A0A077Z552_TRITR Loading...

DNA repair protein RAD50

AlphaFold DB , UniProt , Accession A0A077Z552, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 574 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	34.7	Very low	48.4	Very low	244 Å²	244	137.1 Å²	137.1	100%	1.202	73%	0.728	S	S	*	*				0	127.3	0	-67.4	-166.3	168.4	0	0	106.5
2	P	39.8	Very low	50.3	Low	125 Å²	125	133.2 Å²	133.2	81%	0.812	71%	0.705	S	S	*	*			cis	-132.6	-166.1	40.5	39.4	-20.9	0	0	0	114.6
3	S	34.4	Very low	51.8	Low	103 Å²	103	131.8 Å²	131.8	72%	0.72	70%	0.698	S	S	*	*			trans	90.1	91.4	170.5	75	0	0	0	0	117.1	R5	S3-R5 PolarHBondContact O-N 3.18Å
4	G	38.6	Very low	53.1	Low	75 Å²	75	130.7 Å²	130.7	77%	0.773	69%	0.691	S	S	*	*			trans	-59.2	114.2	162.5	0	0	0	0	0	110	H6	G4-H6 PolarHBondContact O-N 3.48Å; G4-H6 VanDerWaalsContact O-N 3.16Å
5	R	45.3	Very low	54.3	Low	211 Å²	211	125.9 Å²	125.9	80%	0.796	68%	0.678	S	S	*	*			trans	-77.1	97.7	165.6	-69.6	-175.1	-169.1	-178	3.1	107.2	S3 W7	S3-R5 PolarHBondContact O-N 3.18Å; R5-W7 VanDerWaalsContact C-N 3.27Å; R5-W7 VanDerWaalsContact O-CD1 3.28Å; R5-W7 PolarHBondContact O-N 2.85Å
6	H	44.7	Very low	55.6	Low	184 Å²	184	124.5 Å²	124.5	85%	0.852	67%	0.668	S	S	*	*			trans	-57.8	96.3	156.7	-85.4	-76.7	0	0	0	107.6	G4 T8	G4-H6 PolarHBondContact O-N 3.48Å; G4-H6 VanDerWaalsContact O-N 3.16Å; H6-T8 PolarHBondContact O-N 3.09Å
7	W	45.1	Very low	56.5	Low	180 Å²	180	125.5 Å²	125.5	68%	0.682	67%	0.666	S	S	*	*			trans	-62.5	110.2	162.6	-70.2	70.8	0	0	0	105.8	R5 A11 I12	R5-W7 VanDerWaalsContact C-N 3.27Å; R5-W7 VanDerWaalsContact O-CD1 3.28Å; R5-W7 PolarHBondContact O-N 2.85Å; W7-A11 HydrophobicContact CE3-CB 3.82Å; W7-A11 HydrophobicContact CZ3-CB 4.48Å; W7-I12 HydrophobicContact CB-CD1 4.43Å; W7-I12 HydrophobicContact CB-CG1 4.28Å
8	T	55.4	Low	57.3	Low	97 Å²	97	128.9 Å²	128.9	60%	0.595	67%	0.668	S	S	*	*			trans	-57.2	143.9	176.8	49.8	0	0	0	0	108.5	H6 S10 A11	H6-T8 PolarHBondContact O-N 3.09Å; T8-S10 PolarHBondContact O-N 3.31Å; T8-A11 PolarHBondContact O-N 2.95Å
9	K	61	Low	58	Low	185 Å²	185	125.3 Å²	125.3	80%	0.804	66%	0.659	S	S	*	*	H	α-helix	trans	-45.1	-31.1	179.7	-81.2	179.7	174.1	178.6	0	113.1	L13	K9-L13 WeakPolarHBondContact O-CB 3.33Å; K9-L13 PolarHBondContact O-N 3.35Å; K9-L13 VanDerWaalsContact O-N 3.09Å
10	S	64.3	Low	58.8	Low	73 Å²	73	126.1 Å²	126.1	51%	0.51	66%	0.657	S	S	.	*	H	α-helix	trans	-61.5	-42.9	175.5	-179.3	0	0	0	0	114	T8 I12 L13 L14	T8-S10 PolarHBondContact O-N 3.31Å; S10-I12 PolarHBondContact O-N 2.89Å; S10-L13 PolarHBondContact O-N 2.99Å; S10-L14 WeakPolarHBondContact O-CB 3.36Å; S10-L14 PolarHBondContact O-N 3.34Å
11	A	68.8	Low	59.3	Low	31 Å²	31	124 Å²	124	26%	0.256	65%	0.647	S	S	.	*	H	α-helix	trans	-69.4	-34.7	-178.4	0	0	0	0	0	112.5	W7 T8 A15	W7-A11 HydrophobicContact CE3-CB 3.82Å; W7-A11 HydrophobicContact CZ3-CB 4.48Å; T8-A11 PolarHBondContact O-N 2.95Å; A11-A15 PolarHBondContact O-N 3.26Å; A11-A15 VanDerWaalsContact O-N 3.11Å
12	I	71.9	Confident	61.1	Low	90 Å²	90	116.3 Å²	116.3	46%	0.462	61%	0.61	S	S	.	*	H	α-helix	trans	-69.8	-42.6	174.2	-61.2	173.4	0	0	0	110.2	W7 S10 L14 A15 I16	W7-I12 HydrophobicContact CB-CD1 4.43Å; W7-I12 HydrophobicContact CB-CG1 4.28Å; S10-I12 PolarHBondContact O-N 2.89Å; I12-L14 PolarHBondContact O-N 3.25Å; I12-A15 PolarHBondContact O-N 2.62Å; I12-I16 HydrophobicContact CG2-CD1 3.85Å; I12-I16 HydrophobicContact CG2-CG1 4.48Å; I12-I16 VanDerWaalsContact O-CG1 3.31Å; I12-I16 WeakPolarHBondContact O-CG1 3.38Å; I12-I16 PolarHBondContact O-N 2.86Å
13	L	69.8	Low	62.8	Low	116 Å²	116	113.1 Å²	113.1	61%	0.607	59%	0.594	S	S	*	*	H	α-helix	trans	-60.6	-43.7	175.3	-97.4	154.3	0	0	0	112.2	K9 S10 I16 F17	K9-L13 WeakPolarHBondContact O-CB 3.33Å; K9-L13 PolarHBondContact O-N 3.35Å; K9-L13 VanDerWaalsContact O-N 3.09Å; S10-L13 PolarHBondContact O-N 2.99Å; L13-I16 PolarHBondContact O-N 2.99Å; L13-F17 VanDerWaalsContact O-CB 3.28Å; L13-F17 WeakPolarHBondContact O-CB 3.28Å; L13-F17 PolarHBondContact O-N 3.32Å
14	L	69.9	Low	64.6	Low	116 Å²	116	112.8 Å²	112.8	61%	0.607	58%	0.584	S	S	*	*	H	α-helix	trans	-62.3	-42.2	176	-95.8	148.4	0	0	0	112.4	S10 I12 F17 W18	S10-L14 WeakPolarHBondContact O-CB 3.36Å; S10-L14 PolarHBondContact O-N 3.34Å; I12-L14 PolarHBondContact O-N 3.25Å; L14-F17 PolarHBondContact O-N 2.72Å; L14-W18 VanDerWaalsContact O-CB 3.29Å; L14-W18 WeakPolarHBondContact O-CB 3.43Å; L14-W18 PolarHBondContact O-N 2.85Å
15	A	71.6	Confident	66.3	Low	59 Å²	59	116.3 Å²	116.3	49%	0.488	58%	0.579	S	S	.	*	H	α-helix	trans	-66	-41.4	177.2	0	0	0	0	0	112.3	A11 I12 W18 A19	A11-A15 PolarHBondContact O-N 3.26Å; A11-A15 VanDerWaalsContact O-N 3.11Å; I12-A15 PolarHBondContact O-N 2.62Å; A15-W18 PolarHBondContact O-N 3.34Å; A15-A19 WeakPolarHBondContact O-CB 3.47Å; A15-A19 PolarHBondContact O-N 3.07Å
16	I	73.8	Confident	67.9	Low	103 Å²	103	110.1 Å²	110.1	53%	0.528	56%	0.564	S	S	.	*	H	α-helix	trans	-65	-44.4	175.3	-66.7	168.3	0	0	0	110.2	I12 L13 W18 A19 F20	I12-I16 HydrophobicContact CG2-CD1 3.85Å; I12-I16 HydrophobicContact CG2-CG1 4.48Å; I12-I16 VanDerWaalsContact O-CG1 3.31Å; I12-I16 WeakPolarHBondContact O-CG1 3.38Å; I12-I16 PolarHBondContact O-N 2.86Å; L13-I16 PolarHBondContact O-N 2.99Å; I16-W18 VanDerWaalsContact C-N 3.35Å; I16-W18 PolarHBondContact O-N 3.01Å; I16-A19 PolarHBondContact O-N 2.83Å; I16-F20 VanDerWaalsContact O-CB 3.3Å; I16-F20 WeakPolarHBondContact O-CB 3.28Å; I16-F20 PolarHBondContact O-N 3.12Å
17	F	70.8	Confident	69.4	Low	141 Å²	141	108.1 Å²	108.1	62%	0.618	55%	0.553	S	S	*	*	H	α-helix	trans	-64	-40.6	179.6	-155.9	-95.1	0	0	0	111.7	L13 L14 N21	L13-F17 VanDerWaalsContact O-CB 3.28Å; L13-F17 WeakPolarHBondContact O-CB 3.28Å; L13-F17 PolarHBondContact O-N 3.32Å; L14-F17 PolarHBondContact O-N 2.72Å; F17-N21 WeakPolarHBondContact CE1-ND2 3.39Å; F17-N21 WeakPolarHBondContact O-CB 3.46Å; F17-N21 PolarHBondContact O-N 2.88Å
18	W	71.3	Confident	70.7	Confident	187 Å²	187	102.3 Å²	102.3	71%	0.708	54%	0.543	S	S	*	.	H	α-helix	trans	-67.9	-42.9	176.9	-158.1	72.1	0	0	0	112.1	L14 A15 I16 N22	L14-W18 VanDerWaalsContact O-CB 3.29Å; L14-W18 WeakPolarHBondContact O-CB 3.43Å; L14-W18 PolarHBondContact O-N 2.85Å; A15-W18 PolarHBondContact O-N 3.34Å; I16-W18 VanDerWaalsContact C-N 3.35Å; I16-W18 PolarHBondContact O-N 3.01Å; W18-N22 WeakPolarHBondContact O-CB 3.4Å; W18-N22 PolarHBondContact O-N 2.79Å
19	A	71.8	Confident	71.8	Confident	60 Å²	60	105.6 Å²	105.6	50%	0.496	55%	0.545	S	S	.	.	H	α-helix	trans	-65.1	-40.4	175.6	0	0	0	0	0	112.5	A15 I16 N22 A23	A15-A19 WeakPolarHBondContact O-CB 3.47Å; A15-A19 PolarHBondContact O-N 3.07Å; I16-A19 PolarHBondContact O-N 2.83Å; A19-N22 PolarHBondContact O-N 3.36Å; A19-A23 WeakPolarHBondContact O-CB 3.47Å; A19-A23 PolarHBondContact O-N 3.35Å
20	F	73.5	Confident	72.6	Confident	142 Å²	142	102.1 Å²	102.1	62%	0.623	53%	0.531	S	S	*	.	H	α-helix	trans	-68.5	-42.4	178.6	-153.3	-96.8	0	0	0	111.6	I16 A23 L24	I16-F20 VanDerWaalsContact O-CB 3.3Å; I16-F20 WeakPolarHBondContact O-CB 3.28Å; I16-F20 PolarHBondContact O-N 3.12Å; F20-A23 PolarHBondContact O-N 3.24Å; F20-L24 HydrophobicContact CD1-CD1 3.63Å; F20-L24 HydrophobicContact CE1-CD1 3.69Å; F20-L24 WeakPolarHBondContact O-CB 3.28Å; F20-L24 PolarHBondContact O-N 3.48Å
21	N	68.3	Low	73.3	Confident	83 Å²	83	103.7 Å²	103.7	44%	0.444	53%	0.534	S	S	.	.	H	α-helix	trans	-64.2	-41.5	174.4	-91.6	-10.8	0	0	0	112.2	F17 L24 F25	F17-N21 WeakPolarHBondContact CE1-ND2 3.39Å; F17-N21 WeakPolarHBondContact O-CB 3.46Å; F17-N21 PolarHBondContact O-N 2.88Å; N21-L24 PolarHBondContact O-N 3.46Å; N21-F25 WeakPolarHBondContact O-CB 3.35Å; N21-F25 PolarHBondContact O-N 2.85Å
22	N	73.9	Confident	73.8	Confident	81 Å²	81	109 Å²	109	43%	0.433	55%	0.552	S	S	.	*	H	α-helix	trans	-64.6	-41.7	176.7	-112.9	-2.1	0	0	0	111.9	W18 A19 L24 F25 V26	W18-N22 WeakPolarHBondContact O-CB 3.4Å; W18-N22 PolarHBondContact O-N 2.79Å; A19-N22 PolarHBondContact O-N 3.36Å; N22-L24 PolarHBondContact O-N 2.78Å; N22-F25 PolarHBondContact O-N 3.41Å; N22-V26 VanDerWaalsContact O-CG2 3.3Å; N22-V26 WeakPolarHBondContact O-CG2 3.38Å; N22-V26 PolarHBondContact O-N 3.36Å
23	A	73.9	Confident	74.1	Confident	58 Å²	58	108.7 Å²	108.7	48%	0.479	55%	0.551	S	S	.	*	H	α-helix	trans	-64.3	-39.3	176.9	0	0	0	0	0	112.4	A19 F20 K27	A19-A23 WeakPolarHBondContact O-CB 3.47Å; A19-A23 PolarHBondContact O-N 3.35Å; F20-A23 PolarHBondContact O-N 3.24Å; A23-K27 PolarHBondContact O-N 3.07Å; A23-K27 VanDerWaalsContact O-N 3.09Å
24	L	73.8	Confident	74.6	Confident	97 Å²	97	108 Å²	108	51%	0.508	55%	0.547	S	S	.	.	H	α-helix	trans	-63.7	-42.1	172.4	-91.6	158.5	0	0	0	111.8	F20 N21 N22 K27 A28	F20-L24 HydrophobicContact CD1-CD1 3.63Å; F20-L24 HydrophobicContact CE1-CD1 3.69Å; F20-L24 WeakPolarHBondContact O-CB 3.28Å; F20-L24 PolarHBondContact O-N 3.48Å; N21-L24 PolarHBondContact O-N 3.46Å; N22-L24 PolarHBondContact O-N 2.78Å; L24-K27 PolarHBondContact O-N 2.96Å; L24-A28 WeakPolarHBondContact O-CB 3.22Å; L24-A28 PolarHBondContact O-N 2.7Å
25	F	74.4	Confident	74.9	Confident	149 Å²	149	107.8 Å²	107.8	65%	0.654	55%	0.546	S	S	*	.	H	α-helix	trans	-67.6	-39.7	-179.5	-142.7	-87.7	0	0	0	112.1	N21 N22 A28 R29	N21-F25 WeakPolarHBondContact O-CB 3.35Å; N21-F25 PolarHBondContact O-N 2.85Å; N22-F25 PolarHBondContact O-N 3.41Å; F25-A28 PolarHBondContact O-N 3.04Å; F25-R29 WeakPolarHBondContact O-CB 3.2Å; F25-R29 PolarHBondContact O-N 3.42Å
26	V	77.9	Confident	75.4	Confident	81 Å²	81	107.6 Å²	107.6	49%	0.491	54%	0.541	S	S	.	.	H	α-helix	trans	-65.2	-46.3	175.4	172.8	0	0	0	0	110.7	N22 A28 R29 E30	N22-V26 VanDerWaalsContact O-CG2 3.3Å; N22-V26 WeakPolarHBondContact O-CG2 3.38Å; N22-V26 PolarHBondContact O-N 3.36Å; V26-A28 VanDerWaalsContact C-N 3.33Å; V26-A28 PolarHBondContact O-N 3.19Å; V26-R29 WeakPolarHBondContact O-CB 3.26Å; V26-R29 PolarHBondContact O-N 2.81Å; V26-E30 WeakPolarHBondContact O-CG 3.37Å; V26-E30 PolarHBondContact O-N 3.48Å
27	K	75.3	Confident	75.7	Confident	142 Å²	142	107.2 Å²	107.2	62%	0.617	54%	0.54	S	S	*	.	H	α-helix	trans	-61.4	-39.2	174.4	-97.2	-177.8	174.3	179.1	0	113	A23 L24 R29 E30 N31	A23-K27 PolarHBondContact O-N 3.07Å; A23-K27 VanDerWaalsContact O-N 3.09Å; L24-K27 PolarHBondContact O-N 2.96Å; K27-R29 VanDerWaalsContact C-N 3.35Å; K27-E30 PolarHBondContact O-N 3.4Å; K27-N31 WeakPolarHBondContact O-CB 3.49Å; K27-N31 VanDerWaalsContact O-CG 3.28Å; K27-N31 PolarHBondContact O-N 3.42Å
28	A	74.1	Confident	76.1	Confident	58 Å²	58	105.1 Å²	105.1	48%	0.479	54%	0.535	S	S	.	.	H	α-helix	trans	-65.4	-39.4	176.6	0	0	0	0	0	111.7	L24 F25 V26 F32	L24-A28 WeakPolarHBondContact O-CB 3.22Å; L24-A28 PolarHBondContact O-N 2.7Å; F25-A28 PolarHBondContact O-N 3.04Å; V26-A28 VanDerWaalsContact C-N 3.33Å; V26-A28 PolarHBondContact O-N 3.19Å; A28-F32 WeakPolarHBondContact O-CB 3.14Å; A28-F32 PolarHBondContact O-N 2.82Å
29	R	76.9	Confident	76.6	Confident	166 Å²	166	100.2 Å²	100.2	63%	0.626	53%	0.526	S	S	*	.	H	α-helix	trans	-64.7	-44.6	175.2	-168.3	86.3	179.4	-159.2	1.7	111.7	F25 V26 K27 F32 N33	F25-R29 WeakPolarHBondContact O-CB 3.2Å; F25-R29 PolarHBondContact O-N 3.42Å; V26-R29 WeakPolarHBondContact O-CB 3.26Å; V26-R29 PolarHBondContact O-N 2.81Å; K27-R29 VanDerWaalsContact C-N 3.35Å; R29-F32 PolarHBondContact O-N 2.88Å; R29-N33 WeakPolarHBondContact O-CB 3.46Å; R29-N33 VanDerWaalsContact O-CG 3.31Å; R29-N33 PolarHBondContact O-N 2.77Å
30	E	78.3	Confident	77	Confident	112 Å²	112	103.5 Å²	103.5	52%	0.523	53%	0.531	S	S	.	.	H	α-helix	trans	-62.6	-45.4	176.3	-74.3	175.9	171.8	0	0	111.4	V26 K27 F32 N33 L34	V26-E30 WeakPolarHBondContact O-CG 3.37Å; V26-E30 PolarHBondContact O-N 3.48Å; K27-E30 PolarHBondContact O-N 3.4Å; E30-F32 PolarHBondContact O-N 3.04Å; E30-N33 PolarHBondContact O-N 3.48Å; E30-L34 WeakPolarHBondContact O-CG 3.28Å; E30-L34 PolarHBondContact O-N 2.9Å
31	N	78.5	Confident	77.2	Confident	106 Å²	106	100.5 Å²	100.5	57%	0.567	52%	0.524	S	S	*	.	H	α-helix	trans	-63	-39.6	175.7	-74.9	-9.4	0	0	0	112.4	K27 L34 L35	K27-N31 WeakPolarHBondContact O-CB 3.49Å; K27-N31 VanDerWaalsContact O-CG 3.28Å; K27-N31 PolarHBondContact O-N 3.42Å; N31-L34 PolarHBondContact O-N 2.82Å; N31-L35 WeakPolarHBondContact O-CB 3.19Å; N31-L35 PolarHBondContact O-N 2.75Å
32	F	80.6	Confident	77.7	Confident	143 Å²	143	100.9 Å²	100.9	63%	0.627	53%	0.529	S	S	*	.	H	α-helix	trans	-66.4	-41.4	177.5	-174.3	-93.6	0	0	0	111.8	A28 R29 E30 L35 S36	A28-F32 WeakPolarHBondContact O-CB 3.14Å; A28-F32 PolarHBondContact O-N 2.82Å; R29-F32 PolarHBondContact O-N 2.88Å; E30-F32 PolarHBondContact O-N 3.04Å; F32-L35 PolarHBondContact O-N 3.42Å; F32-S36 WeakPolarHBondContact O-CB 3.11Å; F32-S36 PolarHBondContact O-N 2.84Å
33	N	78.5	Confident	77.9	Confident	82 Å²	82	103.4 Å²	103.4	44%	0.439	54%	0.538	S	S	.	.	H	α-helix	trans	-66.4	-40.2	176.6	-72.3	-10	0	0	0	111.9	R29 E30 S36 N37	R29-N33 WeakPolarHBondContact O-CB 3.46Å; R29-N33 VanDerWaalsContact O-CG 3.31Å; R29-N33 PolarHBondContact O-N 2.77Å; E30-N33 PolarHBondContact O-N 3.48Å; N33-S36 PolarHBondContact O-N 3.42Å; N33-N37 PolarHBondContact O-N 2.93Å
34	L	78.9	Confident	78.2	Confident	102 Å²	102	104.9 Å²	104.9	53%	0.534	54%	0.542	S	S	.	.	H	α-helix	trans	-60.8	-45.9	173.1	-75.4	166.3	0	0	0	111.1	E30 N31 S36 N37 D38	E30-L34 WeakPolarHBondContact O-CG 3.28Å; E30-L34 PolarHBondContact O-N 2.9Å; N31-L34 PolarHBondContact O-N 2.82Å; L34-S36 VanDerWaalsContact C-N 3.34Å; L34-S36 PolarHBondContact O-N 3.3Å; L34-N37 PolarHBondContact O-N 3.39Å; L34-D38 VanDerWaalsContact O-CG 3.31Å; L34-D38 PolarHBondContact O-N 3.31Å
35	L	77.3	Confident	78.4	Confident	111 Å²	111	104.8 Å²	104.8	58%	0.581	54%	0.541	S	S	*	.	H	α-helix	trans	-65.5	-36.9	178.9	-152.6	78.9	0	0	0	112.3	N31 F32 D38 V39	N31-L35 WeakPolarHBondContact O-CB 3.19Å; N31-L35 PolarHBondContact O-N 2.75Å; F32-L35 PolarHBondContact O-N 3.42Å; L35-D38 PolarHBondContact O-N 3.22Å; L35-V39 VanDerWaalsContact O-CG2 3.28Å; L35-V39 WeakPolarHBondContact O-CG2 3.22Å; L35-V39 PolarHBondContact O-N 3.33Å
36	S	80.9	Confident	78.6	Confident	55 Å²	55	106.5 Å²	106.5	39%	0.385	54%	0.544	S	S	.	.	H	α-helix	trans	-65.4	-41.7	176.1	-167.8	0	0	0	0	111.6	F32 N33 L34 V39 E40	F32-S36 WeakPolarHBondContact O-CB 3.11Å; F32-S36 PolarHBondContact O-N 2.84Å; N33-S36 PolarHBondContact O-N 3.42Å; L34-S36 VanDerWaalsContact C-N 3.34Å; L34-S36 PolarHBondContact O-N 3.3Å; S36-V39 PolarHBondContact O-N 3.26Å; S36-E40 PolarHBondContact O-N 3.24Å; S36-E40 VanDerWaalsContact O-N 3.09Å
37	N	80	Confident	78.7	Confident	95 Å²	95	104.8 Å²	104.8	51%	0.508	54%	0.542	S	S	.	.	H	α-helix	trans	-66.4	-39.8	175	-72.8	-7.3	0	0	0	111.2	N33 L34 V39 E40 V41	N33-N37 PolarHBondContact O-N 2.93Å; L34-N37 PolarHBondContact O-N 3.39Å; N37-V39 VanDerWaalsContact C-N 3.3Å; N37-V39 PolarHBondContact O-N 3.21Å; N37-E40 PolarHBondContact O-N 3.44Å; N37-V41 VanDerWaalsContact O-CG2 3.3Å; N37-V41 WeakPolarHBondContact O-CG2 3.31Å; N37-V41 PolarHBondContact O-N 2.98Å
38	D	80.4	Confident	78.9	Confident	97 Å²	97	102.5 Å²	102.5	52%	0.519	54%	0.536	S	S	.	.	H	α-helix	trans	-62.6	-37.5	175.3	-71.4	-17.1	0	0	0	111.5	L34 L35 V41 V42	L34-D38 VanDerWaalsContact O-CG 3.31Å; L34-D38 PolarHBondContact O-N 3.31Å; L35-D38 PolarHBondContact O-N 3.22Å; D38-V41 PolarHBondContact O-N 2.96Å; D38-V42 WeakPolarHBondContact O-CB 3.46Å; D38-V42 WeakPolarHBondContact O-CG2 3.48Å; D38-V42 PolarHBondContact O-N 3.08Å
39	V	80.7	Confident	79.1	Confident	84 Å²	84	102.1 Å²	102.1	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-66.7	-43.2	175.9	170.4	0	0	0	0	111.8	L35 S36 N37 V41 V42 E43	L35-V39 VanDerWaalsContact O-CG2 3.28Å; L35-V39 WeakPolarHBondContact O-CG2 3.22Å; L35-V39 PolarHBondContact O-N 3.33Å; S36-V39 PolarHBondContact O-N 3.26Å; N37-V39 VanDerWaalsContact C-N 3.3Å; N37-V39 PolarHBondContact O-N 3.21Å; V39-V41 VanDerWaalsContact C-N 3.35Å; V39-V41 PolarHBondContact O-N 3.06Å; V39-V42 PolarHBondContact O-N 2.78Å; V39-E43 HydrophobicContact CG1-CG 4.49Å; V39-E43 WeakPolarHBondContact O-CG 3.47Å; V39-E43 PolarHBondContact O-N 3.21Å
40	E	80.2	Confident	79.2	Confident	129 Å²	129	96.9 Å²	96.9	60%	0.603	53%	0.525	S	S	*	.	H	α-helix	trans	-62.7	-40.4	174.3	-83.8	-173.5	160.1	0	0	112.2	S36 N37 V42 E43 T44	S36-E40 PolarHBondContact O-N 3.24Å; S36-E40 VanDerWaalsContact O-N 3.09Å; N37-E40 PolarHBondContact O-N 3.44Å; E40-V42 VanDerWaalsContact C-N 3.35Å; E40-E43 PolarHBondContact O-N 3.15Å; E40-T44 WeakPolarHBondContact O-CG2 3.38Å; E40-T44 PolarHBondContact O-N 3.42Å; E40-T44 PolarHBondContact O-OG1 2.75Å; E40-T44 VanDerWaalsContact O-OG1 3.13Å
41	V	78.9	Confident	79.2	Confident	79 Å²	79	97.1 Å²	97.1	48%	0.479	53%	0.528	S	S	.	.	H	α-helix	trans	-66	-38	175.2	174.5	0	0	0	0	111	N37 D38 V39 T44 L45	N37-V41 VanDerWaalsContact O-CG2 3.3Å; N37-V41 WeakPolarHBondContact O-CG2 3.31Å; N37-V41 PolarHBondContact O-N 2.98Å; D38-V41 PolarHBondContact O-N 2.96Å; V39-V41 VanDerWaalsContact C-N 3.35Å; V39-V41 PolarHBondContact O-N 3.06Å; V41-T44 WeakPolarHBondContact CA-OG1 3.45Å; V41-T44 PolarHBondContact O-OG1 3.29Å; V41-L45 HydrophobicContact CG1-CD1 3.76Å; V41-L45 HydrophobicContact CG1-CG 4.35Å; V41-L45 WeakPolarHBondContact O-CB 3.44Å; V41-L45 WeakPolarHBondContact O-CD1 3.48Å; V41-L45 WeakPolarHBondContact O-CG 3.23Å; V41-L45 PolarHBondContact O-N 3.26Å
42	V	78.1	Confident	79.3	Confident	92 Å²	92	96.5 Å²	96.5	56%	0.558	52%	0.524	S	S	*	.	H	α-helix	trans	-68.9	-39.4	175.9	169.9	0	0	0	0	111.7	D38 V39 E40 L45 R46	D38-V42 WeakPolarHBondContact O-CB 3.46Å; D38-V42 WeakPolarHBondContact O-CG2 3.48Å; D38-V42 PolarHBondContact O-N 3.08Å; V39-V42 PolarHBondContact O-N 2.78Å; E40-V42 VanDerWaalsContact C-N 3.35Å; V42-L45 PolarHBondContact O-N 3.49Å; V42-R46 WeakPolarHBondContact O-CB 3.44Å; V42-R46 PolarHBondContact O-N 2.9Å
43	E	78.4	Confident	79.4	Confident	133 Å²	133	93.4 Å²	93.4	62%	0.621	52%	0.52	S	S	*	.	H	α-helix	trans	-61.6	-43.2	175.7	-76.2	-114.6	136.9	0	0	111.7	V39 E40 R46	V39-E43 HydrophobicContact CG1-CG 4.49Å; V39-E43 WeakPolarHBondContact O-CG 3.47Å; V39-E43 PolarHBondContact O-N 3.21Å; E40-E43 PolarHBondContact O-N 3.15Å; E43-R46 WeakPolarHBondContact O-CB 3.38Å; E43-R46 PolarHBondContact O-N 3.49Å
44	T	80	Confident	79.5	Confident	90 Å²	90	96 Å²	96	55%	0.552	53%	0.531	S	S	*	.	H	α-helix	trans	-66.7	-44.8	175.7	52.1	0	0	0	0	112.1	E40 V41 R46 G47 D48	E40-T44 WeakPolarHBondContact O-CG2 3.38Å; E40-T44 PolarHBondContact O-N 3.42Å; E40-T44 PolarHBondContact O-OG1 2.75Å; E40-T44 VanDerWaalsContact O-OG1 3.13Å; V41-T44 WeakPolarHBondContact CA-OG1 3.45Å; V41-T44 PolarHBondContact O-OG1 3.29Å; T44-R46 PolarHBondContact O-N 2.92Å; T44-G47 PolarHBondContact O-N 3.39Å; T44-G47 VanDerWaalsContact O-N 3.15Å; T44-D48 PolarHBondContact O-N 2.82Å
45	L	77.9	Confident	79.6	Confident	95 Å²	95	96.2 Å²	96.2	50%	0.497	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-24.6	176.1	-71.5	168.6	0	0	0	113	V41 V42 G47 D48 A49	V41-L45 HydrophobicContact CG1-CD1 3.76Å; V41-L45 HydrophobicContact CG1-CG 4.35Å; V41-L45 WeakPolarHBondContact O-CB 3.44Å; V41-L45 WeakPolarHBondContact O-CD1 3.48Å; V41-L45 WeakPolarHBondContact O-CG 3.23Å; V41-L45 PolarHBondContact O-N 3.26Å; V42-L45 PolarHBondContact O-N 3.49Å; L45-G47 VanDerWaalsContact C-N 3.34Å; L45-D48 PolarHBondContact O-N 3.29Å; L45-A49 WeakPolarHBondContact O-CB 3.47Å; L45-A49 PolarHBondContact O-N 3.47Å
46	R	78.6	Confident	79.9	Confident	185 Å²	185	96.5 Å²	96.5	70%	0.698	53%	0.53	S	S	*	.	H	α-helix	trans	-67	-36.7	175.8	-159.8	178.7	-173.7	-172.8	2.1	111.7	V42 E43 T44 A50	V42-R46 WeakPolarHBondContact O-CB 3.44Å; V42-R46 PolarHBondContact O-N 2.9Å; E43-R46 WeakPolarHBondContact O-CB 3.38Å; E43-R46 PolarHBondContact O-N 3.49Å; T44-R46 PolarHBondContact O-N 2.92Å; R46-A50 WeakPolarHBondContact O-CB 3.34Å; R46-A50 PolarHBondContact O-N 2.88Å
47	G	79.3	Confident	79.9	Confident	44 Å²	44	98.8 Å²	98.8	45%	0.454	54%	0.535	S	S	.	.	H	α-helix	trans	-63.4	-47.9	171.5	0	0	0	0	0	111.8	T44 L45 A50 M51	T44-G47 PolarHBondContact O-N 3.39Å; T44-G47 VanDerWaalsContact O-N 3.15Å; L45-G47 VanDerWaalsContact C-N 3.34Å; G47-A50 PolarHBondContact O-N 3.22Å; G47-M51 PolarHBondContact O-N 2.76Å
48	D	79.7	Confident	79.9	Confident	94 Å²	94	95.8 Å²	95.8	50%	0.503	53%	0.526	S	S	.	.	H	α-helix	trans	-65.6	-41.9	178.9	-69.4	-17.3	0	0	0	112.2	T44 L45 A50 M51 I52	T44-D48 PolarHBondContact O-N 2.82Å; L45-D48 PolarHBondContact O-N 3.29Å; D48-A50 PolarHBondContact O-N 3.43Å; D48-M51 PolarHBondContact O-N 3.4Å; D48-I52 VanDerWaalsContact O-CG1 3.3Å; D48-I52 WeakPolarHBondContact O-CG1 3.37Å; D48-I52 PolarHBondContact O-N 3.44Å
49	A	78.9	Confident	80	Confident	50 Å²	50	95.3 Å²	95.3	41%	0.413	52%	0.522	S	S	.	.	H	α-helix	trans	-62.9	-41.7	176.5	0	0	0	0	0	111.8	L45 M51 I52 S53	L45-A49 WeakPolarHBondContact O-CB 3.47Å; L45-A49 PolarHBondContact O-N 3.47Å; A49-M51 VanDerWaalsContact C-N 3.31Å; A49-M51 PolarHBondContact O-N 2.86Å; A49-I52 PolarHBondContact O-N 2.9Å; A49-S53 WeakPolarHBondContact O-CB 3.26Å; A49-S53 PolarHBondContact O-N 3.35Å; A49-S53 PolarHBondContact O-OG 2.88Å
50	A	79	Confident	80	Confident	56 Å²	56	94.5 Å²	94.5	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-61.9	-40.7	174.2	0	0	0	0	0	111.5	R46 G47 D48 S53 M54	R46-A50 WeakPolarHBondContact O-CB 3.34Å; R46-A50 PolarHBondContact O-N 2.88Å; G47-A50 PolarHBondContact O-N 3.22Å; D48-A50 PolarHBondContact O-N 3.43Å; A50-S53 PolarHBondContact O-N 2.79Å; A50-M54 WeakPolarHBondContact O-CG 3.45Å; A50-M54 PolarHBondContact O-N 2.78Å
51	M	78.9	Confident	80	Confident	118 Å²	118	93.3 Å²	93.3	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-66.8	-42.7	176.3	-160.8	175.1	-146.5	0	0	112.1	G47 D48 A49 M54 L55	G47-M51 PolarHBondContact O-N 2.76Å; D48-M51 PolarHBondContact O-N 3.4Å; A49-M51 VanDerWaalsContact C-N 3.31Å; A49-M51 PolarHBondContact O-N 2.86Å; M51-M54 PolarHBondContact O-N 2.89Å; M51-L55 HydrophobicContact CG-CD1 4.38Å; M51-L55 WeakPolarHBondContact O-CB 3.45Å; M51-L55 VanDerWaalsContact O-CG 3.3Å; M51-L55 WeakPolarHBondContact O-CG 3.4Å; M51-L55 PolarHBondContact O-N 2.97Å
52	I	80.7	Confident	80	Confident	93 Å²	93	94.7 Å²	94.7	48%	0.477	52%	0.515	S	S	.	.	H	α-helix	trans	-63.8	-40.3	176.1	-69	167.7	0	0	0	111.2	D48 A49 L55 H56	D48-I52 VanDerWaalsContact O-CG1 3.3Å; D48-I52 WeakPolarHBondContact O-CG1 3.37Å; D48-I52 PolarHBondContact O-N 3.44Å; A49-I52 PolarHBondContact O-N 2.9Å; I52-L55 PolarHBondContact O-N 2.91Å; I52-H56 WeakPolarHBondContact O-CB 3.41Å; I52-H56 PolarHBondContact O-N 3.38Å; I52-H56 PolarHBondContact O-ND1 3.39Å; I52-H56 VanDerWaalsContact O-ND1 3.16Å
53	S	81.4	Confident	80	Confident	77 Å²	77	96 Å²	96	54%	0.538	52%	0.515	S	S	.	.	H	α-helix	trans	-64.1	-44.1	174.6	-71.2	0	0	0	0	111.7	A49 A50 L55 H56 E57	A49-S53 WeakPolarHBondContact O-CB 3.26Å; A49-S53 PolarHBondContact O-N 3.35Å; A49-S53 PolarHBondContact O-OG 2.88Å; A50-S53 PolarHBondContact O-N 2.79Å; S53-L55 VanDerWaalsContact C-N 3.33Å; S53-L55 PolarHBondContact O-N 3.45Å; S53-H56 PolarHBondContact O-N 3.36Å; S53-E57 WeakPolarHBondContact O-CB 3.27Å; S53-E57 PolarHBondContact O-N 2.89Å
54	M	81.2	Confident	80	Confident	138 Å²	138	96 Å²	96	68%	0.68	52%	0.515	S	S	*	.	H	α-helix	trans	-62.6	-38.6	174.2	-71.6	-151.6	-52	0	0	112.3	A50 M51 G58	A50-M54 WeakPolarHBondContact O-CG 3.45Å; A50-M54 PolarHBondContact O-N 2.78Å; M51-M54 PolarHBondContact O-N 2.89Å; M54-G58 PolarHBondContact O-N 2.82Å
55	L	81.3	Confident	79.9	Confident	106 Å²	106	96.4 Å²	96.4	56%	0.555	51%	0.514	S	S	*	.	H	α-helix	trans	-69.6	-40.1	176.7	-72.2	171.2	0	0	0	112.2	M51 I52 S53 G58 I59	M51-L55 HydrophobicContact CG-CD1 4.38Å; M51-L55 WeakPolarHBondContact O-CB 3.45Å; M51-L55 VanDerWaalsContact O-CG 3.3Å; M51-L55 WeakPolarHBondContact O-CG 3.4Å; M51-L55 PolarHBondContact O-N 2.97Å; I52-L55 PolarHBondContact O-N 2.91Å; S53-L55 VanDerWaalsContact C-N 3.33Å; S53-L55 PolarHBondContact O-N 3.45Å; L55-G58 PolarHBondContact O-N 2.84Å; L55-I59 VanDerWaalsContact O-CG1 3.26Å; L55-I59 WeakPolarHBondContact O-CG1 3.18Å; L55-I59 PolarHBondContact O-N 3.49Å
56	H	82.7	Confident	79.7	Confident	116 Å²	116	95.7 Å²	95.7	54%	0.537	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-41.6	173.1	-91.2	82.7	0	0	0	111.8	I52 S53 G58 I59 T60	I52-H56 WeakPolarHBondContact O-CB 3.41Å; I52-H56 PolarHBondContact O-N 3.38Å; I52-H56 PolarHBondContact O-ND1 3.39Å; I52-H56 VanDerWaalsContact O-ND1 3.16Å; S53-H56 PolarHBondContact O-N 3.36Å; H56-G58 VanDerWaalsContact C-N 3.29Å; H56-G58 PolarHBondContact O-N 3.33Å; H56-I59 PolarHBondContact O-N 2.89Å; H56-T60 WeakPolarHBondContact O-CB 3.35Å; H56-T60 WeakPolarHBondContact O-CG2 3.22Å; H56-T60 PolarHBondContact O-N 3.46Å; H56-T60 PolarHBondContact O-OG1 2.89Å
57	E	81.4	Confident	79.5	Confident	104 Å²	104	90.4 Å²	90.4	49%	0.486	50%	0.501	S	S	.	.	H	α-helix	trans	-65.8	-34.9	174.9	-160.5	-179.5	155.6	0	0	111.4	S53 T60 K61	S53-E57 WeakPolarHBondContact O-CB 3.27Å; S53-E57 PolarHBondContact O-N 2.89Å; E57-T60 VanDerWaalsContact CA-OG1 3.31Å; E57-T60 WeakPolarHBondContact CA-OG1 3.3Å; E57-T60 PolarHBondContact O-OG1 3.04Å; E57-K61 WeakPolarHBondContact O-CB 3.38Å; E57-K61 VanDerWaalsContact O-CG 3.26Å; E57-K61 WeakPolarHBondContact O-CG 3.28Å; E57-K61 PolarHBondContact O-N 3.41Å; E57-K61 VanDerWaalsContact O-N 3.15Å; E57-K61 WeakPolarHBondContact OE1-CE 3.39Å; E57-K61 IonicContact OE1-NZ 2.72Å; E57-K61 PolarHBondContact OE1-NZ 3.29Å
58	G	80.8	Confident	79.3	Confident	31 Å²	31	91.4 Å²	91.4	32%	0.32	50%	0.499	S	S	.	.	H	α-helix	trans	-64.8	-45.5	171.1	0	0	0	0	0	113.4	M54 L55 H56 L62	M54-G58 PolarHBondContact O-N 2.82Å; L55-G58 PolarHBondContact O-N 2.84Å; H56-G58 VanDerWaalsContact C-N 3.29Å; H56-G58 PolarHBondContact O-N 3.33Å; G58-L62 WeakPolarHBondContact O-CB 3.18Å; G58-L62 WeakPolarHBondContact O-CG 3.06Å; G58-L62 PolarHBondContact O-N 3.21Å
59	I	81.7	Confident	78.6	Confident	87 Å²	87	89.1 Å²	89.1	45%	0.446	49%	0.493	S	S	.	.	H	α-helix	trans	-65.7	-45.8	179.4	-70.5	165.3	0	0	0	110.6	L55 H56 K61 L62 E63	L55-I59 VanDerWaalsContact O-CG1 3.26Å; L55-I59 WeakPolarHBondContact O-CG1 3.18Å; L55-I59 PolarHBondContact O-N 3.49Å; H56-I59 PolarHBondContact O-N 2.89Å; I59-K61 PolarHBondContact O-N 2.87Å; I59-L62 CarbonylContact O-C 3.57Å; I59-L62 WeakPolarHBondContact O-CA 3.41Å; I59-L62 WeakPolarHBondContact O-CB 3.28Å; I59-L62 PolarHBondContact O-N 3.12Å; I59-L62 VanDerWaalsContact O-N 3.1Å; I59-E63 HydrophobicContact CG2-CG 4.3Å; I59-E63 WeakPolarHBondContact O-CG 3.38Å; I59-E63 PolarHBondContact O-N 3.48Å
60	T	81.6	Confident	78	Confident	67 Å²	67	95.2 Å²	95.2	41%	0.411	51%	0.505	S	S	.	.	H	α-helix	trans	-61.3	-43.2	177.9	47.1	0	0	0	0	112	H56 E57 L62 E63 E64	H56-T60 WeakPolarHBondContact O-CB 3.35Å; H56-T60 WeakPolarHBondContact O-CG2 3.22Å; H56-T60 PolarHBondContact O-N 3.46Å; H56-T60 PolarHBondContact O-OG1 2.89Å; E57-T60 VanDerWaalsContact CA-OG1 3.31Å; E57-T60 WeakPolarHBondContact CA-OG1 3.3Å; E57-T60 PolarHBondContact O-OG1 3.04Å; T60-L62 VanDerWaalsContact C-N 3.32Å; T60-L62 PolarHBondContact O-N 2.97Å; T60-E63 PolarHBondContact O-N 2.75Å; T60-E64 PolarHBondContact O-N 2.72Å
61	K	79.9	Confident	77.5	Confident	105 Å²	105	97.5 Å²	97.5	46%	0.457	51%	0.509	S	S	.	.	H	α-helix	trans	-61.8	-38.9	172.5	-74.3	172.6	-174.6	164.3	0	112.2	E57 I59 N65	E57-K61 WeakPolarHBondContact O-CB 3.38Å; E57-K61 VanDerWaalsContact O-CG 3.26Å; E57-K61 WeakPolarHBondContact O-CG 3.28Å; E57-K61 PolarHBondContact O-N 3.41Å; E57-K61 VanDerWaalsContact O-N 3.15Å; E57-K61 WeakPolarHBondContact OE1-CE 3.39Å; E57-K61 IonicContact OE1-NZ 2.72Å; E57-K61 PolarHBondContact OE1-NZ 3.29Å; I59-K61 PolarHBondContact O-N 2.87Å; K61-N65 WeakPolarHBondContact O-CB 3.43Å; K61-N65 PolarHBondContact O-N 3.32Å; K61-N65 PolarHBondContact O-ND2 3.47Å; K61-N65 VanDerWaalsContact O-ND2 3.13Å
62	L	77.8	Confident	76.8	Confident	108 Å²	108	98.8 Å²	98.8	57%	0.565	51%	0.512	S	S	*	.	H	α-helix	trans	-68.2	-39.2	175.7	-83.9	160.4	0	0	0	112.3	G58 I59 T60 N65 V66	G58-L62 WeakPolarHBondContact O-CB 3.18Å; G58-L62 WeakPolarHBondContact O-CG 3.06Å; G58-L62 PolarHBondContact O-N 3.21Å; I59-L62 CarbonylContact O-C 3.57Å; I59-L62 WeakPolarHBondContact O-CA 3.41Å; I59-L62 WeakPolarHBondContact O-CB 3.28Å; I59-L62 PolarHBondContact O-N 3.12Å; I59-L62 VanDerWaalsContact O-N 3.1Å; T60-L62 VanDerWaalsContact C-N 3.32Å; T60-L62 PolarHBondContact O-N 2.97Å; L62-N65 CarbonylContact O-C 3.44Å; L62-N65 PolarHBondContact O-N 2.89Å; L62-V66 WeakPolarHBondContact O-CB 3.5Å; L62-V66 WeakPolarHBondContact O-CG2 3.4Å; L62-V66 PolarHBondContact O-N 3Å
63	E	78.1	Confident	75.7	Confident	120 Å²	120	101 Å²	101	56%	0.561	52%	0.524	S	S	*	.	H	α-helix	trans	-65.9	-40.6	174.9	-74.3	-179.6	162.8	0	0	111.9	I59 T60 N65 V66 T67	I59-E63 HydrophobicContact CG2-CG 4.3Å; I59-E63 WeakPolarHBondContact O-CG 3.38Å; I59-E63 PolarHBondContact O-N 3.48Å; T60-E63 PolarHBondContact O-N 2.75Å; E63-N65 VanDerWaalsContact C-N 3.35Å; E63-V66 PolarHBondContact O-N 3.48Å; E63-T67 WeakPolarHBondContact O-CB 3.46Å; E63-T67 VanDerWaalsContact O-CG2 3.29Å; E63-T67 WeakPolarHBondContact O-CG2 3.41Å; E63-T67 PolarHBondContact O-N 2.89Å; E63-T67 PolarHBondContact O-OG1 3.43Å
64	E	78.7	Confident	74.4	Confident	133 Å²	133	107.3 Å²	107.3	62%	0.621	54%	0.536	S	S	*	.	H	α-helix	trans	-61.1	-42.3	169.5	-83.6	-169.7	150.5	0	0	111.7	T60 V66 T67 T68	T60-E64 PolarHBondContact O-N 2.72Å; E64-V66 PolarHBondContact O-N 3.27Å; E64-T67 VanDerWaalsContact CA-OG1 3.29Å; E64-T67 WeakPolarHBondContact CA-OG1 3.34Å; E64-T67 PolarHBondContact O-N 2.94Å; E64-T67 PolarHBondContact O-OG1 3.48Å; E64-T68 WeakPolarHBondContact O-CB 3.29Å; E64-T68 VanDerWaalsContact O-CG2 3.28Å; E64-T68 WeakPolarHBondContact O-CG2 3.27Å; E64-T68 PolarHBondContact O-N 2.96Å; E64-T68 PolarHBondContact O-OG1 2.81Å
65	N	77.8	Confident	73.2	Confident	98 Å²	98	104.9 Å²	104.9	52%	0.524	53%	0.532	S	S	.	.	H	α-helix	trans	-66.5	-37.9	176.7	-72.5	-26	0	0	0	112.2	K61 L62 E63 T68 A69	K61-N65 WeakPolarHBondContact O-CB 3.43Å; K61-N65 PolarHBondContact O-N 3.32Å; K61-N65 PolarHBondContact O-ND2 3.47Å; K61-N65 VanDerWaalsContact O-ND2 3.13Å; L62-N65 CarbonylContact O-C 3.44Å; L62-N65 PolarHBondContact O-N 2.89Å; E63-N65 VanDerWaalsContact C-N 3.35Å; N65-T68 WeakPolarHBondContact CA-OG1 3.48Å; N65-T68 PolarHBondContact O-OG1 3.13Å; N65-A69 WeakPolarHBondContact O-CB 3.38Å; N65-A69 PolarHBondContact O-N 2.81Å
66	V	74.5	Confident	71.5	Confident	80 Å²	80	107.6 Å²	107.6	49%	0.485	54%	0.54	S	S	.	.	H	α-helix	trans	-71	-39.8	177	172.9	0	0	0	0	111.2	L62 E63 E64 A69 R70	L62-V66 WeakPolarHBondContact O-CB 3.5Å; L62-V66 WeakPolarHBondContact O-CG2 3.4Å; L62-V66 PolarHBondContact O-N 3Å; E63-V66 PolarHBondContact O-N 3.48Å; E64-V66 PolarHBondContact O-N 3.27Å; V66-A69 PolarHBondContact O-N 3.31Å; V66-R70 WeakPolarHBondContact O-CB 3.32Å; V66-R70 PolarHBondContact O-N 2.89Å
67	T	74.8	Confident	69.5	Low	73 Å²	73	109.7 Å²	109.7	45%	0.448	56%	0.555	S	S	.	*	H	α-helix	trans	-67.6	-43	176.3	50.4	0	0	0	0	111.5	E63 E64 R70 N71	E63-T67 WeakPolarHBondContact O-CB 3.46Å; E63-T67 VanDerWaalsContact O-CG2 3.29Å; E63-T67 WeakPolarHBondContact O-CG2 3.41Å; E63-T67 PolarHBondContact O-N 2.89Å; E63-T67 PolarHBondContact O-OG1 3.43Å; E64-T67 VanDerWaalsContact CA-OG1 3.29Å; E64-T67 WeakPolarHBondContact CA-OG1 3.34Å; E64-T67 PolarHBondContact O-N 2.94Å; E64-T67 PolarHBondContact O-OG1 3.48Å; T67-R70 PolarHBondContact O-N 2.89Å; T67-N71 WeakPolarHBondContact O-CB 3.46Å; T67-N71 PolarHBondContact O-N 3.32Å; T67-N71 PolarHBondContact O-ND2 2.79Å
68	T	73.8	Confident	67.9	Low	65 Å²	65	107.8 Å²	107.8	40%	0.399	56%	0.557	S	S	.	*	H	α-helix	trans	-64.8	-39.3	173.7	53.5	0	0	0	0	112.2	E64 N65 N71 K72	E64-T68 WeakPolarHBondContact O-CB 3.29Å; E64-T68 VanDerWaalsContact O-CG2 3.28Å; E64-T68 WeakPolarHBondContact O-CG2 3.27Å; E64-T68 PolarHBondContact O-N 2.96Å; E64-T68 PolarHBondContact O-OG1 2.81Å; N65-T68 WeakPolarHBondContact CA-OG1 3.48Å; N65-T68 PolarHBondContact O-OG1 3.13Å; T68-N71 PolarHBondContact O-N 2.86Å; T68-K72 WeakPolarHBondContact O-CB 3.39Å; T68-K72 VanDerWaalsContact O-CG 3.31Å; T68-K72 WeakPolarHBondContact O-CG 3.3Å; T68-K72 PolarHBondContact O-N 3.13Å
69	A	66.6	Low	66.3	Low	46 Å²	46	113.2 Å²	113.2	38%	0.38	59%	0.585	S	S	.	*	H	α-helix	trans	-65.4	-41.7	173.3	0	0	0	0	0	112.4	N65 V66 N71 K72 L73	N65-A69 WeakPolarHBondContact O-CB 3.38Å; N65-A69 PolarHBondContact O-N 2.81Å; V66-A69 PolarHBondContact O-N 3.31Å; A69-N71 VanDerWaalsContact C-N 3.35Å; A69-N71 PolarHBondContact O-N 2.91Å; A69-K72 PolarHBondContact O-N 3.26Å; A69-L73 PolarHBondContact O-N 3.34Å
70	R	66.1	Low	64.7	Low	178 Å²	178	113 Å²	113	67%	0.672	58%	0.584	S	S	*	*	H	α-helix	trans	-61.2	-41.3	172.9	-104.3	-179.6	175.7	148.4	0	112.2	V66 T67 L73 R74	V66-R70 WeakPolarHBondContact O-CB 3.32Å; V66-R70 PolarHBondContact O-N 2.89Å; T67-R70 PolarHBondContact O-N 2.89Å; R70-L73 PolarHBondContact O-N 3.5Å; R70-R74 PolarHBondContact O-N 3.11Å
71	N	67.1	Low	63	Low	104 Å²	104	113.6 Å²	113.6	56%	0.556	59%	0.589	S	S	*	*	H	α-helix	trans	-66.1	-40.2	177	-70.8	-14.7	0	0	0	111.3	T67 T68 A69 R74 S75	T67-N71 WeakPolarHBondContact O-CB 3.46Å; T67-N71 PolarHBondContact O-N 3.32Å; T67-N71 PolarHBondContact O-ND2 2.79Å; T68-N71 PolarHBondContact O-N 2.86Å; A69-N71 VanDerWaalsContact C-N 3.35Å; A69-N71 PolarHBondContact O-N 2.91Å; N71-R74 PolarHBondContact O-N 2.83Å; N71-S75 PolarHBondContact O-N 3.24Å
72	K	64.5	Low	61.9	Low	145 Å²	145	113 Å²	113	63%	0.63	60%	0.598	S	S	*	*	H	α-helix	trans	-66.5	-34.8	174.1	-73.9	175	-179	176.4	0	113	T68 A69 S75	T68-K72 WeakPolarHBondContact O-CB 3.39Å; T68-K72 VanDerWaalsContact O-CG 3.31Å; T68-K72 WeakPolarHBondContact O-CG 3.3Å; T68-K72 PolarHBondContact O-N 3.13Å; A69-K72 PolarHBondContact O-N 3.26Å; K72-S75 WeakPolarHBondContact CA-OG 3.36Å; K72-S75 PolarHBondContact O-N 2.81Å; K72-S75 PolarHBondContact O-OG 2.71Å
73	L	57.4	Low	61.3	Low	140 Å²	140	112 Å²	112	73%	0.733	60%	0.6	S	S	*	*	H	α-helix	trans	-70.1	-37	174.6	-111.1	109.2	0	0	0	112.4	A69 R70 S75 F76	A69-L73 PolarHBondContact O-N 3.34Å; R70-L73 PolarHBondContact O-N 3.5Å; L73-S75 PolarHBondContact O-N 2.86Å; L73-F76 PolarHBondContact O-N 3.15Å
74	R	55.4	Low	60.6	Low	210 Å²	210	112 Å²	112	79%	0.792	60%	0.6	S	S	*	*	H	α-helix	trans	-65.2	-24.1	174.7	-76.9	-175.5	176	-171.4	-0.5	113.3	R70 N71 F76	R70-R74 PolarHBondContact O-N 3.11Å; N71-R74 PolarHBondContact O-N 2.83Å; R74-F76 VanDerWaalsContact C-N 3.32Å
75	S	56.3	Low	59.7	Low	86 Å²	86	109.8 Å²	109.8	60%	0.601	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-1.7	176.3	55.5	0	0	0	0	114.7	N71 K72 L73	N71-S75 PolarHBondContact O-N 3.24Å; K72-S75 WeakPolarHBondContact CA-OG 3.36Å; K72-S75 PolarHBondContact O-N 2.81Å; K72-S75 PolarHBondContact O-OG 2.71Å; L73-S75 PolarHBondContact O-N 2.86Å
76	F	45.7	Very low	59.3	Low	163 Å²	163	110.9 Å²	110.9	72%	0.715	59%	0.594	S	S	*	*			trans	-108.5	66.1	178.2	-94.6	-89.2	0	0	0	111.2	L73 R74 A78	L73-F76 PolarHBondContact O-N 3.15Å; R74-F76 VanDerWaalsContact C-N 3.32Å; F76-A78 PolarHBondContact O-N 3.46Å
77	D	40.4	Very low	59.3	Low	161 Å²	161	115.9 Å²	115.9	86%	0.861	60%	0.604	S	S	*	*			trans	-79.1	89.1	153.6	-87	-26.7	0	0	0	107.7
78	A	47.2	Very low	59.3	Low	64 Å²	64	116.7 Å²	116.7	53%	0.529	61%	0.605	S	S	.	*	S	Bend	trans	-177	116.5	154	0	0	0	0	0	110.8	F76 L80	F76-A78 PolarHBondContact O-N 3.46Å; A78-L80 PolarHBondContact O-N 2.95Å
79	T	46.4	Very low	59.4	Low	145 Å²	145	117.5 Å²	117.5	89%	0.89	61%	0.607	S	S	*	*			trans	-27.1	92.4	155.5	50.1	0	0	0	0	114.4
80	L	47.8	Very low	60	Low	82 Å²	82	120.6 Å²	120.6	43%	0.429	61%	0.613	S	S	.	*			trans	-95.5	128.5	157.7	-106.7	85.5	0	0	0	108.7	A78 L85	A78-L80 PolarHBondContact O-N 2.95Å; L80-L85 HydrophobicContact CB-CD1 4.36Å; L80-L85 HydrophobicContact CD2-CD1 4.31Å
81	P	47.3	Very low	60.7	Low	80 Å²	80	116.6 Å²	116.6	52%	0.519	61%	0.605	S	S	.	*			trans	-62	138	175.7	14.8	-17.7	0	0	0	111.3	S83 E84	P81-S83 PolarHBondContact O-N 3.29Å; P81-E84 PolarHBondContact O-N 2.79Å; P81-E84 VanDerWaalsContact O-N 3.09Å
82	S	56.7	Low	61.2	Low	92 Å²	92	117.7 Å²	117.7	64%	0.643	61%	0.605	S	S	*	*	H	α-helix	trans	-46.2	-35.1	-170.8	-167.2	0	0	0	0	114.6	Q86	S82-Q86 WeakPolarHBondContact O-CB 3.47Å; S82-Q86 PolarHBondContact O-N 3.44Å; S82-Q86 PolarHBondContact O-OE1 2.92Å
83	S	65.5	Low	61.9	Low	88 Å²	88	117.6 Å²	117.6	62%	0.615	60%	0.601	S	S	*	*	H	α-helix	trans	-69.4	-39.6	-177.2	50	0	0	0	0	114.2	P81 Q86 R87	P81-S83 PolarHBondContact O-N 3.29Å; S83-Q86 PolarHBondContact O-N 3.1Å; S83-R87 PolarHBondContact O-N 2.89Å
84	E	61.8	Low	63.1	Low	118 Å²	118	112.7 Å²	112.7	55%	0.551	58%	0.584	S	S	*	*	H	α-helix	trans	-79.3	-33.7	-176.1	-156.1	153.5	-151.2	0	0	111.1	P81 Q86 R87 L88	P81-E84 PolarHBondContact O-N 2.79Å; P81-E84 VanDerWaalsContact O-N 3.09Å; E84-Q86 VanDerWaalsContact C-N 3.34Å; E84-R87 PolarHBondContact O-N 2.86Å; E84-L88 PolarHBondContact O-N 2.93Å
85	L	60.3	Low	64.3	Low	88 Å²	88	107.1 Å²	107.1	46%	0.461	57%	0.57	S	S	.	*	H	α-helix	trans	-63	-40.5	167.2	-157.4	88.5	0	0	0	111.2	L80 L89	L80-L85 HydrophobicContact CB-CD1 4.36Å; L80-L85 HydrophobicContact CD2-CD1 4.31Å; L85-L89 HydrophobicContact CD2-CD1 4.22Å; L85-L89 HydrophobicContact CG-CD1 4.29Å; L85-L89 WeakPolarHBondContact O-CB 3.49Å; L85-L89 WeakPolarHBondContact O-CD1 3.13Å; L85-L89 WeakPolarHBondContact O-CG 3.4Å; L85-L89 PolarHBondContact O-N 2.98Å
86	Q	69.5	Low	65.5	Low	121 Å²	121	108.6 Å²	108.6	57%	0.565	57%	0.57	S	S	*	*	H	α-helix	trans	-64.6	-41.1	176.5	-118	157.1	-25.6	0	0	112.5	S82 S83 E84 L89 E90	S82-Q86 WeakPolarHBondContact O-CB 3.47Å; S82-Q86 PolarHBondContact O-N 3.44Å; S82-Q86 PolarHBondContact O-OE1 2.92Å; S83-Q86 PolarHBondContact O-N 3.1Å; E84-Q86 VanDerWaalsContact C-N 3.34Å; Q86-L89 PolarHBondContact O-N 2.98Å; Q86-E90 WeakPolarHBondContact O-CB 3.26Å; Q86-E90 PolarHBondContact O-N 3.49Å
87	R	74.4	Confident	67.2	Low	185 Å²	185	104.7 Å²	104.7	70%	0.698	56%	0.562	S	S	*	*	H	α-helix	trans	-67.2	-44.7	176.2	-175.5	178.5	162.5	-179.2	-4.6	112.1	S83 E84 L89 E90 D91	S83-R87 PolarHBondContact O-N 2.89Å; E84-R87 PolarHBondContact O-N 2.86Å; R87-L89 VanDerWaalsContact C-N 3.31Å; R87-L89 PolarHBondContact O-N 2.98Å; R87-E90 PolarHBondContact O-N 2.96Å; R87-D91 PolarHBondContact O-N 2.77Å
88	L	75.8	Confident	69.3	Low	89 Å²	89	100.5 Å²	100.5	47%	0.466	54%	0.542	S	S	.	.	H	α-helix	trans	-63.2	-38.3	173.9	-81.1	165.4	0	0	0	111.8	E84 E90 K92	E84-L88 PolarHBondContact O-N 2.93Å; L88-E90 VanDerWaalsContact C-N 3.34Å; L88-K92 VanDerWaalsContact O-CB 3.28Å; L88-K92 WeakPolarHBondContact O-CB 3.29Å; L88-K92 WeakPolarHBondContact O-CG 3.43Å; L88-K92 PolarHBondContact O-N 2.96Å
