 Å²	68.7	76%	0.76	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-51.7	124.7	168.6	0	0	0	0	0	110.1	T458	A456-T458 PolarHBondContact O-N 3.46Å
457	W	47.3	Very low	53.7	Low	106 Å²	106	66.6 Å²	66.6	40%	0.402	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-65	123.9	-167.3	-136.9	76.2	0	0	0	111.8	L396 G455 Y465	L396-W457 HydrophobicContact CD1-CE3 4Å; L396-W457 HydrophobicContact CD1-CH2 4.16Å; L396-W457 HydrophobicContact CD1-CZ3 3.45Å; L396-W457 VanDerWaalsContact CD1-CZ3 3.45Å; L396-W457 HydrophobicContact CD2-CD2 4.4Å; L396-W457 HydrophobicContact CD2-CE3 3.52Å; L396-W457 HydrophobicContact CD2-CZ3 3.89Å; L396-W457 HydrophobicContact CG-CE3 4.35Å; L396-W457 HydrophobicContact CG-CZ3 4.27Å; G455-W457 PolarHBondContact O-N 2.91Å; W457-Y465 AromaticContact CE2-CE2 3.63Å; W457-Y465 AromaticContact CE2-CZ 3.78Å; W457-Y465 VanDerWaalsContact CE2-OH 3.28Å; W457-Y465 AromaticContact CH2-CD2 3.57Å; W457-Y465 HydrophobicContact CH2-CD2 3.57Å; W457-Y465 AromaticContact CH2-CE2 3.13Å; W457-Y465 HydrophobicContact CH2-CE2 3.13Å; W457-Y465 AromaticContact CZ2-CD2 3.66Å; W457-Y465 HydrophobicContact CZ2-CD2 3.66Å; W457-Y465 HydrophobicContact CZ2-CE1 4.45Å; W457-Y465 AromaticContact CZ2-CE2 2.86Å; W457-Y465 HydrophobicContact CZ2-CE2 2.86Å; W457-Y465 AromaticContact CZ2-CZ 3.32Å; W457-Y465 WeakPolarHBondContact CZ2-OH 3.43Å; W457-Y465 HydrophobicContact CZ3-CE2 4.14Å; W457-Y465 AromaticContact NE1-CZ 3.95Å; W457-Y465 PolarHBondContact NE1-OH 3.18Å
458	T	44.7	Very low	56.6	Low	55 Å²	55	60.8 Å²	60.8	34%	0.337	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-90.8	128.5	164.1	54	0	0	0	0	106.9	A456 T460 G461	A456-T458 PolarHBondContact O-N 3.46Å; T458-T460 PolarHBondContact O-N 3.07Å; T458-T460 PolarHBondContact O-OG1 3.1Å; T458-T460 PolarHBondContact OG1-OG1 3.03Å; T458-G461 PolarHBondContact O-N 2.97Å
459	G	48.6	Very low	59.7	Low	20 Å²	20	55.2 Å²	55.2	21%	0.206	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-49.2	-12.9	-175.9	0	0	0	0	0	116.3	H431 G461 A462	H431-G459 WeakPolarHBondContact CB-O 3.48Å; H431-G459 WeakPolarHBondContact ND1-CA 3.4Å; G459-G461 PolarHBondContact O-N 3.45Å; G459-A462 PolarHBondContact O-N 3.07Å
460	T	55.7	Low	62.9	Low	70 Å²	70	51.2 Å²	51.2	43%	0.429	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-46.1	-16.3	171.6	57.5	0	0	0	0	116.6	T458	T458-T460 PolarHBondContact O-N 3.07Å; T458-T460 PolarHBondContact O-OG1 3.1Å; T458-T460 PolarHBondContact OG1-OG1 3.03Å
461	G	72.7	Confident	66.1	Low	9 Å²	9	47.2 Å²	47.2	9%	0.093	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-91.4	-1.5	177.6	0	0	0	0	0	115.6	T458 G459 L463 R464 Y465	T458-G461 PolarHBondContact O-N 2.97Å; G459-G461 PolarHBondContact O-N 3.45Å; G461-L463 VanDerWaalsContact C-N 3.32Å; G461-L463 PolarHBondContact O-N 3.24Å; G461-R464 WeakPolarHBondContact O-CA 3.46Å; G461-R464 VanDerWaalsContact O-CB 3.29Å; G461-R464 WeakPolarHBondContact O-CB 3.38Å; G461-R464 PolarHBondContact O-N 2.92Å; G461-Y465 PolarHBondContact O-N 3.14Å
462	A	88.3	Confident	69.4	Low	0 Å²	0	48.6 Å²	48.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-55.2	-45.1	-170.1	0	0	0	0	0	113	F399 Y427 H431 G459 R464 Y465 L466	F399-A462 HydrophobicContact CE1-CB 4.18Å; F399-A462 WeakPolarHBondContact CE1-O 3.46Å; Y427-A462 HydrophobicContact CD1-CB 4.09Å; Y427-A462 HydrophobicContact CE1-CB 3.92Å; H431-A462 HydrophobicContact CB-CB 3.99Å; G459-A462 PolarHBondContact O-N 3.07Å; A462-R464 VanDerWaalsContact C-N 3.27Å; A462-R464 PolarHBondContact O-N 3.41Å; A462-Y465 PolarHBondContact O-N 3.37Å; A462-L466 PolarHBondContact O-N 3.22Å
463	L	91.9	Very high	72.5	Confident	4 Å²	4	39.8 Å²	39.8	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-32	176.8	-175	56.6	0	0	0	112.6	A428 L432 G461 Y465 L466 L467 L470 L491 L492 F495	A428-L463 HydrophobicContact CB-CB 4.12Å; A428-L463 HydrophobicContact CB-CD1 4.08Å; L432-L463 HydrophobicContact CD2-CD2 4.3Å; G461-L463 VanDerWaalsContact C-N 3.32Å; G461-L463 PolarHBondContact O-N 3.24Å; L463-Y465 VanDerWaalsContact C-N 3.31Å; L463-Y465 PolarHBondContact O-N 3.04Å; L463-L466 PolarHBondContact O-N 3.06Å; L463-L466 VanDerWaalsContact O-N 3.15Å; L463-L467 HydrophobicContact CD1-CG 4.45Å; L463-L467 HydrophobicContact CG-CG 4.3Å; L463-L467 VanDerWaalsContact O-CG 3.26Å; L463-L467 WeakPolarHBondContact O-CG 3.44Å; L463-L467 PolarHBondContact O-N 3.07Å; L463-L470 HydrophobicContact CD1-CD1 4.08Å; L463-L491 HydrophobicContact CD1-CD2 4.11Å; L463-L491 HydrophobicContact CD1-CG 4.49Å; L463-L491 HydrophobicContact CD2-CD1 4.28Å; L463-L491 HydrophobicContact CD2-CD2 4.44Å; L463-L491 HydrophobicContact CD2-CG 4.01Å; L463-L492 HydrophobicContact CD1-CD2 4.4Å; L463-F495 HydrophobicContact CD2-CB 3.51Å; L463-F495 HydrophobicContact CD2-CD1 4.48Å; L463-F495 HydrophobicContact CD2-CD2 3.78Å; L463-F495 HydrophobicContact CD2-CG 3.66Å; L463-F495 HydrophobicContact CG-CD2 4.44Å
464	R	91.4	Very high	75.6	Confident	92 Å²	92	38 Å²	38	35%	0.347	24%	0.237	S	C	.	.	H	α-helix	trans	-63.6	-36.2	178.6	-63.8	177.3	173.4	-107	-1.2	112.4	G461 A462 F495 D514	G461-R464 WeakPolarHBondContact O-CA 3.46Å; G461-R464 VanDerWaalsContact O-CB 3.29Å; G461-R464 WeakPolarHBondContact O-CB 3.38Å; G461-R464 PolarHBondContact O-N 2.92Å; A462-R464 VanDerWaalsContact C-N 3.27Å; A462-R464 PolarHBondContact O-N 3.41Å; R464-F495 HydrophobicContact CG-CE2 4.07Å; R464-F495 HydrophobicContact CG-CZ 4.11Å; R464-D514 IonicContact CZ-OD1 2.87Å; R464-D514 IonicContact CZ-OD2 3.94Å; R464-D514 IonicContact NH1-OD1 3.57Å; R464-D514 PolarHBondContact NH1-OD1 3.04Å; R464-D514 IonicContact NH1-OD2 2.83Å; R464-D514 PolarHBondContact NH1-OD2 3.47Å; R464-D514 IonicContact NH2-OD2 3.63Å; R464-D514 PolarHBondContact NH2-OD2 2.92Å
465	Y	90.4	Very high	78.7	Confident	59 Å²	59	38.1 Å²	38.1	23%	0.231	23%	0.233	C	C	.	.	H	α-helix	trans	-70.5	-36.4	173.4	-66.8	-51.3	0	0	0	112.5	R400 C403 W457 G461 A462 L463 P468	R400-Y465 HydrophobicContact CB-CD2 4.31Å; R400-Y465 HydrophobicContact CB-CE2 4.28Å; R400-Y465 HydrophobicContact CG-CD1 4.31Å; R400-Y465 HydrophobicContact CG-CD2 4.13Å; R400-Y465 HydrophobicContact CG-CE1 4.21Å; R400-Y465 HydrophobicContact CG-CE2 3.9Å; R400-Y465 HydrophobicContact CG-CG 4.31Å; R400-Y465 PolarHBondContact NH1-OH 3.41Å; C403-Y465 WeakPolarHBondContact CB-O 3.49Å; W457-Y465 AromaticContact CE2-CE2 3.63Å; W457-Y465 AromaticContact CE2-CZ 3.78Å; W457-Y465 VanDerWaalsContact CE2-OH 3.28Å; W457-Y465 AromaticContact CH2-CD2 3.57Å; W457-Y465 HydrophobicContact CH2-CD2 3.57Å; W457-Y465 AromaticContact CH2-CE2 3.13Å; W457-Y465 HydrophobicContact CH2-CE2 3.13Å; W457-Y465 AromaticContact CZ2-CD2 3.66Å; W457-Y465 HydrophobicContact CZ2-CD2 3.66Å; W457-Y465 HydrophobicContact CZ2-CE1 4.45Å; W457-Y465 AromaticContact CZ2-CE2 2.86Å; W457-Y465 HydrophobicContact CZ2-CE2 2.86Å; W457-Y465 AromaticContact CZ2-CZ 3.32Å; W457-Y465 WeakPolarHBondContact CZ2-OH 3.43Å; W457-Y465 HydrophobicContact CZ3-CE2 4.14Å; W457-Y465 AromaticContact NE1-CZ 3.95Å; W457-Y465 PolarHBondContact NE1-OH 3.18Å; G461-Y465 PolarHBondContact O-N 3.14Å; A462-Y465 PolarHBondContact O-N 3.37Å; L463-Y465 VanDerWaalsContact C-N 3.31Å; L463-Y465 PolarHBondContact O-N 3.04Å; Y465-P468 WeakPolarHBondContact O-CD 3.5Å
466	L	95.1	Very high	81.7	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-76.9	-24.4	-177	-174.7	59.2	0	0	0	113	F399 L424 I425 A428 A462 L463 A469 L470	F399-L466 HydrophobicContact CZ-CB 4.08Å; F399-L466 HydrophobicContact CZ-CD2 4.32Å; L424-L466 HydrophobicContact CB-CD1 4.15Å; L424-L466 HydrophobicContact CB-CD2 3.94Å; L424-L466 HydrophobicContact CD1-CD1 4.07Å; I425-L466 HydrophobicContact CD1-CD2 4.19Å; A428-L466 HydrophobicContact CB-CD2 4.09Å; A462-L466 PolarHBondContact O-N 3.22Å; L463-L466 PolarHBondContact O-N 3.06Å; L463-L466 VanDerWaalsContact O-N 3.15Å; L466-A469 HydrophobicContact CD1-CB 4.4Å; L466-A469 WeakPolarHBondContact O-CB 3.36Å; L466-A469 PolarHBondContact O-N 3.17Å; L466-L470 HydrophobicContact CD2-CD1 4.15Å; L466-L470 HydrophobicContact CD2-CD2 4.48Å; L466-L470 HydrophobicContact CD2-CG 4.41Å; L466-L470 HydrophobicContact CG-CD1 3.97Å; L466-L470 HydrophobicContact CG-CD2 4.27Å; L466-L470 HydrophobicContact CG-CG 3.88Å; L466-L470 WeakPolarHBondContact O-CG 3.29Å; L466-L470 PolarHBondContact O-N 3.05Å
467	L	95.2	Very high	84.5	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-55.7	-46.1	-173.3	-89.5	169.8	0	0	0	115.5	L463 A469 L470 C471 L492 F495 S516 T519 A520	L463-L467 HydrophobicContact CD1-CG 4.45Å; L463-L467 HydrophobicContact CG-CG 4.3Å; L463-L467 VanDerWaalsContact O-CG 3.26Å; L463-L467 WeakPolarHBondContact O-CG 3.44Å; L463-L467 PolarHBondContact O-N 3.07Å; L467-A469 VanDerWaalsContact C-N 3.32Å; L467-A469 PolarHBondContact O-N 3.11Å; L467-L470 PolarHBondContact O-N 3.22Å; L467-L470 VanDerWaalsContact O-N 3.16Å; L467-C471 PolarHBondContact O-N 3.49Å; L467-L492 HydrophobicContact CD2-CD2 3.52Å; L467-F495 HydrophobicContact CD1-CD1 4.25Å; L467-F495 HydrophobicContact CD1-CE1 3.69Å; L467-F495 HydrophobicContact CD1-CZ 3.97Å; L467-S516 WeakPolarHBondContact CD1-O 3.5Å; L467-T519 HydrophobicContact CB-CG2 4.07Å; L467-T519 WeakPolarHBondContact O-CG2 3.2Å; L467-A520 HydrophobicContact CD1-CB 4.31Å; L467-A520 HydrophobicContact CD2-CB 3.66Å
468	P	92.9	Very high	86.8	Confident	45 Å²	45	36.3 Å²	36.3	29%	0.292	21%	0.206	S	C	.	.	H	α-helix	trans	-55.2	-46.6	175	-27.6	36.2	0	0	0	112.5	A407 Y465 L470 C471 H472	A407-P468 HydrophobicContact CB-CB 3.66Å; A407-P468 HydrophobicContact CB-CG 4.42Å; Y465-P468 WeakPolarHBondContact O-CD 3.5Å; P468-L470 PolarHBondContact O-N 2.93Å; P468-C471 VanDerWaalsContact O-CB 3.3Å; P468-C471 WeakPolarHBondContact O-CB 3.41Å; P468-C471 PolarHBondContact O-N 3.23Å; P468-H472 PolarHBondContact O-CD2 3.35Å; P468-H472 VanDerWaalsContact O-CD2 3.26Å; P468-H472 PolarHBondContact O-N 3.1Å
469	A	94.6	Very high	89.3	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-43.2	175.7	0	0	0	0	0	112	L406 L466 L467 C471 H472 L473	L406-A469 HydrophobicContact CB-CB 3.5Å; L406-A469 VanDerWaalsContact CB-CB 3.5Å; L406-A469 HydrophobicContact CD1-CB 4.5Å; L466-A469 HydrophobicContact CD1-CB 4.4Å; L466-A469 WeakPolarHBondContact O-CB 3.36Å; L466-A469 PolarHBondContact O-N 3.17Å; L467-A469 VanDerWaalsContact C-N 3.32Å; L467-A469 PolarHBondContact O-N 3.11Å; A469-C471 VanDerWaalsContact C-N 3.27Å; A469-C471 PolarHBondContact O-N 3.37Å; A469-H472 PolarHBondContact O-N 3.07Å; A469-H472 VanDerWaalsContact O-N 3.15Å; A469-L473 HydrophobicContact CB-CD1 4.34Å; A469-L473 WeakPolarHBondContact O-CB 3.33Å; A469-L473 VanDerWaalsContact O-CG 3.25Å; A469-L473 WeakPolarHBondContact O-CG 3.27Å; A469-L473 PolarHBondContact O-N 2.86Å
470	L	96.7	Very high	91.7	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-63.3	-32.9	177.3	-65.3	177.3	0	0	0	112.7	I425 L463 L466 L467 P468 H472 S474 L483 L492	I425-L470 HydrophobicContact CD1-CD1 4.15Å; I425-L470 HydrophobicContact CD1-CD2 3.91Å; L463-L470 HydrophobicContact CD1-CD1 4.08Å; L466-L470 HydrophobicContact CD2-CD1 4.15Å; L466-L470 HydrophobicContact CD2-CD2 4.48Å; L466-L470 HydrophobicContact CD2-CG 4.41Å; L466-L470 HydrophobicContact CG-CD1 3.97Å; L466-L470 HydrophobicContact CG-CD2 4.27Å; L466-L470 HydrophobicContact CG-CG 3.88Å; L466-L470 WeakPolarHBondContact O-CG 3.29Å; L466-L470 PolarHBondContact O-N 3.05Å; L467-L470 PolarHBondContact O-N 3.22Å; L467-L470 VanDerWaalsContact O-N 3.16Å; P468-L470 PolarHBondContact O-N 2.93Å; L470-H472 VanDerWaalsContact C-N 3.29Å; L470-H472 PolarHBondContact O-N 3.37Å; L470-S474 WeakPolarHBondContact O-CB 3.48Å; L470-S474 PolarHBondContact O-N 2.9Å; L470-S474 PolarHBondContact O-OG 3.39Å; L470-L483 HydrophobicContact CD2-CD1 4.23Å; L470-L483 HydrophobicContact CD2-CD2 3.66Å; L470-L492 HydrophobicContact CD1-CD2 4.14Å
471	C	95.5	Very high	93.7	Very high	29 Å²	29	35.8 Å²	35.8	20%	0.196	19%	0.187	C	C	.	.	H	α-helix	trans	-59.9	-41	174.4	-169.3	0	0	0	0	111.4	L467 P468 A469 S474 T519 S522 N526	L467-C471 PolarHBondContact O-N 3.49Å; P468-C471 VanDerWaalsContact O-CB 3.3Å; P468-C471 WeakPolarHBondContact O-CB 3.41Å; P468-C471 PolarHBondContact O-N 3.23Å; A469-C471 VanDerWaalsContact C-N 3.27Å; A469-C471 PolarHBondContact O-N 3.37Å; C471-S474 PolarHBondContact O-OG 3.05Å; C471-T519 HydrophobicContact CB-CG2 3.81Å; C471-S522 VanDerWaalsContact SG-CB 3.55Å; C471-N526 PolarHBondContact O-ND2 3.48Å
472	H	94.3	Very high	94.9	Very high	92 Å²	92	36.9 Å²	36.9	43%	0.426	19%	0.192	S	C	.	.	H	α-helix	trans	-76.5	-49.2	176.2	-64.4	-59.7	0	0	0	112.4	T410 P468 A469 L470 S474 A475	T410-H472 HydrophobicContact CG2-CB 3.74Å; P468-H472 PolarHBondContact O-CD2 3.35Å; P468-H472 VanDerWaalsContact O-CD2 3.26Å; P468-H472 PolarHBondContact O-N 3.1Å; A469-H472 PolarHBondContact O-N 3.07Å; A469-H472 VanDerWaalsContact O-N 3.15Å; L470-H472 VanDerWaalsContact C-N 3.29Å; L470-H472 PolarHBondContact O-N 3.37Å; H472-S474 VanDerWaalsContact C-N 3.31Å; H472-S474 PolarHBondContact O-N 2.93Å; H472-A475 WeakPolarHBondContact O-CB 3.48Å; H472-A475 PolarHBondContact O-N 2.92Å
473	L	96.3	Very high	95.3	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-64.5	-33.4	-176	-66.1	169.2	0	0	0	112.6	T410 V417 L421 A469 A475 E476 P479 L483	T410-L473 HydrophobicContact CG2-CD2 4.4Å; T410-L473 HydrophobicContact CG2-CG 4.46Å; V417-L473 HydrophobicContact CG1-CD1 4.24Å; V417-L473 HydrophobicContact CG1-CD2 4.22Å; L421-L473 HydrophobicContact CD2-CD1 3.9Å; A469-L473 HydrophobicContact CB-CD1 4.34Å; A469-L473 WeakPolarHBondContact O-CB 3.33Å; A469-L473 VanDerWaalsContact O-CG 3.25Å; A469-L473 WeakPolarHBondContact O-CG 3.27Å; A469-L473 PolarHBondContact O-N 2.86Å; L473-A475 PolarHBondContact O-N 2.96Å; L473-E476 PolarHBondContact O-N 3.5Å; L473-P479 HydrophobicContact CB-CB 4.07Å; L473-P479 HydrophobicContact CD2-CB 4.05Å; L473-P479 HydrophobicContact CD2-CG 4.14Å; L473-L483 HydrophobicContact CB-CD1 4.38Å
474	S	96.9	Very high	95.6	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.021	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-22.8	175	58.4	0	0	0	0	113.6	L470 C471 H472 R480 N526	L470-S474 WeakPolarHBondContact O-CB 3.48Å; L470-S474 PolarHBondContact O-N 2.9Å; L470-S474 PolarHBondContact O-OG 3.39Å; C471-S474 PolarHBondContact O-OG 3.05Å; H472-S474 VanDerWaalsContact C-N 3.31Å; H472-S474 PolarHBondContact O-N 2.93Å; S474-R480 VanDerWaalsContact O-CD 3.3Å; S474-R480 WeakPolarHBondContact O-CD 3.44Å; S474-R480 PolarHBondContact O-NH1 3.18Å; S474-N526 PolarHBondContact OG-ND2 3.2Å
475	A	95.8	Very high	95.9	Very high	55 Å²	55	38.7 Å²	38.7	46%	0.455	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-27.2	175.9	0	0	0	0	0	112.3	H472 L473 R480	H472-A475 WeakPolarHBondContact O-CB 3.48Å; H472-A475 PolarHBondContact O-N 2.92Å; L473-A475 PolarHBondContact O-N 2.96Å; A475-R480 VanDerWaalsContact C-NH1 3.27Å; A475-R480 PolarHBondContact O-NH1 2.9Å
476	E	94.9	Very high	96.2	Very high	51 Å²	51	37.2 Å²	37.2	24%	0.238	21%	0.213	C	C	.	.	S	Bend	trans	-83.4	143.5	-179.5	-63.6	-166.3	-132.7	0	0	112.8	K414 L473 P479 R480	K414-E476 IonicContact NZ-OE1 2.64Å; K414-E476 IonicContact NZ-OE2 3.19Å; K414-E476 PolarHBondContact NZ-OE2 3.47Å; L473-E476 PolarHBondContact O-N 3.5Å; E476-P479 HydrophobicContact CB-CG 3.9Å; E476-R480 WeakPolarHBondContact O-CB 3.46Å; E476-R480 PolarHBondContact O-N 2.9Å; E476-R480 VanDerWaalsContact O-N 3.13Å; E476-R480 PolarHBondContact O-NH1 3.34Å; E476-R480 VanDerWaalsContact O-NH1 3.14Å
477	D	95.2	Very high	96.3	Very high	79 Å²	79	41.6 Å²	41.6	42%	0.422	24%	0.236	S	C	.	.	H	α-helix	trans	-65.8	-51.4	-172.5	-172.9	55.8	0	0	0	114.4	R480 K481	D477-R480 IonicContact OD1-NH2 3.71Å; D477-R480 PolarHBondContact OD1-NH2 3.43Å; D477-R480 VanDerWaalsContact OD1-NH2 3.13Å; D477-K481 WeakPolarHBondContact O-CG 3.34Å; D477-K481 PolarHBondContact O-N 3.49Å; D477-K481 WeakPolarHBondContact OD1-CE 3.36Å; D477-K481 IonicContact OD1-NZ 3.75Å; D477-K481 PolarHBondContact OD1-NZ 2.82Å; D477-K481 IonicContact OD2-NZ 3.84Å; D477-K481 PolarHBondContact OD2-NZ 3.33Å
478	T	96.4	Very high	96.4	Very high	91 Å²	91	41.8 Å²	41.8	56%	0.558	24%	0.238	S	C	*	.	H	α-helix	trans	-66.6	-51.1	-177.5	-50.5	0	0	0	0	112.6	T418 R480 K481 V482	T418-T478 HydrophobicContact CG2-CG2 4.14Å; T478-R480 PolarHBondContact O-N 3.33Å; T478-K481 PolarHBondContact O-N 2.9Å; T478-V482 PolarHBondContact O-N 3.12Å
479	P	96.9	Very high	96.6	Very high	6 Å²	6	39.9 Å²	39.9	4%	0.039	23%	0.225	C	C	.	.	H	α-helix	trans	-63.3	-39.5	178.9	-19.5	33	0	0	0	112.2	L421 L473 E476 K481 V482 L483	L421-P479 HydrophobicContact CD1-CB 3.93Å; L473-P479 HydrophobicContact CB-CB 4.07Å; L473-P479 HydrophobicContact CD2-CB 4.05Å; L473-P479 HydrophobicContact CD2-CG 4.14Å; E476-P479 HydrophobicContact CB-CG 3.9Å; P479-K481 VanDerWaalsContact C-N 3.32Å; P479-K481 PolarHBondContact O-N 3.18Å; P479-V482 PolarHBondContact O-N 3.17Å; P479-V482 VanDerWaalsContact O-N 3.1Å; P479-L483 WeakPolarHBondContact O-CG 3.28Å; P479-L483 PolarHBondContact O-N 2.88Å
480	R	97.6	Very high	96.7	Very high	14 Å²	14	41.2 Å²	41.2	5%	0.053	24%	0.236	C	C	.	.	H	α-helix	trans	-57.5	-41.9	176.2	179.4	177.4	55.8	-104.4	1.7	112.8	S474 A475 E476 D477 T478 V482 L483 L484 T530 E531	S474-R480 VanDerWaalsContact O-CD 3.3Å; S474-R480 WeakPolarHBondContact O-CD 3.44Å; S474-R480 PolarHBondContact O-NH1 3.18Å; A475-R480 VanDerWaalsContact C-NH1 3.27Å; A475-R480 PolarHBondContact O-NH1 2.9Å; E476-R480 WeakPolarHBondContact O-CB 3.46Å; E476-R480 PolarHBondContact O-N 2.9Å; E476-R480 VanDerWaalsContact O-N 3.13Å; E476-R480 PolarHBondContact O-NH1 3.34Å; E476-R480 VanDerWaalsContact O-NH1 3.14Å; D477-R480 IonicContact OD1-NH2 3.71Å; D477-R480 PolarHBondContact OD1-NH2 3.43Å; D477-R480 VanDerWaalsContact OD1-NH2 3.13Å; T478-R480 PolarHBondContact O-N 3.33Å; R480-V482 VanDerWaalsContact C-N 3.28Å; R480-V482 PolarHBondContact O-N 3.3Å; R480-L483 WeakPolarHBondContact O-CB 3.45Å; R480-L483 PolarHBondContact O-N 2.9Å; R480-L484 WeakPolarHBondContact O-CG 3.5Å; R480-L484 PolarHBondContact O-N 2.88Å; R480-T530 WeakPolarHBondContact CD-OG1 3.45Å; R480-T530 PolarHBondContact NE-OG1 3.33Å; R480-E531 HydrophobicContact CG-CG 4.33Å; R480-E531 IonicContact CZ-OE1 3.53Å; R480-E531 IonicContact NE-OE1 2.72Å; R480-E531 PolarHBondContact NE-OE1 3.45Å; R480-E531 IonicContact NH2-OE1 2.98Å
481	K	97.7	Very high	96.7	Very high	114 Å²	114	41.3 Å²	41.3	50%	0.496	24%	0.237	S	C	.	.	H	α-helix	trans	-60.7	-38	177.1	-74.9	167.6	178.8	163.9	0	112.2	D477 T478 P479 S485	D477-K481 WeakPolarHBondContact O-CG 3.34Å; D477-K481 PolarHBondContact O-N 3.49Å; D477-K481 WeakPolarHBondContact OD1-CE 3.36Å; D477-K481 IonicContact OD1-NZ 3.75Å; D477-K481 PolarHBondContact OD1-NZ 2.82Å; D477-K481 IonicContact OD2-NZ 3.84Å; D477-K481 PolarHBondContact OD2-NZ 3.33Å; T478-K481 PolarHBondContact O-N 2.9Å; P479-K481 VanDerWaalsContact C-N 3.32Å; P479-K481 PolarHBondContact O-N 3.18Å; K481-S485 PolarHBondContact O-N 3.37Å; K481-S485 VanDerWaalsContact O-N 3.14Å
482	V	98.2	Very high	96.8	Very high	33 Å²	33	40.3 Å²	40.3	20%	0.2	23%	0.23	C	C	.	.	H	α-helix	trans	-69.9	-43	174.3	-179.5	0	0	0	0	111	T418 L421 P422 T478 P479 R480 L484 S485 V486	T418-V482 HydrophobicContact CG2-CB 4.47Å; T418-V482 HydrophobicContact CG2-CG2 3.69Å; L421-V482 HydrophobicContact CB-CG1 3.83Å; L421-V482 HydrophobicContact CD1-CB 3.98Å; L421-V482 HydrophobicContact CD1-CG1 4.06Å; P422-V482 HydrophobicContact CG-CG1 4.19Å; T478-V482 PolarHBondContact O-N 3.12Å; P479-V482 PolarHBondContact O-N 3.17Å; P479-V482 VanDerWaalsContact O-N 3.1Å; R480-V482 VanDerWaalsContact C-N 3.28Å; R480-V482 PolarHBondContact O-N 3.3Å; V482-L484 PolarHBondContact O-N 3.05Å; V482-S485 PolarHBondContact O-N 2.64Å; V482-S485 PolarHBondContact O-OG 3.49Å; V482-V486 WeakPolarHBondContact O-CG2 3.47Å; V482-V486 PolarHBondContact O-N 3.01Å
483	L	98.1	Very high	97	Very high	8 Å²	8	36 Å²	36	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-57.3	-39	175.5	-69.3	176	0	0	0	112.2	L421 I425 L470 L473 P479 R480 V486 D487 A488	L421-L483 HydrophobicContact CD1-CD2 4.1Å; L421-L483 HydrophobicContact CD1-CG 4.09Å; L421-L483 HydrophobicContact CD2-CD2 3.82Å; L421-L483 HydrophobicContact CG-CD2 4.42Å; I425-L483 HydrophobicContact CD1-CD2 3.93Å; I425-L483 HydrophobicContact CG1-CD2 4Å; L470-L483 HydrophobicContact CD2-CD1 4.23Å; L470-L483 HydrophobicContact CD2-CD2 3.66Å; L473-L483 HydrophobicContact CB-CD1 4.38Å; P479-L483 WeakPolarHBondContact O-CG 3.28Å; P479-L483 PolarHBondContact O-N 2.88Å; R480-L483 WeakPolarHBondContact O-CB 3.45Å; R480-L483 PolarHBondContact O-N 2.9Å; L483-V486 WeakPolarHBondContact O-CG2 3.43Å; L483-D487 PolarHBondContact O-N 3.15Å; L483-A488 HydrophobicContact CB-CB 3.93Å; L483-A488 HydrophobicContact CD2-CB 4Å; L483-A488 WeakPolarHBondContact O-CB 3.4Å; L483-A488 PolarHBondContact O-N 3.16Å
484	L	97.6	Very high	96.9	Very high	36 Å²	36	39 Å²	39	19%	0.188	23%	0.226	C	C	.	.	H	α-helix	trans	-66.9	-40.1	174	-70.7	-178.7	0	0	0	112.6	R480 V482 V486 D487 P489 V527 E531	R480-L484 WeakPolarHBondContact O-CG 3.5Å; R480-L484 PolarHBondContact O-N 2.88Å; V482-L484 PolarHBondContact O-N 3.05Å; L484-V486 PolarHBondContact O-N 2.85Å; L484-D487 PolarHBondContact O-N 3.29Å; L484-P489 HydrophobicContact CD2-CG 3.78Å; L484-V527 HydrophobicContact CD2-CG1 3.93Å; L484-E531 HydrophobicContact CD1-CB 4.36Å; L484-E531 HydrophobicContact CD1-CG 3.87Å
485	S	97.4	Very high	96.8	Very high	90 Å²	90	39.1 Å²	39.1	63%	0.629	23%	0.226	S	C	*	.	H	α-helix	trans	-69.1	-18.5	-178.7	72.9	0	0	0	0	113.7	K481 V482	K481-S485 PolarHBondContact O-N 3.37Å; K481-S485 VanDerWaalsContact O-N 3.14Å; V482-S485 PolarHBondContact O-N 2.64Å; V482-S485 PolarHBondContact O-OG 3.49Å
486	V	97.1	Very high	96.7	Very high	28 Å²	28	36.5 Å²	36.5	17%	0.17	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	14.1	177.5	-56.7	0	0	0	0	113.4	P422 I425 R429 V482 L483 L484 A488	P422-V486 HydrophobicContact CB-CG1 4.02Å; P422-V486 HydrophobicContact CG-CG1 4.09Å; I425-V486 HydrophobicContact CB-CG2 4.02Å; I425-V486 HydrophobicContact CG1-CG2 3.91Å; I425-V486 HydrophobicContact CG2-CG2 3.93Å; R429-V486 PolarHBondContact NH2-O 3.36Å; V482-V486 WeakPolarHBondContact O-CG2 3.47Å; V482-V486 PolarHBondContact O-N 3.01Å; L483-V486 WeakPolarHBondContact O-CG2 3.43Å; L484-V486 PolarHBondContact O-N 2.85Å; V486-A488 VanDerWaalsContact C-N 3.31Å; V486-A488 HydrophobicContact CG2-CB 4.49Å; V486-A488 PolarHBondContact O-N 3.49Å
487	D	96.3	Very high	96.6	Very high	92 Å²	92	36.2 Å²	36.2	49%	0.492	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	39.7	-179.5	-60.9	-37.3	0	0	0	113.9	R429 L483 L484 P489 A490 L491	R429-D487 PolarHBondContact NH2-O 3.2Å; L483-D487 PolarHBondContact O-N 3.15Å; L484-D487 PolarHBondContact O-N 3.29Å; D487-P489 VanDerWaalsContact C-CD 3.45Å; D487-A490 HydrophobicContact CB-CB 4.4Å; D487-A490 PolarHBondContact O-N 3.23Å; D487-L491 PolarHBondContact O-N 3Å
