A0AA82N832_SCHMA Loading...

DUF4806 domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N832, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 295 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.6	Low	68.8	Low	188 Å²	188	119.8 Å²	119.8	93%	0.926	62%	0.62	S	S	*	*				0	-28.6	0	-77.4	-171.9	76.2	0	0	114.4	R5	M1-R5 PolarHBondContact O-N 3.2Å
2	T	67.8	Low	68.9	Low	121 Å²	121	121.5 Å²	121.5	74%	0.742	62%	0.619	S	S	*	*	H	α-helix	trans	-63.7	-41.7	179.5	34.3	0	0	0	0	114	F4 R5 L6	T2-F4 PolarHBondContact O-N 3.1Å; T2-R5 PolarHBondContact O-N 3.32Å; T2-L6 PolarHBondContact O-N 3.18Å
3	C	63.4	Low	68.9	Low	99 Å²	99	116.6 Å²	116.6	67%	0.669	61%	0.609	S	S	*	*	H	α-helix	trans	-60.7	-41.9	177.4	-79.7	0	0	0	0	113.9	R5 L6 V7	C3-R5 PolarHBondContact O-N 3.23Å; C3-L6 PolarHBondContact O-N 3.11Å; C3-V7 WeakPolarHBondContact O-CG2 3.13Å; C3-V7 PolarHBondContact O-N 3.29Å
4	F	61.7	Low	68.8	Low	164 Å²	164	116.4 Å²	116.4	72%	0.719	60%	0.603	S	S	*	*	H	α-helix	trans	-66.9	-37.6	-179.1	-165.9	-93.4	0	0	0	112.2	T2 T8	T2-F4 PolarHBondContact O-N 3.1Å; F4-T8 WeakPolarHBondContact O-CB 3.49Å; F4-T8 PolarHBondContact O-N 3.35Å; F4-T8 PolarHBondContact O-OG1 3.39Å
5	R	68.9	Low	69.2	Low	172 Å²	172	115.6 Å²	115.6	65%	0.649	60%	0.599	S	S	*	*	H	α-helix	trans	-64.3	-41.3	173	-71.2	-174.5	176.4	-178.8	-0.4	111.3	M1 T2 C3 T8 L9	M1-R5 PolarHBondContact O-N 3.2Å; T2-R5 PolarHBondContact O-N 3.32Å; C3-R5 PolarHBondContact O-N 3.23Å; R5-T8 PolarHBondContact O-N 3.42Å; R5-L9 WeakPolarHBondContact O-CG 3.01Å; R5-L9 PolarHBondContact O-N 3Å
6	L	72.4	Confident	69.2	Low	108 Å²	108	114.8 Å²	114.8	57%	0.565	59%	0.592	S	S	*	*	H	α-helix	trans	-64.4	-46.1	178.2	-162.4	76	0	0	0	112.2	T2 C3 T8 L9 L10	T2-L6 PolarHBondContact O-N 3.18Å; C3-L6 PolarHBondContact O-N 3.11Å; L6-T8 VanDerWaalsContact C-N 3.33Å; L6-T8 PolarHBondContact O-N 3.08Å; L6-L9 PolarHBondContact O-N 3.36Å; L6-L10 HydrophobicContact CG-CD1 4.44Å; L6-L10 WeakPolarHBondContact O-CG 3.45Å; L6-L10 PolarHBondContact O-N 2.96Å
7	V	72.7	Confident	69.6	Low	80 Å²	80	113.8 Å²	113.8	49%	0.485	59%	0.587	S	S	.	*	H	α-helix	trans	-61.7	-41.8	177	172.7	0	0	0	0	111.3	C3 L9 L10 L11	C3-V7 WeakPolarHBondContact O-CG2 3.13Å; C3-V7 PolarHBondContact O-N 3.29Å; V7-L9 PolarHBondContact O-N 2.96Å; V7-L10 PolarHBondContact O-N 3.35Å; V7-L11 HydrophobicContact CG1-CD1 3.91Å; V7-L11 WeakPolarHBondContact O-CB 3.37Å; V7-L11 WeakPolarHBondContact O-CG 3.42Å; V7-L11 PolarHBondContact O-N 3.13Å