89	L	75.6	Confident	71	Confident	82 Å²	82	101.9 Å²	101.9	43%	0.429	54%	0.54	S	S	.	.	H	α-helix	trans	-63	-40.9	172.6	-80.6	167	0	0	0	111.2	L85 Q86 R87 K92 R93	L85-L89 HydrophobicContact CD2-CD1 4.22Å; L85-L89 HydrophobicContact CG-CD1 4.29Å; L85-L89 WeakPolarHBondContact O-CB 3.49Å; L85-L89 WeakPolarHBondContact O-CD1 3.13Å; L85-L89 WeakPolarHBondContact O-CG 3.4Å; L85-L89 PolarHBondContact O-N 2.98Å; Q86-L89 PolarHBondContact O-N 2.98Å; R87-L89 VanDerWaalsContact C-N 3.31Å; R87-L89 PolarHBondContact O-N 2.98Å; L89-K92 PolarHBondContact O-N 3.33Å; L89-R93 VanDerWaalsContact O-CB 3.23Å; L89-R93 WeakPolarHBondContact O-CB 3.21Å; L89-R93 WeakPolarHBondContact O-CD 3.36Å; L89-R93 WeakPolarHBondContact O-CG 3.41Å; L89-R93 PolarHBondContact O-N 3.32Å
90	E	79.8	Confident	72.8	Confident	112 Å²	112	96.2 Å²	96.2	52%	0.523	51%	0.51	S	S	.	.	H	α-helix	trans	-69.8	-42.4	178.6	-158.5	61.3	-157.4	0	0	112.1	Q86 R87 L88 K92 R93 G94	Q86-E90 WeakPolarHBondContact O-CB 3.26Å; Q86-E90 PolarHBondContact O-N 3.49Å; R87-E90 PolarHBondContact O-N 2.96Å; L88-E90 VanDerWaalsContact C-N 3.34Å; E90-K92 PolarHBondContact O-N 2.84Å; E90-R93 CarbonylContact O-C 3.58Å; E90-R93 WeakPolarHBondContact O-CB 3.42Å; E90-R93 PolarHBondContact O-N 3.44Å; E90-R93 IonicContact OE2-NH1 3.29Å; E90-R93 PolarHBondContact OE2-NH1 3.36Å; E90-G94 PolarHBondContact O-N 2.92Å
91	D	79.2	Confident	74.6	Confident	94 Å²	94	95.5 Å²	95.5	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-62.3	-42.6	173	-80.5	-12.9	0	0	0	111.2	R87 G94 L95	R87-D91 PolarHBondContact O-N 2.77Å; D91-G94 PolarHBondContact O-N 3.22Å; D91-L95 WeakPolarHBondContact O-CG 3.22Å; D91-L95 PolarHBondContact O-N 3.28Å
92	K	78.2	Confident	76.5	Confident	126 Å²	126	96.6 Å²	96.6	55%	0.548	51%	0.511	S	S	.	.	H	α-helix	trans	-68.6	-34.9	175.6	-68.4	-66.8	176.4	-170.2	0	112	L88 L89 E90 L95 L96	L88-K92 VanDerWaalsContact O-CB 3.28Å; L88-K92 WeakPolarHBondContact O-CB 3.29Å; L88-K92 WeakPolarHBondContact O-CG 3.43Å; L88-K92 PolarHBondContact O-N 2.96Å; L89-K92 PolarHBondContact O-N 3.33Å; E90-K92 PolarHBondContact O-N 2.84Å; K92-L95 HydrophobicContact CD-CD1 4.41Å; K92-L96 VanDerWaalsContact O-CB 3.26Å; K92-L96 WeakPolarHBondContact O-CB 3.41Å; K92-L96 WeakPolarHBondContact O-CD1 3.29Å; K92-L96 VanDerWaalsContact O-CG 3.22Å; K92-L96 WeakPolarHBondContact O-CG 3.46Å; K92-L96 PolarHBondContact O-N 3.09Å
93	R	79.8	Confident	77.8	Confident	144 Å²	144	98.1 Å²	98.1	54%	0.543	51%	0.509	S	S	.	.	H	α-helix	trans	-65.4	-41.3	171.5	-79.7	167	177.1	-179	-2.5	111.4	L89 E90 L96 C97	L89-R93 VanDerWaalsContact O-CB 3.23Å; L89-R93 WeakPolarHBondContact O-CB 3.21Å; L89-R93 WeakPolarHBondContact O-CD 3.36Å; L89-R93 WeakPolarHBondContact O-CG 3.41Å; L89-R93 PolarHBondContact O-N 3.32Å; E90-R93 CarbonylContact O-C 3.58Å; E90-R93 WeakPolarHBondContact O-CB 3.42Å; E90-R93 PolarHBondContact O-N 3.44Å; E90-R93 IonicContact OE2-NH1 3.29Å; E90-R93 PolarHBondContact OE2-NH1 3.36Å; R93-L96 PolarHBondContact O-N 2.93Å; R93-C97 VanDerWaalsContact O-CB 3.28Å; R93-C97 WeakPolarHBondContact O-CB 3.48Å; R93-C97 PolarHBondContact O-N 3.41Å
94	G	81.3	Confident	78.8	Confident	37 Å²	37	100.5 Å²	100.5	38%	0.381	51%	0.511	S	S	.	.	H	α-helix	trans	-61.3	-49.3	174.1	0	0	0	0	0	111.4	E90 D91 L96 C97 T98	E90-G94 PolarHBondContact O-N 2.92Å; D91-G94 PolarHBondContact O-N 3.22Å; G94-L96 PolarHBondContact O-N 3.33Å; G94-C97 WeakPolarHBondContact O-CB 3.05Å; G94-C97 PolarHBondContact O-N 2.81Å; G94-C97 VanDerWaalsContact O-N 3.12Å; G94-T98 PolarHBondContact O-N 3.45Å; G94-T98 PolarHBondContact O-OG1 3.48Å
95	L	82.2	Confident	80.1	Confident	93 Å²	93	100.5 Å²	100.5	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-59.4	-45.2	174.3	-72.9	172	0	0	0	111.9	D91 K92 C97 T98 I99	D91-L95 WeakPolarHBondContact O-CG 3.22Å; D91-L95 PolarHBondContact O-N 3.28Å; K92-L95 HydrophobicContact CD-CD1 4.41Å; L95-C97 VanDerWaalsContact C-N 3.29Å; L95-C97 PolarHBondContact O-N 3.33Å; L95-T98 VanDerWaalsContact CA-OG1 3.28Å; L95-T98 WeakPolarHBondContact CA-OG1 3.45Å; L95-T98 PolarHBondContact O-N 3.16Å; L95-T98 PolarHBondContact O-OG1 2.95Å; L95-I99 WeakPolarHBondContact O-CB 3.39Å; L95-I99 WeakPolarHBondContact O-CD1 3.42Å; L95-I99 WeakPolarHBondContact O-CG1 3.48Å; L95-I99 PolarHBondContact O-N 3.43Å
96	L	79.9	Confident	81.3	Confident	117 Å²	117	99.6 Å²	99.6	61%	0.613	51%	0.512	S	S	*	.	H	α-helix	trans	-61.8	-35.8	174.8	-80.5	164.9	0	0	0	112.2	K92 R93 G94 G100	K92-L96 VanDerWaalsContact O-CB 3.26Å; K92-L96 WeakPolarHBondContact O-CB 3.41Å; K92-L96 WeakPolarHBondContact O-CD1 3.29Å; K92-L96 VanDerWaalsContact O-CG 3.22Å; K92-L96 WeakPolarHBondContact O-CG 3.46Å; K92-L96 PolarHBondContact O-N 3.09Å; R93-L96 PolarHBondContact O-N 2.93Å; G94-L96 PolarHBondContact O-N 3.33Å; L96-G100 WeakPolarHBondContact O-CA 3.26Å; L96-G100 PolarHBondContact O-N 2.98Å
97	C	82.8	Confident	82.3	Confident	81 Å²	81	98.7 Å²	98.7	55%	0.547	51%	0.51	S	S	.	.	H	α-helix	trans	-69.7	-43.7	175.9	-170.6	0	0	0	0	111.3	R93 G94 L95 G100 T101	R93-C97 VanDerWaalsContact O-CB 3.28Å; R93-C97 WeakPolarHBondContact O-CB 3.48Å; R93-C97 PolarHBondContact O-N 3.41Å; G94-C97 WeakPolarHBondContact O-CB 3.05Å; G94-C97 PolarHBondContact O-N 2.81Å; G94-C97 VanDerWaalsContact O-N 3.12Å; L95-C97 VanDerWaalsContact C-N 3.29Å; L95-C97 PolarHBondContact O-N 3.33Å; C97-G100 PolarHBondContact O-N 3.34Å; C97-T101 WeakPolarHBondContact O-CB 3.46Å; C97-T101 WeakPolarHBondContact O-CG2 3.3Å; C97-T101 PolarHBondContact O-N 3.01Å; C97-T101 PolarHBondContact O-OG1 3.45Å
98	T	83.6	Confident	83.1	Confident	73 Å²	73	93.3 Å²	93.3	45%	0.448	50%	0.501	S	S	.	.	H	α-helix	trans	-64.5	-38.5	172.4	37.5	0	0	0	0	113	G94 L95 T101 N102	G94-T98 PolarHBondContact O-N 3.45Å; G94-T98 PolarHBondContact O-OG1 3.48Å; L95-T98 VanDerWaalsContact CA-OG1 3.28Å; L95-T98 WeakPolarHBondContact CA-OG1 3.45Å; L95-T98 PolarHBondContact O-N 3.16Å; L95-T98 PolarHBondContact O-OG1 2.95Å; T98-T101 WeakPolarHBondContact CA-OG1 3.37Å; T98-T101 PolarHBondContact O-OG1 3.49Å; T98-N102 WeakPolarHBondContact O-CB 3.38Å; T98-N102 PolarHBondContact O-N 2.85Å; T98-N102 PolarHBondContact O-ND2 3.21Å
99	I	82.8	Confident	83.9	Confident	92 Å²	92	93.7 Å²	93.7	47%	0.472	50%	0.503	S	S	.	.	H	α-helix	trans	-69.4	-40.7	175.7	-68.6	165.2	0	0	0	110	L95 N102 M103	L95-I99 WeakPolarHBondContact O-CB 3.39Å; L95-I99 WeakPolarHBondContact O-CD1 3.42Å; L95-I99 WeakPolarHBondContact O-CG1 3.48Å; L95-I99 PolarHBondContact O-N 3.43Å; I99-N102 PolarHBondContact O-N 3.05Å; I99-M103 HydrophobicContact CG2-SD 4.5Å; I99-M103 WeakPolarHBondContact O-CB 3.36Å; I99-M103 PolarHBondContact O-N 2.92Å
100	G	84.9	Confident	84.6	Confident	26 Å²	26	95.1 Å²	95.1	27%	0.268	51%	0.51	S	S	.	.	H	α-helix	trans	-62.3	-47.8	177	0	0	0	0	0	112.2	L96 C97 N102 M103 E104	L96-G100 WeakPolarHBondContact O-CA 3.26Å; L96-G100 PolarHBondContact O-N 2.98Å; C97-G100 PolarHBondContact O-N 3.34Å; G100-N102 PolarHBondContact O-N 2.93Å; G100-M103 CarbonylContact O-C 3.58Å; G100-M103 WeakPolarHBondContact O-CB 3.3Å; G100-M103 PolarHBondContact O-N 3.48Å; G100-E104 WeakPolarHBondContact O-CB 3.45Å; G100-E104 WeakPolarHBondContact O-CG 3.3Å; G100-E104 PolarHBondContact O-N 3.15Å
101	T	86	Confident	85.1	Confident	67 Å²	67	93.6 Å²	93.6	41%	0.411	51%	0.506	S	S	.	.	H	α-helix	trans	-63.4	-39.9	175.4	47.8	0	0	0	0	112.4	C97 T98 E104 H105	C97-T101 WeakPolarHBondContact O-CB 3.46Å; C97-T101 WeakPolarHBondContact O-CG2 3.3Å; C97-T101 PolarHBondContact O-N 3.01Å; C97-T101 PolarHBondContact O-OG1 3.45Å; T98-T101 WeakPolarHBondContact CA-OG1 3.37Å; T98-T101 PolarHBondContact O-OG1 3.49Å; T101-E104 PolarHBondContact O-N 2.85Å; T101-H105 WeakPolarHBondContact O-CB 3.49Å; T101-H105 PolarHBondContact O-N 2.9Å
102	N	87	Confident	85.7	Confident	104 Å²	104	91.6 Å²	91.6	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-66	-37.8	172.9	-74.6	-18.8	0	0	0	112.4	T98 I99 G100 S106	T98-N102 WeakPolarHBondContact O-CB 3.38Å; T98-N102 PolarHBondContact O-N 2.85Å; T98-N102 PolarHBondContact O-ND2 3.21Å; I99-N102 PolarHBondContact O-N 3.05Å; G100-N102 PolarHBondContact O-N 2.93Å; N102-S106 VanDerWaalsContact O-CB 3.28Å; N102-S106 WeakPolarHBondContact O-CB 3.41Å; N102-S106 PolarHBondContact O-N 3.4Å; N102-S106 PolarHBondContact O-OG 3.27Å
103	M	84.5	Confident	86.4	Confident	123 Å²	123	90.9 Å²	90.9	61%	0.606	50%	0.501	S	S	*	.	H	α-helix	trans	-65.5	-45.2	173.8	-93.8	-178.4	163.1	0	0	111.4	I99 G100 S106 L107	I99-M103 HydrophobicContact CG2-SD 4.5Å; I99-M103 WeakPolarHBondContact O-CB 3.36Å; I99-M103 PolarHBondContact O-N 2.92Å; G100-M103 CarbonylContact O-C 3.58Å; G100-M103 WeakPolarHBondContact O-CB 3.3Å; G100-M103 PolarHBondContact O-N 3.48Å; M103-S106 PolarHBondContact O-N 3.25Å; M103-L107 WeakPolarHBondContact O-CB 3.48Å; M103-L107 VanDerWaalsContact O-CG 3.26Å; M103-L107 WeakPolarHBondContact O-CG 3.45Å; M103-L107 PolarHBondContact O-N 3.43Å
104	E	85.6	Confident	87	Confident	139 Å²	139	92.4 Å²	92.4	65%	0.65	51%	0.507	S	S	*	.	H	α-helix	trans	-61.8	-43.2	175.8	-77.3	176	-179	0	0	111.5	G100 T101 L107 S108	G100-E104 WeakPolarHBondContact O-CB 3.45Å; G100-E104 WeakPolarHBondContact O-CG 3.3Å; G100-E104 PolarHBondContact O-N 3.15Å; T101-E104 PolarHBondContact O-N 2.85Å; E104-L107 PolarHBondContact O-N 2.86Å; E104-S108 WeakPolarHBondContact O-CB 3.31Å; E104-S108 PolarHBondContact O-N 3.19Å
105	H	88.3	Confident	87.5	Confident	117 Å²	117	96 Å²	96	54%	0.542	52%	0.517	S	S	.	.	H	α-helix	trans	-64	-43.7	174.9	-173.4	59.1	0	0	0	111.7	T101 L107 S108 L109	T101-H105 WeakPolarHBondContact O-CB 3.49Å; T101-H105 PolarHBondContact O-N 2.9Å; H105-L107 VanDerWaalsContact C-N 3.34Å; H105-L107 PolarHBondContact O-N 2.68Å; H105-S108 PolarHBondContact O-N 2.82Å; H105-L109 WeakPolarHBondContact O-CG 3.43Å; H105-L109 PolarHBondContact O-N 3.19Å
106	S	87.5	Confident	88	Confident	70 Å²	70	99.4 Å²	99.4	49%	0.49	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-40.7	176	-58.5	0	0	0	0	111.6	N102 M103 L109 L110	N102-S106 VanDerWaalsContact O-CB 3.28Å; N102-S106 WeakPolarHBondContact O-CB 3.41Å; N102-S106 PolarHBondContact O-N 3.4Å; N102-S106 PolarHBondContact O-OG 3.27Å; M103-S106 PolarHBondContact O-N 3.25Å; S106-L109 PolarHBondContact O-N 2.94Å; S106-L110 WeakPolarHBondContact O-CB 3.43Å; S106-L110 PolarHBondContact O-N 2.91Å
107	L	89.7	Confident	88.6	Confident	101 Å²	101	98.9 Å²	98.9	53%	0.529	52%	0.521	S	S	.	.	H	α-helix	trans	-66.2	-38.5	174.7	-76.2	170.4	0	0	0	111.7	M103 E104 H105 L110 N111	M103-L107 WeakPolarHBondContact O-CB 3.48Å; M103-L107 VanDerWaalsContact O-CG 3.26Å; M103-L107 WeakPolarHBondContact O-CG 3.45Å; M103-L107 PolarHBondContact O-N 3.43Å; E104-L107 PolarHBondContact O-N 2.86Å; H105-L107 VanDerWaalsContact C-N 3.34Å; H105-L107 PolarHBondContact O-N 2.68Å; L107-L110 PolarHBondContact O-N 2.89Å; L107-N111 VanDerWaalsContact O-CB 3.27Å; L107-N111 WeakPolarHBondContact O-CB 3.46Å; L107-N111 PolarHBondContact O-N 3.32Å; L107-N111 PolarHBondContact O-ND2 3.25Å
108	S	90.8	Very high	89.1	Confident	72 Å²	72	99.1 Å²	99.1	50%	0.503	51%	0.514	S	S	.	.	H	α-helix	trans	-64.7	-45.1	175.7	-179.8	0	0	0	0	111.7	E104 H105 N111 A112	E104-S108 WeakPolarHBondContact O-CB 3.31Å; E104-S108 PolarHBondContact O-N 3.19Å; H105-S108 PolarHBondContact O-N 2.82Å; S108-N111 PolarHBondContact O-N 3.49Å; S108-A112 WeakPolarHBondContact O-CB 3.46Å; S108-A112 PolarHBondContact O-N 3.14Å
109	L	92.4	Very high	89.5	Confident	97 Å²	97	98.5 Å²	98.5	51%	0.508	52%	0.516	S	S	.	.	H	α-helix	trans	-62.6	-42.8	173.8	-72.6	172.4	0	0	0	111.6	H105 S106 N111 A112 E113	H105-L109 WeakPolarHBondContact O-CG 3.43Å; H105-L109 PolarHBondContact O-N 3.19Å; S106-L109 PolarHBondContact O-N 2.94Å; L109-N111 VanDerWaalsContact C-N 3.34Å; L109-N111 PolarHBondContact O-N 3.5Å; L109-A112 PolarHBondContact O-N 2.98Å; L109-E113 PolarHBondContact O-N 3.41Å
110	L	90.8	Very high	90	Very high	112 Å²	112	98.8 Å²	98.8	59%	0.586	52%	0.518	S	S	*	.	H	α-helix	trans	-67.8	-35.8	179.9	-159.3	143.6	0	0	0	111.7	S106 L107 R114	S106-L110 WeakPolarHBondContact O-CB 3.43Å; S106-L110 PolarHBondContact O-N 2.91Å; L107-L110 PolarHBondContact O-N 2.89Å; L110-R114 VanDerWaalsContact O-CB 3.27Å; L110-R114 WeakPolarHBondContact O-CB 3.34Å; L110-R114 PolarHBondContact O-N 2.82Å
111	N	90.9	Very high	90.4	Very high	80 Å²	80	105.1 Å²	105.1	43%	0.428	53%	0.534	S	S	.	.	H	α-helix	trans	-67.4	-42.8	171.1	-74.9	-21.2	0	0	0	111.6	L107 S108 L109 E113 R114 D115	L107-N111 VanDerWaalsContact O-CB 3.27Å; L107-N111 WeakPolarHBondContact O-CB 3.46Å; L107-N111 PolarHBondContact O-N 3.32Å; L107-N111 PolarHBondContact O-ND2 3.25Å; S108-N111 PolarHBondContact O-N 3.49Å; L109-N111 VanDerWaalsContact C-N 3.34Å; L109-N111 PolarHBondContact O-N 3.5Å; N111-E113 VanDerWaalsContact C-N 3.35Å; N111-E113 PolarHBondContact O-N 2.9Å; N111-R114 CarbonylContact O-C 3.6Å; N111-R114 WeakPolarHBondContact O-CB 3.39Å; N111-R114 PolarHBondContact O-N 3.22Å; N111-R114 VanDerWaalsContact O-N 3.13Å; N111-D115 VanDerWaalsContact O-CG 3.31Å; N111-D115 PolarHBondContact O-N 3.33Å
112	A	92	Very high	90.7	Very high	53 Å²	53	105.2 Å²	105.2	44%	0.438	53%	0.532	S	S	.	.	H	α-helix	trans	-62	-41.1	176	0	0	0	0	0	112.2	S108 L109 D115 R116	S108-A112 WeakPolarHBondContact O-CB 3.46Å; S108-A112 PolarHBondContact O-N 3.14Å; L109-A112 PolarHBondContact O-N 2.98Å; A112-D115 PolarHBondContact O-N 3.47Å; A112-R116 WeakPolarHBondContact O-CB 3.46Å; A112-R116 PolarHBondContact O-N 2.99Å
113	E	92.4	Very high	91.1	Very high	111 Å²	111	106.5 Å²	106.5	52%	0.519	53%	0.533	S	S	.	.	H	α-helix	trans	-67.2	-36.6	172.8	-73.2	-57.5	150.9	0	0	112.1	L109 N111 R116 L117	L109-E113 PolarHBondContact O-N 3.41Å; N111-E113 VanDerWaalsContact C-N 3.35Å; N111-E113 PolarHBondContact O-N 2.9Å; E113-R116 PolarHBondContact O-N 2.83Å; E113-L117 WeakPolarHBondContact O-CB 3.37Å; E113-L117 VanDerWaalsContact O-CG 3.3Å; E113-L117 WeakPolarHBondContact O-CG 3.31Å; E113-L117 PolarHBondContact O-N 3.08Å
114	R	91.2	Very high	91.5	Very high	175 Å²	175	103.8 Å²	103.8	66%	0.66	53%	0.526	S	S	*	.	H	α-helix	trans	-63.9	-44.4	174.3	-173.8	178.2	-178.5	157.7	0.8	111.8	L110 N111 R116 L117 Q118	L110-R114 VanDerWaalsContact O-CB 3.27Å; L110-R114 WeakPolarHBondContact O-CB 3.34Å; L110-R114 PolarHBondContact O-N 2.82Å; N111-R114 CarbonylContact O-C 3.6Å; N111-R114 WeakPolarHBondContact O-CB 3.39Å; N111-R114 PolarHBondContact O-N 3.22Å; N111-R114 VanDerWaalsContact O-N 3.13Å; R114-R116 VanDerWaalsContact C-N 3.34Å; R114-L117 PolarHBondContact O-N 3.29Å; R114-Q118 WeakPolarHBondContact O-CB 3.41Å; R114-Q118 PolarHBondContact O-N 3.22Å
115	D	92.3	Very high	91.9	Very high	112 Å²	112	103 Å²	103	60%	0.599	52%	0.522	S	S	*	.	H	α-helix	trans	-65.6	-39.5	176.9	-69.1	-21.1	0	0	0	111	N111 A112 Q118 A119	N111-D115 VanDerWaalsContact O-CG 3.31Å; N111-D115 PolarHBondContact O-N 3.33Å; A112-D115 PolarHBondContact O-N 3.47Å; D115-Q118 PolarHBondContact O-N 2.92Å; D115-A119 WeakPolarHBondContact O-CB 3.16Å; D115-A119 PolarHBondContact O-N 3.04Å
116	R	93.6	Very high	92.2	Very high	165 Å²	165	103.1 Å²	103.1	62%	0.623	52%	0.523	S	S	*	.	H	α-helix	trans	-61.8	-45.3	173.2	-172.7	-175.5	178.9	110.4	1.3	111.6	A112 E113 R114 Q118 A119 L120	A112-R116 WeakPolarHBondContact O-CB 3.46Å; A112-R116 PolarHBondContact O-N 2.99Å; E113-R116 PolarHBondContact O-N 2.83Å; R114-R116 VanDerWaalsContact C-N 3.34Å; R116-Q118 VanDerWaalsContact C-N 3.3Å; R116-Q118 PolarHBondContact O-N 2.9Å; R116-A119 PolarHBondContact O-N 3.09Å; R116-L120 HydrophobicContact CG-CD1 4.34Å; R116-L120 WeakPolarHBondContact O-CB 3.45Å; R116-L120 VanDerWaalsContact O-CG 3.29Å; R116-L120 WeakPolarHBondContact O-CG 3.5Å; R116-L120 PolarHBondContact O-N 3.45Å
117	L	92.6	Very high	92.5	Very high	106 Å²	106	104.5 Å²	104.5	56%	0.555	52%	0.524	S	S	*	.	H	α-helix	trans	-63.1	-37.6	175.5	-76.8	170.9	0	0	0	111.8	E113 R114 L120 R121	E113-L117 WeakPolarHBondContact O-CB 3.37Å; E113-L117 VanDerWaalsContact O-CG 3.3Å; E113-L117 WeakPolarHBondContact O-CG 3.31Å; E113-L117 PolarHBondContact O-N 3.08Å; R114-L117 PolarHBondContact O-N 3.29Å; L117-L120 PolarHBondContact O-N 3.04Å; L117-R121 PolarHBondContact O-N 3.39Å
118	Q	91.8	Very high	92.6	Very high	87 Å²	87	103.3 Å²	103.3	41%	0.407	52%	0.521	S	S	.	.	H	α-helix	trans	-67.1	-47.2	176.3	-170.8	60.8	28.8	0	0	111.4	R114 D115 R116 L120 R121 D122	R114-Q118 WeakPolarHBondContact O-CB 3.41Å; R114-Q118 PolarHBondContact O-N 3.22Å; D115-Q118 PolarHBondContact O-N 2.92Å; R116-Q118 VanDerWaalsContact C-N 3.3Å; R116-Q118 PolarHBondContact O-N 2.9Å; Q118-L120 VanDerWaalsContact C-N 3.28Å; Q118-L120 PolarHBondContact O-N 3.44Å; Q118-R121 WeakPolarHBondContact O-CA 3.46Å; Q118-R121 WeakPolarHBondContact O-CB 3.46Å; Q118-R121 PolarHBondContact O-N 3.4Å; Q118-D122 PolarHBondContact NE2-OD1 3.16Å; Q118-D122 VanDerWaalsContact O-CG 3.27Å; Q118-D122 PolarHBondContact O-N 3.46Å
119	A	93.1	Very high	92.7	Very high	60 Å²	60	104.5 Å²	104.5	50%	0.496	52%	0.519	S	S	.	.	H	α-helix	trans	-60.3	-37.3	175.5	0	0	0	0	0	112.4	D115 R116 D122 K123	D115-A119 WeakPolarHBondContact O-CB 3.16Å; D115-A119 PolarHBondContact O-N 3.04Å; R116-A119 PolarHBondContact O-N 3.09Å; A119-D122 PolarHBondContact O-N 2.68Å; A119-K123 WeakPolarHBondContact O-CB 3.46Å; A119-K123 PolarHBondContact O-N 2.95Å
120	L	93.1	Very high	92.8	Very high	97 Å²	97	105.2 Å²	105.2	51%	0.508	52%	0.519	S	S	.	.	H	α-helix	trans	-67.4	-38.6	173.4	-73.7	171.7	0	0	0	112.2	R116 L117 Q118 S124	R116-L120 HydrophobicContact CG-CD1 4.34Å; R116-L120 WeakPolarHBondContact O-CB 3.45Å; R116-L120 VanDerWaalsContact O-CG 3.29Å; R116-L120 WeakPolarHBondContact O-CG 3.5Å; R116-L120 PolarHBondContact O-N 3.45Å; L117-L120 PolarHBondContact O-N 3.04Å; Q118-L120 VanDerWaalsContact C-N 3.28Å; Q118-L120 PolarHBondContact O-N 3.44Å; L120-S124 WeakPolarHBondContact O-CB 3.46Å; L120-S124 PolarHBondContact O-N 3.1Å
121	R	92.8	Very high	92.9	Very high	159 Å²	159	107.5 Å²	107.5	60%	0.6	53%	0.525	S	S	*	.	H	α-helix	trans	-62.6	-46	172	-86.5	-177.7	-177.3	158.4	0.2	111.9	L117 Q118 K123 S124 H125	L117-R121 PolarHBondContact O-N 3.39Å; Q118-R121 WeakPolarHBondContact O-CA 3.46Å; Q118-R121 WeakPolarHBondContact O-CB 3.46Å; Q118-R121 PolarHBondContact O-N 3.4Å; R121-K123 VanDerWaalsContact C-N 3.33Å; R121-K123 PolarHBondContact O-N 3.01Å; R121-S124 CarbonylContact O-C 3.6Å; R121-S124 WeakPolarHBondContact O-CA 3.37Å; R121-S124 VanDerWaalsContact O-CB 3.32Å; R121-S124 WeakPolarHBondContact O-CB 3.36Å; R121-S124 PolarHBondContact O-N 3.34Å; R121-S124 VanDerWaalsContact O-N 3.14Å; R121-H125 PolarHBondContact O-CD2 3.43Å; R121-H125 VanDerWaalsContact O-CD2 3.27Å; R121-H125 PolarHBondContact O-N 2.86Å
122	D	93.2	Very high	92.9	Very high	70 Å²	70	105.7 Å²	105.7	37%	0.374	52%	0.521	S	S	.	.	H	α-helix	trans	-64	-41.5	-179.6	-63.1	-22	0	0	0	110.7	Q118 A119 S124 H125 Q126	Q118-D122 PolarHBondContact NE2-OD1 3.16Å; Q118-D122 VanDerWaalsContact O-CG 3.27Å; Q118-D122 PolarHBondContact O-N 3.46Å; A119-D122 PolarHBondContact O-N 2.68Å; D122-S124 VanDerWaalsContact C-N 3.35Å; D122-S124 PolarHBondContact O-N 2.8Å; D122-H125 PolarHBondContact O-N 3.13Å; D122-Q126 WeakPolarHBondContact O-CG 3.48Å; D122-Q126 PolarHBondContact O-N 3.31Å
123	K	94.4	Very high	93	Very high	130 Å²	130	109.8 Å²	109.8	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-64.2	-38.9	173	-167.8	168.8	-172.1	172.9	0	112.2	A119 R121 H125 Q126 L127	A119-K123 WeakPolarHBondContact O-CB 3.46Å; A119-K123 PolarHBondContact O-N 2.95Å; R121-K123 VanDerWaalsContact C-N 3.33Å; R121-K123 PolarHBondContact O-N 3.01Å; K123-H125 VanDerWaalsContact C-N 3.33Å; K123-Q126 PolarHBondContact O-N 3.38Å; K123-L127 HydrophobicContact CG-CD1 4.4Å; K123-L127 WeakPolarHBondContact O-CB 3.44Å; K123-L127 VanDerWaalsContact O-CG 3.3Å; K123-L127 WeakPolarHBondContact O-CG 3.46Å; K123-L127 PolarHBondContact O-N 2.87Å
124	S	93.8	Very high	93.1	Very high	67 Å²	67	109 Å²	109	47%	0.469	52%	0.524	S	S	.	.	H	α-helix	trans	-60.8	-43.6	172.2	-175.1	0	0	0	0	111	L120 R121 D122 L127 T128	L120-S124 WeakPolarHBondContact O-CB 3.46Å; L120-S124 PolarHBondContact O-N 3.1Å; R121-S124 CarbonylContact O-C 3.6Å; R121-S124 WeakPolarHBondContact O-CA 3.37Å; R121-S124 VanDerWaalsContact O-CB 3.32Å; R121-S124 WeakPolarHBondContact O-CB 3.36Å; R121-S124 PolarHBondContact O-N 3.34Å; R121-S124 VanDerWaalsContact O-N 3.14Å; D122-S124 VanDerWaalsContact C-N 3.35Å; D122-S124 PolarHBondContact O-N 2.8Å; S124-L127 PolarHBondContact O-N 3.13Å; S124-T128 VanDerWaalsContact O-CG2 3.3Å; S124-T128 WeakPolarHBondContact O-CG2 3.35Å; S124-T128 PolarHBondContact O-N 3.17Å; S124-T128 PolarHBondContact O-OG1 3.39Å
125	H	93.3	Very high	93.2	Very high	122 Å²	122	107.1 Å²	107.1	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-64	-44.4	177	-76.6	-51	0	0	0	112.2	R121 D122 K123 L127 T128 E129	R121-H125 PolarHBondContact O-CD2 3.43Å; R121-H125 VanDerWaalsContact O-CD2 3.27Å; R121-H125 PolarHBondContact O-N 2.86Å; D122-H125 PolarHBondContact O-N 3.13Å; K123-H125 VanDerWaalsContact C-N 3.33Å; H125-L127 PolarHBondContact O-N 3.39Å; H125-T128 VanDerWaalsContact CA-OG1 3.3Å; H125-T128 WeakPolarHBondContact CA-OG1 3.38Å; H125-T128 PolarHBondContact O-N 2.85Å; H125-T128 PolarHBondContact O-OG1 2.79Å; H125-E129 PolarHBondContact O-N 2.86Å
126	Q	93.9	Very high	93.2	Very high	120 Å²	120	108.1 Å²	108.1	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-58.8	-47.7	174.8	-72.4	172.2	3.7	0	0	111.7	D122 K123 T128 E129 E130	D122-Q126 WeakPolarHBondContact O-CG 3.48Å; D122-Q126 PolarHBondContact O-N 3.31Å; K123-Q126 PolarHBondContact O-N 3.38Å; Q126-T128 VanDerWaalsContact C-N 3.31Å; Q126-T128 PolarHBondContact O-N 2.92Å; Q126-E129 PolarHBondContact O-N 3.46Å; Q126-E129 VanDerWaalsContact O-N 3.15Å; Q126-E130 WeakPolarHBondContact O-CG 3.36Å; Q126-E130 PolarHBondContact O-N 2.94Å
127	L	93.9	Very high	93.2	Very high	98 Å²	98	104.7 Å²	104.7	51%	0.513	51%	0.51	S	S	.	.	H	α-helix	trans	-63.6	-36.3	177.2	-71.4	173	0	0	0	112.2	K123 S124 H125 K131	K123-L127 HydrophobicContact CG-CD1 4.4Å; K123-L127 WeakPolarHBondContact O-CB 3.44Å; K123-L127 VanDerWaalsContact O-CG 3.3Å; K123-L127 WeakPolarHBondContact O-CG 3.46Å; K123-L127 PolarHBondContact O-N 2.87Å; S124-L127 PolarHBondContact O-N 3.13Å; H125-L127 PolarHBondContact O-N 3.39Å; L127-K131 VanDerWaalsContact O-CB 3.26Å; L127-K131 WeakPolarHBondContact O-CB 3.2Å; L127-K131 PolarHBondContact O-N 3.27Å
128	T	92.2	Very high	93.1	Very high	77 Å²	77	105.7 Å²	105.7	47%	0.472	51%	0.512	S	S	.	.	H	α-helix	trans	-66.9	-37.2	174	55.4	0	0	0	0	112.3	S124 H125 Q126 A132	S124-T128 VanDerWaalsContact O-CG2 3.3Å; S124-T128 WeakPolarHBondContact O-CG2 3.35Å; S124-T128 PolarHBondContact O-N 3.17Å; S124-T128 PolarHBondContact O-OG1 3.39Å; H125-T128 VanDerWaalsContact CA-OG1 3.3Å; H125-T128 WeakPolarHBondContact CA-OG1 3.38Å; H125-T128 PolarHBondContact O-N 2.85Å; H125-T128 PolarHBondContact O-OG1 2.79Å; Q126-T128 VanDerWaalsContact C-N 3.31Å; Q126-T128 PolarHBondContact O-N 2.92Å; T128-A132 WeakPolarHBondContact O-CB 3.29Å; T128-A132 PolarHBondContact O-N 3.49Å
129	E	92.6	Very high	93.1	Very high	96 Å²	96	107.6 Å²	107.6	45%	0.449	52%	0.52	S	S	.	.	H	α-helix	trans	-70.8	-42.9	177.3	-161.5	-170.7	151.6	0	0	111.6	H125 Q126 A132 R133	H125-E129 PolarHBondContact O-N 2.86Å; Q126-E129 PolarHBondContact O-N 3.46Å; Q126-E129 VanDerWaalsContact O-N 3.15Å; E129-A132 CarbonylContact O-C 3.59Å; E129-A132 WeakPolarHBondContact O-CB 3.48Å; E129-A132 PolarHBondContact O-N 3.41Å; E129-R133 WeakPolarHBondContact O-CG 3.46Å; E129-R133 PolarHBondContact O-N 3.46Å; E129-R133 IonicContact OE1-CZ 3.41Å; E129-R133 IonicContact OE1-NE 2.77Å; E129-R133 PolarHBondContact OE1-NE 3.28Å; E129-R133 IonicContact OE1-NH2 3.46Å; E129-R133 PolarHBondContact OE1-NH2 3.06Å
130	E	94.2	Very high	93.1	Very high	112 Å²	112	110.3 Å²	110.3	52%	0.523	52%	0.523	S	S	.	.	H	α-helix	trans	-60.4	-44.9	173.4	-75	-177.3	170.5	0	0	111.5	Q126 A132 R133 I134	Q126-E130 WeakPolarHBondContact O-CG 3.36Å; Q126-E130 PolarHBondContact O-N 2.94Å; E130-A132 VanDerWaalsContact C-N 3.3Å; E130-A132 PolarHBondContact O-N 2.97Å; E130-R133 PolarHBondContact O-N 3.35Å; E130-R133 VanDerWaalsContact O-N 3.13Å; E130-I134 WeakPolarHBondContact O-CG1 3.45Å; E130-I134 PolarHBondContact O-N 3.05Å
131	K	93.6	Very high	93	Very high	161 Å²	161	110.5 Å²	110.5	70%	0.7	53%	0.528	S	S	*	.	H	α-helix	trans	-58	-43.3	173.3	-176	-179.5	178.4	-177.4	0	111.3	L127 R133 I134 F135	L127-K131 VanDerWaalsContact O-CB 3.26Å; L127-K131 WeakPolarHBondContact O-CB 3.2Å; L127-K131 PolarHBondContact O-N 3.27Å; K131-R133 VanDerWaalsContact C-N 3.34Å; K131-R133 PolarHBondContact O-N 2.84Å; K131-I134 PolarHBondContact O-N 3.19Å; K131-F135 WeakPolarHBondContact O-CB 3.39Å; K131-F135 PolarHBondContact O-N 3.34Å
132	A	92	Very high	92.9	Very high	42 Å²	42	105 Å²	105	35%	0.347	52%	0.516	S	S	.	.	H	α-helix	trans	-66.6	-33.3	176.8	0	0	0	0	0	112.9	T128 E129 E130 R136	T128-A132 WeakPolarHBondContact O-CB 3.29Å; T128-A132 PolarHBondContact O-N 3.49Å; E129-A132 CarbonylContact O-C 3.59Å; E129-A132 WeakPolarHBondContact O-CB 3.48Å; E129-A132 PolarHBondContact O-N 3.41Å; E130-A132 VanDerWaalsContact C-N 3.3Å; E130-A132 PolarHBondContact O-N 2.97Å; A132-R136 WeakPolarHBondContact O-CG 3.3Å; A132-R136 PolarHBondContact O-N 3.46Å; A132-R136 VanDerWaalsContact O-N 3.13Å; A132-R136 PolarHBondContact O-NE 2.84Å
133	R	93.8	Very high	92.9	Very high	138 Å²	138	104 Å²	104	52%	0.521	52%	0.515	S	S	.	.	H	α-helix	trans	-69.7	-44.9	173.7	-72.5	176.5	-174.5	-147.6	4	111.6	E129 E130 K131 F135 R136 N137	E129-R133 WeakPolarHBondContact O-CG 3.46Å; E129-R133 PolarHBondContact O-N 3.46Å; E129-R133 IonicContact OE1-CZ 3.41Å; E129-R133 IonicContact OE1-NE 2.77Å; E129-R133 PolarHBondContact OE1-NE 3.28Å; E129-R133 IonicContact OE1-NH2 3.46Å; E129-R133 PolarHBondContact OE1-NH2 3.06Å; E130-R133 PolarHBondContact O-N 3.35Å; E130-R133 VanDerWaalsContact O-N 3.13Å; K131-R133 VanDerWaalsContact C-N 3.34Å; K131-R133 PolarHBondContact O-N 2.84Å; R133-F135 VanDerWaalsContact C-N 3.31Å; R133-F135 PolarHBondContact O-N 3.45Å; R133-R136 PolarHBondContact O-N 3.26Å; R133-N137 PolarHBondContact O-N 3.13Å
134	I	94.1	Very high	92.8	Very high	96 Å²	96	102.8 Å²	102.8	49%	0.492	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-43.2	176.3	-68.1	167.6	0	0	0	110.3	E130 K131 N137 Q138	E130-I134 WeakPolarHBondContact O-CG1 3.45Å; E130-I134 PolarHBondContact O-N 3.05Å; K131-I134 PolarHBondContact O-N 3.19Å; I134-N137 PolarHBondContact O-N 3.48Å; I134-Q138 HydrophobicContact CG2-CG 4.36Å; I134-Q138 WeakPolarHBondContact O-CB 3.26Å; I134-Q138 WeakPolarHBondContact O-CG 3.46Å; I134-Q138 PolarHBondContact O-N 3.45Å
135	F	93	Very high	92.7	Very high	135 Å²	135	102.4 Å²	102.4	59%	0.592	51%	0.511	S	S	*	.	H	α-helix	trans	-60.9	-45.6	177.2	-169.4	-95	0	0	0	112	K131 R133 N137 Q138 E139	K131-F135 WeakPolarHBondContact O-CB 3.39Å; K131-F135 PolarHBondContact O-N 3.34Å; R133-F135 VanDerWaalsContact C-N 3.31Å; R133-F135 PolarHBondContact O-N 3.45Å; F135-N137 PolarHBondContact O-N 2.99Å; F135-Q138 PolarHBondContact O-N 3.31Å; F135-E139 PolarHBondContact O-N 3.37Å
136	R	92.2	Very high	92.6	Very high	133 Å²	133	105.7 Å²	105.7	50%	0.502	52%	0.519	S	S	.	.	H	α-helix	trans	-60.1	-42.8	174.2	-80.6	-178.4	-88.3	153.7	-13	112.7	A132 R133 E139 Q140	A132-R136 WeakPolarHBondContact O-CG 3.3Å; A132-R136 PolarHBondContact O-N 3.46Å; A132-R136 VanDerWaalsContact O-N 3.13Å; A132-R136 PolarHBondContact O-NE 2.84Å; R133-R136 PolarHBondContact O-N 3.26Å; R136-E139 PolarHBondContact O-N 3.23Å; R136-Q140 WeakPolarHBondContact O-CG 3.37Å; R136-Q140 PolarHBondContact O-N 2.88Å
137	N	93.2	Very high	92.5	Very high	93 Å²	93	105 Å²	105	50%	0.497	52%	0.516	S	S	.	.	H	α-helix	trans	-67.6	-37.8	177.7	-71	-3.4	0	0	0	111.9	R133 I134 F135 E139 Q140 V141	R133-N137 PolarHBondContact O-N 3.13Å; I134-N137 PolarHBondContact O-N 3.48Å; F135-N137 PolarHBondContact O-N 2.99Å; N137-E139 VanDerWaalsContact C-N 3.33Å; N137-Q140 PolarHBondContact O-N 2.88Å; N137-V141 WeakPolarHBondContact O-CB 3.41Å; N137-V141 VanDerWaalsContact O-CG2 3.28Å; N137-V141 WeakPolarHBondContact O-CG2 3.29Å; N137-V141 PolarHBondContact O-N 3.35Å
138	Q	91.9	Very high	92.5	Very high	126 Å²	126	105.7 Å²	105.7	59%	0.589	52%	0.516	S	S	*	.	H	α-helix	trans	-62.6	-41.5	174	-77.6	178.3	-14.7	0	0	111.4	I134 F135 V141 A142	I134-Q138 HydrophobicContact CG2-CG 4.36Å; I134-Q138 WeakPolarHBondContact O-CB 3.26Å; I134-Q138 WeakPolarHBondContact O-CG 3.46Å; I134-Q138 PolarHBondContact O-N 3.45Å; F135-Q138 PolarHBondContact O-N 3.31Å; Q138-V141 PolarHBondContact O-N 2.82Å; Q138-A142 VanDerWaalsContact O-CB 3.29Å; Q138-A142 WeakPolarHBondContact O-CB 3.38Å; Q138-A142 PolarHBondContact O-N 2.71Å
139	E	90.4	Very high	92.5	Very high	127 Å²	127	108.4 Å²	108.4	59%	0.593	52%	0.521	S	S	*	.	H	α-helix	trans	-64.9	-40.9	175.6	-167.4	173.5	-171.5	0	0	112	F135 R136 N137 A142 S143	F135-E139 PolarHBondContact O-N 3.37Å; R136-E139 PolarHBondContact O-N 3.23Å; N137-E139 VanDerWaalsContact C-N 3.33Å; E139-A142 PolarHBondContact O-N 2.85Å; E139-S143 PolarHBondContact O-N 2.87Å; E139-S143 PolarHBondContact O-OG 3.13Å
140	Q	92.5	Very high	92.5	Very high	118 Å²	118	109.8 Å²	109.8	55%	0.551	53%	0.528	S	S	*	.	H	α-helix	trans	-66.5	-42	174.3	-74.2	-179.9	-9.1	0	0	113.3	R136 N137 A142 S143 L144	R136-Q140 WeakPolarHBondContact O-CG 3.37Å; R136-Q140 PolarHBondContact O-N 2.88Å; N137-Q140 PolarHBondContact O-N 2.88Å; Q140-A142 VanDerWaalsContact C-N 3.3Å; Q140-A142 PolarHBondContact O-N 3.41Å; Q140-S143 WeakPolarHBondContact CA-OG 3.42Å; Q140-S143 PolarHBondContact O-N 3.16Å; Q140-S143 PolarHBondContact O-OG 3.05Å; Q140-L144 WeakPolarHBondContact O-CB 3.26Å; Q140-L144 WeakPolarHBondContact O-CG 3.32Å; Q140-L144 PolarHBondContact O-N 2.98Å
141	V	92.6	Very high	92.4	Very high	100 Å²	100	108.9 Å²	108.9	61%	0.606	53%	0.525	S	S	*	.	H	α-helix	trans	-65.4	-38.6	175.9	170.5	0	0	0	0	110.2	N137 Q138 S145	N137-V141 WeakPolarHBondContact O-CB 3.41Å; N137-V141 VanDerWaalsContact O-CG2 3.28Å; N137-V141 WeakPolarHBondContact O-CG2 3.29Å; N137-V141 PolarHBondContact O-N 3.35Å; Q138-V141 PolarHBondContact O-N 2.82Å; V141-S145 WeakPolarHBondContact O-CB 3.33Å; V141-S145 PolarHBondContact O-N 3.31Å
142	A	91.1	Very high	92.4	Very high	43 Å²	43	105 Å²	105	36%	0.355	51%	0.512	S	S	.	.	H	α-helix	trans	-64.8	-41.4	174.9	0	0	0	0	0	112.1	Q138 E139 Q140 R146	Q138-A142 VanDerWaalsContact O-CB 3.29Å; Q138-A142 WeakPolarHBondContact O-CB 3.38Å; Q138-A142 PolarHBondContact O-N 2.71Å; E139-A142 PolarHBondContact O-N 2.85Å; Q140-A142 VanDerWaalsContact C-N 3.3Å; Q140-A142 PolarHBondContact O-N 3.41Å; A142-R146 WeakPolarHBondContact O-CG 3.26Å; A142-R146 PolarHBondContact O-N 2.79Å
143	S	91.3	Very high	92.5	Very high	51 Å²	51	108.1 Å²	108.1	36%	0.357	52%	0.522	S	S	.	.	H	α-helix	trans	-68.6	-43.2	177.1	69.1	0	0	0	0	112.3	E139 Q140 S145 R146 Q147	E139-S143 PolarHBondContact O-N 2.87Å; E139-S143 PolarHBondContact O-OG 3.13Å; Q140-S143 WeakPolarHBondContact CA-OG 3.42Å; Q140-S143 PolarHBondContact O-N 3.16Å; Q140-S143 PolarHBondContact O-OG 3.05Å; S143-S145 PolarHBondContact O-N 3.24Å; S143-R146 WeakPolarHBondContact O-CB 3.46Å; S143-R146 PolarHBondContact O-N 3Å; S143-Q147 WeakPolarHBondContact O-CG 3.36Å; S143-Q147 PolarHBondContact O-N 2.93Å
144	L	93.4	Very high	92.4	Very high	104 Å²	104	104 Å²	104	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-64.5	-38.9	174.8	-72.5	172	0	0	0	112.2	Q140 R146 Q147 H148	Q140-L144 WeakPolarHBondContact O-CB 3.26Å; Q140-L144 WeakPolarHBondContact O-CG 3.32Å; Q140-L144 PolarHBondContact O-N 2.98Å; L144-R146 VanDerWaalsContact C-N 3.31Å; L144-R146 PolarHBondContact O-N 2.86Å; L144-Q147 PolarHBondContact O-N 2.81Å; L144-H148 WeakPolarHBondContact O-CB 3.11Å; L144-H148 PolarHBondContact O-N 3.39Å
145	S	91.6	Very high	92.3	Very high	58 Å²	58	103.7 Å²	103.7	41%	0.406	51%	0.508	S	S	.	.	H	α-helix	trans	-64.9	-36.1	175.4	-177.1	0	0	0	0	111.9	V141 S143 K149	V141-S145 WeakPolarHBondContact O-CB 3.33Å; V141-S145 PolarHBondContact O-N 3.31Å; S143-S145 PolarHBondContact O-N 3.24Å; S145-K149 WeakPolarHBondContact O-CG 3.33Å; S145-K149 PolarHBondContact O-N 2.86Å; S145-K149 VanDerWaalsContact O-N 3.1Å
146	R	90.9	Very high	92.3	Very high	191 Å²	191	103 Å²	103	72%	0.721	51%	0.507	S	S	*	.	H	α-helix	trans	-64.3	-49	171.7	-74.4	174.9	-175.3	163.8	1.9	111.4	A142 S143 L144 H148 K149 E150	A142-R146 WeakPolarHBondContact O-CG 3.26Å; A142-R146 PolarHBondContact O-N 2.79Å; S143-R146 WeakPolarHBondContact O-CB 3.46Å; S143-R146 PolarHBondContact O-N 3Å; L144-R146 VanDerWaalsContact C-N 3.31Å; L144-R146 PolarHBondContact O-N 2.86Å; R146-H148 VanDerWaalsContact C-N 3.3Å; R146-H148 PolarHBondContact O-N 3.42Å; R146-K149 PolarHBondContact O-N 3.22Å; R146-E150 PolarHBondContact O-N 3.46Å
147	Q	92.5	Very high	92.3	Very high	107 Å²	107	102.5 Å²	102.5	50%	0.5	51%	0.505	S	S	.	.	H	α-helix	trans	-59.8	-40.6	176.9	-72.1	178.9	-13	0	0	112.2	S143 L144 K149 E150 I151	S143-Q147 WeakPolarHBondContact O-CG 3.36Å; S143-Q147 PolarHBondContact O-N 2.93Å; L144-Q147 PolarHBondContact O-N 2.81Å; Q147-K149 PolarHBondContact O-N 2.87Å; Q147-E150 PolarHBondContact O-N 2.88Å; Q147-I151 VanDerWaalsContact O-CG1 3.27Å; Q147-I151 WeakPolarHBondContact O-CG1 3.49Å; Q147-I151 PolarHBondContact O-N 2.74Å
148	H	92.7	Very high	92.3	Very high	112 Å²	112	102.6 Å²	102.6	52%	0.519	51%	0.505	S	S	.	.	H	α-helix	trans	-63.8	-40.7	177.1	-173.8	58.5	0	0	0	112.2	L144 R146 L152	L144-H148 WeakPolarHBondContact O-CB 3.11Å; L144-H148 PolarHBondContact O-N 3.39Å; R146-H148 VanDerWaalsContact C-N 3.3Å; R146-H148 PolarHBondContact O-N 3.42Å; H148-L152 WeakPolarHBondContact O-CG 3.33Å; H148-L152 PolarHBondContact O-N 2.85Å
149	K	92.6	Very high	92.3	Very high	134 Å²	134	99.3 Å²	99.3	58%	0.583	50%	0.496	S	S	*	.	H	α-helix	trans	-64.2	-41.5	174.4	-74.8	177.1	179.9	-177.4	0	112	S145 R146 Q147 L152 I153	S145-K149 WeakPolarHBondContact O-CG 3.33Å; S145-K149 PolarHBondContact O-N 2.86Å; S145-K149 VanDerWaalsContact O-N 3.1Å; R146-K149 PolarHBondContact O-N 3.22Å; Q147-K149 PolarHBondContact O-N 2.87Å; K149-L152 PolarHBondContact O-N 3.12Å; K149-I153 WeakPolarHBondContact O-CG1 3.44Å; K149-I153 PolarHBondContact O-N 3.46Å; K149-I153 VanDerWaalsContact O-N 3.11Å
150	E	92.4	Very high	92.4	Very high	125 Å²	125	99.4 Å²	99.4	58%	0.584	49%	0.494	S	S	*	.	H	α-helix	trans	-62.7	-46.1	177.2	-170.3	173.7	-169.4	0	0	111.5	R146 Q147 L152 I153 D154	R146-E150 PolarHBondContact O-N 3.46Å; Q147-E150 PolarHBondContact O-N 2.88Å; E150-L152 VanDerWaalsContact C-N 3.32Å; E150-L152 PolarHBondContact O-N 3.29Å; E150-I153 PolarHBondContact O-N 2.63Å; E150-D154 PolarHBondContact O-N 3.4Å
151	I	93.3	Very high	92.4	Very high	92 Å²	92	98.3 Å²	98.3	47%	0.472	49%	0.489	S	S	.	.	H	α-helix	trans	-61.7	-39.3	176.3	-67.9	165.7	0	0	0	111.7	Q147 D154 I155	Q147-I151 VanDerWaalsContact O-CG1 3.27Å; Q147-I151 WeakPolarHBondContact O-CG1 3.49Å; Q147-I151 PolarHBondContact O-N 2.74Å; I151-D154 PolarHBondContact O-N 3.11Å; I151-I155 HydrophobicContact CG2-CD1 3.84Å; I151-I155 HydrophobicContact CG2-CG1 4.36Å; I151-I155 VanDerWaalsContact O-CG1 3.28Å; I151-I155 WeakPolarHBondContact O-CG1 3.28Å; I151-I155 PolarHBondContact O-N 3.49Å
152	L	93.5	Very high	92.4	Very high	79 Å²	79	99.2 Å²	99.2	41%	0.414	49%	0.487	S	S	.	.	H	α-helix	trans	-63.7	-41.6	176.5	-76.5	170.5	0	0	0	112	H148 K149 E150 D154 I155 E156	H148-L152 WeakPolarHBondContact O-CG 3.33Å; H148-L152 PolarHBondContact O-N 2.85Å; K149-L152 PolarHBondContact O-N 3.12Å; E150-L152 VanDerWaalsContact C-N 3.32Å; E150-L152 PolarHBondContact O-N 3.29Å; L152-D154 VanDerWaalsContact C-N 3.33Å; L152-I155 PolarHBondContact O-N 2.92Å; L152-E156 WeakPolarHBondContact O-CG 3.38Å; L152-E156 PolarHBondContact O-N 3.5Å
153	I	92.8	Very high	92.5	Very high	109 Å²	109	102.9 Å²	102.9	56%	0.559	50%	0.496	S	S	*	.	H	α-helix	trans	-63.3	-42.2	175.5	-66.4	164.3	0	0	0	110.4	K149 E150 E156 R157	K149-I153 WeakPolarHBondContact O-CG1 3.44Å; K149-I153 PolarHBondContact O-N 3.46Å; K149-I153 VanDerWaalsContact O-N 3.11Å; E150-I153 PolarHBondContact O-N 2.63Å; I153-E156 PolarHBondContact O-N 2.9Å; I153-R157 WeakPolarHBondContact O-CB 3.44Å; I153-R157 PolarHBondContact O-N 3.47Å
154	D	92	Very high	92.5	Very high	52 Å²	52	105.2 Å²	105.2	28%	0.278	50%	0.501	S	S	.	.	H	α-helix	trans	-64.7	-39.9	176.9	-78.3	-27.2	0	0	0	112.3	E150 I151 L152 R157 L158	E150-D154 PolarHBondContact O-N 3.4Å; I151-D154 PolarHBondContact O-N 3.11Å; L152-D154 VanDerWaalsContact C-N 3.33Å; D154-R157 PolarHBondContact O-N 2.96Å; D154-R157 IonicContact OD1-CZ 3.3Å; D154-R157 IonicContact OD1-NH1 3.8Å; D154-R157 PolarHBondContact OD1-NH1 3.27Å; D154-R157 IonicContact OD1-NH2 2.89Å; D154-R157 PolarHBondContact OD1-NH2 2.73Å; D154-L158 WeakPolarHBondContact O-CB 3.33Å; D154-L158 VanDerWaalsContact O-CG 3.24Å; D154-L158 WeakPolarHBondContact O-CG 3.41Å; D154-L158 PolarHBondContact O-N 3.42Å
155	I	93.3	Very high	92.4	Very high	88 Å²	88	103 Å²	103	45%	0.451	50%	0.498	S	S	.	.	H	α-helix	trans	-62.8	-46.2	175	-71.3	167.5	0	0	0	110.5	I151 L152 R157 L158 C159	I151-I155 HydrophobicContact CG2-CD1 3.84Å; I151-I155 HydrophobicContact CG2-CG1 4.36Å; I151-I155 VanDerWaalsContact O-CG1 3.28Å; I151-I155 WeakPolarHBondContact O-CG1 3.28Å; I151-I155 PolarHBondContact O-N 3.49Å; L152-I155 PolarHBondContact O-N 2.92Å; I155-R157 VanDerWaalsContact C-N 3.31Å; I155-R157 PolarHBondContact O-N 3.45Å; I155-L158 PolarHBondContact O-N 2.91Å; I155-C159 PolarHBondContact O-N 3.42Å; I155-C159 PolarHBondContact O-SG 3.47Å; I155-C159 VanDerWaalsContact O-SG 3.4Å
156	E	93.1	Very high	92.4	Very high	122 Å²	122	104.5 Å²	104.5	57%	0.57	50%	0.501	S	S	*	.	H	α-helix	trans	-62.2	-38.4	177	-73.9	179.8	-172.8	0	0	112.2	L152 I153 K160	L152-E156 WeakPolarHBondContact O-CG 3.38Å; L152-E156 PolarHBondContact O-N 3.5Å; I153-E156 PolarHBondContact O-N 2.9Å; E156-K160 WeakPolarHBondContact O-CG 3.11Å; E156-K160 PolarHBondContact O-N 3.39Å
157	R	91.4	Very high	92.4	Very high	121 Å²	121	102.2 Å²	102.2	46%	0.457	49%	0.493	S	S	.	.	H	α-helix	trans	-63.3	-49.1	174.2	-174	-178	68.7	-124.3	-11.4	111.1	I153 D154 I155 C159 K160 E161	I153-R157 WeakPolarHBondContact O-CB 3.44Å; I153-R157 PolarHBondContact O-N 3.47Å; D154-R157 PolarHBondContact O-N 2.96Å; D154-R157 IonicContact OD1-CZ 3.3Å; D154-R157 IonicContact OD1-NH1 3.8Å; D154-R157 PolarHBondContact OD1-NH1 3.27Å; D154-R157 IonicContact OD1-NH2 2.89Å; D154-R157 PolarHBondContact OD1-NH2 2.73Å; I155-R157 VanDerWaalsContact C-N 3.31Å; I155-R157 PolarHBondContact O-N 3.45Å; R157-C159 VanDerWaalsContact C-N 3.34Å; R157-C159 PolarHBondContact O-N 3.15Å; R157-K160 PolarHBondContact O-N 2.9Å; R157-K160 VanDerWaalsContact O-N 3.15Å; R157-E161 WeakPolarHBondContact CG-OE1 3.5Å; R157-E161 IonicContact NE-OE1 2.94Å; R157-E161 WeakPolarHBondContact O-CG 3.47Å; R157-E161 PolarHBondContact O-N 2.77Å