488	A	97.5	Very high	96.4	Very high	4 Å²	4	35.8 Å²	35.8	3%	0.033	20%	0.196	C	C	.	.	H	α-helix	trans	-59.7	-37.3	174.4	0	0	0	0	0	113.6	I425 L483 V486 A490 L491 L492	I425-A488 HydrophobicContact CD1-CB 3.9Å; I425-A488 HydrophobicContact CG1-CB 4.3Å; L483-A488 HydrophobicContact CB-CB 3.93Å; L483-A488 HydrophobicContact CD2-CB 4Å; L483-A488 WeakPolarHBondContact O-CB 3.4Å; L483-A488 PolarHBondContact O-N 3.16Å; V486-A488 VanDerWaalsContact C-N 3.31Å; V486-A488 HydrophobicContact CG2-CB 4.49Å; V486-A488 PolarHBondContact O-N 3.49Å; A488-A490 VanDerWaalsContact C-N 3.3Å; A488-A490 PolarHBondContact O-N 3Å; A488-L491 WeakPolarHBondContact O-CB 3.07Å; A488-L491 PolarHBondContact O-N 3.3Å; A488-L491 VanDerWaalsContact O-N 3.16Å; A488-L492 WeakPolarHBondContact O-CG 3.38Å; A488-L492 PolarHBondContact O-N 3.4Å
489	P	97.8	Very high	96	Very high	4 Å²	4	32 Å²	32	3%	0.026	17%	0.173	C	C	.	.	H	α-helix	trans	-57.3	-41.2	175.7	-26.6	35.9	0	0	0	113.1	L484 D487 L491 L492 V493 L524 V527 F541	L484-P489 HydrophobicContact CD2-CG 3.78Å; D487-P489 VanDerWaalsContact C-CD 3.45Å; P489-L491 VanDerWaalsContact C-N 3.35Å; P489-L491 PolarHBondContact O-N 3.26Å; P489-L492 PolarHBondContact O-N 3.47Å; P489-V493 VanDerWaalsContact O-CG2 3.31Å; P489-V493 WeakPolarHBondContact O-CG2 3.26Å; P489-V493 PolarHBondContact O-N 2.65Å; P489-L524 HydrophobicContact CB-CD2 4.15Å; P489-V527 HydrophobicContact CG-CG1 4.48Å; P489-F541 HydrophobicContact CB-CE2 4.11Å; P489-F541 HydrophobicContact CB-CZ 4.13Å
490	A	97.1	Very high	95.6	Very high	29 Å²	29	31.9 Å²	31.9	24%	0.24	17%	0.172	C	C	.	.	H	α-helix	trans	-62.9	-41.5	177.4	0	0	0	0	0	111.8	D487 A488 L492 V493 D494 C540	D487-A490 HydrophobicContact CB-CB 4.4Å; D487-A490 PolarHBondContact O-N 3.23Å; A488-A490 VanDerWaalsContact C-N 3.3Å; A488-A490 PolarHBondContact O-N 3Å; A490-L492 VanDerWaalsContact C-N 3.34Å; A490-L492 PolarHBondContact O-N 3.31Å; A490-V493 PolarHBondContact O-N 3.24Å; A490-D494 PolarHBondContact O-N 2.95Å; A490-C540 HydrophobicContact CB-CB 4.04Å
491	L	96.8	Very high	95.2	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-59.7	-43.1	174.9	177.1	64	0	0	0	112.1	I425 A428 R429 L432 L463 D487 A488 P489 D494 F495	I425-L491 HydrophobicContact CD1-CD2 4.47Å; I425-L491 HydrophobicContact CG2-CD2 3.95Å; A428-L491 HydrophobicContact CB-CD2 4.26Å; R429-L491 HydrophobicContact CB-CD1 3.99Å; R429-L491 HydrophobicContact CB-CD2 4.31Å; R429-L491 HydrophobicContact CG-CD1 4.25Å; L432-L491 HydrophobicContact CB-CD1 4.48Å; L432-L491 HydrophobicContact CD2-CD1 3.58Å; L463-L491 HydrophobicContact CD1-CD2 4.11Å; L463-L491 HydrophobicContact CD1-CG 4.49Å; L463-L491 HydrophobicContact CD2-CD1 4.28Å; L463-L491 HydrophobicContact CD2-CD2 4.44Å; L463-L491 HydrophobicContact CD2-CG 4.01Å; D487-L491 PolarHBondContact O-N 3Å; A488-L491 WeakPolarHBondContact O-CB 3.07Å; A488-L491 PolarHBondContact O-N 3.3Å; A488-L491 VanDerWaalsContact O-N 3.16Å; P489-L491 VanDerWaalsContact C-N 3.35Å; P489-L491 PolarHBondContact O-N 3.26Å; L491-D494 PolarHBondContact O-N 3.48Å; L491-F495 WeakPolarHBondContact O-CB 3.44Å; L491-F495 PolarHBondContact O-N 2.91Å
492	L	97.3	Very high	94.4	Very high	9 Å²	9	33.8 Å²	33.8	5%	0.047	19%	0.191	C	C	.	.	H	α-helix	trans	-67	-38.8	177.9	-65	177.4	0	0	0	112.1	L463 L467 L470 A488 P489 A490 F495 L496 A520 A523 L524	L463-L492 HydrophobicContact CD1-CD2 4.4Å; L467-L492 HydrophobicContact CD2-CD2 3.52Å; L470-L492 HydrophobicContact CD1-CD2 4.14Å; A488-L492 WeakPolarHBondContact O-CG 3.38Å; A488-L492 PolarHBondContact O-N 3.4Å; P489-L492 PolarHBondContact O-N 3.47Å; A490-L492 VanDerWaalsContact C-N 3.34Å; A490-L492 PolarHBondContact O-N 3.31Å; L492-F495 PolarHBondContact O-N 3.22Å; L492-L496 WeakPolarHBondContact O-CG 3.47Å; L492-L496 PolarHBondContact O-N 2.95Å; L492-A520 HydrophobicContact CD2-CB 4.44Å; L492-A523 HydrophobicContact CD1-CB 3.87Å; L492-L524 HydrophobicContact CB-CD1 4.06Å; L492-L524 HydrophobicContact CB-CD2 4.05Å; L492-L524 HydrophobicContact CB-CG 3.99Å; L492-L524 HydrophobicContact CD1-CD2 4.16Å; L492-L524 HydrophobicContact CD1-CG 4.01Å
493	V	97.6	Very high	93.5	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-64.2	-46.1	175.2	172.2	0	0	0	0	110.8	P489 A490 F495 L496 I497 L524 T543 L544	P489-V493 VanDerWaalsContact O-CG2 3.31Å; P489-V493 WeakPolarHBondContact O-CG2 3.26Å; P489-V493 PolarHBondContact O-N 2.65Å; A490-V493 PolarHBondContact O-N 3.24Å; V493-F495 VanDerWaalsContact C-N 3.3Å; V493-F495 PolarHBondContact O-N 2.73Å; V493-L496 PolarHBondContact O-N 2.94Å; V493-I497 HydrophobicContact CG1-CD1 3.75Å; V493-I497 HydrophobicContact CG1-CG1 4.5Å; V493-I497 WeakPolarHBondContact O-CG1 3.28Å; V493-I497 PolarHBondContact O-N 3.1Å; V493-L524 HydrophobicContact CG2-CD1 4.25Å; V493-L524 HydrophobicContact CG2-CD2 4.25Å; V493-T543 HydrophobicContact CG1-CG2 4.33Å; V493-L544 HydrophobicContact CG1-CB 4.17Å; V493-L544 HydrophobicContact CG2-CB 3.87Å; V493-L544 HydrophobicContact CG2-CD1 4.27Å; V493-L544 HydrophobicContact CG2-CD2 4.11Å; V493-L544 HydrophobicContact CG2-CG 4.31Å
494	D	94.9	Very high	92.6	Very high	67 Å²	67	37.8 Å²	37.8	36%	0.358	20%	0.203	S	C	.	.	H	α-helix	trans	-59.6	-42	176.2	-76.5	-9.2	0	0	0	111.7	L432 A490 L491 I497 R498	L432-D494 HydrophobicContact CD2-CB 4.44Å; A490-D494 PolarHBondContact O-N 2.95Å; L491-D494 PolarHBondContact O-N 3.48Å; D494-I497 PolarHBondContact O-N 2.95Å; D494-R498 WeakPolarHBondContact O-CB 3.46Å; D494-R498 VanDerWaalsContact O-CG 3.27Å; D494-R498 WeakPolarHBondContact O-CG 3.37Å; D494-R498 PolarHBondContact O-N 3.11Å
495	F	94	Very high	91.2	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.018	23%	0.226	C	C	.	.	H	α-helix	trans	-60.9	-46.7	175.2	172.9	-100.5	0	0	0	112.6	L432 L463 R464 L467 L491 L492 V493 I497 R498 T499 M517 A520	L432-F495 HydrophobicContact CD1-CD2 4.22Å; L432-F495 HydrophobicContact CD2-CB 4.21Å; L463-F495 HydrophobicContact CD2-CB 3.51Å; L463-F495 HydrophobicContact CD2-CD1 4.48Å; L463-F495 HydrophobicContact CD2-CD2 3.78Å; L463-F495 HydrophobicContact CD2-CG 3.66Å; L463-F495 HydrophobicContact CG-CD2 4.44Å; R464-F495 HydrophobicContact CG-CE2 4.07Å; R464-F495 HydrophobicContact CG-CZ 4.11Å; L467-F495 HydrophobicContact CD1-CD1 4.25Å; L467-F495 HydrophobicContact CD1-CE1 3.69Å; L467-F495 HydrophobicContact CD1-CZ 3.97Å; L491-F495 WeakPolarHBondContact O-CB 3.44Å; L491-F495 PolarHBondContact O-N 2.91Å; L492-F495 PolarHBondContact O-N 3.22Å; V493-F495 VanDerWaalsContact C-N 3.3Å; V493-F495 PolarHBondContact O-N 2.73Å; F495-I497 VanDerWaalsContact C-N 3.34Å; F495-I497 PolarHBondContact O-N 3.45Å; F495-R498 PolarHBondContact O-N 2.75Å; F495-T499 WeakPolarHBondContact CE2-OG1 3.3Å; F495-T499 WeakPolarHBondContact O-CB 3.5Å; F495-T499 PolarHBondContact O-N 3.33Å; F495-T499 PolarHBondContact O-OG1 3.29Å; F495-M517 HydrophobicContact CE1-CG 4.48Å; F495-A520 HydrophobicContact CD1-CB 4.07Å; F495-A520 HydrophobicContact CE1-CB 4.25Å
496	L	94.6	Very high	89.8	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-42.5	178.2	-76.1	177.3	0	0	0	111.9	L492 V493 W500 M517 A520 L524 L544 Y568	L492-L496 WeakPolarHBondContact O-CG 3.47Å; L492-L496 PolarHBondContact O-N 2.95Å; V493-L496 PolarHBondContact O-N 2.94Å; L496-W500 WeakPolarHBondContact O-CB 3.4Å; L496-W500 PolarHBondContact O-N 3.17Å; L496-M517 HydrophobicContact CD2-CB 3.96Å; L496-M517 HydrophobicContact CD2-CE 4.12Å; L496-M517 HydrophobicContact CD2-CG 4.37Å; L496-A520 HydrophobicContact CD2-CB 3.94Å; L496-A520 HydrophobicContact CG-CB 4.17Å; L496-L524 HydrophobicContact CD1-CD1 3.57Å; L496-L544 HydrophobicContact CD1-CD1 4.19Å; L496-Y568 HydrophobicContact CD2-CE1 4.34Å
497	I	93.7	Very high	87.5	Confident	45 Å²	45	43.6 Å²	43.6	23%	0.231	25%	0.246	C	C	.	.	H	α-helix	trans	-64.7	-50.5	179.4	-68.1	166.8	0	0	0	110.2	V493 D494 F495 W500 T501 T543 H547	V493-I497 HydrophobicContact CG1-CD1 3.75Å; V493-I497 HydrophobicContact CG1-CG1 4.5Å; V493-I497 WeakPolarHBondContact O-CG1 3.28Å; V493-I497 PolarHBondContact O-N 3.1Å; D494-I497 PolarHBondContact O-N 2.95Å; F495-I497 VanDerWaalsContact C-N 3.34Å; F495-I497 PolarHBondContact O-N 3.45Å; I497-W500 PolarHBondContact O-N 3.13Å; I497-T501 WeakPolarHBondContact O-CG2 3.49Å; I497-T501 PolarHBondContact O-N 2.81Å; I497-T501 PolarHBondContact O-OG1 3.45Å; I497-T543 HydrophobicContact CD1-CG2 3.71Å; I497-H547 HydrophobicContact CD1-CB 4.45Å; I497-H547 HydrophobicContact CG1-CB 4.03Å
498	R	89.8	Confident	85.2	Confident	71 Å²	71	48.9 Å²	48.9	27%	0.268	27%	0.268	S	S	.	.	H	α-helix	trans	-63.2	-47	-178.5	-71.1	173.5	-175.6	-150.1	1.7	112.5	L432 A436 D494 F495 W500 T501 D502	L432-R498 PolarHBondContact O-NH1 3.43Å; A436-R498 VanDerWaalsContact CB-NH1 3.34Å; D494-R498 WeakPolarHBondContact O-CB 3.46Å; D494-R498 VanDerWaalsContact O-CG 3.27Å; D494-R498 WeakPolarHBondContact O-CG 3.37Å; D494-R498 PolarHBondContact O-N 3.11Å; F495-R498 PolarHBondContact O-N 2.75Å; R498-W500 VanDerWaalsContact C-N 3.27Å; R498-W500 PolarHBondContact O-N 3.14Å; R498-T501 WeakPolarHBondContact CA-OG1 3.32Å; R498-T501 PolarHBondContact O-N 2.81Å; R498-T501 VanDerWaalsContact O-N 3.16Å; R498-T501 PolarHBondContact O-OG1 3.34Å; R498-D502 PolarHBondContact O-N 3.03Å
499	T	87.8	Confident	83.2	Confident	11 Å²	11	54.3 Å²	54.3	7%	0.067	30%	0.301	C	S	.	.	H	α-helix	trans	-63.4	-38.6	-179.9	-50.2	0	0	0	0	110.6	F495 D502 L503 D514 M517	F495-T499 WeakPolarHBondContact CE2-OG1 3.3Å; F495-T499 WeakPolarHBondContact O-CB 3.5Å; F495-T499 PolarHBondContact O-N 3.33Å; F495-T499 PolarHBondContact O-OG1 3.29Å; T499-D502 PolarHBondContact O-N 3.3Å; T499-L503 HydrophobicContact CG2-CD1 4.28Å; T499-L503 WeakPolarHBondContact O-CB 3.36Å; T499-L503 VanDerWaalsContact O-CG 3.24Å; T499-L503 WeakPolarHBondContact O-CG 3.17Å; T499-L503 PolarHBondContact O-N 2.83Å; T499-D514 WeakPolarHBondContact CG2-OD2 3.17Å; T499-M517 HydrophobicContact CG2-CG 3.74Å; T499-M517 HydrophobicContact CG2-SD 3.53Å; T499-M517 VanDerWaalsContact CG2-SD 3.53Å
500	W	89.1	Confident	81.5	Confident	4 Å²	4	56.9 Å²	56.9	2%	0.015	32%	0.322	C	S	.	.	H	α-helix	trans	-65.5	-41.8	173.6	176.1	-110.6	0	0	0	113.4	L496 I497 R498 D502 L503 R504 M517 H547 A551 V554 L555	L496-W500 WeakPolarHBondContact O-CB 3.4Å; L496-W500 PolarHBondContact O-N 3.17Å; I497-W500 PolarHBondContact O-N 3.13Å; R498-W500 VanDerWaalsContact C-N 3.27Å; R498-W500 PolarHBondContact O-N 3.14Å; W500-D502 VanDerWaalsContact C-N 3.33Å; W500-L503 PolarHBondContact O-N 2.88Å; W500-R504 WeakPolarHBondContact O-CB 3.29Å; W500-R504 PolarHBondContact O-N 3.4Å; W500-M517 HydrophobicContact CB-CE 4.09Å; W500-H547 AromaticContact CD1-CE1 3.4Å; W500-H547 AromaticContact CG-CE1 3.55Å; W500-A551 HydrophobicContact CD2-CB 4.07Å; W500-A551 HydrophobicContact CG-CB 4.45Å; W500-A551 HydrophobicContact CH2-CB 4.46Å; W500-A551 HydrophobicContact CZ2-CB 3.76Å; W500-V554 HydrophobicContact CH2-CB 3.88Å; W500-V554 HydrophobicContact CH2-CG1 3.83Å; W500-V554 HydrophobicContact CZ2-CB 3.83Å; W500-V554 HydrophobicContact CZ2-CG1 4.03Å; W500-V554 HydrophobicContact CZ2-CG2 4.34Å; W500-L555 HydrophobicContact CE3-CD2 4.31Å; W500-L555 HydrophobicContact CH2-CD2 3.79Å; W500-L555 HydrophobicContact CH2-CG 3.73Å; W500-L555 HydrophobicContact CZ3-CD1 4.49Å; W500-L555 HydrophobicContact CZ3-CD2 3.36Å; W500-L555 HydrophobicContact CZ3-CG 3.77Å
501	T	88	Confident	80	Confident	69 Å²	69	56.8 Å²	56.8	42%	0.423	32%	0.318	S	S	.	.	H	α-helix	trans	-64.1	-40.1	177.3	49.5	0	0	0	0	111.7	I497 R498 R504 G505	I497-T501 WeakPolarHBondContact O-CG2 3.49Å; I497-T501 PolarHBondContact O-N 2.81Å; I497-T501 PolarHBondContact O-OG1 3.45Å; R498-T501 WeakPolarHBondContact CA-OG1 3.32Å; R498-T501 PolarHBondContact O-N 2.81Å; R498-T501 VanDerWaalsContact O-N 3.16Å; R498-T501 PolarHBondContact O-OG1 3.34Å; T501-R504 PolarHBondContact O-N 3.48Å; T501-G505 PolarHBondContact O-N 3.49Å
502	D	82.8	Confident	78.8	Confident	99 Å²	99	60 Å²	60	53%	0.529	34%	0.339	S	S	.	.	H	α-helix	trans	-65.3	-46	176.8	-71.5	-12.6	0	0	0	111.2	R498 T499 W500 R504 G505 Q506	R498-D502 PolarHBondContact O-N 3.03Å; T499-D502 PolarHBondContact O-N 3.3Å; W500-D502 VanDerWaalsContact C-N 3.33Å; D502-R504 VanDerWaalsContact C-N 3.32Å; D502-R504 PolarHBondContact O-N 3.41Å; D502-G505 PolarHBondContact O-N 3.3Å; D502-Q506 WeakPolarHBondContact O-CG 3.25Å; D502-Q506 PolarHBondContact O-N 3.4Å
503	L	78.4	Confident	78.1	Confident	11 Å²	11	64.3 Å²	64.3	6%	0.058	35%	0.354	C	S	.	.	H	α-helix	trans	-58.7	-43.5	175.2	-78.6	172.3	0	0	0	111.5	T499 W500 G505 Q506 L511 P512 M517	T499-L503 HydrophobicContact CG2-CD1 4.28Å; T499-L503 WeakPolarHBondContact O-CB 3.36Å; T499-L503 VanDerWaalsContact O-CG 3.24Å; T499-L503 WeakPolarHBondContact O-CG 3.17Å; T499-L503 PolarHBondContact O-N 2.83Å; W500-L503 PolarHBondContact O-N 2.88Å; L503-G505 VanDerWaalsContact C-N 3.32Å; L503-G505 PolarHBondContact O-N 2.96Å; L503-Q506 PolarHBondContact O-N 2.95Å; L503-L511 HydrophobicContact CB-CD2 3.67Å; L503-L511 HydrophobicContact CD2-CD2 4.15Å; L503-L511 HydrophobicContact CG-CD2 4.44Å; L503-L511 WeakPolarHBondContact O-CD2 3.43Å; L503-P512 HydrophobicContact CD2-CG 4.1Å; L503-M517 HydrophobicContact CD1-SD 3.51Å; L503-M517 VanDerWaalsContact CD1-SD 3.51Å
504	R	78.5	Confident	77.4	Confident	113 Å²	113	65.1 Å²	65.1	43%	0.426	36%	0.359	S	S	.	.	H	α-helix	trans	-66	-33.1	178	-171.3	-169.3	-72	-178.1	-6	112.7	W500 T501 D502 Q506 E550	W500-R504 WeakPolarHBondContact O-CB 3.29Å; W500-R504 PolarHBondContact O-N 3.4Å; T501-R504 PolarHBondContact O-N 3.48Å; D502-R504 VanDerWaalsContact C-N 3.32Å; D502-R504 PolarHBondContact O-N 3.41Å; R504-Q506 VanDerWaalsContact C-N 3.32Å; R504-E550 IonicContact CZ-OE1 3.53Å; R504-E550 IonicContact NH1-OE1 2.96Å; R504-E550 PolarHBondContact NH1-OE1 3.12Å; R504-E550 IonicContact NH2-OE1 2.65Å; R504-E550 PolarHBondContact NH2-OE1 2.87Å
505	G	68.9	Low	77.1	Confident	65 Å²	65	65.3 Å²	65.3	67%	0.67	36%	0.363	S	S	*	.	H	α-helix	trans	-73.2	-18.8	-179.4	0	0	0	0	0	114.6	T501 D502 L503	T501-G505 PolarHBondContact O-N 3.49Å; D502-G505 PolarHBondContact O-N 3.3Å; L503-G505 VanDerWaalsContact C-N 3.32Å; L503-G505 PolarHBondContact O-N 2.96Å
506	Q	68.3	Low	76.9	Confident	109 Å²	109	66.1 Å²	66.1	51%	0.509	37%	0.37	S	S	.	.	S	Bend	trans	-79.1	121.5	179.2	-68	173	15.1	0	0	111.1	D502 L503 R504	D502-Q506 WeakPolarHBondContact O-CG 3.25Å; D502-Q506 PolarHBondContact O-N 3.4Å; L503-Q506 PolarHBondContact O-N 2.95Å; R504-Q506 VanDerWaalsContact C-N 3.32Å
507	S	48	Very low	76.9	Confident	103 Å²	103	66.1 Å²	66.1	72%	0.72	37%	0.37	S	S	*	.			trans	-77.8	126	-173.6	64.8	0	0	0	0	114	T509	S507-T509 VanDerWaalsContact C-N 3.3Å; S507-T509 PolarHBondContact O-N 3.41Å
508	Q	49.4	Very low	76.9	Confident	203 Å²	203	64.8 Å²	64.8	95%	0.949	36%	0.362	S	S	*	.	S	Bend	trans	55.2	-11.2	153.2	-63.1	-163.2	17.6	0	0	122
509	T	54.6	Low	77.1	Confident	118 Å²	118	63 Å²	63	72%	0.724	36%	0.36	S	S	*	.	S	Bend	trans	-75.9	144.7	159.2	40.4	0	0	0	0	109.2	S507 L511	S507-T509 VanDerWaalsContact C-N 3.3Å; S507-T509 PolarHBondContact O-N 3.41Å; T509-L511 PolarHBondContact O-N 3.28Å; T509-L511 VanDerWaalsContact O-N 3.13Å
510	A	61.1	Low	77.6	Confident	57 Å²	57	62.5 Å²	62.5	47%	0.471	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-49.8	123.2	-176.8	0	0	0	0	0	110.6	P512	A510-P512 VanDerWaalsContact O-N 3.15Å
511	L	66	Low	78	Confident	28 Å²	28	62.4 Å²	62.4	15%	0.147	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-50.3	120.9	178.8	-80.5	137.3	0	0	0	109.4	L503 T509 K558 L561	L503-L511 HydrophobicContact CB-CD2 3.67Å; L503-L511 HydrophobicContact CD2-CD2 4.15Å; L503-L511 HydrophobicContact CG-CD2 4.44Å; L503-L511 WeakPolarHBondContact O-CD2 3.43Å; T509-L511 PolarHBondContact O-N 3.28Å; T509-L511 VanDerWaalsContact O-N 3.13Å; L511-K558 HydrophobicContact CD1-CD 3.79Å; L511-K558 HydrophobicContact CD1-CG 4.02Å; L511-L561 HydrophobicContact CB-CD1 3.92Å; L511-L561 HydrophobicContact CD1-CD1 4.33Å
512	P	73	Confident	78.4	Confident	73 Å²	73	60.9 Å²	60.9	47%	0.474	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-67.6	143.7	179	27.3	-32.6	0	0	0	109.9	L503 A510	L503-P512 HydrophobicContact CD2-CG 4.1Å; A510-P512 VanDerWaalsContact O-N 3.15Å
513	R	81.2	Confident	79.1	Confident	99 Å²	99	56.2 Å²	56.2	37%	0.374	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-66.5	134.8	170.4	-179.1	-179.5	175.2	-161.6	-7.4	108.5	E518 L561 E626	R513-E518 IonicContact CZ-OE1 3.21Å; R513-E518 IonicContact CZ-OE2 3.35Å; R513-E518 IonicContact NE-OE1 3.18Å; R513-E518 PolarHBondContact NE-OE1 3.42Å; R513-E518 IonicContact NE-OE2 3.76Å; R513-E518 IonicContact NH2-OE1 3.97Å; R513-E518 IonicContact NH2-OE2 2.93Å; R513-E518 PolarHBondContact NH2-OE2 2.88Å; R513-L561 HydrophobicContact CB-CD2 4.5Å; R513-E626 IonicContact CZ-OE1 3.57Å; R513-E626 IonicContact CZ-OE2 2.95Å; R513-E626 IonicContact NH1-OE1 3.23Å; R513-E626 PolarHBondContact NH1-OE1 3.05Å; R513-E626 IonicContact NH1-OE2 2.77Å; R513-E626 PolarHBondContact NH1-OE2 3.48Å; R513-E626 IonicContact NH2-OE1 3.37Å; R513-E626 IonicContact NH2-OE2 2.88Å; R513-E626 PolarHBondContact NH2-OE2 2.92Å
514	D	83.9	Confident	80.1	Confident	19 Å²	19	55.7 Å²	55.7	10%	0.102	32%	0.321	C	S	.	.			trans	-122.7	95.2	176.7	-169.2	-19	0	0	0	110.2	R464 T499 S516 M517	R464-D514 IonicContact CZ-OD1 2.87Å; R464-D514 IonicContact CZ-OD2 3.94Å; R464-D514 IonicContact NH1-OD1 3.57Å; R464-D514 PolarHBondContact NH1-OD1 3.04Å; R464-D514 IonicContact NH1-OD2 2.83Å; R464-D514 PolarHBondContact NH1-OD2 3.47Å; R464-D514 IonicContact NH2-OD2 3.63Å; R464-D514 PolarHBondContact NH2-OD2 2.92Å; T499-D514 WeakPolarHBondContact CG2-OD2 3.17Å; D514-S516 PolarHBondContact O-N 3.22Å; D514-S516 VanDerWaalsContact O-N 3.14Å; D514-S516 VanDerWaalsContact OD1-CB 3.29Å; D514-S516 WeakPolarHBondContact OD1-CB 3.47Å; D514-S516 PolarHBondContact OD1-N 3.36Å; D514-S516 VanDerWaalsContact OD1-N 3.1Å; D514-M517 HydrophobicContact CB-CG 4.19Å; D514-M517 HydrophobicContact CB-SD 4.36Å; D514-M517 PolarHBondContact O-N 3.45Å; D514-M517 VanDerWaalsContact O-N 3.09Å
515	P	87.8	Confident	81	Confident	70 Å²	70	51.2 Å²	51.2	46%	0.455	31%	0.306	S	S	.	.	H	α-helix	trans	-58	-26.4	-179.6	-25.6	35	0	0	0	113.6	M517 E518 T519	P515-M517 PolarHBondContact O-N 2.93Å; P515-E518 WeakPolarHBondContact O-CB 3.17Å; P515-E518 PolarHBondContact O-N 2.96Å; P515-E518 VanDerWaalsContact O-N 3.08Å; P515-T519 PolarHBondContact O-N 3.19Å; P515-T519 PolarHBondContact O-OG1 3.48Å; P515-T519 VanDerWaalsContact O-OG1 3.12Å
516	S	90.8	Very high	82.4	Confident	22 Å²	22	50.1 Å²	50.1	15%	0.154	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-33.7	178	-57.6	0	0	0	0	111.8	L467 D514 A520	L467-S516 WeakPolarHBondContact CD1-O 3.5Å; D514-S516 PolarHBondContact O-N 3.22Å; D514-S516 VanDerWaalsContact O-N 3.14Å; D514-S516 VanDerWaalsContact OD1-CB 3.29Å; D514-S516 WeakPolarHBondContact OD1-CB 3.47Å; D514-S516 PolarHBondContact OD1-N 3.36Å; D514-S516 VanDerWaalsContact OD1-N 3.1Å; S516-A520 WeakPolarHBondContact O-CB 3.32Å; S516-A520 PolarHBondContact O-N 3.01Å
517	M	93	Very high	83.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-68.2	-37.9	175.4	-62.6	-174	69.2	0	0	111.9	F495 L496 T499 W500 L503 D514 P515 A520 C521 L564 Y568	F495-M517 HydrophobicContact CE1-CG 4.48Å; L496-M517 HydrophobicContact CD2-CB 3.96Å; L496-M517 HydrophobicContact CD2-CE 4.12Å; L496-M517 HydrophobicContact CD2-CG 4.37Å; T499-M517 HydrophobicContact CG2-CG 3.74Å; T499-M517 HydrophobicContact CG2-SD 3.53Å; T499-M517 VanDerWaalsContact CG2-SD 3.53Å; W500-M517 HydrophobicContact CB-CE 4.09Å; L503-M517 HydrophobicContact CD1-SD 3.51Å; L503-M517 VanDerWaalsContact CD1-SD 3.51Å; D514-M517 HydrophobicContact CB-CG 4.19Å; D514-M517 HydrophobicContact CB-SD 4.36Å; D514-M517 PolarHBondContact O-N 3.45Å; D514-M517 VanDerWaalsContact O-N 3.09Å; P515-M517 PolarHBondContact O-N 2.93Å; M517-A520 PolarHBondContact O-N 3.33Å; M517-C521 PolarHBondContact O-N 3.42Å; M517-C521 PolarHBondContact O-SG 3.23Å; M517-C521 VanDerWaalsContact O-SG 3.39Å; M517-L564 HydrophobicContact CB-CD1 3.73Å; M517-L564 HydrophobicContact CB-CD2 4.4Å; M517-L564 HydrophobicContact CE-CD2 4.12Å; M517-L564 HydrophobicContact SD-CD2 4.06Å; M517-Y568 WeakPolarHBondContact CE-OH 3.25Å
518	E	94.3	Very high	86.1	Confident	16 Å²	16	40.4 Å²	40.4	8%	0.075	23%	0.228	C	C	.	.	H	α-helix	trans	-65.5	-46.2	177.2	-60.2	167.3	-169.4	0	0	110.3	R513 P515 A520 C521 S522 V563 L564	R513-E518 IonicContact CZ-OE1 3.21Å; R513-E518 IonicContact CZ-OE2 3.35Å; R513-E518 IonicContact NE-OE1 3.18Å; R513-E518 PolarHBondContact NE-OE1 3.42Å; R513-E518 IonicContact NE-OE2 3.76Å; R513-E518 IonicContact NH2-OE1 3.97Å; R513-E518 IonicContact NH2-OE2 2.93Å; R513-E518 PolarHBondContact NH2-OE2 2.88Å; P515-E518 WeakPolarHBondContact O-CB 3.17Å; P515-E518 PolarHBondContact O-N 2.96Å; P515-E518 VanDerWaalsContact O-N 3.08Å; E518-A520 VanDerWaalsContact C-N 3.34Å; E518-A520 PolarHBondContact O-N 3.41Å; E518-C521 WeakPolarHBondContact O-CB 3.36Å; E518-C521 PolarHBondContact O-N 3.41Å; E518-C521 VanDerWaalsContact O-N 3.15Å; E518-S522 PolarHBondContact O-N 3.12Å; E518-S522 PolarHBondContact O-OG 3.35Å; E518-V563 HydrophobicContact CG-CG1 4.34Å; E518-L564 HydrophobicContact CG-CB 4.24Å; E518-L564 HydrophobicContact CG-CD1 4.1Å
519	T	94.6	Very high	88.3	Confident	35 Å²	35	33.8 Å²	33.8	22%	0.215	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-38.8	175.2	-49.3	0	0	0	0	112.6	L467 C471 P515 C521 S522 A523	L467-T519 HydrophobicContact CB-CG2 4.07Å; L467-T519 WeakPolarHBondContact O-CG2 3.2Å; C471-T519 HydrophobicContact CB-CG2 3.81Å; P515-T519 PolarHBondContact O-N 3.19Å; P515-T519 PolarHBondContact O-OG1 3.48Å; P515-T519 VanDerWaalsContact O-OG1 3.12Å; T519-C521 VanDerWaalsContact C-N 3.33Å; T519-C521 PolarHBondContact O-N 3.43Å; T519-S522 WeakPolarHBondContact O-CB 3.46Å; T519-S522 PolarHBondContact O-N 2.99Å; T519-A523 PolarHBondContact O-N 3.12Å
520	A	97.2	Very high	90.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.4	-39.2	175.1	0	0	0	0	0	112	L467 L492 F495 L496 S516 M517 E518 A523 L524	L467-A520 HydrophobicContact CD1-CB 4.31Å; L467-A520 HydrophobicContact CD2-CB 3.66Å; L492-A520 HydrophobicContact CD2-CB 4.44Å; F495-A520 HydrophobicContact CD1-CB 4.07Å; F495-A520 HydrophobicContact CE1-CB 4.25Å; L496-A520 HydrophobicContact CD2-CB 3.94Å; L496-A520 HydrophobicContact CG-CB 4.17Å; S516-A520 WeakPolarHBondContact O-CB 3.32Å; S516-A520 PolarHBondContact O-N 3.01Å; M517-A520 PolarHBondContact O-N 3.33Å; E518-A520 VanDerWaalsContact C-N 3.34Å; E518-A520 PolarHBondContact O-N 3.41Å; A520-A523 PolarHBondContact O-N 3.37Å; A520-L524 WeakPolarHBondContact O-CG 3.24Å; A520-L524 PolarHBondContact O-N 2.67Å
521	C	97.8	Very high	92	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.007	17%	0.169	C	C	.	.	H	α-helix	trans	-62.1	-42.7	172.2	-71.5	0	0	0	0	112.1	M517 E518 T519 L524 L525 N567 Y568 L571	M517-C521 PolarHBondContact O-N 3.42Å; M517-C521 PolarHBondContact O-SG 3.23Å; M517-C521 VanDerWaalsContact O-SG 3.39Å; E518-C521 WeakPolarHBondContact O-CB 3.36Å; E518-C521 PolarHBondContact O-N 3.41Å; E518-C521 VanDerWaalsContact O-N 3.15Å; T519-C521 VanDerWaalsContact C-N 3.33Å; T519-C521 PolarHBondContact O-N 3.43Å; C521-L524 PolarHBondContact O-N 2.89Å; C521-L525 VanDerWaalsContact O-CB 3.28Å; C521-L525 WeakPolarHBondContact O-CB 3.4Å; C521-L525 PolarHBondContact O-N 3.45Å; C521-N567 HydrophobicContact CB-CB 3.73Å; C521-Y568 VanDerWaalsContact SG-CD1 3.59Å; C521-Y568 WeakPolarHBondContact SG-CE1 3.43Å; C521-L571 HydrophobicContact CB-CD2 4.44Å