8	T	70.5	Confident	70	Confident	52 Å²	52	111.2 Å²	111.2	32%	0.319	58%	0.577	S	S	.	*	H	α-helix	trans	-64.3	-39.9	177.4	-53.8	0	0	0	0	111.9	F4 R5 L6 K12	F4-T8 WeakPolarHBondContact O-CB 3.49Å; F4-T8 PolarHBondContact O-N 3.35Å; F4-T8 PolarHBondContact O-OG1 3.39Å; R5-T8 PolarHBondContact O-N 3.42Å; L6-T8 VanDerWaalsContact C-N 3.33Å; L6-T8 PolarHBondContact O-N 3.08Å; T8-K12 WeakPolarHBondContact O-CG 3.44Å; T8-K12 PolarHBondContact O-N 3.28Å
9	L	77.7	Confident	70.2	Confident	115 Å²	115	110.3 Å²	110.3	60%	0.602	57%	0.57	S	S	*	*	H	α-helix	trans	-66.5	-42	175.9	-74	169.9	0	0	0	111.7	R5 L6 V7 K12 A13	R5-L9 WeakPolarHBondContact O-CG 3.01Å; R5-L9 PolarHBondContact O-N 3Å; L6-L9 PolarHBondContact O-N 3.36Å; V7-L9 PolarHBondContact O-N 2.96Å; L9-K12 PolarHBondContact O-N 2.95Å; L9-A13 WeakPolarHBondContact O-CB 3.44Å; L9-A13 PolarHBondContact O-N 3.5Å
10	L	75.9	Confident	70.4	Confident	105 Å²	105	111.6 Å²	111.6	55%	0.55	57%	0.571	S	S	.	*	H	α-helix	trans	-63.4	-42.5	175.8	-73.8	170.4	0	0	0	112.1	L6 V7 A13 Q14	L6-L10 HydrophobicContact CG-CD1 4.44Å; L6-L10 WeakPolarHBondContact O-CG 3.45Å; L6-L10 PolarHBondContact O-N 2.96Å; V7-L10 PolarHBondContact O-N 3.35Å; L10-A13 PolarHBondContact O-N 3.09Å; L10-Q14 WeakPolarHBondContact O-CB 3.44Å; L10-Q14 WeakPolarHBondContact O-CG 3.28Å; L10-Q14 PolarHBondContact O-N 3.07Å
11	L	71.4	Confident	70.8	Confident	114 Å²	114	109.3 Å²	109.3	60%	0.597	56%	0.563	S	S	*	*	H	α-helix	trans	-64.2	-43.1	175.9	-78.3	164.4	0	0	0	112.1	V7 A13 Q14 L15	V7-L11 HydrophobicContact CG1-CD1 3.91Å; V7-L11 WeakPolarHBondContact O-CB 3.37Å; V7-L11 WeakPolarHBondContact O-CG 3.42Å; V7-L11 PolarHBondContact O-N 3.13Å; L11-A13 VanDerWaalsContact C-N 3.35Å; L11-Q14 PolarHBondContact O-N 2.68Å; L11-L15 WeakPolarHBondContact O-CB 3.5Å; L11-L15 PolarHBondContact O-N 3.31Å
12	K	69.7	Low	71.7	Confident	140 Å²	140	104.7 Å²	104.7	61%	0.609	54%	0.54	S	S	*	.	H	α-helix	trans	-62.8	-41.6	174.8	-77.4	-178.2	178	-176.1	0	111.8	T8 L9 L15 Q16	T8-K12 WeakPolarHBondContact O-CG 3.44Å; T8-K12 PolarHBondContact O-N 3.28Å; L9-K12 PolarHBondContact O-N 2.95Å; K12-L15 PolarHBondContact O-N 3.49Å; K12-Q16 WeakPolarHBondContact O-CG 3.4Å; K12-Q16 PolarHBondContact O-N 3.28Å
13	A	69	Low	72	Confident	58 Å²	58	103 Å²	103	48%	0.479	53%	0.53	S	S	.	.	H	α-helix	trans	-64.8	-42.5	176.4	0	0	0	0	0	111.8	L9 L10 L11 Q16 L17	L9-A13 WeakPolarHBondContact O-CB 3.44Å; L9-A13 PolarHBondContact O-N 3.5Å; L10-A13 PolarHBondContact O-N 3.09Å; L11-A13 VanDerWaalsContact C-N 3.35Å; A13-Q16 PolarHBondContact O-N 3.01Å; A13-L17 WeakPolarHBondContact O-CB 3.44Å; A13-L17 PolarHBondContact O-N 3.42Å