158	L	92.5	Very high	92.3	Very high	96 Å²	96	101.7 Å²	101.7	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-63.1	-38.1	-179.7	-71.9	170.7	0	0	0	112.3	D154 I155 K160 E161 E162	D154-L158 WeakPolarHBondContact O-CB 3.33Å; D154-L158 VanDerWaalsContact O-CG 3.24Å; D154-L158 WeakPolarHBondContact O-CG 3.41Å; D154-L158 PolarHBondContact O-N 3.42Å; I155-L158 PolarHBondContact O-N 2.91Å; L158-K160 VanDerWaalsContact C-N 3.34Å; L158-K160 PolarHBondContact O-N 2.83Å; L158-E161 PolarHBondContact O-N 2.98Å; L158-E162 WeakPolarHBondContact O-CB 3.42Å; L158-E162 PolarHBondContact O-N 3.03Å
159	C	93.3	Very high	92.3	Very high	57 Å²	57	100.9 Å²	100.9	39%	0.385	49%	0.492	S	S	.	.	H	α-helix	trans	-63.1	-38.7	174.1	-73.7	0	0	0	0	112.2	I155 R157 E162 E163	I155-C159 PolarHBondContact O-N 3.42Å; I155-C159 PolarHBondContact O-SG 3.47Å; I155-C159 VanDerWaalsContact O-SG 3.4Å; R157-C159 VanDerWaalsContact C-N 3.34Å; R157-C159 PolarHBondContact O-N 3.15Å; C159-E162 PolarHBondContact O-N 3.38Å; C159-E163 WeakPolarHBondContact O-CG 3.46Å; C159-E163 PolarHBondContact O-N 2.87Å
160	K	92.6	Very high	92.2	Very high	129 Å²	129	97 Å²	97	56%	0.561	49%	0.486	S	S	*	.	H	α-helix	trans	-67	-43.2	175	-70.8	175.7	-176.7	176.4	0	112	E156 R157 L158 E162 E163 E164	E156-K160 WeakPolarHBondContact O-CG 3.11Å; E156-K160 PolarHBondContact O-N 3.39Å; R157-K160 PolarHBondContact O-N 2.9Å; R157-K160 VanDerWaalsContact O-N 3.15Å; L158-K160 VanDerWaalsContact C-N 3.34Å; L158-K160 PolarHBondContact O-N 2.83Å; K160-E162 VanDerWaalsContact C-N 3.29Å; K160-E162 PolarHBondContact O-N 2.83Å; K160-E163 PolarHBondContact O-N 3.33Å; K160-E164 WeakPolarHBondContact O-CG 3.28Å; K160-E164 PolarHBondContact O-N 2.93Å
161	E	92.5	Very high	92.2	Very high	94 Å²	94	95 Å²	95	44%	0.439	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-38.7	175.2	-70.8	174.1	-167.9	0	0	111.3	R157 L158 E164 A165	R157-E161 WeakPolarHBondContact CG-OE1 3.5Å; R157-E161 IonicContact NE-OE1 2.94Å; R157-E161 WeakPolarHBondContact O-CG 3.47Å; R157-E161 PolarHBondContact O-N 2.77Å; L158-E161 PolarHBondContact O-N 2.98Å; E161-E164 PolarHBondContact O-N 3.33Å; E161-A165 WeakPolarHBondContact O-CB 3.04Å; E161-A165 PolarHBondContact O-N 3.3Å
162	E	92.6	Very high	92	Very high	120 Å²	120	99.2 Å²	99.2	56%	0.561	49%	0.494	S	S	*	.	H	α-helix	trans	-65.1	-43.5	174.4	-173.7	-174.8	-177.9	0	0	112	L158 C159 K160 E164 A165 N166	L158-E162 WeakPolarHBondContact O-CB 3.42Å; L158-E162 PolarHBondContact O-N 3.03Å; C159-E162 PolarHBondContact O-N 3.38Å; K160-E162 VanDerWaalsContact C-N 3.29Å; K160-E162 PolarHBondContact O-N 2.83Å; E162-E164 PolarHBondContact O-N 3.1Å; E162-A165 PolarHBondContact O-N 3.49Å; E162-N166 WeakPolarHBondContact O-CB 3.37Å; E162-N166 VanDerWaalsContact O-CG 3.3Å; E162-N166 PolarHBondContact O-N 3.11Å; E162-N166 PolarHBondContact O-ND2 2.98Å; E162-N166 VanDerWaalsContact O-ND2 3.14Å
163	E	92.4	Very high	91.8	Very high	119 Å²	119	100.6 Å²	100.6	56%	0.556	50%	0.499	S	S	*	.	H	α-helix	trans	-63.5	-38.7	175.7	-75.2	178.3	-177.9	0	0	112.6	C159 K160 R167	C159-E163 WeakPolarHBondContact O-CG 3.46Å; C159-E163 PolarHBondContact O-N 2.87Å; K160-E163 PolarHBondContact O-N 3.33Å; E163-R167 WeakPolarHBondContact O-CG 3.4Å; E163-R167 PolarHBondContact O-N 3.48Å; E163-R167 PolarHBondContact O-NE 2.9Å
164	E	91.5	Very high	91.8	Very high	100 Å²	100	104.7 Å²	104.7	47%	0.467	51%	0.507	S	S	.	.	H	α-helix	trans	-64.8	-49.7	174.2	-74.2	176.2	-177.7	0	0	111.4	K160 E161 E162 N166 R167 D168	K160-E164 WeakPolarHBondContact O-CG 3.28Å; K160-E164 PolarHBondContact O-N 2.93Å; E161-E164 PolarHBondContact O-N 3.33Å; E162-E164 PolarHBondContact O-N 3.1Å; E164-N166 VanDerWaalsContact C-N 3.29Å; E164-N166 PolarHBondContact O-N 3.19Å; E164-R167 WeakPolarHBondContact O-CB 3.38Å; E164-R167 PolarHBondContact O-N 3.3Å; E164-R167 VanDerWaalsContact O-N 3.14Å; E164-D168 PolarHBondContact O-N 2.96Å
165	A	91	Very high	91.7	Very high	57 Å²	57	106.4 Å²	106.4	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-60.2	-38.8	177.2	0	0	0	0	0	112.3	E161 E162 D168 L169	E161-A165 WeakPolarHBondContact O-CB 3.04Å; E161-A165 PolarHBondContact O-N 3.3Å; E162-A165 PolarHBondContact O-N 3.49Å; A165-D168 PolarHBondContact O-N 3.18Å; A165-L169 VanDerWaalsContact O-CB 3.29Å; A165-L169 WeakPolarHBondContact O-CB 3.36Å; A165-L169 PolarHBondContact O-N 2.97Å
166	N	92.5	Very high	91.6	Very high	90 Å²	90	106.7 Å²	106.7	48%	0.481	52%	0.515	S	S	.	.	H	α-helix	trans	-67.7	-36.9	176	-79.4	-36.2	0	0	0	112.6	E162 E164 L169 A170	E162-N166 WeakPolarHBondContact O-CB 3.37Å; E162-N166 VanDerWaalsContact O-CG 3.3Å; E162-N166 PolarHBondContact O-N 3.11Å; E162-N166 PolarHBondContact O-ND2 2.98Å; E162-N166 VanDerWaalsContact O-ND2 3.14Å; E164-N166 VanDerWaalsContact C-N 3.29Å; E164-N166 PolarHBondContact O-N 3.19Å; N166-L169 PolarHBondContact O-N 3.36Å; N166-A170 PolarHBondContact O-N 3.24Å
167	R	90.4	Very high	91.5	Very high	144 Å²	144	107.1 Å²	107.1	54%	0.543	52%	0.517	S	S	.	.	H	α-helix	trans	-64.9	-44.4	173.5	-81.1	-178.4	-87.7	120.7	-11.4	111.6	E163 E164 A170 C171	E163-R167 WeakPolarHBondContact O-CG 3.4Å; E163-R167 PolarHBondContact O-N 3.48Å; E163-R167 PolarHBondContact O-NE 2.9Å; E164-R167 WeakPolarHBondContact O-CB 3.38Å; E164-R167 PolarHBondContact O-N 3.3Å; E164-R167 VanDerWaalsContact O-N 3.14Å; R167-A170 PolarHBondContact O-N 3.46Å; R167-C171 PolarHBondContact O-N 3.35Å
168	D	90.7	Very high	91.5	Very high	96 Å²	96	105.7 Å²	105.7	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-63.7	-44	176.4	-73	-12.8	0	0	0	110.9	E164 A165 A170 C171 W172	E164-D168 PolarHBondContact O-N 2.96Å; A165-D168 PolarHBondContact O-N 3.18Å; D168-A170 VanDerWaalsContact C-N 3.34Å; D168-A170 PolarHBondContact O-N 2.92Å; D168-C171 WeakPolarHBondContact O-CB 3.33Å; D168-C171 PolarHBondContact O-N 3.15Å; D168-C171 VanDerWaalsContact O-N 3.11Å; D168-W172 PolarHBondContact O-N 3.48Å
169	L	91.4	Very high	91.4	Very high	94 Å²	94	105.2 Å²	105.2	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-59.1	-43.2	177	-168.7	117.6	0	0	0	111.9	A165 N166 C171 W172 Q173	A165-L169 VanDerWaalsContact O-CB 3.29Å; A165-L169 WeakPolarHBondContact O-CB 3.36Å; A165-L169 PolarHBondContact O-N 2.97Å; N166-L169 PolarHBondContact O-N 3.36Å; L169-C171 VanDerWaalsContact C-N 3.34Å; L169-C171 PolarHBondContact O-N 3.06Å; L169-W172 PolarHBondContact O-N 3.49Å; L169-Q173 WeakPolarHBondContact O-CB 3.39Å; L169-Q173 VanDerWaalsContact O-CG 3.27Å; L169-Q173 WeakPolarHBondContact O-CG 3.48Å; L169-Q173 PolarHBondContact O-N 3.38Å
170	A	91.2	Very high	91.3	Very high	53 Å²	53	106.7 Å²	106.7	44%	0.438	52%	0.517	S	S	.	.	H	α-helix	trans	-63.8	-38.3	175.1	0	0	0	0	0	112.4	N166 R167 D168 Q173 R174	N166-A170 PolarHBondContact O-N 3.24Å; R167-A170 PolarHBondContact O-N 3.46Å; D168-A170 VanDerWaalsContact C-N 3.34Å; D168-A170 PolarHBondContact O-N 2.92Å; A170-Q173 PolarHBondContact O-N 3.37Å; A170-R174 PolarHBondContact O-N 2.84Å; A170-R174 VanDerWaalsContact O-N 3.08Å
171	C	91.9	Very high	91.3	Very high	83 Å²	83	106.7 Å²	106.7	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-62.9	-47.2	174.5	-173	0	0	0	0	111.4	R167 D168 L169 R174 K175	R167-C171 PolarHBondContact O-N 3.35Å; D168-C171 WeakPolarHBondContact O-CB 3.33Å; D168-C171 PolarHBondContact O-N 3.15Å; D168-C171 VanDerWaalsContact O-N 3.11Å; L169-C171 VanDerWaalsContact C-N 3.34Å; L169-C171 PolarHBondContact O-N 3.06Å; C171-R174 PolarHBondContact O-N 2.76Å; C171-K175 PolarHBondContact O-N 2.79Å
172	W	88.8	Confident	91.3	Very high	180 Å²	180	106.4 Å²	106.4	68%	0.682	52%	0.515	S	S	*	.	H	α-helix	trans	-66.8	-36.6	177.9	-71.2	116.3	0	0	0	112.7	D168 L169 K175 N176	D168-W172 PolarHBondContact O-N 3.48Å; L169-W172 PolarHBondContact O-N 3.49Å; W172-K175 PolarHBondContact O-N 2.82Å; W172-N176 VanDerWaalsContact O-CB 3.32Å; W172-N176 WeakPolarHBondContact O-CB 3.49Å; W172-N176 PolarHBondContact O-N 2.8Å
173	Q	90.7	Very high	91.2	Very high	109 Å²	109	105.1 Å²	105.1	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-60	-47.7	172.6	-78.9	174.6	-16.5	0	0	111.4	L169 A170 K175 N176 E177	L169-Q173 WeakPolarHBondContact O-CB 3.39Å; L169-Q173 VanDerWaalsContact O-CG 3.27Å; L169-Q173 WeakPolarHBondContact O-CG 3.48Å; L169-Q173 PolarHBondContact O-N 3.38Å; A170-Q173 PolarHBondContact O-N 3.37Å; Q173-K175 VanDerWaalsContact C-N 3.31Å; Q173-K175 PolarHBondContact O-N 3.3Å; Q173-N176 PolarHBondContact O-N 3.37Å; Q173-E177 WeakPolarHBondContact O-CG 3.47Å; Q173-E177 PolarHBondContact O-N 3.09Å
174	R	91.6	Very high	91.1	Very high	194 Å²	194	103.5 Å²	103.5	73%	0.732	51%	0.507	S	S	*	.	H	α-helix	trans	-61.4	-40.1	176.6	-168.8	-179.3	-176.2	96.7	0.5	112	A170 C171 N176 E177 E178	A170-R174 PolarHBondContact O-N 2.84Å; A170-R174 VanDerWaalsContact O-N 3.08Å; C171-R174 PolarHBondContact O-N 2.76Å; R174-N176 VanDerWaalsContact C-N 3.35Å; R174-E177 PolarHBondContact O-N 3.18Å; R174-E178 PolarHBondContact O-N 2.81Å
175	K	90.2	Very high	91.1	Very high	88 Å²	88	102.7 Å²	102.7	38%	0.383	50%	0.503	S	S	.	.	H	α-helix	trans	-67.3	-37.7	176.6	-169.2	68.2	-163.8	167	0	112	C171 W172 Q173 E178 L179	C171-K175 PolarHBondContact O-N 2.79Å; W172-K175 PolarHBondContact O-N 2.82Å; Q173-K175 VanDerWaalsContact C-N 3.31Å; Q173-K175 PolarHBondContact O-N 3.3Å; K175-E178 IonicContact NZ-OE1 2.76Å; K175-E178 IonicContact NZ-OE2 2.68Å; K175-E178 PolarHBondContact NZ-OE2 3.25Å; K175-E178 PolarHBondContact O-N 3.36Å; K175-L179 HydrophobicContact CG-CD1 4.33Å; K175-L179 WeakPolarHBondContact O-CG 3.38Å; K175-L179 PolarHBondContact O-N 3.32Å
176	N	90.5	Very high	91	Very high	95 Å²	95	104.4 Å²	104.4	51%	0.508	50%	0.504	S	S	.	.	H	α-helix	trans	-67.2	-40.9	176.5	-164.2	41.4	0	0	0	111.5	W172 Q173 R174 E178 L179 L180	W172-N176 VanDerWaalsContact O-CB 3.32Å; W172-N176 WeakPolarHBondContact O-CB 3.49Å; W172-N176 PolarHBondContact O-N 2.8Å; Q173-N176 PolarHBondContact O-N 3.37Å; R174-N176 VanDerWaalsContact C-N 3.35Å; N176-E178 VanDerWaalsContact C-N 3.35Å; N176-E178 PolarHBondContact O-N 2.89Å; N176-L179 PolarHBondContact O-N 2.47Å; N176-L180 WeakPolarHBondContact O-CB 3.34Å; N176-L180 VanDerWaalsContact O-CG 3.26Å; N176-L180 WeakPolarHBondContact O-CG 3.45Å; N176-L180 PolarHBondContact O-N 2.74Å
177	E	91.6	Very high	90.9	Very high	131 Å²	131	105 Å²	105	61%	0.612	50%	0.504	S	S	*	.	H	α-helix	trans	-60.2	-42.8	172.3	-73.1	173.2	-179.9	0	0	112	Q173 R174 L180 F181	Q173-E177 WeakPolarHBondContact O-CG 3.47Å; Q173-E177 PolarHBondContact O-N 3.09Å; R174-E177 PolarHBondContact O-N 3.18Å; E177-L180 PolarHBondContact O-N 2.85Å; E177-F181 WeakPolarHBondContact O-CB 3.21Å; E177-F181 PolarHBondContact O-N 3.4Å
178	E	92.2	Very high	91	Very high	91 Å²	91	103.5 Å²	103.5	43%	0.425	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-44	175.7	-171.3	-172.2	-174.1	0	0	111.9	R174 K175 N176 F181 Q182	R174-E178 PolarHBondContact O-N 2.81Å; K175-E178 IonicContact NZ-OE1 2.76Å; K175-E178 IonicContact NZ-OE2 2.68Å; K175-E178 PolarHBondContact NZ-OE2 3.25Å; K175-E178 PolarHBondContact O-N 3.36Å; N176-E178 VanDerWaalsContact C-N 3.35Å; N176-E178 PolarHBondContact O-N 2.89Å; E178-F181 WeakPolarHBondContact O-CB 3.3Å; E178-F181 PolarHBondContact O-N 3.27Å; E178-Q182 WeakPolarHBondContact O-CG 3.41Å; E178-Q182 PolarHBondContact O-N 3.22Å
179	L	89.5	Confident	91	Very high	86 Å²	86	104.3 Å²	104.3	45%	0.45	51%	0.506	S	S	.	.	H	α-helix	trans	-66.5	-39.4	177.7	-73.3	170.8	0	0	0	112	K175 N176 F181 Q182 L183	K175-L179 HydrophobicContact CG-CD1 4.33Å; K175-L179 WeakPolarHBondContact O-CG 3.38Å; K175-L179 PolarHBondContact O-N 3.32Å; N176-L179 PolarHBondContact O-N 2.47Å; L179-F181 VanDerWaalsContact C-N 3.33Å; L179-Q182 PolarHBondContact O-N 3.48Å; L179-L183 WeakPolarHBondContact O-CB 3.43Å; L179-L183 PolarHBondContact O-N 3.15Å
180	L	90.9	Very high	90.9	Very high	88 Å²	88	109 Å²	109	46%	0.461	52%	0.517	S	S	.	.	H	α-helix	trans	-64	-38.9	173.5	-74.8	170.4	0	0	0	111.5	N176 E177 L183 N184	N176-L180 WeakPolarHBondContact O-CB 3.34Å; N176-L180 VanDerWaalsContact O-CG 3.26Å; N176-L180 WeakPolarHBondContact O-CG 3.45Å; N176-L180 PolarHBondContact O-N 2.74Å; E177-L180 PolarHBondContact O-N 2.85Å; L180-L183 PolarHBondContact O-N 2.93Å; L180-N184 PolarHBondContact O-N 3.42Å
181	F	93.2	Very high	90.7	Very high	128 Å²	128	110.8 Å²	110.8	56%	0.561	52%	0.522	S	S	*	.	H	α-helix	trans	-63.4	-45	174	-177.6	-94.9	0	0	0	111.8	E177 E178 L179 L183 N184 E185	E177-F181 WeakPolarHBondContact O-CB 3.21Å; E177-F181 PolarHBondContact O-N 3.4Å; E178-F181 WeakPolarHBondContact O-CB 3.3Å; E178-F181 PolarHBondContact O-N 3.27Å; L179-F181 VanDerWaalsContact C-N 3.33Å; F181-L183 VanDerWaalsContact C-N 3.34Å; F181-L183 PolarHBondContact O-N 3.01Å; F181-N184 PolarHBondContact O-N 3.35Å; F181-E185 HydrophobicContact CD1-CG 4.48Å; F181-E185 HydrophobicContact CE1-CG 3.96Å; F181-E185 WeakPolarHBondContact CE1-OE1 3.36Å; F181-E185 HydrophobicContact CZ-CG 4.18Å; F181-E185 PolarHBondContact O-N 3Å
182	Q	91.7	Very high	90.5	Very high	89 Å²	89	111.2 Å²	111.2	42%	0.416	52%	0.523	S	S	.	.	H	α-helix	trans	-63.7	-38.6	175.9	-71.2	176.5	8.5	0	0	112.4	E178 L179 E185 L186	E178-Q182 WeakPolarHBondContact O-CG 3.41Å; E178-Q182 PolarHBondContact O-N 3.22Å; L179-Q182 PolarHBondContact O-N 3.48Å; Q182-E185 PolarHBondContact O-N 3.29Å; Q182-L186 WeakPolarHBondContact O-CG 3.3Å; Q182-L186 PolarHBondContact O-N 2.89Å
183	L	90.6	Very high	90.5	Very high	92 Å²	92	105.5 Å²	105.5	48%	0.482	51%	0.51	S	S	.	.	H	α-helix	trans	-62.3	-49.1	175.8	-164.8	91.5	0	0	0	110.8	L179 L180 F181 E185 L186 E187	L179-L183 WeakPolarHBondContact O-CB 3.43Å; L179-L183 PolarHBondContact O-N 3.15Å; L180-L183 PolarHBondContact O-N 2.93Å; F181-L183 VanDerWaalsContact C-N 3.34Å; F181-L183 PolarHBondContact O-N 3.01Å; L183-E185 PolarHBondContact O-N 2.91Å; L183-L186 PolarHBondContact O-N 3.32Å; L183-L186 VanDerWaalsContact O-N 3.15Å; L183-E187 WeakPolarHBondContact O-CG 3.35Å; L183-E187 PolarHBondContact O-N 2.95Å
184	N	91.2	Very high	90.3	Very high	85 Å²	85	103.1 Å²	103.1	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-61.5	-42.3	177.6	-74.5	-16.7	0	0	0	111.9	L180 F181 L186 E187 D188	L180-N184 PolarHBondContact O-N 3.42Å; F181-N184 PolarHBondContact O-N 3.35Å; N184-L186 VanDerWaalsContact C-N 3.29Å; N184-L186 PolarHBondContact O-N 2.93Å; N184-E187 PolarHBondContact O-N 3.38Å; N184-D188 PolarHBondContact O-N 3.38Å
185	E	92.1	Very high	90.2	Very high	84 Å²	84	102.1 Å²	102.1	39%	0.393	50%	0.502	S	S	.	.	H	α-helix	trans	-60.4	-39.3	174.7	-88.2	-155.8	178.9	0	0	112.6	F181 Q182 L183 K189	F181-E185 HydrophobicContact CD1-CG 4.48Å; F181-E185 HydrophobicContact CE1-CG 3.96Å; F181-E185 WeakPolarHBondContact CE1-OE1 3.36Å; F181-E185 HydrophobicContact CZ-CG 4.18Å; F181-E185 PolarHBondContact O-N 3Å; Q182-E185 PolarHBondContact O-N 3.29Å; L183-E185 PolarHBondContact O-N 2.91Å; E185-K189 WeakPolarHBondContact O-CB 3.47Å; E185-K189 WeakPolarHBondContact O-CD 3.25Å; E185-K189 WeakPolarHBondContact O-CG 3.44Å; E185-K189 PolarHBondContact O-N 2.9Å; E185-K189 VanDerWaalsContact O-N 3.09Å; E185-K189 IonicContact OE2-NZ 3.56Å; E185-K189 PolarHBondContact OE2-NZ 3.34Å
186	L	88.7	Confident	90.1	Very high	93 Å²	93	103.2 Å²	103.2	49%	0.487	51%	0.511	S	S	.	.	H	α-helix	trans	-68.3	-45.2	176.5	-72.7	171.8	0	0	0	110.3	Q182 L183 N184 D188 K189 W190	Q182-L186 WeakPolarHBondContact O-CG 3.3Å; Q182-L186 PolarHBondContact O-N 2.89Å; L183-L186 PolarHBondContact O-N 3.32Å; L183-L186 VanDerWaalsContact O-N 3.15Å; N184-L186 VanDerWaalsContact C-N 3.29Å; N184-L186 PolarHBondContact O-N 2.93Å; L186-D188 VanDerWaalsContact C-N 3.34Å; L186-D188 PolarHBondContact O-N 2.93Å; L186-K189 PolarHBondContact O-N 3.36Å; L186-K189 VanDerWaalsContact O-N 3.17Å; L186-W190 WeakPolarHBondContact O-CB 3.33Å; L186-W190 PolarHBondContact O-N 3.41Å
187	E	90.1	Very high	89.8	Confident	103 Å²	103	104.1 Å²	104.1	48%	0.481	51%	0.513	S	S	.	.	H	α-helix	trans	-58.2	-42.2	176.1	-75.3	-177.6	-178.7	0	0	112.4	L183 N184 W190 T191	L183-E187 WeakPolarHBondContact O-CG 3.35Å; L183-E187 PolarHBondContact O-N 2.95Å; N184-E187 PolarHBondContact O-N 3.38Å; E187-W190 PolarHBondContact O-N 2.97Å; E187-T191 WeakPolarHBondContact O-CB 3.05Å; E187-T191 PolarHBondContact O-N 3.06Å; E187-T191 PolarHBondContact O-OG1 2.87Å
188	D	92.2	Very high	89.5	Confident	112 Å²	112	103.6 Å²	103.6	60%	0.599	51%	0.51	S	S	*	.	H	α-helix	trans	-63.9	-42.3	174.6	-77.4	-22.4	0	0	0	111.9	N184 L186 T191 T192	N184-D188 PolarHBondContact O-N 3.38Å; L186-D188 VanDerWaalsContact C-N 3.34Å; L186-D188 PolarHBondContact O-N 2.93Å; D188-T191 PolarHBondContact O-N 2.76Å; D188-T192 WeakPolarHBondContact O-CB 3.17Å; D188-T192 WeakPolarHBondContact O-CG2 3.3Å; D188-T192 PolarHBondContact O-N 2.82Å; D188-T192 PolarHBondContact O-OG1 3.25Å
189	K	91.1	Very high	89.4	Confident	113 Å²	113	103 Å²	103	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-63.6	-41.8	175.2	-73.7	164.4	-170.7	154.1	0	111.6	E185 L186 T192 S193	E185-K189 WeakPolarHBondContact O-CB 3.47Å; E185-K189 WeakPolarHBondContact O-CD 3.25Å; E185-K189 WeakPolarHBondContact O-CG 3.44Å; E185-K189 PolarHBondContact O-N 2.9Å; E185-K189 VanDerWaalsContact O-N 3.09Å; E185-K189 IonicContact OE2-NZ 3.56Å; E185-K189 PolarHBondContact OE2-NZ 3.34Å; L186-K189 PolarHBondContact O-N 3.36Å; L186-K189 VanDerWaalsContact O-N 3.17Å; K189-T192 WeakPolarHBondContact CA-OG1 3.34Å; K189-T192 PolarHBondContact O-OG1 3.21Å; K189-S193 WeakPolarHBondContact O-CB 3.31Å; K189-S193 PolarHBondContact O-N 2.91Å
190	W	88.8	Confident	89.2	Confident	191 Å²	191	102.8 Å²	102.8	72%	0.723	51%	0.508	S	S	*	.	H	α-helix	trans	-65	-43.9	175.9	-83.4	107.2	0	0	0	111.6	L186 E187 T192 S193 S194	L186-W190 WeakPolarHBondContact O-CB 3.33Å; L186-W190 PolarHBondContact O-N 3.41Å; E187-W190 PolarHBondContact O-N 2.97Å; W190-T192 PolarHBondContact O-N 3.26Å; W190-S193 PolarHBondContact O-N 3.28Å; W190-S194 VanDerWaalsContact O-CB 3.3Å; W190-S194 WeakPolarHBondContact O-CB 3.34Å; W190-S194 PolarHBondContact O-N 3.4Å
191	T	86.3	Confident	89	Confident	91 Å²	91	103.8 Å²	103.8	56%	0.558	51%	0.513	S	S	*	.	H	α-helix	trans	-65.2	-41.1	-179.6	-55.3	0	0	0	0	111.4	E187 D188 R195	E187-T191 WeakPolarHBondContact O-CB 3.05Å; E187-T191 PolarHBondContact O-N 3.06Å; E187-T191 PolarHBondContact O-OG1 2.87Å; D188-T191 PolarHBondContact O-N 2.76Å; T191-R195 VanDerWaalsContact O-CB 3.25Å; T191-R195 WeakPolarHBondContact O-CB 3.31Å; T191-R195 PolarHBondContact O-N 3.5Å
192	T	89.3	Confident	88.7	Confident	92 Å²	92	102 Å²	102	56%	0.564	51%	0.506	S	S	*	.	H	α-helix	trans	-68.9	-41.9	175.8	49.9	0	0	0	0	112.4	D188 K189 W190 R195 L196	D188-T192 WeakPolarHBondContact O-CB 3.17Å; D188-T192 WeakPolarHBondContact O-CG2 3.3Å; D188-T192 PolarHBondContact O-N 2.82Å; D188-T192 PolarHBondContact O-OG1 3.25Å; K189-T192 WeakPolarHBondContact CA-OG1 3.34Å; K189-T192 PolarHBondContact O-OG1 3.21Å; W190-T192 PolarHBondContact O-N 3.26Å; T192-R195 PolarHBondContact O-N 2.87Å; T192-L196 PolarHBondContact O-N 2.97Å
193	S	87.7	Confident	88.6	Confident	60 Å²	60	102.1 Å²	102.1	42%	0.42	51%	0.51	S	S	.	.	H	α-helix	trans	-64.9	-46.5	175.9	-163.5	0	0	0	0	111.9	K189 W190 R195 L196 E197	K189-S193 WeakPolarHBondContact O-CB 3.31Å; K189-S193 PolarHBondContact O-N 2.91Å; W190-S193 PolarHBondContact O-N 3.28Å; S193-R195 VanDerWaalsContact C-N 3.32Å; S193-R195 PolarHBondContact O-N 3.07Å; S193-L196 PolarHBondContact O-N 2.92Å; S193-L196 VanDerWaalsContact O-N 3.16Å; S193-E197 PolarHBondContact O-N 2.94Å
194	S	86.5	Confident	88.5	Confident	60 Å²	60	104.2 Å²	104.2	42%	0.42	52%	0.517	S	S	.	.	H	α-helix	trans	-58.9	-44.4	176.8	-166.6	0	0	0	0	111.2	W190 L196 E197 E198	W190-S194 VanDerWaalsContact O-CB 3.3Å; W190-S194 WeakPolarHBondContact O-CB 3.34Å; W190-S194 PolarHBondContact O-N 3.4Å; S194-L196 VanDerWaalsContact C-N 3.33Å; S194-L196 PolarHBondContact O-N 3.49Å; S194-E197 PolarHBondContact O-N 2.76Å; S194-E198 WeakPolarHBondContact O-CB 3.37Å; S194-E198 WeakPolarHBondContact O-CG 3.22Å; S194-E198 PolarHBondContact O-N 3.43Å; S194-E198 PolarHBondContact OG-OE1 3.23Å
195	R	89.6	Confident	88.2	Confident	173 Å²	173	103.3 Å²	103.3	65%	0.653	52%	0.517	S	S	*	.	H	α-helix	trans	-62.6	-38.3	176.7	-176.1	176.5	-180	178.8	0.9	112.7	T191 T192 S193 L199	T191-R195 VanDerWaalsContact O-CB 3.25Å; T191-R195 WeakPolarHBondContact O-CB 3.31Å; T191-R195 PolarHBondContact O-N 3.5Å; T192-R195 PolarHBondContact O-N 2.87Å; S193-R195 VanDerWaalsContact C-N 3.32Å; S193-R195 PolarHBondContact O-N 3.07Å; R195-L199 HydrophobicContact CG-CD1 4.36Å; R195-L199 WeakPolarHBondContact O-CB 3.43Å; R195-L199 WeakPolarHBondContact O-CG 3.46Å; R195-L199 PolarHBondContact O-N 3.12Å; R195-L199 VanDerWaalsContact O-N 3.08Å
196	L	88.9	Confident	88.1	Confident	110 Å²	110	103.8 Å²	103.8	58%	0.576	52%	0.518	S	S	*	.	H	α-helix	trans	-66.7	-43.6	176.3	-172.7	71.2	0	0	0	111	T192 S193 S194 L199 L200	T192-L196 PolarHBondContact O-N 2.97Å; S193-L196 PolarHBondContact O-N 2.92Å; S193-L196 VanDerWaalsContact O-N 3.16Å; S194-L196 VanDerWaalsContact C-N 3.33Å; S194-L196 PolarHBondContact O-N 3.49Å; L196-L199 PolarHBondContact O-N 3.48Å; L196-L200 HydrophobicContact CG-CD1 4.44Å; L196-L200 WeakPolarHBondContact O-CG 3.43Å; L196-L200 PolarHBondContact O-N 3.19Å
197	E	83.9	Confident	87.9	Confident	115 Å²	115	100.9 Å²	100.9	54%	0.537	51%	0.51	S	S	.	.	H	α-helix	trans	-61.6	-45.5	176.7	-148.9	93.9	-145.8	0	0	111.1	S193 S194 L199 L200 I201	S193-E197 PolarHBondContact O-N 2.94Å; S194-E197 PolarHBondContact O-N 2.76Å; E197-L199 PolarHBondContact O-N 2.95Å; E197-L200 WeakPolarHBondContact O-CB 3.42Å; E197-L200 PolarHBondContact O-N 3.45Å; E197-I201 HydrophobicContact CG-CD1 4.46Å; E197-I201 VanDerWaalsContact O-CG1 3.28Å; E197-I201 WeakPolarHBondContact O-CG1 3.42Å; E197-I201 PolarHBondContact O-N 3.46Å
198	E	85.1	Confident	87.8	Confident	119 Å²	119	101 Å²	101	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-59.6	-44.7	176.1	-76.8	169.1	-158.4	0	0	112	S194 L200 I201 E202	S194-E198 WeakPolarHBondContact O-CB 3.37Å; S194-E198 WeakPolarHBondContact O-CG 3.22Å; S194-E198 PolarHBondContact O-N 3.43Å; S194-E198 PolarHBondContact OG-OE1 3.23Å; E198-L200 VanDerWaalsContact C-N 3.34Å; E198-L200 PolarHBondContact O-N 3.23Å; E198-I201 PolarHBondContact O-N 3.25Å; E198-E202 WeakPolarHBondContact O-CB 3.29Å; E198-E202 PolarHBondContact O-N 2.9Å
199	L	89.5	Confident	87.6	Confident	79 Å²	79	101.3 Å²	101.3	41%	0.414	51%	0.512	S	S	.	.	H	α-helix	trans	-63.7	-37.9	175.3	-78.7	166.6	0	0	0	112.4	R195 L196 E197 E202 N203	R195-L199 HydrophobicContact CG-CD1 4.36Å; R195-L199 WeakPolarHBondContact O-CB 3.43Å; R195-L199 WeakPolarHBondContact O-CG 3.46Å; R195-L199 PolarHBondContact O-N 3.12Å; R195-L199 VanDerWaalsContact O-N 3.08Å; L196-L199 PolarHBondContact O-N 3.48Å; E197-L199 PolarHBondContact O-N 2.95Å; L199-E202 PolarHBondContact O-N 2.98Å; L199-N203 WeakPolarHBondContact O-CB 3.5Å; L199-N203 VanDerWaalsContact O-CG 3.31Å; L199-N203 PolarHBondContact O-N 2.98Å; L199-N203 PolarHBondContact O-ND2 3.39Å
200	L	86.3	Confident	87.4	Confident	81 Å²	81	102.2 Å²	102.2	42%	0.424	52%	0.518	S	S	.	.	H	α-helix	trans	-65.4	-45	175.4	-73.8	170.1	0	0	0	111	L196 E197 E198 E202 N203 H204	L196-L200 HydrophobicContact CG-CD1 4.44Å; L196-L200 WeakPolarHBondContact O-CG 3.43Å; L196-L200 PolarHBondContact O-N 3.19Å; E197-L200 WeakPolarHBondContact O-CB 3.42Å; E197-L200 PolarHBondContact O-N 3.45Å; E198-L200 VanDerWaalsContact C-N 3.34Å; E198-L200 PolarHBondContact O-N 3.23Å; L200-E202 VanDerWaalsContact C-N 3.34Å; L200-E202 PolarHBondContact O-N 3.44Å; L200-N203 PolarHBondContact O-N 3.5Å; L200-H204 WeakPolarHBondContact O-CB 3.24Å; L200-H204 VanDerWaalsContact O-CG 3.3Å; L200-H204 PolarHBondContact O-N 2.99Å; L200-H204 PolarHBondContact O-ND1 2.74Å
201	I	86	Confident	87.3	Confident	110 Å²	110	99 Å²	99	56%	0.564	51%	0.514	S	S	*	.	H	α-helix	trans	-61.4	-42.9	176	-67.5	164.9	0	0	0	110.7	E197 E198 N203 H204 S205	E197-I201 HydrophobicContact CG-CD1 4.46Å; E197-I201 VanDerWaalsContact O-CG1 3.28Å; E197-I201 WeakPolarHBondContact O-CG1 3.42Å; E197-I201 PolarHBondContact O-N 3.46Å; E198-I201 PolarHBondContact O-N 3.25Å; I201-N203 PolarHBondContact O-N 3.27Å; I201-H204 PolarHBondContact O-N 2.87Å; I201-S205 WeakPolarHBondContact O-CB 3.43Å; I201-S205 PolarHBondContact O-N 3.38Å; I201-S205 PolarHBondContact O-OG 3.35Å
202	E	88.1	Confident	87.4	Confident	89 Å²	89	99.7 Å²	99.7	42%	0.416	51%	0.511	S	S	.	.	H	α-helix	trans	-63.6	-39.8	176.3	-164.6	-169.1	161.9	0	0	111.9	E198 L199 L200 S205 K206	E198-E202 WeakPolarHBondContact O-CB 3.29Å; E198-E202 PolarHBondContact O-N 2.9Å; L199-E202 PolarHBondContact O-N 2.98Å; L200-E202 VanDerWaalsContact C-N 3.34Å; L200-E202 PolarHBondContact O-N 3.44Å; E202-S205 PolarHBondContact O-OG 2.84Å; E202-K206 WeakPolarHBondContact O-CG 3.2Å; E202-K206 PolarHBondContact O-N 3Å; E202-K206 VanDerWaalsContact OE1-CE 3.25Å; E202-K206 WeakPolarHBondContact OE1-CE 3.37Å; E202-K206 IonicContact OE1-NZ 2.76Å; E202-K206 PolarHBondContact OE1-NZ 3.09Å
203	N	89.2	Confident	87.4	Confident	93 Å²	93	99.8 Å²	99.8	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-66.9	-38.9	174.4	-76.2	-23.8	0	0	0	112	L199 L200 I201 G207	L199-N203 WeakPolarHBondContact O-CB 3.5Å; L199-N203 VanDerWaalsContact O-CG 3.31Å; L199-N203 PolarHBondContact O-N 2.98Å; L199-N203 PolarHBondContact O-ND2 3.39Å; L200-N203 PolarHBondContact O-N 3.5Å; I201-N203 PolarHBondContact O-N 3.27Å; N203-G207 PolarHBondContact O-N 3.43Å
204	H	87.7	Confident	87.3	Confident	136 Å²	136	102.5 Å²	102.5	63%	0.63	52%	0.517	S	S	*	.	H	α-helix	trans	-68.7	-37.8	177.9	-72.2	30.5	0	0	0	111.5	L200 I201 G207 L208	L200-H204 WeakPolarHBondContact O-CB 3.24Å; L200-H204 VanDerWaalsContact O-CG 3.3Å; L200-H204 PolarHBondContact O-N 2.99Å; L200-H204 PolarHBondContact O-ND1 2.74Å; I201-H204 PolarHBondContact O-N 2.87Å; H204-G207 PolarHBondContact O-N 3.1Å; H204-L208 WeakPolarHBondContact O-CB 3.27Å; H204-L208 PolarHBondContact O-N 2.73Å
205	S	85.9	Confident	87.3	Confident	65 Å²	65	104.5 Å²	104.5	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-67.8	-40.8	176.5	70.3	0	0	0	0	112	I201 E202 L208 Q209	I201-S205 WeakPolarHBondContact O-CB 3.43Å; I201-S205 PolarHBondContact O-N 3.38Å; I201-S205 PolarHBondContact O-OG 3.35Å; E202-S205 PolarHBondContact O-OG 2.84Å; S205-L208 PolarHBondContact O-N 3.38Å; S205-Q209 WeakPolarHBondContact O-CB 3.43Å; S205-Q209 PolarHBondContact O-N 3.42Å
206	K	89.1	Confident	87.3	Confident	94 Å²	94	99.9 Å²	99.9	41%	0.409	51%	0.508	S	S	.	.	H	α-helix	trans	-60.5	-47.8	171.3	-73.1	171.9	-174.1	164.2	0	111.7	E202 L208 Q209 E210	E202-K206 WeakPolarHBondContact O-CG 3.2Å; E202-K206 PolarHBondContact O-N 3Å; E202-K206 VanDerWaalsContact OE1-CE 3.25Å; E202-K206 WeakPolarHBondContact OE1-CE 3.37Å; E202-K206 IonicContact OE1-NZ 2.76Å; E202-K206 PolarHBondContact OE1-NZ 3.09Å; K206-L208 VanDerWaalsContact C-N 3.32Å; K206-L208 PolarHBondContact O-N 3.33Å; K206-Q209 PolarHBondContact O-N 2.92Å; K206-E210 WeakPolarHBondContact O-CG 3.48Å; K206-E210 PolarHBondContact O-N 3.33Å
207	G	85.4	Confident	87.1	Confident	32 Å²	32	101.3 Å²	101.3	33%	0.33	51%	0.507	S	S	.	.	H	α-helix	trans	-61.1	-38.8	177.1	0	0	0	0	0	113	N203 H204 E210 L211	N203-G207 PolarHBondContact O-N 3.43Å; H204-G207 PolarHBondContact O-N 3.1Å; G207-E210 PolarHBondContact O-N 3.04Å; G207-L211 WeakPolarHBondContact O-CB 3.38Å; G207-L211 PolarHBondContact O-N 2.88Å
208	L	87.8	Confident	87.3	Confident	106 Å²	106	99.7 Å²	99.7	56%	0.555	51%	0.505	S	S	*	.	H	α-helix	trans	-65.3	-43.8	175.2	-169.1	77.2	0	0	0	111.5	H204 S205 K206 E210 L211 E212	H204-L208 WeakPolarHBondContact O-CB 3.27Å; H204-L208 PolarHBondContact O-N 2.73Å; S205-L208 PolarHBondContact O-N 3.38Å; K206-L208 VanDerWaalsContact C-N 3.32Å; K206-L208 PolarHBondContact O-N 3.33Å; L208-E210 PolarHBondContact O-N 3.24Å; L208-L211 WeakPolarHBondContact O-CB 3.2Å; L208-L211 PolarHBondContact O-N 3.48Å; L208-E212 PolarHBondContact O-N 3.01Å
209	Q	87.1	Confident	87.3	Confident	118 Å²	118	99 Å²	99	55%	0.551	50%	0.5	S	S	*	.	H	α-helix	trans	-64.2	-39.9	178.1	-169.2	176	13.4	0	0	111.8	S205 K206 L211 E212 N213	S205-Q209 WeakPolarHBondContact O-CB 3.43Å; S205-Q209 PolarHBondContact O-N 3.42Å; K206-Q209 PolarHBondContact O-N 2.92Å; Q209-L211 VanDerWaalsContact C-N 3.35Å; Q209-E212 PolarHBondContact O-N 3.21Å; Q209-N213 WeakPolarHBondContact O-CB 3.3Å; Q209-N213 PolarHBondContact O-N 3.4Å; Q209-N213 PolarHBondContact O-ND2 3.26Å
210	E	88	Confident	87.2	Confident	132 Å²	132	101.2 Å²	101.2	62%	0.617	51%	0.508	S	S	*	.	H	α-helix	trans	-62	-42	171.9	-72.8	177.4	-173.8	0	0	111.8	K206 G207 L208 N213 L214	K206-E210 WeakPolarHBondContact O-CG 3.48Å; K206-E210 PolarHBondContact O-N 3.33Å; G207-E210 PolarHBondContact O-N 3.04Å; L208-E210 PolarHBondContact O-N 3.24Å; E210-N213 PolarHBondContact O-N 2.83Å; E210-L214 PolarHBondContact O-N 2.99Å
211	L	86.1	Confident	87.1	Confident	125 Å²	125	101.4 Å²	101.4	65%	0.654	51%	0.507	S	S	*	.	H	α-helix	trans	-66.1	-41.8	178.1	-143.4	94.3	0	0	0	112.2	G207 L208 Q209 L214 Q215	G207-L211 WeakPolarHBondContact O-CB 3.38Å; G207-L211 PolarHBondContact O-N 2.88Å; L208-L211 WeakPolarHBondContact O-CB 3.2Å; L208-L211 PolarHBondContact O-N 3.48Å; Q209-L211 VanDerWaalsContact C-N 3.35Å; L211-L214 PolarHBondContact O-N 3.42Å; L211-Q215 WeakPolarHBondContact O-CB 3.34Å; L211-Q215 PolarHBondContact O-N 3.36Å
212	E	87.6	Confident	86.9	Confident	105 Å²	105	99.7 Å²	99.7	49%	0.491	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-42.9	174.2	-79.5	-172.5	164.3	0	0	111.3	L208 Q209 L214 Q215 N216	L208-E212 PolarHBondContact O-N 3.01Å; Q209-E212 PolarHBondContact O-N 3.21Å; E212-L214 PolarHBondContact O-N 2.88Å; E212-Q215 PolarHBondContact O-N 3.16Å; E212-N216 WeakPolarHBondContact O-CB 3.5Å; E212-N216 VanDerWaalsContact O-CG 3.23Å; E212-N216 PolarHBondContact O-N 3.21Å; E212-N216 PolarHBondContact O-ND2 2.84Å
213	N	88.9	Confident	86.8	Confident	94 Å²	94	100.9 Å²	100.9	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-43.4	175.3	-72.1	-23.2	0	0	0	111.4	Q209 E210 N216 Y217	Q209-N213 WeakPolarHBondContact O-CB 3.3Å; Q209-N213 PolarHBondContact O-N 3.4Å; Q209-N213 PolarHBondContact O-ND2 3.26Å; E210-N213 PolarHBondContact O-N 2.83Å; N213-N216 PolarHBondContact O-N 3.05Å; N213-Y217 WeakPolarHBondContact O-CB 3.45Å; N213-Y217 PolarHBondContact O-N 3.33Å
214	L	86.9	Confident	86.6	Confident	116 Å²	116	100.7 Å²	100.7	61%	0.607	51%	0.51	S	S	*	.	H	α-helix	trans	-63.2	-43.3	174.8	-124.1	83.1	0	0	0	111.6	E210 L211 E212 N216 Y217 V218	E210-L214 PolarHBondContact O-N 2.99Å; L211-L214 PolarHBondContact O-N 3.42Å; E212-L214 PolarHBondContact O-N 2.88Å; L214-N216 VanDerWaalsContact C-N 3.33Å; L214-N216 PolarHBondContact O-N 3.45Å; L214-Y217 PolarHBondContact O-N 2.95Å; L214-V218 VanDerWaalsContact O-CG2 3.32Å; L214-V218 WeakPolarHBondContact O-CG2 3.31Å; L214-V218 PolarHBondContact O-N 3.43Å
215	Q	86.9	Confident	86.5	Confident	102 Å²	102	99.2 Å²	99.2	48%	0.477	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-42.8	178.7	-165.6	-164.5	37.4	0	0	110.9	L211 E212 V218 K219	L211-Q215 WeakPolarHBondContact O-CB 3.34Å; L211-Q215 PolarHBondContact O-N 3.36Å; E212-Q215 PolarHBondContact O-N 3.16Å; Q215-V218 PolarHBondContact O-N 3.13Å; Q215-K219 VanDerWaalsContact CD-NZ 3.27Å; Q215-K219 HydrophobicContact CG-CD 4.34Å; Q215-K219 WeakPolarHBondContact O-CB 3.2Å; Q215-K219 VanDerWaalsContact O-CG 3.26Å; Q215-K219 WeakPolarHBondContact O-CG 3.5Å; Q215-K219 PolarHBondContact O-N 3.33Å; Q215-K219 VanDerWaalsContact OE1-NZ 3.14Å
216	N	88	Confident	86.3	Confident	77 Å²	77	104.7 Å²	104.7	41%	0.412	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-40.8	176.5	-71.8	-25.9	0	0	0	111.5	E212 N213 L214 K219 Q220	E212-N216 WeakPolarHBondContact O-CB 3.5Å; E212-N216 VanDerWaalsContact O-CG 3.23Å; E212-N216 PolarHBondContact O-N 3.21Å; E212-N216 PolarHBondContact O-ND2 2.84Å; N213-N216 PolarHBondContact O-N 3.05Å; L214-N216 VanDerWaalsContact C-N 3.33Å; L214-N216 PolarHBondContact O-N 3.45Å; N216-K219 PolarHBondContact O-N 2.96Å; N216-Q220 WeakPolarHBondContact O-CB 3.44Å; N216-Q220 WeakPolarHBondContact O-CG 3.34Å; N216-Q220 PolarHBondContact O-N 2.95Å
217	Y	86.1	Confident	86.2	Confident	140 Å²	140	104.6 Å²	104.6	55%	0.549	52%	0.515	S	S	.	.	H	α-helix	trans	-60.7	-48.1	173.6	-179.7	-98.3	0	0	0	111.9	N213 L214 Q220 Q221	N213-Y217 WeakPolarHBondContact O-CB 3.45Å; N213-Y217 PolarHBondContact O-N 3.33Å; L214-Y217 PolarHBondContact O-N 2.95Å; Y217-Q220 PolarHBondContact O-N 3.45Å; Y217-Q221 HydrophobicContact CD1-CG 4.22Å; Y217-Q221 HydrophobicContact CE1-CG 3.83Å; Y217-Q221 HydrophobicContact CE2-CG 4.27Å; Y217-Q221 WeakPolarHBondContact O-CG 3.18Å; Y217-Q221 PolarHBondContact O-N 2.93Å; Y217-Q221 PolarHBondContact OH-NE2 2.98Å
218	V	86.9	Confident	86.3	Confident	81 Å²	81	109.3 Å²	109.3	49%	0.491	53%	0.528	S	S	.	.	H	α-helix	trans	-63.3	-44.2	177.7	172.1	0	0	0	0	111.3	L214 Q215 Q220 Q221 C222	L214-V218 VanDerWaalsContact O-CG2 3.32Å; L214-V218 WeakPolarHBondContact O-CG2 3.31Å; L214-V218 PolarHBondContact O-N 3.43Å; Q215-V218 PolarHBondContact O-N 3.13Å; V218-Q220 VanDerWaalsContact C-N 3.33Å; V218-Q220 PolarHBondContact O-N 2.89Å; V218-Q221 PolarHBondContact O-N 3.4Å; V218-C222 WeakPolarHBondContact O-CB 3.32Å; V218-C222 PolarHBondContact O-N 3.09Å; V218-C222 PolarHBondContact O-SG 3.33Å
219	K	85.2	Confident	86.2	Confident	103 Å²	103	111.9 Å²	111.9	45%	0.448	53%	0.531	S	S	.	.	H	α-helix	trans	-58	-45.6	175.4	-77.6	171.2	-179.4	166.4	0	111.3	Q215 N216 C222 I223	Q215-K219 VanDerWaalsContact CD-NZ 3.27Å; Q215-K219 HydrophobicContact CG-CD 4.34Å; Q215-K219 WeakPolarHBondContact O-CB 3.2Å; Q215-K219 VanDerWaalsContact O-CG 3.26Å; Q215-K219 WeakPolarHBondContact O-CG 3.5Å; Q215-K219 PolarHBondContact O-N 3.33Å; Q215-K219 VanDerWaalsContact OE1-NZ 3.14Å; N216-K219 PolarHBondContact O-N 2.96Å; K219-C222 PolarHBondContact O-N 3.43Å; K219-I223 WeakPolarHBondContact O-CD1 3.37Å; K219-I223 VanDerWaalsContact O-CG1 3.24Å; K219-I223 WeakPolarHBondContact O-CG1 3.39Å; K219-I223 PolarHBondContact O-N 3.4Å
220	Q	87.2	Confident	86.3	Confident	126 Å²	126	109.4 Å²	109.4	59%	0.589	52%	0.521	S	S	*	.	H	α-helix	trans	-64.4	-43.4	177.9	-76.4	178.9	1.8	0	0	112.3	N216 Y217 V218 I223 L224	N216-Q220 WeakPolarHBondContact O-CB 3.44Å; N216-Q220 WeakPolarHBondContact O-CG 3.34Å; N216-Q220 PolarHBondContact O-N 2.95Å; Y217-Q220 PolarHBondContact O-N 3.45Å; V218-Q220 VanDerWaalsContact C-N 3.33Å; V218-Q220 PolarHBondContact O-N 2.89Å; Q220-I223 PolarHBondContact O-N 3.13Å; Q220-L224 WeakPolarHBondContact O-CG 3.5Å; Q220-L224 PolarHBondContact O-N 3.43Å
221	Q	84.1	Confident	86.3	Confident	85 Å²	85	106.4 Å²	106.4	40%	0.397	51%	0.509	S	S	.	.	H	α-helix	trans	-62.4	-44.5	176.3	-71.7	-64.9	-17	0	0	111.9	Y217 V218 I223 L224 E225	Y217-Q221 HydrophobicContact CD1-CG 4.22Å; Y217-Q221 HydrophobicContact CE1-CG 3.83Å; Y217-Q221 HydrophobicContact CE2-CG 4.27Å; Y217-Q221 WeakPolarHBondContact O-CG 3.18Å; Y217-Q221 PolarHBondContact O-N 2.93Å; Y217-Q221 PolarHBondContact OH-NE2 2.98Å; V218-Q221 PolarHBondContact O-N 3.4Å; Q221-I223 VanDerWaalsContact C-N 3.31Å; Q221-I223 PolarHBondContact O-N 3.31Å; Q221-L224 PolarHBondContact O-N 2.93Å; Q221-E225 WeakPolarHBondContact O-CB 3.49Å; Q221-E225 PolarHBondContact O-N 3.38Å
222	C	82.9	Confident	86.5	Confident	74 Å²	74	102.9 Å²	102.9	50%	0.5	50%	0.498	S	S	.	.	H	α-helix	trans	-61.2	-38.7	175.9	-73.6	0	0	0	0	112.5	V218 K219 R226	V218-C222 WeakPolarHBondContact O-CB 3.32Å; V218-C222 PolarHBondContact O-N 3.09Å; V218-C222 PolarHBondContact O-SG 3.33Å; K219-C222 PolarHBondContact O-N 3.43Å; C222-R226 WeakPolarHBondContact O-CB 3.22Å; C222-R226 PolarHBondContact O-N 2.97Å
223	I	84.9	Confident	86.5	Confident	114 Å²	114	102 Å²	102	59%	0.585	50%	0.5	S	S	*	.	H	α-helix	trans	-66.9	-47.6	176.5	-69.3	164.7	0	0	0	110.3	K219 Q220 Q221 R226 Q227	K219-I223 WeakPolarHBondContact O-CD1 3.37Å; K219-I223 VanDerWaalsContact O-CG1 3.24Å; K219-I223 WeakPolarHBondContact O-CG1 3.39Å; K219-I223 PolarHBondContact O-N 3.4Å; Q220-I223 PolarHBondContact O-N 3.13Å; Q221-I223 VanDerWaalsContact C-N 3.31Å; Q221-I223 PolarHBondContact O-N 3.31Å; I223-R226 PolarHBondContact O-N 3.15Å; I223-Q227 WeakPolarHBondContact O-CB 3.34Å; I223-Q227 PolarHBondContact O-N 3.43Å
224	L	86.1	Confident	86.5	Confident	90 Å²	90	102.9 Å²	102.9	47%	0.471	50%	0.5	S	S	.	.	H	α-helix	trans	-62.1	-46	178.9	-76.4	166.7	0	0	0	112	Q220 Q221 R226 Q227 H228	Q220-L224 WeakPolarHBondContact O-CG 3.5Å; Q220-L224 PolarHBondContact O-N 3.43Å; Q221-L224 PolarHBondContact O-N 2.93Å; L224-R226 VanDerWaalsContact C-N 3.33Å; L224-R226 PolarHBondContact O-N 2.95Å; L224-Q227 WeakPolarHBondContact O-CB 2.99Å; L224-Q227 PolarHBondContact O-N 3.06Å; L224-H228 PolarHBondContact O-CD2 3.48Å; L224-H228 PolarHBondContact O-N 2.92Å
225	E	84.7	Confident	86.6	Confident	104 Å²	104	102.5 Å²	102.5	49%	0.486	50%	0.496	S	S	.	.	H	α-helix	trans	-64.3	-40.5	178.8	-163.4	-174.2	168.9	0	0	111.3	Q221 Q227 H228 R229	Q221-E225 WeakPolarHBondContact O-CB 3.49Å; Q221-E225 PolarHBondContact O-N 3.38Å; E225-Q227 VanDerWaalsContact C-N 3.35Å; E225-H228 PolarHBondContact O-N 3.3Å; E225-R229 WeakPolarHBondContact O-CG 3.42Å; E225-R229 PolarHBondContact O-N 2.84Å; E225-R229 IonicContact OE1-CZ 3.62Å; E225-R229 IonicContact OE1-NE 3.89Å; E225-R229 IonicContact OE1-NH2 2.73Å; E225-R229 PolarHBondContact OE1-NH2 2.96Å
226	R	83.5	Confident	86.8	Confident	181 Å²	181	103.8 Å²	103.8	68%	0.683	50%	0.502	S	S	*	.	H	α-helix	trans	-66.5	-37.1	175.1	-170.4	171	173.5	103.7	-1.7	111.7	C222 I223 L224 R229 I230	C222-R226 WeakPolarHBondContact O-CB 3.22Å; C222-R226 PolarHBondContact O-N 2.97Å; I223-R226 PolarHBondContact O-N 3.15Å; L224-R226 VanDerWaalsContact C-N 3.33Å; L224-R226 PolarHBondContact O-N 2.95Å; R226-R229 PolarHBondContact O-N 3.45Å; R226-I230 HydrophobicContact CG-CD1 4.18Å; R226-I230 VanDerWaalsContact O-CG1 3.25Å; R226-I230 WeakPolarHBondContact O-CG1 3.44Å; R226-I230 PolarHBondContact O-N 3.31Å