522	S	96.8	Very high	93.4	Very high	37 Å²	37	30.5 Å²	30.5	26%	0.259	18%	0.175	S	C	.	.	H	α-helix	trans	-61.3	-43.3	176.5	-61.8	0	0	0	0	112.5	C471 E518 T519 L524 L525 N526	C471-S522 VanDerWaalsContact SG-CB 3.55Å; E518-S522 PolarHBondContact O-N 3.12Å; E518-S522 PolarHBondContact O-OG 3.35Å; T519-S522 WeakPolarHBondContact O-CB 3.46Å; T519-S522 PolarHBondContact O-N 2.99Å; S522-L524 PolarHBondContact O-N 3.5Å; S522-L525 WeakPolarHBondContact O-CB 3.27Å; S522-L525 PolarHBondContact O-N 3.35Å; S522-N526 PolarHBondContact O-N 3.27Å
523	A	97.9	Very high	94.4	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-63.4	-41.7	175.7	0	0	0	0	0	112.5	L492 T519 A520 L525 N526 V527	L492-A523 HydrophobicContact CD1-CB 3.87Å; T519-A523 PolarHBondContact O-N 3.12Å; A520-A523 PolarHBondContact O-N 3.37Å; A523-L525 VanDerWaalsContact C-N 3.33Å; A523-N526 PolarHBondContact O-N 3.42Å; A523-V527 PolarHBondContact O-N 3.07Å
524	L	98.4	Very high	94.9	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-67.1	-33.5	174.1	-74.5	166.8	0	0	0	112.5	P489 L492 V493 L496 A520 C521 S522 V527 T528 F541 L544 L571	P489-L524 HydrophobicContact CB-CD2 4.15Å; L492-L524 HydrophobicContact CB-CD1 4.06Å; L492-L524 HydrophobicContact CB-CD2 4.05Å; L492-L524 HydrophobicContact CB-CG 3.99Å; L492-L524 HydrophobicContact CD1-CD2 4.16Å; L492-L524 HydrophobicContact CD1-CG 4.01Å; V493-L524 HydrophobicContact CG2-CD1 4.25Å; V493-L524 HydrophobicContact CG2-CD2 4.25Å; L496-L524 HydrophobicContact CD1-CD1 3.57Å; A520-L524 WeakPolarHBondContact O-CG 3.24Å; A520-L524 PolarHBondContact O-N 2.67Å; C521-L524 PolarHBondContact O-N 2.89Å; S522-L524 PolarHBondContact O-N 3.5Å; L524-V527 PolarHBondContact O-N 3.06Å; L524-T528 WeakPolarHBondContact O-CB 3.4Å; L524-T528 PolarHBondContact O-N 2.84Å; L524-T528 PolarHBondContact O-OG1 3.24Å; L524-F541 HydrophobicContact CD2-CE1 4.41Å; L524-L544 HydrophobicContact CD1-CD2 4.12Å; L524-L571 HydrophobicContact CB-CD1 4.11Å; L524-L571 HydrophobicContact CB-CD2 4.06Å; L524-L571 HydrophobicContact CD1-CD2 4.24Å
525	L	97.8	Very high	95.5	Very high	20 Å²	20	28.4 Å²	28.4	11%	0.105	17%	0.17	C	C	.	.	H	α-helix	trans	-65.2	-41.2	176.9	-179.6	62.6	0	0	0	111.1	C521 S522 A523 V527 T528 V529 T570 L571 M574 L633	C521-L525 VanDerWaalsContact O-CB 3.28Å; C521-L525 WeakPolarHBondContact O-CB 3.4Å; C521-L525 PolarHBondContact O-N 3.45Å; S522-L525 WeakPolarHBondContact O-CB 3.27Å; S522-L525 PolarHBondContact O-N 3.35Å; A523-L525 VanDerWaalsContact C-N 3.33Å; L525-V527 PolarHBondContact O-N 3.28Å; L525-T528 WeakPolarHBondContact O-CB 3.48Å; L525-T528 PolarHBondContact O-N 3.36Å; L525-T528 VanDerWaalsContact O-N 3.16Å; L525-V529 HydrophobicContact CD1-CG2 4.23Å; L525-V529 HydrophobicContact CG-CG2 4.45Å; L525-V529 VanDerWaalsContact O-CG2 3.26Å; L525-V529 WeakPolarHBondContact O-CG2 3.4Å; L525-V529 PolarHBondContact O-N 3.34Å; L525-T570 HydrophobicContact CD1-CG2 4.29Å; L525-T570 HydrophobicContact CD2-CG2 4.2Å; L525-L571 HydrophobicContact CB-CD1 4.32Å; L525-M574 HydrophobicContact CD1-CB 3.99Å; L525-M574 HydrophobicContact CD1-CE 4.08Å; L525-M574 HydrophobicContact CD1-CG 3.77Å; L525-L633 HydrophobicContact CD1-CD2 4.48Å; L525-L633 HydrophobicContact CD2-CD2 3.82Å
526	N	97.7	Very high	95.7	Very high	41 Å²	41	31.2 Å²	31.2	22%	0.219	17%	0.172	C	C	.	.	H	α-helix	trans	-54.9	-52.2	173.3	-70.5	-24.3	0	0	0	110.8	C471 S474 S522 A523 T528 V529 T530	C471-N526 PolarHBondContact O-ND2 3.48Å; S474-N526 PolarHBondContact OG-ND2 3.2Å; S522-N526 PolarHBondContact O-N 3.27Å; A523-N526 PolarHBondContact O-N 3.42Å; N526-T528 VanDerWaalsContact C-N 3.32Å; N526-T528 PolarHBondContact O-N 2.93Å; N526-V529 PolarHBondContact O-N 3.41Å; N526-T530 PolarHBondContact O-N 3.44Å; N526-T530 PolarHBondContact O-OG1 2.97Å
527	V	97.6	Very high	95.8	Very high	8 Å²	8	37.8 Å²	37.8	5%	0.048	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-42.5	176.6	-179.8	0	0	0	0	111.5	L484 P489 A523 L524 L525 V529 T530 E531 V535 F541	L484-V527 HydrophobicContact CD2-CG1 3.93Å; P489-V527 HydrophobicContact CG-CG1 4.48Å; A523-V527 PolarHBondContact O-N 3.07Å; L524-V527 PolarHBondContact O-N 3.06Å; L525-V527 PolarHBondContact O-N 3.28Å; V527-V529 VanDerWaalsContact C-N 3.27Å; V527-V529 PolarHBondContact O-N 2.86Å; V527-T530 PolarHBondContact O-N 3.42Å; V527-E531 HydrophobicContact CG1-CB 4.2Å; V527-E531 WeakPolarHBondContact O-CA 3.41Å; V527-E531 WeakPolarHBondContact O-CB 3.4Å; V527-E531 PolarHBondContact O-N 2.82Å; V527-V535 HydrophobicContact CG1-CG2 4.47Å; V527-F541 HydrophobicContact CB-CZ 4.5Å; V527-F541 HydrophobicContact CG1-CZ 3.87Å
528	T	97.2	Very high	95.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.5	-36.5	179.3	-57.1	0	0	0	0	112.3	L524 L525 N526 M574 I575 L578	L524-T528 WeakPolarHBondContact O-CB 3.4Å; L524-T528 PolarHBondContact O-N 2.84Å; L524-T528 PolarHBondContact O-OG1 3.24Å; L525-T528 WeakPolarHBondContact O-CB 3.48Å; L525-T528 PolarHBondContact O-N 3.36Å; L525-T528 VanDerWaalsContact O-N 3.16Å; N526-T528 VanDerWaalsContact C-N 3.32Å; N526-T528 PolarHBondContact O-N 2.93Å; T528-M574 HydrophobicContact CG2-CB 3.8Å; T528-I575 HydrophobicContact CG2-CG1 3.83Å; T528-L578 HydrophobicContact CG2-CD1 4.31Å
529	V	95.7	Very high	95.9	Very high	65 Å²	65	42.5 Å²	42.5	39%	0.394	23%	0.228	S	C	.	.	H	α-helix	trans	-76.3	-47	179.3	172	0	0	0	0	111.5	L525 N526 V527 M574	L525-V529 HydrophobicContact CD1-CG2 4.23Å; L525-V529 HydrophobicContact CG-CG2 4.45Å; L525-V529 VanDerWaalsContact O-CG2 3.26Å; L525-V529 WeakPolarHBondContact O-CG2 3.4Å; L525-V529 PolarHBondContact O-N 3.34Å; N526-V529 PolarHBondContact O-N 3.41Å; V527-V529 VanDerWaalsContact C-N 3.27Å; V527-V529 PolarHBondContact O-N 2.86Å; V529-M574 HydrophobicContact CG2-CE 3.28Å
530	T	96.9	Very high	96	Very high	54 Å²	54	41.4 Å²	41.4	33%	0.331	22%	0.221	S	C	.	.	H	α-helix	trans	-90.3	-24	-168	58.3	0	0	0	0	113.5	R480 N526 V527 P532	R480-T530 WeakPolarHBondContact CD-OG1 3.45Å; R480-T530 PolarHBondContact NE-OG1 3.33Å; N526-T530 PolarHBondContact O-N 3.44Å; N526-T530 PolarHBondContact O-OG1 2.97Å; V527-T530 PolarHBondContact O-N 3.42Å; T530-P532 WeakPolarHBondContact O-CD 3.38Å
531	E	96.8	Very high	95.9	Very high	38 Å²	38	41.5 Å²	41.5	18%	0.178	22%	0.222	C	C	.	.			trans	-124.8	55.5	-171.3	-56.5	-67.5	161.1	0	0	112.5	R480 L484 V527 D533 S534 V535	R480-E531 HydrophobicContact CG-CG 4.33Å; R480-E531 IonicContact CZ-OE1 3.53Å; R480-E531 IonicContact NE-OE1 2.72Å; R480-E531 PolarHBondContact NE-OE1 3.45Å; R480-E531 IonicContact NH2-OE1 2.98Å; L484-E531 HydrophobicContact CD1-CB 4.36Å; L484-E531 HydrophobicContact CD1-CG 3.87Å; V527-E531 HydrophobicContact CG1-CB 4.2Å; V527-E531 WeakPolarHBondContact O-CA 3.41Å; V527-E531 WeakPolarHBondContact O-CB 3.4Å; V527-E531 PolarHBondContact O-N 2.82Å; E531-D533 PolarHBondContact O-N 3.09Å; E531-D533 VanDerWaalsContact O-N 3.16Å; E531-S534 PolarHBondContact O-N 3.23Å; E531-S534 VanDerWaalsContact O-N 3.14Å; E531-V535 VanDerWaalsContact O-CG2 3.25Å; E531-V535 WeakPolarHBondContact O-CG2 3.46Å; E531-V535 PolarHBondContact O-N 2.79Å; E531-V535 VanDerWaalsContact O-N 3.1Å
532	P	95	Very high	95.7	Very high	42 Å²	42	49.1 Å²	49.1	27%	0.273	25%	0.25	S	S	.	.	H	α-helix	trans	-62.4	-29.3	-171.2	26.6	-36.3	0	0	0	113.5	T530 R536 L578	T530-P532 WeakPolarHBondContact O-CD 3.38Å; P532-R536 WeakPolarHBondContact O-CG 3.46Å; P532-R536 PolarHBondContact O-N 3.46Å; P532-R536 PolarHBondContact O-NH1 3.48Å; P532-L578 HydrophobicContact CB-CD1 4.02Å; P532-L578 HydrophobicContact CB-CD2 3.67Å; P532-L578 HydrophobicContact CB-CG 4.46Å
533	D	93.7	Very high	95.7	Very high	98 Å²	98	50.8 Å²	50.8	52%	0.524	26%	0.259	S	S	.	.	H	α-helix	trans	-73.3	-37.6	178.6	-70.6	-19	0	0	0	112.3	E531 R536 K537	E531-D533 PolarHBondContact O-N 3.09Å; E531-D533 VanDerWaalsContact O-N 3.16Å; D533-R536 IonicContact OD1-NH1 2.71Å; D533-R536 PolarHBondContact OD1-NH1 2.91Å; D533-K537 WeakPolarHBondContact O-CG 3.46Å; D533-K537 PolarHBondContact O-N 2.76Å
534	S	92.6	Very high	95.6	Very high	42 Å²	42	50.8 Å²	50.8	29%	0.294	26%	0.259	S	S	.	.	H	α-helix	trans	-65.1	-47	174.8	-57	0	0	0	0	110.1	E531 R536 K537 D538	E531-S534 PolarHBondContact O-N 3.23Å; E531-S534 VanDerWaalsContact O-N 3.14Å; S534-R536 VanDerWaalsContact C-N 3.27Å; S534-R536 PolarHBondContact O-N 3.36Å; S534-K537 PolarHBondContact O-N 3.35Å; S534-D538 WeakPolarHBondContact O-CB 3.35Å; S534-D538 PolarHBondContact O-N 3.37Å
535	V	95.2	Very high	95.5	Very high	7 Å²	7	52.6 Å²	52.6	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-57.7	-37.8	178.6	175.5	0	0	0	0	112.3	V527 E531 K537 F541 I575 L578	V527-V535 HydrophobicContact CG1-CG2 4.47Å; E531-V535 VanDerWaalsContact O-CG2 3.25Å; E531-V535 WeakPolarHBondContact O-CG2 3.46Å; E531-V535 PolarHBondContact O-N 2.79Å; E531-V535 VanDerWaalsContact O-N 3.1Å; V535-K537 VanDerWaalsContact C-N 3.34Å; V535-K537 PolarHBondContact O-N 2.86Å; V535-F541 HydrophobicContact CB-CD2 4.38Å; V535-F541 HydrophobicContact CB-CE2 4.47Å; V535-F541 HydrophobicContact CB-CG 4.41Å; V535-F541 HydrophobicContact CG1-CB 4.23Å; V535-F541 HydrophobicContact CG1-CD1 3.81Å; V535-F541 HydrophobicContact CG1-CD2 4.31Å; V535-F541 HydrophobicContact CG1-CE1 4.24Å; V535-F541 HydrophobicContact CG1-CG 3.85Å; V535-F541 HydrophobicContact CG2-CD1 4.41Å; V535-F541 HydrophobicContact CG2-CD2 4.45Å; V535-F541 HydrophobicContact CG2-CE1 4.03Å; V535-F541 HydrophobicContact CG2-CE2 4.08Å; V535-F541 HydrophobicContact CG2-CZ 3.85Å; V535-I575 HydrophobicContact CG1-CG1 4.5Å; V535-I575 HydrophobicContact CG1-CG2 4.33Å; V535-L578 HydrophobicContact CB-CD1 4.01Å; V535-L578 HydrophobicContact CG1-CD1 3.75Å
536	R	93.4	Very high	95.3	Very high	129 Å²	129	54.6 Å²	54.6	49%	0.487	29%	0.287	S	S	.	.	H	α-helix	trans	-69.8	-28.7	178.1	-74	-176.9	-159.2	105.5	-3.3	113.7	P532 D533 S534 L578	P532-R536 WeakPolarHBondContact O-CG 3.46Å; P532-R536 PolarHBondContact O-N 3.46Å; P532-R536 PolarHBondContact O-NH1 3.48Å; D533-R536 IonicContact OD1-NH1 2.71Å; D533-R536 PolarHBondContact OD1-NH1 2.91Å; S534-R536 VanDerWaalsContact C-N 3.27Å; S534-R536 PolarHBondContact O-N 3.36Å; R536-L578 HydrophobicContact CG-CB 4.35Å; R536-L578 PolarHBondContact NE-O 3.04Å
537	K	92.6	Very high	95.2	Very high	159 Å²	159	53.3 Å²	53.3	69%	0.691	28%	0.279	S	S	*	.	H	α-helix	trans	-95.6	-39.8	-172.4	-67.9	172	-173.4	171.4	0	111.9	D533 S534 V535	D533-K537 WeakPolarHBondContact O-CG 3.46Å; D533-K537 PolarHBondContact O-N 2.76Å; S534-K537 PolarHBondContact O-N 3.35Å; V535-K537 VanDerWaalsContact C-N 3.34Å; V535-K537 PolarHBondContact O-N 2.86Å
538	D	94.4	Very high	95.1	Very high	37 Å²	37	53 Å²	53	20%	0.198	28%	0.277	C	S	.	.			trans	-69.8	124.2	-173	-175.9	-21.2	0	0	0	111.3	S534 C540 F541	S534-D538 WeakPolarHBondContact O-CB 3.35Å; S534-D538 PolarHBondContact O-N 3.37Å; D538-C540 VanDerWaalsContact C-N 3.25Å; D538-C540 PolarHBondContact O-N 3.32Å; D538-C540 WeakPolarHBondContact OD1-CB 3.49Å; D538-C540 PolarHBondContact OD1-N 3.39Å; D538-C540 PolarHBondContact OD1-SG 3.01Å; D538-C540 PolarHBondContact OD2-SG 3.42Å; D538-F541 HydrophobicContact CB-CD2 4.04Å; D538-F541 HydrophobicContact CB-CE2 4.48Å; D538-F541 PolarHBondContact O-N 2.93Å
539	P	95.1	Very high	94.9	Very high	79 Å²	79	53.6 Å²	53.6	51%	0.513	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-23.3	178.9	27.6	-35.8	0	0	0	114.3	F541 R542 T543	P539-F541 PolarHBondContact O-N 3.35Å; P539-R542 WeakPolarHBondContact O-CB 3.48Å; P539-R542 PolarHBondContact O-N 3.03Å; P539-T543 PolarHBondContact O-N 3.26Å; P539-T543 PolarHBondContact O-OG1 2.84Å
540	C	96.4	Very high	94.8	Very high	11 Å²	11	55 Å²	55	7%	0.074	28%	0.284	C	S	.	.	H	α-helix	trans	-62.2	-32.7	-178.6	76.9	0	0	0	0	112.1	A490 D538 R542 T543 L544	A490-C540 HydrophobicContact CB-CB 4.04Å; D538-C540 VanDerWaalsContact C-N 3.25Å; D538-C540 PolarHBondContact O-N 3.32Å; D538-C540 WeakPolarHBondContact OD1-CB 3.49Å; D538-C540 PolarHBondContact OD1-N 3.39Å; D538-C540 PolarHBondContact OD1-SG 3.01Å; D538-C540 PolarHBondContact OD2-SG 3.42Å; C540-R542 VanDerWaalsContact C-N 3.31Å; C540-R542 PolarHBondContact O-N 2.95Å; C540-T543 WeakPolarHBondContact O-CB 3.33Å; C540-T543 PolarHBondContact O-N 3.49Å; C540-L544 WeakPolarHBondContact O-CB 3.28Å; C540-L544 PolarHBondContact O-N 3.44Å
541	F	95.9	Very high	94.7	Very high	3 Å²	3	52.5 Å²	52.5	1%	0.013	27%	0.268	C	S	.	.	H	α-helix	trans	-70.4	-26.7	175.9	-72.7	-85.4	0	0	0	112.5	P489 L524 V527 V535 D538 P539 L544 E545 I575	P489-F541 HydrophobicContact CB-CE2 4.11Å; P489-F541 HydrophobicContact CB-CZ 4.13Å; L524-F541 HydrophobicContact CD2-CE1 4.41Å; V527-F541 HydrophobicContact CB-CZ 4.5Å; V527-F541 HydrophobicContact CG1-CZ 3.87Å; V535-F541 HydrophobicContact CB-CD2 4.38Å; V535-F541 HydrophobicContact CB-CE2 4.47Å; V535-F541 HydrophobicContact CB-CG 4.41Å; V535-F541 HydrophobicContact CG1-CB 4.23Å; V535-F541 HydrophobicContact CG1-CD1 3.81Å; V535-F541 HydrophobicContact CG1-CD2 4.31Å; V535-F541 HydrophobicContact CG1-CE1 4.24Å; V535-F541 HydrophobicContact CG1-CG 3.85Å; V535-F541 HydrophobicContact CG2-CD1 4.41Å; V535-F541 HydrophobicContact CG2-CD2 4.45Å; V535-F541 HydrophobicContact CG2-CE1 4.03Å; V535-F541 HydrophobicContact CG2-CE2 4.08Å; V535-F541 HydrophobicContact CG2-CZ 3.85Å; D538-F541 HydrophobicContact CB-CD2 4.04Å; D538-F541 HydrophobicContact CB-CE2 4.48Å; D538-F541 PolarHBondContact O-N 2.93Å; P539-F541 PolarHBondContact O-N 3.35Å; F541-L544 HydrophobicContact CD1-CD2 4.03Å; F541-L544 HydrophobicContact CE1-CD2 4.4Å; F541-L544 PolarHBondContact O-N 3.43Å; F541-E545 WeakPolarHBondContact O-CG 3.23Å; F541-E545 PolarHBondContact O-N 3.07Å; F541-I575 HydrophobicContact CD1-CD1 4.11Å; F541-I575 HydrophobicContact CD1-CG1 4.39Å
542	R	93.3	Very high	94.5	Very high	161 Å²	161	50.7 Å²	50.7	61%	0.608	26%	0.26	S	S	*	.	H	α-helix	trans	-70.2	-40.4	170.6	-71.9	-177.3	-94.3	169.8	-6.7	111.4	P539 C540 L544 E545 A546	P539-R542 WeakPolarHBondContact O-CB 3.48Å; P539-R542 PolarHBondContact O-N 3.03Å; C540-R542 VanDerWaalsContact C-N 3.31Å; C540-R542 PolarHBondContact O-N 2.95Å; R542-L544 VanDerWaalsContact C-N 3.33Å; R542-E545 PolarHBondContact O-N 3.5Å; R542-A546 PolarHBondContact O-N 3.37Å; R542-A546 VanDerWaalsContact O-N 3.12Å
543	T	96.4	Very high	94.3	Very high	72 Å²	72	49.7 Å²	49.7	44%	0.442	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-44.1	172.4	-52.4	0	0	0	0	110.9	V493 I497 P539 C540 A546 H547	V493-T543 HydrophobicContact CG1-CG2 4.33Å; I497-T543 HydrophobicContact CD1-CG2 3.71Å; P539-T543 PolarHBondContact O-N 3.26Å; P539-T543 PolarHBondContact O-OG1 2.84Å; C540-T543 WeakPolarHBondContact O-CB 3.33Å; C540-T543 PolarHBondContact O-N 3.49Å; T543-A546 PolarHBondContact O-N 3.44Å; T543-H547 PolarHBondContact O-N 2.7Å
544	L	96.6	Very high	94.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.7	-48.1	175.1	178.8	59.4	0	0	0	111.7	V493 L496 L524 C540 F541 R542 A546 H547 L548 L571 I575	V493-L544 HydrophobicContact CG1-CB 4.17Å; V493-L544 HydrophobicContact CG2-CB 3.87Å; V493-L544 HydrophobicContact CG2-CD1 4.27Å; V493-L544 HydrophobicContact CG2-CD2 4.11Å; V493-L544 HydrophobicContact CG2-CG 4.31Å; L496-L544 HydrophobicContact CD1-CD1 4.19Å; L524-L544 HydrophobicContact CD1-CD2 4.12Å; C540-L544 WeakPolarHBondContact O-CB 3.28Å; C540-L544 PolarHBondContact O-N 3.44Å; F541-L544 HydrophobicContact CD1-CD2 4.03Å; F541-L544 HydrophobicContact CE1-CD2 4.4Å; F541-L544 PolarHBondContact O-N 3.43Å; R542-L544 VanDerWaalsContact C-N 3.33Å; L544-A546 VanDerWaalsContact C-N 3.3Å; L544-A546 PolarHBondContact O-N 2.87Å; L544-H547 WeakPolarHBondContact O-CB 3.37Å; L544-H547 PolarHBondContact O-N 2.84Å; L544-L548 HydrophobicContact CD1-CD1 4.17Å; L544-L548 HydrophobicContact CD1-CD2 4.17Å; L544-L548 HydrophobicContact CD1-CG 3.94Å; L544-L548 HydrophobicContact CG-CD1 4.02Å; L544-L548 HydrophobicContact CG-CG 4.21Å; L544-L548 VanDerWaalsContact O-CG 3.24Å; L544-L548 WeakPolarHBondContact O-CG 3.45Å; L544-L548 PolarHBondContact O-N 3.28Å; L544-L571 HydrophobicContact CD1-CD2 4.26Å; L544-L571 HydrophobicContact CD2-CD2 3.87Å; L544-L571 HydrophobicContact CD2-CG 4.24Å; L544-L571 HydrophobicContact CG-CD2 4.46Å; L544-I575 HydrophobicContact CD2-CD1 3.76Å; L544-I575 HydrophobicContact CG-CD1 4.23Å
545	E	94.4	Very high	94.1	Very high	38 Å²	38	45.7 Å²	45.7	18%	0.178	23%	0.231	C	C	.	.	H	α-helix	trans	-57.5	-42.3	177.4	-77	-170.6	124	0	0	112.8	F541 R542 L548 S549 I575 K579	F541-E545 WeakPolarHBondContact O-CG 3.23Å; F541-E545 PolarHBondContact O-N 3.07Å; R542-E545 PolarHBondContact O-N 3.5Å; E545-L548 PolarHBondContact O-N 3.06Å; E545-S549 WeakPolarHBondContact O-CB 3.31Å; E545-S549 PolarHBondContact O-N 3.41Å; E545-I575 HydrophobicContact CG-CB 4.32Å; E545-I575 HydrophobicContact CG-CD1 4.21Å; E545-I575 HydrophobicContact CG-CG2 3.69Å; E545-I575 VanDerWaalsContact OE1-CG2 3.27Å; E545-I575 WeakPolarHBondContact OE1-CG2 3.3Å; E545-K579 WeakPolarHBondContact OE1-CE 3.33Å; E545-K579 IonicContact OE1-NZ 3.43Å; E545-K579 PolarHBondContact OE1-NZ 3.49Å; E545-K579 WeakPolarHBondContact OE2-CE 3.26Å; E545-K579 IonicContact OE2-NZ 3.14Å; E545-K579 PolarHBondContact OE2-NZ 3.14Å
546	A	94.3	Very high	93.7	Very high	62 Å²	62	48.2 Å²	48.2	51%	0.512	24%	0.243	S	C	.	.	H	α-helix	trans	-62.2	-46.3	176.3	0	0	0	0	0	111.2	R542 T543 L544 S549 E550	R542-A546 PolarHBondContact O-N 3.37Å; R542-A546 VanDerWaalsContact O-N 3.12Å; T543-A546 PolarHBondContact O-N 3.44Å; L544-A546 VanDerWaalsContact C-N 3.3Å; L544-A546 PolarHBondContact O-N 2.87Å; A546-S549 PolarHBondContact O-N 3.5Å; A546-E550 PolarHBondContact O-N 3.31Å
547	H	95.5	Very high	93.4	Very high	15 Å²	15	48.1 Å²	48.1	7%	0.069	25%	0.252	C	S	.	.	H	α-helix	trans	-59.2	-48.8	175.6	174.5	65.4	0	0	0	112.4	I497 W500 T543 L544 S549 E550 A551 Y568	I497-H547 HydrophobicContact CD1-CB 4.45Å; I497-H547 HydrophobicContact CG1-CB 4.03Å; W500-H547 AromaticContact CD1-CE1 3.4Å; W500-H547 AromaticContact CG-CE1 3.55Å; T543-H547 PolarHBondContact O-N 2.7Å; L544-H547 WeakPolarHBondContact O-CB 3.37Å; L544-H547 PolarHBondContact O-N 2.84Å; H547-S549 VanDerWaalsContact C-N 3.31Å; H547-S549 PolarHBondContact O-N 2.87Å; H547-E550 PolarHBondContact O-N 3.48Å; H547-E550 VanDerWaalsContact O-N 3.13Å; H547-A551 VanDerWaalsContact O-CB 3.31Å; H547-A551 WeakPolarHBondContact O-CB 3.41Å; H547-A551 PolarHBondContact O-N 3.34Å; H547-Y568 AromaticContact NE2-CE2 3.57Å; H547-Y568 AromaticContact NE2-CZ 3.66Å; H547-Y568 PolarHBondContact NE2-OH 3.44Å
548	L	95.8	Very high	93.2	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-59.8	-41.5	178.4	-66.1	178.6	0	0	0	111.6	L544 E545 E550 L552 Y568 L571 I575 F593	L544-L548 HydrophobicContact CD1-CD1 4.17Å; L544-L548 HydrophobicContact CD1-CD2 4.17Å; L544-L548 HydrophobicContact CD1-CG 3.94Å; L544-L548 HydrophobicContact CG-CD1 4.02Å; L544-L548 HydrophobicContact CG-CG 4.21Å; L544-L548 VanDerWaalsContact O-CG 3.24Å; L544-L548 WeakPolarHBondContact O-CG 3.45Å; L544-L548 PolarHBondContact O-N 3.28Å; E545-L548 PolarHBondContact O-N 3.06Å; L548-E550 VanDerWaalsContact C-N 3.31Å; L548-E550 PolarHBondContact O-N 2.97Å; L548-L552 WeakPolarHBondContact O-CB 3.46Å; L548-L552 PolarHBondContact O-N 2.99Å; L548-Y568 HydrophobicContact CD2-CD1 3.92Å; L548-Y568 HydrophobicContact CD2-CD2 3.39Å; L548-Y568 HydrophobicContact CD2-CE1 4.31Å; L548-Y568 HydrophobicContact CD2-CE2 3.84Å; L548-Y568 HydrophobicContact CD2-CG 3.42Å; L548-Y568 VanDerWaalsContact CD2-CG 3.42Å; L548-L571 HydrophobicContact CD1-CB 4.2Å; L548-L571 HydrophobicContact CD1-CD2 4.34Å; L548-L571 HydrophobicContact CD1-CG 4.12Å; L548-I575 HydrophobicContact CD1-CD1 4.42Å; L548-F593 HydrophobicContact CB-CE2 4.39Å
549	S	93.8	Very high	92.7	Very high	13 Å²	13	47.8 Å²	47.8	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-35	176.7	-173.9	0	0	0	0	112.9	E545 A546 H547 P553 G589	E545-S549 WeakPolarHBondContact O-CB 3.31Å; E545-S549 PolarHBondContact O-N 3.41Å; A546-S549 PolarHBondContact O-N 3.5Å; H547-S549 VanDerWaalsContact C-N 3.31Å; H547-S549 PolarHBondContact O-N 2.87Å; S549-P553 VanDerWaalsContact O-CD 3.26Å; S549-P553 WeakPolarHBondContact O-CD 3.48Å; S549-P553 WeakPolarHBondContact O-CG 3.34Å; S549-G589 PolarHBondContact OG-O 3.3Å
550	E	93.4	Very high	92.3	Very high	95 Å²	95	52.6 Å²	52.6	44%	0.444	27%	0.267	S	S	.	.	H	α-helix	trans	-78.4	-41.3	178.1	-164.6	-166.3	138.8	0	0	112.9	R504 A546 H547 L548 P553	R504-E550 IonicContact CZ-OE1 3.53Å; R504-E550 IonicContact NH1-OE1 2.96Å; R504-E550 PolarHBondContact NH1-OE1 3.12Å; R504-E550 IonicContact NH2-OE1 2.65Å; R504-E550 PolarHBondContact NH2-OE1 2.87Å; A546-E550 PolarHBondContact O-N 3.31Å; H547-E550 PolarHBondContact O-N 3.48Å; H547-E550 VanDerWaalsContact O-N 3.13Å; L548-E550 VanDerWaalsContact C-N 3.31Å; L548-E550 PolarHBondContact O-N 2.97Å; E550-P553 WeakPolarHBondContact O-CD 3.34Å
551	A	93.4	Very high	92	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-80.6	-41.4	-171.9	0	0	0	0	0	113.4	W500 H547 P553 V554 L555 Y568	W500-A551 HydrophobicContact CD2-CB 4.07Å; W500-A551 HydrophobicContact CG-CB 4.45Å; W500-A551 HydrophobicContact CH2-CB 4.46Å; W500-A551 HydrophobicContact CZ2-CB 3.76Å; H547-A551 VanDerWaalsContact O-CB 3.31Å; H547-A551 WeakPolarHBondContact O-CB 3.41Å; H547-A551 PolarHBondContact O-N 3.34Å; A551-P553 VanDerWaalsContact C-CD 3.43Å; A551-V554 WeakPolarHBondContact O-CB 3.44Å; A551-V554 PolarHBondContact O-N 3.33Å; A551-L555 PolarHBondContact O-N 2.86Å; A551-Y568 HydrophobicContact CB-CD2 3.96Å; A551-Y568 HydrophobicContact CB-CE2 3.62Å
552	L	93.7	Very high	91.9	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-55	-42.7	-174.2	-174.8	64.1	0	0	0	114.3	L548 V554 L555 M556 A565 C569 F593 V596 T597	L548-L552 WeakPolarHBondContact O-CB 3.46Å; L548-L552 PolarHBondContact O-N 2.99Å; L552-V554 PolarHBondContact O-N 3.44Å; L552-L555 PolarHBondContact O-N 3Å; L552-M556 HydrophobicContact CD1-CG 4.47Å; L552-M556 WeakPolarHBondContact O-CG 3.32Å; L552-M556 PolarHBondContact O-N 3.25Å; L552-A565 HydrophobicContact CD1-CB 4.21Å; L552-A565 WeakPolarHBondContact CD1-O 3.39Å; L552-C569 HydrophobicContact CD1-CB 4.42Å; L552-C569 HydrophobicContact CD2-CB 4.45Å; L552-F593 HydrophobicContact CD2-CD2 4.06Å; L552-F593 HydrophobicContact CD2-CE2 3.72Å; L552-F593 HydrophobicContact CD2-CZ 4.5Å; L552-V596 HydrophobicContact CB-CG1 4.37Å; L552-V596 HydrophobicContact CD2-CG1 3.98Å; L552-V596 HydrophobicContact CG-CG1 3.82Å; L552-T597 WeakPolarHBondContact CD2-OG1 3.49Å
553	P	91.6	Very high	92	Very high	21 Å²	21	45.3 Å²	45.3	14%	0.136	24%	0.24	C	C	.	.	H	α-helix	trans	-60.1	-30.9	177	-20.1	30	0	0	0	113.7	S549 E550 A551 N557 V596	S549-P553 VanDerWaalsContact O-CD 3.26Å; S549-P553 WeakPolarHBondContact O-CD 3.48Å; S549-P553 WeakPolarHBondContact O-CG 3.34Å; E550-P553 WeakPolarHBondContact O-CD 3.34Å; A551-P553 VanDerWaalsContact C-CD 3.43Å; P553-N557 PolarHBondContact O-ND2 3.37Å; P553-V596 HydrophobicContact CB-CG1 4.34Å; P553-V596 HydrophobicContact CB-CG2 4.31Å; P553-V596 HydrophobicContact CG-CG1 4.12Å; P553-V596 HydrophobicContact CG-CG2 3.97Å