14	Q	68.3	Low	72.6	Confident	114 Å²	114	104 Å²	104	53%	0.533	53%	0.526	S	S	.	.	H	α-helix	trans	-62.6	-43.7	174.4	-77.5	-66.4	-43.3	0	0	111.8	L10 L11 Q16 L17 T18	L10-Q14 WeakPolarHBondContact O-CB 3.44Å; L10-Q14 WeakPolarHBondContact O-CG 3.28Å; L10-Q14 PolarHBondContact O-N 3.07Å; L11-Q14 PolarHBondContact O-N 2.68Å; Q14-Q16 PolarHBondContact O-N 3.49Å; Q14-L17 WeakPolarHBondContact O-CB 3.3Å; Q14-L17 PolarHBondContact O-N 3.09Å; Q14-T18 WeakPolarHBondContact O-CG2 3.44Å; Q14-T18 PolarHBondContact O-N 3.44Å; Q14-T18 PolarHBondContact O-OG1 3.22Å
15	L	73.7	Confident	73.1	Confident	104 Å²	104	104.5 Å²	104.5	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-60.8	-46.9	177.5	-169.2	71.2	0	0	0	111.4	L11 K12 L17 T18 E19	L11-L15 WeakPolarHBondContact O-CB 3.5Å; L11-L15 PolarHBondContact O-N 3.31Å; K12-L15 PolarHBondContact O-N 3.49Å; L15-L17 VanDerWaalsContact C-N 3.31Å; L15-L17 PolarHBondContact O-N 3.03Å; L15-T18 VanDerWaalsContact CA-OG1 3.3Å; L15-T18 WeakPolarHBondContact CA-OG1 3.44Å; L15-T18 PolarHBondContact O-N 3.38Å; L15-T18 PolarHBondContact O-OG1 3.27Å; L15-E19 PolarHBondContact O-N 3.34Å
16	Q	70.3	Confident	73.3	Confident	102 Å²	102	103.1 Å²	103.1	48%	0.477	52%	0.522	S	S	.	.	H	α-helix	trans	-62	-37.4	175.1	-75.5	-73.9	-63.9	0	0	112.5	K12 A13 Q14 E19 K20	K12-Q16 WeakPolarHBondContact O-CG 3.4Å; K12-Q16 PolarHBondContact O-N 3.28Å; A13-Q16 PolarHBondContact O-N 3.01Å; Q14-Q16 PolarHBondContact O-N 3.49Å; Q16-E19 PolarHBondContact NE2-OE2 3.11Å; Q16-K20 WeakPolarHBondContact O-CB 3.41Å; Q16-K20 WeakPolarHBondContact O-CG 3.42Å; Q16-K20 PolarHBondContact O-N 3.1Å
17	L	75.6	Confident	73.5	Confident	99 Å²	99	102.2 Å²	102.2	52%	0.518	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-43.2	174.9	-154.2	79.9	0	0	0	110.8	A13 Q14 L15 K20 V21	A13-L17 WeakPolarHBondContact O-CB 3.44Å; A13-L17 PolarHBondContact O-N 3.42Å; Q14-L17 WeakPolarHBondContact O-CB 3.3Å; Q14-L17 PolarHBondContact O-N 3.09Å; L15-L17 VanDerWaalsContact C-N 3.31Å; L15-L17 PolarHBondContact O-N 3.03Å; L17-K20 PolarHBondContact O-N 3.29Å; L17-V21 WeakPolarHBondContact O-CB 3.23Å; L17-V21 VanDerWaalsContact O-CG2 3.22Å; L17-V21 WeakPolarHBondContact O-CG2 3.28Å; L17-V21 PolarHBondContact O-N 2.99Å