227	Q	85.9	Confident	86.9	Confident	92 Å²	92	104.4 Å²	104.4	43%	0.43	50%	0.504	S	S	.	.	H	α-helix	trans	-64.7	-47.7	175.8	-166.7	64.4	37.2	0	0	111.1	I223 L224 E225 R229 I230 D231	I223-Q227 WeakPolarHBondContact O-CB 3.34Å; I223-Q227 PolarHBondContact O-N 3.43Å; L224-Q227 WeakPolarHBondContact O-CB 2.99Å; L224-Q227 PolarHBondContact O-N 3.06Å; E225-Q227 VanDerWaalsContact C-N 3.35Å; Q227-R229 VanDerWaalsContact C-N 3.3Å; Q227-R229 PolarHBondContact O-N 3.39Å; Q227-I230 WeakPolarHBondContact O-CB 3.15Å; Q227-I230 PolarHBondContact O-N 2.96Å; Q227-D231 PolarHBondContact NE2-OD1 3.42Å; Q227-D231 PolarHBondContact O-N 3.17Å
228	H	87.6	Confident	87.1	Confident	130 Å²	130	104.6 Å²	104.6	60%	0.602	51%	0.512	S	S	*	.	H	α-helix	trans	-59.1	-39.2	175	-77.5	-60.2	0	0	0	112.8	L224 E225 D231 A232	L224-H228 PolarHBondContact O-CD2 3.48Å; L224-H228 PolarHBondContact O-N 2.92Å; E225-H228 PolarHBondContact O-N 3.3Å; H228-D231 PolarHBondContact O-N 2.99Å; H228-A232 WeakPolarHBondContact O-CB 3.43Å; H228-A232 PolarHBondContact O-N 3.09Å
229	R	86.7	Confident	87.3	Confident	161 Å²	161	106.4 Å²	106.4	61%	0.608	51%	0.513	S	S	*	.	H	α-helix	trans	-65.9	-39.5	174.2	-71.6	179.6	-168.8	-169.2	6	112.1	E225 R226 Q227 V233	E225-R229 WeakPolarHBondContact O-CG 3.42Å; E225-R229 PolarHBondContact O-N 2.84Å; E225-R229 IonicContact OE1-CZ 3.62Å; E225-R229 IonicContact OE1-NE 3.89Å; E225-R229 IonicContact OE1-NH2 2.73Å; E225-R229 PolarHBondContact OE1-NH2 2.96Å; R226-R229 PolarHBondContact O-N 3.45Å; Q227-R229 VanDerWaalsContact C-N 3.3Å; Q227-R229 PolarHBondContact O-N 3.39Å; R229-V233 VanDerWaalsContact O-CG2 3.28Å; R229-V233 WeakPolarHBondContact O-CG2 3.43Å; R229-V233 PolarHBondContact O-N 3.02Å
230	I	87.7	Confident	87.6	Confident	66 Å²	66	105.5 Å²	105.5	34%	0.338	52%	0.516	S	S	.	.	H	α-helix	trans	-64.1	-46.9	175.7	-72.1	166	0	0	0	110.3	R226 Q227 A232 V233 Q234	R226-I230 HydrophobicContact CG-CD1 4.18Å; R226-I230 VanDerWaalsContact O-CG1 3.25Å; R226-I230 WeakPolarHBondContact O-CG1 3.44Å; R226-I230 PolarHBondContact O-N 3.31Å; Q227-I230 WeakPolarHBondContact O-CB 3.15Å; Q227-I230 PolarHBondContact O-N 2.96Å; I230-A232 VanDerWaalsContact C-N 3.33Å; I230-A232 PolarHBondContact O-N 2.94Å; I230-V233 PolarHBondContact O-N 3.4Å; I230-Q234 HydrophobicContact CG2-CG 4.3Å; I230-Q234 WeakPolarHBondContact O-CB 3.38Å; I230-Q234 VanDerWaalsContact O-CG 3.3Å; I230-Q234 WeakPolarHBondContact O-CG 3.42Å; I230-Q234 PolarHBondContact O-N 2.9Å
231	D	89.1	Confident	87.7	Confident	69 Å²	69	104.6 Å²	104.6	37%	0.369	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-40.8	-179.4	-61.8	-15.6	0	0	0	111	Q227 H228 Q234 E235	Q227-D231 PolarHBondContact NE2-OD1 3.42Å; Q227-D231 PolarHBondContact O-N 3.17Å; H228-D231 PolarHBondContact O-N 2.99Å; D231-Q234 PolarHBondContact O-N 3.38Å; D231-E235 PolarHBondContact O-N 2.9Å
232	A	89.2	Confident	88.1	Confident	50 Å²	50	101.9 Å²	101.9	41%	0.413	51%	0.507	S	S	.	.	H	α-helix	trans	-62.6	-44.4	174.6	0	0	0	0	0	112.5	H228 I230 Q234 E235 E236	H228-A232 WeakPolarHBondContact O-CB 3.43Å; H228-A232 PolarHBondContact O-N 3.09Å; I230-A232 VanDerWaalsContact C-N 3.33Å; I230-A232 PolarHBondContact O-N 2.94Å; A232-Q234 VanDerWaalsContact C-N 3.33Å; A232-Q234 PolarHBondContact O-N 3.14Å; A232-E235 PolarHBondContact O-N 3.34Å; A232-E236 PolarHBondContact O-N 3.11Å
233	V	88.1	Confident	88.5	Confident	88 Å²	88	101.6 Å²	101.6	53%	0.533	51%	0.506	S	S	.	.	H	α-helix	trans	-65.9	-36.7	176	171.3	0	0	0	0	111.1	R229 I230 E236 L237	R229-V233 VanDerWaalsContact O-CG2 3.28Å; R229-V233 WeakPolarHBondContact O-CG2 3.43Å; R229-V233 PolarHBondContact O-N 3.02Å; I230-V233 PolarHBondContact O-N 3.4Å; V233-E236 PolarHBondContact O-N 3.04Å; V233-L237 WeakPolarHBondContact O-CB 3.38Å; V233-L237 PolarHBondContact O-N 2.87Å
234	Q	88.5	Confident	88.7	Confident	111 Å²	111	100 Å²	100	52%	0.519	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-39.4	174.6	-75.3	177.9	0.7	0	0	111.7	I230 D231 A232 L237 M238	I230-Q234 HydrophobicContact CG2-CG 4.3Å; I230-Q234 WeakPolarHBondContact O-CB 3.38Å; I230-Q234 VanDerWaalsContact O-CG 3.3Å; I230-Q234 WeakPolarHBondContact O-CG 3.42Å; I230-Q234 PolarHBondContact O-N 2.9Å; D231-Q234 PolarHBondContact O-N 3.38Å; A232-Q234 VanDerWaalsContact C-N 3.33Å; A232-Q234 PolarHBondContact O-N 3.14Å; Q234-L237 PolarHBondContact O-N 3.49Å; Q234-M238 PolarHBondContact O-N 3.14Å
235	E	89.8	Confident	89	Confident	109 Å²	109	98.9 Å²	98.9	51%	0.509	50%	0.495	S	S	.	.	H	α-helix	trans	-66.2	-43	175.9	-159.4	-166.2	145.1	0	0	111.7	D231 A232 L237 M238 K239	D231-E235 PolarHBondContact O-N 2.9Å; A232-E235 PolarHBondContact O-N 3.34Å; E235-L237 VanDerWaalsContact C-N 3.35Å; E235-M238 PolarHBondContact O-N 3.43Å; E235-K239 WeakPolarHBondContact O-CG 3.28Å; E235-K239 PolarHBondContact O-N 3.5Å; E235-K239 VanDerWaalsContact OE1-CE 3.27Å; E235-K239 WeakPolarHBondContact OE1-CE 3.41Å; E235-K239 IonicContact OE1-NZ 3.21Å; E235-K239 PolarHBondContact OE1-NZ 3.49Å
236	E	90.5	Very high	89.3	Confident	129 Å²	129	98.1 Å²	98.1	60%	0.603	49%	0.494	S	S	*	.	H	α-helix	trans	-62.6	-41.9	172.8	-74.1	-169.7	166.6	0	0	112	A232 V233 M238 K239 V240	A232-E236 PolarHBondContact O-N 3.11Å; V233-E236 PolarHBondContact O-N 3.04Å; E236-M238 VanDerWaalsContact C-N 3.33Å; E236-M238 PolarHBondContact O-N 3.08Å; E236-K239 WeakPolarHBondContact O-CB 3.48Å; E236-K239 PolarHBondContact O-N 3.5Å; E236-K239 VanDerWaalsContact O-N 3.15Å; E236-V240 WeakPolarHBondContact O-CG2 3.47Å; E236-V240 PolarHBondContact O-N 2.87Å
237	L	89.8	Confident	89.7	Confident	90 Å²	90	94.6 Å²	94.6	47%	0.471	49%	0.488	S	S	.	.	H	α-helix	trans	-63.1	-40.1	177.5	-170.3	149.2	0	0	0	111.1	V233 Q234 E235 V240 Q241	V233-L237 WeakPolarHBondContact O-CB 3.38Å; V233-L237 PolarHBondContact O-N 2.87Å; Q234-L237 PolarHBondContact O-N 3.49Å; E235-L237 VanDerWaalsContact C-N 3.35Å; L237-V240 PolarHBondContact O-N 2.97Å; L237-Q241 VanDerWaalsContact CD2-CD 3.42Å; L237-Q241 HydrophobicContact CD2-CG 4.11Å; L237-Q241 VanDerWaalsContact CD2-NE2 3.26Å; L237-Q241 VanDerWaalsContact O-CB 3.31Å; L237-Q241 WeakPolarHBondContact O-CB 3.38Å; L237-Q241 VanDerWaalsContact O-CG 3.24Å; L237-Q241 WeakPolarHBondContact O-CG 3.45Å; L237-Q241 PolarHBondContact O-N 2.87Å
238	M	91.5	Very high	90	Very high	143 Å²	143	95.4 Å²	95.4	70%	0.704	49%	0.492	S	S	*	.	H	α-helix	trans	-62.7	-41.9	171.4	-83.6	-166.8	173	0	0	112.4	Q234 E235 E236 Q241 G242	Q234-M238 PolarHBondContact O-N 3.14Å; E235-M238 PolarHBondContact O-N 3.43Å; E236-M238 VanDerWaalsContact C-N 3.33Å; E236-M238 PolarHBondContact O-N 3.08Å; M238-Q241 PolarHBondContact O-N 3.35Å; M238-G242 PolarHBondContact O-N 3.44Å
239	K	91.5	Very high	90.1	Very high	120 Å²	120	95.8 Å²	95.8	52%	0.522	49%	0.492	S	S	.	.	H	α-helix	trans	-63.3	-42.9	176.8	-72.7	169	-174.3	162.1	0	112	E235 E236 G242 S243	E235-K239 WeakPolarHBondContact O-CG 3.28Å; E235-K239 PolarHBondContact O-N 3.5Å; E235-K239 VanDerWaalsContact OE1-CE 3.27Å; E235-K239 WeakPolarHBondContact OE1-CE 3.41Å; E235-K239 IonicContact OE1-NZ 3.21Å; E235-K239 PolarHBondContact OE1-NZ 3.49Å; E236-K239 WeakPolarHBondContact O-CB 3.48Å; E236-K239 PolarHBondContact O-N 3.5Å; E236-K239 VanDerWaalsContact O-N 3.15Å; K239-G242 PolarHBondContact O-N 3.3Å; K239-S243 PolarHBondContact O-N 3.04Å; K239-S243 PolarHBondContact O-OG 3.38Å
240	V	90	Very high	90.4	Very high	84 Å²	84	96.5 Å²	96.5	51%	0.509	49%	0.494	S	S	.	.	H	α-helix	trans	-67.9	-43.9	177	174	0	0	0	0	110.8	E236 L237 G242 S243 I244	E236-V240 WeakPolarHBondContact O-CG2 3.47Å; E236-V240 PolarHBondContact O-N 2.87Å; L237-V240 PolarHBondContact O-N 2.97Å; V240-G242 VanDerWaalsContact C-N 3.33Å; V240-G242 PolarHBondContact O-N 2.95Å; V240-S243 WeakPolarHBondContact O-CB 3.45Å; V240-S243 PolarHBondContact O-N 3.09Å; V240-S243 VanDerWaalsContact O-N 3.17Å; V240-I244 HydrophobicContact CG1-CD1 3.94Å; V240-I244 HydrophobicContact CG1-CG1 4.42Å; V240-I244 WeakPolarHBondContact O-CG1 3.4Å; V240-I244 PolarHBondContact O-N 3.35Å
241	Q	90.1	Very high	90.6	Very high	106 Å²	106	101.5 Å²	101.5	50%	0.495	51%	0.509	S	S	.	.	H	α-helix	trans	-59	-43.7	174	-77.9	178.7	-15.4	0	0	111.7	L237 M238 S243 I244 T245	L237-Q241 VanDerWaalsContact CD2-CD 3.42Å; L237-Q241 HydrophobicContact CD2-CG 4.11Å; L237-Q241 VanDerWaalsContact CD2-NE2 3.26Å; L237-Q241 VanDerWaalsContact O-CB 3.31Å; L237-Q241 WeakPolarHBondContact O-CB 3.38Å; L237-Q241 VanDerWaalsContact O-CG 3.24Å; L237-Q241 WeakPolarHBondContact O-CG 3.45Å; L237-Q241 PolarHBondContact O-N 2.87Å; M238-Q241 PolarHBondContact O-N 3.35Å; Q241-S243 PolarHBondContact O-N 2.9Å; Q241-I244 PolarHBondContact O-N 3.44Å; Q241-T245 WeakPolarHBondContact O-CG2 3.35Å; Q241-T245 PolarHBondContact O-N 3.4Å
242	G	92.2	Very high	90.6	Very high	29 Å²	29	101.2 Å²	101.2	30%	0.299	51%	0.512	S	S	.	.	H	α-helix	trans	-56.5	-48.5	172.7	0	0	0	0	0	111.9	M238 K239 V240 I244 T245 D246	M238-G242 PolarHBondContact O-N 3.44Å; K239-G242 PolarHBondContact O-N 3.3Å; V240-G242 VanDerWaalsContact C-N 3.33Å; V240-G242 PolarHBondContact O-N 2.95Å; G242-I244 VanDerWaalsContact C-N 3.34Å; G242-I244 PolarHBondContact O-N 2.96Å; G242-T245 PolarHBondContact O-N 3.46Å; G242-T245 VanDerWaalsContact O-N 3.14Å; G242-T245 PolarHBondContact O-OG1 3.02Å; G242-D246 PolarHBondContact O-N 3.45Å
243	S	91.2	Very high	90.7	Very high	67 Å²	67	102.6 Å²	102.6	47%	0.469	52%	0.516	S	S	.	.	H	α-helix	trans	-61.3	-39.4	177.8	-57.7	0	0	0	0	112.7	K239 V240 Q241 D246 L247	K239-S243 PolarHBondContact O-N 3.04Å; K239-S243 PolarHBondContact O-OG 3.38Å; V240-S243 WeakPolarHBondContact O-CB 3.45Å; V240-S243 PolarHBondContact O-N 3.09Å; V240-S243 VanDerWaalsContact O-N 3.17Å; Q241-S243 PolarHBondContact O-N 2.9Å; S243-D246 PolarHBondContact O-N 2.95Å; S243-L247 WeakPolarHBondContact O-CB 3.38Å; S243-L247 VanDerWaalsContact O-CG 3.26Å; S243-L247 WeakPolarHBondContact O-CG 3.23Å; S243-L247 PolarHBondContact O-N 2.87Å
244	I	89.5	Confident	90.8	Very high	82 Å²	82	102.8 Å²	102.8	42%	0.421	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-45.5	174.8	-69.8	166.8	0	0	0	110.2	V240 Q241 G242 D246 L247 Q248	V240-I244 HydrophobicContact CG1-CD1 3.94Å; V240-I244 HydrophobicContact CG1-CG1 4.42Å; V240-I244 WeakPolarHBondContact O-CG1 3.4Å; V240-I244 PolarHBondContact O-N 3.35Å; Q241-I244 PolarHBondContact O-N 3.44Å; G242-I244 VanDerWaalsContact C-N 3.34Å; G242-I244 PolarHBondContact O-N 2.96Å; I244-D246 VanDerWaalsContact C-N 3.35Å; I244-D246 PolarHBondContact O-N 2.86Å; I244-L247 PolarHBondContact O-N 3.38Å; I244-Q248 HydrophobicContact CG2-CG 4.38Å; I244-Q248 WeakPolarHBondContact O-CB 3.3Å; I244-Q248 VanDerWaalsContact O-CG 3.26Å; I244-Q248 WeakPolarHBondContact O-CG 3.28Å; I244-Q248 PolarHBondContact O-N 3.14Å
245	T	91.5	Very high	90.9	Very high	66 Å²	66	101.7 Å²	101.7	41%	0.405	51%	0.508	S	S	.	.	H	α-helix	trans	-64.8	-38.4	179	61.7	0	0	0	0	112.5	Q241 G242 Q248 K249	Q241-T245 WeakPolarHBondContact O-CG2 3.35Å; Q241-T245 PolarHBondContact O-N 3.4Å; G242-T245 PolarHBondContact O-N 3.46Å; G242-T245 VanDerWaalsContact O-N 3.14Å; G242-T245 PolarHBondContact O-OG1 3.02Å; T245-Q248 PolarHBondContact O-N 2.9Å; T245-K249 PolarHBondContact O-N 3.37Å
246	D	91.4	Very high	90.9	Very high	87 Å²	87	99.8 Å²	99.8	47%	0.465	51%	0.507	S	S	.	.	H	α-helix	trans	-67.1	-42.4	175.2	-78.5	-16.9	0	0	0	111.7	G242 S243 I244 Q248 K249 R250	G242-D246 PolarHBondContact O-N 3.45Å; S243-D246 PolarHBondContact O-N 2.95Å; I244-D246 VanDerWaalsContact C-N 3.35Å; I244-D246 PolarHBondContact O-N 2.86Å; D246-Q248 VanDerWaalsContact C-N 3.32Å; D246-Q248 PolarHBondContact O-N 2.81Å; D246-K249 PolarHBondContact O-N 3.25Å; D246-R250 WeakPolarHBondContact O-CG 3.4Å; D246-R250 PolarHBondContact O-N 2.93Å
247	L	91.5	Very high	90.8	Very high	108 Å²	108	100.7 Å²	100.7	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-64.2	-37	173.9	-74.4	172.5	0	0	0	111.9	S243 I244 R250 R251	S243-L247 WeakPolarHBondContact O-CB 3.38Å; S243-L247 VanDerWaalsContact O-CG 3.26Å; S243-L247 WeakPolarHBondContact O-CG 3.23Å; S243-L247 PolarHBondContact O-N 2.87Å; I244-L247 PolarHBondContact O-N 3.38Å; L247-R250 PolarHBondContact O-N 3Å; L247-R251 WeakPolarHBondContact O-CB 3.31Å; L247-R251 PolarHBondContact O-N 2.86Å
248	Q	91.8	Very high	90.7	Very high	109 Å²	109	101 Å²	101	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-64.9	-41.3	174.2	-76.6	173.8	-19.3	0	0	112.1	I244 T245 D246 R251 S252	I244-Q248 HydrophobicContact CG2-CG 4.38Å; I244-Q248 WeakPolarHBondContact O-CB 3.3Å; I244-Q248 VanDerWaalsContact O-CG 3.26Å; I244-Q248 WeakPolarHBondContact O-CG 3.28Å; I244-Q248 PolarHBondContact O-N 3.14Å; T245-Q248 PolarHBondContact O-N 2.9Å; D246-Q248 VanDerWaalsContact C-N 3.32Å; D246-Q248 PolarHBondContact O-N 2.81Å; Q248-R251 PolarHBondContact O-N 2.84Å; Q248-S252 PolarHBondContact O-N 3.5Å; Q248-S252 PolarHBondContact O-OG 2.79Å
249	K	91.4	Very high	90.5	Very high	137 Å²	137	101.4 Å²	101.4	60%	0.596	50%	0.502	S	S	*	.	H	α-helix	trans	-65.3	-40	173	-76.1	178	-177.9	171.1	0	112.5	T245 D246 R251 S252 T253	T245-K249 PolarHBondContact O-N 3.37Å; D246-K249 PolarHBondContact O-N 3.25Å; K249-R251 VanDerWaalsContact C-N 3.34Å; K249-S252 PolarHBondContact O-N 3.49Å; K249-S252 PolarHBondContact O-OG 2.93Å; K249-T253 PolarHBondContact O-N 3.4Å; K249-T253 PolarHBondContact O-OG1 3.31Å
250	R	92	Very high	90.3	Very high	176 Å²	176	102 Å²	102	66%	0.664	51%	0.506	S	S	*	.	H	α-helix	trans	-64.2	-40.8	173.4	-73.6	179.6	-175	-173.7	3.4	111.3	D246 L247 T253 E254	D246-R250 WeakPolarHBondContact O-CG 3.4Å; D246-R250 PolarHBondContact O-N 2.93Å; L247-R250 PolarHBondContact O-N 3Å; R250-T253 VanDerWaalsContact CA-OG1 3.31Å; R250-T253 WeakPolarHBondContact CA-OG1 3.27Å; R250-T253 PolarHBondContact O-N 3.38Å; R250-T253 PolarHBondContact O-OG1 3Å; R250-E254 WeakPolarHBondContact O-CB 3.44Å; R250-E254 PolarHBondContact O-N 2.85Å
251	R	91.6	Very high	90	Very high	172 Å²	172	102.9 Å²	102.9	65%	0.649	51%	0.512	S	S	*	.	H	α-helix	trans	-63.2	-42.8	175.6	-167.5	-172.2	76.5	169.2	4.5	111.8	L247 Q248 K249 N255	L247-R251 WeakPolarHBondContact O-CB 3.31Å; L247-R251 PolarHBondContact O-N 2.86Å; Q248-R251 PolarHBondContact O-N 2.84Å; K249-R251 VanDerWaalsContact C-N 3.34Å; R251-N255 VanDerWaalsContact O-CB 3.27Å; R251-N255 WeakPolarHBondContact O-CB 3.25Å; R251-N255 VanDerWaalsContact O-CG 3.25Å; R251-N255 PolarHBondContact O-N 3.33Å
252	S	90	Very high	89.8	Confident	63 Å²	63	107 Å²	107	44%	0.441	52%	0.522	S	S	.	.	H	α-helix	trans	-67.5	-42.8	178.8	62.7	0	0	0	0	112.1	Q248 K249 N255 S256	Q248-S252 PolarHBondContact O-N 3.5Å; Q248-S252 PolarHBondContact O-OG 2.79Å; K249-S252 PolarHBondContact O-N 3.49Å; K249-S252 PolarHBondContact O-OG 2.93Å; S252-N255 PolarHBondContact O-N 2.88Å; S252-S256 PolarHBondContact O-N 3.5Å; S252-S256 PolarHBondContact O-OG 3.46Å
253	T	90.8	Very high	89.4	Confident	78 Å²	78	108.4 Å²	108.4	48%	0.479	52%	0.523	S	S	.	.	H	α-helix	trans	-63.9	-42.4	175.9	40.3	0	0	0	0	112.6	K249 R250 S256 R257	K249-T253 PolarHBondContact O-N 3.4Å; K249-T253 PolarHBondContact O-OG1 3.31Å; R250-T253 VanDerWaalsContact CA-OG1 3.31Å; R250-T253 WeakPolarHBondContact CA-OG1 3.27Å; R250-T253 PolarHBondContact O-N 3.38Å; R250-T253 PolarHBondContact O-OG1 3Å; T253-S256 PolarHBondContact O-N 3.17Å; T253-R257 WeakPolarHBondContact O-CG 3.47Å; T253-R257 PolarHBondContact O-N 3.35Å
254	E	90.2	Very high	89.1	Confident	93 Å²	93	106.9 Å²	106.9	44%	0.435	52%	0.518	S	S	.	.	H	α-helix	trans	-70	-33.7	176.5	-159.6	59.6	-152	0	0	112	R250 R257 L258	R250-E254 WeakPolarHBondContact O-CB 3.44Å; R250-E254 PolarHBondContact O-N 2.85Å; E254-R257 PolarHBondContact O-N 3.03Å; E254-R257 WeakPolarHBondContact OE2-CD 3.38Å; E254-R257 IonicContact OE2-NH1 2.63Å; E254-R257 PolarHBondContact OE2-NH1 2.94Å; E254-L258 WeakPolarHBondContact O-CB 3.42Å; E254-L258 WeakPolarHBondContact O-CG 3.41Å; E254-L258 PolarHBondContact O-N 3.45Å
255	N	90.7	Very high	88.7	Confident	87 Å²	87	108 Å²	108	47%	0.465	53%	0.525	S	S	.	.	H	α-helix	trans	-64.9	-38.7	171.2	-82.1	-10.6	0	0	0	112.4	R251 S252 L258 Y259	R251-N255 VanDerWaalsContact O-CB 3.27Å; R251-N255 WeakPolarHBondContact O-CB 3.25Å; R251-N255 VanDerWaalsContact O-CG 3.25Å; R251-N255 PolarHBondContact O-N 3.33Å; S252-N255 PolarHBondContact O-N 2.88Å; N255-L258 PolarHBondContact O-N 3.4Å; N255-Y259 WeakPolarHBondContact O-CB 3.43Å; N255-Y259 PolarHBondContact O-N 2.93Å
256	S	89.4	Confident	88.2	Confident	70 Å²	70	107.7 Å²	107.7	49%	0.49	53%	0.525	S	S	.	.	H	α-helix	trans	-63.2	-42.1	172.7	-66.3	0	0	0	0	111.3	S252 T253 Y259 E260	S252-S256 PolarHBondContact O-N 3.5Å; S252-S256 PolarHBondContact O-OG 3.46Å; T253-S256 PolarHBondContact O-N 3.17Å; S256-Y259 WeakPolarHBondContact O-CB 3.28Å; S256-Y259 PolarHBondContact O-N 2.84Å; S256-E260 WeakPolarHBondContact O-CG 3.31Å; S256-E260 PolarHBondContact O-N 2.85Å
257	R	89.7	Confident	87.7	Confident	147 Å²	147	110 Å²	110	56%	0.555	53%	0.533	S	S	*	.	H	α-helix	trans	-63.1	-42.3	173.2	-72.8	173.5	173	178	-3.9	112.5	T253 E254 Y259 E260 V261	T253-R257 WeakPolarHBondContact O-CG 3.47Å; T253-R257 PolarHBondContact O-N 3.35Å; E254-R257 PolarHBondContact O-N 3.03Å; E254-R257 WeakPolarHBondContact OE2-CD 3.38Å; E254-R257 IonicContact OE2-NH1 2.63Å; E254-R257 PolarHBondContact OE2-NH1 2.94Å; R257-Y259 VanDerWaalsContact C-N 3.28Å; R257-Y259 PolarHBondContact O-N 2.73Å; R257-E260 PolarHBondContact O-N 3.36Å; R257-V261 WeakPolarHBondContact O-CB 3.45Å; R257-V261 VanDerWaalsContact O-CG2 3.29Å; R257-V261 WeakPolarHBondContact O-CG2 3.25Å; R257-V261 PolarHBondContact O-N 3.46Å
258	L	87.8	Confident	87.1	Confident	96 Å²	96	107.4 Å²	107.4	50%	0.503	53%	0.526	S	S	.	.	H	α-helix	trans	-61.4	-37.8	173.9	-81.9	169.6	0	0	0	111.7	E254 N255 R262	E254-L258 WeakPolarHBondContact O-CB 3.42Å; E254-L258 WeakPolarHBondContact O-CG 3.41Å; E254-L258 PolarHBondContact O-N 3.45Å; N255-L258 PolarHBondContact O-N 3.4Å; L258-R262 VanDerWaalsContact O-CB 3.26Å; L258-R262 WeakPolarHBondContact O-CB 3.39Å; L258-R262 PolarHBondContact O-N 3.46Å
259	Y	86	Confident	86.6	Confident	153 Å²	153	106.3 Å²	106.3	60%	0.6	52%	0.524	S	S	*	.	H	α-helix	trans	-66.6	-43.5	174.8	-175	-100.5	0	0	0	111.6	N255 S256 R257 R262 N263	N255-Y259 WeakPolarHBondContact O-CB 3.43Å; N255-Y259 PolarHBondContact O-N 2.93Å; S256-Y259 WeakPolarHBondContact O-CB 3.28Å; S256-Y259 PolarHBondContact O-N 2.84Å; R257-Y259 VanDerWaalsContact C-N 3.28Å; R257-Y259 PolarHBondContact O-N 2.73Å; Y259-R262 PolarHBondContact O-N 3.41Å; Y259-N263 WeakPolarHBondContact CE1-ND2 3.29Å; Y259-N263 VanDerWaalsContact CZ-ND2 3.33Å; Y259-N263 WeakPolarHBondContact O-CB 3.34Å; Y259-N263 PolarHBondContact O-N 2.94Å
260	E	87.1	Confident	86.1	Confident	133 Å²	133	103.4 Å²	103.4	62%	0.621	52%	0.518	S	S	*	.	H	α-helix	trans	-62.6	-44.3	174.1	-74.2	174	-171.8	0	0	112.2	S256 R257 N263 G264	S256-E260 WeakPolarHBondContact O-CG 3.31Å; S256-E260 PolarHBondContact O-N 2.85Å; R257-E260 PolarHBondContact O-N 3.36Å; E260-N263 PolarHBondContact O-N 3.36Å; E260-G264 PolarHBondContact O-N 2.87Å
261	V	84.4	Confident	85.5	Confident	102 Å²	102	102.2 Å²	102.2	62%	0.618	51%	0.513	S	S	*	.	H	α-helix	trans	-67.2	-39.3	176.6	172.1	0	0	0	0	111	R257 G264 L265	R257-V261 WeakPolarHBondContact O-CB 3.45Å; R257-V261 VanDerWaalsContact O-CG2 3.29Å; R257-V261 WeakPolarHBondContact O-CG2 3.25Å; R257-V261 PolarHBondContact O-N 3.46Å; V261-G264 PolarHBondContact O-N 2.84Å; V261-L265 VanDerWaalsContact O-CB 3.29Å; V261-L265 WeakPolarHBondContact O-CB 3.4Å; V261-L265 PolarHBondContact O-N 3.21Å
262	R	85	Confident	85	Confident	192 Å²	192	101 Å²	101	73%	0.725	51%	0.513	S	S	*	.	H	α-helix	trans	-63.4	-42.2	173	-93.3	-175.9	168	165.6	-2.6	111.9	L258 Y259 G264 L265 S266	L258-R262 VanDerWaalsContact O-CB 3.26Å; L258-R262 WeakPolarHBondContact O-CB 3.39Å; L258-R262 PolarHBondContact O-N 3.46Å; Y259-R262 PolarHBondContact O-N 3.41Å; R262-G264 VanDerWaalsContact C-N 3.35Å; R262-L265 PolarHBondContact O-N 3.23Å; R262-S266 WeakPolarHBondContact O-CB 3.48Å; R262-S266 PolarHBondContact O-N 3.35Å; R262-S266 PolarHBondContact O-OG 2.89Å
263	N	84.4	Confident	84.5	Confident	58 Å²	58	106.6 Å²	106.6	31%	0.31	52%	0.524	S	S	.	.	H	α-helix	trans	-67.8	-37.2	175.3	-76.3	-6.3	0	0	0	111.5	Y259 E260 S266 Q267	Y259-N263 WeakPolarHBondContact CE1-ND2 3.29Å; Y259-N263 VanDerWaalsContact CZ-ND2 3.33Å; Y259-N263 WeakPolarHBondContact O-CB 3.34Å; Y259-N263 PolarHBondContact O-N 2.94Å; E260-N263 PolarHBondContact O-N 3.36Å; N263-S266 WeakPolarHBondContact CA-OG 3.33Å; N263-S266 PolarHBondContact O-N 3.43Å; N263-S266 PolarHBondContact O-OG 2.88Å; N263-Q267 VanDerWaalsContact O-CB 3.31Å; N263-Q267 WeakPolarHBondContact O-CB 3.38Å; N263-Q267 VanDerWaalsContact O-CG 3.22Å; N263-Q267 WeakPolarHBondContact O-CG 3.46Å; N263-Q267 PolarHBondContact O-N 3.44Å
264	G	84.2	Confident	84	Confident	35 Å²	35	106.8 Å²	106.8	36%	0.361	52%	0.52	S	S	.	.	H	α-helix	trans	-65.3	-39	172.6	0	0	0	0	0	112	E260 V261 R262 A268	E260-G264 PolarHBondContact O-N 2.87Å; V261-G264 PolarHBondContact O-N 2.84Å; R262-G264 VanDerWaalsContact C-N 3.35Å; G264-A268 WeakPolarHBondContact O-CB 3.38Å; G264-A268 PolarHBondContact O-N 3.34Å
265	L	82.6	Confident	83.5	Confident	107 Å²	107	107.2 Å²	107.2	56%	0.56	52%	0.524	S	S	*	.	H	α-helix	trans	-68	-43.4	175	-170.8	74.6	0	0	0	111	V261 R262 Q267 A268 D269	V261-L265 VanDerWaalsContact O-CB 3.29Å; V261-L265 WeakPolarHBondContact O-CB 3.4Å; V261-L265 PolarHBondContact O-N 3.21Å; R262-L265 PolarHBondContact O-N 3.23Å; L265-Q267 VanDerWaalsContact C-N 3.34Å; L265-Q267 PolarHBondContact O-N 3.37Å; L265-A268 CarbonylContact O-C 3.55Å; L265-A268 PolarHBondContact O-N 2.63Å; L265-D269 WeakPolarHBondContact O-CB 3.4Å; L265-D269 PolarHBondContact O-N 2.76Å
266	S	80.7	Confident	82.9	Confident	58 Å²	58	105.7 Å²	105.7	41%	0.406	52%	0.524	S	S	.	.	H	α-helix	trans	-65	-39.8	176.3	72	0	0	0	0	111.3	R262 N263 D269 V270	R262-S266 WeakPolarHBondContact O-CB 3.48Å; R262-S266 PolarHBondContact O-N 3.35Å; R262-S266 PolarHBondContact O-OG 2.89Å; N263-S266 WeakPolarHBondContact CA-OG 3.33Å; N263-S266 PolarHBondContact O-N 3.43Å; N263-S266 PolarHBondContact O-OG 2.88Å; S266-D269 PolarHBondContact O-N 3.44Å; S266-V270 WeakPolarHBondContact O-CB 3.34Å; S266-V270 VanDerWaalsContact O-CG2 3.23Å; S266-V270 WeakPolarHBondContact O-CG2 3.31Å; S266-V270 PolarHBondContact O-N 2.84Å
267	Q	80.8	Confident	82.4	Confident	137 Å²	137	106.8 Å²	106.8	64%	0.64	52%	0.524	S	S	*	.	H	α-helix	trans	-66.2	-37.8	171.7	-74.5	176.6	14.2	0	0	112.2	N263 L265 V270 R271	N263-Q267 VanDerWaalsContact O-CB 3.31Å; N263-Q267 WeakPolarHBondContact O-CB 3.38Å; N263-Q267 VanDerWaalsContact O-CG 3.22Å; N263-Q267 WeakPolarHBondContact O-CG 3.46Å; N263-Q267 PolarHBondContact O-N 3.44Å; L265-Q267 VanDerWaalsContact C-N 3.34Å; L265-Q267 PolarHBondContact O-N 3.37Å; Q267-V270 PolarHBondContact O-N 2.84Å; Q267-R271 WeakPolarHBondContact O-CB 3.31Å; Q267-R271 PolarHBondContact O-N 2.95Å
268	A	79.5	Confident	81.9	Confident	52 Å²	52	103.6 Å²	103.6	43%	0.43	52%	0.518	S	S	.	.	H	α-helix	trans	-68.7	-36.6	175.7	0	0	0	0	0	111.8	G264 L265 R271 K272	G264-A268 WeakPolarHBondContact O-CB 3.38Å; G264-A268 PolarHBondContact O-N 3.34Å; L265-A268 CarbonylContact O-C 3.55Å; L265-A268 PolarHBondContact O-N 2.63Å; A268-R271 CarbonylContact O-C 3.57Å; A268-R271 PolarHBondContact O-N 3.31Å; A268-K272 WeakPolarHBondContact O-CB 3.36Å; A268-K272 PolarHBondContact O-N 2.92Å
269	D	81.2	Confident	81.6	Confident	87 Å²	87	102.9 Å²	102.9	47%	0.465	52%	0.517	S	S	.	.	H	α-helix	trans	-68.4	-40.6	173.2	-82.7	-31.2	0	0	0	111.3	L265 S266 K272 R273	L265-D269 WeakPolarHBondContact O-CB 3.4Å; L265-D269 PolarHBondContact O-N 2.76Å; S266-D269 PolarHBondContact O-N 3.44Å; D269-K272 PolarHBondContact O-N 3.38Å; D269-R273 PolarHBondContact O-N 2.86Å
270	V	81.2	Confident	81.2	Confident	75 Å²	75	101.3 Å²	101.3	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-61.7	-46.1	170	171.1	0	0	0	0	110	S266 Q267 K272 R273 E274	S266-V270 WeakPolarHBondContact O-CB 3.34Å; S266-V270 VanDerWaalsContact O-CG2 3.23Å; S266-V270 WeakPolarHBondContact O-CG2 3.31Å; S266-V270 PolarHBondContact O-N 2.84Å; Q267-V270 PolarHBondContact O-N 2.84Å; V270-K272 VanDerWaalsContact C-N 3.33Å; V270-K272 PolarHBondContact O-N 3.33Å; V270-R273 CarbonylContact O-C 3.43Å; V270-R273 WeakPolarHBondContact O-CA 3.37Å; V270-R273 WeakPolarHBondContact O-CB 3.26Å; V270-R273 PolarHBondContact O-N 2.86Å; V270-R273 VanDerWaalsContact O-N 3.14Å; V270-E274 HydrophobicContact CG1-CG 4.3Å; V270-E274 WeakPolarHBondContact O-CG 3.3Å; V270-E274 PolarHBondContact O-N 2.91Å
271	R	79.1	Confident	80.8	Confident	151 Å²	151	98.8 Å²	98.8	57%	0.57	50%	0.504	S	S	*	.	H	α-helix	trans	-63.4	-38.5	177.5	-166.3	69.3	168.1	176.9	-3.5	112.1	Q267 A268 E274 L275	Q267-R271 WeakPolarHBondContact O-CB 3.31Å; Q267-R271 PolarHBondContact O-N 2.95Å; A268-R271 CarbonylContact O-C 3.57Å; A268-R271 PolarHBondContact O-N 3.31Å; R271-E274 WeakPolarHBondContact CD-OE2 3.41Å; R271-E274 IonicContact NH1-OE2 3.17Å; R271-E274 PolarHBondContact NH1-OE2 3.09Å; R271-E274 PolarHBondContact O-N 3.49Å; R271-L275 HydrophobicContact CG-CD1 4.37Å; R271-L275 VanDerWaalsContact O-CB 3.31Å; R271-L275 WeakPolarHBondContact O-CB 3.3Å; R271-L275 VanDerWaalsContact O-CG 3.26Å; R271-L275 WeakPolarHBondContact O-CG 3.27Å; R271-L275 PolarHBondContact O-N 3.45Å
272	K	80.4	Confident	80.4	Confident	147 Å²	147	103.2 Å²	103.2	64%	0.639	51%	0.51	S	S	*	.	H	α-helix	trans	-66	-40.7	174.7	-177	-177.6	177.4	-175.5	0	110.2	A268 D269 V270 A276	A268-K272 WeakPolarHBondContact O-CB 3.36Å; A268-K272 PolarHBondContact O-N 2.92Å; D269-K272 PolarHBondContact O-N 3.38Å; V270-K272 VanDerWaalsContact C-N 3.33Å; V270-K272 PolarHBondContact O-N 3.33Å; K272-A276 WeakPolarHBondContact O-CB 3.3Å; K272-A276 PolarHBondContact O-N 3.49Å
273	R	79.3	Confident	80.1	Confident	180 Å²	180	100.5 Å²	100.5	68%	0.679	50%	0.503	S	S	*	.	H	α-helix	trans	-61.7	-51.8	168.5	-94.6	-173.5	-169.2	140.2	3.6	111.2	D269 V270 L275 A276 D277	D269-R273 PolarHBondContact O-N 2.86Å; V270-R273 CarbonylContact O-C 3.43Å; V270-R273 WeakPolarHBondContact O-CA 3.37Å; V270-R273 WeakPolarHBondContact O-CB 3.26Å; V270-R273 PolarHBondContact O-N 2.86Å; V270-R273 VanDerWaalsContact O-N 3.14Å; R273-L275 VanDerWaalsContact C-N 3.26Å; R273-L275 PolarHBondContact O-N 3.24Å; R273-A276 CarbonylContact O-C 3.58Å; R273-A276 PolarHBondContact O-N 3.47Å; R273-A276 VanDerWaalsContact O-N 3.1Å; R273-D277 WeakPolarHBondContact O-CA 3.47Å; R273-D277 WeakPolarHBondContact O-CB 3.12Å; R273-D277 PolarHBondContact O-N 2.95Å
274	E	80.1	Confident	79.7	Confident	83 Å²	83	101.2 Å²	101.2	39%	0.388	51%	0.505	S	S	.	.	H	α-helix	trans	-56.8	-38	177.9	-72.8	175.6	175.4	0	0	112.5	V270 R271 D277 N278	V270-E274 HydrophobicContact CG1-CG 4.3Å; V270-E274 WeakPolarHBondContact O-CG 3.3Å; V270-E274 PolarHBondContact O-N 2.91Å; R271-E274 WeakPolarHBondContact CD-OE2 3.41Å; R271-E274 IonicContact NH1-OE2 3.17Å; R271-E274 PolarHBondContact NH1-OE2 3.09Å; R271-E274 PolarHBondContact O-N 3.49Å; E274-D277 CarbonylContact O-C 3.58Å; E274-N278 VanDerWaalsContact O-CB 3.27Å; E274-N278 WeakPolarHBondContact O-CB 3.4Å; E274-N278 PolarHBondContact O-N 3.37Å; E274-N278 PolarHBondContact O-ND2 3.17Å
275	L	79.5	Confident	79.2	Confident	102 Å²	102	105.7 Å²	105.7	53%	0.534	51%	0.514	S	S	.	.	H	α-helix	trans	-74.4	-42.1	176.3	-74.9	172.4	0	0	0	111.7	R271 R273 D277 N278 V279	R271-L275 HydrophobicContact CG-CD1 4.37Å; R271-L275 VanDerWaalsContact O-CB 3.31Å; R271-L275 WeakPolarHBondContact O-CB 3.3Å; R271-L275 VanDerWaalsContact O-CG 3.26Å; R271-L275 WeakPolarHBondContact O-CG 3.27Å; R271-L275 PolarHBondContact O-N 3.45Å; R273-L275 VanDerWaalsContact C-N 3.26Å; R273-L275 PolarHBondContact O-N 3.24Å; L275-D277 VanDerWaalsContact C-N 3.27Å; L275-D277 PolarHBondContact O-N 2.88Å; L275-N278 PolarHBondContact O-N 3Å; L275-N278 VanDerWaalsContact O-N 3.17Å; L275-V279 WeakPolarHBondContact O-CG2 3.32Å; L275-V279 PolarHBondContact O-N 3.4Å
276	A	79.9	Confident	78.8	Confident	55 Å²	55	106.2 Å²	106.2	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-61.1	-40.9	172.7	0	0	0	0	0	110.6	K272 R273 V279 K280	K272-A276 WeakPolarHBondContact O-CB 3.3Å; K272-A276 PolarHBondContact O-N 3.49Å; R273-A276 CarbonylContact O-C 3.58Å; R273-A276 PolarHBondContact O-N 3.47Å; R273-A276 VanDerWaalsContact O-N 3.1Å; A276-V279 PolarHBondContact O-N 3.05Å; A276-K280 WeakPolarHBondContact O-CA 3.4Å; A276-K280 WeakPolarHBondContact O-CB 3.32Å; A276-K280 PolarHBondContact O-N 2.96Å
277	D	78.3	Confident	78.4	Confident	92 Å²	92	106.1 Å²	106.1	49%	0.492	51%	0.508	S	S	.	.	H	α-helix	trans	-71.1	-29.7	174.8	-68.1	-21.2	0	0	0	111.2	R273 E274 L275 K280 L281	R273-D277 WeakPolarHBondContact O-CA 3.47Å; R273-D277 WeakPolarHBondContact O-CB 3.12Å; R273-D277 PolarHBondContact O-N 2.95Å; E274-D277 CarbonylContact O-C 3.58Å; L275-D277 VanDerWaalsContact C-N 3.27Å; L275-D277 PolarHBondContact O-N 2.88Å; D277-K280 CarbonylContact O-C 3.55Å; D277-L281 WeakPolarHBondContact O-CA 3.49Å; D277-L281 WeakPolarHBondContact O-CB 3.4Å; D277-L281 PolarHBondContact O-N 3.32Å
278	N	79	Confident	77.4	Confident	80 Å²	80	101.7 Å²	101.7	43%	0.428	49%	0.492	S	S	.	.	H	α-helix	trans	-73.9	-40.1	171.4	-96.9	-77.8	0	0	0	112	E274 L275 K280 L281 R282	E274-N278 VanDerWaalsContact O-CB 3.27Å; E274-N278 WeakPolarHBondContact O-CB 3.4Å; E274-N278 PolarHBondContact O-N 3.37Å; E274-N278 PolarHBondContact O-ND2 3.17Å; L275-N278 PolarHBondContact O-N 3Å; L275-N278 VanDerWaalsContact O-N 3.17Å; N278-K280 VanDerWaalsContact C-N 3.33Å; N278-L281 PolarHBondContact O-N 2.98Å; N278-R282 WeakPolarHBondContact O-CG 3.46Å; N278-R282 PolarHBondContact O-N 2.9Å
279	V	80.6	Confident	76.9	Confident	81 Å²	81	104.8 Å²	104.8	49%	0.491	50%	0.501	S	S	.	.	H	α-helix	trans	-65.2	-44	172.7	171	0	0	0	0	109.4	L275 A276 R282 K283	L275-V279 WeakPolarHBondContact O-CG2 3.32Å; L275-V279 PolarHBondContact O-N 3.4Å; A276-V279 PolarHBondContact O-N 3.05Å; V279-R282 PolarHBondContact O-N 3.15Å; V279-K283 WeakPolarHBondContact O-CG 3.5Å; V279-K283 PolarHBondContact O-N 3.49Å
280	K	78.9	Confident	76.3	Confident	120 Å²	120	104.6 Å²	104.6	52%	0.522	50%	0.497	S	S	.	.	H	α-helix	trans	-60.8	-52.7	173.2	-160.3	177.7	-177.7	-170.9	0	108.6	A276 D277 N278 R282 K283 E284	A276-K280 WeakPolarHBondContact O-CA 3.4Å; A276-K280 WeakPolarHBondContact O-CB 3.32Å; A276-K280 PolarHBondContact O-N 2.96Å; D277-K280 CarbonylContact O-C 3.55Å; N278-K280 VanDerWaalsContact C-N 3.33Å; K280-R282 VanDerWaalsContact C-N 3.26Å; K280-R282 PolarHBondContact O-N 2.95Å; K280-R282 VanDerWaalsContact O-N 3.15Å; K280-K283 CarbonylContact O-C 3.58Å; K280-K283 WeakPolarHBondContact O-CA 3.35Å; K280-K283 WeakPolarHBondContact O-CB 3.47Å; K280-K283 PolarHBondContact O-N 3.22Å; K280-E284 WeakPolarHBondContact O-CA 3.35Å; K280-E284 VanDerWaalsContact O-CB 3.26Å; K280-E284 WeakPolarHBondContact O-CB 3.27Å; K280-E284 PolarHBondContact O-N 2.93Å
281	L	77.8	Confident	74.8	Confident	81 Å²	81	104.4 Å²	104.4	42%	0.424	49%	0.492	S	S	.	.	H	α-helix	trans	-55.5	-32.7	174.7	-176.1	75.8	0	0	0	113.2	D277 N278 E284 K285	D277-L281 WeakPolarHBondContact O-CA 3.49Å; D277-L281 WeakPolarHBondContact O-CB 3.4Å; D277-L281 PolarHBondContact O-N 3.32Å; N278-L281 PolarHBondContact O-N 2.98Å; L281-E284 CarbonylContact O-C 3.54Å; L281-K285 HydrophobicContact CD1-CG 4.32Å; L281-K285 HydrophobicContact CG-CD 4.23Å; L281-K285 HydrophobicContact CG-CG 4.25Å; L281-K285 WeakPolarHBondContact O-CA 3.29Å; L281-K285 WeakPolarHBondContact O-CB 3.13Å; L281-K285 WeakPolarHBondContact O-CG 3.33Å; L281-K285 PolarHBondContact O-N 3.38Å
282	R	77.3	Confident	73.6	Confident	195 Å²	195	104 Å²	104	74%	0.736	50%	0.496	S	S	*	.	H	α-helix	trans	-70.5	-43.6	173	-75.1	179.1	-173.8	-164	2.1	111.3	N278 V279 K280 E284 K285 Q286	N278-R282 WeakPolarHBondContact O-CG 3.46Å; N278-R282 PolarHBondContact O-N 2.9Å; V279-R282 PolarHBondContact O-N 3.15Å; K280-R282 VanDerWaalsContact C-N 3.26Å; K280-R282 PolarHBondContact O-N 2.95Å; K280-R282 VanDerWaalsContact O-N 3.15Å; R282-E284 VanDerWaalsContact C-N 3.33Å; R282-K285 PolarHBondContact O-N 2.86Å; R282-Q286 PolarHBondContact O-N 3.24Å; R282-Q286 VanDerWaalsContact O-N 3.09Å
283	K	78.3	Confident	72.2	Confident	135 Å²	135	103.7 Å²	103.7	59%	0.587	50%	0.497	S	S	*	.	H	α-helix	trans	-66	-37.5	171.9	-66.9	177.5	179.6	-176.4	0	111.7	V279 K280 Q286 I287	V279-K283 WeakPolarHBondContact O-CG 3.5Å; V279-K283 PolarHBondContact O-N 3.49Å; K280-K283 CarbonylContact O-C 3.58Å; K280-K283 WeakPolarHBondContact O-CA 3.35Å; K280-K283 WeakPolarHBondContact O-CB 3.47Å; K280-K283 PolarHBondContact O-N 3.22Å; K283-Q286 VanDerWaalsContact O-CB 3.31Å; K283-Q286 WeakPolarHBondContact O-CB 3.26Å; K283-Q286 PolarHBondContact O-N 3.44Å; K283-I287 WeakPolarHBondContact O-CB 3.47Å; K283-I287 WeakPolarHBondContact O-CD1 3.35Å; K283-I287 WeakPolarHBondContact O-CG1 3.41Å; K283-I287 PolarHBondContact O-N 3.46Å
284	E	74.4	Confident	70.8	Confident	73 Å²	73	99.7 Å²	99.7	34%	0.341	49%	0.485	S	S	.	.	H	α-helix	trans	-82.2	-19.6	-179	-131.1	75.2	-173.2	0	0	110.6	K280 L281 R282 I287 C288	K280-E284 WeakPolarHBondContact O-CA 3.35Å; K280-E284 VanDerWaalsContact O-CB 3.26Å; K280-E284 WeakPolarHBondContact O-CB 3.27Å; K280-E284 PolarHBondContact O-N 2.93Å; L281-E284 CarbonylContact O-C 3.54Å; R282-E284 VanDerWaalsContact C-N 3.33Å; E284-I287 CarbonylContact O-C 3.5Å; E284-C288 WeakPolarHBondContact O-CA 3.43Å; E284-C288 WeakPolarHBondContact O-CB 3.37Å; E284-C288 PolarHBondContact O-N 3.38Å; E284-C288 PolarHBondContact O-SG 2.84Å
285	K	74.5	Confident	68.9	Low	129 Å²	129	98.9 Å²	98.9	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-78.3	-35.4	166.3	-86.6	178.9	175.7	-176.4	0	110.3	L281 R282 L289	L281-K285 HydrophobicContact CD1-CG 4.32Å; L281-K285 HydrophobicContact CG-CD 4.23Å; L281-K285 HydrophobicContact CG-CG 4.25Å; L281-K285 WeakPolarHBondContact O-CA 3.29Å; L281-K285 WeakPolarHBondContact O-CB 3.13Å; L281-K285 WeakPolarHBondContact O-CG 3.33Å; L281-K285 PolarHBondContact O-N 3.38Å; R282-K285 PolarHBondContact O-N 2.86Å; K285-L289 WeakPolarHBondContact O-CB 3.48Å; K285-L289 WeakPolarHBondContact O-CG 3.36Å; K285-L289 PolarHBondContact O-N 2.98Å
286	Q	74.5	Confident	67.4	Low	118 Å²	118	98.4 Å²	98.4	55%	0.551	49%	0.488	S	S	*	.	H	α-helix	trans	-62.9	-49.1	168.3	-168.9	73.1	18.9	0	0	109.9	R282 K283 L289 E290	R282-Q286 PolarHBondContact O-N 3.24Å; R282-Q286 VanDerWaalsContact O-N 3.09Å; K283-Q286 VanDerWaalsContact O-CB 3.31Å; K283-Q286 WeakPolarHBondContact O-CB 3.26Å; K283-Q286 PolarHBondContact O-N 3.44Å; Q286-L289 WeakPolarHBondContact O-CB 3.45Å; Q286-L289 PolarHBondContact O-N 3.49Å; Q286-E290 WeakPolarHBondContact O-CG 3.38Å; Q286-E290 PolarHBondContact O-N 2.89Å; Q286-E290 VanDerWaalsContact O-N 3.15Å
287	I	71.6	Confident	65.8	Low	55 Å²	55	102.2 Å²	102.2	28%	0.282	50%	0.5	S	S	.	.	H	α-helix	trans	-71.6	-30.4	176.7	-65.8	160.5	0	0	0	111	K283 E284 E290 M291	K283-I287 WeakPolarHBondContact O-CB 3.47Å; K283-I287 WeakPolarHBondContact O-CD1 3.35Å; K283-I287 WeakPolarHBondContact O-CG1 3.41Å; K283-I287 PolarHBondContact O-N 3.46Å; E284-I287 CarbonylContact O-C 3.5Å; I287-E290 CarbonylContact O-C 3.39Å; I287-E290 VanDerWaalsContact O-C 3.25Å; I287-E290 WeakPolarHBondContact O-CA 3.33Å; I287-E290 WeakPolarHBondContact O-CB 3.3Å; I287-E290 PolarHBondContact O-N 3.48Å; I287-M291 HydrophobicContact CG2-CB 4.35Å; I287-M291 HydrophobicContact CG2-CE 4.25Å; I287-M291 HydrophobicContact CG2-CG 3.44Å; I287-M291 VanDerWaalsContact CG2-CG 3.44Å; I287-M291 VanDerWaalsContact O-CA 3.24Å; I287-M291 WeakPolarHBondContact O-CA 3.48Å; I287-M291 WeakPolarHBondContact O-CB 3.37Å; I287-M291 WeakPolarHBondContact O-CG 3.37Å; I287-M291 PolarHBondContact O-N 2.96Å
288	C	60.3	Low	64.4	Low	44 Å²	44	103 Å²	103	30%	0.297	50%	0.504	S	S	.	.	H	α-helix	trans	-78	-19.5	173.3	-78.1	0	0	0	0	111.1	E284 M291 Q292	E284-C288 WeakPolarHBondContact O-CA 3.43Å; E284-C288 WeakPolarHBondContact O-CB 3.37Å; E284-C288 PolarHBondContact O-N 3.38Å; E284-C288 PolarHBondContact O-SG 2.84Å; C288-M291 CarbonylContact O-C 3.56Å; C288-Q292 WeakPolarHBondContact O-CA 3.21Å; C288-Q292 WeakPolarHBondContact O-CB 3.44Å; C288-Q292 PolarHBondContact O-N 3.04Å; C288-Q292 PolarHBondContact O-OE1 3.42Å
289	L	68.5	Low	62.7	Low	118 Å²	118	106.9 Å²	106.9	62%	0.618	52%	0.519	S	S	*	.	H	α-helix	trans	-66.6	-47	161.2	-81.9	158.2	0	0	0	108.7	K285 Q286 M291	K285-L289 WeakPolarHBondContact O-CB 3.48Å; K285-L289 WeakPolarHBondContact O-CG 3.36Å; K285-L289 PolarHBondContact O-N 2.98Å; Q286-L289 WeakPolarHBondContact O-CB 3.45Å; Q286-L289 PolarHBondContact O-N 3.49Å; L289-M291 VanDerWaalsContact C-N 3.29Å; L289-M291 PolarHBondContact O-N 3.48Å
290	E	69.8	Low	60.7	Low	83 Å²	83	111.2 Å²	111.2	39%	0.388	53%	0.534	S	S	.	.	H	α-helix	trans	-70.9	-19.7	176.2	-62.1	169.6	-168.8	0	0	114.3	Q286 I287 K294	Q286-E290 WeakPolarHBondContact O-CG 3.38Å; Q286-E290 PolarHBondContact O-N 2.89Å; Q286-E290 VanDerWaalsContact O-N 3.15Å; I287-E290 CarbonylContact O-C 3.39Å; I287-E290 VanDerWaalsContact O-C 3.25Å; I287-E290 WeakPolarHBondContact O-CA 3.33Å; I287-E290 WeakPolarHBondContact O-CB 3.3Å; I287-E290 PolarHBondContact O-N 3.48Å; E290-K294 VanDerWaalsContact O-CD 3.27Å; E290-K294 WeakPolarHBondContact O-CD 3.25Å; E290-K294 WeakPolarHBondContact O-CE 3.31Å; E290-K294 VanDerWaalsContact O-CG 3.28Å; E290-K294 WeakPolarHBondContact O-CG 3.3Å
291	M	49.9	Very low	58.8	Low	70 Å²	70	112.6 Å²	112.6	35%	0.345	54%	0.542	S	S	.	.	H	α-helix	trans	-114.9	-7	-175.7	-67.5	-87.6	176.3	0	0	110.5	I287 C288 L289 K294 L295	I287-M291 HydrophobicContact CG2-CB 4.35Å; I287-M291 HydrophobicContact CG2-CE 4.25Å; I287-M291 HydrophobicContact CG2-CG 3.44Å; I287-M291 VanDerWaalsContact CG2-CG 3.44Å; I287-M291 VanDerWaalsContact O-CA 3.24Å; I287-M291 WeakPolarHBondContact O-CA 3.48Å; I287-M291 WeakPolarHBondContact O-CB 3.37Å; I287-M291 WeakPolarHBondContact O-CG 3.37Å; I287-M291 PolarHBondContact O-N 2.96Å; C288-M291 CarbonylContact O-C 3.56Å; L289-M291 VanDerWaalsContact C-N 3.29Å; L289-M291 PolarHBondContact O-N 3.48Å; M291-K294 VanDerWaalsContact C-N 3.33Å; M291-K294 HydrophobicContact CB-CB 4.36Å; M291-K294 HydrophobicContact CE-CD 3.72Å; M291-K294 HydrophobicContact CG-CB 4.45Å; M291-K294 HydrophobicContact CG-CD 4.12Å; M291-K294 CarbonylContact O-C 3.58Å; M291-K294 PolarHBondContact O-N 3.4Å; M291-K294 HydrophobicContact SD-CB 3.67Å; M291-K294 HydrophobicContact SD-CD 3.38Å; M291-K294 WeakPolarHBondContact SD-CD 3.36Å; M291-K294 HydrophobicContact SD-CG 4.15Å; M291-L295 HydrophobicContact CB-CD1 4.13Å; M291-L295 HydrophobicContact CB-CG 4.33Å; M291-L295 VanDerWaalsContact O-CA 3.25Å; M291-L295 WeakPolarHBondContact O-CA 3.28Å; M291-L295 WeakPolarHBondContact O-CB 3.2Å; M291-L295 WeakPolarHBondContact O-CD1 3.29Å; M291-L295 WeakPolarHBondContact O-CG 3.45Å; M291-L295 PolarHBondContact O-N 3.15Å