554	V	91.1	Very high	91.9	Very high	55 Å²	55	42 Å²	42	33%	0.333	22%	0.219	S	C	.	.	H	α-helix	trans	-77.8	-45.1	177.7	-178.1	0	0	0	0	109.9	W500 A551 L552 M556 N557	W500-V554 HydrophobicContact CH2-CB 3.88Å; W500-V554 HydrophobicContact CH2-CG1 3.83Å; W500-V554 HydrophobicContact CZ2-CB 3.83Å; W500-V554 HydrophobicContact CZ2-CG1 4.03Å; W500-V554 HydrophobicContact CZ2-CG2 4.34Å; A551-V554 WeakPolarHBondContact O-CB 3.44Å; A551-V554 PolarHBondContact O-N 3.33Å; L552-V554 PolarHBondContact O-N 3.44Å; V554-M556 VanDerWaalsContact C-N 3.3Å; V554-M556 PolarHBondContact O-N 3.17Å; V554-N557 PolarHBondContact O-N 3.12Å; V554-N557 VanDerWaalsContact O-N 3.11Å
555	L	90.3	Very high	91.8	Very high	1 Å²	1	42 Å²	42	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-57.6	-40.2	179.1	-73.7	171.8	0	0	0	112.6	W500 A551 L552 N557 K558 L561 L564 A565 Y568	W500-L555 HydrophobicContact CE3-CD2 4.31Å; W500-L555 HydrophobicContact CH2-CD2 3.79Å; W500-L555 HydrophobicContact CH2-CG 3.73Å; W500-L555 HydrophobicContact CZ3-CD1 4.49Å; W500-L555 HydrophobicContact CZ3-CD2 3.36Å; W500-L555 HydrophobicContact CZ3-CG 3.77Å; A551-L555 PolarHBondContact O-N 2.86Å; L552-L555 PolarHBondContact O-N 3Å; L555-N557 PolarHBondContact O-N 3.39Å; L555-N557 VanDerWaalsContact O-N 3.08Å; L555-K558 WeakPolarHBondContact O-CB 3.31Å; L555-K558 PolarHBondContact O-N 3.34Å; L555-L561 HydrophobicContact CD2-CB 3.92Å; L555-L561 HydrophobicContact CD2-CD1 3.72Å; L555-L561 HydrophobicContact CD2-CG 4.48Å; L555-L564 HydrophobicContact CD1-CG 4.29Å; L555-L564 HydrophobicContact CD2-CD2 3.9Å; L555-L564 HydrophobicContact CD2-CG 4.31Å; L555-A565 HydrophobicContact CB-CB 3.98Å; L555-Y568 HydrophobicContact CD1-CD2 3.47Å; L555-Y568 VanDerWaalsContact CD1-CD2 3.47Å; L555-Y568 HydrophobicContact CD1-CE2 3.87Å; L555-Y568 HydrophobicContact CD1-CG 3.86Å
556	M	86.8	Confident	92	Very high	60 Å²	60	40.2 Å²	40.2	30%	0.296	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.8	178.5	-75.1	-174.4	65.7	0	0	114.3	L552 V554 K558 V596 R599 F600	L552-M556 HydrophobicContact CD1-CG 4.47Å; L552-M556 WeakPolarHBondContact O-CG 3.32Å; L552-M556 PolarHBondContact O-N 3.25Å; V554-M556 VanDerWaalsContact C-N 3.3Å; V554-M556 PolarHBondContact O-N 3.17Å; M556-K558 VanDerWaalsContact C-N 3.29Å; M556-V596 HydrophobicContact CG-CG1 4.36Å; M556-V596 HydrophobicContact SD-CB 4.36Å; M556-V596 HydrophobicContact SD-CG1 3.23Å; M556-V596 WeakPolarHBondContact SD-CG1 3.42Å; M556-V596 VanDerWaalsContact SD-O 3.41Å; M556-R599 HydrophobicContact CE-CB 4.01Å; M556-F600 HydrophobicContact CE-CB 3.68Å; M556-F600 HydrophobicContact CE-CD2 4.29Å; M556-F600 HydrophobicContact CG-CB 4.38Å; M556-F600 HydrophobicContact CG-CD2 3.96Å; M556-F600 HydrophobicContact SD-CB 3.82Å; M556-F600 HydrophobicContact SD-CD2 4.46Å
557	N	86.3	Confident	92.1	Very high	127 Å²	127	37.6 Å²	37.6	68%	0.679	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.5	11.7	177.8	-63.4	-58.3	0	0	0	112.4	P553 V554 L555	P553-N557 PolarHBondContact O-ND2 3.37Å; V554-N557 PolarHBondContact O-N 3.12Å; V554-N557 VanDerWaalsContact O-N 3.11Å; L555-N557 PolarHBondContact O-N 3.39Å; L555-N557 VanDerWaalsContact O-N 3.08Å
558	K	88.3	Confident	92.2	Very high	87 Å²	87	36.9 Å²	36.9	38%	0.378	19%	0.185	S	C	.	.			trans	-128.3	90.3	-176.3	-59.8	-65	-178.4	173.8	0	109.5	L511 L555 M556 R560 L561	L511-K558 HydrophobicContact CD1-CD 3.79Å; L511-K558 HydrophobicContact CD1-CG 4.02Å; L555-K558 WeakPolarHBondContact O-CB 3.31Å; L555-K558 PolarHBondContact O-N 3.34Å; M556-K558 VanDerWaalsContact C-N 3.29Å; K558-R560 VanDerWaalsContact C-N 3.26Å; K558-R560 PolarHBondContact O-N 3.1Å; K558-R560 VanDerWaalsContact O-N 3.16Å; K558-L561 HydrophobicContact CB-CB 4.2Å; K558-L561 HydrophobicContact CB-CD1 4.06Å; K558-L561 HydrophobicContact CB-CG 4.2Å; K558-L561 HydrophobicContact CG-CD1 4.46Å; K558-L561 PolarHBondContact O-N 3.19Å
559	P	85.5	Confident	92.3	Very high	102 Å²	102	36.8 Å²	36.8	66%	0.662	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-54.2	-38.3	-175.8	-27.4	34.4	0	0	0	114	L561 L562	P559-L561 PolarHBondContact O-N 3.37Å; P559-L561 VanDerWaalsContact O-N 3.08Å; P559-L562 VanDerWaalsContact O-CB 3.28Å; P559-L562 WeakPolarHBondContact O-CB 3.47Å; P559-L562 PolarHBondContact O-N 3.1Å; P559-L562 VanDerWaalsContact O-N 3.11Å
560	R	85.9	Confident	92.5	Very high	181 Å²	181	36.2 Å²	36.2	68%	0.683	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-62.7	-14.8	176.8	-67.4	-172.5	176.1	-172.7	-3.4	114.8	K558	K558-R560 VanDerWaalsContact C-N 3.26Å; K558-R560 PolarHBondContact O-N 3.1Å; K558-R560 VanDerWaalsContact O-N 3.16Å
561	L	90.4	Very high	92.7	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-111.2	20.3	180	-57	-179.6	0	0	0	111.8	L511 R513 L555 K558 P559 V563 L564 A565	L511-L561 HydrophobicContact CB-CD1 3.92Å; L511-L561 HydrophobicContact CD1-CD1 4.33Å; R513-L561 HydrophobicContact CB-CD2 4.5Å; L555-L561 HydrophobicContact CD2-CB 3.92Å; L555-L561 HydrophobicContact CD2-CD1 3.72Å; L555-L561 HydrophobicContact CD2-CG 4.48Å; K558-L561 HydrophobicContact CB-CB 4.2Å; K558-L561 HydrophobicContact CB-CD1 4.06Å; K558-L561 HydrophobicContact CB-CG 4.2Å; K558-L561 HydrophobicContact CG-CD1 4.46Å; K558-L561 PolarHBondContact O-N 3.19Å; P559-L561 PolarHBondContact O-N 3.37Å; P559-L561 VanDerWaalsContact O-N 3.08Å; L561-V563 VanDerWaalsContact C-N 3.33Å; L561-V563 PolarHBondContact O-N 2.84Å; L561-L564 PolarHBondContact O-N 3.33Å; L561-A565 PolarHBondContact O-N 2.89Å
562	L	93.4	Very high	92.9	Very high	13 Å²	13	31.9 Å²	31.9	7%	0.068	16%	0.162	C	C	.	.	H	α-helix	trans	-58.1	-42.9	-178.4	-175.8	156.2	0	0	0	112.2	P559 L564 A565 A566 D619 W620 A627	P559-L562 VanDerWaalsContact O-CB 3.28Å; P559-L562 WeakPolarHBondContact O-CB 3.47Å; P559-L562 PolarHBondContact O-N 3.1Å; P559-L562 VanDerWaalsContact O-N 3.11Å; L562-L564 VanDerWaalsContact C-N 3.34Å; L562-L564 PolarHBondContact O-N 3.31Å; L562-A565 WeakPolarHBondContact O-CB 3.49Å; L562-A565 PolarHBondContact O-N 2.9Å; L562-A565 VanDerWaalsContact O-N 3.14Å; L562-A566 PolarHBondContact O-N 3.21Å; L562-D619 VanDerWaalsContact CD1-O 3.32Å; L562-D619 WeakPolarHBondContact CD1-O 3.28Å; L562-W620 HydrophobicContact CD1-CD2 3.86Å; L562-W620 HydrophobicContact CD1-CE3 4.33Å; L562-W620 HydrophobicContact CD1-CG 3.93Å; L562-W620 HydrophobicContact CD2-CD2 4.17Å; L562-W620 HydrophobicContact CD2-CE3 3.79Å; L562-W620 HydrophobicContact CD2-CH2 4.41Å; L562-W620 HydrophobicContact CD2-CZ3 3.93Å; L562-W620 HydrophobicContact CG-CD2 4.45Å; L562-A627 HydrophobicContact CD2-CB 3.65Å
563	V	94.7	Very high	93	Very high	7 Å²	7	31.9 Å²	31.9	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-62.5	-41.7	178.4	-178.2	0	0	0	0	111.2	E518 L561 A566 N567 E626	E518-V563 HydrophobicContact CG-CG1 4.34Å; L561-V563 VanDerWaalsContact C-N 3.33Å; L561-V563 PolarHBondContact O-N 2.84Å; V563-A566 WeakPolarHBondContact O-CB 3.36Å; V563-A566 PolarHBondContact O-N 3.4Å; V563-N567 PolarHBondContact O-N 3.36Å; V563-N567 PolarHBondContact O-ND2 2.92Å; V563-E626 HydrophobicContact CG1-CB 4.38Å; V563-E626 HydrophobicContact CG2-CB 3.99Å
564	L	94.8	Very high	93.3	Very high	2 Å²	2	31 Å²	31	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-65	-39.7	173.3	-176	61.4	0	0	0	112	M517 E518 L555 L561 L562 A566 N567 Y568	M517-L564 HydrophobicContact CB-CD1 3.73Å; M517-L564 HydrophobicContact CB-CD2 4.4Å; M517-L564 HydrophobicContact CE-CD2 4.12Å; M517-L564 HydrophobicContact SD-CD2 4.06Å; E518-L564 HydrophobicContact CG-CB 4.24Å; E518-L564 HydrophobicContact CG-CD1 4.1Å; L555-L564 HydrophobicContact CD1-CG 4.29Å; L555-L564 HydrophobicContact CD2-CD2 3.9Å; L555-L564 HydrophobicContact CD2-CG 4.31Å; L561-L564 PolarHBondContact O-N 3.33Å; L562-L564 VanDerWaalsContact C-N 3.34Å; L562-L564 PolarHBondContact O-N 3.31Å; L564-A566 VanDerWaalsContact C-N 3.32Å; L564-A566 PolarHBondContact O-N 3.49Å; L564-N567 WeakPolarHBondContact O-CB 3.45Å; L564-N567 PolarHBondContact O-N 2.91Å; L564-Y568 HydrophobicContact CD1-CD1 3.82Å; L564-Y568 HydrophobicContact CD1-CE1 3.49Å; L564-Y568 VanDerWaalsContact CD1-CE1 3.49Å; L564-Y568 HydrophobicContact CG-CD1 4.22Å; L564-Y568 HydrophobicContact CG-CE1 4.08Å; L564-Y568 WeakPolarHBondContact O-CD1 3.46Å; L564-Y568 PolarHBondContact O-N 3.12Å
565	A	95.6	Very high	93.5	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.008	14%	0.142	C	C	.	.	H	α-helix	trans	-61.5	-40.6	174.1	0	0	0	0	0	111.7	L552 L555 L561 L562 Y568 C569 F600	L552-A565 HydrophobicContact CD1-CB 4.21Å; L552-A565 WeakPolarHBondContact CD1-O 3.39Å; L555-A565 HydrophobicContact CB-CB 3.98Å; L561-A565 PolarHBondContact O-N 2.89Å; L562-A565 WeakPolarHBondContact O-CB 3.49Å; L562-A565 PolarHBondContact O-N 2.9Å; L562-A565 VanDerWaalsContact O-N 3.14Å; A565-Y568 PolarHBondContact O-N 3.17Å; A565-C569 WeakPolarHBondContact O-CB 3.46Å; A565-C569 PolarHBondContact O-N 3.09Å; A565-F600 HydrophobicContact CB-CE2 3.8Å; A565-F600 HydrophobicContact CB-CZ 3.98Å
566	A	96.9	Very high	93.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.6	-42.2	175.1	0	0	0	0	0	111.7	L562 V563 L564 T570 F600 A627 L630	L562-A566 PolarHBondContact O-N 3.21Å; V563-A566 WeakPolarHBondContact O-CB 3.36Å; V563-A566 PolarHBondContact O-N 3.4Å; L564-A566 VanDerWaalsContact C-N 3.32Å; L564-A566 PolarHBondContact O-N 3.49Å; A566-T570 VanDerWaalsContact O-CB 3.31Å; A566-T570 WeakPolarHBondContact O-CB 3.28Å; A566-T570 PolarHBondContact O-N 3.25Å; A566-T570 PolarHBondContact O-OG1 3.33Å; A566-F600 HydrophobicContact CB-CE1 4.08Å; A566-F600 HydrophobicContact CB-CZ 3.98Å; A566-A627 HydrophobicContact CB-CB 4.34Å; A566-L630 HydrophobicContact CB-CB 3.9Å; A566-L630 HydrophobicContact CB-CD1 3.93Å
567	N	97.3	Very high	94	Very high	7 Å²	7	30.1 Å²	30.1	4%	0.037	14%	0.144	C	C	.	.	H	α-helix	trans	-59.4	-49.2	173.1	-86.7	-72.9	0	0	0	112	C521 V563 L564 T570 L571 L630	C521-N567 HydrophobicContact CB-CB 3.73Å; V563-N567 PolarHBondContact O-N 3.36Å; V563-N567 PolarHBondContact O-ND2 2.92Å; L564-N567 WeakPolarHBondContact O-CB 3.45Å; L564-N567 PolarHBondContact O-N 2.91Å; N567-T570 PolarHBondContact O-N 3.01Å; N567-L571 WeakPolarHBondContact O-CB 3.45Å; N567-L571 PolarHBondContact O-N 3.14Å; N567-L630 HydrophobicContact CB-CD1 4.49Å; N567-L630 WeakPolarHBondContact ND2-CD1 3.37Å
568	Y	97.4	Very high	94.3	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.5	-42.7	-179.5	-85.5	36.4	0	0	0	112	L496 M517 C521 H547 L548 A551 L555 L564 A565 G572	L496-Y568 HydrophobicContact CD2-CE1 4.34Å; M517-Y568 WeakPolarHBondContact CE-OH 3.25Å; C521-Y568 VanDerWaalsContact SG-CD1 3.59Å; C521-Y568 WeakPolarHBondContact SG-CE1 3.43Å; H547-Y568 AromaticContact NE2-CE2 3.57Å; H547-Y568 AromaticContact NE2-CZ 3.66Å; H547-Y568 PolarHBondContact NE2-OH 3.44Å; L548-Y568 HydrophobicContact CD2-CD1 3.92Å; L548-Y568 HydrophobicContact CD2-CD2 3.39Å; L548-Y568 HydrophobicContact CD2-CE1 4.31Å; L548-Y568 HydrophobicContact CD2-CE2 3.84Å; L548-Y568 HydrophobicContact CD2-CG 3.42Å; L548-Y568 VanDerWaalsContact CD2-CG 3.42Å; A551-Y568 HydrophobicContact CB-CD2 3.96Å; A551-Y568 HydrophobicContact CB-CE2 3.62Å; L555-Y568 HydrophobicContact CD1-CD2 3.47Å; L555-Y568 VanDerWaalsContact CD1-CD2 3.47Å; L555-Y568 HydrophobicContact CD1-CE2 3.87Å; L555-Y568 HydrophobicContact CD1-CG 3.86Å; L564-Y568 HydrophobicContact CD1-CD1 3.82Å; L564-Y568 HydrophobicContact CD1-CE1 3.49Å; L564-Y568 VanDerWaalsContact CD1-CE1 3.49Å; L564-Y568 HydrophobicContact CG-CD1 4.22Å; L564-Y568 HydrophobicContact CG-CE1 4.08Å; L564-Y568 WeakPolarHBondContact O-CD1 3.46Å; L564-Y568 PolarHBondContact O-N 3.12Å; A565-Y568 PolarHBondContact O-N 3.17Å; Y568-G572 PolarHBondContact O-N 3.11Å
569	C	97.5	Very high	94.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-57.5	-51.4	173.4	171.5	0	0	0	0	111.1	L552 A565 G572 L573 T597 F600 S634	L552-C569 HydrophobicContact CD1-CB 4.42Å; L552-C569 HydrophobicContact CD2-CB 4.45Å; A565-C569 WeakPolarHBondContact O-CB 3.46Å; A565-C569 PolarHBondContact O-N 3.09Å; C569-G572 PolarHBondContact O-N 3.46Å; C569-L573 WeakPolarHBondContact O-CG 3.38Å; C569-L573 PolarHBondContact O-N 3.1Å; C569-T597 VanDerWaalsContact SG-CG2 3.55Å; C569-F600 HydrophobicContact CB-CD1 3.96Å; C569-F600 HydrophobicContact CB-CE1 4.09Å; C569-S634 PolarHBondContact SG-OG 3.16Å
570	T	97.9	Very high	94	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.4	-50.2	-178.1	-56.5	0	0	0	0	111.1	L525 A566 N567 G572 L573 M574 L630 L633 S634	L525-T570 HydrophobicContact CD1-CG2 4.29Å; L525-T570 HydrophobicContact CD2-CG2 4.2Å; A566-T570 VanDerWaalsContact O-CB 3.31Å; A566-T570 WeakPolarHBondContact O-CB 3.28Å; A566-T570 PolarHBondContact O-N 3.25Å; A566-T570 PolarHBondContact O-OG1 3.33Å; N567-T570 PolarHBondContact O-N 3.01Å; T570-G572 PolarHBondContact O-N 3.13Å; T570-L573 PolarHBondContact O-N 2.88Å; T570-M574 HydrophobicContact CG2-CG 4.32Å; T570-M574 WeakPolarHBondContact O-CB 3.39Å; T570-M574 WeakPolarHBondContact O-CG 3.37Å; T570-M574 PolarHBondContact O-N 3.14Å; T570-L630 HydrophobicContact CG2-CD2 4.28Å; T570-L630 PolarHBondContact OG1-O 3.14Å; T570-L633 HydrophobicContact CG2-CB 4.16Å; T570-L633 HydrophobicContact CG2-CD2 3.67Å; T570-L633 HydrophobicContact CG2-CG 3.84Å; T570-S634 WeakPolarHBondContact CA-OG 3.38Å; T570-S634 PolarHBondContact N-OG 3.4Å; T570-S634 PolarHBondContact OG1-OG 2.9Å
571	L	97.8	Very high	93.6	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-60.7	-46.1	-178.9	-172.2	56.8	0	0	0	111.4	C521 L524 L525 L544 L548 N567 L573 M574 I575	C521-L571 HydrophobicContact CB-CD2 4.44Å; L524-L571 HydrophobicContact CB-CD1 4.11Å; L524-L571 HydrophobicContact CB-CD2 4.06Å; L524-L571 HydrophobicContact CD1-CD2 4.24Å; L525-L571 HydrophobicContact CB-CD1 4.32Å; L544-L571 HydrophobicContact CD1-CD2 4.26Å; L544-L571 HydrophobicContact CD2-CD2 3.87Å; L544-L571 HydrophobicContact CD2-CG 4.24Å; L544-L571 HydrophobicContact CG-CD2 4.46Å; L548-L571 HydrophobicContact CD1-CB 4.2Å; L548-L571 HydrophobicContact CD1-CD2 4.34Å; L548-L571 HydrophobicContact CD1-CG 4.12Å; N567-L571 WeakPolarHBondContact O-CB 3.45Å; N567-L571 PolarHBondContact O-N 3.14Å; L571-L573 PolarHBondContact O-N 3.31Å; L571-M574 PolarHBondContact O-N 3.09Å; L571-I575 HydrophobicContact CD1-CD1 4.42Å; L571-I575 HydrophobicContact CG-CD1 4.21Å; L571-I575 VanDerWaalsContact O-CG1 3.32Å; L571-I575 WeakPolarHBondContact O-CG1 3.46Å; L571-I575 PolarHBondContact O-N 3.45Å
572	G	96.9	Very high	92.6	Very high	4 Å²	4	22 Å²	22	4%	0.041	13%	0.128	C	C	.	.	H	α-helix	trans	-66.3	-36.1	179.2	0	0	0	0	0	113.6	Y568 C569 T570 G576 F593	Y568-G572 PolarHBondContact O-N 3.11Å; C569-G572 PolarHBondContact O-N 3.46Å; T570-G572 PolarHBondContact O-N 3.13Å; G572-G576 PolarHBondContact O-N 3.27Å; G572-F593 VanDerWaalsContact CA-CZ 3.48Å
573	L	97.6	Very high	91.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-68	-38.7	172.4	-72.6	172.2	0	0	0	112.1	C569 T570 L571 G576 R577 F593 F594 T597 L601 S634 A637 L638 C641	C569-L573 WeakPolarHBondContact O-CG 3.38Å; C569-L573 PolarHBondContact O-N 3.1Å; T570-L573 PolarHBondContact O-N 2.88Å; L571-L573 PolarHBondContact O-N 3.31Å; L573-G576 PolarHBondContact O-N 2.92Å; L573-R577 PolarHBondContact O-N 3.32Å; L573-F593 HydrophobicContact CD2-CE1 4.43Å; L573-F594 HydrophobicContact CD2-CD1 4.02Å; L573-F594 HydrophobicContact CD2-CE1 3.56Å; L573-F594 HydrophobicContact CD2-CZ 4.48Å; L573-T597 HydrophobicContact CD1-CG2 3.65Å; L573-T597 HydrophobicContact CD2-CG2 3.85Å; L573-T597 HydrophobicContact CG-CG2 3.86Å; L573-L601 HydrophobicContact CD1-CD1 4.22Å; L573-S634 WeakPolarHBondContact CD1-O 3.44Å; L573-A637 HydrophobicContact CB-CB 3.69Å; L573-L638 HydrophobicContact CD1-CB 4.46Å; L573-L638 HydrophobicContact CD2-CB 4.46Å; L573-L638 HydrophobicContact CD2-CD1 4.2Å; L573-C641 PolarHBondContact O-SG 3.14Å
574	M	97.1	Very high	90.1	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-69.2	-33.6	179.3	-70.9	-70.7	-90.6	0	0	112.4	L525 T528 V529 T570 L571 R577 L633 A637	L525-M574 HydrophobicContact CD1-CB 3.99Å; L525-M574 HydrophobicContact CD1-CE 4.08Å; L525-M574 HydrophobicContact CD1-CG 3.77Å; T528-M574 HydrophobicContact CG2-CB 3.8Å; V529-M574 HydrophobicContact CG2-CE 3.28Å; T570-M574 HydrophobicContact CG2-CG 4.32Å; T570-M574 WeakPolarHBondContact O-CB 3.39Å; T570-M574 WeakPolarHBondContact O-CG 3.37Å; T570-M574 PolarHBondContact O-N 3.14Å; L571-M574 PolarHBondContact O-N 3.09Å; M574-R577 WeakPolarHBondContact O-CG 3.31Å; M574-R577 VanDerWaalsContact SD-CZ 3.51Å; M574-R577 PolarHBondContact SD-NH1 2.88Å; M574-R577 VanDerWaalsContact SD-NH1 3.4Å; M574-L633 HydrophobicContact CE-CD1 4.09Å; M574-L633 HydrophobicContact CE-CD2 4.48Å; M574-L633 HydrophobicContact CE-CG 4.44Å; M574-L633 HydrophobicContact SD-CD1 4.45Å; M574-A637 HydrophobicContact CG-CB 3.92Å; M574-A637 HydrophobicContact SD-CB 3.51Å; M574-A637 VanDerWaalsContact SD-CB 3.51Å
575	I	95.4	Very high	89	Confident	8 Å²	8	34 Å²	34	4%	0.041	23%	0.232	C	C	.	.	H	α-helix	trans	-71.1	-44.5	168.5	-60.2	163.6	0	0	0	109.8	T528 V535 F541 L544 E545 L548 L571 R577 L578	T528-I575 HydrophobicContact CG2-CG1 3.83Å; V535-I575 HydrophobicContact CG1-CG1 4.5Å; V535-I575 HydrophobicContact CG1-CG2 4.33Å; F541-I575 HydrophobicContact CD1-CD1 4.11Å; F541-I575 HydrophobicContact CD1-CG1 4.39Å; L544-I575 HydrophobicContact CD2-CD1 3.76Å; L544-I575 HydrophobicContact CG-CD1 4.23Å; E545-I575 HydrophobicContact CG-CB 4.32Å; E545-I575 HydrophobicContact CG-CD1 4.21Å; E545-I575 HydrophobicContact CG-CG2 3.69Å; E545-I575 VanDerWaalsContact OE1-CG2 3.27Å; E545-I575 WeakPolarHBondContact OE1-CG2 3.3Å; L548-I575 HydrophobicContact CD1-CD1 4.42Å; L571-I575 HydrophobicContact CD1-CD1 4.42Å; L571-I575 HydrophobicContact CG-CD1 4.21Å; L571-I575 VanDerWaalsContact O-CG1 3.32Å; L571-I575 WeakPolarHBondContact O-CG1 3.46Å; L571-I575 PolarHBondContact O-N 3.45Å; I575-R577 VanDerWaalsContact C-N 3.28Å; I575-R577 PolarHBondContact O-N 2.97Å; I575-L578 WeakPolarHBondContact O-CB 3.43Å; I575-L578 PolarHBondContact O-N 3.41Å
576	G	93.2	Very high	88.3	Confident	2 Å²	2	36 Å²	36	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-56.2	-37.2	-179	0	0	0	0	0	114	G572 L573 L578 K579	G572-G576 PolarHBondContact O-N 3.27Å; L573-G576 PolarHBondContact O-N 2.92Å; G576-L578 PolarHBondContact O-N 2.97Å; G576-K579 WeakPolarHBondContact O-CB 3.44Å; G576-K579 PolarHBondContact O-N 3.09Å
577	R	93.3	Very high	87.7	Confident	87 Å²	87	40.4 Å²	40.4	33%	0.328	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-18.4	178.7	87.2	-167.2	-175.8	157.6	5.7	113.4	L573 M574 I575 C641	L573-R577 PolarHBondContact O-N 3.32Å; M574-R577 WeakPolarHBondContact O-CG 3.31Å; M574-R577 VanDerWaalsContact SD-CZ 3.51Å; M574-R577 PolarHBondContact SD-NH1 2.88Å; M574-R577 VanDerWaalsContact SD-NH1 3.4Å; I575-R577 VanDerWaalsContact C-N 3.28Å; I575-R577 PolarHBondContact O-N 2.97Å; R577-C641 PolarHBondContact N-SG 3.35Å; R577-C641 VanDerWaalsContact N-SG 3.36Å
578	L	92.7	Very high	87	Confident	20 Å²	20	44.8 Å²	44.8	11%	0.105	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-12.1	179.3	-58	178.9	0	0	0	112.8	T528 P532 V535 R536 I575 G576	T528-L578 HydrophobicContact CG2-CD1 4.31Å; P532-L578 HydrophobicContact CB-CD1 4.02Å; P532-L578 HydrophobicContact CB-CD2 3.67Å; P532-L578 HydrophobicContact CB-CG 4.46Å; V535-L578 HydrophobicContact CB-CD1 4.01Å; V535-L578 HydrophobicContact CG1-CD1 3.75Å; R536-L578 HydrophobicContact CG-CB 4.35Å; R536-L578 PolarHBondContact NE-O 3.04Å; I575-L578 WeakPolarHBondContact O-CB 3.43Å; I575-L578 PolarHBondContact O-N 3.41Å; G576-L578 PolarHBondContact O-N 2.97Å
579	K	85.6	Confident	86.5	Confident	63 Å²	63	45.8 Å²	45.8	27%	0.274	31%	0.309	S	S	.	.	S	Bend	trans	-69.2	135	-177.3	-73.5	-175.4	159.1	164.6	0	112	E545 G576 Q645	E545-K579 WeakPolarHBondContact OE1-CE 3.33Å; E545-K579 IonicContact OE1-NZ 3.43Å; E545-K579 PolarHBondContact OE1-NZ 3.49Å; E545-K579 WeakPolarHBondContact OE2-CE 3.26Å; E545-K579 IonicContact OE2-NZ 3.14Å; E545-K579 PolarHBondContact OE2-NZ 3.14Å; G576-K579 WeakPolarHBondContact O-CB 3.44Å; G576-K579 PolarHBondContact O-N 3.09Å; K579-Q645 PolarHBondContact O-NE2 2.96Å; K579-Q645 VanDerWaalsContact O-NE2 3.12Å
580	A	82.3	Confident	86	Confident	76 Å²	76	46.8 Å²	46.8	63%	0.628	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-64.3	148.5	171	0	0	0	0	0	111	T582 Q645	A580-T582 PolarHBondContact O-N 2.93Å; A580-Q645 VanDerWaalsContact C-NE2 3.28Å; A580-Q645 PolarHBondContact O-NE2 3.14Å
581	P	78.1	Confident	85.6	Confident	101 Å²	101	52.5 Å²	52.5	66%	0.656	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-54	126.3	178.5	-22.1	31.1	0	0	0	111
582	T	70.3	Confident	85.3	Confident	68 Å²	68	59 Å²	59	42%	0.417	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-81.9	123.5	178.3	43	0	0	0	0	110.2	A580 Q645	A580-T582 PolarHBondContact O-N 2.93Å; T582-Q645 PolarHBondContact OG1-OE1 2.97Å
583	G	62.3	Low	85.2	Confident	90 Å²	90	59.5 Å²	59.5	93%	0.928	36%	0.36	S	S	*	.			trans	-89.6	-5.4	173.1	0	0	0	0	0	114.3
584	G	71.3	Confident	85.1	Confident	46 Å²	46	59.6 Å²	59.6	47%	0.474	36%	0.361	S	S	.	.	S	Bend	trans	-111.6	-178	-178.2	0	0	0	0	0	113.6	V586	G584-V586 PolarHBondContact O-N 2.99Å
585	P	73.2	Confident	85.1	Confident	137 Å²	137	60 Å²	60	89%	0.89	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-59.6	135.3	176.3	24.7	-32.3	0	0	0	111
586	V	79.9	Confident	85.1	Confident	42 Å²	42	60 Å²	60	26%	0.255	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-66.2	132.6	-179.6	-179.1	0	0	0	0	109.6	G584 S588 R591 W647	G584-V586 PolarHBondContact O-N 2.99Å; V586-S588 PolarHBondContact O-N 2.96Å; V586-R591 HydrophobicContact CG1-CB 4.31Å; V586-W647 HydrophobicContact CG1-CD2 4.23Å; V586-W647 HydrophobicContact CG1-CE3 4.38Å; V586-W647 HydrophobicContact CG1-CH2 3.74Å; V586-W647 HydrophobicContact CG1-CZ2 3.56Å; V586-W647 HydrophobicContact CG1-CZ3 4.14Å; V586-W647 HydrophobicContact CG2-CB 4.45Å; V586-W647 HydrophobicContact CG2-CD2 3.72Å; V586-W647 HydrophobicContact CG2-CE3 4.29Å; V586-W647 HydrophobicContact CG2-CG 3.77Å; V586-W647 HydrophobicContact CG2-CZ2 4.43Å
587	D	83.9	Confident	85.2	Confident	93 Å²	93	60 Å²	60	50%	0.497	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-57.7	136.5	175.2	172.4	58.5	0	0	0	111.5	G589 Q590 R591	D587-G589 VanDerWaalsContact C-N 3.31Å; D587-G589 PolarHBondContact O-N 3.46Å; D587-G589 VanDerWaalsContact OD2-CA 3.29Å; D587-G589 WeakPolarHBondContact OD2-CA 3.48Å; D587-G589 PolarHBondContact OD2-N 3.26Å; D587-Q590 HydrophobicContact CB-CB 4.04Å; D587-Q590 WeakPolarHBondContact O-CB 3.43Å; D587-Q590 PolarHBondContact O-N 3.07Å; D587-Q590 PolarHBondContact OD2-N 3.45Å; D587-R591 PolarHBondContact O-N 2.8Å
588	S	84.4	Confident	85.4	Confident	99 Å²	99	55.9 Å²	55.9	69%	0.692	35%	0.348	S	S	*	.	H	α-helix	trans	-64	-36.2	-176.9	66.1	0	0	0	0	112.6	V586 R591 R592	V586-S588 PolarHBondContact O-N 2.96Å; S588-R591 PolarHBondContact O-N 3.37Å; S588-R592 WeakPolarHBondContact O-CB 3.27Å; S588-R592 PolarHBondContact O-N 3.03Å