18	T	76.2	Confident	73.8	Confident	66 Å²	66	103.9 Å²	103.9	41%	0.405	52%	0.52	S	S	.	.	H	α-helix	trans	-64	-42.1	176.8	50.7	0	0	0	0	112.2	Q14 L15 V21 I22	Q14-T18 WeakPolarHBondContact O-CG2 3.44Å; Q14-T18 PolarHBondContact O-N 3.44Å; Q14-T18 PolarHBondContact O-OG1 3.22Å; L15-T18 VanDerWaalsContact CA-OG1 3.3Å; L15-T18 WeakPolarHBondContact CA-OG1 3.44Å; L15-T18 PolarHBondContact O-N 3.38Å; L15-T18 PolarHBondContact O-OG1 3.27Å; T18-V21 PolarHBondContact O-N 3.4Å; T18-I22 WeakPolarHBondContact O-CB 3.36Å; T18-I22 WeakPolarHBondContact O-CD1 3.47Å; T18-I22 WeakPolarHBondContact O-CG1 3.1Å; T18-I22 PolarHBondContact O-N 2.66Å
19	E	73.8	Confident	73.9	Confident	95 Å²	95	106.1 Å²	106.1	44%	0.444	53%	0.529	S	S	.	.	H	α-helix	trans	-60.9	-46.7	175	-75.7	178.3	170.5	0	0	111.2	L15 Q16 V21 I22 V23	L15-E19 PolarHBondContact O-N 3.34Å; Q16-E19 PolarHBondContact NE2-OE2 3.11Å; E19-V21 PolarHBondContact O-N 2.98Å; E19-I22 PolarHBondContact O-N 2.96Å; E19-V23 WeakPolarHBondContact O-CB 3.26Å; E19-V23 VanDerWaalsContact O-CG2 3.26Å; E19-V23 WeakPolarHBondContact O-CG2 3.49Å; E19-V23 PolarHBondContact O-N 3.28Å
20	K	74.4	Confident	73.6	Confident	135 Å²	135	106.8 Å²	106.8	59%	0.587	53%	0.525	S	S	*	.	H	α-helix	trans	-63.3	-40.3	176.8	-73.1	-178.5	-177.5	-176.5	0	112.7	Q16 L17 V23 M24	Q16-K20 WeakPolarHBondContact O-CB 3.41Å; Q16-K20 WeakPolarHBondContact O-CG 3.42Å; Q16-K20 PolarHBondContact O-N 3.1Å; L17-K20 PolarHBondContact O-N 3.29Å; K20-V23 PolarHBondContact O-N 3.45Å; K20-M24 WeakPolarHBondContact O-CB 3.28Å; K20-M24 PolarHBondContact O-N 2.86Å
21	V	78.2	Confident	73.3	Confident	65 Å²	65	108.9 Å²	108.9	39%	0.394	53%	0.526	S	S	.	.	H	α-helix	trans	-66.8	-41.9	176.6	170.4	0	0	0	0	110.9	L17 T18 E19 M24 R25	L17-V21 WeakPolarHBondContact O-CB 3.23Å; L17-V21 VanDerWaalsContact O-CG2 3.22Å; L17-V21 WeakPolarHBondContact O-CG2 3.28Å; L17-V21 PolarHBondContact O-N 2.99Å; T18-V21 PolarHBondContact O-N 3.4Å; E19-V21 PolarHBondContact O-N 2.98Å; V21-M24 PolarHBondContact O-N 2.62Å; V21-R25 HydrophobicContact CG1-CG 4.31Å; V21-R25 WeakPolarHBondContact O-CB 3.5Å; V21-R25 WeakPolarHBondContact O-CG 3.48Å; V21-R25 PolarHBondContact O-N 3.08Å
22	I	75.2	Confident	73.4	Confident	90 Å²	90	108.2 Å²	108.2	46%	0.462	52%	0.523	S	S	.	.	H	α-helix	trans	-61.2	-50.3	175.1	-70.7	164.2	0	0	0	109.4	T18 E19 M24 R25 F26	T18-I22 WeakPolarHBondContact O-CB 3.36Å; T18-I22 WeakPolarHBondContact O-CD1 3.47Å; T18-I22 WeakPolarHBondContact O-CG1 3.1Å; T18-I22 PolarHBondContact O-N 2.66Å; E19-I22 PolarHBondContact O-N 2.96Å; I22-M24 PolarHBondContact O-N 3Å; I22-R25 PolarHBondContact O-N 3.28Å; I22-R25 VanDerWaalsContact O-N 3.15Å; I22-F26 HydrophobicContact CG2-CD2 3.61Å; I22-F26 HydrophobicContact CG2-CE2 3.72Å; I22-F26 WeakPolarHBondContact O-CD2 3.46Å; I22-F26 PolarHBondContact O-N 2.92Å