292	Q	51.9	Low	56.7	Low	142 Å²	142	116 Å²	116	66%	0.664	56%	0.56	S	S	*	*	H	α-helix	trans	-69.1	-35.3	157.4	-123	139.1	-39.8	0	0	107.7	C288 K294 S296	C288-Q292 WeakPolarHBondContact O-CA 3.21Å; C288-Q292 WeakPolarHBondContact O-CB 3.44Å; C288-Q292 PolarHBondContact O-N 3.04Å; C288-Q292 PolarHBondContact O-OE1 3.42Å; Q292-K294 VanDerWaalsContact C-N 3.29Å; Q292-K294 PolarHBondContact O-N 3.09Å; Q292-S296 WeakPolarHBondContact O-CB 3.46Å; Q292-S296 PolarHBondContact O-N 2.87Å; Q292-S296 VanDerWaalsContact O-N 3.13Å; Q292-S296 PolarHBondContact O-OG 3.17Å
293	E	52.5	Low	54.5	Low	142 Å²	142	110.6 Å²	110.6	66%	0.664	56%	0.557	S	S	*	*	H	α-helix	trans	-58.5	-38.4	164.9	-68.7	179.7	161.8	0	0	111.8	S296	E293-S296 PolarHBondContact O-OG 3.37Å
294	K	50.2	Low	52.4	Low	96 Å²	96	112 Å²	112	42%	0.417	57%	0.571	S	S	.	*	H	α-helix	trans	-96.4	-18.5	-178.9	-59.1	161.7	-178.2	167.9	0	116.5	E290 M291 Q292 L297 L298	E290-K294 VanDerWaalsContact O-CD 3.27Å; E290-K294 WeakPolarHBondContact O-CD 3.25Å; E290-K294 WeakPolarHBondContact O-CE 3.31Å; E290-K294 VanDerWaalsContact O-CG 3.28Å; E290-K294 WeakPolarHBondContact O-CG 3.3Å; M291-K294 VanDerWaalsContact C-N 3.33Å; M291-K294 HydrophobicContact CB-CB 4.36Å; M291-K294 HydrophobicContact CE-CD 3.72Å; M291-K294 HydrophobicContact CG-CB 4.45Å; M291-K294 HydrophobicContact CG-CD 4.12Å; M291-K294 CarbonylContact O-C 3.58Å; M291-K294 PolarHBondContact O-N 3.4Å; M291-K294 HydrophobicContact SD-CB 3.67Å; M291-K294 HydrophobicContact SD-CD 3.38Å; M291-K294 WeakPolarHBondContact SD-CD 3.36Å; M291-K294 HydrophobicContact SD-CG 4.15Å; Q292-K294 VanDerWaalsContact C-N 3.29Å; Q292-K294 PolarHBondContact O-N 3.09Å; K294-L297 CarbonylContact O-C 3.56Å; K294-L297 WeakPolarHBondContact O-CA 3.39Å; K294-L297 VanDerWaalsContact O-CB 3.23Å; K294-L297 WeakPolarHBondContact O-CB 3.45Å; K294-L297 PolarHBondContact O-N 3.44Å; K294-L298 PolarHBondContact O-N 3.02Å; K294-L298 VanDerWaalsContact O-N 3.08Å
295	L	39.4	Very low	50.2	Low	65 Å²	65	115.9 Å²	115.9	34%	0.34	59%	0.593	S	S	.	*	H	α-helix	trans	-92.7	-20.8	179.7	-77.3	162	0	0	0	110.3	M291 L297 L298 Q299	M291-L295 HydrophobicContact CB-CD1 4.13Å; M291-L295 HydrophobicContact CB-CG 4.33Å; M291-L295 VanDerWaalsContact O-CA 3.25Å; M291-L295 WeakPolarHBondContact O-CA 3.28Å; M291-L295 WeakPolarHBondContact O-CB 3.2Å; M291-L295 WeakPolarHBondContact O-CD1 3.29Å; M291-L295 WeakPolarHBondContact O-CG 3.45Å; M291-L295 PolarHBondContact O-N 3.15Å; L295-L297 PolarHBondContact O-N 3.5Å; L295-L298 PolarHBondContact O-N 2.89Å; L295-Q299 HydrophobicContact CB-CG 4.08Å; L295-Q299 HydrophobicContact CD2-CG 4.1Å; L295-Q299 WeakPolarHBondContact O-CB 3.29Å; L295-Q299 VanDerWaalsContact O-CG 3.27Å; L295-Q299 WeakPolarHBondContact O-CG 3.33Å; L295-Q299 PolarHBondContact O-N 3.47Å
296	S	48.5	Very low	47.8	Very low	93 Å²	93	115.2 Å²	115.2	65%	0.65	60%	0.6	S	S	*	*	H	α-helix	trans	-56.7	-29.5	155.1	68.7	0	0	0	0	111.7	Q292 E293	Q292-S296 WeakPolarHBondContact O-CB 3.46Å; Q292-S296 PolarHBondContact O-N 2.87Å; Q292-S296 VanDerWaalsContact O-N 3.13Å; Q292-S296 PolarHBondContact O-OG 3.17Å; E293-S296 PolarHBondContact O-OG 3.37Å
297	L	45.9	Very low	45.5	Very low	135 Å²	135	117.9 Å²	117.9	71%	0.707	61%	0.61	S	S	*	*	H	α-helix	trans	-89.5	-24	179.4	-87.5	152.8	0	0	0	113.9	K294 L295	K294-L297 CarbonylContact O-C 3.56Å; K294-L297 WeakPolarHBondContact O-CA 3.39Å; K294-L297 VanDerWaalsContact O-CB 3.23Å; K294-L297 WeakPolarHBondContact O-CB 3.45Å; K294-L297 PolarHBondContact O-N 3.44Å; L295-L297 PolarHBondContact O-N 3.5Å
298	L	48.9	Very low	43.7	Very low	109 Å²	109	122.1 Å²	122.1	57%	0.571	63%	0.634	S	S	*	*	H	α-helix	trans	-123.2	-4.2	-173.5	-93.1	82.7	0	0	0	116	K294 L295 H300 E301	K294-L298 PolarHBondContact O-N 3.02Å; K294-L298 VanDerWaalsContact O-N 3.08Å; L295-L298 PolarHBondContact O-N 2.89Å; L298-H300 PolarHBondContact O-N 2.95Å; L298-E301 PolarHBondContact O-N 3.41Å
299	Q	42.3	Very low	42.3	Very low	161 Å²	161	132 Å²	132	75%	0.752	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	13.9	171.3	-82.8	176.6	-31.3	0	0	114.7	L295	L295-Q299 HydrophobicContact CB-CG 4.08Å; L295-Q299 HydrophobicContact CD2-CG 4.1Å; L295-Q299 WeakPolarHBondContact O-CB 3.29Å; L295-Q299 VanDerWaalsContact O-CG 3.27Å; L295-Q299 WeakPolarHBondContact O-CG 3.33Å; L295-Q299 PolarHBondContact O-N 3.47Å
300	H	39.4	Very low	40.6	Very low	172 Å²	172	135.5 Å²	135.5	80%	0.796	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-7.6	168.7	-161.8	-78.7	0	0	0	113	L298	L298-H300 PolarHBondContact O-N 2.95Å
301	E	38.2	Very low	39.1	Very low	148 Å²	148	141 Å²	141	69%	0.692	70%	0.703	S	S	*	*	S	Bend	trans	-119.6	82.1	-176.5	-67.6	-173.5	173.7	0	0	111.2	L298	L298-E301 PolarHBondContact O-N 3.41Å
302	L	35.4	Very low	38.9	Very low	153 Å²	153	147.4 Å²	147.4	80%	0.801	73%	0.73	S	S	*	*			trans	63.1	94.6	131.9	-60.3	152.9	0	0	0	115.1
303	A	31.3	Very low	39.2	Very low	81 Å²	81	146.5 Å²	146.5	67%	0.669	73%	0.729	S	S	*	*			cis	37.6	75	48.5	0	0	0	0	0	112.2
304	D	33.2	Very low	40	Very low	165 Å²	165	145.6 Å²	145.6	88%	0.882	73%	0.728	S	S	*	*				179	138.6	112.8	-81.2	-23.8	0	0	0	112.6
305	L	27.4	Very low	41.1	Very low	154 Å²	154	146.9 Å²	146.9	81%	0.806	74%	0.739	S	S	*	*			trans	-130.4	163.7	-157.8	-99.1	163.8	0	0	0	109
306	T	24.9	Very low	42.9	Very low	116 Å²	116	148.3 Å²	148.3	71%	0.712	75%	0.747	S	S	*	*			trans	71.9	164.3	147.1	56.2	0	0	0	0	118.9
307	F	26.1	Very low	44.3	Very low	174 Å²	174	150 Å²	150	76%	0.763	75%	0.749	S	S	*	*			cis	-165.3	178.2	5.8	-139.6	-79.6	0	0	0	108.7
308	N	33.3	Very low	45.9	Very low	144 Å²	144	148.3 Å²	148.3	77%	0.77	74%	0.74	S	S	*	*			trans	100	132.8	142.7	-70.3	-25.9	0	0	0	121.4
309	R	31.1	Very low	47.5	Very low	250 Å²	250	149.3 Å²	149.3	94%	0.943	74%	0.742	S	S	*	*			trans	-158.9	150.6	157.6	-152.2	173.9	-174.9	-168.9	0.8	113.6
310	E	33.2	Very low	49.4	Very low	192 Å²	192	146 Å²	146	90%	0.897	73%	0.727	S	S	*	*			trans	-98.7	167.9	-155.5	-62.5	165.3	152.7	0	0	117.3
311	E	39	Very low	51.6	Low	199 Å²	199	145 Å²	145	93%	0.93	72%	0.717	S	S	*	*			trans	-99	162.1	-168.9	-65.9	173.1	149.3	0	0	114.8
312	F	45.6	Very low	53.8	Low	205 Å²	205	141.8 Å²	141.8	90%	0.899	71%	0.71	S	S	*	*			trans	-125.8	144.9	-179.1	-147.5	-90.2	0	0	0	111.1
313	D	58.1	Low	56.3	Low	122 Å²	122	139.5 Å²	139.5	65%	0.652	70%	0.697	S	S	*	*			trans	-88.1	119.7	-161.7	-164.5	-12.3	0	0	0	114.1	D315	D313-D315 PolarHBondContact OD1-N 2.87Å
314	I	68.9	Low	58.9	Low	124 Å²	124	144.8 Å²	144.8	64%	0.636	70%	0.7	S	S	*	*			trans	-100.8	-16	-174.3	-67.8	169.4	0	0	0	111.5
315	D	73.9	Confident	61.6	Low	122 Å²	122	140.5 Å²	140.5	65%	0.652	68%	0.677	S	S	*	*	H	α-helix	trans	-80.3	-36.9	-163.5	-72.7	-25.6	0	0	0	113	D313 L317 N318 E319	D313-D315 PolarHBondContact OD1-N 2.87Å; D315-L317 VanDerWaalsContact C-N 3.29Å; D315-L317 PolarHBondContact O-N 3.38Å; D315-N318 PolarHBondContact O-N 2.86Å; D315-E319 PolarHBondContact O-N 2.98Å
316	D	75.4	Confident	64.6	Low	96 Å²	96	139.5 Å²	139.5	51%	0.513	67%	0.666	S	S	.	*	H	α-helix	trans	-61.3	-36.9	177.5	-176.3	70.5	0	0	0	112.5	N318 E319 Q320	D316-N318 VanDerWaalsContact C-N 3.32Å; D316-N318 PolarHBondContact O-N 3.39Å; D316-E319 PolarHBondContact O-N 3.5Å; D316-Q320 PolarHBondContact O-N 2.92Å; D316-Q320 PolarHBondContact OD2-NE2 2.84Å
317	L	77.9	Confident	67.6	Low	129 Å²	129	141.2 Å²	141.2	68%	0.675	66%	0.663	S	S	*	*	H	α-helix	trans	-67.7	-34.5	-177.9	-169.7	62.9	0	0	0	112.1	D315 Y321	D315-L317 VanDerWaalsContact C-N 3.29Å; D315-L317 PolarHBondContact O-N 3.38Å; L317-Y321 PolarHBondContact O-N 3.42Å
318	N	81.1	Confident	70.6	Confident	98 Å²	98	140.2 Å²	140.2	52%	0.524	66%	0.656	S	S	.	*	H	α-helix	trans	-71	-35.9	178.9	-99.2	-13.1	0	0	0	112.5	D315 D316 Y321 C322	D315-N318 PolarHBondContact O-N 2.86Å; D316-N318 VanDerWaalsContact C-N 3.32Å; D316-N318 PolarHBondContact O-N 3.39Å; N318-Y321 PolarHBondContact O-N 3.45Å; N318-C322 PolarHBondContact O-N 3.49Å; N318-C322 PolarHBondContact O-SG 2.82Å; N318-C322 VanDerWaalsContact O-SG 3.37Å
319	E	81.4	Confident	73.3	Confident	130 Å²	130	137.6 Å²	137.6	61%	0.607	64%	0.642	S	S	*	*	H	α-helix	trans	-66.5	-44.8	178.5	-171.2	174.1	-179.3	0	0	111.4	D315 D316 Y321 C322 L323	D315-E319 PolarHBondContact O-N 2.98Å; D316-E319 PolarHBondContact O-N 3.5Å; E319-Y321 VanDerWaalsContact C-N 3.29Å; E319-Y321 PolarHBondContact O-N 2.91Å; E319-C322 PolarHBondContact O-N 3.39Å; E319-L323 PolarHBondContact O-N 3.24Å
320	Q	81.8	Confident	76.1	Confident	93 Å²	93	129.9 Å²	129.9	44%	0.435	62%	0.617	S	S	.	*	H	α-helix	trans	-61.7	-36.6	177.4	-66.3	-168.7	36.3	0	0	112.7	D316 R324	D316-Q320 PolarHBondContact O-N 2.92Å; D316-Q320 PolarHBondContact OD2-NE2 2.84Å; Q320-R324 PolarHBondContact O-N 2.94Å
321	Y	85.9	Confident	78.6	Confident	151 Å²	151	124.3 Å²	124.3	59%	0.592	60%	0.598	S	S	*	*	H	α-helix	trans	-63.1	-48.3	176.3	178.8	-96.9	0	0	0	111.7	L317 N318 E319 L323 R324 L325	L317-Y321 PolarHBondContact O-N 3.42Å; N318-Y321 PolarHBondContact O-N 3.45Å; E319-Y321 VanDerWaalsContact C-N 3.29Å; E319-Y321 PolarHBondContact O-N 2.91Å; Y321-L323 VanDerWaalsContact C-N 3.34Å; Y321-L323 PolarHBondContact O-N 2.94Å; Y321-R324 PolarHBondContact O-N 2.85Å; Y321-L325 HydrophobicContact CE1-CD2 4.21Å; Y321-L325 PolarHBondContact O-N 3.4Å
322	C	85.1	Confident	81.1	Confident	80 Å²	80	118 Å²	118	54%	0.541	57%	0.574	S	S	.	*	H	α-helix	trans	-59.1	-42.9	-180	-71.7	0	0	0	0	112.5	N318 E319 L325 K326	N318-C322 PolarHBondContact O-N 3.49Å; N318-C322 PolarHBondContact O-SG 2.82Å; N318-C322 VanDerWaalsContact O-SG 3.37Å; E319-C322 PolarHBondContact O-N 3.39Å; C322-L325 PolarHBondContact O-N 2.9Å; C322-K326 PolarHBondContact O-N 3.27Å; C322-K326 VanDerWaalsContact O-N 3.14Å
323	L	86.8	Confident	83.1	Confident	104 Å²	104	111.3 Å²	111.3	55%	0.545	56%	0.556	S	S	.	*	H	α-helix	trans	-66.2	-40.2	179.3	-74.1	171.4	0	0	0	112.7	E319 Y321 K327	E319-L323 PolarHBondContact O-N 3.24Å; Y321-L323 VanDerWaalsContact C-N 3.34Å; Y321-L323 PolarHBondContact O-N 2.94Å; L323-K327 PolarHBondContact O-N 2.96Å
324	R	86.8	Confident	84.5	Confident	193 Å²	193	114 Å²	114	73%	0.728	56%	0.557	S	S	*	*	H	α-helix	trans	-66.3	-40.7	175.9	-73.8	-167.3	-172	-151.6	5.6	111.8	Q320 Y321 K326 K327 Y328	Q320-R324 PolarHBondContact O-N 2.94Å; Y321-R324 PolarHBondContact O-N 2.85Å; R324-K326 VanDerWaalsContact C-N 3.34Å; R324-K326 PolarHBondContact O-N 3.38Å; R324-K327 PolarHBondContact O-N 2.97Å; R324-Y328 WeakPolarHBondContact O-CB 3.45Å; R324-Y328 PolarHBondContact O-N 3.17Å
325	L	90.4	Very high	85.5	Confident	75 Å²	75	112.7 Å²	112.7	39%	0.393	55%	0.551	S	S	.	*	H	α-helix	trans	-62.1	-40.8	179	-174.7	61.3	0	0	0	111.8	Y321 C322 Y328 N329	Y321-L325 HydrophobicContact CE1-CD2 4.21Å; Y321-L325 PolarHBondContact O-N 3.4Å; C322-L325 PolarHBondContact O-N 2.9Å; L325-Y328 PolarHBondContact O-N 3.42Å; L325-N329 VanDerWaalsContact O-CG 3.29Å; L325-N329 PolarHBondContact O-N 3.35Å; L325-N329 PolarHBondContact O-ND2 3.21Å
326	K	89.1	Confident	86.2	Confident	132 Å²	132	108.5 Å²	108.5	57%	0.574	54%	0.537	S	S	*	.	H	α-helix	trans	-62	-48.9	176.5	-172.2	178.2	176.9	-178.8	0	112.5	C322 R324 Y328 N329 E330	C322-K326 PolarHBondContact O-N 3.27Å; C322-K326 VanDerWaalsContact O-N 3.14Å; R324-K326 VanDerWaalsContact C-N 3.34Å; R324-K326 PolarHBondContact O-N 3.38Å; K326-Y328 VanDerWaalsContact C-N 3.3Å; K326-Y328 PolarHBondContact O-N 2.82Å; K326-N329 PolarHBondContact O-N 2.87Å; K326-E330 VanDerWaalsContact CE-OE1 3.24Å; K326-E330 WeakPolarHBondContact CE-OE1 3.33Å; K326-E330 WeakPolarHBondContact O-CG 3.22Å; K326-E330 PolarHBondContact O-N 2.84Å
327	K	88.5	Confident	86.9	Confident	152 Å²	152	108.9 Å²	108.9	66%	0.661	54%	0.542	S	S	*	.	H	α-helix	trans	-62.6	-36.9	177.8	-73.1	-173.8	177.9	-179.8	0	112.6	L323 R324 S331	L323-K327 PolarHBondContact O-N 2.96Å; R324-K327 PolarHBondContact O-N 2.97Å; K327-S331 WeakPolarHBondContact O-CB 3.48Å; K327-S331 PolarHBondContact O-N 3.48Å; K327-S331 VanDerWaalsContact O-N 3.1Å; K327-S331 PolarHBondContact O-OG 3.11Å
328	Y	90.4	Very high	87.4	Confident	153 Å²	153	108.4 Å²	108.4	60%	0.6	54%	0.54	S	S	*	.	H	α-helix	trans	-60.5	-52.6	173.9	176.5	-98.5	0	0	0	110.5	R324 L325 K326 E330 S331 T332	R324-Y328 WeakPolarHBondContact O-CB 3.45Å; R324-Y328 PolarHBondContact O-N 3.17Å; L325-Y328 PolarHBondContact O-N 3.42Å; K326-Y328 VanDerWaalsContact C-N 3.3Å; K326-Y328 PolarHBondContact O-N 2.82Å; Y328-E330 PolarHBondContact O-N 3.32Å; Y328-S331 PolarHBondContact O-N 3.33Å; Y328-T332 PolarHBondContact O-N 3.09Å; Y328-T332 PolarHBondContact O-OG1 2.88Å
329	N	88.9	Confident	87.9	Confident	89 Å²	89	109.2 Å²	109.2	48%	0.476	54%	0.541	S	S	.	.	H	α-helix	trans	-60.3	-42.4	-179.6	-69.1	-21.5	0	0	0	112.9	L325 K326 S331 T332 A333	L325-N329 VanDerWaalsContact O-CG 3.29Å; L325-N329 PolarHBondContact O-N 3.35Å; L325-N329 PolarHBondContact O-ND2 3.21Å; K326-N329 PolarHBondContact O-N 2.87Å; N329-S331 VanDerWaalsContact C-N 3.35Å; N329-S331 PolarHBondContact O-N 3.24Å; N329-T332 PolarHBondContact O-N 3.09Å; N329-A333 WeakPolarHBondContact O-CB 3.34Å; N329-A333 PolarHBondContact O-N 3.39Å
330	E	89.9	Confident	88.3	Confident	89 Å²	89	105.9 Å²	105.9	42%	0.416	54%	0.535	S	S	.	.	H	α-helix	trans	-62.3	-40.8	176.3	-73.3	174.8	-172.3	0	0	112.5	K326 Y328 R334	K326-E330 VanDerWaalsContact CE-OE1 3.24Å; K326-E330 WeakPolarHBondContact CE-OE1 3.33Å; K326-E330 WeakPolarHBondContact O-CG 3.22Å; K326-E330 PolarHBondContact O-N 2.84Å; Y328-E330 PolarHBondContact O-N 3.32Å; E330-R334 WeakPolarHBondContact O-CG 3.48Å; E330-R334 PolarHBondContact O-N 3.12Å; E330-R334 VanDerWaalsContact O-N 3.12Å
331	S	86.9	Confident	88.8	Confident	74 Å²	74	109.7 Å²	109.7	52%	0.517	55%	0.546	S	S	.	.	H	α-helix	trans	-69.1	-42	178.6	-56.9	0	0	0	0	111.3	K327 Y328 N329 A333 R334 L335	K327-S331 WeakPolarHBondContact O-CB 3.48Å; K327-S331 PolarHBondContact O-N 3.48Å; K327-S331 VanDerWaalsContact O-N 3.1Å; K327-S331 PolarHBondContact O-OG 3.11Å; Y328-S331 PolarHBondContact O-N 3.33Å; N329-S331 VanDerWaalsContact C-N 3.35Å; N329-S331 PolarHBondContact O-N 3.24Å; S331-A333 VanDerWaalsContact C-N 3.35Å; S331-A333 PolarHBondContact O-N 3.42Å; S331-R334 PolarHBondContact O-N 3.02Å; S331-L335 WeakPolarHBondContact O-CB 3.47Å; S331-L335 PolarHBondContact O-N 3.34Å
332	T	90.7	Very high	89	Confident	68 Å²	68	109.2 Å²	109.2	42%	0.417	55%	0.547	S	S	.	.	H	α-helix	trans	-62.1	-41.2	176.1	-53.7	0	0	0	0	111.6	Y328 N329 L335 G336	Y328-T332 PolarHBondContact O-N 3.09Å; Y328-T332 PolarHBondContact O-OG1 2.88Å; N329-T332 PolarHBondContact O-N 3.09Å; T332-L335 PolarHBondContact O-N 3.43Å; T332-G336 PolarHBondContact O-N 3.02Å; T332-G336 VanDerWaalsContact O-N 3.08Å
333	A	86.6	Confident	89.2	Confident	64 Å²	64	110.5 Å²	110.5	53%	0.529	55%	0.545	S	S	.	.	H	α-helix	trans	-64.8	-43.1	175.9	0	0	0	0	0	112.6	N329 S331 L335 G336 V337	N329-A333 WeakPolarHBondContact O-CB 3.34Å; N329-A333 PolarHBondContact O-N 3.39Å; S331-A333 VanDerWaalsContact C-N 3.35Å; S331-A333 PolarHBondContact O-N 3.42Å; A333-L335 VanDerWaalsContact C-N 3.32Å; A333-L335 PolarHBondContact O-N 3.01Å; A333-G336 PolarHBondContact O-N 3.47Å; A333-V337 PolarHBondContact O-N 2.77Å
334	R	88.4	Confident	89.2	Confident	178 Å²	178	108.5 Å²	108.5	67%	0.672	54%	0.539	S	S	*	.	H	α-helix	trans	-63	-39.3	175.4	-74.3	178.3	-178	178.5	2.8	112.2	E330 S331 V337 L338	E330-R334 WeakPolarHBondContact O-CG 3.48Å; E330-R334 PolarHBondContact O-N 3.12Å; E330-R334 VanDerWaalsContact O-N 3.12Å; S331-R334 PolarHBondContact O-N 3.02Å; R334-V337 PolarHBondContact O-N 2.95Å; R334-L338 WeakPolarHBondContact O-CG 3.47Å; R334-L338 PolarHBondContact O-N 3.16Å
335	L	89.4	Confident	89.3	Confident	96 Å²	96	103.9 Å²	103.9	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-61.9	-45.8	177.5	-168.6	133.9	0	0	0	110.8	S331 T332 A333 V337 L338 E339	S331-L335 WeakPolarHBondContact O-CB 3.47Å; S331-L335 PolarHBondContact O-N 3.34Å; T332-L335 PolarHBondContact O-N 3.43Å; A333-L335 VanDerWaalsContact C-N 3.32Å; A333-L335 PolarHBondContact O-N 3.01Å; L335-V337 PolarHBondContact O-N 2.86Å; L335-L338 PolarHBondContact O-N 2.7Å; L335-E339 VanDerWaalsContact CD2-CD 3.49Å; L335-E339 HydrophobicContact CD2-CG 4.33Å; L335-E339 VanDerWaalsContact CD2-OE1 3.26Å; L335-E339 WeakPolarHBondContact CD2-OE1 3.37Å; L335-E339 WeakPolarHBondContact O-CG 3.49Å; L335-E339 PolarHBondContact O-N 3.38Å
336	G	88.9	Confident	89.1	Confident	35 Å²	35	104.5 Å²	104.5	36%	0.361	53%	0.53	S	S	.	.	H	α-helix	trans	-60.5	-39	175.8	0	0	0	0	0	114.2	T332 A333 E339 A340	T332-G336 PolarHBondContact O-N 3.02Å; T332-G336 VanDerWaalsContact O-N 3.08Å; A333-G336 PolarHBondContact O-N 3.47Å; G336-E339 PolarHBondContact O-N 2.83Å; G336-A340 WeakPolarHBondContact O-CB 3.42Å; G336-A340 PolarHBondContact O-N 3.41Å
337	V	89.2	Confident	88.9	Confident	103 Å²	103	104 Å²	104	62%	0.624	53%	0.528	S	S	*	.	H	α-helix	trans	-67.1	-40.8	175.9	175.2	0	0	0	0	111.7	A333 R334 L335 R341	A333-V337 PolarHBondContact O-N 2.77Å; R334-V337 PolarHBondContact O-N 2.95Å; L335-V337 PolarHBondContact O-N 2.86Å; V337-R341 WeakPolarHBondContact O-CB 3.36Å; V337-R341 PolarHBondContact O-N 3.5Å
338	L	89.9	Confident	88.6	Confident	119 Å²	119	101.4 Å²	101.4	62%	0.623	52%	0.521	S	S	*	.	H	α-helix	trans	-68	-38	177.6	-73.3	171.2	0	0	0	111.8	R334 L335 R341 K342	R334-L338 WeakPolarHBondContact O-CG 3.47Å; R334-L338 PolarHBondContact O-N 3.16Å; L335-L338 PolarHBondContact O-N 2.7Å; L338-R341 PolarHBondContact O-N 3.03Å; L338-K342 VanDerWaalsContact O-CB 3.3Å; L338-K342 WeakPolarHBondContact O-CB 3.31Å; L338-K342 PolarHBondContact O-N 2.97Å
339	E	90.8	Very high	88.1	Confident	116 Å²	116	99.6 Å²	99.6	54%	0.542	52%	0.521	S	S	.	.	H	α-helix	trans	-64.3	-46.7	174.3	-74.9	178.6	162	0	0	111.6	L335 G336 R341 K342 E343	L335-E339 VanDerWaalsContact CD2-CD 3.49Å; L335-E339 HydrophobicContact CD2-CG 4.33Å; L335-E339 VanDerWaalsContact CD2-OE1 3.26Å; L335-E339 WeakPolarHBondContact CD2-OE1 3.37Å; L335-E339 WeakPolarHBondContact O-CG 3.49Å; L335-E339 PolarHBondContact O-N 3.38Å; G336-E339 PolarHBondContact O-N 2.83Å; E339-R341 VanDerWaalsContact C-N 3.31Å; E339-R341 PolarHBondContact O-N 2.85Å; E339-K342 WeakPolarHBondContact O-CB 3.06Å; E339-K342 PolarHBondContact O-N 3.27Å; E339-E343 WeakPolarHBondContact O-CB 3.47Å; E339-E343 PolarHBondContact O-N 3.43Å
340	A	89.5	Confident	87.6	Confident	59 Å²	59	100.2 Å²	100.2	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-60.5	-40.1	175.3	0	0	0	0	0	112.1	G336 E343 S344	G336-A340 WeakPolarHBondContact O-CB 3.42Å; G336-A340 PolarHBondContact O-N 3.41Å; A340-E343 PolarHBondContact O-N 3.33Å; A340-S344 PolarHBondContact O-N 3.34Å
341	R	92	Very high	87.1	Confident	174 Å²	174	98.5 Å²	98.5	66%	0.657	52%	0.519	S	S	*	.	H	α-helix	trans	-68.4	-41	176.2	-171.6	173.3	-174.3	169.7	2.1	112.2	V337 L338 E339 E343 S344 I345	V337-R341 WeakPolarHBondContact O-CB 3.36Å; V337-R341 PolarHBondContact O-N 3.5Å; L338-R341 PolarHBondContact O-N 3.03Å; E339-R341 VanDerWaalsContact C-N 3.31Å; E339-R341 PolarHBondContact O-N 2.85Å; R341-E343 VanDerWaalsContact C-N 3.3Å; R341-E343 PolarHBondContact O-N 2.83Å; R341-S344 PolarHBondContact O-N 3.48Å; R341-I345 HydrophobicContact CG-CD1 4.02Å; R341-I345 WeakPolarHBondContact O-CG1 3.48Å; R341-I345 PolarHBondContact O-N 2.9Å
342	K	90.4	Very high	86.2	Confident	141 Å²	141	103.8 Å²	103.8	61%	0.613	54%	0.535	S	S	*	.	H	α-helix	trans	-58.3	-45.8	173.2	179.2	-172.3	173.1	-171.6	0	110	L338 E339 I345 M346	L338-K342 VanDerWaalsContact O-CB 3.3Å; L338-K342 WeakPolarHBondContact O-CB 3.31Å; L338-K342 PolarHBondContact O-N 2.97Å; E339-K342 WeakPolarHBondContact O-CB 3.06Å; E339-K342 PolarHBondContact O-N 3.27Å; K342-I345 PolarHBondContact O-N 3.12Å; K342-M346 HydrophobicContact CG-SD 4.21Å; K342-M346 WeakPolarHBondContact O-CB 3.37Å; K342-M346 VanDerWaalsContact O-CG 3.29Å; K342-M346 WeakPolarHBondContact O-CG 3.2Å; K342-M346 PolarHBondContact O-N 3.36Å
343	E	89.2	Confident	85.2	Confident	107 Å²	107	103.3 Å²	103.3	50%	0.5	54%	0.544	S	S	.	.	H	α-helix	trans	-65.2	-40.3	179.1	-160.7	-171.6	149.5	0	0	112.2	E339 A340 R341 M346 K347	E339-E343 WeakPolarHBondContact O-CB 3.47Å; E339-E343 PolarHBondContact O-N 3.43Å; A340-E343 PolarHBondContact O-N 3.33Å; R341-E343 VanDerWaalsContact C-N 3.3Å; R341-E343 PolarHBondContact O-N 2.83Å; E343-M346 PolarHBondContact O-N 3.5Å; E343-K347 WeakPolarHBondContact O-CG 3.35Å; E343-K347 PolarHBondContact O-N 3.01Å; E343-K347 WeakPolarHBondContact OE1-CE 3.33Å; E343-K347 IonicContact OE1-NZ 3.97Å; E343-K347 PolarHBondContact OE1-NZ 2.94Å
344	S	87.7	Confident	84.3	Confident	61 Å²	61	103.7 Å²	103.7	43%	0.427	54%	0.542	S	S	.	.	H	α-helix	trans	-61.6	-48	174	-169.6	0	0	0	0	112	A340 R341 M346 K347 D348	A340-S344 PolarHBondContact O-N 3.34Å; R341-S344 PolarHBondContact O-N 3.48Å; S344-M346 VanDerWaalsContact C-N 3.29Å; S344-M346 PolarHBondContact O-N 3.5Å; S344-K347 PolarHBondContact O-N 3.24Å; S344-K347 VanDerWaalsContact O-N 3.17Å; S344-D348 VanDerWaalsContact O-CG 3.29Å; S344-D348 PolarHBondContact O-N 2.89Å
345	I	87.8	Confident	83.4	Confident	96 Å²	96	100.9 Å²	100.9	49%	0.492	54%	0.535	S	S	.	.	H	α-helix	trans	-64.5	-36.9	178.7	-67.7	168.7	0	0	0	110.7	R341 K342 D348 L349	R341-I345 HydrophobicContact CG-CD1 4.02Å; R341-I345 WeakPolarHBondContact O-CG1 3.48Å; R341-I345 PolarHBondContact O-N 2.9Å; K342-I345 PolarHBondContact O-N 3.12Å; I345-D348 PolarHBondContact O-N 2.85Å; I345-L349 VanDerWaalsContact O-CB 3.25Å; I345-L349 WeakPolarHBondContact O-CB 3.3Å; I345-L349 PolarHBondContact O-N 3.27Å
346	M	86.2	Confident	82.8	Confident	89 Å²	89	99.5 Å²	99.5	44%	0.438	53%	0.528	S	S	.	.	H	α-helix	trans	-64.3	-43.5	173.7	-76	-177	64.8	0	0	111.4	K342 E343 S344 D348 L349 E350	K342-M346 HydrophobicContact CG-SD 4.21Å; K342-M346 WeakPolarHBondContact O-CB 3.37Å; K342-M346 VanDerWaalsContact O-CG 3.29Å; K342-M346 WeakPolarHBondContact O-CG 3.2Å; K342-M346 PolarHBondContact O-N 3.36Å; E343-M346 PolarHBondContact O-N 3.5Å; S344-M346 VanDerWaalsContact C-N 3.29Å; S344-M346 PolarHBondContact O-N 3.5Å; M346-D348 PolarHBondContact O-N 2.88Å; M346-L349 PolarHBondContact O-N 3.37Å; M346-E350 WeakPolarHBondContact O-CB 3.28Å; M346-E350 WeakPolarHBondContact O-CG 3.26Å; M346-E350 PolarHBondContact O-N 2.97Å
347	K	84.8	Confident	82.4	Confident	122 Å²	122	100 Å²	100	53%	0.53	53%	0.529	S	S	.	.	H	α-helix	trans	-61.7	-41.7	174.5	-77.7	175.1	-175.5	159.1	0	112.5	E343 S344 E350 S351	E343-K347 WeakPolarHBondContact O-CG 3.35Å; E343-K347 PolarHBondContact O-N 3.01Å; E343-K347 WeakPolarHBondContact OE1-CE 3.33Å; E343-K347 IonicContact OE1-NZ 3.97Å; E343-K347 PolarHBondContact OE1-NZ 2.94Å; S344-K347 PolarHBondContact O-N 3.24Å; S344-K347 VanDerWaalsContact O-N 3.17Å; K347-E350 CarbonylContact O-C 3.6Å; K347-E350 PolarHBondContact O-N 3.05Å; K347-S351 PolarHBondContact O-N 3.08Å
348	D	84	Confident	82.1	Confident	96 Å²	96	101.2 Å²	101.2	51%	0.513	53%	0.532	S	S	.	.	H	α-helix	trans	-66.6	-42.3	177.1	-65.6	-23.1	0	0	0	111.4	S344 I345 M346 E350 S351	S344-D348 VanDerWaalsContact O-CG 3.29Å; S344-D348 PolarHBondContact O-N 2.89Å; I345-D348 PolarHBondContact O-N 2.85Å; M346-D348 PolarHBondContact O-N 2.88Å; D348-E350 PolarHBondContact O-N 3.42Å; D348-S351 VanDerWaalsContact O-CB 3.27Å; D348-S351 WeakPolarHBondContact O-CB 3.38Å; D348-S351 PolarHBondContact O-N 3.35Å; D348-S351 VanDerWaalsContact O-N 3.13Å; D348-S351 PolarHBondContact O-OG 3.35Å
349	L	79.5	Confident	81.9	Confident	116 Å²	116	101.8 Å²	101.8	61%	0.607	53%	0.529	S	S	*	.	H	α-helix	trans	-64.6	-30.4	173.8	-171.8	68.5	0	0	0	111.7	I345 M346 S351 K355	I345-L349 VanDerWaalsContact O-CB 3.25Å; I345-L349 WeakPolarHBondContact O-CB 3.3Å; I345-L349 PolarHBondContact O-N 3.27Å; M346-L349 PolarHBondContact O-N 3.37Å; L349-S351 VanDerWaalsContact C-N 3.35Å; L349-K355 VanDerWaalsContact O-CG 3.25Å; L349-K355 WeakPolarHBondContact O-CG 3.43Å
350	E	77.5	Confident	81.7	Confident	102 Å²	102	100.2 Å²	100.2	48%	0.477	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-9	175.5	-77.9	-175.8	-162.6	0	0	114.4	M346 K347 D348 K355	M346-E350 WeakPolarHBondContact O-CB 3.28Å; M346-E350 WeakPolarHBondContact O-CG 3.26Å; M346-E350 PolarHBondContact O-N 2.97Å; K347-E350 CarbonylContact O-C 3.6Å; K347-E350 PolarHBondContact O-N 3.05Å; D348-E350 PolarHBondContact O-N 3.42Å; E350-K355 VanDerWaalsContact CA-CE 3.4Å; E350-K355 WeakPolarHBondContact O-CD 3.37Å; E350-K355 VanDerWaalsContact O-CE 3.27Å; E350-K355 WeakPolarHBondContact O-CE 3.25Å; E350-K355 PolarHBondContact O-NZ 2.99Å; E350-K355 IonicContact OE2-NZ 2.82Å
351	S	78.9	Confident	81.5	Confident	53 Å²	53	104.2 Å²	104.2	37%	0.371	53%	0.531	S	S	.	.	S	Bend	trans	-62.4	145.6	174.5	72.4	0	0	0	0	110.6	K347 D348 L349 G353 C354 K355	K347-S351 PolarHBondContact O-N 3.08Å; D348-S351 VanDerWaalsContact O-CB 3.27Å; D348-S351 WeakPolarHBondContact O-CB 3.38Å; D348-S351 PolarHBondContact O-N 3.35Å; D348-S351 VanDerWaalsContact O-N 3.13Å; D348-S351 PolarHBondContact O-OG 3.35Å; L349-S351 VanDerWaalsContact C-N 3.35Å; S351-G353 PolarHBondContact O-N 3.31Å; S351-C354 PolarHBondContact O-N 2.88Å; S351-K355 PolarHBondContact O-N 3.39Å; S351-K355 VanDerWaalsContact O-N 3.11Å
352	E	69.4	Low	81.4	Confident	184 Å²	184	100.6 Å²	100.6	86%	0.86	52%	0.521	S	S	*	.	H	α-helix	trans	-56.3	-28.5	-174.4	-63.9	-172.8	161	0	0	112.8
353	G	68.3	Low	81.4	Confident	59 Å²	59	98.3 Å²	98.3	61%	0.608	52%	0.516	S	S	*	.	H	α-helix	trans	-71.9	-35.2	177.1	0	0	0	0	0	114.5	S351 A357	S351-G353 PolarHBondContact O-N 3.31Å; G353-A357 WeakPolarHBondContact O-CB 3.36Å
354	C	67.7	Low	81.5	Confident	71 Å²	71	98.9 Å²	98.9	48%	0.48	52%	0.517	S	S	.	.	H	α-helix	trans	-92.2	-37	-176.2	-73.8	0	0	0	0	113.2	S351 D356 A357	S351-C354 PolarHBondContact O-N 2.88Å; C354-D356 VanDerWaalsContact C-N 3.32Å; C354-D356 PolarHBondContact O-N 3.41Å; C354-A357 PolarHBondContact O-N 2.81Å
355	K	69.5	Low	81.8	Confident	120 Å²	120	100 Å²	100	52%	0.522	52%	0.518	S	S	.	.	H	α-helix	trans	-56.5	-45.8	-179	-81.7	-175.9	163.6	129.1	0	112.6	L349 E350 S351	L349-K355 VanDerWaalsContact O-CG 3.25Å; L349-K355 WeakPolarHBondContact O-CG 3.43Å; E350-K355 VanDerWaalsContact CA-CE 3.4Å; E350-K355 WeakPolarHBondContact O-CD 3.37Å; E350-K355 VanDerWaalsContact O-CE 3.27Å; E350-K355 WeakPolarHBondContact O-CE 3.25Å; E350-K355 PolarHBondContact O-NZ 2.99Å; E350-K355 IonicContact OE2-NZ 2.82Å; S351-K355 PolarHBondContact O-N 3.39Å; S351-K355 VanDerWaalsContact O-N 3.11Å
356	D	77.9	Confident	82	Confident	66 Å²	66	99.9 Å²	99.9	35%	0.353	52%	0.517	S	S	.	.	S	Bend	trans	-104.7	6.2	-175.4	-72.4	-40.7	0	0	0	113.3	C354 N358 K359 V360	C354-D356 VanDerWaalsContact C-N 3.32Å; C354-D356 PolarHBondContact O-N 3.41Å; D356-N358 PolarHBondContact O-N 3.16Å; D356-N358 VanDerWaalsContact O-N 3.15Å; D356-K359 CarbonylContact O-C 3.25Å; D356-K359 WeakPolarHBondContact O-CA 3.29Å; D356-K359 PolarHBondContact O-N 3.36Å; D356-K359 WeakPolarHBondContact OD1-CD 3.49Å; D356-K359 WeakPolarHBondContact OD1-CE 3.33Å; D356-K359 IonicContact OD1-NZ 2.73Å; D356-K359 PolarHBondContact OD1-NZ 3.24Å; D356-V360 HydrophobicContact CB-CG2 4.45Å; D356-V360 WeakPolarHBondContact O-CG2 3.26Å; D356-V360 PolarHBondContact O-N 3.24Å
357	A	80.2	Confident	82.3	Confident	46 Å²	46	99.5 Å²	99.5	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-49.4	-45.5	179.5	0	0	0	0	0	112.4	G353 C354 Y361	G353-A357 WeakPolarHBondContact O-CB 3.36Å; C354-A357 PolarHBondContact O-N 2.81Å; A357-Y361 VanDerWaalsContact O-CB 3.23Å; A357-Y361 WeakPolarHBondContact O-CB 3.33Å; A357-Y361 PolarHBondContact O-N 3.19Å
358	N	83.6	Confident	82.7	Confident	129 Å²	129	98.6 Å²	98.6	69%	0.69	52%	0.517	S	S	*	.	H	α-helix	trans	-65.3	-40.9	177.2	-82.7	-25.1	0	0	0	112.3	D356 Q362	D356-N358 PolarHBondContact O-N 3.16Å; D356-N358 VanDerWaalsContact O-N 3.15Å; N358-Q362 WeakPolarHBondContact O-CB 3.45Å; N358-Q362 WeakPolarHBondContact O-CG 3.48Å; N358-Q362 PolarHBondContact O-N 3.05Å
359	K	85.6	Confident	83.2	Confident	131 Å²	131	99.8 Å²	99.8	57%	0.57	52%	0.519	S	S	*	.	H	α-helix	trans	-68	-43.4	178.2	-64.3	-175.2	-163.9	145.3	0	111.3	D356 Q362 N363	D356-K359 CarbonylContact O-C 3.25Å; D356-K359 WeakPolarHBondContact O-CA 3.29Å; D356-K359 PolarHBondContact O-N 3.36Å; D356-K359 WeakPolarHBondContact OD1-CD 3.49Å; D356-K359 WeakPolarHBondContact OD1-CE 3.33Å; D356-K359 IonicContact OD1-NZ 2.73Å; D356-K359 PolarHBondContact OD1-NZ 3.24Å; K359-Q362 PolarHBondContact O-N 2.97Å; K359-N363 WeakPolarHBondContact O-CB 3.5Å; K359-N363 PolarHBondContact O-N 2.88Å; K359-N363 PolarHBondContact O-ND2 3.46Å
360	V	86.3	Confident	83.9	Confident	82 Å²	82	97.7 Å²	97.7	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-63	-44	176.8	175.6	0	0	0	0	110.4	D356 N363 K364	D356-V360 HydrophobicContact CB-CG2 4.45Å; D356-V360 WeakPolarHBondContact O-CG2 3.26Å; D356-V360 PolarHBondContact O-N 3.24Å; V360-N363 PolarHBondContact O-N 3.48Å; V360-K364 HydrophobicContact CG1-CG 4.41Å; V360-K364 WeakPolarHBondContact O-CB 3.45Å; V360-K364 VanDerWaalsContact O-CG 3.31Å; V360-K364 WeakPolarHBondContact O-CG 3.28Å; V360-K364 PolarHBondContact O-N 3.49Å
361	Y	85.1	Confident	84.6	Confident	143 Å²	143	95 Å²	95	56%	0.561	51%	0.506	S	S	*	.	H	α-helix	trans	-60.4	-47.1	174.8	176.5	-99.4	0	0	0	111.8	A357 K364 L365	A357-Y361 VanDerWaalsContact O-CB 3.23Å; A357-Y361 WeakPolarHBondContact O-CB 3.33Å; A357-Y361 PolarHBondContact O-N 3.19Å; Y361-K364 PolarHBondContact O-N 3.33Å; Y361-L365 WeakPolarHBondContact O-CB 3.24Å; Y361-L365 PolarHBondContact O-N 2.89Å
362	Q	89.7	Confident	85.3	Confident	99 Å²	99	96.8 Å²	96.8	46%	0.463	51%	0.511	S	S	.	.	H	α-helix	trans	-62.3	-44.5	177	-71	-68.4	-17.1	0	0	111.7	N358 K359 K364 L365 I366	N358-Q362 WeakPolarHBondContact O-CB 3.45Å; N358-Q362 WeakPolarHBondContact O-CG 3.48Å; N358-Q362 PolarHBondContact O-N 3.05Å; K359-Q362 PolarHBondContact O-N 2.97Å; Q362-K364 VanDerWaalsContact C-N 3.34Å; Q362-K364 PolarHBondContact O-N 3.48Å; Q362-L365 WeakPolarHBondContact O-CB 3.39Å; Q362-L365 PolarHBondContact O-N 3.48Å; Q362-I366 VanDerWaalsContact O-CG1 3.25Å; Q362-I366 WeakPolarHBondContact O-CG1 3.37Å; Q362-I366 PolarHBondContact O-N 3.21Å
363	N	91.5	Very high	86.5	Confident	93 Å²	93	91.3 Å²	91.3	50%	0.497	49%	0.487	S	S	.	.	H	α-helix	trans	-61.5	-42.7	175.9	-71.5	-11.6	0	0	0	111.4	K359 V360 I366 D367	K359-N363 WeakPolarHBondContact O-CB 3.5Å; K359-N363 PolarHBondContact O-N 2.88Å; K359-N363 PolarHBondContact O-ND2 3.46Å; V360-N363 PolarHBondContact O-N 3.48Å; N363-I366 PolarHBondContact O-N 2.94Å; N363-D367 PolarHBondContact O-N 3.4Å
364	K	91.1	Very high	87.7	Confident	119 Å²	119	92.9 Å²	92.9	52%	0.517	48%	0.481	S	S	.	.	H	α-helix	trans	-67.9	-35.4	176.8	-71.8	-69.5	162.6	-145	0	112.9	V360 Y361 Q362 I366 D367 I368	V360-K364 HydrophobicContact CG1-CG 4.41Å; V360-K364 WeakPolarHBondContact O-CB 3.45Å; V360-K364 VanDerWaalsContact O-CG 3.31Å; V360-K364 WeakPolarHBondContact O-CG 3.28Å; V360-K364 PolarHBondContact O-N 3.49Å; Y361-K364 PolarHBondContact O-N 3.33Å; Q362-K364 VanDerWaalsContact C-N 3.34Å; Q362-K364 PolarHBondContact O-N 3.48Å; K364-I366 VanDerWaalsContact C-N 3.34Å; K364-D367 IonicContact NZ-OD2 3.7Å; K364-D367 PolarHBondContact NZ-OD2 3.36Å; K364-D367 PolarHBondContact O-N 2.91Å; K364-I368 WeakPolarHBondContact O-CB 3.47Å; K364-I368 VanDerWaalsContact O-CG1 3.24Å; K364-I368 WeakPolarHBondContact O-CG1 3.49Å; K364-I368 PolarHBondContact O-N 2.86Å
365	L	93.3	Very high	88.9	Confident	85 Å²	85	93 Å²	93	45%	0.445	48%	0.481	S	S	.	.	H	α-helix	trans	-62.8	-43.5	172.5	-166.7	88	0	0	0	110.7	Y361 Q362 I368 H369	Y361-L365 WeakPolarHBondContact O-CB 3.24Å; Y361-L365 PolarHBondContact O-N 2.89Å; Q362-L365 WeakPolarHBondContact O-CB 3.39Å; Q362-L365 PolarHBondContact O-N 3.48Å; L365-I368 PolarHBondContact O-N 3.48Å; L365-H369 WeakPolarHBondContact O-CB 3.49Å; L365-H369 PolarHBondContact O-N 2.8Å
366	I	92.1	Very high	90.1	Very high	92 Å²	92	92.6 Å²	92.6	47%	0.472	48%	0.481	S	S	.	.	H	α-helix	trans	-63.3	-47.6	174.6	-65.7	163.8	0	0	0	110.2	Q362 N363 K364 I368 H369 V370	Q362-I366 VanDerWaalsContact O-CG1 3.25Å; Q362-I366 WeakPolarHBondContact O-CG1 3.37Å; Q362-I366 PolarHBondContact O-N 3.21Å; N363-I366 PolarHBondContact O-N 2.94Å; K364-I366 VanDerWaalsContact C-N 3.34Å; I366-I368 VanDerWaalsContact C-N 3.32Å; I366-I368 PolarHBondContact O-N 3.49Å; I366-H369 PolarHBondContact O-N 3.27Å; I366-H369 VanDerWaalsContact O-N 3.16Å; I366-V370 HydrophobicContact CG2-CG2 4.05Å; I366-V370 WeakPolarHBondContact O-CB 3.36Å; I366-V370 VanDerWaalsContact O-CG2 3.26Å; I366-V370 WeakPolarHBondContact O-CG2 3.45Å; I366-V370 PolarHBondContact O-N 2.91Å
367	D	93.4	Very high	90.9	Very high	81 Å²	81	92.2 Å²	92.2	43%	0.433	48%	0.48	S	S	.	.	H	α-helix	trans	-54.6	-47.4	177.4	-70.2	-15.8	0	0	0	111.1	N363 K364 V370 A371	N363-D367 PolarHBondContact O-N 3.4Å; K364-D367 IonicContact NZ-OD2 3.7Å; K364-D367 PolarHBondContact NZ-OD2 3.36Å; K364-D367 PolarHBondContact O-N 2.91Å; D367-V370 PolarHBondContact O-N 2.96Å; D367-A371 VanDerWaalsContact O-CB 3.29Å; D367-A371 WeakPolarHBondContact O-CB 3.25Å; D367-A371 PolarHBondContact O-N 3.45Å
368	I	93	Very high	91.6	Very high	104 Å²	104	95.2 Å²	95.2	53%	0.533	49%	0.488	S	S	.	.	H	α-helix	trans	-64.9	-43.8	178.9	-69.5	166.4	0	0	0	110.7	K364 L365 I366 A371 N372	K364-I368 WeakPolarHBondContact O-CB 3.47Å; K364-I368 VanDerWaalsContact O-CG1 3.24Å; K364-I368 WeakPolarHBondContact O-CG1 3.49Å; K364-I368 PolarHBondContact O-N 2.86Å; L365-I368 PolarHBondContact O-N 3.48Å; I366-I368 VanDerWaalsContact C-N 3.32Å; I366-I368 PolarHBondContact O-N 3.49Å; I368-A371 PolarHBondContact O-N 3.16Å; I368-N372 PolarHBondContact O-N 2.96Å; I368-N372 PolarHBondContact O-ND2 3.49Å
369	H	94.2	Very high	92	Very high	121 Å²	121	94.4 Å²	94.4	56%	0.56	48%	0.484	S	S	*	.	H	α-helix	trans	-64.6	-44.1	179.4	-171.6	57.4	0	0	0	111.7	L365 I366 N372 I373	L365-H369 WeakPolarHBondContact O-CB 3.49Å; L365-H369 PolarHBondContact O-N 2.8Å; I366-H369 PolarHBondContact O-N 3.27Å; I366-H369 VanDerWaalsContact O-N 3.16Å; H369-N372 PolarHBondContact O-N 3.34Å; H369-I373 WeakPolarHBondContact O-CG1 3.25Å; H369-I373 PolarHBondContact O-N 3.06Å
370	V	93.1	Very high	92.4	Very high	71 Å²	71	93.5 Å²	93.5	43%	0.43	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-44.1	175.5	171.2	0	0	0	0	110.8	I366 D367 N372 I373 I374	I366-V370 HydrophobicContact CG2-CG2 4.05Å; I366-V370 WeakPolarHBondContact O-CB 3.36Å; I366-V370 VanDerWaalsContact O-CG2 3.26Å; I366-V370 WeakPolarHBondContact O-CG2 3.45Å; I366-V370 PolarHBondContact O-N 2.91Å; D367-V370 PolarHBondContact O-N 2.96Å; V370-N372 VanDerWaalsContact C-N 3.33Å; V370-N372 PolarHBondContact O-N 2.68Å; V370-I373 PolarHBondContact O-N 3.26Å; V370-I374 HydrophobicContact CG1-CD1 3.78Å; V370-I374 HydrophobicContact CG1-CG1 4.39Å; V370-I374 VanDerWaalsContact O-CG1 3.28Å; V370-I374 WeakPolarHBondContact O-CG1 3.47Å; V370-I374 PolarHBondContact O-N 3.41Å
371	A	92.8	Very high	92.7	Very high	47 Å²	47	97.7 Å²	97.7	39%	0.388	49%	0.488	S	S	.	.	H	α-helix	trans	-61	-40.3	176.7	0	0	0	0	0	112.4	D367 I368 I374 C375	D367-A371 VanDerWaalsContact O-CB 3.29Å; D367-A371 WeakPolarHBondContact O-CB 3.25Å; D367-A371 PolarHBondContact O-N 3.45Å; I368-A371 PolarHBondContact O-N 3.16Å; A371-I374 PolarHBondContact O-N 3.42Å; A371-C375 PolarHBondContact O-N 2.76Å; A371-C375 PolarHBondContact O-SG 2.87Å; A371-C375 VanDerWaalsContact O-SG 3.35Å
372	N	94.3	Very high	92.9	Very high	90 Å²	90	93.6 Å²	93.6	48%	0.481	48%	0.484	S	S	.	.	H	α-helix	trans	-64.2	-43.3	175.6	-73	-25.4	0	0	0	111.9	I368 H369 V370 I374 C375 E376	I368-N372 PolarHBondContact O-N 2.96Å; I368-N372 PolarHBondContact O-ND2 3.49Å; H369-N372 PolarHBondContact O-N 3.34Å; V370-N372 VanDerWaalsContact C-N 3.33Å; V370-N372 PolarHBondContact O-N 2.68Å; N372-I374 VanDerWaalsContact C-N 3.34Å; N372-I374 PolarHBondContact O-N 2.95Å; N372-C375 PolarHBondContact O-N 3.39Å; N372-E376 WeakPolarHBondContact O-CG 3.37Å; N372-E376 PolarHBondContact O-N 2.86Å
373	I	94.1	Very high	92.9	Very high	69 Å²	69	94.6 Å²	94.6	35%	0.354	49%	0.488	S	S	.	.	H	α-helix	trans	-61.6	-43.1	175.2	-66.3	166.4	0	0	0	110.7	H369 V370 C375 E376 D377	H369-I373 WeakPolarHBondContact O-CG1 3.25Å; H369-I373 PolarHBondContact O-N 3.06Å; V370-I373 PolarHBondContact O-N 3.26Å; I373-C375 VanDerWaalsContact C-N 3.33Å; I373-C375 PolarHBondContact O-N 2.82Å; I373-E376 PolarHBondContact O-N 2.82Å; I373-D377 WeakPolarHBondContact O-CB 3.45Å; I373-D377 PolarHBondContact O-N 2.92Å
374	I	94.3	Very high	93	Very high	91 Å²	91	92.9 Å²	92.9	47%	0.467	49%	0.487	S	S	.	.	H	α-helix	trans	-59.8	-44.5	176.7	-69.5	165.8	0	0	0	110.7	V370 A371 N372 E376 D377 L378	V370-I374 HydrophobicContact CG1-CD1 3.78Å; V370-I374 HydrophobicContact CG1-CG1 4.39Å; V370-I374 VanDerWaalsContact O-CG1 3.28Å; V370-I374 WeakPolarHBondContact O-CG1 3.47Å; V370-I374 PolarHBondContact O-N 3.41Å; A371-I374 PolarHBondContact O-N 3.42Å; N372-I374 VanDerWaalsContact C-N 3.34Å; N372-I374 PolarHBondContact O-N 2.95Å; I374-E376 PolarHBondContact O-N 2.85Å; I374-D377 PolarHBondContact O-N 2.87Å; I374-L378 HydrophobicContact CG2-CD1 3.89Å; I374-L378 HydrophobicContact CG2-CG 4.22Å; I374-L378 WeakPolarHBondContact O-CB 3.33Å; I374-L378 VanDerWaalsContact O-CG 3.26Å; I374-L378 WeakPolarHBondContact O-CG 3.4Å; I374-L378 PolarHBondContact O-N 3.25Å
375	C	92.6	Very high	93	Very high	73 Å²	73	92.5 Å²	92.5	49%	0.493	49%	0.49	S	S	.	.	H	α-helix	trans	-61	-44.3	176.7	-73.2	0	0	0	0	112.1	A371 N372 I373 L378 L379	A371-C375 PolarHBondContact O-N 2.76Å; A371-C375 PolarHBondContact O-SG 2.87Å; A371-C375 VanDerWaalsContact O-SG 3.35Å; N372-C375 PolarHBondContact O-N 3.39Å; I373-C375 VanDerWaalsContact C-N 3.33Å; I373-C375 PolarHBondContact O-N 2.82Å; C375-L378 PolarHBondContact O-N 2.92Å; C375-L379 WeakPolarHBondContact O-CG 3.35Å; C375-L379 PolarHBondContact O-N 2.85Å; C375-L379 VanDerWaalsContact O-N 3.12Å
376	E	94	Very high	92.7	Very high	112 Å²	112	93.1 Å²	93.1	52%	0.523	49%	0.49	S	S	.	.	H	α-helix	trans	-63.1	-42.5	175.9	-72.2	-179.2	-171.6	0	0	112.2	N372 I373 I374 L379 K380	N372-E376 WeakPolarHBondContact O-CG 3.37Å; N372-E376 PolarHBondContact O-N 2.86Å; I373-E376 PolarHBondContact O-N 2.82Å; I374-E376 PolarHBondContact O-N 2.85Å; E376-L379 PolarHBondContact O-N 3.3Å; E376-K380 WeakPolarHBondContact O-CG 3.4Å; E376-K380 PolarHBondContact O-N 2.95Å