589	G	85.3	Confident	85.5	Confident	21 Å²	21	60 Å²	60	22%	0.216	36%	0.363	C	S	.	.	H	α-helix	trans	-66.6	-41.8	174.6	0	0	0	0	0	111.6	S549 D587 R592 F593	S549-G589 PolarHBondContact OG-O 3.3Å; D587-G589 VanDerWaalsContact C-N 3.31Å; D587-G589 PolarHBondContact O-N 3.46Å; D587-G589 VanDerWaalsContact OD2-CA 3.29Å; D587-G589 WeakPolarHBondContact OD2-CA 3.48Å; D587-G589 PolarHBondContact OD2-N 3.26Å; G589-R592 PolarHBondContact O-N 3.3Å; G589-F593 WeakPolarHBondContact O-CB 3.4Å; G589-F593 PolarHBondContact O-N 3.22Å
590	Q	87.3	Confident	86	Confident	21 Å²	21	57.7 Å²	57.7	10%	0.098	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-46.2	174.6	-168.7	177.1	21.4	0	0	111.8	D587 R592 F593 F594 W647	D587-Q590 HydrophobicContact CB-CB 4.04Å; D587-Q590 WeakPolarHBondContact O-CB 3.43Å; D587-Q590 PolarHBondContact O-N 3.07Å; D587-Q590 PolarHBondContact OD2-N 3.45Å; Q590-R592 VanDerWaalsContact C-N 3.32Å; Q590-R592 PolarHBondContact O-N 2.85Å; Q590-F593 PolarHBondContact O-N 3.37Å; Q590-F594 HydrophobicContact CG-CD2 3.93Å; Q590-F594 HydrophobicContact CG-CE2 3.83Å; Q590-F594 WeakPolarHBondContact O-CD2 3.41Å; Q590-F594 PolarHBondContact O-N 3.22Å; Q590-F594 VanDerWaalsContact O-N 3.09Å; Q590-W647 HydrophobicContact CG-CZ2 4.21Å
591	R	90.4	Very high	86.6	Confident	120 Å²	120	54.2 Å²	54.2	45%	0.453	32%	0.324	S	S	.	.	H	α-helix	trans	-60.7	-42.4	176.6	-170	178.1	-177.3	111.1	2.9	111.4	V586 D587 S588 S595	V586-R591 HydrophobicContact CG1-CB 4.31Å; D587-R591 PolarHBondContact O-N 2.8Å; S588-R591 PolarHBondContact O-N 3.37Å; R591-S595 WeakPolarHBondContact O-CB 3.43Å; R591-S595 PolarHBondContact O-N 3.21Å
592	R	91.8	Very high	87.4	Confident	138 Å²	138	54.3 Å²	54.3	52%	0.521	31%	0.311	S	S	.	.	H	α-helix	trans	-61.3	-46.9	176	-176.6	-178.5	-180	-173.9	-1.9	111.7	S588 G589 Q590 S595 V596	S588-R592 WeakPolarHBondContact O-CB 3.27Å; S588-R592 PolarHBondContact O-N 3.03Å; G589-R592 PolarHBondContact O-N 3.3Å; Q590-R592 VanDerWaalsContact C-N 3.32Å; Q590-R592 PolarHBondContact O-N 2.85Å; R592-S595 WeakPolarHBondContact O-CB 3.48Å; R592-S595 PolarHBondContact O-N 2.96Å; R592-V596 HydrophobicContact CG-CG2 4.37Å; R592-V596 WeakPolarHBondContact O-CB 3.32Å; R592-V596 WeakPolarHBondContact O-CG2 3.22Å; R592-V596 PolarHBondContact O-N 3.3Å
593	F	94.7	Very high	88.5	Confident	14 Å²	14	52.5 Å²	52.5	6%	0.061	31%	0.306	C	S	.	.	H	α-helix	trans	-56.1	-55.1	177.6	172.6	-96.4	0	0	0	111.3	L548 L552 G572 L573 G589 Q590 S595 V596 T597	L548-F593 HydrophobicContact CB-CE2 4.39Å; L552-F593 HydrophobicContact CD2-CD2 4.06Å; L552-F593 HydrophobicContact CD2-CE2 3.72Å; L552-F593 HydrophobicContact CD2-CZ 4.5Å; G572-F593 VanDerWaalsContact CA-CZ 3.48Å; L573-F593 HydrophobicContact CD2-CE1 4.43Å; G589-F593 WeakPolarHBondContact O-CB 3.4Å; G589-F593 PolarHBondContact O-N 3.22Å; Q590-F593 PolarHBondContact O-N 3.37Å; F593-S595 VanDerWaalsContact C-N 3.31Å; F593-S595 PolarHBondContact O-N 2.78Å; F593-V596 PolarHBondContact O-N 3.26Å; F593-V596 VanDerWaalsContact O-N 3.16Å; F593-T597 WeakPolarHBondContact CZ-OG1 3.49Å; F593-T597 WeakPolarHBondContact O-CB 3.29Å; F593-T597 PolarHBondContact O-N 3.25Å; F593-T597 PolarHBondContact O-OG1 2.96Å; F593-T597 VanDerWaalsContact O-OG1 3.09Å
594	F	95.5	Very high	90	Very high	3 Å²	3	48.2 Å²	48.2	1%	0.013	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-38.7	-178.7	-82.5	-78.1	0	0	0	112.8	L573 Q590 V596 T597 L598 C641 W647 L648 L651	L573-F594 HydrophobicContact CD2-CD1 4.02Å; L573-F594 HydrophobicContact CD2-CE1 3.56Å; L573-F594 HydrophobicContact CD2-CZ 4.48Å; Q590-F594 HydrophobicContact CG-CD2 3.93Å; Q590-F594 HydrophobicContact CG-CE2 3.83Å; Q590-F594 WeakPolarHBondContact O-CD2 3.41Å; Q590-F594 PolarHBondContact O-N 3.22Å; Q590-F594 VanDerWaalsContact O-N 3.09Å; F594-V596 VanDerWaalsContact C-N 3.32Å; F594-V596 PolarHBondContact O-N 3.45Å; F594-T597 PolarHBondContact O-N 3.42Å; F594-L598 WeakPolarHBondContact O-CB 3.25Å; F594-L598 WeakPolarHBondContact O-CG 3.34Å; F594-L598 PolarHBondContact O-N 2.91Å; F594-C641 HydrophobicContact CE1-CB 3.9Å; F594-C641 HydrophobicContact CZ-CB 4.13Å; F594-W647 HydrophobicContact CB-CH2 4.41Å; F594-W647 AromaticContact CD2-CH2 3.77Å; F594-W647 HydrophobicContact CD2-CH2 3.77Å; F594-W647 HydrophobicContact CD2-CZ2 4.16Å; F594-W647 HydrophobicContact CE2-CH2 4.41Å; F594-W647 HydrophobicContact CE2-CZ2 4.35Å; F594-W647 HydrophobicContact CG-CH2 4.29Å; F594-L648 HydrophobicContact CB-CD2 3.91Å; F594-L648 HydrophobicContact CD1-CD1 4.26Å; F594-L648 HydrophobicContact CD1-CD2 3.48Å; F594-L648 VanDerWaalsContact CD1-CD2 3.48Å; F594-L648 HydrophobicContact CD2-CD2 3.78Å; F594-L648 HydrophobicContact CE1-CD1 3.8Å; F594-L648 HydrophobicContact CE1-CD2 3.84Å; F594-L648 HydrophobicContact CE2-CD2 4.14Å; F594-L648 HydrophobicContact CG-CD2 3.44Å; F594-L648 VanDerWaalsContact CG-CD2 3.44Å; F594-L648 HydrophobicContact CZ-CD1 3.98Å; F594-L648 HydrophobicContact CZ-CD2 4.17Å; F594-L651 HydrophobicContact CB-CD2 3.65Å
595	S	95.4	Very high	91	Very high	12 Å²	12	47 Å²	47	8%	0.084	24%	0.244	C	C	.	.	H	α-helix	trans	-59.3	-43.5	175.9	169.7	0	0	0	0	111.8	R591 R592 F593 R599 E655	R591-S595 WeakPolarHBondContact O-CB 3.43Å; R591-S595 PolarHBondContact O-N 3.21Å; R592-S595 WeakPolarHBondContact O-CB 3.48Å; R592-S595 PolarHBondContact O-N 2.96Å; F593-S595 VanDerWaalsContact C-N 3.31Å; F593-S595 PolarHBondContact O-N 2.78Å; S595-R599 PolarHBondContact O-N 3.13Å; S595-R599 PolarHBondContact OG-NH2 2.65Å; S595-E655 WeakPolarHBondContact CB-OE1 3.47Å; S595-E655 PolarHBondContact OG-OE1 3.42Å
596	V	95.8	Very high	91.9	Very high	8 Å²	8	44.6 Å²	44.6	5%	0.048	22%	0.217	C	C	.	.	H	α-helix	trans	-69.2	-46.6	177.5	171	0	0	0	0	111.1	L552 P553 M556 R592 F593 F594 L598 R599 F600	L552-V596 HydrophobicContact CB-CG1 4.37Å; L552-V596 HydrophobicContact CD2-CG1 3.98Å; L552-V596 HydrophobicContact CG-CG1 3.82Å; P553-V596 HydrophobicContact CB-CG1 4.34Å; P553-V596 HydrophobicContact CB-CG2 4.31Å; P553-V596 HydrophobicContact CG-CG1 4.12Å; P553-V596 HydrophobicContact CG-CG2 3.97Å; M556-V596 HydrophobicContact CG-CG1 4.36Å; M556-V596 HydrophobicContact SD-CB 4.36Å; M556-V596 HydrophobicContact SD-CG1 3.23Å; M556-V596 WeakPolarHBondContact SD-CG1 3.42Å; M556-V596 VanDerWaalsContact SD-O 3.41Å; R592-V596 HydrophobicContact CG-CG2 4.37Å; R592-V596 WeakPolarHBondContact O-CB 3.32Å; R592-V596 WeakPolarHBondContact O-CG2 3.22Å; R592-V596 PolarHBondContact O-N 3.3Å; F593-V596 PolarHBondContact O-N 3.26Å; F593-V596 VanDerWaalsContact O-N 3.16Å; F594-V596 VanDerWaalsContact C-N 3.32Å; F594-V596 PolarHBondContact O-N 3.45Å; V596-L598 VanDerWaalsContact C-N 3.33Å; V596-L598 PolarHBondContact O-N 2.87Å; V596-R599 PolarHBondContact O-N 3.01Å; V596-R599 VanDerWaalsContact O-N 3.15Å; V596-F600 PolarHBondContact O-N 3.06Å
597	T	96.8	Very high	92.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.6	-42.7	175.2	-67.6	0	0	0	0	112.8	L552 C569 L573 F593 F594 R599 F600 L601	L552-T597 WeakPolarHBondContact CD2-OG1 3.49Å; C569-T597 VanDerWaalsContact SG-CG2 3.55Å; L573-T597 HydrophobicContact CD1-CG2 3.65Å; L573-T597 HydrophobicContact CD2-CG2 3.85Å; L573-T597 HydrophobicContact CG-CG2 3.86Å; F593-T597 WeakPolarHBondContact CZ-OG1 3.49Å; F593-T597 WeakPolarHBondContact O-CB 3.29Å; F593-T597 PolarHBondContact O-N 3.25Å; F593-T597 PolarHBondContact O-OG1 2.96Å; F593-T597 VanDerWaalsContact O-OG1 3.09Å; F594-T597 PolarHBondContact O-N 3.42Å; T597-R599 VanDerWaalsContact C-N 3.34Å; T597-R599 PolarHBondContact O-N 3.48Å; T597-F600 WeakPolarHBondContact O-CB 3.27Å; T597-F600 PolarHBondContact O-N 2.84Å; T597-L601 HydrophobicContact CG2-CD1 3.97Å; T597-L601 HydrophobicContact CG2-CG 4.36Å; T597-L601 WeakPolarHBondContact O-CG 3.45Å; T597-L601 PolarHBondContact O-N 3.3Å
598	L	97	Very high	92.2	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-62.9	-40.1	177.4	-73.4	167.8	0	0	0	112	F594 V596 F600 R602 L638 L651 I652 E655 W657	F594-L598 WeakPolarHBondContact O-CB 3.25Å; F594-L598 WeakPolarHBondContact O-CG 3.34Å; F594-L598 PolarHBondContact O-N 2.91Å; V596-L598 VanDerWaalsContact C-N 3.33Å; V596-L598 PolarHBondContact O-N 2.87Å; L598-F600 VanDerWaalsContact C-N 3.35Å; L598-R602 VanDerWaalsContact O-CB 3.24Å; L598-R602 WeakPolarHBondContact O-CB 3.4Å; L598-R602 PolarHBondContact O-N 3.34Å; L598-L638 HydrophobicContact CD2-CD1 4.28Å; L598-L638 HydrophobicContact CD2-CD2 3.95Å; L598-L651 HydrophobicContact CD1-CD2 4.24Å; L598-L651 HydrophobicContact CD1-CG 4.02Å; L598-I652 HydrophobicContact CD1-CG1 3.91Å; L598-I652 HydrophobicContact CD2-CG1 3.7Å; L598-I652 HydrophobicContact CG-CG1 4.46Å; L598-E655 HydrophobicContact CB-CB 4.36Å; L598-E655 HydrophobicContact CD1-CB 4.24Å; L598-E655 HydrophobicContact CD1-CG 4.2Å; L598-W657 HydrophobicContact CB-CB 4.3Å; L598-W657 HydrophobicContact CD2-CB 3.96Å; L598-W657 HydrophobicContact CD2-CD2 4.27Å; L598-W657 HydrophobicContact CD2-CG 3.88Å; L598-W657 VanDerWaalsContact O-CD1 3.31Å
599	R	94.8	Very high	92.1	Very high	108 Å²	108	40.2 Å²	40.2	41%	0.408	20%	0.196	S	C	.	.	H	α-helix	trans	-66.6	-37.8	174.3	-67.9	-174.6	-136.9	107.8	-1	112.2	M556 S595 V596 T597 R602 G603 E655	M556-R599 HydrophobicContact CE-CB 4.01Å; S595-R599 PolarHBondContact O-N 3.13Å; S595-R599 PolarHBondContact OG-NH2 2.65Å; V596-R599 PolarHBondContact O-N 3.01Å; V596-R599 VanDerWaalsContact O-N 3.15Å; T597-R599 VanDerWaalsContact C-N 3.34Å; T597-R599 PolarHBondContact O-N 3.48Å; R599-R602 WeakPolarHBondContact O-CB 3.48Å; R599-R602 PolarHBondContact O-N 3.49Å; R599-G603 PolarHBondContact O-N 3.05Å; R599-E655 IonicContact CZ-OE2 3.06Å; R599-E655 IonicContact NE-OE2 3.17Å; R599-E655 PolarHBondContact NE-OE2 3.43Å; R599-E655 IonicContact NH2-OE1 2.65Å; R599-E655 IonicContact NH2-OE2 3.12Å; R599-E655 PolarHBondContact NH2-OE2 3.16Å; R599-E655 VanDerWaalsContact NH2-OE2 3.14Å
600	F	95.4	Very high	91.5	Very high	13 Å²	13	42.5 Å²	42.5	6%	0.057	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-53.3	176	-177.1	-108.4	0	0	0	111.5	M556 A565 A566 C569 V596 T597 L598 R602 G603 W620	M556-F600 HydrophobicContact CE-CB 3.68Å; M556-F600 HydrophobicContact CE-CD2 4.29Å; M556-F600 HydrophobicContact CG-CB 4.38Å; M556-F600 HydrophobicContact CG-CD2 3.96Å; M556-F600 HydrophobicContact SD-CB 3.82Å; M556-F600 HydrophobicContact SD-CD2 4.46Å; A565-F600 HydrophobicContact CB-CE2 3.8Å; A565-F600 HydrophobicContact CB-CZ 3.98Å; A566-F600 HydrophobicContact CB-CE1 4.08Å; A566-F600 HydrophobicContact CB-CZ 3.98Å; C569-F600 HydrophobicContact CB-CD1 3.96Å; C569-F600 HydrophobicContact CB-CE1 4.09Å; V596-F600 PolarHBondContact O-N 3.06Å; T597-F600 WeakPolarHBondContact O-CB 3.27Å; T597-F600 PolarHBondContact O-N 2.84Å; L598-F600 VanDerWaalsContact C-N 3.35Å; F600-R602 PolarHBondContact O-N 3.23Å; F600-G603 PolarHBondContact O-N 3.17Å; F600-W620 HydrophobicContact CD1-CH2 4.15Å; F600-W620 HydrophobicContact CD1-CZ2 4.29Å; F600-W620 AromaticContact CD2-CZ2 4Å; F600-W620 HydrophobicContact CD2-CZ2 4Å; F600-W620 AromaticContact CE1-CH2 3.41Å; F600-W620 HydrophobicContact CE1-CH2 3.41Å; F600-W620 VanDerWaalsContact CE1-CH2 3.41Å; F600-W620 AromaticContact CE1-CZ2 3.87Å; F600-W620 HydrophobicContact CE1-CZ2 3.87Å; F600-W620 AromaticContact CE2-CH2 3.84Å; F600-W620 HydrophobicContact CE2-CH2 3.84Å; F600-W620 AromaticContact CE2-CZ2 3.55Å; F600-W620 HydrophobicContact CE2-CZ2 3.55Å; F600-W620 HydrophobicContact CG-CZ2 4.35Å; F600-W620 AromaticContact CZ-CH2 3.23Å; F600-W620 HydrophobicContact CZ-CH2 3.23Å; F600-W620 AromaticContact CZ-CZ2 3.48Å; F600-W620 HydrophobicContact CZ-CZ2 3.48Å; F600-W620 VanDerWaalsContact CZ-CZ2 3.48Å; F600-W620 HydrophobicContact CZ-CZ3 4.24Å
601	L	96	Very high	90.9	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-32.5	179.9	-66.1	175.1	0	0	0	112.8	L573 T597 G603 W631 L635 L638	L573-L601 HydrophobicContact CD1-CD1 4.22Å; T597-L601 HydrophobicContact CG2-CD1 3.97Å; T597-L601 HydrophobicContact CG2-CG 4.36Å; T597-L601 WeakPolarHBondContact O-CG 3.45Å; T597-L601 PolarHBondContact O-N 3.3Å; L601-G603 VanDerWaalsContact C-N 3.27Å; L601-G603 PolarHBondContact O-N 2.94Å; L601-W631 HydrophobicContact CD2-CG 4.43Å; L601-W631 PolarHBondContact O-NE1 2.95Å; L601-L635 HydrophobicContact CD1-CD2 4.3Å; L601-L638 HydrophobicContact CD1-CD2 4.06Å
602	R	94.5	Very high	90.4	Very high	102 Å²	102	41.9 Å²	41.9	39%	0.385	24%	0.239	S	C	.	.	H	α-helix	trans	-62	-33.2	174.4	-173.1	-177.2	160.2	-177.9	-9.5	112.4	L598 R599 F600 A604 H660	L598-R602 VanDerWaalsContact O-CB 3.24Å; L598-R602 WeakPolarHBondContact O-CB 3.4Å; L598-R602 PolarHBondContact O-N 3.34Å; R599-R602 WeakPolarHBondContact O-CB 3.48Å; R599-R602 PolarHBondContact O-N 3.49Å; F600-R602 PolarHBondContact O-N 3.23Å; R602-A604 VanDerWaalsContact C-N 3.33Å; R602-A604 PolarHBondContact O-N 3.15Å; R602-H660 HydrophobicContact CG-CB 3.92Å; R602-H660 WeakPolarHBondContact CG-CD2 3.24Å; R602-H660 VanDerWaalsContact NE-CG 3.26Å; R602-H660 PolarHBondContact NE-ND1 3.18Å; R602-H660 PolarHBondContact O-NE2 3.05Å
603	G	92.4	Very high	90.1	Very high	31 Å²	31	38.5 Å²	38.5	32%	0.32	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-17.3	-171.7	0	0	0	0	0	115.3	R599 F600 L601 L605 S617	R599-G603 PolarHBondContact O-N 3.05Å; F600-G603 PolarHBondContact O-N 3.17Å; L601-G603 VanDerWaalsContact C-N 3.27Å; L601-G603 PolarHBondContact O-N 2.94Å; G603-L605 PolarHBondContact O-N 3.36Å; G603-S617 WeakPolarHBondContact O-CB 3.44Å; G603-S617 PolarHBondContact O-OG 3.2Å
604	A	93.7	Very high	89.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-31.4	-169.2	0	0	0	0	0	114.7	R602 S617 W620 W624 W631	R602-A604 VanDerWaalsContact C-N 3.33Å; R602-A604 PolarHBondContact O-N 3.15Å; A604-S617 PolarHBondContact O-N 3.08Å; A604-S617 PolarHBondContact O-OG 3.2Å; A604-W620 HydrophobicContact CB-CD2 3.91Å; A604-W620 HydrophobicContact CB-CE3 4.09Å; A604-W620 HydrophobicContact CB-CG 4.45Å; A604-W620 HydrophobicContact CB-CH2 4.2Å; A604-W620 HydrophobicContact CB-CZ2 4.06Å; A604-W620 HydrophobicContact CB-CZ3 4.24Å; A604-W624 HydrophobicContact CB-CZ3 4.21Å; A604-W631 HydrophobicContact CB-CD2 4.34Å; A604-W631 HydrophobicContact CB-CG 4.25Å; A604-W631 HydrophobicContact CB-CZ2 4.34Å; A604-W631 VanDerWaalsContact CB-NE1 3.26Å
605	L	92.9	Very high	89.6	Confident	19 Å²	19	41.2 Å²	41.2	10%	0.099	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147.1	-171.4	-61.4	-179.5	0	0	0	112.3	G603 V614 Q615 W631 V664 L680	G603-L605 PolarHBondContact O-N 3.36Å; L605-V614 HydrophobicContact CB-CG1 3.98Å; L605-V614 HydrophobicContact CD1-CG1 4Å; L605-V614 HydrophobicContact CD2-CG1 4.17Å; L605-V614 HydrophobicContact CG-CG1 4.28Å; L605-Q615 WeakPolarHBondContact CA-O 3.37Å; L605-W631 HydrophobicContact CD1-CH2 3.45Å; L605-W631 VanDerWaalsContact CD1-CH2 3.45Å; L605-W631 HydrophobicContact CD1-CZ2 3.66Å; L605-W631 HydrophobicContact CD1-CZ3 4.48Å; L605-W631 HydrophobicContact CG-CH2 4.09Å; L605-W631 HydrophobicContact CG-CZ2 3.95Å; L605-V664 HydrophobicContact CB-CG1 4.49Å; L605-L680 HydrophobicContact CD1-CD1 3.88Å
606	R	92.4	Very high	89.5	Confident	88 Å²	88	42.2 Å²	42.2	33%	0.332	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	158.4	174	64	-179.5	175.7	87.5	-0.8	111.6	Q615 V616	R606-Q615 HydrophobicContact CG-CB 4.14Å; R606-Q615 PolarHBondContact N-O 3.22Å; R606-Q615 PolarHBondContact O-N 3.27Å; R606-Q615 VanDerWaalsContact O-N 3.08Å; R606-V616 PolarHBondContact NE-O 3.19Å; R606-V616 VanDerWaalsContact NE-O 3.08Å
607	P	89.1	Confident	89.3	Confident	43 Å²	43	42.6 Å²	42.6	28%	0.279	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-58.3	144.2	176	-19.9	31.9	0	0	0	111.4	V664 Q667	P607-V664 HydrophobicContact CG-CG2 4.2Å; P607-Q667 HydrophobicContact CB-CB 4.07Å; P607-Q667 HydrophobicContact CG-CB 4.44Å; P607-Q667 VanDerWaalsContact CG-OE1 3.27Å
608	G	81.8	Confident	89.1	Confident	9 Å²	9	46 Å²	46	9%	0.093	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-65.7	149.5	172.2	0	0	0	0	0	112.2	G610 P613 S668	G608-G610 PolarHBondContact O-N 3.16Å; G608-P613 WeakPolarHBondContact CA-O 3.45Å; G608-S668 PolarHBondContact N-OG 3.02Å; G608-S668 VanDerWaalsContact N-OG 3.15Å
609	S	81	Confident	88.7	Confident	90 Å²	90	52.6 Å²	52.6	63%	0.629	32%	0.32	S	S	*	.	S	Bend	trans	-67.3	119.6	171.5	-59.1	0	0	0	0	110.2	S611 G612	S609-S611 PolarHBondContact O-N 3.36Å; S609-G612 PolarHBondContact O-N 3.43Å
610	G	73.1	Confident	88.7	Confident	69 Å²	69	48 Å²	48	71%	0.711	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	-126.3	179.7	0	0	0	0	0	112.7	G608 G612	G608-G610 PolarHBondContact O-N 3.16Å; G610-G612 VanDerWaalsContact C-N 3.26Å; G610-G612 PolarHBondContact O-N 2.98Å
611	S	73.9	Confident	88.5	Confident	110 Å²	110	53.8 Å²	53.8	77%	0.769	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	14.6	175.8	66.7	0	0	0	0	113.8	S609	S609-S611 PolarHBondContact O-N 3.36Å
612	G	80.3	Confident	88.3	Confident	17 Å²	17	62.6 Å²	62.6	18%	0.175	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-69.3	169.4	-176.8	0	0	0	0	0	114.5	S609 G610 G669 A670	S609-G612 PolarHBondContact O-N 3.43Å; G610-G612 VanDerWaalsContact C-N 3.26Å; G610-G612 PolarHBondContact O-N 2.98Å; G612-G669 PolarHBondContact O-N 3.23Å; G612-A670 PolarHBondContact O-N 3.28Å
613	P	85.2	Confident	88.2	Confident	67 Å²	67	58.9 Å²	58.9	44%	0.435	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-67.6	159.9	172.3	31.1	-34.8	0	0	0	111.3	G608 Q615 A670	G608-P613 WeakPolarHBondContact CA-O 3.45Å; P613-Q615 PolarHBondContact O-N 2.97Å; P613-A670 WeakPolarHBondContact CA-O 3.23Å; P613-A670 HydrophobicContact CB-CB 4.03Å
614	V	89.6	Confident	88.2	Confident	13 Å²	13	58.7 Å²	58.7	8%	0.079	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-52.7	134.8	167.2	177.7	0	0	0	0	109.5	L605 V664 L665 S668 A670 P672	L605-V614 HydrophobicContact CB-CG1 3.98Å; L605-V614 HydrophobicContact CD1-CG1 4Å; L605-V614 HydrophobicContact CD2-CG1 4.17Å; L605-V614 HydrophobicContact CG-CG1 4.28Å; V614-V664 HydrophobicContact CG1-CG1 3.83Å; V614-V664 HydrophobicContact CG2-CG1 4.26Å; V614-L665 HydrophobicContact CG2-CD2 3.84Å; V614-S668 WeakPolarHBondContact CG2-OG 3.42Å; V614-A670 PolarHBondContact N-O 3.44Å; V614-P672 HydrophobicContact CB-CB 4.13Å; V614-P672 HydrophobicContact CG1-CB 4.44Å
615	Q	90.9	Very high	88.2	Confident	61 Å²	61	66.2 Å²	66.2	29%	0.285	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	154.6	-176.7	-67.8	-176.1	-11	0	0	111.4	L605 R606 P613	L605-Q615 WeakPolarHBondContact CA-O 3.37Å; R606-Q615 HydrophobicContact CG-CB 4.14Å; R606-Q615 PolarHBondContact N-O 3.22Å; R606-Q615 PolarHBondContact O-N 3.27Å; R606-Q615 VanDerWaalsContact O-N 3.08Å; P613-Q615 PolarHBondContact O-N 2.97Å
616	V	92.8	Very high	88.1	Confident	33 Å²	33	69.9 Å²	69.9	20%	0.2	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	140.9	169.2	-177.1	0	0	0	0	109	R606 W620 W624	R606-V616 PolarHBondContact NE-O 3.19Å; R606-V616 VanDerWaalsContact NE-O 3.08Å; V616-W620 HydrophobicContact CG1-CB 3.65Å; V616-W624 HydrophobicContact CB-CD2 4.43Å; V616-W624 HydrophobicContact CG1-CB 4.24Å; V616-W624 HydrophobicContact CG1-CD2 3.83Å; V616-W624 HydrophobicContact CG1-CE3 3.81Å; V616-W624 HydrophobicContact CG1-CG 4.03Å; V616-W624 HydrophobicContact CG2-CD2 3.65Å; V616-W624 HydrophobicContact CG2-CE3 4.22Å; V616-W624 HydrophobicContact CG2-CG 3.92Å; V616-W624 HydrophobicContact CG2-CZ2 4.03Å
617	S	92.8	Very high	88.2	Confident	17 Å²	17	65.7 Å²	65.7	12%	0.119	39%	0.392	C	S	.	.			trans	-67.3	147.1	175.4	-66.9	0	0	0	0	111.2	G603 A604 D619 W620 E621	G603-S617 WeakPolarHBondContact O-CB 3.44Å; G603-S617 PolarHBondContact O-OG 3.2Å; A604-S617 PolarHBondContact O-N 3.08Å; A604-S617 PolarHBondContact O-OG 3.2Å; S617-D619 PolarHBondContact O-N 3.08Å; S617-W620 PolarHBondContact O-N 3.38Å; S617-E621 PolarHBondContact O-N 3.24Å
618	A	91	Very high	88.5	Confident	72 Å²	72	63.8 Å²	63.8	60%	0.595	38%	0.38	S	S	*	.	H	α-helix	trans	-56.2	-36.4	-178.9	0	0	0	0	0	112.7	W620 E621	A618-W620 PolarHBondContact O-N 3.31Å; A618-W620 VanDerWaalsContact O-N 3.15Å; A618-E621 PolarHBondContact O-N 2.74Å
619	D	90	Very high	89.1	Confident	138 Å²	138	68.6 Å²	68.6	74%	0.738	40%	0.4	S	S	*	.	H	α-helix	trans	-65.8	-15.5	178.5	-58.8	-29.9	0	0	0	113.9	L562 S617	L562-D619 VanDerWaalsContact CD1-O 3.32Å; L562-D619 WeakPolarHBondContact CD1-O 3.28Å; S617-D619 PolarHBondContact O-N 3.08Å
620	W	93.7	Very high	89.9	Confident	13 Å²	13	65.4 Å²	65.4	5%	0.049	38%	0.376	C	S	.	.	H	α-helix	trans	-108.8	-13.7	-178.6	-75.8	66.9	0	0	0	112.8	L562 F600 A604 V616 S617 A618 E622 S623 W624 A627 W631	L562-W620 HydrophobicContact CD1-CD2 3.86Å; L562-W620 HydrophobicContact CD1-CE3 4.33Å; L562-W620 HydrophobicContact CD1-CG 3.93Å; L562-W620 HydrophobicContact CD2-CD2 4.17Å; L562-W620 HydrophobicContact CD2-CE3 3.79Å; L562-W620 HydrophobicContact CD2-CH2 4.41Å; L562-W620 HydrophobicContact CD2-CZ3 3.93Å; L562-W620 HydrophobicContact CG-CD2 4.45Å; F600-W620 HydrophobicContact CD1-CH2 4.15Å; F600-W620 HydrophobicContact CD1-CZ2 4.29Å; F600-W620 AromaticContact CD2-CZ2 4Å; F600-W620 HydrophobicContact CD2-CZ2 4Å; F600-W620 AromaticContact CE1-CH2 3.41Å; F600-W620 HydrophobicContact CE1-CH2 3.41Å; F600-W620 VanDerWaalsContact CE1-CH2 3.41Å; F600-W620 AromaticContact CE1-CZ2 3.87Å; F600-W620 HydrophobicContact CE1-CZ2 3.87Å; F600-W620 AromaticContact CE2-CH2 3.84Å; F600-W620 HydrophobicContact CE2-CH2 3.84Å; F600-W620 AromaticContact CE2-CZ2 3.55Å; F600-W620 HydrophobicContact CE2-CZ2 3.55Å; F600-W620 HydrophobicContact CG-CZ2 4.35Å; F600-W620 AromaticContact CZ-CH2 3.23Å; F600-W620 HydrophobicContact CZ-CH2 3.23Å; F600-W620 AromaticContact CZ-CZ2 3.48Å; F600-W620 HydrophobicContact CZ-CZ2 3.48Å; F600-W620 VanDerWaalsContact CZ-CZ2 3.48Å; F600-W620 HydrophobicContact CZ-CZ3 4.24Å; A604-W620 HydrophobicContact CB-CD2 3.91Å; A604-W620 HydrophobicContact CB-CE3 4.09Å; A604-W620 HydrophobicContact CB-CG 4.45Å; A604-W620 HydrophobicContact CB-CH2 4.2Å; A604-W620 HydrophobicContact CB-CZ2 4.06Å; A604-W620 HydrophobicContact CB-CZ3 4.24Å; V616-W620 HydrophobicContact CG1-CB 3.65Å; S617-W620 PolarHBondContact O-N 3.38Å; A618-W620 PolarHBondContact O-N 3.31Å; A618-W620 VanDerWaalsContact O-N 3.15Å; W620-E622 PolarHBondContact O-N 3.33Å; W620-S623 CarbonylContact O-C 3.58Å; W620-S623 PolarHBondContact O-N 3.37Å; W620-S623 VanDerWaalsContact O-N 3.14Å; W620-W624 HydrophobicContact CB-CE3 4.49Å; W620-W624 AromaticContact CE3-CE3 3.95Å; W620-W624 HydrophobicContact CE3-CE3 3.95Å; W620-W624 AromaticContact CE3-CZ3 3.99Å; W620-W624 HydrophobicContact CE3-CZ3 3.99Å; W620-W624 HydrophobicContact CZ3-CZ3 4.41Å; W620-W624 WeakPolarHBondContact O-CA 3.46Å; W620-W624 WeakPolarHBondContact O-CB 3.41Å; W620-W624 PolarHBondContact O-N 2.89Å; W620-A627 HydrophobicContact CE3-CB 4.3Å; W620-A627 HydrophobicContact CZ3-CB 4.09Å; W620-W631 AromaticContact CH2-CD1 3.98Å; W620-W631 HydrophobicContact CZ3-CB 4.22Å; W620-W631 HydrophobicContact CZ3-CG 4.46Å
621	E	91.5	Very high	91	Very high	133 Å²	133	62.2 Å²	62.2	62%	0.621	34%	0.342	S	S	*	.	H	α-helix	trans	-61.4	-41.1	-168	-166.9	166.2	-168.9	0	0	112.4	S617 A618 S623	S617-E621 PolarHBondContact O-N 3.24Å; A618-E621 PolarHBondContact O-N 2.74Å; E621-S623 VanDerWaalsContact C-N 3.32Å; E621-S623 PolarHBondContact O-N 2.89Å