377	D	95.5	Very high	92.5	Very high	59 Å²	59	93.2 Å²	93.2	32%	0.316	49%	0.492	S	S	.	.	H	α-helix	trans	-68.7	-41.2	179.1	-76.1	-8.4	0	0	0	111.5	I373 I374 L379 K380 Y381	I373-D377 WeakPolarHBondContact O-CB 3.45Å; I373-D377 PolarHBondContact O-N 2.92Å; I374-D377 PolarHBondContact O-N 2.87Å; D377-L379 VanDerWaalsContact C-N 3.27Å; D377-L379 PolarHBondContact O-N 3.34Å; D377-K380 CarbonylContact O-C 3.54Å; D377-K380 WeakPolarHBondContact O-CB 3.31Å; D377-K380 PolarHBondContact O-N 3.41Å; D377-K380 VanDerWaalsContact O-N 3.12Å; D377-K380 IonicContact OD1-NZ 2.71Å; D377-K380 PolarHBondContact OD1-NZ 2.9Å; D377-Y381 HydrophobicContact CB-CD2 4.33Å; D377-Y381 HydrophobicContact CB-CE2 4.28Å; D377-Y381 WeakPolarHBondContact O-CB 3.47Å; D377-Y381 WeakPolarHBondContact O-CD2 3.37Å; D377-Y381 PolarHBondContact O-N 3.23Å
378	L	94.3	Very high	92.4	Very high	108 Å²	108	92 Å²	92	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-59.2	-38.6	174	-75.1	174	0	0	0	112	I374 C375 Y381 A382	I374-L378 HydrophobicContact CG2-CD1 3.89Å; I374-L378 HydrophobicContact CG2-CG 4.22Å; I374-L378 WeakPolarHBondContact O-CB 3.33Å; I374-L378 VanDerWaalsContact O-CG 3.26Å; I374-L378 WeakPolarHBondContact O-CG 3.4Å; I374-L378 PolarHBondContact O-N 3.25Å; C375-L378 PolarHBondContact O-N 2.92Å; L378-Y381 PolarHBondContact O-N 3.17Å; L378-A382 WeakPolarHBondContact O-CB 3.39Å; L378-A382 PolarHBondContact O-N 3.49Å
379	L	92.8	Very high	92.1	Very high	113 Å²	113	91.9 Å²	91.9	59%	0.592	49%	0.492	S	S	*	.	H	α-helix	trans	-65.7	-43.1	174.1	-71.8	171.7	0	0	0	111.8	C375 E376 D377 A382 Q383	C375-L379 WeakPolarHBondContact O-CG 3.35Å; C375-L379 PolarHBondContact O-N 2.85Å; C375-L379 VanDerWaalsContact O-N 3.12Å; E376-L379 PolarHBondContact O-N 3.3Å; D377-L379 VanDerWaalsContact C-N 3.27Å; D377-L379 PolarHBondContact O-N 3.34Å; L379-A382 PolarHBondContact O-N 2.86Å; L379-Q383 WeakPolarHBondContact O-CG 3.47Å; L379-Q383 PolarHBondContact O-N 3.37Å
380	K	92.3	Very high	91.7	Very high	112 Å²	112	88.2 Å²	88.2	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-62.5	-42.6	174.1	-66.8	169.1	-156.2	152.3	0	111.3	E376 D377 Q383 A384	E376-K380 WeakPolarHBondContact O-CG 3.4Å; E376-K380 PolarHBondContact O-N 2.95Å; D377-K380 CarbonylContact O-C 3.54Å; D377-K380 WeakPolarHBondContact O-CB 3.31Å; D377-K380 PolarHBondContact O-N 3.41Å; D377-K380 VanDerWaalsContact O-N 3.12Å; D377-K380 IonicContact OD1-NZ 2.71Å; D377-K380 PolarHBondContact OD1-NZ 2.9Å; K380-Q383 PolarHBondContact O-N 2.96Å; K380-A384 WeakPolarHBondContact O-CB 3.43Å; K380-A384 PolarHBondContact O-N 3.4Å
381	Y	93.4	Very high	91.5	Very high	170 Å²	170	89.1 Å²	89.1	67%	0.667	48%	0.482	S	S	*	.	H	α-helix	trans	-63.2	-43.4	176.8	-82.9	-66.5	0	0	0	111.6	D377 L378 A384 L385	D377-Y381 HydrophobicContact CB-CD2 4.33Å; D377-Y381 HydrophobicContact CB-CE2 4.28Å; D377-Y381 WeakPolarHBondContact O-CB 3.47Å; D377-Y381 WeakPolarHBondContact O-CD2 3.37Å; D377-Y381 PolarHBondContact O-N 3.23Å; L378-Y381 PolarHBondContact O-N 3.17Å; Y381-A384 PolarHBondContact O-N 2.99Å; Y381-L385 WeakPolarHBondContact O-CB 3.14Å; Y381-L385 PolarHBondContact O-N 3.49Å
382	A	89.5	Confident	91.2	Very high	57 Å²	57	93.4 Å²	93.4	47%	0.471	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-45.4	177.1	0	0	0	0	0	111.7	L378 L379 L385 E386	L378-A382 WeakPolarHBondContact O-CB 3.39Å; L378-A382 PolarHBondContact O-N 3.49Å; L379-A382 PolarHBondContact O-N 2.86Å; A382-L385 PolarHBondContact O-N 3.15Å; A382-E386 WeakPolarHBondContact O-CB 3.46Å; A382-E386 PolarHBondContact O-N 2.91Å
383	Q	90.4	Very high	90.9	Very high	120 Å²	120	93.4 Å²	93.4	56%	0.561	49%	0.486	S	S	*	.	H	α-helix	trans	-65.6	-42.6	176.3	-72.3	177.4	-3.1	0	0	112.3	L379 K380 L385 E386 N387	L379-Q383 WeakPolarHBondContact O-CG 3.47Å; L379-Q383 PolarHBondContact O-N 3.37Å; K380-Q383 PolarHBondContact O-N 2.96Å; Q383-L385 VanDerWaalsContact C-N 3.32Å; Q383-L385 PolarHBondContact O-N 3.36Å; Q383-E386 PolarHBondContact O-N 3.33Å; Q383-N387 WeakPolarHBondContact O-CB 3.44Å; Q383-N387 PolarHBondContact O-N 3.06Å; Q383-N387 PolarHBondContact O-ND2 2.74Å
384	A	91.9	Very high	90.6	Very high	56 Å²	56	94.1 Å²	94.1	46%	0.463	49%	0.488	S	S	.	.	H	α-helix	trans	-63.7	-39.7	176.8	0	0	0	0	0	111.4	K380 Y381 A388	K380-A384 WeakPolarHBondContact O-CB 3.43Å; K380-A384 PolarHBondContact O-N 3.4Å; Y381-A384 PolarHBondContact O-N 2.99Å; A384-A388 WeakPolarHBondContact O-CB 3.4Å; A384-A388 PolarHBondContact O-N 3.5Å
385	L	91.3	Very high	90.4	Very high	111 Å²	111	92 Å²	92	58%	0.581	48%	0.482	S	S	*	.	H	α-helix	trans	-66.9	-46	176.3	-179.3	63.4	0	0	0	111.6	Y381 A382 Q383 N387 A388 I389	Y381-L385 WeakPolarHBondContact O-CB 3.14Å; Y381-L385 PolarHBondContact O-N 3.49Å; A382-L385 PolarHBondContact O-N 3.15Å; Q383-L385 VanDerWaalsContact C-N 3.32Å; Q383-L385 PolarHBondContact O-N 3.36Å; L385-N387 PolarHBondContact O-N 3.21Å; L385-A388 PolarHBondContact O-N 2.89Å; L385-I389 HydrophobicContact CD1-CD1 4.18Å; L385-I389 HydrophobicContact CD1-CG1 4.39Å; L385-I389 HydrophobicContact CG-CD1 3.97Å; L385-I389 VanDerWaalsContact O-CG1 3.25Å; L385-I389 WeakPolarHBondContact O-CG1 3.27Å; L385-I389 PolarHBondContact O-N 3.36Å
386	E	86.8	Confident	90.3	Very high	98 Å²	98	90.5 Å²	90.5	46%	0.458	47%	0.466	S	S	.	.	H	α-helix	trans	-59.7	-46.9	176.4	-174.2	173.8	-165.4	0	0	111	A382 Q383 A388 I389 I390	A382-E386 WeakPolarHBondContact O-CB 3.46Å; A382-E386 PolarHBondContact O-N 2.91Å; Q383-E386 PolarHBondContact O-N 3.33Å; E386-A388 VanDerWaalsContact C-N 3.35Å; E386-A388 PolarHBondContact O-N 3.41Å; E386-I389 PolarHBondContact O-N 2.98Å; E386-I390 HydrophobicContact CG-CD1 4.13Å; E386-I390 VanDerWaalsContact O-CG1 3.31Å; E386-I390 WeakPolarHBondContact O-CG1 3.2Å; E386-I390 PolarHBondContact O-N 3.28Å
387	N	89.1	Confident	90.1	Very high	95 Å²	95	86.1 Å²	86.1	51%	0.508	45%	0.446	S	S	.	.	H	α-helix	trans	-61.8	-41.5	175	-71.5	-23.3	0	0	0	112.1	Q383 L385 I389 I390 V391	Q383-N387 WeakPolarHBondContact O-CB 3.44Å; Q383-N387 PolarHBondContact O-N 3.06Å; Q383-N387 PolarHBondContact O-ND2 2.74Å; L385-N387 PolarHBondContact O-N 3.21Å; N387-I389 VanDerWaalsContact C-N 3.33Å; N387-I389 PolarHBondContact O-N 3.25Å; N387-I390 PolarHBondContact O-N 3.48Å; N387-V391 WeakPolarHBondContact O-CB 3.25Å; N387-V391 VanDerWaalsContact O-CG2 3.29Å; N387-V391 WeakPolarHBondContact O-CG2 3.47Å; N387-V391 PolarHBondContact O-N 2.82Å
388	A	90	Very high	89.9	Confident	56 Å²	56	89.9 Å²	89.9	46%	0.463	46%	0.462	S	S	.	.	H	α-helix	trans	-64.1	-39	177.2	0	0	0	0	0	111.7	A384 L385 E386 Y392	A384-A388 WeakPolarHBondContact O-CB 3.4Å; A384-A388 PolarHBondContact O-N 3.5Å; L385-A388 PolarHBondContact O-N 2.89Å; E386-A388 VanDerWaalsContact C-N 3.35Å; E386-A388 PolarHBondContact O-N 3.41Å; A388-Y392 WeakPolarHBondContact O-CB 3.23Å; A388-Y392 PolarHBondContact O-N 2.63Å
389	I	87.3	Confident	89.7	Confident	100 Å²	100	88.6 Å²	88.6	51%	0.513	45%	0.453	S	S	.	.	H	α-helix	trans	-65.2	-44.2	175	-69.1	165.1	0	0	0	110.5	L385 E386 N387 Y392 H393	L385-I389 HydrophobicContact CD1-CD1 4.18Å; L385-I389 HydrophobicContact CD1-CG1 4.39Å; L385-I389 HydrophobicContact CG-CD1 3.97Å; L385-I389 VanDerWaalsContact O-CG1 3.25Å; L385-I389 WeakPolarHBondContact O-CG1 3.27Å; L385-I389 PolarHBondContact O-N 3.36Å; E386-I389 PolarHBondContact O-N 2.98Å; N387-I389 VanDerWaalsContact C-N 3.33Å; N387-I389 PolarHBondContact O-N 3.25Å; I389-Y392 PolarHBondContact O-N 2.87Å; I389-H393 WeakPolarHBondContact O-CB 3.4Å; I389-H393 PolarHBondContact O-N 2.98Å
390	I	85.6	Confident	89.7	Confident	44 Å²	44	83.4 Å²	83.4	23%	0.226	43%	0.426	C	S	.	.	H	α-helix	trans	-61.5	-50.3	177.5	-68.2	165.1	0	0	0	110.4	E386 N387 Y392 H393 Q394	E386-I390 HydrophobicContact CG-CD1 4.13Å; E386-I390 VanDerWaalsContact O-CG1 3.31Å; E386-I390 WeakPolarHBondContact O-CG1 3.2Å; E386-I390 PolarHBondContact O-N 3.28Å; N387-I390 PolarHBondContact O-N 3.48Å; I390-Y392 VanDerWaalsContact C-N 3.32Å; I390-Y392 PolarHBondContact O-N 3.11Å; I390-H393 PolarHBondContact O-N 3.13Å; I390-Q394 HydrophobicContact CG2-CG 4.41Å; I390-Q394 WeakPolarHBondContact O-CB 3.37Å; I390-Q394 WeakPolarHBondContact O-CG 3.32Å; I390-Q394 PolarHBondContact O-N 2.83Å
391	V	88.4	Confident	89.8	Confident	91 Å²	91	78.5 Å²	78.5	55%	0.552	41%	0.405	S	S	*	.	H	α-helix	trans	-62.7	-40.8	178.7	171.6	0	0	0	0	111.1	N387 Q394 S395	N387-V391 WeakPolarHBondContact O-CB 3.25Å; N387-V391 VanDerWaalsContact O-CG2 3.29Å; N387-V391 WeakPolarHBondContact O-CG2 3.47Å; N387-V391 PolarHBondContact O-N 2.82Å; V391-Q394 PolarHBondContact O-N 2.85Å; V391-S395 VanDerWaalsContact O-CB 3.3Å; V391-S395 WeakPolarHBondContact O-CB 3.37Å; V391-S395 PolarHBondContact O-N 3.47Å
392	Y	88	Confident	89.8	Confident	137 Å²	137	73 Å²	73	54%	0.537	39%	0.391	S	S	.	.	H	α-helix	trans	-61.6	-46.3	175.3	-179.6	-95.3	0	0	0	111.3	A388 I389 I390 S395 K396	A388-Y392 WeakPolarHBondContact O-CB 3.23Å; A388-Y392 PolarHBondContact O-N 2.63Å; I389-Y392 PolarHBondContact O-N 2.87Å; I390-Y392 VanDerWaalsContact C-N 3.32Å; I390-Y392 PolarHBondContact O-N 3.11Å; Y392-S395 PolarHBondContact O-N 3.03Å; Y392-K396 HydrophobicContact CD1-CG 4.12Å; Y392-K396 HydrophobicContact CE1-CG 3.73Å; Y392-K396 HydrophobicContact CE2-CG 4.21Å; Y392-K396 WeakPolarHBondContact O-CB 3.27Å; Y392-K396 VanDerWaalsContact O-CG 3.3Å; Y392-K396 WeakPolarHBondContact O-CG 3.21Å; Y392-K396 PolarHBondContact O-N 3.34Å; Y392-K396 WeakPolarHBondContact OH-CE 3.38Å
393	H	86.9	Confident	89.7	Confident	89 Å²	89	71.4 Å²	71.4	41%	0.412	38%	0.375	S	S	.	.	H	α-helix	trans	-65.7	-41	178.5	-169.8	-78.3	0	0	0	111.9	I389 I390 K396 M397	I389-H393 WeakPolarHBondContact O-CB 3.4Å; I389-H393 PolarHBondContact O-N 2.98Å; I390-H393 PolarHBondContact O-N 3.13Å; H393-K396 PolarHBondContact O-N 3.37Å; H393-M397 VanDerWaalsContact CE1-CE 3.46Å; H393-M397 WeakPolarHBondContact CE1-CE 3.4Å; H393-M397 VanDerWaalsContact O-CB 3.26Å; H393-M397 WeakPolarHBondContact O-CB 3.33Å; H393-M397 PolarHBondContact O-N 3.28Å
394	Q	87.6	Confident	89.8	Confident	84 Å²	84	65.8 Å²	65.8	39%	0.393	35%	0.348	S	S	.	.	H	α-helix	trans	-62.3	-44.8	174.3	-73.6	176.1	-2.4	0	0	111.4	I390 V391 K396 M397 Q398	I390-Q394 HydrophobicContact CG2-CG 4.41Å; I390-Q394 WeakPolarHBondContact O-CB 3.37Å; I390-Q394 WeakPolarHBondContact O-CG 3.32Å; I390-Q394 PolarHBondContact O-N 2.83Å; V391-Q394 PolarHBondContact O-N 2.85Å; Q394-K396 PolarHBondContact O-N 2.91Å; Q394-M397 PolarHBondContact O-N 2.89Å; Q394-Q398 VanDerWaalsContact O-CG 3.3Å; Q394-Q398 WeakPolarHBondContact O-CG 3.26Å; Q394-Q398 PolarHBondContact O-N 3.3Å
395	S	90.6	Very high	89.8	Confident	48 Å²	48	66.6 Å²	66.6	34%	0.336	34%	0.34	S	S	.	.	H	α-helix	trans	-62.4	-42.6	176.1	-178	0	0	0	0	111.9	V391 Y392 Q398 Q399	V391-S395 VanDerWaalsContact O-CB 3.3Å; V391-S395 WeakPolarHBondContact O-CB 3.37Å; V391-S395 PolarHBondContact O-N 3.47Å; Y392-S395 PolarHBondContact O-N 3.03Å; S395-Q398 PolarHBondContact O-N 3.43Å; S395-Q399 WeakPolarHBondContact O-CG 3.48Å; S395-Q399 PolarHBondContact O-N 2.88Å; S395-Q399 VanDerWaalsContact O-N 3.09Å
396	K	90.1	Very high	89.6	Confident	40 Å²	40	65.6 Å²	65.6	17%	0.174	34%	0.335	C	S	.	.	H	α-helix	trans	-68.6	-39.3	177	-73	-70	174.5	-171.8	0	112.3	Y392 H393 Q394 Q398 Q399 I400 V473	Y392-K396 HydrophobicContact CD1-CG 4.12Å; Y392-K396 HydrophobicContact CE1-CG 3.73Å; Y392-K396 HydrophobicContact CE2-CG 4.21Å; Y392-K396 WeakPolarHBondContact O-CB 3.27Å; Y392-K396 VanDerWaalsContact O-CG 3.3Å; Y392-K396 WeakPolarHBondContact O-CG 3.21Å; Y392-K396 PolarHBondContact O-N 3.34Å; Y392-K396 WeakPolarHBondContact OH-CE 3.38Å; H393-K396 PolarHBondContact O-N 3.37Å; Q394-K396 PolarHBondContact O-N 2.91Å; K396-Q398 VanDerWaalsContact C-N 3.35Å; K396-Q399 VanDerWaalsContact NZ-OE1 3.1Å; K396-Q399 WeakPolarHBondContact O-CB 3.21Å; K396-Q399 PolarHBondContact O-N 3.29Å; K396-I400 VanDerWaalsContact O-CG1 3.25Å; K396-I400 WeakPolarHBondContact O-CG1 3.25Å; K396-I400 PolarHBondContact O-N 2.76Å; K396-V473 HydrophobicContact CB-CG1 4.42Å; K396-V473 HydrophobicContact CD-CG1 3.41Å; K396-V473 VanDerWaalsContact CD-CG1 3.41Å
397	M	90	Very high	89.6	Confident	20 Å²	20	62.2 Å²	62.2	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-64.8	-39.4	175.6	-166.2	59.6	69.2	0	0	111.7	H393 Q394 Q399 I400 N401 I422	H393-M397 VanDerWaalsContact CE1-CE 3.46Å; H393-M397 WeakPolarHBondContact CE1-CE 3.4Å; H393-M397 VanDerWaalsContact O-CB 3.26Å; H393-M397 WeakPolarHBondContact O-CB 3.33Å; H393-M397 PolarHBondContact O-N 3.28Å; Q394-M397 PolarHBondContact O-N 2.89Å; M397-Q399 PolarHBondContact O-N 3.31Å; M397-I400 PolarHBondContact O-N 3.21Å; M397-I400 HydrophobicContact SD-CD1 4.49Å; M397-N401 WeakPolarHBondContact O-CB 3.29Å; M397-N401 PolarHBondContact O-N 3.17Å; M397-I422 HydrophobicContact CE-CG2 4.16Å; M397-I422 HydrophobicContact SD-CB 3.88Å; M397-I422 HydrophobicContact SD-CG2 3.8Å
398	Q	91.5	Very high	89.7	Confident	139 Å²	139	57.8 Å²	57.8	65%	0.65	30%	0.296	S	S	*	.	H	α-helix	trans	-61.7	-42.4	172.8	-74.7	172.7	-1.7	0	0	112.2	Q394 S395 K396 N401 S402	Q394-Q398 VanDerWaalsContact O-CG 3.3Å; Q394-Q398 WeakPolarHBondContact O-CG 3.26Å; Q394-Q398 PolarHBondContact O-N 3.3Å; S395-Q398 PolarHBondContact O-N 3.43Å; K396-Q398 VanDerWaalsContact C-N 3.35Å; Q398-N401 PolarHBondContact O-N 3.37Å; Q398-S402 WeakPolarHBondContact O-CB 3.36Å; Q398-S402 PolarHBondContact O-N 3.44Å
399	Q	91.1	Very high	89.5	Confident	80 Å²	80	60.5 Å²	60.5	37%	0.374	30%	0.299	S	S	.	.	H	α-helix	trans	-60.8	-48	174.5	-72	168.6	29.2	0	0	111	S395 K396 M397 N401 S402 I403 V473	S395-Q399 WeakPolarHBondContact O-CG 3.48Å; S395-Q399 PolarHBondContact O-N 2.88Å; S395-Q399 VanDerWaalsContact O-N 3.09Å; K396-Q399 VanDerWaalsContact NZ-OE1 3.1Å; K396-Q399 WeakPolarHBondContact O-CB 3.21Å; K396-Q399 PolarHBondContact O-N 3.29Å; M397-Q399 PolarHBondContact O-N 3.31Å; Q399-N401 PolarHBondContact O-N 3.45Å; Q399-S402 WeakPolarHBondContact O-CB 3.39Å; Q399-S402 PolarHBondContact O-N 2.94Å; Q399-I403 WeakPolarHBondContact O-CD1 3.44Å; Q399-I403 WeakPolarHBondContact O-CG1 3.35Å; Q399-I403 PolarHBondContact O-N 2.87Å; Q399-I403 VanDerWaalsContact O-N 3.16Å; Q399-V473 HydrophobicContact CB-CG2 4.08Å
400	I	92.4	Very high	89.3	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-58.2	-49.7	177.4	-66.9	162.3	0	0	0	110.5	K396 M397 S402 I403 I404 I422 A469 L470 V473 F474	K396-I400 VanDerWaalsContact O-CG1 3.25Å; K396-I400 WeakPolarHBondContact O-CG1 3.25Å; K396-I400 PolarHBondContact O-N 2.76Å; M397-I400 PolarHBondContact O-N 3.21Å; M397-I400 HydrophobicContact SD-CD1 4.49Å; I400-S402 VanDerWaalsContact C-N 3.31Å; I400-S402 PolarHBondContact O-N 2.9Å; I400-I403 PolarHBondContact O-N 3.49Å; I400-I404 HydrophobicContact CG2-CD1 3.59Å; I400-I404 HydrophobicContact CG2-CG1 4.22Å; I400-I404 VanDerWaalsContact O-CG1 3.31Å; I400-I404 WeakPolarHBondContact O-CG1 3.47Å; I400-I404 PolarHBondContact O-N 3.44Å; I400-I422 HydrophobicContact CG2-CD1 4.22Å; I400-A469 HydrophobicContact CG2-CB 4.2Å; I400-L470 HydrophobicContact CD1-CD2 3.85Å; I400-L470 HydrophobicContact CG1-CD2 4.48Å; I400-V473 HydrophobicContact CD1-CG1 4.39Å; I400-V473 HydrophobicContact CG1-CB 3.86Å; I400-V473 HydrophobicContact CG1-CG1 3.96Å; I400-V473 HydrophobicContact CG1-CG2 3.68Å; I400-F474 HydrophobicContact CD1-CE2 3.87Å; I400-F474 HydrophobicContact CD1-CZ 4.28Å
401	N	93.5	Very high	89.2	Confident	9 Å²	9	56.6 Å²	56.6	5%	0.048	28%	0.282	C	S	.	.	H	α-helix	trans	-66.8	-30.5	-178.3	-72.9	-19.2	0	0	0	113	M397 Q398 Q399 R405 E421 I422	M397-N401 WeakPolarHBondContact O-CB 3.29Å; M397-N401 PolarHBondContact O-N 3.17Å; Q398-N401 PolarHBondContact O-N 3.37Å; Q399-N401 PolarHBondContact O-N 3.45Å; N401-R405 WeakPolarHBondContact O-CB 3.17Å; N401-R405 PolarHBondContact O-N 2.89Å; N401-E421 HydrophobicContact CB-CG 3.96Å; N401-E421 WeakPolarHBondContact ND2-CG 3.42Å; N401-E421 PolarHBondContact ND2-OE1 3.35Å; N401-I422 PolarHBondContact ND2-O 3.4Å; N401-I422 PolarHBondContact OD1-N 3.37Å; N401-I422 PolarHBondContact OD1-O 3.04Å
402	S	93.1	Very high	89	Confident	55 Å²	55	53.4 Å²	53.4	39%	0.385	26%	0.26	S	S	.	.	H	α-helix	trans	-62	-50.5	171.4	-165.8	0	0	0	0	110.6	Q398 Q399 I400 I404 R405 D406	Q398-S402 WeakPolarHBondContact O-CB 3.36Å; Q398-S402 PolarHBondContact O-N 3.44Å; Q399-S402 WeakPolarHBondContact O-CB 3.39Å; Q399-S402 PolarHBondContact O-N 2.94Å; I400-S402 VanDerWaalsContact C-N 3.31Å; I400-S402 PolarHBondContact O-N 2.9Å; S402-I404 PolarHBondContact O-N 2.9Å; S402-R405 PolarHBondContact O-N 3.39Å; S402-D406 PolarHBondContact O-N 3.03Å
403	I	88.6	Confident	88.7	Confident	24 Å²	24	52.3 Å²	52.3	12%	0.123	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-42.2	-179.4	-63.7	156.1	0	0	0	111	Q399 I400 R405 D406 L407 A469 E472 V473	Q399-I403 WeakPolarHBondContact O-CD1 3.44Å; Q399-I403 WeakPolarHBondContact O-CG1 3.35Å; Q399-I403 PolarHBondContact O-N 2.87Å; Q399-I403 VanDerWaalsContact O-N 3.16Å; I400-I403 PolarHBondContact O-N 3.49Å; I403-R405 VanDerWaalsContact C-N 3.3Å; I403-R405 PolarHBondContact O-N 3.29Å; I403-D406 PolarHBondContact O-N 3.46Å; I403-L407 HydrophobicContact CG2-CD1 3.68Å; I403-L407 HydrophobicContact CG2-CG 4.18Å; I403-L407 WeakPolarHBondContact O-CB 3.33Å; I403-L407 VanDerWaalsContact O-CG 3.29Å; I403-L407 WeakPolarHBondContact O-CG 3.46Å; I403-L407 PolarHBondContact O-N 2.87Å; I403-A469 HydrophobicContact CB-CB 4.07Å; I403-A469 HydrophobicContact CG2-CB 3.74Å; I403-E472 HydrophobicContact CD1-CB 4.25Å; I403-E472 HydrophobicContact CD1-CG 3.57Å; I403-E472 WeakPolarHBondContact CG2-OE2 3.49Å; I403-V473 HydrophobicContact CD1-CG2 3.48Å; I403-V473 VanDerWaalsContact CD1-CG2 3.48Å
404	I	92.3	Very high	88.5	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-58.6	-44.8	176.2	-69.2	170.2	0	0	0	110.3	I400 S402 W408 V420 I422 I465 I466 A469	I400-I404 HydrophobicContact CG2-CD1 3.59Å; I400-I404 HydrophobicContact CG2-CG1 4.22Å; I400-I404 VanDerWaalsContact O-CG1 3.31Å; I400-I404 WeakPolarHBondContact O-CG1 3.47Å; I400-I404 PolarHBondContact O-N 3.44Å; S402-I404 PolarHBondContact O-N 2.9Å; I404-W408 WeakPolarHBondContact O-CB 3.39Å; I404-W408 PolarHBondContact O-N 3.41Å; I404-V420 HydrophobicContact CG2-CB 4.19Å; I404-V420 HydrophobicContact CG2-CG1 4.4Å; I404-V420 VanDerWaalsContact CG2-O 3.28Å; I404-V420 WeakPolarHBondContact CG2-O 3.24Å; I404-I422 HydrophobicContact CD1-CD1 3.64Å; I404-I422 HydrophobicContact CD1-CG1 3.84Å; I404-I465 HydrophobicContact CB-CG2 4.34Å; I404-I465 HydrophobicContact CG1-CG2 4.36Å; I404-I465 HydrophobicContact CG2-CG2 4.09Å; I404-I466 HydrophobicContact CD1-CG1 3.95Å; I404-I466 HydrophobicContact CG1-CG1 4.46Å; I404-A469 HydrophobicContact CD1-CB 4.35Å; I404-A469 HydrophobicContact CG1-CB 3.57Å
405	R	91.7	Very high	88.3	Confident	74 Å²	74	53.1 Å²	53.1	28%	0.279	27%	0.274	S	S	.	.	H	α-helix	trans	-62.3	-50.2	179.2	-175.8	177.5	-65.6	121.5	1.4	111.1	N401 S402 I403 L407 W408 E409 Y419	N401-R405 WeakPolarHBondContact O-CB 3.17Å; N401-R405 PolarHBondContact O-N 2.89Å; S402-R405 PolarHBondContact O-N 3.39Å; I403-R405 VanDerWaalsContact C-N 3.3Å; I403-R405 PolarHBondContact O-N 3.29Å; R405-L407 VanDerWaalsContact C-N 3.33Å; R405-L407 PolarHBondContact O-N 2.95Å; R405-W408 PolarHBondContact O-N 3.04Å; R405-E409 WeakPolarHBondContact CG-OE1 3.49Å; R405-E409 WeakPolarHBondContact O-CG 3.45Å; R405-E409 PolarHBondContact O-N 3.4Å; R405-Y419 HydrophobicContact CG-CG 4.37Å
406	D	88	Confident	88.2	Confident	90 Å²	90	54.7 Å²	54.7	48%	0.481	28%	0.279	S	S	.	.	H	α-helix	trans	-60.1	-43.8	-179	-62.9	-20.4	0	0	0	111.4	S402 I403 T410	S402-D406 PolarHBondContact O-N 3.03Å; I403-D406 PolarHBondContact O-N 3.46Å; D406-T410 WeakPolarHBondContact O-CB 3.48Å; D406-T410 PolarHBondContact O-N 3.3Å; D406-T410 PolarHBondContact O-OG1 2.87Å
407	L	86.2	Confident	88.1	Confident	27 Å²	27	53.1 Å²	53.1	14%	0.141	27%	0.272	C	S	.	.	H	α-helix	trans	-69.6	-39	176.9	-70.6	175.2	0	0	0	112.4	I403 R405 T410 V411 I465 I468	I403-L407 HydrophobicContact CG2-CD1 3.68Å; I403-L407 HydrophobicContact CG2-CG 4.18Å; I403-L407 WeakPolarHBondContact O-CB 3.33Å; I403-L407 VanDerWaalsContact O-CG 3.29Å; I403-L407 WeakPolarHBondContact O-CG 3.46Å; I403-L407 PolarHBondContact O-N 2.87Å; R405-L407 VanDerWaalsContact C-N 3.33Å; R405-L407 PolarHBondContact O-N 2.95Å; L407-T410 PolarHBondContact O-N 2.71Å; L407-V411 WeakPolarHBondContact O-CB 3.36Å; L407-V411 WeakPolarHBondContact O-CG2 3.25Å; L407-V411 PolarHBondContact O-N 3.5Å; L407-I465 HydrophobicContact CB-CD1 4.4Å; L407-I465 HydrophobicContact CB-CG1 4.3Å; L407-I465 HydrophobicContact CB-CG2 3.75Å; L407-I465 HydrophobicContact CD1-CG2 4.16Å; L407-I468 HydrophobicContact CD1-CB 4.12Å; L407-I468 HydrophobicContact CD1-CG2 3.45Å; L407-I468 VanDerWaalsContact CD1-CG2 3.45Å
408	W	90.1	Very high	88.1	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-64	-49.5	-180	-175.1	-87.5	0	0	0	111.5	I404 R405 T410 V411 Y412 I417 V420 L461 A462 I465	I404-W408 WeakPolarHBondContact O-CB 3.39Å; I404-W408 PolarHBondContact O-N 3.41Å; R405-W408 PolarHBondContact O-N 3.04Å; W408-T410 PolarHBondContact O-N 2.94Å; W408-V411 PolarHBondContact O-N 2.96Å; W408-Y412 AromaticContact CE2-CD1 3.82Å; W408-Y412 AromaticContact CE2-CG 3.75Å; W408-Y412 HydrophobicContact CH2-CD2 4.28Å; W408-Y412 HydrophobicContact CH2-CG 4.36Å; W408-Y412 AromaticContact CZ2-CD1 3.76Å; W408-Y412 HydrophobicContact CZ2-CD1 3.76Å; W408-Y412 AromaticContact CZ2-CD2 3.95Å; W408-Y412 HydrophobicContact CZ2-CD2 3.95Å; W408-Y412 HydrophobicContact CZ2-CE1 4.14Å; W408-Y412 HydrophobicContact CZ2-CE2 4.33Å; W408-Y412 AromaticContact CZ2-CG 3.65Å; W408-Y412 HydrophobicContact CZ2-CG 3.65Å; W408-Y412 AromaticContact NE1-CD1 3.61Å; W408-Y412 AromaticContact NE1-CG 3.89Å; W408-Y412 WeakPolarHBondContact O-CB 3.3Å; W408-Y412 PolarHBondContact O-N 3.23Å; W408-I417 HydrophobicContact CH2-CD1 4.48Å; W408-I417 HydrophobicContact CZ2-CB 3.95Å; W408-I417 HydrophobicContact CZ2-CD1 4.02Å; W408-I417 HydrophobicContact CZ2-CG2 3.69Å; W408-I417 PolarHBondContact NE1-O 3.36Å; W408-V420 HydrophobicContact CD2-CB 4.34Å; W408-V420 HydrophobicContact CD2-CG2 3.7Å; W408-V420 HydrophobicContact CE3-CB 4.23Å; W408-V420 HydrophobicContact CE3-CG2 3.64Å; W408-V420 HydrophobicContact CG-CG2 4.45Å; W408-V420 HydrophobicContact CH2-CG2 3.85Å; W408-V420 HydrophobicContact CZ2-CG2 3.88Å; W408-V420 HydrophobicContact CZ3-CG2 3.73Å; W408-L461 HydrophobicContact CD2-CD2 4.43Å; W408-L461 HydrophobicContact CE3-CD2 3.66Å; W408-L461 HydrophobicContact CH2-CD2 3.93Å; W408-L461 HydrophobicContact CZ3-CD2 3.35Å; W408-A462 HydrophobicContact CH2-CB 4.49Å; W408-A462 HydrophobicContact CZ3-CB 3.79Å; W408-I465 HydrophobicContact CB-CD1 4.36Å; W408-I465 HydrophobicContact CE3-CD1 3.82Å
409	E	87.3	Confident	88.1	Confident	113 Å²	113	51.4 Å²	51.4	53%	0.528	26%	0.264	S	S	.	.	H	α-helix	trans	-61	-30.6	177.4	-69.5	178.2	-168.3	0	0	112.2	R405	R405-E409 WeakPolarHBondContact CG-OE1 3.49Å; R405-E409 WeakPolarHBondContact O-CG 3.45Å; R405-E409 PolarHBondContact O-N 3.4Å
410	T	83.2	Confident	88.1	Confident	59 Å²	59	47.6 Å²	47.6	36%	0.362	25%	0.247	S	C	.	.	H	α-helix	trans	-75.7	-50.6	178.1	-57.3	0	0	0	0	111.8	D406 L407 W408 K413 A501	D406-T410 WeakPolarHBondContact O-CB 3.48Å; D406-T410 PolarHBondContact O-N 3.3Å; D406-T410 PolarHBondContact O-OG1 2.87Å; L407-T410 PolarHBondContact O-N 2.71Å; W408-T410 PolarHBondContact O-N 2.94Å; T410-K413 WeakPolarHBondContact O-CE 3.36Å; T410-K413 PolarHBondContact O-NZ 3.48Å; T410-A501 HydrophobicContact CG2-CB 4.32Å
411	V	82.9	Confident	88.1	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-81.8	-43.9	-171.2	-176.9	0	0	0	0	112.1	L407 W408 K413 L461 I465 S497 L498 A501	L407-V411 WeakPolarHBondContact O-CB 3.36Å; L407-V411 WeakPolarHBondContact O-CG2 3.25Å; L407-V411 PolarHBondContact O-N 3.5Å; W408-V411 PolarHBondContact O-N 2.96Å; V411-K413 PolarHBondContact O-N 3.4Å; V411-L461 HydrophobicContact CG1-CD1 3.72Å; V411-L461 HydrophobicContact CG1-CD2 4.15Å; V411-L461 HydrophobicContact CG1-CG 3.88Å; V411-I465 HydrophobicContact CB-CD1 4.09Å; V411-I465 HydrophobicContact CG2-CD1 4.08Å; V411-I465 HydrophobicContact CG2-CG1 4.45Å; V411-S497 WeakPolarHBondContact O-CB 3.23Å; V411-L498 HydrophobicContact CG1-CB 4.11Å; V411-L498 HydrophobicContact CG1-CD1 4.06Å; V411-A501 HydrophobicContact CB-CB 4.33Å; V411-A501 HydrophobicContact CG2-CB 3.21Å
412	Y	85	Confident	88	Confident	23 Å²	23	49.8 Å²	49.8	9%	0.09	26%	0.257	C	S	.	.			trans	-82.4	117.5	-172.5	-169.4	-112.5	0	0	0	110.4	W408 G414 D416 I417 Q458 L461	W408-Y412 AromaticContact CE2-CD1 3.82Å; W408-Y412 AromaticContact CE2-CG 3.75Å; W408-Y412 HydrophobicContact CH2-CD2 4.28Å; W408-Y412 HydrophobicContact CH2-CG 4.36Å; W408-Y412 AromaticContact CZ2-CD1 3.76Å; W408-Y412 HydrophobicContact CZ2-CD1 3.76Å; W408-Y412 AromaticContact CZ2-CD2 3.95Å; W408-Y412 HydrophobicContact CZ2-CD2 3.95Å; W408-Y412 HydrophobicContact CZ2-CE1 4.14Å; W408-Y412 HydrophobicContact CZ2-CE2 4.33Å; W408-Y412 AromaticContact CZ2-CG 3.65Å; W408-Y412 HydrophobicContact CZ2-CG 3.65Å; W408-Y412 AromaticContact NE1-CD1 3.61Å; W408-Y412 AromaticContact NE1-CG 3.89Å; W408-Y412 WeakPolarHBondContact O-CB 3.3Å; W408-Y412 PolarHBondContact O-N 3.23Å; Y412-G414 WeakPolarHBondContact CE1-O 3.44Å; Y412-D416 VanDerWaalsContact CE1-OD1 3.31Å; Y412-D416 WeakPolarHBondContact CE1-OD1 3.41Å; Y412-D416 VanDerWaalsContact CZ-OD1 3.27Å; Y412-D416 VanDerWaalsContact OH-CG 3.25Å; Y412-D416 PolarHBondContact OH-OD1 2.83Å; Y412-D416 PolarHBondContact OH-OD2 3.18Å; Y412-I417 HydrophobicContact CE1-CB 4.02Å; Y412-Q458 HydrophobicContact CE2-CG 3.89Å; Y412-Q458 PolarHBondContact OH-NE2 2.92Å; Y412-L461 HydrophobicContact CD2-CD1 4.07Å; Y412-L461 HydrophobicContact CD2-CD2 4.31Å
413	K	81.7	Confident	87.8	Confident	115 Å²	115	50.7 Å²	50.7	50%	0.5	25%	0.254	S	S	.	.			trans	-102.2	11.7	177.5	-59.5	-56.5	-176.3	-154.2	0	113.7	T410 V411 N494 S497	T410-K413 WeakPolarHBondContact O-CE 3.36Å; T410-K413 PolarHBondContact O-NZ 3.48Å; V411-K413 PolarHBondContact O-N 3.4Å; K413-N494 PolarHBondContact N-OD1 3.31Å; K413-S497 WeakPolarHBondContact CE-OG 3.4Å; K413-S497 WeakPolarHBondContact CG-OG 3.26Å
414	G	82.2	Confident	87.3	Confident	25 Å²	25	51.5 Å²	51.5	26%	0.258	26%	0.261	S	S	.	.			trans	-79.3	152.4	173	0	0	0	0	0	112.1	Y412	Y412-G414 WeakPolarHBondContact CE1-O 3.44Å
415	N	83.6	Confident	86.2	Confident	165 Å²	165	57.7 Å²	57.7	88%	0.882	29%	0.29	S	S	*	.	S	Bend	trans	-97.8	5.9	-179.2	-62.9	-14.6	0	0	0	113.3
416	D	87	Confident	84.9	Confident	80 Å²	80	58.9 Å²	58.9	43%	0.428	30%	0.299	S	S	.	.	S	Bend	trans	-100.5	-18	-170.9	59.8	-37.4	0	0	0	114	Y412 C443 Q458	Y412-D416 VanDerWaalsContact CE1-OD1 3.31Å; Y412-D416 WeakPolarHBondContact CE1-OD1 3.41Å; Y412-D416 VanDerWaalsContact CZ-OD1 3.27Å; Y412-D416 VanDerWaalsContact OH-CG 3.25Å; Y412-D416 PolarHBondContact OH-OD1 2.83Å; Y412-D416 PolarHBondContact OH-OD2 3.18Å; D416-C443 PolarHBondContact O-SG 3.45Å; D416-Q458 PolarHBondContact OD2-NE2 3.45Å
417	I	88.8	Confident	83.4	Confident	8 Å²	8	56.7 Å²	56.7	4%	0.041	29%	0.293	C	S	.	.			trans	-132.5	119.4	178.9	-58.3	171.8	0	0	0	109	W408 Y412 V420 M441 Q458	W408-I417 HydrophobicContact CH2-CD1 4.48Å; W408-I417 HydrophobicContact CZ2-CB 3.95Å; W408-I417 HydrophobicContact CZ2-CD1 4.02Å; W408-I417 HydrophobicContact CZ2-CG2 3.69Å; W408-I417 PolarHBondContact NE1-O 3.36Å; Y412-I417 HydrophobicContact CE1-CB 4.02Å; I417-V420 HydrophobicContact CG2-CG2 4.28Å; I417-M441 HydrophobicContact CD1-SD 3.87Å; I417-M441 HydrophobicContact CG1-SD 4.13Å; I417-M441 HydrophobicContact CG2-CB 3.92Å; I417-Q458 HydrophobicContact CD1-CG 4.18Å
418	D	90.2	Very high	81.9	Confident	66 Å²	66	64.1 Å²	64.1	35%	0.353	32%	0.324	S	S	.	.			trans	-70.9	-58.7	-178.9	-56.9	-37.9	0	0	0	110.6	F442 D444 G445	D418-F442 HydrophobicContact CB-CB 4.49Å; D418-F442 WeakPolarHBondContact CB-O 3.37Å; D418-F442 PolarHBondContact N-O 3.21Å; D418-D444 PolarHBondContact OD2-N 3.37Å; D418-G445 PolarHBondContact OD2-N 2.85Å
419	Y	91.2	Very high	80	Confident	56 Å²	56	67.9 Å²	67.9	22%	0.22	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	163.4	176.5	61.4	-86.3	0	0	0	111.6	R405 F442	R405-Y419 HydrophobicContact CG-CG 4.37Å; Y419-F442 HydrophobicContact CD1-CB 4.26Å; Y419-F442 AromaticContact CD2-CD2 3.83Å; Y419-F442 HydrophobicContact CD2-CD2 3.83Å; Y419-F442 HydrophobicContact CD2-CE2 4.44Å; Y419-F442 HydrophobicContact CE1-CB 3.87Å; Y419-F442 HydrophobicContact CE1-CD2 4.27Å; Y419-F442 HydrophobicContact CE1-CG 4.06Å; Y419-F442 HydrophobicContact CE2-CB 4.29Å; Y419-F442 AromaticContact CE2-CD2 3.18Å; Y419-F442 HydrophobicContact CE2-CD2 3.18Å; Y419-F442 AromaticContact CE2-CE2 3.55Å; Y419-F442 HydrophobicContact CE2-CE2 3.55Å; Y419-F442 AromaticContact CE2-CG 3.81Å; Y419-F442 HydrophobicContact CE2-CG 3.81Å; Y419-F442 HydrophobicContact CE2-CZ 4.41Å; Y419-F442 AromaticContact CZ-CD2 3.44Å; Y419-F442 VanDerWaalsContact CZ-CD2 3.44Å; Y419-F442 AromaticContact CZ-CE2 3.93Å; Y419-F442 AromaticContact CZ-CG 3.53Å; Y419-F442 PolarHBondContact O-N 3.08Å
420	V	92.1	Very high	78.4	Confident	1 Å²	1	72 Å²	72	1%	0.006	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	142.5	177.7	175.9	0	0	0	0	109.6	I404 W408 I417 V439 V440 M441 M450	I404-V420 HydrophobicContact CG2-CB 4.19Å; I404-V420 HydrophobicContact CG2-CG1 4.4Å; I404-V420 VanDerWaalsContact CG2-O 3.28Å; I404-V420 WeakPolarHBondContact CG2-O 3.24Å; W408-V420 HydrophobicContact CD2-CB 4.34Å; W408-V420 HydrophobicContact CD2-CG2 3.7Å; W408-V420 HydrophobicContact CE3-CB 4.23Å; W408-V420 HydrophobicContact CE3-CG2 3.64Å; W408-V420 HydrophobicContact CG-CG2 4.45Å; W408-V420 HydrophobicContact CH2-CG2 3.85Å; W408-V420 HydrophobicContact CZ2-CG2 3.88Å; W408-V420 HydrophobicContact CZ3-CG2 3.73Å; I417-V420 HydrophobicContact CG2-CG2 4.28Å; V420-V439 HydrophobicContact CG1-CG1 3.46Å; V420-V439 VanDerWaalsContact CG1-CG1 3.46Å; V420-V440 WeakPolarHBondContact CA-O 3.26Å; V420-M441 HydrophobicContact CG2-CB 4.4Å; V420-M450 HydrophobicContact CB-SD 4.27Å; V420-M450 HydrophobicContact CG1-SD 3.51Å; V420-M450 VanDerWaalsContact CG1-SD 3.51Å; V420-M450 HydrophobicContact CG2-CE 3.99Å; V420-M450 HydrophobicContact CG2-SD 3.7Å
421	E	92.1	Very high	77	Confident	44 Å²	44	74.9 Å²	74.9	21%	0.206	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	144.5	178.4	-166.2	174	-172.7	0	0	111	N401 V440 F442	N401-E421 HydrophobicContact CB-CG 3.96Å; N401-E421 WeakPolarHBondContact ND2-CG 3.42Å; N401-E421 PolarHBondContact ND2-OE1 3.35Å; E421-V440 HydrophobicContact CB-CG2 4.04Å; E421-V440 PolarHBondContact N-O 3.07Å; E421-V440 WeakPolarHBondContact O-CG2 3.37Å; E421-V440 PolarHBondContact O-N 2.84Å; E421-F442 HydrophobicContact CB-CE2 4.31Å
422	I	91.9	Very high	75.3	Confident	15 Å²	15	84.1 Å²	84.1	8%	0.077	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	117.1	168.9	-57.1	176.8	0	0	0	108	M397 I400 N401 I404 I466	M397-I422 HydrophobicContact CE-CG2 4.16Å; M397-I422 HydrophobicContact SD-CB 3.88Å; M397-I422 HydrophobicContact SD-CG2 3.8Å; I400-I422 HydrophobicContact CG2-CD1 4.22Å; N401-I422 PolarHBondContact ND2-O 3.4Å; N401-I422 PolarHBondContact OD1-N 3.37Å; N401-I422 PolarHBondContact OD1-O 3.04Å; I404-I422 HydrophobicContact CD1-CD1 3.64Å; I404-I422 HydrophobicContact CD1-CG1 3.84Å; I422-I466 HydrophobicContact CD1-CD1 4.49Å; I422-I466 HydrophobicContact CD1-CG1 4.3Å; I422-I466 HydrophobicContact CD1-CG2 3.93Å
423	K	87	Confident	73.6	Confident	74 Å²	74	85.8 Å²	85.8	32%	0.322	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	124.1	172.5	-74.2	-167.2	177.2	-172.9	0	110.4	S437 I438 V440 E447	K423-S437 CarbonylContact O-C 3.52Å; K423-S437 WeakPolarHBondContact O-CA 3.47Å; K423-I438 PolarHBondContact N-O 2.85Å; K423-I438 PolarHBondContact O-N 3.33Å; K423-V440 HydrophobicContact CD-CG2 4.02Å; K423-V440 HydrophobicContact CG-CG2 3.9Å; K423-E447 VanDerWaalsContact CD-OE1 3.29Å; K423-E447 WeakPolarHBondContact CD-OE1 3.28Å; K423-E447 VanDerWaalsContact CE-OE1 3.27Å; K423-E447 WeakPolarHBondContact CE-OE1 3.3Å; K423-E447 IonicContact NZ-OE1 2.76Å; K423-E447 PolarHBondContact NZ-OE1 3.2Å; K423-E447 IonicContact NZ-OE2 3.96Å; K423-E447 PolarHBondContact NZ-OE2 3.06Å
424	S	78.4	Confident	72.1	Confident	40 Å²	40	85.5 Å²	85.5	28%	0.28	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	111.1	167.8	55.5	0	0	0	0	109.3
425	E	70.7	Confident	70.7	Confident	132 Å²	132	86.2 Å²	86.2	62%	0.617	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	126.8	171.2	-161.4	172.4	-167.5	0	0	109.9	A427 G435 L436	E425-A427 PolarHBondContact O-N 2.95Å; E425-A427 VanDerWaalsContact O-N 3.15Å; E425-G435 WeakPolarHBondContact O-CA 3.47Å; E425-L436 PolarHBondContact N-O 3.2Å; E425-L436 PolarHBondContact O-N 3.44Å
426	E	63.6	Low	69.5	Low	99 Å²	99	83.3 Å²	83.3	46%	0.463	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	87.9	-178.5	-66.8	-179.3	-171.1	0	0	110.7	K428 V433	E426-K428 PolarHBondContact O-N 2.99Å; E426-V433 HydrophobicContact CB-CG1 4.17Å; E426-V433 HydrophobicContact CG-CG1 4.18Å
427	A	56.1	Low	68.8	Low	44 Å²	44	82.6 Å²	82.6	36%	0.364	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	113	171.2	0	0	0	0	0	110.3	E425 V429 I434	E425-A427 PolarHBondContact O-N 2.95Å; E425-A427 VanDerWaalsContact O-N 3.15Å; A427-V429 HydrophobicContact CB-CG2 4.36Å; A427-V429 PolarHBondContact O-N 3.49Å; A427-I434 PolarHBondContact O-N 3.06Å
428	K	54.4	Low	68.5	Low	182 Å²	182	84.9 Å²	84.9	79%	0.791	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	88.4	170.4	-71	-175.7	180	-179.6	0	110	E426	E426-K428 PolarHBondContact O-N 2.99Å
429	V	51.1	Low	68.4	Low	81 Å²	81	83.9 Å²	83.9	49%	0.491	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	113.3	171.6	-176.1	0	0	0	0	109.5	A427 S431 R432	A427-V429 HydrophobicContact CB-CG2 4.36Å; A427-V429 PolarHBondContact O-N 3.49Å; V429-S431 PolarHBondContact O-N 2.99Å; V429-R432 PolarHBondContact N-O 2.89Å; V429-R432 PolarHBondContact O-N 3.41Å; V429-R432 VanDerWaalsContact O-N 3.09Å; V429-R432 VanDerWaalsContact O-O 3.05Å
430	K	52.8	Low	68.4	Low	199 Å²	199	81.7 Å²	81.7	87%	0.865	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.4	55.9	172	-63.5	-177.2	179.1	178.5	0	113.7	R432	K430-R432 VanDerWaalsContact C-N 3.26Å; K430-R432 PolarHBondContact O-N 3.38Å
431	S	53.6	Low	68.3	Low	121 Å²	121	82.1 Å²	82.1	85%	0.846	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	4.8	175.2	-153.2	0	0	0	0	117.1	V429	V429-S431 PolarHBondContact O-N 2.99Å
432	R	47.3	Very low	68.3	Low	196 Å²	196	81.1 Å²	81.1	74%	0.74	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.7	166.5	-86.1	-176.2	-85.7	-171.1	-6.1	109.3	V429 K430 I434	V429-R432 PolarHBondContact N-O 2.89Å; V429-R432 PolarHBondContact O-N 3.41Å; V429-R432 VanDerWaalsContact O-N 3.09Å; V429-R432 VanDerWaalsContact O-O 3.05Å; K430-R432 VanDerWaalsContact C-N 3.26Å; K430-R432 PolarHBondContact O-N 3.38Å; R432-I434 HydrophobicContact CB-CG1 4.46Å; R432-I434 PolarHBondContact O-N 3.24Å
433	V	49.6	Very low	68	Low	59 Å²	59	81.5 Å²	81.5	36%	0.358	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	105.1	168.2	-177.8	0	0	0	0	106.5	E426	E426-V433 HydrophobicContact CB-CG1 4.17Å; E426-V433 HydrophobicContact CG-CG1 4.18Å
434	I	50.4	Low	68	Low	108 Å²	108	85.4 Å²	85.4	55%	0.554	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	103.3	170.1	-59.9	174.6	0	0	0	105	A427 R432 L436	A427-I434 PolarHBondContact O-N 3.06Å; R432-I434 HydrophobicContact CB-CG1 4.46Å; R432-I434 PolarHBondContact O-N 3.24Å; I434-L436 PolarHBondContact O-N 2.98Å; I434-L436 VanDerWaalsContact O-N 3.17Å
435	G	53.6	Low	68.4	Low	41 Å²	41	86.4 Å²	86.4	42%	0.423	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	108.7	178	0	0	0	0	0	109.9	E425 S437	E425-G435 WeakPolarHBondContact O-CA 3.47Å; G435-S437 PolarHBondContact O-N 3.48Å
436	L	58.5	Low	69.3	Low	103 Å²	103	84.1 Å²	84.1	54%	0.539	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	113.8	170.6	-170.4	73.7	0	0	0	106.8	E425 I434 I438	E425-L436 PolarHBondContact N-O 3.2Å; E425-L436 PolarHBondContact O-N 3.44Å; I434-L436 PolarHBondContact O-N 2.98Å; I434-L436 VanDerWaalsContact O-N 3.17Å; L436-I438 HydrophobicContact CD2-CD1 4.07Å; L436-I438 HydrophobicContact CD2-CG1 4.28Å; L436-I438 HydrophobicContact CG-CG1 4.32Å
437	S	71.9	Confident	70.6	Confident	66 Å²	66	83.7 Å²	83.7	46%	0.462	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	118.4	177.3	-61	0	0	0	0	109.6	K423 G435	K423-S437 CarbonylContact O-C 3.52Å; K423-S437 WeakPolarHBondContact O-CA 3.47Å; G435-S437 PolarHBondContact O-N 3.48Å
438	I	81.5	Confident	72.2	Confident	55 Å²	55	83.9 Å²	83.9	28%	0.282	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.6	177.2	-58.5	175.5	0	0	0	108.1	K423 L436 V440	K423-I438 PolarHBondContact N-O 2.85Å; K423-I438 PolarHBondContact O-N 3.33Å; L436-I438 HydrophobicContact CD2-CD1 4.07Å; L436-I438 HydrophobicContact CD2-CG1 4.28Å; L436-I438 HydrophobicContact CG-CG1 4.32Å; I438-V440 HydrophobicContact CG2-CG1 4.2Å
439	V	88.3	Confident	73.9	Confident	46 Å²	46	78.5 Å²	78.5	28%	0.279	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	116.7	174.2	-169.6	0	0	0	0	108.4	V420 M450 I466	V420-V439 HydrophobicContact CG1-CG1 3.46Å; V420-V439 VanDerWaalsContact CG1-CG1 3.46Å; V439-M450 HydrophobicContact CB-SD 4.42Å; V439-M450 HydrophobicContact CG1-CG 4.19Å; V439-M450 HydrophobicContact CG1-SD 3.44Å; V439-M450 WeakPolarHBondContact CG1-SD 3.36Å; V439-M450 PolarHBondContact O-N 2.73Å; V439-M450 VanDerWaalsContact O-N 3.14Å; V439-I466 HydrophobicContact CG1-CD1 3.97Å; V439-I466 HydrophobicContact CG2-CD1 4.09Å
440	V	91.2	Very high	75.6	Confident	9 Å²	9	75.1 Å²	75.1	6%	0.055	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	149.9	178.9	-60.4	0	0	0	0	110.1	V420 E421 K423 I438 F442 E447 L448	V420-V440 WeakPolarHBondContact CA-O 3.26Å; E421-V440 HydrophobicContact CB-CG2 4.04Å; E421-V440 PolarHBondContact N-O 3.07Å; E421-V440 WeakPolarHBondContact O-CG2 3.37Å; E421-V440 PolarHBondContact O-N 2.84Å; K423-V440 HydrophobicContact CD-CG2 4.02Å; K423-V440 HydrophobicContact CG-CG2 3.9Å; I438-V440 HydrophobicContact CG2-CG1 4.2Å; V440-F442 HydrophobicContact CG2-CE2 4.17Å; V440-E447 HydrophobicContact CB-CG 4.12Å; V440-E447 HydrophobicContact CG1-CG 4.39Å; V440-E447 HydrophobicContact CG2-CG 4.35Å; V440-L448 CarbonylContact C-O 3.59Å; V440-L448 WeakPolarHBondContact CA-O 3.27Å