622	E	91.1	Very high	92.1	Very high	189 Å²	189	58.5 Å²	58.5	88%	0.883	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-30.2	178.9	-172.6	179.9	179.7	0	0	113.3	W620	W620-E622 PolarHBondContact O-N 3.33Å
623	S	92.4	Very high	92.9	Very high	25 Å²	25	59.6 Å²	59.6	18%	0.175	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	7.7	-174.7	-58.3	0	0	0	0	113.3	W620 E621 D625 E626 A627	W620-S623 CarbonylContact O-C 3.58Å; W620-S623 PolarHBondContact O-N 3.37Å; W620-S623 VanDerWaalsContact O-N 3.14Å; E621-S623 VanDerWaalsContact C-N 3.32Å; E621-S623 PolarHBondContact O-N 2.89Å; S623-D625 PolarHBondContact O-N 3.42Å; S623-E626 PolarHBondContact O-N 3.28Å; S623-A627 VanDerWaalsContact O-CB 3.24Å; S623-A627 WeakPolarHBondContact O-CB 3.23Å; S623-A627 PolarHBondContact O-N 3.19Å
624	W	93.8	Very high	93.5	Very high	26 Å²	26	56.4 Å²	56.4	10%	0.098	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-42.1	-172.3	-176.9	-110.6	0	0	0	111.7	A604 V616 W620 E626 A627 A628 W631	A604-W624 HydrophobicContact CB-CZ3 4.21Å; V616-W624 HydrophobicContact CB-CD2 4.43Å; V616-W624 HydrophobicContact CG1-CB 4.24Å; V616-W624 HydrophobicContact CG1-CD2 3.83Å; V616-W624 HydrophobicContact CG1-CE3 3.81Å; V616-W624 HydrophobicContact CG1-CG 4.03Å; V616-W624 HydrophobicContact CG2-CD2 3.65Å; V616-W624 HydrophobicContact CG2-CE3 4.22Å; V616-W624 HydrophobicContact CG2-CG 3.92Å; V616-W624 HydrophobicContact CG2-CZ2 4.03Å; W620-W624 HydrophobicContact CB-CE3 4.49Å; W620-W624 AromaticContact CE3-CE3 3.95Å; W620-W624 HydrophobicContact CE3-CE3 3.95Å; W620-W624 AromaticContact CE3-CZ3 3.99Å; W620-W624 HydrophobicContact CE3-CZ3 3.99Å; W620-W624 HydrophobicContact CZ3-CZ3 4.41Å; W620-W624 WeakPolarHBondContact O-CA 3.46Å; W620-W624 WeakPolarHBondContact O-CB 3.41Å; W620-W624 PolarHBondContact O-N 2.89Å; W624-E626 PolarHBondContact O-N 3.42Å; W624-A627 PolarHBondContact O-N 2.82Å; W624-A627 VanDerWaalsContact O-N 3.15Å; W624-A628 HydrophobicContact CD2-CB 3.72Å; W624-A628 VanDerWaalsContact CE2-CB 3.42Å; W624-A628 HydrophobicContact CE3-CB 4.12Å; W624-A628 HydrophobicContact CG-CB 4.24Å; W624-A628 HydrophobicContact CH2-CB 4.01Å; W624-A628 HydrophobicContact CZ2-CB 3.6Å; W624-A628 HydrophobicContact CZ3-CB 4.25Å; W624-A628 WeakPolarHBondContact O-CB 3.29Å; W624-A628 PolarHBondContact O-N 3.17Å; W624-W631 HydrophobicContact CH2-CD2 4.14Å; W624-W631 AromaticContact CH2-CE3 3.83Å; W624-W631 HydrophobicContact CH2-CE3 3.83Å; W624-W631 HydrophobicContact CH2-CZ3 4.31Å; W624-W631 HydrophobicContact CZ3-CB 4.5Å; W624-W631 HydrophobicContact CZ3-CD2 4.48Å; W624-W631 HydrophobicContact CZ3-CG 4.45Å
625	D	92.2	Very high	93.9	Very high	158 Å²	158	55.8 Å²	55.8	85%	0.845	29%	0.289	S	S	*	.	H	α-helix	trans	-58	-34.3	-179.1	-66.8	-26	0	0	0	112.3	S623	S623-D625 PolarHBondContact O-N 3.42Å
626	E	91.4	Very high	94.1	Very high	96 Å²	96	56.2 Å²	56.2	45%	0.449	29%	0.29	S	S	.	.	H	α-helix	trans	-87.5	-33.8	177.6	-57.3	-170.1	-126.7	0	0	112.8	R513 V563 S623 W624	R513-E626 IonicContact CZ-OE1 3.57Å; R513-E626 IonicContact CZ-OE2 2.95Å; R513-E626 IonicContact NH1-OE1 3.23Å; R513-E626 PolarHBondContact NH1-OE1 3.05Å; R513-E626 IonicContact NH1-OE2 2.77Å; R513-E626 PolarHBondContact NH1-OE2 3.48Å; R513-E626 IonicContact NH2-OE1 3.37Å; R513-E626 IonicContact NH2-OE2 2.88Å; R513-E626 PolarHBondContact NH2-OE2 2.92Å; V563-E626 HydrophobicContact CG1-CB 4.38Å; V563-E626 HydrophobicContact CG2-CB 3.99Å; S623-E626 PolarHBondContact O-N 3.28Å; W624-E626 PolarHBondContact O-N 3.42Å
627	A	94.6	Very high	94.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-95.1	-18.7	-171.4	0	0	0	0	0	114.7	L562 A566 W620 S623 W624 E629 L630 W631	L562-A627 HydrophobicContact CD2-CB 3.65Å; A566-A627 HydrophobicContact CB-CB 4.34Å; W620-A627 HydrophobicContact CE3-CB 4.3Å; W620-A627 HydrophobicContact CZ3-CB 4.09Å; S623-A627 VanDerWaalsContact O-CB 3.24Å; S623-A627 WeakPolarHBondContact O-CB 3.23Å; S623-A627 PolarHBondContact O-N 3.19Å; W624-A627 PolarHBondContact O-N 2.82Å; W624-A627 VanDerWaalsContact O-N 3.15Å; A627-E629 VanDerWaalsContact C-N 3.33Å; A627-E629 PolarHBondContact O-N 3.47Å; A627-L630 PolarHBondContact O-N 2.94Å; A627-W631 PolarHBondContact O-N 3.38Å
628	A	95.1	Very high	94.5	Very high	4 Å²	4	53.9 Å²	53.9	3%	0.033	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-40.5	-170.9	0	0	0	0	0	112.6	W624 W631 R632	W624-A628 HydrophobicContact CD2-CB 3.72Å; W624-A628 VanDerWaalsContact CE2-CB 3.42Å; W624-A628 HydrophobicContact CE3-CB 4.12Å; W624-A628 HydrophobicContact CG-CB 4.24Å; W624-A628 HydrophobicContact CH2-CB 4.01Å; W624-A628 HydrophobicContact CZ2-CB 3.6Å; W624-A628 HydrophobicContact CZ3-CB 4.25Å; W624-A628 WeakPolarHBondContact O-CB 3.29Å; W624-A628 PolarHBondContact O-N 3.17Å; A628-W631 PolarHBondContact O-N 3.12Å; A628-R632 WeakPolarHBondContact O-CG 3.41Å; A628-R632 PolarHBondContact O-N 3.25Å
629	E	95.4	Very high	94.7	Very high	110 Å²	110	50.5 Å²	50.5	51%	0.514	25%	0.247	S	C	.	.	H	α-helix	trans	-69.7	-39.4	179.8	-166.8	56.4	-152.3	0	0	111.9	A627 W631 R632 L633	A627-E629 VanDerWaalsContact C-N 3.33Å; A627-E629 PolarHBondContact O-N 3.47Å; E629-W631 VanDerWaalsContact C-N 3.32Å; E629-W631 PolarHBondContact O-N 2.92Å; E629-R632 PolarHBondContact O-N 3.42Å; E629-R632 IonicContact OE2-CZ 3.94Å; E629-R632 VanDerWaalsContact OE2-CZ 3.23Å; E629-R632 IonicContact OE2-NE 2.72Å; E629-R632 PolarHBondContact OE2-NE 2.88Å; E629-R632 IonicContact OE2-NH2 2.77Å; E629-R632 PolarHBondContact OE2-NH2 3.39Å; E629-L633 WeakPolarHBondContact O-CB 3.19Å; E629-L633 PolarHBondContact O-N 3.39Å
630	L	96.8	Very high	94.9	Very high	22 Å²	22	44.7 Å²	44.7	12%	0.115	22%	0.221	C	C	.	.	H	α-helix	trans	-62.8	-40.1	173.1	-67.4	170	0	0	0	111.5	A566 N567 T570 A627 L633 S634	A566-L630 HydrophobicContact CB-CB 3.9Å; A566-L630 HydrophobicContact CB-CD1 3.93Å; N567-L630 HydrophobicContact CB-CD1 4.49Å; N567-L630 WeakPolarHBondContact ND2-CD1 3.37Å; T570-L630 HydrophobicContact CG2-CD2 4.28Å; T570-L630 PolarHBondContact OG1-O 3.14Å; A627-L630 PolarHBondContact O-N 2.94Å; L630-L633 PolarHBondContact O-N 3.17Å; L630-S634 VanDerWaalsContact O-CB 3.28Å; L630-S634 WeakPolarHBondContact O-CB 3.47Å; L630-S634 PolarHBondContact O-N 2.95Å; L630-S634 PolarHBondContact O-OG 3.44Å
631	W	97.3	Very high	95	Very high	3 Å²	3	44.1 Å²	44.1	1%	0.011	22%	0.218	C	C	.	.	H	α-helix	trans	-64.4	-44.7	175.6	177.7	87.9	0	0	0	112	L601 A604 L605 W620 W624 A627 A628 E629 S634 L635 L680	L601-W631 HydrophobicContact CD2-CG 4.43Å; L601-W631 PolarHBondContact O-NE1 2.95Å; A604-W631 HydrophobicContact CB-CD2 4.34Å; A604-W631 HydrophobicContact CB-CG 4.25Å; A604-W631 HydrophobicContact CB-CZ2 4.34Å; A604-W631 VanDerWaalsContact CB-NE1 3.26Å; L605-W631 HydrophobicContact CD1-CH2 3.45Å; L605-W631 VanDerWaalsContact CD1-CH2 3.45Å; L605-W631 HydrophobicContact CD1-CZ2 3.66Å; L605-W631 HydrophobicContact CD1-CZ3 4.48Å; L605-W631 HydrophobicContact CG-CH2 4.09Å; L605-W631 HydrophobicContact CG-CZ2 3.95Å; W620-W631 AromaticContact CH2-CD1 3.98Å; W620-W631 HydrophobicContact CZ3-CB 4.22Å; W620-W631 HydrophobicContact CZ3-CG 4.46Å; W624-W631 HydrophobicContact CH2-CD2 4.14Å; W624-W631 AromaticContact CH2-CE3 3.83Å; W624-W631 HydrophobicContact CH2-CE3 3.83Å; W624-W631 HydrophobicContact CH2-CZ3 4.31Å; W624-W631 HydrophobicContact CZ3-CB 4.5Å; W624-W631 HydrophobicContact CZ3-CD2 4.48Å; W624-W631 HydrophobicContact CZ3-CG 4.45Å; A627-W631 PolarHBondContact O-N 3.38Å; A628-W631 PolarHBondContact O-N 3.12Å; E629-W631 VanDerWaalsContact C-N 3.32Å; E629-W631 PolarHBondContact O-N 2.92Å; W631-S634 WeakPolarHBondContact O-CB 3.42Å; W631-S634 PolarHBondContact O-N 3.48Å; W631-L635 HydrophobicContact CD2-CD1 4.09Å; W631-L635 HydrophobicContact CE3-CD1 3.97Å; W631-L635 HydrophobicContact CH2-CD1 3.31Å; W631-L635 HydrophobicContact CZ2-CD1 3.47Å; W631-L635 VanDerWaalsContact CZ2-CD1 3.47Å; W631-L635 HydrophobicContact CZ2-CG 4.32Å; W631-L635 HydrophobicContact CZ3-CD1 3.58Å; W631-L635 PolarHBondContact O-N 3.19Å; W631-L680 HydrophobicContact CH2-CD1 4.06Å; W631-L680 HydrophobicContact CH2-CD2 3.96Å; W631-L680 HydrophobicContact CH2-CG 3.84Å; W631-L680 HydrophobicContact CZ2-CD2 4.18Å
632	R	97.2	Very high	95.1	Very high	32 Å²	32	37.8 Å²	37.8	12%	0.121	19%	0.189	C	C	.	.	H	α-helix	trans	-61.5	-47.3	175.4	-74.7	-176.4	-74.3	-92.4	0.8	111.7	A628 E629 S634 L635 Q636 E673 S676 A679	A628-R632 WeakPolarHBondContact O-CG 3.41Å; A628-R632 PolarHBondContact O-N 3.25Å; E629-R632 PolarHBondContact O-N 3.42Å; E629-R632 IonicContact OE2-CZ 3.94Å; E629-R632 VanDerWaalsContact OE2-CZ 3.23Å; E629-R632 IonicContact OE2-NE 2.72Å; E629-R632 PolarHBondContact OE2-NE 2.88Å; E629-R632 IonicContact OE2-NH2 2.77Å; E629-R632 PolarHBondContact OE2-NH2 3.39Å; R632-S634 VanDerWaalsContact C-N 3.29Å; R632-S634 PolarHBondContact O-N 3.12Å; R632-L635 WeakPolarHBondContact O-CB 3.36Å; R632-L635 PolarHBondContact O-N 2.94Å; R632-L635 VanDerWaalsContact O-N 3.15Å; R632-Q636 PolarHBondContact O-N 3.46Å; R632-Q636 VanDerWaalsContact O-N 3.16Å; R632-E673 IonicContact NH1-OE1 3.58Å; R632-E673 PolarHBondContact NH1-OE1 2.84Å; R632-S676 PolarHBondContact NH1-OG 3.29Å; R632-A679 HydrophobicContact CB-CB 4Å; R632-A679 HydrophobicContact CG-CB 4.12Å
633	L	96.8	Very high	95.1	Very high	40 Å²	40	32.6 Å²	32.6	21%	0.209	16%	0.161	C	C	.	.	H	α-helix	trans	-62.3	-38.5	177.7	-174.6	59	0	0	0	111.6	L525 T570 M574 E629 L630 L635 Q636 A637	L525-L633 HydrophobicContact CD1-CD2 4.48Å; L525-L633 HydrophobicContact CD2-CD2 3.82Å; T570-L633 HydrophobicContact CG2-CB 4.16Å; T570-L633 HydrophobicContact CG2-CD2 3.67Å; T570-L633 HydrophobicContact CG2-CG 3.84Å; M574-L633 HydrophobicContact CE-CD1 4.09Å; M574-L633 HydrophobicContact CE-CD2 4.48Å; M574-L633 HydrophobicContact CE-CG 4.44Å; M574-L633 HydrophobicContact SD-CD1 4.45Å; E629-L633 WeakPolarHBondContact O-CB 3.19Å; E629-L633 PolarHBondContact O-N 3.39Å; L630-L633 PolarHBondContact O-N 3.17Å; L633-L635 PolarHBondContact O-N 2.95Å; L633-Q636 PolarHBondContact O-N 2.81Å; L633-A637 VanDerWaalsContact O-CB 3.29Å; L633-A637 WeakPolarHBondContact O-CB 3.45Å; L633-A637 PolarHBondContact O-N 2.89Å
634	S	98	Very high	95	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.7	-42.6	173	-72.8	0	0	0	0	112.3	C569 T570 L573 L630 W631 R632 A637 L638	C569-S634 PolarHBondContact SG-OG 3.16Å; T570-S634 WeakPolarHBondContact CA-OG 3.38Å; T570-S634 PolarHBondContact N-OG 3.4Å; T570-S634 PolarHBondContact OG1-OG 2.9Å; L573-S634 WeakPolarHBondContact CD1-O 3.44Å; L630-S634 VanDerWaalsContact O-CB 3.28Å; L630-S634 WeakPolarHBondContact O-CB 3.47Å; L630-S634 PolarHBondContact O-N 2.95Å; L630-S634 PolarHBondContact O-OG 3.44Å; W631-S634 WeakPolarHBondContact O-CB 3.42Å; W631-S634 PolarHBondContact O-N 3.48Å; R632-S634 VanDerWaalsContact C-N 3.29Å; R632-S634 PolarHBondContact O-N 3.12Å; S634-A637 PolarHBondContact O-N 3.48Å; S634-L638 WeakPolarHBondContact O-CB 3.46Å; S634-L638 PolarHBondContact O-N 3.38Å
635	L	97.6	Very high	94.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.5	-43.5	177.2	-72.2	175.8	0	0	0	112.6	L601 W631 R632 L633 A637 L638 G639 W657 A679 L680 A683	L601-L635 HydrophobicContact CD1-CD2 4.3Å; W631-L635 HydrophobicContact CD2-CD1 4.09Å; W631-L635 HydrophobicContact CE3-CD1 3.97Å; W631-L635 HydrophobicContact CH2-CD1 3.31Å; W631-L635 HydrophobicContact CZ2-CD1 3.47Å; W631-L635 VanDerWaalsContact CZ2-CD1 3.47Å; W631-L635 HydrophobicContact CZ2-CG 4.32Å; W631-L635 HydrophobicContact CZ3-CD1 3.58Å; W631-L635 PolarHBondContact O-N 3.19Å; R632-L635 WeakPolarHBondContact O-CB 3.36Å; R632-L635 PolarHBondContact O-N 2.94Å; R632-L635 VanDerWaalsContact O-N 3.15Å; L633-L635 PolarHBondContact O-N 2.95Å; L635-A637 VanDerWaalsContact C-N 3.35Å; L635-L638 WeakPolarHBondContact O-CB 3.45Å; L635-L638 PolarHBondContact O-N 3.32Å; L635-G639 PolarHBondContact O-N 3.31Å; L635-W657 HydrophobicContact CD2-CH2 4.4Å; L635-W657 HydrophobicContact CD2-CZ2 3.6Å; L635-A679 HydrophobicContact CB-CB 4.19Å; L635-A679 HydrophobicContact CD1-CB 4.16Å; L635-L680 HydrophobicContact CD1-CD2 3.63Å; L635-L680 HydrophobicContact CD1-CG 3.82Å; L635-L680 HydrophobicContact CD2-CD2 4.38Å; L635-A683 HydrophobicContact CB-CB 4.33Å; L635-A683 HydrophobicContact CD2-CB 4.43Å; L635-A683 WeakPolarHBondContact O-CB 3.46Å
636	Q	95.5	Very high	94.4	Very high	69 Å²	69	27.4 Å²	27.4	32%	0.322	14%	0.141	S	C	.	.	H	α-helix	trans	-62.5	-44.3	175.5	-64.7	174.8	-15.9	0	0	110.9	R632 L633 L638 G639 G640 A679	R632-Q636 PolarHBondContact O-N 3.46Å; R632-Q636 VanDerWaalsContact O-N 3.16Å; L633-Q636 PolarHBondContact O-N 2.81Å; Q636-L638 VanDerWaalsContact C-N 3.34Å; Q636-L638 PolarHBondContact O-N 3.33Å; Q636-G639 PolarHBondContact O-N 3.17Å; Q636-G640 PolarHBondContact O-N 2.68Å; Q636-A679 HydrophobicContact CG-CB 4.25Å
637	A	96.8	Very high	94.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.3	-38.9	176	0	0	0	0	0	112.4	L573 M574 L633 S634 L635 G640 C641	L573-A637 HydrophobicContact CB-CB 3.69Å; M574-A637 HydrophobicContact CG-CB 3.92Å; M574-A637 HydrophobicContact SD-CB 3.51Å; M574-A637 VanDerWaalsContact SD-CB 3.51Å; L633-A637 VanDerWaalsContact O-CB 3.29Å; L633-A637 WeakPolarHBondContact O-CB 3.45Å; L633-A637 PolarHBondContact O-N 2.89Å; S634-A637 PolarHBondContact O-N 3.48Å; L635-A637 VanDerWaalsContact C-N 3.35Å; A637-G640 CarbonylContact O-C 3.58Å; A637-G640 WeakPolarHBondContact O-CA 3.48Å; A637-G640 PolarHBondContact O-N 3.1Å; A637-C641 PolarHBondContact O-N 3.3Å; A637-C641 PolarHBondContact O-SG 3.44Å
638	L	97.3	Very high	94.3	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-60.6	-44.2	173.8	178.6	65.3	0	0	0	111.1	L573 L598 L601 S634 L635 Q636 G640 C641 V642 I652 W657	L573-L638 HydrophobicContact CD1-CB 4.46Å; L573-L638 HydrophobicContact CD2-CB 4.46Å; L573-L638 HydrophobicContact CD2-CD1 4.2Å; L598-L638 HydrophobicContact CD2-CD1 4.28Å; L598-L638 HydrophobicContact CD2-CD2 3.95Å; L601-L638 HydrophobicContact CD1-CD2 4.06Å; S634-L638 WeakPolarHBondContact O-CB 3.46Å; S634-L638 PolarHBondContact O-N 3.38Å; L635-L638 WeakPolarHBondContact O-CB 3.45Å; L635-L638 PolarHBondContact O-N 3.32Å; Q636-L638 VanDerWaalsContact C-N 3.34Å; Q636-L638 PolarHBondContact O-N 3.33Å; L638-G640 VanDerWaalsContact C-N 3.3Å; L638-G640 PolarHBondContact O-N 2.93Å; L638-C641 WeakPolarHBondContact O-CB 3.31Å; L638-C641 PolarHBondContact O-N 3.35Å; L638-C641 VanDerWaalsContact O-N 3.13Å; L638-V642 WeakPolarHBondContact O-CG2 3.39Å; L638-V642 PolarHBondContact O-N 3.02Å; L638-I652 HydrophobicContact CD1-CD1 4.37Å; L638-W657 HydrophobicContact CD2-CH2 4.49Å; L638-W657 HydrophobicContact CD2-CZ2 4.38Å
639	G	95	Very high	94.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-58.1	-42.1	173.2	0	0	0	0	0	112.4	L635 Q636 V642 R643	L635-G639 PolarHBondContact O-N 3.31Å; Q636-G639 PolarHBondContact O-N 3.17Å; G639-V642 PolarHBondContact O-N 3.4Å; G639-R643 WeakPolarHBondContact O-CG 3.4Å; G639-R643 PolarHBondContact O-N 2.72Å; G639-R643 VanDerWaalsContact O-N 3.15Å; G639-R643 PolarHBondContact O-NE 3.2Å
640	G	94.1	Very high	94	Very high	17 Å²	17	21.6 Å²	21.6	18%	0.175	12%	0.119	C	C	.	.	H	α-helix	trans	-59.2	-46	170.8	0	0	0	0	0	113.3	Q636 A637 L638 V642 R643 A644	Q636-G640 PolarHBondContact O-N 2.68Å; A637-G640 CarbonylContact O-C 3.58Å; A637-G640 WeakPolarHBondContact O-CA 3.48Å; A637-G640 PolarHBondContact O-N 3.1Å; L638-G640 VanDerWaalsContact C-N 3.3Å; L638-G640 PolarHBondContact O-N 2.93Å; G640-V642 PolarHBondContact O-N 2.85Å; G640-R643 PolarHBondContact O-N 3.16Å; G640-A644 PolarHBondContact O-N 3.19Å
641	C	95.3	Very high	93.8	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.5	-46.3	177	-67	0	0	0	0	111.7	L573 R577 F594 A637 L638 R643 A644 Q645 L648	L573-C641 PolarHBondContact O-SG 3.14Å; R577-C641 PolarHBondContact N-SG 3.35Å; R577-C641 VanDerWaalsContact N-SG 3.36Å; F594-C641 HydrophobicContact CE1-CB 3.9Å; F594-C641 HydrophobicContact CZ-CB 4.13Å; A637-C641 PolarHBondContact O-N 3.3Å; A637-C641 PolarHBondContact O-SG 3.44Å; L638-C641 WeakPolarHBondContact O-CB 3.31Å; L638-C641 PolarHBondContact O-N 3.35Å; L638-C641 VanDerWaalsContact O-N 3.13Å; C641-R643 VanDerWaalsContact C-N 3.28Å; C641-R643 PolarHBondContact O-N 2.93Å; C641-A644 CarbonylContact O-C 3.52Å; C641-A644 PolarHBondContact O-N 3.39Å; C641-A644 VanDerWaalsContact O-N 3.1Å; C641-Q645 WeakPolarHBondContact O-CB 3.27Å; C641-Q645 PolarHBondContact O-N 3.07Å; C641-L648 HydrophobicContact CB-CD1 3.55Å
642	V	94.1	Very high	93.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.5	-38.7	178.7	170.8	0	0	0	0	111.5	L638 G639 G640 A644 L648 I652 A686 V687 R690	L638-V642 WeakPolarHBondContact O-CG2 3.39Å; L638-V642 PolarHBondContact O-N 3.02Å; G639-V642 PolarHBondContact O-N 3.4Å; G640-V642 PolarHBondContact O-N 2.85Å; V642-A644 VanDerWaalsContact C-N 3.35Å; V642-L648 HydrophobicContact CG2-CB 4.14Å; V642-I652 HydrophobicContact CG2-CD1 3.4Å; V642-A686 HydrophobicContact CB-CB 4.49Å; V642-A686 HydrophobicContact CG1-CB 4.5Å; V642-V687 HydrophobicContact CG1-CG2 4.28Å; V642-V687 HydrophobicContact CG2-CG2 4.07Å; V642-R690 HydrophobicContact CG1-CB 4.08Å; V642-R690 HydrophobicContact CG1-CG 4.09Å
643	R	90.9	Very high	93.5	Very high	80 Å²	80	23.8 Å²	23.8	30%	0.302	13%	0.126	S	C	.	.	H	α-helix	trans	-67.8	-34.8	175.7	-72.5	-177.2	-78.4	-111.8	5.1	112.4	G639 G640 C641 E682 A686 R690	G639-R643 WeakPolarHBondContact O-CG 3.4Å; G639-R643 PolarHBondContact O-N 2.72Å; G639-R643 VanDerWaalsContact O-N 3.15Å; G639-R643 PolarHBondContact O-NE 3.2Å; G640-R643 PolarHBondContact O-N 3.16Å; C641-R643 VanDerWaalsContact C-N 3.28Å; C641-R643 PolarHBondContact O-N 2.93Å; R643-E682 IonicContact CZ-OE1 2.76Å; R643-E682 IonicContact NH2-OE1 3.75Å; R643-E682 PolarHBondContact NH2-OE1 3.41Å; R643-A686 HydrophobicContact CG-CB 4.31Å; R643-R690 PolarHBondContact O-NH1 3.47Å; R643-R690 PolarHBondContact O-NH2 3.07Å; R643-R690 VanDerWaalsContact O-NH2 3.12Å
644	A	90.3	Very high	93.3	Very high	20 Å²	20	26.9 Å²	26.9	17%	0.165	14%	0.143	C	C	.	.	H	α-helix	trans	-79.3	-33.8	178.1	0	0	0	0	0	113.2	G640 C641 V642	G640-A644 PolarHBondContact O-N 3.19Å; C641-A644 CarbonylContact O-C 3.52Å; C641-A644 PolarHBondContact O-N 3.39Å; C641-A644 VanDerWaalsContact O-N 3.1Å; V642-A644 VanDerWaalsContact C-N 3.35Å
645	Q	89.7	Confident	93.1	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	15%	0.153	C	C	.	.			trans	-131.2	94.8	-169.7	-58.8	-64.4	-38.2	0	0	111	K579 A580 T582 C641 W647 L648	K579-Q645 PolarHBondContact O-NE2 2.96Å; K579-Q645 VanDerWaalsContact O-NE2 3.12Å; A580-Q645 VanDerWaalsContact C-NE2 3.28Å; A580-Q645 PolarHBondContact O-NE2 3.14Å; T582-Q645 PolarHBondContact OG1-OE1 2.97Å; C641-Q645 WeakPolarHBondContact O-CB 3.27Å; C641-Q645 PolarHBondContact O-N 3.07Å; Q645-W647 VanDerWaalsContact C-N 3.26Å; Q645-W647 PolarHBondContact O-N 3.36Å; Q645-W647 VanDerWaalsContact O-N 3.14Å; Q645-L648 HydrophobicContact CB-CD1 3.84Å; Q645-L648 HydrophobicContact CB-CG 4.1Å; Q645-L648 WeakPolarHBondContact O-CB 3.42Å; Q645-L648 PolarHBondContact O-N 2.94Å; Q645-L648 VanDerWaalsContact O-N 3.17Å
646	P	84.1	Confident	92.9	Very high	80 Å²	80	30 Å²	30	52%	0.519	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.5	-173.5	-27.7	35.6	0	0	0	115.3	L648 S649	P646-L648 PolarHBondContact O-N 3.37Å; P646-L648 VanDerWaalsContact O-N 3.16Å; P646-S649 PolarHBondContact O-N 3.17Å; P646-S649 PolarHBondContact O-OG 3.1Å
647	W	90.3	Very high	92.9	Very high	53 Å²	53	26.8 Å²	26.8	20%	0.201	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.6	-179.1	67.5	-98.8	0	0	0	113.4	V586 Q590 F594 Q645 S649 G650 L651	V586-W647 HydrophobicContact CG1-CD2 4.23Å; V586-W647 HydrophobicContact CG1-CE3 4.38Å; V586-W647 HydrophobicContact CG1-CH2 3.74Å; V586-W647 HydrophobicContact CG1-CZ2 3.56Å; V586-W647 HydrophobicContact CG1-CZ3 4.14Å; V586-W647 HydrophobicContact CG2-CB 4.45Å; V586-W647 HydrophobicContact CG2-CD2 3.72Å; V586-W647 HydrophobicContact CG2-CE3 4.29Å; V586-W647 HydrophobicContact CG2-CG 3.77Å; V586-W647 HydrophobicContact CG2-CZ2 4.43Å; Q590-W647 HydrophobicContact CG-CZ2 4.21Å; F594-W647 HydrophobicContact CB-CH2 4.41Å; F594-W647 AromaticContact CD2-CH2 3.77Å; F594-W647 HydrophobicContact CD2-CH2 3.77Å; F594-W647 HydrophobicContact CD2-CZ2 4.16Å; F594-W647 HydrophobicContact CE2-CH2 4.41Å; F594-W647 HydrophobicContact CE2-CZ2 4.35Å; F594-W647 HydrophobicContact CG-CH2 4.29Å; Q645-W647 VanDerWaalsContact C-N 3.26Å; Q645-W647 PolarHBondContact O-N 3.36Å; Q645-W647 VanDerWaalsContact O-N 3.14Å; W647-S649 PolarHBondContact O-N 2.91Å; W647-G650 PolarHBondContact O-N 3.15Å; W647-L651 HydrophobicContact CE3-CB 4.49Å; W647-L651 HydrophobicContact CH2-CD2 4.44Å; W647-L651 HydrophobicContact CZ3-CB 4.31Å; W647-L651 HydrophobicContact CZ3-CD2 3.76Å; W647-L651 PolarHBondContact O-N 3.39Å
648	L	93.6	Very high	92.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63	-29.6	179.4	-74.2	173.9	0	0	0	113	F594 C641 V642 Q645 P646 G650 L651 I652	F594-L648 HydrophobicContact CB-CD2 3.91Å; F594-L648 HydrophobicContact CD1-CD1 4.26Å; F594-L648 HydrophobicContact CD1-CD2 3.48Å; F594-L648 VanDerWaalsContact CD1-CD2 3.48Å; F594-L648 HydrophobicContact CD2-CD2 3.78Å; F594-L648 HydrophobicContact CE1-CD1 3.8Å; F594-L648 HydrophobicContact CE1-CD2 3.84Å; F594-L648 HydrophobicContact CE2-CD2 4.14Å; F594-L648 HydrophobicContact CG-CD2 3.44Å; F594-L648 VanDerWaalsContact CG-CD2 3.44Å; F594-L648 HydrophobicContact CZ-CD1 3.98Å; F594-L648 HydrophobicContact CZ-CD2 4.17Å; C641-L648 HydrophobicContact CB-CD1 3.55Å; V642-L648 HydrophobicContact CG2-CB 4.14Å; Q645-L648 HydrophobicContact CB-CD1 3.84Å; Q645-L648 HydrophobicContact CB-CG 4.1Å; Q645-L648 WeakPolarHBondContact O-CB 3.42Å; Q645-L648 PolarHBondContact O-N 2.94Å; Q645-L648 VanDerWaalsContact O-N 3.17Å; P646-L648 PolarHBondContact O-N 3.37Å; P646-L648 VanDerWaalsContact O-N 3.16Å; L648-G650 VanDerWaalsContact C-N 3.26Å; L648-G650 PolarHBondContact O-N 3.46Å; L648-L651 HydrophobicContact CD2-CD2 4.49Å; L648-L651 PolarHBondContact O-N 2.93Å; L648-I652 WeakPolarHBondContact O-CB 3.45Å; L648-I652 VanDerWaalsContact O-CG1 3.26Å; L648-I652 WeakPolarHBondContact O-CG1 3.49Å; L648-I652 PolarHBondContact O-N 3.33Å
649	S	91.5	Very high	92.7	Very high	4 Å²	4	36.7 Å²	36.7	3%	0.028	18%	0.184	C	C	.	.	H	α-helix	trans	-62.9	-36.9	179.7	-50.7	0	0	0	0	111.8	P646 W647 R653	P646-S649 PolarHBondContact O-N 3.17Å; P646-S649 PolarHBondContact O-OG 3.1Å; W647-S649 PolarHBondContact O-N 2.91Å; S649-R653 PolarHBondContact O-N 3.3Å
650	G	91.2	Very high	92.7	Very high	30 Å²	30	39.3 Å²	39.3	31%	0.309	20%	0.196	S	C	.	.	H	α-helix	trans	-65.6	-48	173.7	0	0	0	0	0	111.3	W647 L648 I652 R653 D654	W647-G650 PolarHBondContact O-N 3.15Å; L648-G650 VanDerWaalsContact C-N 3.26Å; L648-G650 PolarHBondContact O-N 3.46Å; G650-I652 VanDerWaalsContact C-N 3.32Å; G650-I652 PolarHBondContact O-N 3.34Å; G650-R653 WeakPolarHBondContact O-CB 3.44Å; G650-R653 PolarHBondContact O-N 3.04Å; G650-R653 VanDerWaalsContact O-N 3.08Å; G650-D654 PolarHBondContact O-N 2.69Å
651	L	94.1	Very high	92.7	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-60.6	-40.2	178.5	-176	66.1	0	0	0	112.6	F594 L598 W647 L648 R653 D654 E655	F594-L651 HydrophobicContact CB-CD2 3.65Å; L598-L651 HydrophobicContact CD1-CD2 4.24Å; L598-L651 HydrophobicContact CD1-CG 4.02Å; W647-L651 HydrophobicContact CE3-CB 4.49Å; W647-L651 HydrophobicContact CH2-CD2 4.44Å; W647-L651 HydrophobicContact CZ3-CB 4.31Å; W647-L651 HydrophobicContact CZ3-CD2 3.76Å; W647-L651 PolarHBondContact O-N 3.39Å; L648-L651 HydrophobicContact CD2-CD2 4.49Å; L648-L651 PolarHBondContact O-N 2.93Å; L651-R653 PolarHBondContact O-N 3.01Å; L651-D654 PolarHBondContact O-N 3.15Å; L651-E655 HydrophobicContact CD1-CG 3.89Å; L651-E655 HydrophobicContact CG-CG 4.2Å; L651-E655 PolarHBondContact O-N 2.95Å
652	I	95.6	Very high	92.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58	-38.1	176.1	-77	167.9	0	0	0	111.8	L598 L638 V642 L648 G650 W657 L658 V687	L598-I652 HydrophobicContact CD1-CG1 3.91Å; L598-I652 HydrophobicContact CD2-CG1 3.7Å; L598-I652 HydrophobicContact CG-CG1 4.46Å; L638-I652 HydrophobicContact CD1-CD1 4.37Å; V642-I652 HydrophobicContact CG2-CD1 3.4Å; L648-I652 WeakPolarHBondContact O-CB 3.45Å; L648-I652 VanDerWaalsContact O-CG1 3.26Å; L648-I652 WeakPolarHBondContact O-CG1 3.49Å; L648-I652 PolarHBondContact O-N 3.33Å; G650-I652 VanDerWaalsContact C-N 3.32Å; G650-I652 PolarHBondContact O-N 3.34Å; I652-W657 HydrophobicContact CG2-CE3 3.75Å; I652-W657 HydrophobicContact CG2-CZ3 4.43Å; I652-W657 PolarHBondContact O-N 2.93Å; I652-L658 HydrophobicContact CG2-CB 3.93Å; I652-V687 HydrophobicContact CD1-CG2 3.65Å; I652-V687 HydrophobicContact CG2-CG1 4.29Å; I652-V687 HydrophobicContact CG2-CG2 4.41Å
653	R	92.6	Very high	92.6	Very high	99 Å²	99	40.5 Å²	40.5	37%	0.374	20%	0.203	S	C	.	.	H	α-helix	trans	-73.1	-45.7	175.8	-164.5	179.3	69.2	-176.5	1.8	111.1	S649 G650 L651 E655 G656 D693 E697	S649-R653 PolarHBondContact O-N 3.3Å; G650-R653 WeakPolarHBondContact O-CB 3.44Å; G650-R653 PolarHBondContact O-N 3.04Å; G650-R653 VanDerWaalsContact O-N 3.08Å; L651-R653 PolarHBondContact O-N 3.01Å; R653-E655 PolarHBondContact O-N 3.48Å; R653-G656 PolarHBondContact O-N 3.46Å; R653-D693 IonicContact CZ-OD2 3.97Å; R653-D693 IonicContact NH1-OD2 2.87Å; R653-D693 PolarHBondContact NH1-OD2 3.1Å; R653-E697 VanDerWaalsContact CD-OE1 3.24Å; R653-E697 WeakPolarHBondContact CD-OE1 3.44Å
654	D	92.6	Very high	92.7	Very high	104 Å²	104	37 Å²	37	56%	0.556	19%	0.191	S	C	*	.	H	α-helix	trans	-63.7	-40.8	-177.2	-64.1	-15.4	0	0	0	112.6	G650 L651 G656	G650-D654 PolarHBondContact O-N 2.69Å; L651-D654 PolarHBondContact O-N 3.15Å; D654-G656 PolarHBondContact O-N 3.2Å
655	E	93.4	Very high	92.8	Very high	49 Å²	49	36.1 Å²	36.1	23%	0.229	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-3.2	176	-66	-69.9	159.9	0	0	113	S595 L598 R599 L651 R653 W657	S595-E655 WeakPolarHBondContact CB-OE1 3.47Å; S595-E655 PolarHBondContact OG-OE1 3.42Å; L598-E655 HydrophobicContact CB-CB 4.36Å; L598-E655 HydrophobicContact CD1-CB 4.24Å; L598-E655 HydrophobicContact CD1-CG 4.2Å; R599-E655 IonicContact CZ-OE2 3.06Å; R599-E655 IonicContact NE-OE2 3.17Å; R599-E655 PolarHBondContact NE-OE2 3.43Å; R599-E655 IonicContact NH2-OE1 2.65Å; R599-E655 IonicContact NH2-OE2 3.12Å; R599-E655 PolarHBondContact NH2-OE2 3.16Å; R599-E655 VanDerWaalsContact NH2-OE2 3.14Å; L651-E655 HydrophobicContact CD1-CG 3.89Å; L651-E655 HydrophobicContact CG-CG 4.2Å; L651-E655 PolarHBondContact O-N 2.95Å; R653-E655 PolarHBondContact O-N 3.48Å; E655-W657 PolarHBondContact O-N 3.3Å
656	G	92.6	Very high	92.9	Very high	17 Å²	17	37.5 Å²	37.5	18%	0.175	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	14.9	176.3	0	0	0	0	0	114.9	R653 D654 H660	R653-G656 PolarHBondContact O-N 3.46Å; D654-G656 PolarHBondContact O-N 3.2Å; G656-H660 WeakPolarHBondContact O-CB 3.49Å; G656-H660 PolarHBondContact O-N 3.44Å
657	W	95.6	Very high	93.2	Very high	1 Å²	1	39.8 Å²	39.8	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-48.4	176.6	179.2	88.4	0	0	0	110.8	L598 L635 L638 I652 E655 R659 H660 T661 A683 L684	L598-W657 HydrophobicContact CB-CB 4.3Å; L598-W657 HydrophobicContact CD2-CB 3.96Å; L598-W657 HydrophobicContact CD2-CD2 4.27Å; L598-W657 HydrophobicContact CD2-CG 3.88Å; L598-W657 VanDerWaalsContact O-CD1 3.31Å; L635-W657 HydrophobicContact CD2-CH2 4.4Å; L635-W657 HydrophobicContact CD2-CZ2 3.6Å; L638-W657 HydrophobicContact CD2-CH2 4.49Å; L638-W657 HydrophobicContact CD2-CZ2 4.38Å; I652-W657 HydrophobicContact CG2-CE3 3.75Å; I652-W657 HydrophobicContact CG2-CZ3 4.43Å; I652-W657 PolarHBondContact O-N 2.93Å; E655-W657 PolarHBondContact O-N 3.3Å; W657-R659 PolarHBondContact O-N 3.42Å; W657-H660 PolarHBondContact O-N 2.6Å; W657-T661 HydrophobicContact CH2-CG2 4.44Å; W657-T661 HydrophobicContact CZ2-CG2 4.31Å; W657-T661 WeakPolarHBondContact O-CB 3.4Å; W657-T661 PolarHBondContact O-N 3.28Å; W657-T661 PolarHBondContact O-OG1 3.07Å; W657-A683 HydrophobicContact CH2-CB 4.05Å; W657-L684 HydrophobicContact CH2-CD2 4.18Å; W657-L684 HydrophobicContact CZ3-CD2 3.99Å
658	L	95.5	Very high	93.1	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-58	-53.1	-179.6	179.9	64.7	0	0	0	111.5	I652 H660 T661 V662 L684 V687 C694 V698	I652-L658 HydrophobicContact CG2-CB 3.93Å; L658-H660 VanDerWaalsContact C-N 3.29Å; L658-H660 PolarHBondContact O-N 3.08Å; L658-T661 PolarHBondContact O-N 3.12Å; L658-V662 HydrophobicContact CD1-CG2 3.93Å; L658-V662 HydrophobicContact CG-CG2 4.44Å; L658-V662 VanDerWaalsContact O-CB 3.26Å; L658-V662 WeakPolarHBondContact O-CB 3.44Å; L658-V662 VanDerWaalsContact O-CG2 3.27Å; L658-V662 WeakPolarHBondContact O-CG2 3.46Å; L658-V662 PolarHBondContact O-N 3.23Å; L658-L684 HydrophobicContact CD1-CD2 3.62Å; L658-V687 HydrophobicContact CD2-CG1 4.5Å; L658-C694 HydrophobicContact CD2-CB 3.61Å; L658-V698 HydrophobicContact CD1-CG2 3.8Å
659	R	94.2	Very high	92.6	Very high	210 Å²	210	38.6 Å²	38.6	79%	0.792	20%	0.2	S	C	*	.	H	α-helix	trans	-58.2	-42	-179.6	-177.9	178.4	177.4	-179.1	0.4	111.7	W657 G663	W657-R659 PolarHBondContact O-N 3.42Å; R659-G663 PolarHBondContact O-N 3.05Å
660	H	94.8	Very high	92.3	Very high	55 Å²	55	39.6 Å²	39.6	26%	0.255	21%	0.209	S	C	.	.	H	α-helix	trans	-67.3	-53.6	179.1	-179.4	80	0	0	0	112	R602 G656 W657 L658 V662 G663 V664	R602-H660 HydrophobicContact CG-CB 3.92Å; R602-H660 WeakPolarHBondContact CG-CD2 3.24Å; R602-H660 VanDerWaalsContact NE-CG 3.26Å; R602-H660 PolarHBondContact NE-ND1 3.18Å; R602-H660 PolarHBondContact O-NE2 3.05Å; G656-H660 WeakPolarHBondContact O-CB 3.49Å; G656-H660 PolarHBondContact O-N 3.44Å; W657-H660 PolarHBondContact O-N 2.6Å; L658-H660 VanDerWaalsContact C-N 3.29Å; L658-H660 PolarHBondContact O-N 3.08Å; H660-V662 PolarHBondContact O-N 3.08Å; H660-G663 CarbonylContact O-C 3.59Å; H660-G663 WeakPolarHBondContact O-CA 3.34Å; H660-G663 PolarHBondContact O-N 2.94Å; H660-V664 WeakPolarHBondContact O-CG2 3.34Å; H660-V664 PolarHBondContact O-N 3.3Å
661	T	94.6	Very high	92.1	Very high	13 Å²	13	39 Å²	39	8%	0.08	20%	0.2	C	C	.	.	H	α-helix	trans	-58.6	-47.7	-177.6	-60.2	0	0	0	0	111.4	W657 L658 G663 V664 L665 L680 L684	W657-T661 HydrophobicContact CH2-CG2 4.44Å; W657-T661 HydrophobicContact CZ2-CG2 4.31Å; W657-T661 WeakPolarHBondContact O-CB 3.4Å; W657-T661 PolarHBondContact O-N 3.28Å; W657-T661 PolarHBondContact O-OG1 3.07Å; L658-T661 PolarHBondContact O-N 3.12Å; T661-G663 VanDerWaalsContact C-N 3.32Å; T661-G663 PolarHBondContact O-N 3.34Å; T661-V664 PolarHBondContact O-N 3.38Å; T661-L665 HydrophobicContact CG2-CD1 3.89Å; T661-L665 VanDerWaalsContact O-CD1 3.31Å; T661-L665 WeakPolarHBondContact O-CD1 3.25Å; T661-L665 PolarHBondContact O-N 3.16Å; T661-L680 HydrophobicContact CG2-CD2 3.73Å; T661-L684 HydrophobicContact CG2-CD1 4.49Å; T661-L684 HydrophobicContact CG2-CD2 4.49Å
662	V	94.1	Very high	91.7	Very high	12 Å²	12	39.3 Å²	39.3	7%	0.073	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-42	175.1	169.1	0	0	0	0	111	L658 H660 V664 L665 T666 L684 V698 A701 L708	L658-V662 HydrophobicContact CD1-CG2 3.93Å; L658-V662 HydrophobicContact CG-CG2 4.44Å; L658-V662 VanDerWaalsContact O-CB 3.26Å; L658-V662 WeakPolarHBondContact O-CB 3.44Å; L658-V662 VanDerWaalsContact O-CG2 3.27Å; L658-V662 WeakPolarHBondContact O-CG2 3.46Å; L658-V662 PolarHBondContact O-N 3.23Å; H660-V662 PolarHBondContact O-N 3.08Å; V662-V664 PolarHBondContact O-N 3.5Å; V662-L665 PolarHBondContact O-N 2.94Å; V662-T666 HydrophobicContact CG1-CG2 4.38Å; V662-T666 VanDerWaalsContact O-CG2 3.31Å; V662-T666 WeakPolarHBondContact O-CG2 3.45Å; V662-T666 PolarHBondContact O-N 3.47Å; V662-T666 PolarHBondContact O-OG1 2.96Å; V662-T666 VanDerWaalsContact O-OG1 3.07Å; V662-L684 HydrophobicContact CG2-CD2 4.19Å; V662-V698 HydrophobicContact CG2-CG2 4.22Å; V662-A701 HydrophobicContact CG1-CB 3.02Å; V662-L708 HydrophobicContact CG1-CD2 3.95Å
663	G	93.3	Very high	91.5	Very high	17 Å²	17	44 Å²	44	18%	0.175	22%	0.224	C	C	.	.	H	α-helix	trans	-56.6	-48.2	173.7	0	0	0	0	0	113	R659 H660 T661 L665 T666 Q667	R659-G663 PolarHBondContact O-N 3.05Å; H660-G663 CarbonylContact O-C 3.59Å; H660-G663 WeakPolarHBondContact O-CA 3.34Å; H660-G663 PolarHBondContact O-N 2.94Å; T661-G663 VanDerWaalsContact C-N 3.32Å; T661-G663 PolarHBondContact O-N 3.34Å; G663-L665 PolarHBondContact O-N 3.31Å; G663-T666 WeakPolarHBondContact CA-OG1 3.47Å; G663-T666 PolarHBondContact O-N 3.19Å; G663-T666 PolarHBondContact O-OG1 3.06Å; G663-Q667 WeakPolarHBondContact O-CB 3.44Å; G663-Q667 VanDerWaalsContact O-CG 3.24Å; G663-Q667 WeakPolarHBondContact O-CG 3.45Å; G663-Q667 PolarHBondContact O-N 3.48Å
664	V	92.9	Very high	91.4	Very high	6 Å²	6	47.8 Å²	47.8	4%	0.036	24%	0.239	C	C	.	.	H	α-helix	trans	-60.2	-45.1	177.4	171.9	0	0	0	0	111.7	L605 P607 V614 H660 T661 V662 S668	L605-V664 HydrophobicContact CB-CG1 4.49Å; P607-V664 HydrophobicContact CG-CG2 4.2Å; V614-V664 HydrophobicContact CG1-CG1 3.83Å; V614-V664 HydrophobicContact CG2-CG1 4.26Å; H660-V664 WeakPolarHBondContact O-CG2 3.34Å; H660-V664 PolarHBondContact O-N 3.3Å; T661-V664 PolarHBondContact O-N 3.38Å; V662-V664 PolarHBondContact O-N 3.5Å; V664-S668 WeakPolarHBondContact O-CB 3.47Å; V664-S668 PolarHBondContact O-N 3.19Å; V664-S668 PolarHBondContact O-OG 3.42Å
665	L	92.4	Very high	91.4	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-66.1	-38.5	177.5	-87.3	119.8	0	0	0	112.6	V614 T661 V662 G663 L680 L684 A707 L708 M711	V614-L665 HydrophobicContact CG2-CD2 3.84Å; T661-L665 HydrophobicContact CG2-CD1 3.89Å; T661-L665 VanDerWaalsContact O-CD1 3.31Å; T661-L665 WeakPolarHBondContact O-CD1 3.25Å; T661-L665 PolarHBondContact O-N 3.16Å; V662-L665 PolarHBondContact O-N 2.94Å; G663-L665 PolarHBondContact O-N 3.31Å; L665-L680 HydrophobicContact CD2-CD1 4.36Å; L665-L684 HydrophobicContact CD1-CD1 4.11Å; L665-A707 HydrophobicContact CD2-CB 4.43Å; L665-A707 VanDerWaalsContact O-CB 3.25Å; L665-A707 WeakPolarHBondContact O-CB 3.44Å; L665-A707 PolarHBondContact O-N 3Å; L665-L708 HydrophobicContact CB-CB 3.86Å; L665-L708 HydrophobicContact CB-CD1 3.89Å; L665-L708 HydrophobicContact CB-CG 4.43Å; L665-L708 HydrophobicContact CD1-CD1 3.99Å; L665-L708 HydrophobicContact CG-CD1 4.05Å; L665-L708 PolarHBondContact O-N 3.14Å; L665-M711 HydrophobicContact CD1-CE 4.11Å; L665-M711 HydrophobicContact CD2-CE 4.25Å; L665-M711 HydrophobicContact CG-CE 4.04Å
666	T	91.6	Very high	91.4	Very high	31 Å²	31	46.1 Å²	46.1	19%	0.19	23%	0.228	C	C	.	.	H	α-helix	trans	-71.5	-35.5	179.7	53.1	0	0	0	0	112.8	V662 G663 S668 A701 S704 L708	V662-T666 HydrophobicContact CG1-CG2 4.38Å; V662-T666 VanDerWaalsContact O-CG2 3.31Å; V662-T666 WeakPolarHBondContact O-CG2 3.45Å; V662-T666 PolarHBondContact O-N 3.47Å; V662-T666 PolarHBondContact O-OG1 2.96Å; V662-T666 VanDerWaalsContact O-OG1 3.07Å; G663-T666 WeakPolarHBondContact CA-OG1 3.47Å; G663-T666 PolarHBondContact O-N 3.19Å; G663-T666 PolarHBondContact O-OG1 3.06Å; T666-S668 VanDerWaalsContact C-N 3.3Å; T666-S668 PolarHBondContact O-N 3.47Å; T666-A701 HydrophobicContact CG2-CB 4Å; T666-A701 WeakPolarHBondContact CG2-O 3.44Å; T666-S704 VanDerWaalsContact CG2-OG 3.31Å; T666-S704 WeakPolarHBondContact CG2-OG 3.47Å; T666-L708 HydrophobicContact CG2-CB 4.26Å; T666-L708 HydrophobicContact CG2-CD2 3.87Å
667	Q	90.1	Very high	91.4	Very high	127 Å²	127	47.2 Å²	47.2	59%	0.593	23%	0.228	S	C	*	.	H	α-helix	trans	-77.1	-15.4	-179.7	-69.2	170.3	18	0	0	113.5	P607 G663	P607-Q667 HydrophobicContact CB-CB 4.07Å; P607-Q667 HydrophobicContact CG-CB 4.44Å; P607-Q667 VanDerWaalsContact CG-OE1 3.27Å; G663-Q667 WeakPolarHBondContact O-CB 3.44Å; G663-Q667 VanDerWaalsContact O-CG 3.24Å; G663-Q667 WeakPolarHBondContact O-CG 3.45Å; G663-Q667 PolarHBondContact O-N 3.48Å
668	S	88.9	Confident	91.4	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.007	25%	0.245	C	C	.	.			trans	-97.7	139.8	-177.4	-55.3	0	0	0	0	111.6	G608 V614 V664 T666 G706 A707	G608-S668 PolarHBondContact N-OG 3.02Å; G608-S668 VanDerWaalsContact N-OG 3.15Å; V614-S668 WeakPolarHBondContact CG2-OG 3.42Å; V664-S668 WeakPolarHBondContact O-CB 3.47Å; V664-S668 PolarHBondContact O-N 3.19Å; V664-S668 PolarHBondContact O-OG 3.42Å; T666-S668 VanDerWaalsContact C-N 3.3Å; T666-S668 PolarHBondContact O-N 3.47Å; S668-G706 CarbonylContact O-C 3.57Å; S668-G706 WeakPolarHBondContact O-CA 3.39Å; S668-A707 PolarHBondContact O-N 3.42Å
669	G	82.8	Confident	91.4	Very high	27 Å²	27	50.7 Å²	50.7	28%	0.278	24%	0.244	S	C	.	.	S	Bend	trans	-76.5	-23.6	-178	0	0	0	0	0	114.1	G612 R710	G612-G669 PolarHBondContact O-N 3.23Å; G669-R710 PolarHBondContact O-NH2 2.96Å
670	A	86.4	Confident	91.4	Very high	26 Å²	26	40.8 Å²	40.8	22%	0.215	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-134.5	151.6	176.9	0	0	0	0	0	111.9	G612 P613 V614 A707	G612-A670 PolarHBondContact O-N 3.28Å; P613-A670 WeakPolarHBondContact CA-O 3.23Å; P613-A670 HydrophobicContact CB-CB 4.03Å; V614-A670 PolarHBondContact N-O 3.44Å; A670-A707 VanDerWaalsContact C-CB 3.46Å; A670-A707 WeakPolarHBondContact O-CB 3.49Å
671	A	85.3	Confident	91.4	Very high	16 Å²	16	38.8 Å²	38.8	13%	0.132	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-64.3	157.7	175.5	0	0	0	0	0	111.5	Q677 A707	A671-Q677 HydrophobicContact CB-CG 4.16Å; A671-A707 HydrophobicContact CB-CB 4.29Å
672	P	87.6	Confident	91.4	Very high	13 Å²	13	41.4 Å²	41.4	8%	0.084	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-60.7	173.5	166.8	28.9	-34.5	0	0	0	110.2	V614 Q677 L680	V614-P672 HydrophobicContact CB-CB 4.13Å; V614-P672 HydrophobicContact CG1-CB 4.44Å; P672-Q677 HydrophobicContact CG-CB 4.19Å; P672-L680 HydrophobicContact CG-CD1 4.01Å
673	E	89.4	Confident	91.5	Very high	97 Å²	97	40.9 Å²	40.9	45%	0.453	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-46.2	148.5	170.3	71.5	-159.3	178.7	0	0	112	R632 H675 S676 Q677	R632-E673 IonicContact NH1-OE1 3.58Å; R632-E673 PolarHBondContact NH1-OE1 2.84Å; E673-H675 VanDerWaalsContact C-N 3.33Å; E673-H675 PolarHBondContact O-N 3.11Å; E673-H675 VanDerWaalsContact O-N 3.16Å; E673-S676 WeakPolarHBondContact CG-OG 3.47Å; E673-S676 PolarHBondContact O-N 2.78Å; E673-S676 PolarHBondContact OE1-OG 3.42Å; E673-Q677 PolarHBondContact O-N 3.25Å
674	R	91	Very high	91.6	Very high	179 Å²	179	40 Å²	40	68%	0.675	20%	0.198	S	C	*	.	H	α-helix	trans	-52	-46.3	-167.1	-178.5	179.8	173	-179.1	-0.5	113.7	S676 Q677 E678	R674-S676 PolarHBondContact O-N 2.93Å; R674-Q677 WeakPolarHBondContact O-CB 3.3Å; R674-Q677 PolarHBondContact O-N 3.15Å; R674-E678 WeakPolarHBondContact CG-OE1 3.47Å; R674-E678 IonicContact CZ-OE1 2.68Å; R674-E678 IonicContact NE-OE1 2.82Å; R674-E678 PolarHBondContact NE-OE1 3.2Å; R674-E678 IonicContact NH2-OE1 2.91Å; R674-E678 WeakPolarHBondContact O-CG 3.41Å; R674-E678 PolarHBondContact O-N 3.38Å
675	H	92.6	Very high	91.7	Very high	118 Å²	118	40.4 Å²	40.4	55%	0.546	20%	0.2	S	C	.	.	H	α-helix	trans	-64.6	-39.9	-178.9	-64.3	-62	0	0	0	112.4	E673 E678 A679	E673-H675 VanDerWaalsContact C-N 3.33Å; E673-H675 PolarHBondContact O-N 3.11Å; E673-H675 VanDerWaalsContact O-N 3.16Å; H675-E678 PolarHBondContact O-N 2.87Å; H675-A679 PolarHBondContact O-N 2.93Å
676	S	93.3	Very high	91.8	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.007	20%	0.2	C	C	.	.	H	α-helix	trans	-70.5	-34.9	176.4	-65.1	0	0	0	0	111.8	R632 E673 R674 L680	R632-S676 PolarHBondContact NH1-OG 3.29Å; E673-S676 WeakPolarHBondContact CG-OG 3.47Å; E673-S676 PolarHBondContact O-N 2.78Å; E673-S676 PolarHBondContact OE1-OG 3.42Å; R674-S676 PolarHBondContact O-N 2.93Å; S676-L680 WeakPolarHBondContact O-CB 3.21Å; S676-L680 WeakPolarHBondContact O-CG 3.32Å; S676-L680 PolarHBondContact O-N 3.06Å; S676-L680 VanDerWaalsContact O-N 3.09Å
677	Q	93.8	Very high	91.9	Very high	40 Å²	40	38.9 Å²	38.9	19%	0.187	19%	0.191	C	C	.	.	H	α-helix	trans	-61.8	-48.6	171.2	-175.6	-170.4	-35.4	0	0	111.2	A671 P672 E673 R674 A679 L680 E681 M711	A671-Q677 HydrophobicContact CB-CG 4.16Å; P672-Q677 HydrophobicContact CG-CB 4.19Å; E673-Q677 PolarHBondContact O-N 3.25Å; R674-Q677 WeakPolarHBondContact O-CB 3.3Å; R674-Q677 PolarHBondContact O-N 3.15Å; Q677-A679 PolarHBondContact O-N 3.13Å; Q677-L680 PolarHBondContact O-N 3.42Å; Q677-E681 VanDerWaalsContact O-CB 3.24Å; Q677-E681 WeakPolarHBondContact O-CB 3.26Å; Q677-E681 PolarHBondContact O-N 3.26Å; Q677-M711 HydrophobicContact CG-CE 3.74Å; Q677-M711 HydrophobicContact CG-CG 4.15Å
678	E	94.3	Very high	92.1	Very high	74 Å²	74	32.9 Å²	32.9	35%	0.346	16%	0.163	S	C	.	.	H	α-helix	trans	-61.3	-42	-179.1	-73.4	172.1	-176.1	0	0	111.7	R674 H675 E681 E682	R674-E678 WeakPolarHBondContact CG-OE1 3.47Å; R674-E678 IonicContact CZ-OE1 2.68Å; R674-E678 IonicContact NE-OE1 2.82Å; R674-E678 PolarHBondContact NE-OE1 3.2Å; R674-E678 IonicContact NH2-OE1 2.91Å; R674-E678 WeakPolarHBondContact O-CG 3.41Å; R674-E678 PolarHBondContact O-N 3.38Å; H675-E678 PolarHBondContact O-N 2.87Å; E678-E681 PolarHBondContact O-N 3.47Å; E678-E682 PolarHBondContact O-N 3.36Å
679	A	95.4	Very high	92.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.3	-43.2	177.6	0	0	0	0	0	112.9	R632 L635 Q636 H675 Q677 E682 A683	R632-A679 HydrophobicContact CB-CB 4Å; R632-A679 HydrophobicContact CG-CB 4.12Å; L635-A679 HydrophobicContact CB-CB 4.19Å; L635-A679 HydrophobicContact CD1-CB 4.16Å; Q636-A679 HydrophobicContact CG-CB 4.25Å; H675-A679 PolarHBondContact O-N 2.93Å; Q677-A679 PolarHBondContact O-N 3.13Å; A679-E682 PolarHBondContact O-N 3.47Å; A679-A683 PolarHBondContact O-N 3.36Å
680	L	95.3	Very high	92.6	Very high	2 Å²	2	42 Å²	42	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-63	-44.5	174.8	-77.9	168.5	0	0	0	111.8	L605 W631 L635 T661 L665 P672 S676 Q677 E682 A683 L684 M711	L605-L680 HydrophobicContact CD1-CD1 3.88Å; W631-L680 HydrophobicContact CH2-CD1 4.06Å; W631-L680 HydrophobicContact CH2-CD2 3.96Å; W631-L680 HydrophobicContact CH2-CG 3.84Å; W631-L680 HydrophobicContact CZ2-CD2 4.18Å; L635-L680 HydrophobicContact CD1-CD2 3.63Å; L635-L680 HydrophobicContact CD1-CG 3.82Å; L635-L680 HydrophobicContact CD2-CD2 4.38Å; T661-L680 HydrophobicContact CG2-CD2 3.73Å; L665-L680 HydrophobicContact CD2-CD1 4.36Å; P672-L680 HydrophobicContact CG-CD1 4.01Å; S676-L680 WeakPolarHBondContact O-CB 3.21Å; S676-L680 WeakPolarHBondContact O-CG 3.32Å; S676-L680 PolarHBondContact O-N 3.06Å; S676-L680 VanDerWaalsContact O-N 3.09Å; Q677-L680 PolarHBondContact O-N 3.42Å; L680-E682 VanDerWaalsContact C-N 3.32Å; L680-E682 PolarHBondContact O-N 3.26Å; L680-A683 PolarHBondContact O-N 3.13Å; L680-L684 WeakPolarHBondContact O-CB 3.36Å; L680-L684 VanDerWaalsContact O-CG 3.27Å; L680-L684 WeakPolarHBondContact O-CG 3.39Å; L680-L684 PolarHBondContact O-N 3.2Å; L680-M711 HydrophobicContact CB-CE 4.03Å
681	E	94.7	Very high	92.9	Very high	14 Å²	14	41.7 Å²	41.7	7%	0.065	19%	0.189	C	C	.	.	H	α-helix	trans	-61.3	-41.3	179.6	179.9	161.1	-149.5	0	0	111.2	Q677 E678 C685 M711 K712 R713 L714	Q677-E681 VanDerWaalsContact O-CB 3.24Å; Q677-E681 WeakPolarHBondContact O-CB 3.26Å; Q677-E681 PolarHBondContact O-N 3.26Å; E678-E681 PolarHBondContact O-N 3.47Å; E681-C685 WeakPolarHBondContact O-CB 3.47Å; E681-C685 PolarHBondContact O-N 3.16Å; E681-C685 PolarHBondContact O-SG 2.9Å; E681-M711 HydrophobicContact CB-CG 4.36Å; E681-M711 HydrophobicContact CB-SD 4.2Å; E681-M711 HydrophobicContact CG-CB 4.23Å; E681-M711 VanDerWaalsContact OE1-CA 3.26Å; E681-M711 WeakPolarHBondContact OE1-CA 3.16Å; E681-M711 WeakPolarHBondContact OE1-CB 3.32Å; E681-K712 PolarHBondContact OE1-N 2.98Å; E681-K712 VanDerWaalsContact OE1-N 3.08Å; E681-R713 HydrophobicContact CG-CB 3.98Å; E681-R713 VanDerWaalsContact OE1-CA 3.27Å; E681-R713 WeakPolarHBondContact OE1-CA 3.14Å; E681-R713 VanDerWaalsContact OE1-CB 3.24Å; E681-R713 WeakPolarHBondContact OE1-CB 3.49Å; E681-R713 PolarHBondContact OE1-N 3.16Å; E681-L714 HydrophobicContact CG-CB 4.18Å; E681-L714 PolarHBondContact OE1-N 3Å
682	E	94.4	Very high	93.2	Very high	67 Å²	67	45.3 Å²	45.3	31%	0.313	21%	0.211	S	C	.	.	H	α-helix	trans	-61.9	-47.6	175	-178	172.7	177.2	0	0	112.8	R643 E678 A679 L680 C685 A686	R643-E682 IonicContact CZ-OE1 2.76Å; R643-E682 IonicContact NH2-OE1 3.75Å; R643-E682 PolarHBondContact NH2-OE1 3.41Å; E678-E682 PolarHBondContact O-N 3.36Å; A679-E682 PolarHBondContact O-N 3.47Å; L680-E682 VanDerWaalsContact C-N 3.32Å; L680-E682 PolarHBondContact O-N 3.26Å; E682-C685 PolarHBondContact O-N 3.1Å; E682-A686 PolarHBondContact O-N 2.96Å; E682-A686 VanDerWaalsContact O-N 3.07Å
683	A	95.4	Very high	93.4	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-62.6	-44.8	179.9	0	0	0	0	0	111.6	L635 W657 A679 L680 A686 V687	L635-A683 HydrophobicContact CB-CB 4.33Å; L635-A683 HydrophobicContact CD2-CB 4.43Å; L635-A683 WeakPolarHBondContact O-CB 3.46Å; W657-A683 HydrophobicContact CH2-CB 4.05Å; A679-A683 PolarHBondContact O-N 3.36Å; L680-A683 PolarHBondContact O-N 3.13Å; A683-A686 PolarHBondContact O-N 3.12Å; A683-V687 WeakPolarHBondContact O-CG2 3.41Å; A683-V687 PolarHBondContact O-N 3.46Å; A683-V687 VanDerWaalsContact O-N 3.17Å
684	L	96	Very high	93.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.8	-39.9	179.1	-70	170.9	0	0	0	112.1	W657 L658 T661 V662 L665 L680 V687 A688 L708 M711 L714	W657-L684 HydrophobicContact CH2-CD2 4.18Å; W657-L684 HydrophobicContact CZ3-CD2 3.99Å; L658-L684 HydrophobicContact CD1-CD2 3.62Å; T661-L684 HydrophobicContact CG2-CD1 4.49Å; T661-L684 HydrophobicContact CG2-CD2 4.49Å; V662-L684 HydrophobicContact CG2-CD2 4.19Å; L665-L684 HydrophobicContact CD1-CD1 4.11Å; L680-L684 WeakPolarHBondContact O-CB 3.36Å; L680-L684 VanDerWaalsContact O-CG 3.27Å; L680-L684 WeakPolarHBondContact O-CG 3.39Å; L680-L684 PolarHBondContact O-N 3.2Å; L684-V687 PolarHBondContact O-N 3.45Å; L684-A688 WeakPolarHBondContact O-CB 3.43Å; L684-A688 PolarHBondContact O-N 2.85Å; L684-L708 HydrophobicContact CD1-CD1 4.33Å; L684-M711 HydrophobicContact CD1-SD 4.37Å; L684-L714 HydrophobicContact CB-CD1 3.68Å; L684-L714 HydrophobicContact CB-CD2 3.9Å; L684-L714 HydrophobicContact CB-CG 4.44Å; L684-L714 HydrophobicContact CD1-CD2 3.8Å; L684-L714 HydrophobicContact CG-CD2 4.48Å