441	M	91.1	Very high	77.1	Confident	11 Å²	11	76 Å²	76	5%	0.054	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	150	172.3	65.2	-171.8	-169.5	0	0	109.8	I417 V420 L448 M450 R453	I417-M441 HydrophobicContact CD1-SD 3.87Å; I417-M441 HydrophobicContact CG1-SD 4.13Å; I417-M441 HydrophobicContact CG2-CB 3.92Å; V420-M441 HydrophobicContact CG2-CB 4.4Å; M441-L448 HydrophobicContact CE-CB 3.86Å; M441-L448 HydrophobicContact CE-CD1 3.91Å; M441-L448 HydrophobicContact CG-CB 4.02Å; M441-L448 PolarHBondContact N-O 3.37Å; M441-L448 PolarHBondContact O-N 3.37Å; M441-M450 HydrophobicContact CB-CG 3.66Å; M441-M450 HydrophobicContact CB-SD 4.25Å; M441-M450 HydrophobicContact CG-CG 3.9Å; M441-M450 HydrophobicContact SD-CG 4.04Å; M441-R453 HydrophobicContact CE-CB 3.88Å
442	F	91.1	Very high	78.6	Confident	23 Å²	23	73.5 Å²	73.5	10%	0.101	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	127.4	172.3	-72.4	-96.1	0	0	0	109.4	D418 Y419 E421 V440 V446 E447	D418-F442 HydrophobicContact CB-CB 4.49Å; D418-F442 WeakPolarHBondContact CB-O 3.37Å; D418-F442 PolarHBondContact N-O 3.21Å; Y419-F442 HydrophobicContact CD1-CB 4.26Å; Y419-F442 AromaticContact CD2-CD2 3.83Å; Y419-F442 HydrophobicContact CD2-CD2 3.83Å; Y419-F442 HydrophobicContact CD2-CE2 4.44Å; Y419-F442 HydrophobicContact CE1-CB 3.87Å; Y419-F442 HydrophobicContact CE1-CD2 4.27Å; Y419-F442 HydrophobicContact CE1-CG 4.06Å; Y419-F442 HydrophobicContact CE2-CB 4.29Å; Y419-F442 AromaticContact CE2-CD2 3.18Å; Y419-F442 HydrophobicContact CE2-CD2 3.18Å; Y419-F442 AromaticContact CE2-CE2 3.55Å; Y419-F442 HydrophobicContact CE2-CE2 3.55Å; Y419-F442 AromaticContact CE2-CG 3.81Å; Y419-F442 HydrophobicContact CE2-CG 3.81Å; Y419-F442 HydrophobicContact CE2-CZ 4.41Å; Y419-F442 AromaticContact CZ-CD2 3.44Å; Y419-F442 VanDerWaalsContact CZ-CD2 3.44Å; Y419-F442 AromaticContact CZ-CE2 3.93Å; Y419-F442 AromaticContact CZ-CG 3.53Å; Y419-F442 PolarHBondContact O-N 3.08Å; E421-F442 HydrophobicContact CB-CE2 4.31Å; V440-F442 HydrophobicContact CG2-CE2 4.17Å; F442-V446 WeakPolarHBondContact CA-O 3.41Å; F442-E447 HydrophobicContact CD1-CB 4.22Å; F442-E447 HydrophobicContact CE1-CB 3.77Å; F442-E447 HydrophobicContact CE1-CG 4.26Å; F442-E447 HydrophobicContact CZ-CB 4.13Å; F442-E447 HydrophobicContact CZ-CG 4.1Å
443	C	86.6	Confident	80.4	Confident	23 Å²	23	72.3 Å²	72.3	16%	0.155	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	115.1	176.3	-58.5	0	0	0	0	108.2	D416 G445 V446 L448	D416-C443 PolarHBondContact O-SG 3.45Å; C443-G445 PolarHBondContact O-N 3.38Å; C443-V446 PolarHBondContact N-O 3.21Å; C443-V446 WeakPolarHBondContact O-CB 3.41Å; C443-V446 PolarHBondContact O-N 3.48Å; C443-L448 HydrophobicContact CB-CD1 4.3Å
444	D	86.9	Confident	82.1	Confident	155 Å²	155	70.2 Å²	70.2	83%	0.829	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	37.2	-176.2	-67.8	-45	0	0	0	112.5	D418 V446	D418-D444 PolarHBondContact OD2-N 3.37Å; D444-V446 VanDerWaalsContact C-N 3.28Å; D444-V446 PolarHBondContact O-N 2.96Å
445	G	86.9	Confident	83.9	Confident	61 Å²	61	68 Å²	68	63%	0.629	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	3.5	-176.8	0	0	0	0	0	116	D418 C443	D418-G445 PolarHBondContact OD2-N 2.85Å; C443-G445 PolarHBondContact O-N 3.38Å
446	V	89.5	Confident	85.3	Confident	85 Å²	85	68.5 Å²	68.5	52%	0.515	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125.4	173.4	-176.8	0	0	0	0	110.3	F442 C443 D444 L448	F442-V446 WeakPolarHBondContact CA-O 3.41Å; C443-V446 PolarHBondContact N-O 3.21Å; C443-V446 WeakPolarHBondContact O-CB 3.41Å; C443-V446 PolarHBondContact O-N 3.48Å; D444-V446 VanDerWaalsContact C-N 3.28Å; D444-V446 PolarHBondContact O-N 2.96Å; V446-L448 HydrophobicContact CG1-CD2 4.15Å; V446-L448 HydrophobicContact CG1-CG 4.22Å
447	E	90.5	Very high	86.4	Confident	89 Å²	89	64.1 Å²	64.1	42%	0.416	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	125.8	173.8	-177.3	-179.5	167.3	0	0	111.4	K423 V440 F442	K423-E447 VanDerWaalsContact CD-OE1 3.29Å; K423-E447 WeakPolarHBondContact CD-OE1 3.28Å; K423-E447 VanDerWaalsContact CE-OE1 3.27Å; K423-E447 WeakPolarHBondContact CE-OE1 3.3Å; K423-E447 IonicContact NZ-OE1 2.76Å; K423-E447 PolarHBondContact NZ-OE1 3.2Å; K423-E447 IonicContact NZ-OE2 3.96Å; K423-E447 PolarHBondContact NZ-OE2 3.06Å; V440-E447 HydrophobicContact CB-CG 4.12Å; V440-E447 HydrophobicContact CG1-CG 4.39Å; V440-E447 HydrophobicContact CG2-CG 4.35Å; F442-E447 HydrophobicContact CD1-CB 4.22Å; F442-E447 HydrophobicContact CE1-CB 3.77Å; F442-E447 HydrophobicContact CE1-CG 4.26Å; F442-E447 HydrophobicContact CZ-CB 4.13Å; F442-E447 HydrophobicContact CZ-CG 4.1Å
448	L	90.3	Very high	87.1	Confident	49 Å²	49	62 Å²	62	26%	0.257	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.3	-179.8	-64	172.3	0	0	0	110.7	V440 M441 C443 V446 M450	V440-L448 CarbonylContact C-O 3.59Å; V440-L448 WeakPolarHBondContact CA-O 3.27Å; M441-L448 HydrophobicContact CE-CB 3.86Å; M441-L448 HydrophobicContact CE-CD1 3.91Å; M441-L448 HydrophobicContact CG-CB 4.02Å; M441-L448 PolarHBondContact N-O 3.37Å; M441-L448 PolarHBondContact O-N 3.37Å; C443-L448 HydrophobicContact CB-CD1 4.3Å; V446-L448 HydrophobicContact CG1-CD2 4.15Å; V446-L448 HydrophobicContact CG1-CG 4.22Å; L448-M450 PolarHBondContact O-N 2.98Å
449	D	89.3	Confident	87.5	Confident	68 Å²	68	64.2 Å²	64.2	36%	0.364	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	127.4	168.1	-177.6	-0.3	0	0	0	109.6	R451 R453	D449-R451 PolarHBondContact O-N 3.44Å; D449-R451 VanDerWaalsContact OD1-CB 3.31Å; D449-R451 WeakPolarHBondContact OD1-CB 3.18Å; D449-R451 PolarHBondContact OD1-N 3.36Å; D449-R453 VanDerWaalsContact O-CD 3.31Å; D449-R453 WeakPolarHBondContact O-CD 3.39Å
450	M	86.4	Confident	87.3	Confident	10 Å²	10	64 Å²	64	5%	0.049	36%	0.355	C	S	.	.			trans	-66.8	-27.3	177.3	-71.1	-165.3	78.5	0	0	112	V420 V439 M441 L448 G452 R453 C454 A462	V420-M450 HydrophobicContact CB-SD 4.27Å; V420-M450 HydrophobicContact CG1-SD 3.51Å; V420-M450 VanDerWaalsContact CG1-SD 3.51Å; V420-M450 HydrophobicContact CG2-CE 3.99Å; V420-M450 HydrophobicContact CG2-SD 3.7Å; V439-M450 HydrophobicContact CB-SD 4.42Å; V439-M450 HydrophobicContact CG1-CG 4.19Å; V439-M450 HydrophobicContact CG1-SD 3.44Å; V439-M450 WeakPolarHBondContact CG1-SD 3.36Å; V439-M450 PolarHBondContact O-N 2.73Å; V439-M450 VanDerWaalsContact O-N 3.14Å; M441-M450 HydrophobicContact CB-CG 3.66Å; M441-M450 HydrophobicContact CB-SD 4.25Å; M441-M450 HydrophobicContact CG-CG 3.9Å; M441-M450 HydrophobicContact SD-CG 4.04Å; L448-M450 PolarHBondContact O-N 2.98Å; M450-G452 PolarHBondContact O-N 3.28Å; M450-R453 PolarHBondContact O-N 2.92Å; M450-R453 VanDerWaalsContact O-N 3.09Å; M450-C454 HydrophobicContact CE-CB 4.25Å; M450-C454 PolarHBondContact O-SG 2.9Å; M450-A462 HydrophobicContact CE-CB 3.99Å
451	R	85.6	Confident	87.1	Confident	218 Å²	218	63.6 Å²	63.6	82%	0.823	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	113.2	-173.7	-168.4	175.8	-178.8	-177.8	0.5	111	D449 R453	D449-R451 PolarHBondContact O-N 3.44Å; D449-R451 VanDerWaalsContact OD1-CB 3.31Å; D449-R451 WeakPolarHBondContact OD1-CB 3.18Å; D449-R451 PolarHBondContact OD1-N 3.36Å; R451-R453 VanDerWaalsContact C-N 3.3Å; R451-R453 PolarHBondContact O-N 3Å
452	G	83.9	Confident	87	Confident	68 Å²	68	63.4 Å²	63.4	70%	0.701	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.3	2.1	178.1	0	0	0	0	0	115.2	M450	M450-G452 PolarHBondContact O-N 3.28Å
453	R	86.3	Confident	86.8	Confident	172 Å²	172	64.7 Å²	64.7	65%	0.649	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-13.7	-179.6	-60.9	-168.9	-177.5	-113.9	-0	114.8	M441 D449 M450 R451	M441-R453 HydrophobicContact CE-CB 3.88Å; D449-R453 VanDerWaalsContact O-CD 3.31Å; D449-R453 WeakPolarHBondContact O-CD 3.39Å; M450-R453 PolarHBondContact O-N 2.92Å; M450-R453 VanDerWaalsContact O-N 3.09Å; R451-R453 VanDerWaalsContact C-N 3.3Å; R451-R453 PolarHBondContact O-N 3Å
454	C	84.9	Confident	86.8	Confident	15 Å²	15	64 Å²	64	10%	0.101	36%	0.359	C	S	.	.	S	Bend	trans	-104.4	156.4	179.9	55.3	0	0	0	0	113.4	M450 Q458 K459	M450-C454 HydrophobicContact CE-CB 4.25Å; M450-C454 PolarHBondContact O-SG 2.9Å; C454-Q458 VanDerWaalsContact CA-OE1 3.32Å; C454-Q458 HydrophobicContact CB-CB 3.99Å; C454-Q458 VanDerWaalsContact CB-OE1 3.27Å; C454-K459 VanDerWaalsContact O-CE 3.23Å; C454-K459 WeakPolarHBondContact O-CE 3.24Å; C454-K459 PolarHBondContact O-NZ 2.97Å; C454-K459 WeakPolarHBondContact SG-CE 3.31Å; C454-K459 WeakPolarHBondContact SG-CG 3.45Å
455	S	87.2	Confident	86.8	Confident	60 Å²	60	56.7 Å²	56.7	42%	0.42	32%	0.32	S	S	.	.			trans	-68.5	167.5	176.5	78	0	0	0	0	112.2	Q458 K459	S455-Q458 PolarHBondContact O-N 3.29Å; S455-Q458 VanDerWaalsContact OG-CG 3.31Å; S455-Q458 WeakPolarHBondContact OG-CG 3.42Å; S455-Q458 PolarHBondContact OG-N 2.88Å; S455-K459 WeakPolarHBondContact O-CG 3.46Å; S455-K459 PolarHBondContact O-N 2.85Å; S455-K459 VanDerWaalsContact O-N 3.12Å
456	A	83.5	Confident	87	Confident	53 Å²	53	55 Å²	55	44%	0.438	30%	0.297	S	S	.	.	H	α-helix	trans	-61.2	-45	175.8	0	0	0	0	0	111.9	Q458 K459 V460 N489	A456-Q458 PolarHBondContact O-N 3.15Å; A456-K459 WeakPolarHBondContact O-CB 3.42Å; A456-K459 PolarHBondContact O-N 3.12Å; A456-V460 WeakPolarHBondContact O-CG2 3.32Å; A456-V460 PolarHBondContact O-N 3.48Å; A456-V460 VanDerWaalsContact O-N 3.07Å; A456-N489 HydrophobicContact CB-CB 4.13Å
457	G	82.4	Confident	86.9	Confident	11 Å²	11	57.9 Å²	57.9	11%	0.113	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-42.8	177.8	0	0	0	0	0	113.1	K459 V460 L461 N489	G457-K459 VanDerWaalsContact C-N 3.32Å; G457-K459 PolarHBondContact O-N 3.37Å; G457-V460 PolarHBondContact O-N 3.42Å; G457-L461 WeakPolarHBondContact O-CB 3.48Å; G457-L461 PolarHBondContact O-N 3.49Å; G457-N489 WeakPolarHBondContact CA-O 3.2Å
458	Q	87	Confident	86.5	Confident	20 Å²	20	54.3 Å²	54.3	9%	0.093	28%	0.282	C	S	.	.	H	α-helix	trans	-62.3	-37.7	175.7	-73.4	164.4	-6.1	0	0	112.3	Y412 D416 I417 C454 S455 A456 A462	Y412-Q458 HydrophobicContact CE2-CG 3.89Å; Y412-Q458 PolarHBondContact OH-NE2 2.92Å; D416-Q458 PolarHBondContact OD2-NE2 3.45Å; I417-Q458 HydrophobicContact CD1-CG 4.18Å; C454-Q458 VanDerWaalsContact CA-OE1 3.32Å; C454-Q458 HydrophobicContact CB-CB 3.99Å; C454-Q458 VanDerWaalsContact CB-OE1 3.27Å; S455-Q458 PolarHBondContact O-N 3.29Å; S455-Q458 VanDerWaalsContact OG-CG 3.31Å; S455-Q458 WeakPolarHBondContact OG-CG 3.42Å; S455-Q458 PolarHBondContact OG-N 2.88Å; A456-Q458 PolarHBondContact O-N 3.15Å; Q458-A462 WeakPolarHBondContact O-CB 3.45Å; Q458-A462 PolarHBondContact O-N 2.93Å
459	K	88.1	Confident	86.3	Confident	102 Å²	102	52 Å²	52	44%	0.443	27%	0.27	S	S	.	.	H	α-helix	trans	-65.9	-43.5	176	-71.5	171.2	-173.6	165.6	0	112.1	C454 S455 A456 G457 S463	C454-K459 VanDerWaalsContact O-CE 3.23Å; C454-K459 WeakPolarHBondContact O-CE 3.24Å; C454-K459 PolarHBondContact O-NZ 2.97Å; C454-K459 WeakPolarHBondContact SG-CE 3.31Å; C454-K459 WeakPolarHBondContact SG-CG 3.45Å; S455-K459 WeakPolarHBondContact O-CG 3.46Å; S455-K459 PolarHBondContact O-N 2.85Å; S455-K459 VanDerWaalsContact O-N 3.12Å; A456-K459 WeakPolarHBondContact O-CB 3.42Å; A456-K459 PolarHBondContact O-N 3.12Å; G457-K459 VanDerWaalsContact C-N 3.32Å; G457-K459 PolarHBondContact O-N 3.37Å; K459-S463 VanDerWaalsContact O-CB 3.3Å; K459-S463 WeakPolarHBondContact O-CB 3.42Å; K459-S463 PolarHBondContact O-N 3.32Å
460	V	85.3	Confident	86.2	Confident	42 Å²	42	52 Å²	52	26%	0.255	27%	0.269	S	S	.	.	H	α-helix	trans	-62.4	-48.8	177.7	172.5	0	0	0	0	109.7	A456 G457 S463 I464	A456-V460 WeakPolarHBondContact O-CG2 3.32Å; A456-V460 PolarHBondContact O-N 3.48Å; A456-V460 VanDerWaalsContact O-N 3.07Å; G457-V460 PolarHBondContact O-N 3.42Å; V460-S463 WeakPolarHBondContact O-CB 3.26Å; V460-S463 PolarHBondContact O-N 3.48Å; V460-I464 HydrophobicContact CG1-CD1 3.86Å; V460-I464 WeakPolarHBondContact O-CG1 3.24Å; V460-I464 PolarHBondContact O-N 2.9Å
461	L	86.1	Confident	85.9	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-47.6	179.4	-168.1	151.5	0	0	0	111.8	W408 V411 Y412 G457 S463 I464 I465 L490 N494	W408-L461 HydrophobicContact CD2-CD2 4.43Å; W408-L461 HydrophobicContact CE3-CD2 3.66Å; W408-L461 HydrophobicContact CH2-CD2 3.93Å; W408-L461 HydrophobicContact CZ3-CD2 3.35Å; V411-L461 HydrophobicContact CG1-CD1 3.72Å; V411-L461 HydrophobicContact CG1-CD2 4.15Å; V411-L461 HydrophobicContact CG1-CG 3.88Å; Y412-L461 HydrophobicContact CD2-CD1 4.07Å; Y412-L461 HydrophobicContact CD2-CD2 4.31Å; G457-L461 WeakPolarHBondContact O-CB 3.48Å; G457-L461 PolarHBondContact O-N 3.49Å; L461-S463 VanDerWaalsContact C-N 3.32Å; L461-S463 PolarHBondContact O-N 2.82Å; L461-I464 PolarHBondContact O-N 3.17Å; L461-I465 HydrophobicContact CD2-CD1 3.42Å; L461-I465 VanDerWaalsContact CD2-CD1 3.42Å; L461-I465 HydrophobicContact CD2-CG1 4.37Å; L461-I465 HydrophobicContact CG-CD1 4.34Å; L461-I465 WeakPolarHBondContact O-CG1 3.48Å; L461-I465 PolarHBondContact O-N 2.9Å; L461-L490 HydrophobicContact CB-CD2 4.3Å; L461-L490 HydrophobicContact CD1-CD2 4.3Å; L461-N494 HydrophobicContact CD1-CB 4.35Å
462	A	89.1	Confident	85.5	Confident	7 Å²	7	45.3 Å²	45.3	6%	0.058	25%	0.253	C	S	.	.	H	α-helix	trans	-59.5	-41.8	174.8	0	0	0	0	0	112	W408 M450 Q458 I464 I465 I466	W408-A462 HydrophobicContact CH2-CB 4.49Å; W408-A462 HydrophobicContact CZ3-CB 3.79Å; M450-A462 HydrophobicContact CE-CB 3.99Å; Q458-A462 WeakPolarHBondContact O-CB 3.45Å; Q458-A462 PolarHBondContact O-N 2.93Å; A462-I464 PolarHBondContact O-N 3.1Å; A462-I465 PolarHBondContact O-N 3.43Å; A462-I466 WeakPolarHBondContact O-CB 3.4Å; A462-I466 WeakPolarHBondContact O-CD1 3.36Å; A462-I466 WeakPolarHBondContact O-CG1 3.26Å; A462-I466 PolarHBondContact O-N 2.85Å
463	S	88.2	Confident	85.5	Confident	49 Å²	49	43 Å²	43	34%	0.343	23%	0.225	S	C	.	.	H	α-helix	trans	-63.5	-42.7	178.5	-173.7	0	0	0	0	112	K459 V460 L461 R467	K459-S463 VanDerWaalsContact O-CB 3.3Å; K459-S463 WeakPolarHBondContact O-CB 3.42Å; K459-S463 PolarHBondContact O-N 3.32Å; V460-S463 WeakPolarHBondContact O-CB 3.26Å; V460-S463 PolarHBondContact O-N 3.48Å; L461-S463 VanDerWaalsContact C-N 3.32Å; L461-S463 PolarHBondContact O-N 2.82Å; S463-R467 WeakPolarHBondContact O-CB 3.36Å; S463-R467 WeakPolarHBondContact O-CG 3.31Å; S463-R467 PolarHBondContact O-N 2.97Å
464	I	85.3	Confident	85.3	Confident	8 Å²	8	40.5 Å²	40.5	4%	0.041	22%	0.219	C	C	.	.	H	α-helix	trans	-63.9	-48.5	177.7	-67.4	167.1	0	0	0	110.1	V460 L461 A462 I466 R467 I468 L483 P486 L498	V460-I464 HydrophobicContact CG1-CD1 3.86Å; V460-I464 WeakPolarHBondContact O-CG1 3.24Å; V460-I464 PolarHBondContact O-N 2.9Å; L461-I464 PolarHBondContact O-N 3.17Å; A462-I464 PolarHBondContact O-N 3.1Å; I464-I466 PolarHBondContact O-N 3.45Å; I464-R467 PolarHBondContact O-N 3.44Å; I464-I468 HydrophobicContact CG2-CD1 3.87Å; I464-I468 WeakPolarHBondContact O-CG1 3.34Å; I464-I468 PolarHBondContact O-N 3.36Å; I464-L483 HydrophobicContact CG1-CD2 4.17Å; I464-L483 HydrophobicContact CG2-CD1 4.47Å; I464-L483 HydrophobicContact CG2-CD2 4.21Å; I464-P486 HydrophobicContact CD1-CB 3.99Å; I464-L498 HydrophobicContact CD1-CD2 4.26Å; I464-L498 HydrophobicContact CG2-CD1 4.33Å
465	I	87.6	Confident	84.8	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-45.5	179.6	-70	176.6	0	0	0	111.6	I404 L407 W408 V411 L461 A462 R467 I468 A469	I404-I465 HydrophobicContact CB-CG2 4.34Å; I404-I465 HydrophobicContact CG1-CG2 4.36Å; I404-I465 HydrophobicContact CG2-CG2 4.09Å; L407-I465 HydrophobicContact CB-CD1 4.4Å; L407-I465 HydrophobicContact CB-CG1 4.3Å; L407-I465 HydrophobicContact CB-CG2 3.75Å; L407-I465 HydrophobicContact CD1-CG2 4.16Å; W408-I465 HydrophobicContact CB-CD1 4.36Å; W408-I465 HydrophobicContact CE3-CD1 3.82Å; V411-I465 HydrophobicContact CB-CD1 4.09Å; V411-I465 HydrophobicContact CG2-CD1 4.08Å; V411-I465 HydrophobicContact CG2-CG1 4.45Å; L461-I465 HydrophobicContact CD2-CD1 3.42Å; L461-I465 VanDerWaalsContact CD2-CD1 3.42Å; L461-I465 HydrophobicContact CD2-CG1 4.37Å; L461-I465 HydrophobicContact CG-CD1 4.34Å; L461-I465 WeakPolarHBondContact O-CG1 3.48Å; L461-I465 PolarHBondContact O-N 2.9Å; A462-I465 PolarHBondContact O-N 3.43Å; I465-R467 VanDerWaalsContact C-N 3.34Å; I465-R467 PolarHBondContact O-N 2.87Å; I465-I468 WeakPolarHBondContact O-CB 3.33Å; I465-I468 PolarHBondContact O-N 3.01Å; I465-A469 PolarHBondContact O-N 3.4Å
466	I	90.3	Very high	83.9	Confident	27 Å²	27	44 Å²	44	14%	0.138	24%	0.244	C	C	.	.	H	α-helix	trans	-62.5	-42.6	177.7	-70	166.6	0	0	0	110.7	I404 I422 V439 A462 I464 I468 A469 L470	I404-I466 HydrophobicContact CD1-CG1 3.95Å; I404-I466 HydrophobicContact CG1-CG1 4.46Å; I422-I466 HydrophobicContact CD1-CD1 4.49Å; I422-I466 HydrophobicContact CD1-CG1 4.3Å; I422-I466 HydrophobicContact CD1-CG2 3.93Å; V439-I466 HydrophobicContact CG1-CD1 3.97Å; V439-I466 HydrophobicContact CG2-CD1 4.09Å; A462-I466 WeakPolarHBondContact O-CB 3.4Å; A462-I466 WeakPolarHBondContact O-CD1 3.36Å; A462-I466 WeakPolarHBondContact O-CG1 3.26Å; A462-I466 PolarHBondContact O-N 2.85Å; I464-I466 PolarHBondContact O-N 3.45Å; I466-I468 VanDerWaalsContact C-N 3.31Å; I466-I468 PolarHBondContact O-N 3.38Å; I466-A469 PolarHBondContact O-N 3.41Å; I466-L470 HydrophobicContact CG2-CD1 3.78Å; I466-L470 HydrophobicContact CG2-CG 4.28Å; I466-L470 WeakPolarHBondContact O-CB 3.46Å; I466-L470 VanDerWaalsContact O-CG 3.25Å; I466-L470 WeakPolarHBondContact O-CG 3.43Å; I466-L470 PolarHBondContact O-N 3.32Å
467	R	87.2	Confident	83	Confident	145 Å²	145	47.4 Å²	47.4	55%	0.547	26%	0.255	S	S	.	.	H	α-helix	trans	-61.2	-41.4	177	-77	174.5	-175.1	-172.3	3.6	111.8	S463 I464 I465 G471 F481	S463-R467 WeakPolarHBondContact O-CB 3.36Å; S463-R467 WeakPolarHBondContact O-CG 3.31Å; S463-R467 PolarHBondContact O-N 2.97Å; I464-R467 PolarHBondContact O-N 3.44Å; I465-R467 VanDerWaalsContact C-N 3.34Å; I465-R467 PolarHBondContact O-N 2.87Å; R467-G471 PolarHBondContact O-N 2.86Å; R467-F481 HydrophobicContact CB-CE2 3.92Å; R467-F481 HydrophobicContact CB-CZ 3.96Å
468	I	82.1	Confident	82.1	Confident	14 Å²	14	50.5 Å²	50.5	7%	0.072	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-53.6	175.1	-73.3	168	0	0	0	110.4	L407 I464 I465 I466 L470 G471 E472 F481 L502 L505	L407-I468 HydrophobicContact CD1-CB 4.12Å; L407-I468 HydrophobicContact CD1-CG2 3.45Å; L407-I468 VanDerWaalsContact CD1-CG2 3.45Å; I464-I468 HydrophobicContact CG2-CD1 3.87Å; I464-I468 WeakPolarHBondContact O-CG1 3.34Å; I464-I468 PolarHBondContact O-N 3.36Å; I465-I468 WeakPolarHBondContact O-CB 3.33Å; I465-I468 PolarHBondContact O-N 3.01Å; I466-I468 VanDerWaalsContact C-N 3.31Å; I466-I468 PolarHBondContact O-N 3.38Å; I468-L470 VanDerWaalsContact C-N 3.3Å; I468-L470 PolarHBondContact O-N 3.01Å; I468-G471 CarbonylContact O-C 3.6Å; I468-G471 WeakPolarHBondContact O-CA 3.29Å; I468-G471 PolarHBondContact O-N 3.26Å; I468-G471 VanDerWaalsContact O-N 3.09Å; I468-E472 WeakPolarHBondContact O-CB 3.43Å; I468-E472 PolarHBondContact O-N 3.17Å; I468-F481 HydrophobicContact CB-CZ 4.44Å; I468-F481 HydrophobicContact CD1-CE1 4.21Å; I468-F481 HydrophobicContact CD1-CZ 4.3Å; I468-F481 HydrophobicContact CG1-CD1 4.48Å; I468-F481 HydrophobicContact CG1-CE1 3.66Å; I468-F481 HydrophobicContact CG1-CE2 3.95Å; I468-F481 HydrophobicContact CG1-CZ 3.38Å; I468-L502 HydrophobicContact CD1-CD2 4.08Å; I468-L505 HydrophobicContact CB-CD1 4.25Å; I468-L505 HydrophobicContact CD1-CD1 3.9Å; I468-L505 HydrophobicContact CG1-CD1 4.07Å; I468-L505 HydrophobicContact CG2-CD1 3.2Å
469	A	85.7	Confident	81.4	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61	-39	-176.6	0	0	0	0	0	112.3	I400 I403 I404 I465 I466 E472 V473	I400-A469 HydrophobicContact CG2-CB 4.2Å; I403-A469 HydrophobicContact CB-CB 4.07Å; I403-A469 HydrophobicContact CG2-CB 3.74Å; I404-A469 HydrophobicContact CD1-CB 4.35Å; I404-A469 HydrophobicContact CG1-CB 3.57Å; I465-A469 PolarHBondContact O-N 3.4Å; I466-A469 PolarHBondContact O-N 3.41Å; A469-E472 PolarHBondContact O-N 2.95Å; A469-V473 WeakPolarHBondContact O-CG2 3.46Å; A469-V473 PolarHBondContact O-N 2.99Å
470	L	87	Confident	81	Confident	68 Å²	68	51.1 Å²	51.1	36%	0.356	28%	0.279	S	S	.	.	H	α-helix	trans	-65.3	-45	173.9	-71.6	171.6	0	0	0	111.9	I400 I466 I468 E472 V473 F474	I400-L470 HydrophobicContact CD1-CD2 3.85Å; I400-L470 HydrophobicContact CG1-CD2 4.48Å; I466-L470 HydrophobicContact CG2-CD1 3.78Å; I466-L470 HydrophobicContact CG2-CG 4.28Å; I466-L470 WeakPolarHBondContact O-CB 3.46Å; I466-L470 VanDerWaalsContact O-CG 3.25Å; I466-L470 WeakPolarHBondContact O-CG 3.43Å; I466-L470 PolarHBondContact O-N 3.32Å; I468-L470 VanDerWaalsContact C-N 3.3Å; I468-L470 PolarHBondContact O-N 3.01Å; L470-E472 PolarHBondContact O-N 2.72Å; L470-V473 PolarHBondContact O-N 3.38Å; L470-F474 HydrophobicContact CD2-CD2 4.31Å; L470-F474 HydrophobicContact CD2-CE2 3.95Å; L470-F474 WeakPolarHBondContact O-CD2 3.27Å; L470-F474 PolarHBondContact O-N 3.14Å; L470-F474 VanDerWaalsContact O-N 3.15Å
471	G	81	Confident	80.9	Confident	21 Å²	21	50.2 Å²	50.2	22%	0.216	27%	0.272	C	S	.	.	H	α-helix	trans	-58.3	-39.8	174.4	0	0	0	0	0	111.6	R467 I468 S475	R467-G471 PolarHBondContact O-N 2.86Å; I468-G471 CarbonylContact O-C 3.6Å; I468-G471 WeakPolarHBondContact O-CA 3.29Å; I468-G471 PolarHBondContact O-N 3.26Å; I468-G471 VanDerWaalsContact O-N 3.09Å; G471-S475 WeakPolarHBondContact O-CB 3.45Å; G471-S475 PolarHBondContact O-N 3.46Å; G471-S475 PolarHBondContact O-OG 3.38Å
472	E	77.3	Confident	81	Confident	66 Å²	66	54.6 Å²	54.6	31%	0.308	30%	0.299	S	S	.	.	H	α-helix	trans	-66.5	-45.4	179.3	169	155.8	-156.5	0	0	113.7	I403 I468 A469 L470 R509	I403-E472 HydrophobicContact CD1-CB 4.25Å; I403-E472 HydrophobicContact CD1-CG 3.57Å; I403-E472 WeakPolarHBondContact CG2-OE2 3.49Å; I468-E472 WeakPolarHBondContact O-CB 3.43Å; I468-E472 PolarHBondContact O-N 3.17Å; A469-E472 PolarHBondContact O-N 2.95Å; L470-E472 PolarHBondContact O-N 2.72Å; E472-R509 VanDerWaalsContact CA-NH2 3.34Å; E472-R509 VanDerWaalsContact CG-NH2 3.25Å; E472-R509 IonicContact OE1-NH2 3.14Å
473	V	83.5	Confident	80.9	Confident	19 Å²	19	54.6 Å²	54.6	12%	0.115	30%	0.298	C	S	.	.	H	α-helix	trans	-77.4	-29.3	-174.4	173	0	0	0	0	113.2	K396 Q399 I400 I403 A469 L470	K396-V473 HydrophobicContact CB-CG1 4.42Å; K396-V473 HydrophobicContact CD-CG1 3.41Å; K396-V473 VanDerWaalsContact CD-CG1 3.41Å; Q399-V473 HydrophobicContact CB-CG2 4.08Å; I400-V473 HydrophobicContact CD1-CG1 4.39Å; I400-V473 HydrophobicContact CG1-CB 3.86Å; I400-V473 HydrophobicContact CG1-CG1 3.96Å; I400-V473 HydrophobicContact CG1-CG2 3.68Å; I403-V473 HydrophobicContact CD1-CG2 3.48Å; I403-V473 VanDerWaalsContact CD1-CG2 3.48Å; A469-V473 WeakPolarHBondContact O-CG2 3.46Å; A469-V473 PolarHBondContact O-N 2.99Å; L470-V473 PolarHBondContact O-N 3.38Å
474	F	82.8	Confident	81	Confident	120 Å²	120	58 Å²	58	53%	0.526	31%	0.312	S	S	.	.	H	α-helix	trans	-107	-19	-174.8	-66.5	-67.3	0	0	0	115.3	I400 L470 S476	I400-F474 HydrophobicContact CD1-CE2 3.87Å; I400-F474 HydrophobicContact CD1-CZ 4.28Å; L470-F474 HydrophobicContact CD2-CD2 4.31Å; L470-F474 HydrophobicContact CD2-CE2 3.95Å; L470-F474 WeakPolarHBondContact O-CD2 3.27Å; L470-F474 PolarHBondContact O-N 3.14Å; L470-F474 VanDerWaalsContact O-N 3.15Å; F474-S476 PolarHBondContact O-N 3.44Å
475	S	73	Confident	81.2	Confident	44 Å²	44	59.8 Å²	59.8	31%	0.308	32%	0.32	S	S	.	.			trans	-94	87.2	-176.2	-44.9	0	0	0	0	111	G471	G471-S475 WeakPolarHBondContact O-CB 3.45Å; G471-S475 PolarHBondContact O-N 3.46Å; G471-S475 PolarHBondContact O-OG 3.38Å
476	S	68.5	Low	81.1	Confident	104 Å²	104	60 Å²	60	73%	0.727	32%	0.321	S	S	*	.	S	Bend	trans	-74	-28.6	178.7	51.2	0	0	0	0	114.1	F474	F474-S476 PolarHBondContact O-N 3.44Å
477	N	65.8	Low	80.9	Confident	125 Å²	125	59.3 Å²	59.3	67%	0.668	32%	0.319	S	S	*	.	S	Bend	trans	-132.1	-4.9	-168.3	-71.4	-16.4	0	0	0	115.4
478	C	62.1	Low	80.7	Confident	77 Å²	77	55.8 Å²	55.8	52%	0.52	31%	0.313	S	S	.	.			trans	-155.4	89.4	-171.3	-167.9	0	0	0	0	110.6	F480	C478-F480 WeakPolarHBondContact SG-CD2 3.42Å; C478-F480 WeakPolarHBondContact SG-CE2 3.29Å
479	G	72.6	Confident	80.6	Confident	9 Å²	9	60.1 Å²	60.1	9%	0.093	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	68.8	-178.9	0	0	0	0	0	112	H514 F515 Q516	G479-H514 VanDerWaalsContact CA-O 3.25Å; G479-H514 WeakPolarHBondContact CA-O 3.43Å; G479-H514 PolarHBondContact N-O 2.97Å; G479-F515 CarbonylContact O-C 3.57Å; G479-F515 VanDerWaalsContact O-CA 3.3Å; G479-F515 WeakPolarHBondContact O-CA 3.45Å; G479-F515 VanDerWaalsContact O-CD2 3.31Å; G479-F515 WeakPolarHBondContact O-CD2 3.26Å; G479-Q516 PolarHBondContact O-N 2.89Å
480	F	80.8	Confident	80.5	Confident	125 Å²	125	61.5 Å²	61.5	55%	0.548	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	124.4	166.2	-70.7	-91	0	0	0	109.3	C478 Q516	C478-F480 WeakPolarHBondContact SG-CD2 3.42Å; C478-F480 WeakPolarHBondContact SG-CE2 3.29Å; F480-Q516 HydrophobicContact CD1-CB 4Å; F480-Q516 HydrophobicContact CE1-CB 4.23Å; F480-Q516 HydrophobicContact CE1-CG 4.32Å
481	F	83	Confident	80.5	Confident	24 Å²	24	62.2 Å²	62.2	11%	0.105	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	124.4	175.1	-157.1	-107.6	0	0	0	109.5	R467 I468 L483 F515 Q516 L517 I518	R467-F481 HydrophobicContact CB-CE2 3.92Å; R467-F481 HydrophobicContact CB-CZ 3.96Å; I468-F481 HydrophobicContact CB-CZ 4.44Å; I468-F481 HydrophobicContact CD1-CE1 4.21Å; I468-F481 HydrophobicContact CD1-CZ 4.3Å; I468-F481 HydrophobicContact CG1-CD1 4.48Å; I468-F481 HydrophobicContact CG1-CE1 3.66Å; I468-F481 HydrophobicContact CG1-CE2 3.95Å; I468-F481 HydrophobicContact CG1-CZ 3.38Å; F481-L483 HydrophobicContact CD1-CD1 4.27Å; F481-L483 HydrophobicContact CD1-CD2 4.32Å; F481-L483 HydrophobicContact CD1-CG 3.92Å; F481-L483 HydrophobicContact CE1-CD1 3.87Å; F481-L483 HydrophobicContact CE1-CD2 3.55Å; F481-L483 HydrophobicContact CE1-CG 3.59Å; F481-L483 HydrophobicContact CZ-CD2 4.13Å; F481-F515 HydrophobicContact CB-CE2 3.79Å; F481-F515 HydrophobicContact CB-CZ 3.7Å; F481-F515 HydrophobicContact CG-CZ 4.38Å; F481-Q516 PolarHBondContact N-O 2.83Å; F481-L517 HydrophobicContact CB-CD1 4.09Å; F481-L517 HydrophobicContact CD1-CD1 3.62Å; F481-L517 HydrophobicContact CG-CD1 4.34Å; F481-L517 CarbonylContact O-C 3.49Å; F481-L517 WeakPolarHBondContact O-CA 3.03Å; F481-I518 PolarHBondContact O-N 3.36Å
482	T	87	Confident	80.7	Confident	93 Å²	93	64.9 Å²	64.9	57%	0.571	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	124	-177.8	55.4	0	0	0	0	109.1	I518	T482-I518 CarbonylContact C-O 3.59Å; T482-I518 WeakPolarHBondContact CA-O 3.18Å; T482-I518 HydrophobicContact CG2-CB 4.09Å; T482-I518 HydrophobicContact CG2-CD1 4.17Å
483	L	88.6	Confident	81.1	Confident	7 Å²	7	65.6 Å²	65.6	4%	0.037	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	114.9	174.5	-70.3	178.5	0	0	0	109.3	I464 F481 P486 L502 L517 I518 L519 I520	I464-L483 HydrophobicContact CG1-CD2 4.17Å; I464-L483 HydrophobicContact CG2-CD1 4.47Å; I464-L483 HydrophobicContact CG2-CD2 4.21Å; F481-L483 HydrophobicContact CD1-CD1 4.27Å; F481-L483 HydrophobicContact CD1-CD2 4.32Å; F481-L483 HydrophobicContact CD1-CG 3.92Å; F481-L483 HydrophobicContact CE1-CD1 3.87Å; F481-L483 HydrophobicContact CE1-CD2 3.55Å; F481-L483 HydrophobicContact CE1-CG 3.59Å; F481-L483 HydrophobicContact CZ-CD2 4.13Å; L483-P486 HydrophobicContact CB-CB 4.22Å; L483-P486 HydrophobicContact CB-CG 4.16Å; L483-P486 HydrophobicContact CD1-CB 4.22Å; L483-P486 HydrophobicContact CD1-CG 4.43Å; L483-L502 HydrophobicContact CD1-CD1 3.69Å; L483-L502 HydrophobicContact CD1-CD2 3.83Å; L483-L502 HydrophobicContact CD1-CG 4.44Å; L483-L517 HydrophobicContact CD1-CD1 4.3Å; L483-L517 HydrophobicContact CG-CD1 4.42Å; L483-I518 PolarHBondContact N-O 3.33Å; L483-L519 HydrophobicContact CB-CD1 4.04Å; L483-I520 PolarHBondContact O-N 2.75Å
484	D	90.1	Very high	81.1	Confident	119 Å²	119	65.5 Å²	65.5	64%	0.636	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	116.2	172.4	-168.8	25.2	0	0	0	109.4	I520	D484-I520 WeakPolarHBondContact OD1-CB 3.36Å; D484-I520 VanDerWaalsContact OD1-CG2 3.32Å; D484-I520 WeakPolarHBondContact OD1-CG2 3.4Å
485	E	89.8	Confident	81.2	Confident	47 Å²	47	60.2 Å²	60.2	22%	0.22	35%	0.354	C	S	.	.	S	Bend	trans	48	58.5	-180	-63.1	-64.7	176.9	0	0	114.8	T487 T488 I520 T521 H522	E485-T487 PolarHBondContact O-N 3.26Å; E485-T487 VanDerWaalsContact O-N 3.09Å; E485-T488 WeakPolarHBondContact O-CB 3.42Å; E485-T488 PolarHBondContact O-N 2.92Å; E485-T488 PolarHBondContact O-OG1 2.84Å; E485-I520 WeakPolarHBondContact CA-O 3.09Å; E485-I520 PolarHBondContact N-O 3.34Å; E485-T521 VanDerWaalsContact CD-CA 3.49Å; E485-T521 VanDerWaalsContact OE1-C 3.31Å; E485-T521 WeakPolarHBondContact OE1-CA 3.45Å; E485-T521 VanDerWaalsContact OE2-CA 3.29Å; E485-T521 WeakPolarHBondContact OE2-CA 3.31Å; E485-T521 PolarHBondContact OE2-OG1 2.85Å; E485-H522 IonicContact OE1-CG 2.71Å; E485-H522 PolarHBondContact OE1-N 3.33Å; E485-H522 IonicContact OE1-ND1 3.76Å; E485-H522 PolarHBondContact OE1-ND1 2.76Å; E485-H522 IonicContact OE2-CE1 2.71Å; E485-H522 PolarHBondContact OE2-CE1 3.19Å; E485-H522 IonicContact OE2-CG 3.69Å; E485-H522 PolarHBondContact OE2-N 3.38Å; E485-H522 VanDerWaalsContact OE2-N 3.09Å; E485-H522 IonicContact OE2-ND1 3.05Å; E485-H522 PolarHBondContact OE2-ND1 2.77Å
486	P	85.7	Confident	81.9	Confident	5 Å²	5	62.5 Å²	62.5	3%	0.032	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-11.5	-172.5	29.8	-35.8	0	0	0	114.3	I464 L483 T488 L490 L498 L519 F526	I464-P486 HydrophobicContact CD1-CB 3.99Å; L483-P486 HydrophobicContact CB-CB 4.22Å; L483-P486 HydrophobicContact CB-CG 4.16Å; L483-P486 HydrophobicContact CD1-CB 4.22Å; L483-P486 HydrophobicContact CD1-CG 4.43Å; P486-T488 VanDerWaalsContact C-N 3.29Å; P486-L490 VanDerWaalsContact O-CD1 3.3Å; P486-L490 WeakPolarHBondContact O-CD1 3.19Å; P486-L498 HydrophobicContact CB-CD2 4.15Å; P486-L519 HydrophobicContact CG-CD1 3.42Å; P486-L519 VanDerWaalsContact CG-CD1 3.42Å; P486-F526 HydrophobicContact CG-CE1 4.04Å; P486-F526 HydrophobicContact CG-CZ 4.11Å
487	T	85.1	Confident	82.7	Confident	14 Å²	14	58.4 Å²	58.4	9%	0.086	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-4.9	177.5	55.4	0	0	0	0	113.6	E485 N489 L490 D523 F526	E485-T487 PolarHBondContact O-N 3.26Å; E485-T487 VanDerWaalsContact O-N 3.09Å; T487-N489 PolarHBondContact O-N 3.14Å; T487-N489 VanDerWaalsContact O-N 3.13Å; T487-L490 PolarHBondContact O-N 3.45Å; T487-D523 HydrophobicContact CG2-CB 4.18Å; T487-F526 HydrophobicContact CG2-CB 3.7Å; T487-F526 HydrophobicContact CG2-CD1 4.11Å; T487-F526 HydrophobicContact CG2-CD2 3.37Å; T487-F526 HydrophobicContact CG2-CE2 3.94Å; T487-F526 HydrophobicContact CG2-CG 3.46Å; T487-F526 VanDerWaalsContact CG2-CG 3.46Å
488	T	83.3	Confident	83.7	Confident	70 Å²	70	52.6 Å²	52.6	43%	0.429	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	117.5	-177.9	-52.5	0	0	0	0	111.1	E485 P486	E485-T488 WeakPolarHBondContact O-CB 3.42Å; E485-T488 PolarHBondContact O-N 2.92Å; E485-T488 PolarHBondContact O-OG1 2.84Å; P486-T488 VanDerWaalsContact C-N 3.29Å
489	N	80.8	Confident	84.9	Confident	106 Å²	106	48.9 Å²	48.9	57%	0.567	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	14.6	-174.9	-51.5	-59.4	0	0	0	116.5	A456 G457 T487	A456-N489 HydrophobicContact CB-CB 4.13Å; G457-N489 WeakPolarHBondContact CA-O 3.2Å; T487-N489 PolarHBondContact O-N 3.14Å; T487-N489 VanDerWaalsContact O-N 3.13Å
490	L	83.6	Confident	85.5	Confident	28 Å²	28	50.1 Å²	50.1	15%	0.147	28%	0.282	C	S	.	.			trans	-94.4	143.7	170.4	-62	179.8	0	0	0	110.7	L461 P486 T487 N494 L498	L461-L490 HydrophobicContact CB-CD2 4.3Å; L461-L490 HydrophobicContact CD1-CD2 4.3Å; P486-L490 VanDerWaalsContact O-CD1 3.3Å; P486-L490 WeakPolarHBondContact O-CD1 3.19Å; T487-L490 PolarHBondContact O-N 3.45Å; L490-N494 HydrophobicContact CD2-CB 4.45Å; L490-L498 HydrophobicContact CD1-CD2 3.54Å
491	D	85.4	Confident	85.5	Confident	83 Å²	83	44.5 Å²	44.5	44%	0.444	26%	0.258	S	S	.	.			trans	-77.4	166.2	167.8	60.1	14.5	0	0	0	110.6	T493 N494 S495	D491-T493 VanDerWaalsContact C-N 3.26Å; D491-T493 PolarHBondContact O-N 3.4Å; D491-T493 PolarHBondContact OD1-OG1 3.19Å; D491-T493 VanDerWaalsContact OD1-OG1 3.12Å; D491-T493 PolarHBondContact OD2-OG1 3.34Å; D491-N494 PolarHBondContact O-N 3.01Å; D491-N494 WeakPolarHBondContact OD1-CB 3.22Å; D491-N494 PolarHBondContact OD1-N 3.44Å; D491-N494 PolarHBondContact OD1-ND2 3.23Å; D491-N494 PolarHBondContact OD2-ND2 3.38Å; D491-S495 WeakPolarHBondContact O-CB 3.31Å; D491-S495 PolarHBondContact O-N 3.28Å; D491-S495 PolarHBondContact O-OG 3.47Å
492	A	86.1	Confident	85.6	Confident	77 Å²	77	43.4 Å²	43.4	64%	0.636	25%	0.253	S	S	*	.	H	α-helix	trans	-56.8	-40	-175.8	0	0	0	0	0	112.4	S495 E496	A492-S495 WeakPolarHBondContact CA-OG 3.46Å; A492-S495 PolarHBondContact O-N 3.19Å; A492-S495 PolarHBondContact O-OG 3.46Å; A492-E496 PolarHBondContact O-N 3.37Å
493	T	86.2	Confident	85.4	Confident	81 Å²	81	39 Å²	39	50%	0.497	23%	0.226	S	C	.	.	H	α-helix	trans	-66.5	-45.1	-179.9	39.5	0	0	0	0	113.5	D491 S495 S497	D491-T493 VanDerWaalsContact C-N 3.26Å; D491-T493 PolarHBondContact O-N 3.4Å; D491-T493 PolarHBondContact OD1-OG1 3.19Å; D491-T493 VanDerWaalsContact OD1-OG1 3.12Å; D491-T493 PolarHBondContact OD2-OG1 3.34Å; T493-S495 VanDerWaalsContact C-N 3.34Å; T493-S497 WeakPolarHBondContact O-CB 3.21Å; T493-S497 PolarHBondContact O-N 3.46Å; T493-S497 VanDerWaalsContact O-N 3.1Å; T493-S497 PolarHBondContact O-OG 3.26Å
494	N	82.1	Confident	85	Confident	18 Å²	18	42.3 Å²	42.3	10%	0.096	24%	0.244	C	C	.	.	H	α-helix	trans	-74.4	-29	176.6	-67.7	-53.8	0	0	0	111.1	K413 L461 L490 D491 S497 L498	K413-N494 PolarHBondContact N-OD1 3.31Å; L461-N494 HydrophobicContact CD1-CB 4.35Å; L490-N494 HydrophobicContact CD2-CB 4.45Å; D491-N494 PolarHBondContact O-N 3.01Å; D491-N494 WeakPolarHBondContact OD1-CB 3.22Å; D491-N494 PolarHBondContact OD1-N 3.44Å; D491-N494 PolarHBondContact OD1-ND2 3.23Å; D491-N494 PolarHBondContact OD2-ND2 3.38Å; N494-S497 PolarHBondContact O-N 2.93Å; N494-L498 VanDerWaalsContact O-CB 3.26Å; N494-L498 WeakPolarHBondContact O-CB 3.36Å; N494-L498 PolarHBondContact O-N 3.35Å
495	S	86.5	Confident	84.4	Confident	8 Å²	8	37.5 Å²	37.5	6%	0.056	22%	0.218	C	C	.	.	H	α-helix	trans	-64	-42.9	173.8	78.7	0	0	0	0	112	D491 A492 T493 L498 A499 F526	D491-S495 WeakPolarHBondContact O-CB 3.31Å; D491-S495 PolarHBondContact O-N 3.28Å; D491-S495 PolarHBondContact O-OG 3.47Å; A492-S495 WeakPolarHBondContact CA-OG 3.46Å; A492-S495 PolarHBondContact O-N 3.19Å; A492-S495 PolarHBondContact O-OG 3.46Å; T493-S495 VanDerWaalsContact C-N 3.34Å; S495-L498 PolarHBondContact O-N 3.48Å; S495-A499 PolarHBondContact O-N 3.37Å; S495-F526 VanDerWaalsContact O-CD2 3.31Å; S495-F526 WeakPolarHBondContact O-CD2 3.08Å; S495-F526 VanDerWaalsContact O-CE2 3.26Å; S495-F526 WeakPolarHBondContact O-CE2 2.98Å
496	E	88.1	Confident	83.8	Confident	93 Å²	93	36.1 Å²	36.1	44%	0.435	21%	0.212	S	C	.	.	H	α-helix	trans	-65.5	-44.3	175	-177	177.6	-172.5	0	0	111.1	A492 L498 A499 C500	A492-E496 PolarHBondContact O-N 3.37Å; E496-L498 VanDerWaalsContact C-N 3.3Å; E496-L498 PolarHBondContact O-N 2.87Å; E496-A499 WeakPolarHBondContact O-CB 3.31Å; E496-A499 PolarHBondContact O-N 3.3Å; E496-A499 VanDerWaalsContact O-N 3.16Å; E496-C500 PolarHBondContact O-N 2.97Å
497	S	85	Confident	83.5	Confident	17 Å²	17	39.2 Å²	39.2	12%	0.119	23%	0.231	C	C	.	.	H	α-helix	trans	-64.9	-35	178.2	-57.1	0	0	0	0	112.3	V411 K413 T493 N494 A501	V411-S497 WeakPolarHBondContact O-CB 3.23Å; K413-S497 WeakPolarHBondContact CE-OG 3.4Å; K413-S497 WeakPolarHBondContact CG-OG 3.26Å; T493-S497 WeakPolarHBondContact O-CB 3.21Å; T493-S497 PolarHBondContact O-N 3.46Å; T493-S497 VanDerWaalsContact O-N 3.1Å; T493-S497 PolarHBondContact O-OG 3.26Å; N494-S497 PolarHBondContact O-N 2.93Å; S497-A501 WeakPolarHBondContact O-CB 3.5Å; S497-A501 PolarHBondContact O-N 3.04Å
498	L	86.1	Confident	82.9	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.016	26%	0.257	C	S	.	.	H	α-helix	trans	-66.7	-41.9	172.2	179.5	64.4	0	0	0	112	V411 I464 P486 L490 N494 S495 E496 C500 A501 L502 F526	V411-L498 HydrophobicContact CG1-CB 4.11Å; V411-L498 HydrophobicContact CG1-CD1 4.06Å; I464-L498 HydrophobicContact CD1-CD2 4.26Å; I464-L498 HydrophobicContact CG2-CD1 4.33Å; P486-L498 HydrophobicContact CB-CD2 4.15Å; L490-L498 HydrophobicContact CD1-CD2 3.54Å; N494-L498 VanDerWaalsContact O-CB 3.26Å; N494-L498 WeakPolarHBondContact O-CB 3.36Å; N494-L498 PolarHBondContact O-N 3.35Å; S495-L498 PolarHBondContact O-N 3.48Å; E496-L498 VanDerWaalsContact C-N 3.3Å; E496-L498 PolarHBondContact O-N 2.87Å; L498-C500 VanDerWaalsContact C-N 3.33Å; L498-A501 PolarHBondContact O-N 3.35Å; L498-L502 HydrophobicContact CD1-CD1 4.31Å; L498-L502 HydrophobicContact CD1-CG 4.23Å; L498-L502 HydrophobicContact CG-CD1 4.16Å; L498-L502 HydrophobicContact CG-CG 4.49Å; L498-L502 WeakPolarHBondContact O-CB 3.17Å; L498-L502 WeakPolarHBondContact O-CG 3.36Å; L498-L502 PolarHBondContact O-N 2.81Å; L498-F526 HydrophobicContact CB-CE2 4.2Å; L498-F526 HydrophobicContact CD2-CE2 4.15Å; L498-F526 HydrophobicContact CD2-CZ 4.34Å; L498-F526 HydrophobicContact CG-CE2 4.11Å; L498-F526 HydrophobicContact CG-CZ 4.3Å
499	A	86.8	Confident	82.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61	-44.9	176	0	0	0	0	0	111.2	S495 E496 L502 A503 F526 N529 M530	S495-A499 PolarHBondContact O-N 3.37Å; E496-A499 WeakPolarHBondContact O-CB 3.31Å; E496-A499 PolarHBondContact O-N 3.3Å; E496-A499 VanDerWaalsContact O-N 3.16Å; A499-L502 PolarHBondContact O-N 3.42Å; A499-A503 WeakPolarHBondContact O-CB 3.2Å; A499-A503 PolarHBondContact O-N 3.37Å; A499-F526 HydrophobicContact CB-CD2 3.9Å; A499-F526 HydrophobicContact CB-CE2 3.67Å; A499-F526 HydrophobicContact CB-CZ 4.19Å; A499-N529 HydrophobicContact CB-CB 3.79Å; A499-M530 HydrophobicContact CB-CB 4.3Å
500	C	85.4	Confident	81.8	Confident	35 Å²	35	39.3 Å²	39.3	24%	0.236	24%	0.236	C	C	.	.	H	α-helix	trans	-59.9	-49.7	175.5	-172	0	0	0	0	111.5	E496 L498 L502 A503 D504	E496-C500 PolarHBondContact O-N 2.97Å; L498-C500 VanDerWaalsContact C-N 3.33Å; C500-L502 PolarHBondContact O-N 3.28Å; C500-A503 WeakPolarHBondContact O-CB 3.34Å; C500-A503 PolarHBondContact O-N 3.4Å; C500-A503 VanDerWaalsContact O-N 3.13Å; C500-D504 PolarHBondContact O-N 3.34Å