685	C	95.3	Very high	93.8	Very high	13 Å²	13	38.8 Å²	38.8	9%	0.088	19%	0.186	C	C	.	.	H	α-helix	trans	-58.7	-49	173.6	-76.4	0	0	0	0	111.1	E681 E682 V687 A688 E689 L714 A717	E681-C685 WeakPolarHBondContact O-CB 3.47Å; E681-C685 PolarHBondContact O-N 3.16Å; E681-C685 PolarHBondContact O-SG 2.9Å; E682-C685 PolarHBondContact O-N 3.1Å; C685-V687 VanDerWaalsContact C-N 3.28Å; C685-V687 PolarHBondContact O-N 2.96Å; C685-A688 PolarHBondContact O-N 3.12Å; C685-E689 WeakPolarHBondContact O-CB 3.31Å; C685-E689 VanDerWaalsContact O-CG 3.26Å; C685-E689 WeakPolarHBondContact O-CG 3.39Å; C685-E689 PolarHBondContact O-N 3.36Å; C685-L714 VanDerWaalsContact SG-CA 3.53Å; C685-A717 HydrophobicContact CB-CB 4.36Å
686	A	94.3	Very high	93.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-57.4	-42	-180	0	0	0	0	0	112.4	V642 R643 E682 A683 R690	V642-A686 HydrophobicContact CB-CB 4.49Å; V642-A686 HydrophobicContact CG1-CB 4.5Å; R643-A686 HydrophobicContact CG-CB 4.31Å; E682-A686 PolarHBondContact O-N 2.96Å; E682-A686 VanDerWaalsContact O-N 3.07Å; A683-A686 PolarHBondContact O-N 3.12Å; A686-R690 WeakPolarHBondContact O-CB 3.47Å; A686-R690 WeakPolarHBondContact O-CG 3.46Å; A686-R690 PolarHBondContact O-N 3.44Å
687	V	94.4	Very high	93.8	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.006	20%	0.199	C	C	.	.	H	α-helix	trans	-68.4	-45.1	177.8	176.9	0	0	0	0	111.5	V642 I652 L658 A683 L684 C685 E689 R690 C691 C694	V642-V687 HydrophobicContact CG1-CG2 4.28Å; V642-V687 HydrophobicContact CG2-CG2 4.07Å; I652-V687 HydrophobicContact CD1-CG2 3.65Å; I652-V687 HydrophobicContact CG2-CG1 4.29Å; I652-V687 HydrophobicContact CG2-CG2 4.41Å; L658-V687 HydrophobicContact CD2-CG1 4.5Å; A683-V687 WeakPolarHBondContact O-CG2 3.41Å; A683-V687 PolarHBondContact O-N 3.46Å; A683-V687 VanDerWaalsContact O-N 3.17Å; L684-V687 PolarHBondContact O-N 3.45Å; C685-V687 VanDerWaalsContact C-N 3.28Å; C685-V687 PolarHBondContact O-N 2.96Å; V687-E689 VanDerWaalsContact C-N 3.35Å; V687-E689 PolarHBondContact O-N 3.33Å; V687-R690 PolarHBondContact O-N 3.36Å; V687-C691 PolarHBondContact O-N 2.88Å; V687-C694 HydrophobicContact CG1-CB 3.64Å
688	A	93.8	Very high	93.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-67.3	-33.9	179.6	0	0	0	0	0	112.9	L684 C685 R695 V718	L684-A688 WeakPolarHBondContact O-CB 3.43Å; L684-A688 PolarHBondContact O-N 2.85Å; C685-A688 PolarHBondContact O-N 3.12Å; A688-R695 HydrophobicContact CB-CB 4.36Å; A688-R695 HydrophobicContact CB-CG 4.35Å; A688-R695 WeakPolarHBondContact O-CB 3.49Å; A688-R695 PolarHBondContact O-NE 3.33Å; A688-R695 PolarHBondContact O-NH2 2.75Å; A688-V718 HydrophobicContact CB-CG1 4.12Å
689	E	92.2	Very high	93.8	Very high	95 Å²	95	41 Å²	41	44%	0.444	19%	0.187	S	C	.	.	H	α-helix	trans	-67.6	-41.4	176.4	-76	170.9	-178.1	0	0	111.4	C685 V687 R695	C685-E689 WeakPolarHBondContact O-CB 3.31Å; C685-E689 VanDerWaalsContact O-CG 3.26Å; C685-E689 WeakPolarHBondContact O-CG 3.39Å; C685-E689 PolarHBondContact O-N 3.36Å; V687-E689 VanDerWaalsContact C-N 3.35Å; V687-E689 PolarHBondContact O-N 3.33Å; E689-R695 PolarHBondContact O-NH2 3.04Å
690	R	90	Very high	93.6	Very high	124 Å²	124	46.1 Å²	46.1	47%	0.468	21%	0.211	S	C	.	.	H	α-helix	trans	-87.1	-22	-173.7	-66.1	-60.8	-179.3	124.1	-0.4	115.1	V642 R643 A686 V687	V642-R690 HydrophobicContact CG1-CB 4.08Å; V642-R690 HydrophobicContact CG1-CG 4.09Å; R643-R690 PolarHBondContact O-NH1 3.47Å; R643-R690 PolarHBondContact O-NH2 3.07Å; R643-R690 VanDerWaalsContact O-NH2 3.12Å; A686-R690 WeakPolarHBondContact O-CB 3.47Å; A686-R690 WeakPolarHBondContact O-CG 3.46Å; A686-R690 PolarHBondContact O-N 3.44Å; V687-R690 PolarHBondContact O-N 3.36Å
691	C	91.6	Very high	93.4	Very high	20 Å²	20	47 Å²	47	14%	0.135	22%	0.218	C	C	.	.			trans	-127.9	116.3	-179.1	-176.1	0	0	0	0	112.4	V687 D693 C694 R695	V687-C691 PolarHBondContact O-N 2.88Å; C691-D693 VanDerWaalsContact C-N 3.29Å; C691-D693 PolarHBondContact O-N 2.91Å; C691-C694 HydrophobicContact CB-CB 3.88Å; C691-C694 PolarHBondContact O-N 3.2Å; C691-R695 PolarHBondContact O-N 3.16Å
692	P	91.8	Very high	93.2	Very high	92 Å²	92	47 Å²	47	60%	0.597	22%	0.218	S	C	*	.	H	α-helix	trans	-59.4	-35.7	178.7	-25.4	34.4	0	0	0	114.2	R695 R696	P692-R695 WeakPolarHBondContact O-CB 3.5Å; P692-R695 PolarHBondContact O-N 3.29Å; P692-R696 PolarHBondContact O-N 2.93Å; P692-R696 VanDerWaalsContact O-N 3.12Å
693	D	92.6	Very high	92.9	Very high	65 Å²	65	52 Å²	52	35%	0.348	23%	0.234	S	C	.	.	H	α-helix	trans	-68.9	-48.4	178.4	-68.4	-19.6	0	0	0	110.8	R653 C691 R695 R696 E697	R653-D693 IonicContact CZ-OD2 3.97Å; R653-D693 IonicContact NH1-OD2 2.87Å; R653-D693 PolarHBondContact NH1-OD2 3.1Å; C691-D693 VanDerWaalsContact C-N 3.29Å; C691-D693 PolarHBondContact O-N 2.91Å; D693-R695 VanDerWaalsContact C-N 3.25Å; D693-R695 PolarHBondContact O-N 3.04Å; D693-R696 WeakPolarHBondContact O-CB 3.45Å; D693-R696 PolarHBondContact O-N 3.16Å; D693-R696 IonicContact OD1-NH2 3.92Å; D693-E697 PolarHBondContact O-N 2.81Å
694	C	93.5	Very high	92.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-58.8	-39	174.6	-60.4	0	0	0	0	111.7	L658 V687 C691 R696 E697 V698	L658-C694 HydrophobicContact CD2-CB 3.61Å; V687-C694 HydrophobicContact CG1-CB 3.64Å; C691-C694 HydrophobicContact CB-CB 3.88Å; C691-C694 PolarHBondContact O-N 3.2Å; C694-R696 VanDerWaalsContact C-N 3.28Å; C694-R696 PolarHBondContact O-N 2.88Å; C694-E697 PolarHBondContact O-N 3.06Å; C694-V698 VanDerWaalsContact O-CG2 3.31Å; C694-V698 WeakPolarHBondContact O-CG2 3.39Å; C694-V698 PolarHBondContact O-N 3.47Å
695	R	94.7	Very high	91.7	Very high	87 Å²	87	57.2 Å²	57.2	33%	0.328	28%	0.275	S	S	.	.	H	α-helix	trans	-58.4	-41.3	174.8	-165.2	-176.6	-61.3	-173.8	1.6	112	A688 E689 C691 P692 D693 R699 V718	A688-R695 HydrophobicContact CB-CB 4.36Å; A688-R695 HydrophobicContact CB-CG 4.35Å; A688-R695 WeakPolarHBondContact O-CB 3.49Å; A688-R695 PolarHBondContact O-NE 3.33Å; A688-R695 PolarHBondContact O-NH2 2.75Å; E689-R695 PolarHBondContact O-NH2 3.04Å; C691-R695 PolarHBondContact O-N 3.16Å; P692-R695 WeakPolarHBondContact O-CB 3.5Å; P692-R695 PolarHBondContact O-N 3.29Å; D693-R695 VanDerWaalsContact C-N 3.25Å; D693-R695 PolarHBondContact O-N 3.04Å; R695-R699 VanDerWaalsContact O-CB 3.25Å; R695-R699 WeakPolarHBondContact O-CB 3.49Å; R695-R699 PolarHBondContact O-N 3.37Å; R695-V718 HydrophobicContact CG-CB 4.3Å; R695-V718 HydrophobicContact CG-CG1 4.12Å
696	R	93.3	Very high	91.3	Very high	137 Å²	137	58.1 Å²	58.1	52%	0.517	29%	0.287	S	S	.	.	H	α-helix	trans	-66.5	-47.6	178.6	-167.9	-168.9	-44.7	-150.6	5.9	110.8	P692 D693 C694 V698 R699 E700	P692-R696 PolarHBondContact O-N 2.93Å; P692-R696 VanDerWaalsContact O-N 3.12Å; D693-R696 WeakPolarHBondContact O-CB 3.45Å; D693-R696 PolarHBondContact O-N 3.16Å; D693-R696 IonicContact OD1-NH2 3.92Å; C694-R696 VanDerWaalsContact C-N 3.28Å; C694-R696 PolarHBondContact O-N 2.88Å; R696-V698 PolarHBondContact O-N 2.93Å; R696-R699 WeakPolarHBondContact O-CB 3.47Å; R696-R699 PolarHBondContact O-N 3.48Å; R696-E700 WeakPolarHBondContact CG-OE1 3.38Å; R696-E700 WeakPolarHBondContact O-CG 3.26Å; R696-E700 PolarHBondContact O-N 3.37Å
697	E	92.9	Very high	91	Very high	67 Å²	67	58.1 Å²	58.1	31%	0.313	29%	0.287	S	S	.	.	H	α-helix	trans	-58.7	-47.5	178.1	-70.9	176.8	-147.8	0	0	111.9	R653 D693 C694 R699 E700 A701	R653-E697 VanDerWaalsContact CD-OE1 3.24Å; R653-E697 WeakPolarHBondContact CD-OE1 3.44Å; D693-E697 PolarHBondContact O-N 2.81Å; C694-E697 PolarHBondContact O-N 3.06Å; E697-R699 PolarHBondContact O-N 3.04Å; E697-E700 PolarHBondContact O-N 3.23Å; E697-A701 WeakPolarHBondContact O-CB 3.33Å; E697-A701 PolarHBondContact O-N 2.94Å
698	V	93.9	Very high	90.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.8	-44	176.6	176.8	0	0	0	0	110.7	L658 V662 C694 R696 E700 A701 M702 L714 V718	L658-V698 HydrophobicContact CD1-CG2 3.8Å; V662-V698 HydrophobicContact CG2-CG2 4.22Å; C694-V698 VanDerWaalsContact O-CG2 3.31Å; C694-V698 WeakPolarHBondContact O-CG2 3.39Å; C694-V698 PolarHBondContact O-N 3.47Å; R696-V698 PolarHBondContact O-N 2.93Å; V698-E700 VanDerWaalsContact C-N 3.33Å; V698-E700 PolarHBondContact O-N 3.39Å; V698-A701 PolarHBondContact O-N 3.08Å; V698-M702 HydrophobicContact CG1-CG 4.32Å; V698-M702 HydrophobicContact CG1-SD 4.32Å; V698-M702 VanDerWaalsContact O-CG 3.31Å; V698-M702 WeakPolarHBondContact O-CG 3.45Å; V698-M702 PolarHBondContact O-N 3.34Å; V698-L714 HydrophobicContact CG1-CD1 4.02Å; V698-L714 HydrophobicContact CG1-CD2 3.83Å; V698-L714 HydrophobicContact CG1-CG 3.94Å; V698-V718 HydrophobicContact CB-CG1 4.04Å; V698-V718 HydrophobicContact CG1-CG1 3.75Å
699	R	93.8	Very high	90.4	Very high	77 Å²	77	59.6 Å²	59.6	29%	0.291	30%	0.302	S	S	.	.	H	α-helix	trans	-60.2	-42.9	178.4	-173.6	-172	-66.3	143.6	-3.1	112	R695 R696 E697 M702 R703 V718 L720	R695-R699 VanDerWaalsContact O-CB 3.25Å; R695-R699 WeakPolarHBondContact O-CB 3.49Å; R695-R699 PolarHBondContact O-N 3.37Å; R696-R699 WeakPolarHBondContact O-CB 3.47Å; R696-R699 PolarHBondContact O-N 3.48Å; E697-R699 PolarHBondContact O-N 3.04Å; R699-M702 PolarHBondContact O-N 3.12Å; R699-R703 PolarHBondContact O-N 3.31Å; R699-V718 HydrophobicContact CB-CB 4.13Å; R699-V718 HydrophobicContact CB-CG2 4.33Å; R699-V718 HydrophobicContact CG-CG2 4.47Å; R699-V718 VanDerWaalsContact CZ-O 3.24Å; R699-V718 PolarHBondContact NE-O 2.92Å; R699-V718 PolarHBondContact NH2-O 2.94Å; R699-L720 HydrophobicContact CG-CD1 4.15Å; R699-L720 HydrophobicContact CG-CD2 4.14Å; R699-L720 HydrophobicContact CG-CG 4.13Å
700	E	92.1	Very high	90.1	Very high	107 Å²	107	62.2 Å²	62.2	50%	0.5	31%	0.308	S	S	.	.	H	α-helix	trans	-65	-44.9	178.2	-75.6	172	-170.7	0	0	111.1	R696 E697 V698 M702 R703	R696-E700 WeakPolarHBondContact CG-OE1 3.38Å; R696-E700 WeakPolarHBondContact O-CG 3.26Å; R696-E700 PolarHBondContact O-N 3.37Å; E697-E700 PolarHBondContact O-N 3.23Å; V698-E700 VanDerWaalsContact C-N 3.33Å; V698-E700 PolarHBondContact O-N 3.39Å; E700-M702 VanDerWaalsContact C-N 3.35Å; E700-M702 PolarHBondContact O-N 3.01Å; E700-R703 WeakPolarHBondContact O-CB 3.44Å; E700-R703 PolarHBondContact O-N 3.47Å
701	A	90.9	Very high	90.1	Very high	19 Å²	19	56.3 Å²	56.3	16%	0.157	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-37.1	175.8	0	0	0	0	0	113.1	V662 T666 E697 V698 R703 S704 L708	V662-A701 HydrophobicContact CG1-CB 3.02Å; T666-A701 HydrophobicContact CG2-CB 4Å; T666-A701 WeakPolarHBondContact CG2-O 3.44Å; E697-A701 WeakPolarHBondContact O-CB 3.33Å; E697-A701 PolarHBondContact O-N 2.94Å; V698-A701 PolarHBondContact O-N 3.08Å; A701-R703 PolarHBondContact O-N 3.36Å; A701-S704 WeakPolarHBondContact O-CB 3.36Å; A701-S704 PolarHBondContact O-N 3.32Å; A701-S704 PolarHBondContact O-OG 3.26Å; A701-L708 HydrophobicContact CB-CD2 3.9Å
702	M	91	Very high	90.1	Very high	14 Å²	14	62.5 Å²	62.5	7%	0.069	31%	0.311	C	S	.	.	H	α-helix	trans	-60.9	-29.1	176	-76.6	-169.4	83.7	0	0	113.1	V698 R699 E700 S704 G705 L708 L714 K715 V718 L720	V698-M702 HydrophobicContact CG1-CG 4.32Å; V698-M702 HydrophobicContact CG1-SD 4.32Å; V698-M702 VanDerWaalsContact O-CG 3.31Å; V698-M702 WeakPolarHBondContact O-CG 3.45Å; V698-M702 PolarHBondContact O-N 3.34Å; R699-M702 PolarHBondContact O-N 3.12Å; E700-M702 VanDerWaalsContact C-N 3.35Å; E700-M702 PolarHBondContact O-N 3.01Å; M702-S704 VanDerWaalsContact C-N 3.25Å; M702-S704 PolarHBondContact O-N 3.39Å; M702-G705 PolarHBondContact O-N 3.08Å; M702-L708 HydrophobicContact CB-CD2 4.38Å; M702-L708 HydrophobicContact CG-CD2 3.58Å; M702-L708 HydrophobicContact CG-CG 3.75Å; M702-L714 HydrophobicContact SD-CD2 4.48Å; M702-L714 HydrophobicContact SD-CG 4.17Å; M702-K715 HydrophobicContact CE-CB 3.55Å; M702-K715 HydrophobicContact CE-CD 4.48Å; M702-K715 HydrophobicContact CE-CG 3.81Å; M702-V718 HydrophobicContact SD-CG2 3.6Å; M702-V718 VanDerWaalsContact SD-CG2 3.6Å; M702-L720 HydrophobicContact CB-CD1 3.76Å; M702-L720 HydrophobicContact SD-CD1 4.15Å
703	R	87.8	Confident	90	Very high	172 Å²	172	66.7 Å²	66.7	65%	0.649	31%	0.314	S	S	*	.	H	α-helix	trans	-69.8	-23.3	175	-66.5	172.1	177.9	157	-3.5	112.9	R699 E700 A701 G705	R699-R703 PolarHBondContact O-N 3.31Å; E700-R703 WeakPolarHBondContact O-CB 3.44Å; E700-R703 PolarHBondContact O-N 3.47Å; A701-R703 PolarHBondContact O-N 3.36Å; R703-G705 PolarHBondContact O-N 2.86Å
704	S	83.8	Confident	90	Very high	84 Å²	84	63.6 Å²	63.6	59%	0.587	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-9.7	176.9	72.5	0	0	0	0	113.7	T666 A701 M702	T666-S704 VanDerWaalsContact CG2-OG 3.31Å; T666-S704 WeakPolarHBondContact CG2-OG 3.47Å; A701-S704 WeakPolarHBondContact O-CB 3.36Å; A701-S704 PolarHBondContact O-N 3.32Å; A701-S704 PolarHBondContact O-OG 3.26Å; M702-S704 VanDerWaalsContact C-N 3.25Å; M702-S704 PolarHBondContact O-N 3.39Å
705	G	82.3	Confident	89.9	Confident	27 Å²	27	65.4 Å²	65.4	28%	0.278	31%	0.306	S	S	.	.			trans	87.5	-147.9	175.3	0	0	0	0	0	114	M702 R703	M702-G705 PolarHBondContact O-N 3.08Å; R703-G705 PolarHBondContact O-N 2.86Å
706	G	87.1	Confident	89.6	Confident	33 Å²	33	64.6 Å²	64.6	34%	0.34	32%	0.318	S	S	.	.	S	Bend	trans	77.8	-161.6	-177.7	0	0	0	0	0	114.4	S668 L708 G709	S668-G706 CarbonylContact O-C 3.57Å; S668-G706 WeakPolarHBondContact O-CA 3.39Å; G706-L708 PolarHBondContact O-N 2.8Å; G706-G709 PolarHBondContact O-N 3.39Å
707	A	87.7	Confident	89.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-58.9	-32.6	177.6	0	0	0	0	0	112.9	L665 S668 A670 A671 G709 R710	L665-A707 HydrophobicContact CD2-CB 4.43Å; L665-A707 VanDerWaalsContact O-CB 3.25Å; L665-A707 WeakPolarHBondContact O-CB 3.44Å; L665-A707 PolarHBondContact O-N 3Å; S668-A707 PolarHBondContact O-N 3.42Å; A670-A707 VanDerWaalsContact C-CB 3.46Å; A670-A707 WeakPolarHBondContact O-CB 3.49Å; A671-A707 HydrophobicContact CB-CB 4.29Å; A707-G709 PolarHBondContact O-N 3.41Å; A707-R710 WeakPolarHBondContact O-CB 3.47Å; A707-R710 PolarHBondContact O-N 2.97Å; A707-R710 VanDerWaalsContact O-N 3.07Å
708	L	89.4	Confident	89.4	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-58.2	-36.9	179.7	-163.9	67.9	0	0	0	112.1	V662 L665 T666 L684 A701 M702 G706 R710 M711 L714	V662-L708 HydrophobicContact CG1-CD2 3.95Å; L665-L708 HydrophobicContact CB-CB 3.86Å; L665-L708 HydrophobicContact CB-CD1 3.89Å; L665-L708 HydrophobicContact CB-CG 4.43Å; L665-L708 HydrophobicContact CD1-CD1 3.99Å; L665-L708 HydrophobicContact CG-CD1 4.05Å; L665-L708 PolarHBondContact O-N 3.14Å; T666-L708 HydrophobicContact CG2-CB 4.26Å; T666-L708 HydrophobicContact CG2-CD2 3.87Å; L684-L708 HydrophobicContact CD1-CD1 4.33Å; A701-L708 HydrophobicContact CB-CD2 3.9Å; M702-L708 HydrophobicContact CB-CD2 4.38Å; M702-L708 HydrophobicContact CG-CD2 3.58Å; M702-L708 HydrophobicContact CG-CG 3.75Å; G706-L708 PolarHBondContact O-N 2.8Å; L708-R710 PolarHBondContact O-N 3.33Å; L708-R710 VanDerWaalsContact O-N 3.15Å; L708-M711 HydrophobicContact CD1-SD 4.08Å; L708-M711 PolarHBondContact O-N 3.11Å; L708-L714 HydrophobicContact CD1-CD2 3.78Å
709	G	85.6	Confident	89	Confident	32 Å²	32	58.9 Å²	58.9	33%	0.33	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-64.7	-15.8	179.4	0	0	0	0	0	114.3	G706 A707	G706-G709 PolarHBondContact O-N 3.39Å; A707-G709 PolarHBondContact O-N 3.41Å
710	R	85.5	Confident	88.6	Confident	149 Å²	149	57.3 Å²	57.3	56%	0.562	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-87.6	-8.1	179.7	-55.9	-174.7	-175.4	-167.1	3.1	113.4	G669 A707 L708 K712	G669-R710 PolarHBondContact O-NH2 2.96Å; A707-R710 WeakPolarHBondContact O-CB 3.47Å; A707-R710 PolarHBondContact O-N 2.97Å; A707-R710 VanDerWaalsContact O-N 3.07Å; L708-R710 PolarHBondContact O-N 3.33Å; L708-R710 VanDerWaalsContact O-N 3.15Å; R710-K712 PolarHBondContact O-N 3.11Å
711	M	91.3	Very high	87.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.331	C	S	.	.			trans	-83.6	91.4	178.4	-69.6	179.5	170.5	0	0	110.8	L665 Q677 L680 E681 L684 L708 L714 K715	L665-M711 HydrophobicContact CD1-CE 4.11Å; L665-M711 HydrophobicContact CD2-CE 4.25Å; L665-M711 HydrophobicContact CG-CE 4.04Å; Q677-M711 HydrophobicContact CG-CE 3.74Å; Q677-M711 HydrophobicContact CG-CG 4.15Å; L680-M711 HydrophobicContact CB-CE 4.03Å; E681-M711 HydrophobicContact CB-CG 4.36Å; E681-M711 HydrophobicContact CB-SD 4.2Å; E681-M711 HydrophobicContact CG-CB 4.23Å; E681-M711 VanDerWaalsContact OE1-CA 3.26Å; E681-M711 WeakPolarHBondContact OE1-CA 3.16Å; E681-M711 WeakPolarHBondContact OE1-CB 3.32Å; L684-M711 HydrophobicContact CD1-SD 4.37Å; L708-M711 HydrophobicContact CD1-SD 4.08Å; L708-M711 PolarHBondContact O-N 3.11Å; M711-L714 HydrophobicContact CB-CB 3.89Å; M711-L714 HydrophobicContact CB-CD2 4.47Å; M711-L714 PolarHBondContact O-N 3.34Å; M711-L714 HydrophobicContact SD-CD2 4.12Å; M711-K715 WeakPolarHBondContact O-CB 3.25Å; M711-K715 PolarHBondContact O-N 3.32Å
712	K	90.2	Very high	86	Confident	151 Å²	151	69 Å²	69	66%	0.657	37%	0.368	S	S	*	.	H	α-helix	trans	-65.6	-40.7	-172.8	-64.8	-174.5	179	-175	0	113.9	E681 R710 K715 A716	E681-K712 PolarHBondContact OE1-N 2.98Å; E681-K712 VanDerWaalsContact OE1-N 3.08Å; R710-K712 PolarHBondContact O-N 3.11Å; K712-K715 WeakPolarHBondContact O-CB 3.4Å; K712-K715 PolarHBondContact O-N 2.92Å; K712-A716 PolarHBondContact O-N 3.08Å
713	R	90.9	Very high	85.7	Confident	179 Å²	179	71.8 Å²	71.8	68%	0.675	38%	0.383	S	S	*	.	H	α-helix	trans	-66.5	-41.1	177.7	-59.1	178.4	171.8	178	-1.3	110.2	E681 K715 A716 A717	E681-R713 HydrophobicContact CG-CB 3.98Å; E681-R713 VanDerWaalsContact OE1-CA 3.27Å; E681-R713 WeakPolarHBondContact OE1-CA 3.14Å; E681-R713 VanDerWaalsContact OE1-CB 3.24Å; E681-R713 WeakPolarHBondContact OE1-CB 3.49Å; E681-R713 PolarHBondContact OE1-N 3.16Å; R713-K715 VanDerWaalsContact C-N 3.35Å; R713-K715 PolarHBondContact O-N 3.42Å; R713-A716 WeakPolarHBondContact O-CB 3.49Å; R713-A716 PolarHBondContact O-N 3.38Å; R713-A717 PolarHBondContact O-N 2.84Å
714	L	92.5	Very high	85.6	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-63.7	-42.2	175.8	-171.3	60.2	0	0	0	111.6	E681 L684 C685 V698 M702 L708 M711 A716 A717 V718	E681-L714 HydrophobicContact CG-CB 4.18Å; E681-L714 PolarHBondContact OE1-N 3Å; L684-L714 HydrophobicContact CB-CD1 3.68Å; L684-L714 HydrophobicContact CB-CD2 3.9Å; L684-L714 HydrophobicContact CB-CG 4.44Å; L684-L714 HydrophobicContact CD1-CD2 3.8Å; L684-L714 HydrophobicContact CG-CD2 4.48Å; C685-L714 VanDerWaalsContact SG-CA 3.53Å; V698-L714 HydrophobicContact CG1-CD1 4.02Å; V698-L714 HydrophobicContact CG1-CD2 3.83Å; V698-L714 HydrophobicContact CG1-CG 3.94Å; M702-L714 HydrophobicContact SD-CD2 4.48Å; M702-L714 HydrophobicContact SD-CG 4.17Å; L708-L714 HydrophobicContact CD1-CD2 3.78Å; M711-L714 HydrophobicContact CB-CB 3.89Å; M711-L714 HydrophobicContact CB-CD2 4.47Å; M711-L714 PolarHBondContact O-N 3.34Å; M711-L714 HydrophobicContact SD-CD2 4.12Å; L714-A716 VanDerWaalsContact C-N 3.29Å; L714-A716 PolarHBondContact O-N 2.98Å; L714-A717 PolarHBondContact O-N 3.1Å; L714-A717 VanDerWaalsContact O-N 3.14Å; L714-V718 WeakPolarHBondContact O-CG2 3.34Å; L714-V718 PolarHBondContact O-N 3.29Å
715	K	90.9	Very high	85.7	Confident	38 Å²	38	65.6 Å²	65.6	17%	0.165	36%	0.357	C	S	.	.	H	α-helix	trans	-55.2	-45.6	175.1	-160.9	174.9	175.3	-172.2	0	111.5	M702 M711 K712 R713 V718 G719 L720 K721 D722	M702-K715 HydrophobicContact CE-CB 3.55Å; M702-K715 HydrophobicContact CE-CD 4.48Å; M702-K715 HydrophobicContact CE-CG 3.81Å; M711-K715 WeakPolarHBondContact O-CB 3.25Å; M711-K715 PolarHBondContact O-N 3.32Å; K712-K715 WeakPolarHBondContact O-CB 3.4Å; K712-K715 PolarHBondContact O-N 2.92Å; R713-K715 VanDerWaalsContact C-N 3.35Å; R713-K715 PolarHBondContact O-N 3.42Å; K715-V718 WeakPolarHBondContact O-CG2 3.45Å; K715-G719 PolarHBondContact O-N 2.79Å; K715-L720 HydrophobicContact CG-CB 3.58Å; K715-L720 PolarHBondContact O-N 3.04Å; K715-K721 WeakPolarHBondContact CE-O 3.24Å; K715-K721 PolarHBondContact NZ-O 3.1Å; K715-K721 VanDerWaalsContact NZ-O 3.1Å; K715-D722 VanDerWaalsContact NZ-CA 3.34Å; K715-D722 IonicContact NZ-OD1 3.22Å; K715-D722 PolarHBondContact NZ-OXT 3.33Å
716	A	89.6	Confident	85.9	Confident	71 Å²	71	67.8 Å²	67.8	59%	0.587	36%	0.362	S	S	*	.	H	α-helix	trans	-64.3	-45.9	175.2	0	0	0	0	0	112.2	K712 R713 L714 V718 G719	K712-A716 PolarHBondContact O-N 3.08Å; R713-A716 WeakPolarHBondContact O-CB 3.49Å; R713-A716 PolarHBondContact O-N 3.38Å; L714-A716 VanDerWaalsContact C-N 3.29Å; L714-A716 PolarHBondContact O-N 2.98Å; A716-V718 VanDerWaalsContact C-N 3.25Å; A716-V718 PolarHBondContact O-N 3Å; A716-G719 PolarHBondContact O-N 2.68Å
717	A	89	Confident	85.8	Confident	21 Å²	21	70 Å²	70	17%	0.174	36%	0.363	C	S	.	.	H	α-helix	trans	-61.2	-31.3	-179.9	0	0	0	0	0	113.3	C685 R713 L714	C685-A717 HydrophobicContact CB-CB 4.36Å; R713-A717 PolarHBondContact O-N 2.84Å; L714-A717 PolarHBondContact O-N 3.1Å; L714-A717 VanDerWaalsContact O-N 3.14Å
718	V	91.4	Very high	85.7	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.006	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-0.7	175.1	-57	0	0	0	0	114.1	A688 R695 V698 R699 M702 L714 K715 A716 L720	A688-V718 HydrophobicContact CB-CG1 4.12Å; R695-V718 HydrophobicContact CG-CB 4.3Å; R695-V718 HydrophobicContact CG-CG1 4.12Å; V698-V718 HydrophobicContact CB-CG1 4.04Å; V698-V718 HydrophobicContact CG1-CG1 3.75Å; R699-V718 HydrophobicContact CB-CB 4.13Å; R699-V718 HydrophobicContact CB-CG2 4.33Å; R699-V718 HydrophobicContact CG-CG2 4.47Å; R699-V718 VanDerWaalsContact CZ-O 3.24Å; R699-V718 PolarHBondContact NE-O 2.92Å; R699-V718 PolarHBondContact NH2-O 2.94Å; M702-V718 HydrophobicContact SD-CG2 3.6Å; M702-V718 VanDerWaalsContact SD-CG2 3.6Å; L714-V718 WeakPolarHBondContact O-CG2 3.34Å; L714-V718 PolarHBondContact O-N 3.29Å; K715-V718 WeakPolarHBondContact O-CG2 3.45Å; A716-V718 VanDerWaalsContact C-N 3.25Å; A716-V718 PolarHBondContact O-N 3Å; V718-L720 HydrophobicContact CG2-CB 4.45Å; V718-L720 HydrophobicContact CG2-CD1 3.84Å; V718-L720 HydrophobicContact CG2-CG 3.97Å
719	G	85.9	Confident	85.4	Confident	61 Å²	61	80 Å²	80	63%	0.629	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	30.7	175.3	0	0	0	0	0	114.9	K715 A716	K715-G719 PolarHBondContact O-N 2.79Å; A716-G719 PolarHBondContact O-N 2.68Å
720	L	84.6	Confident	85.4	Confident	44 Å²	44	83.7 Å²	83.7	23%	0.23	42%	0.422	C	S	.	.			trans	-95	134.2	170.6	-68.1	171.5	0	0	0	109.1	R699 M702 K715 V718	R699-L720 HydrophobicContact CG-CD1 4.15Å; R699-L720 HydrophobicContact CG-CD2 4.14Å; R699-L720 HydrophobicContact CG-CG 4.13Å; M702-L720 HydrophobicContact CB-CD1 3.76Å; M702-L720 HydrophobicContact SD-CD1 4.15Å; K715-L720 HydrophobicContact CG-CB 3.58Å; K715-L720 PolarHBondContact O-N 3.04Å; V718-L720 HydrophobicContact CG2-CB 4.45Å; V718-L720 HydrophobicContact CG2-CD1 3.84Å; V718-L720 HydrophobicContact CG2-CG 3.97Å
721	K	71.1	Confident	85.4	Confident	198 Å²	198	78.3 Å²	78.3	86%	0.861	41%	0.41	S	S	*	.			trans	-81.3	150.4	176.9	-67.8	-174.9	178.6	-177.5	0	110.8	K715	K715-K721 WeakPolarHBondContact CE-O 3.24Å; K715-K721 PolarHBondContact NZ-O 3.1Å; K715-K721 VanDerWaalsContact NZ-O 3.1Å
722	D	57.5	Low	84.9	Confident	175 Å²	175	85.4 Å²	85.4	94%	0.936	45%	0.447	S	S	*	.			trans	-55.4	0	-178.9	-91.3	-23	0	0	0	113.5	K715	K715-D722 VanDerWaalsContact NZ-CA 3.34Å; K715-D722 IonicContact NZ-OD1 3.22Å; K715-D722 PolarHBondContact NZ-OXT 3.33Å

Retrieved 722 of 722 residues in 347.5 ms (Link to these results)

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