501	A	80.6	Confident	81.1	Confident	6 Å²	6	43.7 Å²	43.7	5%	0.05	26%	0.263	C	S	.	.	H	α-helix	trans	-64.8	-36.2	179.9	0	0	0	0	0	113.9	T410 V411 S497 L498 A503 D504 L505	T410-A501 HydrophobicContact CG2-CB 4.32Å; V411-A501 HydrophobicContact CB-CB 4.33Å; V411-A501 HydrophobicContact CG2-CB 3.21Å; S497-A501 WeakPolarHBondContact O-CB 3.5Å; S497-A501 PolarHBondContact O-N 3.04Å; L498-A501 PolarHBondContact O-N 3.35Å; A501-A503 VanDerWaalsContact C-N 3.34Å; A501-D504 PolarHBondContact O-N 2.93Å; A501-L505 VanDerWaalsContact O-CB 3.28Å; A501-L505 WeakPolarHBondContact O-CB 3.48Å; A501-L505 PolarHBondContact O-N 3.49Å
502	L	85	Confident	80.1	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-67.1	-36.6	173.9	-73.3	173.3	0	0	0	111.7	I468 L483 L498 A499 C500 L505 L506 L517 F526	I468-L502 HydrophobicContact CD1-CD2 4.08Å; L483-L502 HydrophobicContact CD1-CD1 3.69Å; L483-L502 HydrophobicContact CD1-CD2 3.83Å; L483-L502 HydrophobicContact CD1-CG 4.44Å; L498-L502 HydrophobicContact CD1-CD1 4.31Å; L498-L502 HydrophobicContact CD1-CG 4.23Å; L498-L502 HydrophobicContact CG-CD1 4.16Å; L498-L502 HydrophobicContact CG-CG 4.49Å; L498-L502 WeakPolarHBondContact O-CB 3.17Å; L498-L502 WeakPolarHBondContact O-CG 3.36Å; L498-L502 PolarHBondContact O-N 2.81Å; A499-L502 PolarHBondContact O-N 3.42Å; C500-L502 PolarHBondContact O-N 3.28Å; L502-L505 PolarHBondContact O-N 3.02Å; L502-L506 WeakPolarHBondContact O-CB 3.43Å; L502-L506 WeakPolarHBondContact O-CG 3.44Å; L502-L506 PolarHBondContact O-N 3.34Å; L502-L517 HydrophobicContact CB-CD2 4.5Å; L502-F526 HydrophobicContact CD1-CZ 3.9Å
503	A	84.1	Confident	78.9	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-68.6	-40.7	174.4	0	0	0	0	0	112.1	A499 C500 A501 L505 L506 T507 H533 W534	A499-A503 WeakPolarHBondContact O-CB 3.2Å; A499-A503 PolarHBondContact O-N 3.37Å; C500-A503 WeakPolarHBondContact O-CB 3.34Å; C500-A503 PolarHBondContact O-N 3.4Å; C500-A503 VanDerWaalsContact O-N 3.13Å; A501-A503 VanDerWaalsContact C-N 3.34Å; A503-L505 VanDerWaalsContact C-N 3.34Å; A503-L506 WeakPolarHBondContact O-CB 3.44Å; A503-L506 PolarHBondContact O-N 3.21Å; A503-T507 WeakPolarHBondContact O-CB 3.16Å; A503-T507 PolarHBondContact O-N 2.97Å; A503-T507 PolarHBondContact O-OG1 2.75Å; A503-H533 HydrophobicContact CB-CB 3.38Å; A503-W534 HydrophobicContact CB-CB 3.98Å
504	D	79.9	Confident	78.3	Confident	77 Å²	77	52.9 Å²	52.9	41%	0.412	28%	0.281	S	S	.	.	H	α-helix	trans	-61.9	-44	173.4	-74.7	-19.3	0	0	0	110.9	C500 A501 L506 T507 V508	C500-D504 PolarHBondContact O-N 3.34Å; A501-D504 PolarHBondContact O-N 2.93Å; D504-L506 PolarHBondContact O-N 2.91Å; D504-T507 WeakPolarHBondContact O-CB 3.37Å; D504-T507 PolarHBondContact O-N 3.23Å; D504-T507 VanDerWaalsContact O-N 3.11Å; D504-V508 WeakPolarHBondContact O-CG2 3.37Å; D504-V508 PolarHBondContact O-N 3.33Å
505	L	76.1	Confident	78	Confident	17 Å²	17	53.7 Å²	53.7	9%	0.089	28%	0.284	C	S	.	.	H	α-helix	trans	-60.6	-46.4	175.5	-176.2	153.8	0	0	0	111.9	I468 A501 L502 A503 T507 V508 R509 F515	I468-L505 HydrophobicContact CB-CD1 4.25Å; I468-L505 HydrophobicContact CD1-CD1 3.9Å; I468-L505 HydrophobicContact CG1-CD1 4.07Å; I468-L505 HydrophobicContact CG2-CD1 3.2Å; A501-L505 VanDerWaalsContact O-CB 3.28Å; A501-L505 WeakPolarHBondContact O-CB 3.48Å; A501-L505 PolarHBondContact O-N 3.49Å; L502-L505 PolarHBondContact O-N 3.02Å; A503-L505 VanDerWaalsContact C-N 3.34Å; L505-T507 PolarHBondContact O-N 2.93Å; L505-V508 PolarHBondContact O-N 2.91Å; L505-R509 HydrophobicContact CD2-CG 4.4Å; L505-R509 WeakPolarHBondContact O-CB 3.35Å; L505-R509 WeakPolarHBondContact O-CG 3.27Å; L505-R509 PolarHBondContact O-N 3.41Å; L505-F515 HydrophobicContact CD2-CD1 4.1Å; L505-F515 HydrophobicContact CD2-CE1 3.27Å; L505-F515 HydrophobicContact CD2-CE2 4.07Å; L505-F515 HydrophobicContact CD2-CZ 3.26Å
506	L	79.1	Confident	77.8	Confident	19 Å²	19	58.6 Å²	58.6	10%	0.099	31%	0.306	C	S	.	.	H	α-helix	trans	-58.5	-40	173.8	-80.7	170.4	0	0	0	111.3	L502 A503 D504 R509 S510 F515 L517 W534	L502-L506 WeakPolarHBondContact O-CB 3.43Å; L502-L506 WeakPolarHBondContact O-CG 3.44Å; L502-L506 PolarHBondContact O-N 3.34Å; A503-L506 WeakPolarHBondContact O-CB 3.44Å; A503-L506 PolarHBondContact O-N 3.21Å; D504-L506 PolarHBondContact O-N 2.91Å; L506-R509 PolarHBondContact O-N 3.3Å; L506-S510 WeakPolarHBondContact O-CA 3.26Å; L506-S510 WeakPolarHBondContact O-CB 3.4Å; L506-S510 PolarHBondContact O-N 2.82Å; L506-F515 HydrophobicContact CD2-CD1 3.87Å; L506-F515 HydrophobicContact CD2-CE1 3.7Å; L506-F515 HydrophobicContact CG-CE1 4.43Å; L506-L517 HydrophobicContact CD1-CD2 3.84Å; L506-L517 HydrophobicContact CD2-CB 3.82Å; L506-L517 HydrophobicContact CD2-CD2 4.43Å; L506-L517 HydrophobicContact CG-CB 4.47Å; L506-L517 HydrophobicContact CG-CD2 4.18Å; L506-W534 HydrophobicContact CB-CD2 4.09Å; L506-W534 HydrophobicContact CB-CE3 4.03Å; L506-W534 HydrophobicContact CB-CH2 4.46Å; L506-W534 HydrophobicContact CB-CZ2 4.5Å; L506-W534 HydrophobicContact CB-CZ3 4.24Å; L506-W534 HydrophobicContact CD1-CD2 4.26Å; L506-W534 HydrophobicContact CD1-CG 4.11Å
507	T	78.3	Confident	77.7	Confident	69 Å²	69	55.9 Å²	55.9	42%	0.423	29%	0.294	S	S	.	.	H	α-helix	trans	-63.7	-51.5	178.9	-57.9	0	0	0	0	111.3	A503 D504 L505 R509 S510 W534	A503-T507 WeakPolarHBondContact O-CB 3.16Å; A503-T507 PolarHBondContact O-N 2.97Å; A503-T507 PolarHBondContact O-OG1 2.75Å; D504-T507 WeakPolarHBondContact O-CB 3.37Å; D504-T507 PolarHBondContact O-N 3.23Å; D504-T507 VanDerWaalsContact O-N 3.11Å; L505-T507 PolarHBondContact O-N 2.93Å; T507-R509 VanDerWaalsContact C-N 3.3Å; T507-R509 PolarHBondContact O-N 3.23Å; T507-S510 PolarHBondContact O-N 2.81Å; T507-S510 PolarHBondContact O-OG 3.26Å; T507-W534 WeakPolarHBondContact OG1-CZ3 3.42Å
508	V	73.2	Confident	77.8	Confident	104 Å²	104	59.1 Å²	59.1	63%	0.63	31%	0.31	S	S	*	.	H	α-helix	trans	-59.1	-43.9	177.4	174	0	0	0	0	110.6	D504 L505	D504-V508 WeakPolarHBondContact O-CG2 3.37Å; D504-V508 PolarHBondContact O-N 3.33Å; L505-V508 PolarHBondContact O-N 2.91Å
509	R	71.2	Confident	78	Confident	21 Å²	21	61.1 Å²	61.1	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-86.6	-14.2	-174.7	-64.3	-155.7	142.8	-149.5	-23.5	115.2	E472 L505 L506 T507 V511 E512 F515	E472-R509 VanDerWaalsContact CA-NH2 3.34Å; E472-R509 VanDerWaalsContact CG-NH2 3.25Å; E472-R509 IonicContact OE1-NH2 3.14Å; L505-R509 HydrophobicContact CD2-CG 4.4Å; L505-R509 WeakPolarHBondContact O-CB 3.35Å; L505-R509 WeakPolarHBondContact O-CG 3.27Å; L505-R509 PolarHBondContact O-N 3.41Å; L506-R509 PolarHBondContact O-N 3.3Å; T507-R509 VanDerWaalsContact C-N 3.3Å; T507-R509 PolarHBondContact O-N 3.23Å; R509-V511 PolarHBondContact O-N 3.42Å; R509-V511 VanDerWaalsContact O-N 3.15Å; R509-E512 IonicContact NH2-OE2 2.86Å; R509-E512 CarbonylContact O-C 3.39Å; R509-E512 WeakPolarHBondContact O-CA 3.01Å; R509-E512 PolarHBondContact O-N 3.01Å; R509-F515 HydrophobicContact CB-CB 3.74Å; R509-F515 HydrophobicContact CB-CD1 3.93Å; R509-F515 HydrophobicContact CB-CG 3.82Å
510	S	69.4	Low	78.2	Confident	68 Å²	68	65.5 Å²	65.5	48%	0.476	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-26.3	174.6	66.7	0	0	0	0	112.5	L506 T507	L506-S510 WeakPolarHBondContact O-CA 3.26Å; L506-S510 WeakPolarHBondContact O-CB 3.4Å; L506-S510 PolarHBondContact O-N 2.82Å; T507-S510 PolarHBondContact O-N 2.81Å; T507-S510 PolarHBondContact O-OG 3.26Å
511	V	69.4	Low	78.4	Confident	120 Å²	120	65.5 Å²	65.5	73%	0.727	34%	0.341	S	S	*	.	S	Bend	trans	-69.7	-39.2	174.6	-174.1	0	0	0	0	111.1	R509 K513	R509-V511 PolarHBondContact O-N 3.42Å; R509-V511 VanDerWaalsContact O-N 3.15Å; V511-K513 PolarHBondContact O-N 3.3Å
512	E	64.1	Low	78.7	Confident	125 Å²	125	71.7 Å²	71.7	58%	0.584	37%	0.369	S	S	*	.	S	Bend	trans	-81	99.9	173.7	-62.2	-165.9	162.6	0	0	108.5	R509 H514 F515	R509-E512 IonicContact NH2-OE2 2.86Å; R509-E512 CarbonylContact O-C 3.39Å; R509-E512 WeakPolarHBondContact O-CA 3.01Å; R509-E512 PolarHBondContact O-N 3.01Å; E512-H514 PolarHBondContact O-N 2.89Å; E512-F515 PolarHBondContact O-N 3.2Å
513	K	60.8	Low	78.8	Confident	189 Å²	189	73.3 Å²	73.3	82%	0.822	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	7.7	-167.2	-66.6	-177.2	175.8	179.9	0	118.3	V511	V511-K513 PolarHBondContact O-N 3.3Å
514	H	72.9	Confident	78.9	Confident	119 Å²	119	78.4 Å²	78.4	55%	0.551	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.4	24.5	-172	-59.1	-57.3	0	0	0	114.4	G479 E512	G479-H514 VanDerWaalsContact CA-O 3.25Å; G479-H514 WeakPolarHBondContact CA-O 3.43Å; G479-H514 PolarHBondContact N-O 2.97Å; E512-H514 PolarHBondContact O-N 2.89Å
515	F	76.9	Confident	79.2	Confident	36 Å²	36	79.3 Å²	79.3	16%	0.158	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	129.1	171.6	-170.5	-102.4	0	0	0	112.7	G479 F481 L505 L506 R509 E512 L517	G479-F515 CarbonylContact O-C 3.57Å; G479-F515 VanDerWaalsContact O-CA 3.3Å; G479-F515 WeakPolarHBondContact O-CA 3.45Å; G479-F515 VanDerWaalsContact O-CD2 3.31Å; G479-F515 WeakPolarHBondContact O-CD2 3.26Å; F481-F515 HydrophobicContact CB-CE2 3.79Å; F481-F515 HydrophobicContact CB-CZ 3.7Å; F481-F515 HydrophobicContact CG-CZ 4.38Å; L505-F515 HydrophobicContact CD2-CD1 4.1Å; L505-F515 HydrophobicContact CD2-CE1 3.27Å; L505-F515 HydrophobicContact CD2-CE2 4.07Å; L505-F515 HydrophobicContact CD2-CZ 3.26Å; L506-F515 HydrophobicContact CD2-CD1 3.87Å; L506-F515 HydrophobicContact CD2-CE1 3.7Å; L506-F515 HydrophobicContact CG-CE1 4.43Å; R509-F515 HydrophobicContact CB-CB 3.74Å; R509-F515 HydrophobicContact CB-CD1 3.93Å; R509-F515 HydrophobicContact CB-CG 3.82Å; E512-F515 PolarHBondContact O-N 3.2Å; F515-L517 HydrophobicContact CE1-CB 4.16Å
516	Q	82.3	Confident	79.8	Confident	110 Å²	110	78.5 Å²	78.5	51%	0.514	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	125.2	176	-64	-172.2	16.2	0	0	109.7	G479 F480 F481	G479-Q516 PolarHBondContact O-N 2.89Å; F480-Q516 HydrophobicContact CD1-CB 4Å; F480-Q516 HydrophobicContact CE1-CB 4.23Å; F480-Q516 HydrophobicContact CE1-CG 4.32Å; F481-Q516 PolarHBondContact N-O 2.83Å
517	L	84.8	Confident	80.1	Confident	36 Å²	36	79.1 Å²	79.1	19%	0.188	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123.5	173.7	180	65.4	0	0	0	109.9	F481 L483 L502 L506 F515	F481-L517 HydrophobicContact CB-CD1 4.09Å; F481-L517 HydrophobicContact CD1-CD1 3.62Å; F481-L517 HydrophobicContact CG-CD1 4.34Å; F481-L517 CarbonylContact O-C 3.49Å; F481-L517 WeakPolarHBondContact O-CA 3.03Å; L483-L517 HydrophobicContact CD1-CD1 4.3Å; L483-L517 HydrophobicContact CG-CD1 4.42Å; L502-L517 HydrophobicContact CB-CD2 4.5Å; L506-L517 HydrophobicContact CD1-CD2 3.84Å; L506-L517 HydrophobicContact CD2-CB 3.82Å; L506-L517 HydrophobicContact CD2-CD2 4.43Å; L506-L517 HydrophobicContact CG-CB 4.47Å; L506-L517 HydrophobicContact CG-CD2 4.18Å; F515-L517 HydrophobicContact CE1-CB 4.16Å
518	I	88.5	Confident	80.5	Confident	85 Å²	85	78 Å²	78	44%	0.436	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	115.1	168.3	-59.7	172.9	0	0	0	107	F481 T482 L483	F481-I518 PolarHBondContact O-N 3.36Å; T482-I518 CarbonylContact C-O 3.59Å; T482-I518 WeakPolarHBondContact CA-O 3.18Å; T482-I518 HydrophobicContact CG2-CB 4.09Å; T482-I518 HydrophobicContact CG2-CD1 4.17Å; L483-I518 PolarHBondContact N-O 3.33Å
519	L	89	Confident	81.1	Confident	45 Å²	45	74.4 Å²	74.4	24%	0.236	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	125	178.6	176.6	72.3	0	0	0	109	L483 P486 T521 F526 M530	L483-L519 HydrophobicContact CB-CD1 4.04Å; P486-L519 HydrophobicContact CG-CD1 3.42Å; P486-L519 VanDerWaalsContact CG-CD1 3.42Å; L519-T521 HydrophobicContact CD2-CG2 4.25Å; L519-T521 HydrophobicContact CG-CG2 4.35Å; L519-F526 HydrophobicContact CD1-CE1 3.82Å; L519-F526 HydrophobicContact CD2-CD1 4.04Å; L519-F526 HydrophobicContact CD2-CE1 3.6Å; L519-F526 HydrophobicContact CG-CE1 4.32Å; L519-M530 HydrophobicContact CD2-CE 4.46Å
520	I	91.1	Very high	81.9	Confident	93 Å²	93	74.4 Å²	74.4	48%	0.477	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.5	170.7	-56.8	172.1	0	0	0	106.5	L483 D484 E485	L483-I520 PolarHBondContact O-N 2.75Å; D484-I520 WeakPolarHBondContact OD1-CB 3.36Å; D484-I520 VanDerWaalsContact OD1-CG2 3.32Å; D484-I520 WeakPolarHBondContact OD1-CG2 3.4Å; E485-I520 WeakPolarHBondContact CA-O 3.09Å; E485-I520 PolarHBondContact N-O 3.34Å
521	T	89.4	Confident	82.6	Confident	34 Å²	34	72.2 Å²	72.2	21%	0.209	36%	0.361	C	S	.	.			trans	-153	148.6	176.8	-170.7	0	0	0	0	113	E485 L519 D523 F526 V527	E485-T521 VanDerWaalsContact CD-CA 3.49Å; E485-T521 VanDerWaalsContact OE1-C 3.31Å; E485-T521 WeakPolarHBondContact OE1-CA 3.45Å; E485-T521 VanDerWaalsContact OE2-CA 3.29Å; E485-T521 WeakPolarHBondContact OE2-CA 3.31Å; E485-T521 PolarHBondContact OE2-OG1 2.85Å; L519-T521 HydrophobicContact CD2-CG2 4.25Å; L519-T521 HydrophobicContact CG-CG2 4.35Å; T521-D523 PolarHBondContact OG1-N 3.5Å; T521-F526 HydrophobicContact CG2-CD1 4.25Å; T521-V527 HydrophobicContact CG2-CG2 3.46Å; T521-V527 VanDerWaalsContact CG2-CG2 3.46Å
522	H	87.3	Confident	83.3	Confident	137 Å²	137	73.1 Å²	73.1	63%	0.634	36%	0.358	S	S	*	.			trans	-96.8	-5.1	166.8	71.7	-75.7	0	0	0	113.2	E485 N524	E485-H522 IonicContact OE1-CG 2.71Å; E485-H522 PolarHBondContact OE1-N 3.33Å; E485-H522 IonicContact OE1-ND1 3.76Å; E485-H522 PolarHBondContact OE1-ND1 2.76Å; E485-H522 IonicContact OE2-CE1 2.71Å; E485-H522 PolarHBondContact OE2-CE1 3.19Å; E485-H522 IonicContact OE2-CG 3.69Å; E485-H522 PolarHBondContact OE2-N 3.38Å; E485-H522 VanDerWaalsContact OE2-N 3.09Å; E485-H522 IonicContact OE2-ND1 3.05Å; E485-H522 PolarHBondContact OE2-ND1 2.77Å; H522-N524 PolarHBondContact O-N 3.36Å
523	D	87.6	Confident	84.2	Confident	36 Å²	36	70.8 Å²	70.8	19%	0.193	35%	0.346	C	S	.	.			trans	-84.5	99.1	-178.4	-173.2	-7.7	0	0	0	111.1	T487 T521 N525 F526 V527	T487-D523 HydrophobicContact CG2-CB 4.18Å; T521-D523 PolarHBondContact OG1-N 3.5Å; D523-N525 VanDerWaalsContact C-N 3.25Å; D523-N525 PolarHBondContact O-N 2.82Å; D523-N525 WeakPolarHBondContact OD1-CB 3.34Å; D523-N525 PolarHBondContact OD1-N 3.43Å; D523-F526 HydrophobicContact CB-CB 3.8Å; D523-F526 WeakPolarHBondContact O-CB 2.88Å; D523-F526 PolarHBondContact O-N 3.45Å; D523-F526 PolarHBondContact OD1-N 3.41Å; D523-V527 WeakPolarHBondContact O-CG2 3.2Å; D523-V527 PolarHBondContact O-N 3.35Å; D523-V527 VanDerWaalsContact O-N 3.08Å
524	N	85.3	Confident	85.3	Confident	106 Å²	106	64.9 Å²	64.9	57%	0.567	32%	0.319	S	S	*	.	H	α-helix	trans	-62	-31.6	177.4	-66.6	-41	0	0	0	112.9	H522 F526 V527 E528	H522-N524 PolarHBondContact O-N 3.36Å; N524-F526 VanDerWaalsContact C-N 3.35Å; N524-V527 PolarHBondContact O-N 2.73Å; N524-E528 WeakPolarHBondContact O-CG 3.4Å; N524-E528 PolarHBondContact O-N 3.42Å
525	N	86.4	Confident	85.6	Confident	96 Å²	96	64.5 Å²	64.5	51%	0.513	33%	0.327	S	S	.	.	H	α-helix	trans	-69.5	-39.5	178.4	-65.4	-29.2	0	0	0	110.1	D523 E528 N529	D523-N525 VanDerWaalsContact C-N 3.25Å; D523-N525 PolarHBondContact O-N 2.82Å; D523-N525 WeakPolarHBondContact OD1-CB 3.34Å; D523-N525 PolarHBondContact OD1-N 3.43Å; N525-E528 PolarHBondContact O-N 3.4Å; N525-N529 WeakPolarHBondContact O-CB 3.41Å; N525-N529 PolarHBondContact O-N 2.78Å; N525-N529 PolarHBondContact O-ND2 2.75Å
526	F	88.2	Confident	85.7	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-62.8	-41.8	174.2	-173.2	-100.6	0	0	0	112.3	P486 T487 S495 L498 A499 L502 L519 T521 D523 N524 N529 M530	P486-F526 HydrophobicContact CG-CE1 4.04Å; P486-F526 HydrophobicContact CG-CZ 4.11Å; T487-F526 HydrophobicContact CG2-CB 3.7Å; T487-F526 HydrophobicContact CG2-CD1 4.11Å; T487-F526 HydrophobicContact CG2-CD2 3.37Å; T487-F526 HydrophobicContact CG2-CE2 3.94Å; T487-F526 HydrophobicContact CG2-CG 3.46Å; T487-F526 VanDerWaalsContact CG2-CG 3.46Å; S495-F526 VanDerWaalsContact O-CD2 3.31Å; S495-F526 WeakPolarHBondContact O-CD2 3.08Å; S495-F526 VanDerWaalsContact O-CE2 3.26Å; S495-F526 WeakPolarHBondContact O-CE2 2.98Å; L498-F526 HydrophobicContact CB-CE2 4.2Å; L498-F526 HydrophobicContact CD2-CE2 4.15Å; L498-F526 HydrophobicContact CD2-CZ 4.34Å; L498-F526 HydrophobicContact CG-CE2 4.11Å; L498-F526 HydrophobicContact CG-CZ 4.3Å; A499-F526 HydrophobicContact CB-CD2 3.9Å; A499-F526 HydrophobicContact CB-CE2 3.67Å; A499-F526 HydrophobicContact CB-CZ 4.19Å; L502-F526 HydrophobicContact CD1-CZ 3.9Å; L519-F526 HydrophobicContact CD1-CE1 3.82Å; L519-F526 HydrophobicContact CD2-CD1 4.04Å; L519-F526 HydrophobicContact CD2-CE1 3.6Å; L519-F526 HydrophobicContact CG-CE1 4.32Å; T521-F526 HydrophobicContact CG2-CD1 4.25Å; D523-F526 HydrophobicContact CB-CB 3.8Å; D523-F526 WeakPolarHBondContact O-CB 2.88Å; D523-F526 PolarHBondContact O-N 3.45Å; D523-F526 PolarHBondContact OD1-N 3.41Å; N524-F526 VanDerWaalsContact C-N 3.35Å; F526-N529 PolarHBondContact O-N 3.43Å; F526-M530 WeakPolarHBondContact O-CB 3.16Å; F526-M530 PolarHBondContact O-N 2.87Å
527	V	86.9	Confident	85.7	Confident	32 Å²	32	67.5 Å²	67.5	19%	0.194	35%	0.348	C	S	.	.	H	α-helix	trans	-61.7	-45	174.6	176.1	0	0	0	0	111.1	T521 D523 N524 M530 L531 L560	T521-V527 HydrophobicContact CG2-CG2 3.46Å; T521-V527 VanDerWaalsContact CG2-CG2 3.46Å; D523-V527 WeakPolarHBondContact O-CG2 3.2Å; D523-V527 PolarHBondContact O-N 3.35Å; D523-V527 VanDerWaalsContact O-N 3.08Å; N524-V527 PolarHBondContact O-N 2.73Å; V527-M530 PolarHBondContact O-N 2.93Å; V527-L531 HydrophobicContact CG1-CD1 3.79Å; V527-L531 HydrophobicContact CG1-CG 4.31Å; V527-L531 WeakPolarHBondContact O-CB 3.24Å; V527-L531 VanDerWaalsContact O-CG 3.22Å; V527-L531 WeakPolarHBondContact O-CG 3.38Å; V527-L531 PolarHBondContact O-N 2.87Å; V527-L560 HydrophobicContact CG1-CD1 3.95Å
528	E	85.4	Confident	85.7	Confident	46 Å²	46	67.9 Å²	67.9	22%	0.215	35%	0.352	C	S	.	.	H	α-helix	trans	-60.4	-46.5	176.3	-76	177.2	-168	0	0	112	N524 N525 M530 L531 Q532 K564	N524-E528 WeakPolarHBondContact O-CG 3.4Å; N524-E528 PolarHBondContact O-N 3.42Å; N525-E528 PolarHBondContact O-N 3.4Å; E528-M530 VanDerWaalsContact C-N 3.34Å; E528-M530 PolarHBondContact O-N 3.47Å; E528-L531 PolarHBondContact O-N 2.81Å; E528-Q532 PolarHBondContact O-N 2.68Å; E528-K564 WeakPolarHBondContact OE1-CE 3.42Å; E528-K564 IonicContact OE1-NZ 2.76Å; E528-K564 PolarHBondContact OE1-NZ 2.85Å; E528-K564 IonicContact OE2-NZ 2.75Å; E528-K564 PolarHBondContact OE2-NZ 3.25Å
529	N	86.8	Confident	85.7	Confident	29 Å²	29	65.7 Å²	65.7	16%	0.155	34%	0.339	C	S	.	.	H	α-helix	trans	-61.2	-42.8	177	-69.5	-18.3	0	0	0	111.2	A499 N525 F526 Q532 H533	A499-N529 HydrophobicContact CB-CB 3.79Å; N525-N529 WeakPolarHBondContact O-CB 3.41Å; N525-N529 PolarHBondContact O-N 2.78Å; N525-N529 PolarHBondContact O-ND2 2.75Å; F526-N529 PolarHBondContact O-N 3.43Å; N529-Q532 WeakPolarHBondContact O-CB 3.43Å; N529-Q532 PolarHBondContact O-N 3.37Å; N529-H533 PolarHBondContact O-CD2 3.17Å; N529-H533 PolarHBondContact O-N 2.82Å
530	M	87.1	Confident	85.8	Confident	21 Å²	21	70.2 Å²	70.2	10%	0.103	35%	0.354	C	S	.	.	H	α-helix	trans	-64.9	-44	178.6	-158.1	-77.8	-106.7	0	0	111.3	A499 L519 F526 V527 E528 Q532 H533 W534	A499-M530 HydrophobicContact CB-CB 4.3Å; L519-M530 HydrophobicContact CD2-CE 4.46Å; F526-M530 WeakPolarHBondContact O-CB 3.16Å; F526-M530 PolarHBondContact O-N 2.87Å; V527-M530 PolarHBondContact O-N 2.93Å; E528-M530 VanDerWaalsContact C-N 3.34Å; E528-M530 PolarHBondContact O-N 3.47Å; M530-Q532 VanDerWaalsContact C-N 3.27Å; M530-Q532 PolarHBondContact O-N 3.1Å; M530-H533 PolarHBondContact O-N 2.83Å; M530-H533 VanDerWaalsContact O-N 3.09Å; M530-W534 PolarHBondContact O-N 3.22Å; M530-W534 HydrophobicContact SD-CB 3.81Å; M530-W534 HydrophobicContact SD-CG 4.42Å
531	L	84.5	Confident	85.6	Confident	22 Å²	22	68.1 Å²	68.1	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-64.7	-28.2	177.8	-72.7	170.7	0	0	0	113.8	V527 E528 H533 L536 V557 L560	V527-L531 HydrophobicContact CG1-CD1 3.79Å; V527-L531 HydrophobicContact CG1-CG 4.31Å; V527-L531 WeakPolarHBondContact O-CB 3.24Å; V527-L531 VanDerWaalsContact O-CG 3.22Å; V527-L531 WeakPolarHBondContact O-CG 3.38Å; V527-L531 PolarHBondContact O-N 2.87Å; E528-L531 PolarHBondContact O-N 2.81Å; L531-H533 VanDerWaalsContact C-N 3.28Å; L531-L536 HydrophobicContact CD2-CB 3.55Å; L531-V557 HydrophobicContact CD1-CG1 3.72Å; L531-V557 HydrophobicContact CD1-CG2 4.19Å; L531-V557 HydrophobicContact CD2-CG1 4.14Å; L531-V557 HydrophobicContact CD2-CG2 3.67Å; L531-V557 HydrophobicContact CG-CG1 4.45Å; L531-L560 HydrophobicContact CD1-CD1 3.39Å
532	Q	83.9	Confident	85.6	Confident	139 Å²	139	71 Å²	71	65%	0.65	36%	0.362	S	S	*	.	H	α-helix	trans	-65.6	-34.3	173.8	-177.8	176.3	-11.2	0	0	111.9	E528 N529 M530	E528-Q532 PolarHBondContact O-N 2.68Å; N529-Q532 WeakPolarHBondContact O-CB 3.43Å; N529-Q532 PolarHBondContact O-N 3.37Å; M530-Q532 VanDerWaalsContact C-N 3.27Å; M530-Q532 PolarHBondContact O-N 3.1Å
533	H	82.9	Confident	85.6	Confident	75 Å²	75	66.1 Å²	66.1	35%	0.347	34%	0.342	S	S	.	.	H	α-helix	trans	-96.9	-28.4	-177.2	-66.9	-70.4	0	0	0	113.4	A503 N529 M530 L531	A503-H533 HydrophobicContact CB-CB 3.38Å; N529-H533 PolarHBondContact O-CD2 3.17Å; N529-H533 PolarHBondContact O-N 2.82Å; M530-H533 PolarHBondContact O-N 2.83Å; M530-H533 VanDerWaalsContact O-N 3.09Å; L531-H533 VanDerWaalsContact C-N 3.28Å
534	W	83.4	Confident	85.6	Confident	65 Å²	65	72 Å²	72	25%	0.246	37%	0.367	C	S	.	.	S	Bend	trans	-132.9	110.2	179.8	-174.9	-94.9	0	0	0	111.3	A503 L506 T507 M530 L536	A503-W534 HydrophobicContact CB-CB 3.98Å; L506-W534 HydrophobicContact CB-CD2 4.09Å; L506-W534 HydrophobicContact CB-CE3 4.03Å; L506-W534 HydrophobicContact CB-CH2 4.46Å; L506-W534 HydrophobicContact CB-CZ2 4.5Å; L506-W534 HydrophobicContact CB-CZ3 4.24Å; L506-W534 HydrophobicContact CD1-CD2 4.26Å; L506-W534 HydrophobicContact CD1-CG 4.11Å; T507-W534 WeakPolarHBondContact OG1-CZ3 3.42Å; M530-W534 PolarHBondContact O-N 3.22Å; M530-W534 HydrophobicContact SD-CB 3.81Å; M530-W534 HydrophobicContact SD-CG 4.42Å; W534-L536 PolarHBondContact O-N 2.72Å
535	P	80	Confident	85.7	Confident	112 Å²	112	69.5 Å²	69.5	73%	0.727	35%	0.353	S	S	*	.			trans	-70.2	119.2	-178.8	28.2	-32.5	0	0	0	110.3
536	L	79.9	Confident	85.7	Confident	66 Å²	66	75.1 Å²	75.1	35%	0.346	37%	0.373	S	S	.	.			trans	-108.3	136.6	174.1	-161.1	84.6	0	0	0	108.9	L531 W534 V538 F539 V557	L531-L536 HydrophobicContact CD2-CB 3.55Å; W534-L536 PolarHBondContact O-N 2.72Å; L536-V538 WeakPolarHBondContact CD2-O 3.42Å; L536-V538 WeakPolarHBondContact CG-O 3.47Å; L536-F539 HydrophobicContact CD2-CB 3.92Å; L536-V557 HydrophobicContact CB-CG2 4.34Å; L536-V557 WeakPolarHBondContact O-CG2 3.27Å
537	D	81.6	Confident	85.6	Confident	143 Å²	143	81.7 Å²	81.7	77%	0.765	41%	0.408	S	S	*	.	S	Bend	trans	-77.6	-39	177	-65.8	-41.1	0	0	0	111.6
538	V	85.3	Confident	85.5	Confident	43 Å²	43	82.3 Å²	82.3	26%	0.261	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	134	-164.8	172	0	0	0	0	110.2	L536 E554 K555	L536-V538 WeakPolarHBondContact CD2-O 3.42Å; L536-V538 WeakPolarHBondContact CG-O 3.47Å; V538-E554 HydrophobicContact CB-CG 4.45Å; V538-E554 HydrophobicContact CG1-CB 4.49Å; V538-E554 HydrophobicContact CG1-CG 3.12Å; V538-E554 WeakPolarHBondContact CG1-OE1 3.27Å; V538-K555 WeakPolarHBondContact CA-O 3.28Å
539	F	87.5	Confident	85.6	Confident	39 Å²	39	83.7 Å²	83.7	17%	0.171	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	154	168	69.1	-81.8	0	0	0	110.8	L536 N541 K555 V557 L560	L536-F539 HydrophobicContact CD2-CB 3.92Å; F539-N541 HydrophobicContact CD2-CB 4.38Å; F539-N541 HydrophobicContact CE2-CB 3.99Å; F539-K555 HydrophobicContact CD1-CB 4.31Å; F539-K555 VanDerWaalsContact CD1-O 3.28Å; F539-K555 WeakPolarHBondContact CD1-O 3.5Å; F539-K555 HydrophobicContact CE1-CB 3.75Å; F539-K555 HydrophobicContact CE2-CB 4.04Å; F539-K555 HydrophobicContact CE2-CD 4.36Å; F539-K555 HydrophobicContact CZ-CB 3.61Å; F539-K555 HydrophobicContact CZ-CD 4.15Å; F539-K555 HydrophobicContact CZ-CG 4.5Å; F539-K555 PolarHBondContact N-O 2.65Å; F539-K555 PolarHBondContact O-N 3.48Å; F539-V557 HydrophobicContact CD1-CG2 4.13Å; F539-L560 HydrophobicContact CE1-CD1 4.16Å; F539-L560 HydrophobicContact CE1-CG 4.1Å; F539-L560 HydrophobicContact CZ-CD1 4.33Å; F539-L560 HydrophobicContact CZ-CD2 4.13Å; F539-L560 HydrophobicContact CZ-CG 3.98Å
540	Y	90.4	Very high	85.7	Confident	140 Å²	140	87.2 Å²	87.2	55%	0.549	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	110.5	176.9	-66.9	-76	0	0	0	110.1	L552 E554	Y540-L552 HydrophobicContact CD1-CD2 3.28Å; Y540-L552 HydrophobicContact CD1-CG 3.88Å; Y540-L552 HydrophobicContact CE1-CD2 3.82Å; Y540-L552 HydrophobicContact CG-CD2 3.87Å; Y540-L552 HydrophobicContact CG-CG 4.25Å; Y540-E554 HydrophobicContact CD1-CB 4.24Å; Y540-E554 HydrophobicContact CD1-CG 4.47Å; Y540-E554 HydrophobicContact CE1-CB 4.05Å; Y540-E554 HydrophobicContact CE1-CG 4.05Å
541	N	88.5	Confident	85.8	Confident	50 Å²	50	90.3 Å²	90.3	27%	0.267	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	116.3	174.7	177.1	55.8	0	0	0	110.1	F539 T553 K555	F539-N541 HydrophobicContact CD2-CB 4.38Å; F539-N541 HydrophobicContact CE2-CB 3.99Å; N541-T553 PolarHBondContact N-O 2.6Å; N541-T553 PolarHBondContact ND2-OG1 3.09Å; N541-T553 PolarHBondContact O-N 3.15Å; N541-T553 PolarHBondContact O-OG1 2.66Å; N541-K555 HydrophobicContact CB-CD 3.84Å; N541-K555 HydrophobicContact CB-CG 4.29Å; N541-K555 PolarHBondContact ND2-NZ 2.58Å
542	V	88.1	Confident	86.1	Confident	95 Å²	95	94.9 Å²	94.9	58%	0.576	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	116.2	174.4	-173.3	0	0	0	0	108.4	T550 L552	V542-T550 HydrophobicContact CG1-CG2 3.32Å; V542-L552 HydrophobicContact CG2-CD1 4.09Å
543	S	87.4	Confident	86.3	Confident	33 Å²	33	90.1 Å²	90.1	23%	0.231	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	164.4	177.5	57.4	0	0	0	0	110.6	T550 Q551	S543-T550 CarbonylContact O-C 3.52Å; S543-T550 WeakPolarHBondContact O-CA 3.25Å; S543-Q551 PolarHBondContact N-O 2.94Å; S543-Q551 WeakPolarHBondContact O-CG 3.46Å; S543-Q551 PolarHBondContact O-N 3.14Å; S543-Q551 WeakPolarHBondContact OG-CG 3.18Å; S543-Q551 PolarHBondContact OG-NE2 3.01Å
544	K	88.3	Confident	86.7	Confident	161 Å²	161	92.7 Å²	92.7	70%	0.7	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	135	171.9	-67	-177.3	179.8	-178.5	0	109.4	C549	K544-C549 WeakPolarHBondContact CA-O 3.38Å
545	D	86.2	Confident	86.7	Confident	53 Å²	53	91.5 Å²	91.5	28%	0.283	49%	0.485	S	S	.	.			trans	-74.5	-178	173.4	79.2	-5.3	0	0	0	111.5	N547 G548 C549	D545-N547 PolarHBondContact O-N 3.42Å; D545-N547 VanDerWaalsContact OD1-C 3.3Å; D545-N547 VanDerWaalsContact OD1-CA 3.3Å; D545-N547 WeakPolarHBondContact OD1-CA 3.37Å; D545-N547 WeakPolarHBondContact OD1-CB 2.93Å; D545-N547 PolarHBondContact OD1-N 2.84Å; D545-G548 PolarHBondContact O-N 3.45Å; D545-G548 VanDerWaalsContact O-N 3.11Å; D545-G548 PolarHBondContact OD1-N 2.84Å; D545-C549 PolarHBondContact N-O 2.72Å; D545-C549 PolarHBondContact OD1-N 3.17Å
546	K	86.5	Confident	86.9	Confident	214 Å²	214	93.3 Å²	93.3	93%	0.93	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-19.3	178.1	-65.1	-178	-179.4	177.9	0	113.7
547	N	86	Confident	86.7	Confident	137 Å²	137	91.3 Å²	91.3	73%	0.733	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-2.8	178.4	-58.7	-23.1	0	0	0	111.8	D545 C549	D545-N547 PolarHBondContact O-N 3.42Å; D545-N547 VanDerWaalsContact OD1-C 3.3Å; D545-N547 VanDerWaalsContact OD1-CA 3.3Å; D545-N547 WeakPolarHBondContact OD1-CA 3.37Å; D545-N547 WeakPolarHBondContact OD1-CB 2.93Å; D545-N547 PolarHBondContact OD1-N 2.84Å; N547-C549 VanDerWaalsContact C-N 3.3Å
548	G	86.2	Confident	86.2	Confident	46 Å²	46	85.6 Å²	85.6	47%	0.474	45%	0.449	S	S	.	.	S	Bend	trans	81.6	4.2	-175.3	0	0	0	0	0	114.1	D545	D545-G548 PolarHBondContact O-N 3.45Å; D545-G548 VanDerWaalsContact O-N 3.11Å; D545-G548 PolarHBondContact OD1-N 2.84Å
549	C	86.3	Confident	85.5	Confident	74 Å²	74	88.8 Å²	88.8	50%	0.5	46%	0.458	S	S	.	.			trans	-76.4	139	174.7	-65.6	0	0	0	0	110.4	K544 D545 N547 Q551	K544-C549 WeakPolarHBondContact CA-O 3.38Å; D545-C549 PolarHBondContact N-O 2.72Å; D545-C549 PolarHBondContact OD1-N 3.17Å; N547-C549 VanDerWaalsContact C-N 3.3Å; C549-Q551 PolarHBondContact O-N 2.76Å
550	T	89.7	Confident	84.6	Confident	104 Å²	104	88.2 Å²	88.2	64%	0.638	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	124	176.2	-53.5	0	0	0	0	110.1	V542 S543	V542-T550 HydrophobicContact CG1-CG2 3.32Å; S543-T550 CarbonylContact O-C 3.52Å; S543-T550 WeakPolarHBondContact O-CA 3.25Å
551	Q	90.2	Very high	83.5	Confident	86 Å²	86	87.8 Å²	87.8	40%	0.402	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	137.7	172.9	71.1	177.5	3	0	0	110.5	S543 C549 T553	S543-Q551 PolarHBondContact N-O 2.94Å; S543-Q551 WeakPolarHBondContact O-CG 3.46Å; S543-Q551 PolarHBondContact O-N 3.14Å; S543-Q551 WeakPolarHBondContact OG-CG 3.18Å; S543-Q551 PolarHBondContact OG-NE2 3.01Å; C549-Q551 PolarHBondContact O-N 2.76Å; Q551-T553 HydrophobicContact CG-CG2 4.38Å
552	L	89.9	Confident	82.1	Confident	117 Å²	117	88.3 Å²	88.3	61%	0.613	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.7	172.3	-161.8	97.3	0	0	0	108.2	Y540 V542	Y540-L552 HydrophobicContact CD1-CD2 3.28Å; Y540-L552 HydrophobicContact CD1-CG 3.88Å; Y540-L552 HydrophobicContact CE1-CD2 3.82Å; Y540-L552 HydrophobicContact CG-CD2 3.87Å; Y540-L552 HydrophobicContact CG-CG 4.25Å; V542-L552 HydrophobicContact CG2-CD1 4.09Å
553	T	89	Confident	80.4	Confident	40 Å²	40	86 Å²	86	25%	0.245	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	120	176.5	50.2	0	0	0	0	109.7	N541 Q551 K555	N541-T553 PolarHBondContact N-O 2.6Å; N541-T553 PolarHBondContact ND2-OG1 3.09Å; N541-T553 PolarHBondContact O-N 3.15Å; N541-T553 PolarHBondContact O-OG1 2.66Å; Q551-T553 HydrophobicContact CG-CG2 4.38Å; T553-K555 PolarHBondContact O-N 3.27Å
554	E	89.4	Confident	78.6	Confident	129 Å²	129	88.5 Å²	88.5	60%	0.603	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	122.6	170.7	-167.3	-177.9	155	0	0	109	V538 Y540	V538-E554 HydrophobicContact CB-CG 4.45Å; V538-E554 HydrophobicContact CG1-CB 4.49Å; V538-E554 HydrophobicContact CG1-CG 3.12Å; V538-E554 WeakPolarHBondContact CG1-OE1 3.27Å; Y540-E554 HydrophobicContact CD1-CB 4.24Å; Y540-E554 HydrophobicContact CD1-CG 4.47Å; Y540-E554 HydrophobicContact CE1-CB 4.05Å; Y540-E554 HydrophobicContact CE1-CG 4.05Å
555	K	85.2	Confident	76.6	Confident	40 Å²	40	82.4 Å²	82.4	17%	0.174	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139.7	179.6	-69.6	-171.2	177.5	179.1	0	110.4	V538 F539 N541 T553 Y559	V538-K555 WeakPolarHBondContact CA-O 3.28Å; F539-K555 HydrophobicContact CD1-CB 4.31Å; F539-K555 VanDerWaalsContact CD1-O 3.28Å; F539-K555 WeakPolarHBondContact CD1-O 3.5Å; F539-K555 HydrophobicContact CE1-CB 3.75Å; F539-K555 HydrophobicContact CE2-CB 4.04Å; F539-K555 HydrophobicContact CE2-CD 4.36Å; F539-K555 HydrophobicContact CZ-CB 3.61Å; F539-K555 HydrophobicContact CZ-CD 4.15Å; F539-K555 HydrophobicContact CZ-CG 4.5Å; F539-K555 PolarHBondContact N-O 2.65Å; F539-K555 PolarHBondContact O-N 3.48Å; N541-K555 HydrophobicContact CB-CD 3.84Å; N541-K555 HydrophobicContact CB-CG 4.29Å; N541-K555 PolarHBondContact ND2-NZ 2.58Å; T553-K555 PolarHBondContact O-N 3.27Å; K555-Y559 HydrophobicContact CD-CD1 3.73Å; K555-Y559 HydrophobicContact CD-CD2 4.39Å; K555-Y559 HydrophobicContact CD-CE1 3.89Å; K555-Y559 HydrophobicContact CD-CG 4.01Å; K555-Y559 VanDerWaalsContact NZ-CE1 3.26Å; K555-Y559 VanDerWaalsContact NZ-CZ 3.28Å; K555-Y559 PolarHBondContact NZ-OH 3.15Å
556	Q	83.8	Confident	74.7	Confident	150 Å²	150	88 Å²	88	70%	0.701	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	145.9	169.4	-69.5	-175.9	-9.2	0	0	110.2	G558 Y559	Q556-G558 PolarHBondContact O-N 2.75Å; Q556-G558 VanDerWaalsContact O-N 3.12Å; Q556-Y559 WeakPolarHBondContact O-CB 3.12Å; Q556-Y559 PolarHBondContact O-N 3.37Å
557	V	75.6	Confident	72.9	Confident	23 Å²	23	83.9 Å²	83.9	14%	0.139	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-31.1	-178.2	168.7	0	0	0	0	113.6	L531 L536 F539 Y559 L560 Y561	L531-V557 HydrophobicContact CD1-CG1 3.72Å; L531-V557 HydrophobicContact CD1-CG2 4.19Å; L531-V557 HydrophobicContact CD2-CG1 4.14Å; L531-V557 HydrophobicContact CD2-CG2 3.67Å; L531-V557 HydrophobicContact CG-CG1 4.45Å; L536-V557 HydrophobicContact CB-CG2 4.34Å; L536-V557 WeakPolarHBondContact O-CG2 3.27Å; F539-V557 HydrophobicContact CD1-CG2 4.13Å; V557-Y559 PolarHBondContact O-N 3Å; V557-L560 PolarHBondContact O-N 3.26Å; V557-Y561 HydrophobicContact CG1-CE2 4.1Å
558	G	71.2	Confident	70.8	Confident	24 Å²	24	82.7 Å²	82.7	25%	0.247	44%	0.437	C	S	.	.	H	α-helix	trans	-55	-21.7	174	0	0	0	0	0	114.7	Q556 L560 S562	Q556-G558 PolarHBondContact O-N 2.75Å; Q556-G558 VanDerWaalsContact O-N 3.12Å; G558-L560 VanDerWaalsContact C-N 3.35Å; G558-L560 PolarHBondContact O-N 2.81Å; G558-S562 PolarHBondContact O-N 2.62Å; G558-S562 PolarHBondContact O-OG 3.38Å
559	Y	69.7	Low	68.4	Low	110 Å²	110	84.2 Å²	84.2	43%	0.431	45%	0.453	S	S	.	.	H	α-helix	trans	-62.8	-36.8	174.5	-177.4	-91.6	0	0	0	113	K555 Q556 V557 Y561 S562 V563	K555-Y559 HydrophobicContact CD-CD1 3.73Å; K555-Y559 HydrophobicContact CD-CD2 4.39Å; K555-Y559 HydrophobicContact CD-CE1 3.89Å; K555-Y559 HydrophobicContact CD-CG 4.01Å; K555-Y559 VanDerWaalsContact NZ-CE1 3.26Å; K555-Y559 VanDerWaalsContact NZ-CZ 3.28Å; K555-Y559 PolarHBondContact NZ-OH 3.15Å; Q556-Y559 WeakPolarHBondContact O-CB 3.12Å; Q556-Y559 PolarHBondContact O-N 3.37Å; V557-Y559 PolarHBondContact O-N 3Å; Y559-Y561 PolarHBondContact O-N 2.55Å; Y559-S562 WeakPolarHBondContact O-CB 3.13Å; Y559-S562 PolarHBondContact O-N 3.19Å; Y559-V563 HydrophobicContact CD1-CG2 3.99Å; Y559-V563 HydrophobicContact CE1-CG2 3.44Å; Y559-V563 VanDerWaalsContact CE1-CG2 3.44Å; Y559-V563 HydrophobicContact CE2-CG2 4.16Å; Y559-V563 WeakPolarHBondContact O-CG2 3.23Å; Y559-V563 PolarHBondContact O-N 3.2Å; Y559-V563 VanDerWaalsContact O-N 3.15Å
560	L	68.1	Low	65.9	Low	27 Å²	27	89 Å²	89	14%	0.141	47%	0.465	C	S	.	.	H	α-helix	trans	-62.7	-42.6	-178.2	-69.8	167.7	0	0	0	111.6	V527 L531 F539 V557 G558 K564	V527-L560 HydrophobicContact CG1-CD1 3.95Å; L531-L560 HydrophobicContact CD1-CD1 3.39Å; F539-L560 HydrophobicContact CE1-CD1 4.16Å; F539-L560 HydrophobicContact CE1-CG 4.1Å; F539-L560 HydrophobicContact CZ-CD1 4.33Å; F539-L560 HydrophobicContact CZ-CD2 4.13Å; F539-L560 HydrophobicContact CZ-CG 3.98Å; V557-L560 PolarHBondContact O-N 3.26Å; G558-L560 VanDerWaalsContact C-N 3.35Å; G558-L560 PolarHBondContact O-N 2.81Å; L560-K564 PolarHBondContact O-N 2.88Å
561	Y	67.7	Low	63	Low	131 Å²	131	92.7 Å²	92.7	51%	0.514	47%	0.472	S	S	.	.	H	α-helix	trans	-70.7	-32.2	176.4	-58	-74.3	0	0	0	112.8	V557 Y559 S565	V557-Y561 HydrophobicContact CG1-CE2 4.1Å; Y559-Y561 PolarHBondContact O-N 2.55Å; Y561-S565 PolarHBondContact O-N 3.08Å; Y561-S565 VanDerWaalsContact O-N 3.08Å
562	S	58.7	Low	60	Low	60 Å²	60	96.4 Å²	96.4	42%	0.42	49%	0.494	S	S	.	.	H	α-helix	trans	-64.6	-44.6	178.6	-54.7	0	0	0	0	111.6	G558 Y559 S565 E566	G558-S562 PolarHBondContact O-N 2.62Å; G558-S562 PolarHBondContact O-OG 3.38Å; Y559-S562 WeakPolarHBondContact O-CB 3.13Å; Y559-S562 PolarHBondContact O-N 3.19Å; S562-S565 PolarHBondContact O-N 2.56Å; S562-S565 PolarHBondContact O-OG 3.06Å; S562-E566 PolarHBondContact O-N 2.92Å
563	V	54.2	Low	57.1	Low	48 Å²	48	99.5 Å²	99.5	29%	0.291	51%	0.505	S	S	.	.	H	α-helix	trans	-67.4	-39	-179.9	177.4	0	0	0	0	111.8	Y559 E566 I567	Y559-V563 HydrophobicContact CD1-CG2 3.99Å; Y559-V563 HydrophobicContact CE1-CG2 3.44Å; Y559-V563 VanDerWaalsContact CE1-CG2 3.44Å; Y559-V563 HydrophobicContact CE2-CG2 4.16Å; Y559-V563 WeakPolarHBondContact O-CG2 3.23Å; Y559-V563 PolarHBondContact O-N 3.2Å; Y559-V563 VanDerWaalsContact O-N 3.15Å; V563-E566 PolarHBondContact O-N 3.31Å; V563-I567 HydrophobicContact CG1-CD1 3.88Å; V563-I567 WeakPolarHBondContact O-CG1 3.47Å; V563-I567 PolarHBondContact O-N 3.38Å
564	K	48.9	Very low	54.2	Low	85 Å²	85	109.5 Å²	109.5	37%	0.37	55%	0.546	S	S	.	.	H	α-helix	trans	-66	-35.7	173.3	-103.2	178.9	177.5	168.6	0	112.3	E528 L560 E566 I567 D568	E528-K564 WeakPolarHBondContact OE1-CE 3.42Å; E528-K564 IonicContact OE1-NZ 2.76Å; E528-K564 PolarHBondContact OE1-NZ 2.85Å; E528-K564 IonicContact OE2-NZ 2.75Å; E528-K564 PolarHBondContact OE2-NZ 3.25Å; L560-K564 PolarHBondContact O-N 2.88Å; K564-E566 PolarHBondContact O-N 3.27Å; K564-I567 PolarHBondContact O-N 3.46Å; K564-D568 PolarHBondContact O-N 3.35Å
565	S	46.7	Very low	52.5	Low	33 Å²	33	108.6 Å²	108.6	23%	0.231	54%	0.543	C	S	.	.	H	α-helix	trans	-65.1	-22.4	176.1	77.5	0	0	0	0	114	Y561 S562	Y561-S565 PolarHBondContact O-N 3.08Å; Y561-S565 VanDerWaalsContact O-N 3.08Å; S562-S565 PolarHBondContact O-N 2.56Å; S562-S565 PolarHBondContact O-OG 3.06Å
566	E	46.6	Very low	50.7	Low	171 Å²	171	112.2 Å²	112.2	80%	0.799	56%	0.563	S	S	*	*	H	α-helix	trans	-82.5	-29.3	171.1	-74	-175.2	157.8	0	0	112.9	S562 V563 K564	S562-E566 PolarHBondContact O-N 2.92Å; V563-E566 PolarHBondContact O-N 3.31Å; K564-E566 PolarHBondContact O-N 3.27Å
567	I	47	Very low	48.9	Very low	127 Å²	127	110.1 Å²	110.1	65%	0.651	56%	0.555	S	S	*	*	H	α-helix	trans	-87.8	-49.9	-178.6	-63.5	169.4	0	0	0	111.5	V563 K564	V563-I567 HydrophobicContact CG1-CD1 3.88Å; V563-I567 WeakPolarHBondContact O-CG1 3.47Å; V563-I567 PolarHBondContact O-N 3.38Å; K564-I567 PolarHBondContact O-N 3.46Å
568	D	42.4	Very low	47.3	Very low	111 Å²	111	115.2 Å²	115.2	59%	0.594	58%	0.579	S	S	*	*	S	Bend	trans	-102.6	96	170.6	-73.3	-34.5	0	0	0	106.8	K564 K570	K564-D568 PolarHBondContact O-N 3.35Å; D568-K570 PolarHBondContact O-N 3.13Å
569	G	36.5	Very low	45.8	Very low	78 Å²	78	120.9 Å²	120.9	80%	0.804	60%	0.6	S	S	*	*			trans	-59.3	50.1	-168.8	0	0	0	0	0	118.5
570	K	33.8	Very low	44.2	Very low	175 Å²	175	121.6 Å²	121.6	76%	0.761	61%	0.611	S	S	*	*			trans	-122.8	103.5	171.2	-74.9	-176.1	177.4	177	0	108.3	D568 L572	D568-K570 PolarHBondContact O-N 3.13Å; K570-L572 PolarHBondContact O-N 2.93Å; K570-L572 VanDerWaalsContact O-N 3.07Å
571	K	28.4	Very low	42.5	Very low	182 Å²	182	128.4 Å²	128.4	79%	0.791	65%	0.645	S	S	*	*			trans	-63.1	104.7	165.4	-78.7	-177.8	175.1	-179.3	0	109
572	L	27	Very low	40.6	Very low	164 Å²	164	128.2 Å²	128.2	86%	0.859	66%	0.655	S	S	*	*			trans	-79.7	111.8	157.3	-80.8	155.9	0	0	0	106.8	K570	K570-L572 PolarHBondContact O-N 2.93Å; K570-L572 VanDerWaalsContact O-N 3.07Å
573	Q	28.2	Very low	39.1	Very low	181 Å²	181	133.8 Å²	133.8	85%	0.846	68%	0.675	S	S	*	*			trans	-80.7	135.8	165.8	-77.4	-174.6	-33.5	0	0	108.1
574	F	29.4	Very low	37.7	Very low	251 Å²	251	141.6 Å²	141.6	100%	1.101	71%	0.71	S	S	*	*			trans	-45.3	0	-177	-81.7	-90.9	0	0	0	115.3

Retrieved 574 of 574 residues in 159.4 ms (Link to these results)

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