23	V	73.7	Confident	73.3	Confident	85 Å²	85	107 Å²	107	52%	0.515	52%	0.522	S	S	.	.	H	α-helix	trans	-60.2	-43.5	178.3	172	0	0	0	0	111.4	E19 K20 R25 F26 L27	E19-V23 WeakPolarHBondContact O-CB 3.26Å; E19-V23 VanDerWaalsContact O-CG2 3.26Å; E19-V23 WeakPolarHBondContact O-CG2 3.49Å; E19-V23 PolarHBondContact O-N 3.28Å; K20-V23 PolarHBondContact O-N 3.45Å; V23-R25 PolarHBondContact O-N 3.05Å; V23-F26 PolarHBondContact O-N 3.41Å; V23-L27 HydrophobicContact CG1-CD1 3.82Å; V23-L27 WeakPolarHBondContact O-CB 3.44Å; V23-L27 PolarHBondContact O-N 3.31Å
24	M	74.8	Confident	73.3	Confident	120 Å²	120	108.7 Å²	108.7	59%	0.591	52%	0.521	S	S	*	.	H	α-helix	trans	-61.7	-42.9	173.8	-89.7	-160.7	-65	0	0	112.6	K20 V21 I22 F26 L27 Q28	K20-M24 WeakPolarHBondContact O-CB 3.28Å; K20-M24 PolarHBondContact O-N 2.86Å; V21-M24 PolarHBondContact O-N 2.62Å; I22-M24 PolarHBondContact O-N 3Å; M24-F26 VanDerWaalsContact C-N 3.34Å; M24-L27 PolarHBondContact O-N 2.71Å; M24-Q28 VanDerWaalsContact O-CB 3.31Å; M24-Q28 WeakPolarHBondContact O-CB 3.47Å; M24-Q28 PolarHBondContact O-N 3.15Å
25	R	73.5	Confident	73.2	Confident	176 Å²	176	106.8 Å²	106.8	66%	0.664	52%	0.524	S	S	*	.	H	α-helix	trans	-64.9	-39.2	177.1	-73.4	-77.8	-175	171.5	-0.1	111.2	V21 I22 V23 Q28 L29	V21-R25 HydrophobicContact CG1-CG 4.31Å; V21-R25 WeakPolarHBondContact O-CB 3.5Å; V21-R25 WeakPolarHBondContact O-CG 3.48Å; V21-R25 PolarHBondContact O-N 3.08Å; I22-R25 PolarHBondContact O-N 3.28Å; I22-R25 VanDerWaalsContact O-N 3.15Å; V23-R25 PolarHBondContact O-N 3.05Å; R25-Q28 PolarHBondContact O-N 3.23Å; R25-L29 VanDerWaalsContact O-CB 3.27Å; R25-L29 WeakPolarHBondContact O-CB 3.27Å; R25-L29 PolarHBondContact O-N 3.34Å
26	F	73	Confident	72.6	Confident	143 Å²	143	104.6 Å²	104.6	63%	0.627	52%	0.515	S	S	*	.	H	α-helix	trans	-64.5	-45	173.9	-93.7	-81.1	0	0	0	111.9	I22 V23 M24 L29 Y30	I22-F26 HydrophobicContact CG2-CD2 3.61Å; I22-F26 HydrophobicContact CG2-CE2 3.72Å; I22-F26 WeakPolarHBondContact O-CD2 3.46Å; I22-F26 PolarHBondContact O-N 2.92Å; V23-F26 PolarHBondContact O-N 3.41Å; M24-F26 VanDerWaalsContact C-N 3.34Å; F26-L29 PolarHBondContact O-N 3.15Å; F26-Y30 VanDerWaalsContact O-CB 3.28Å; F26-Y30 WeakPolarHBondContact O-CB 3.43Å; F26-Y30 PolarHBondContact O-N 3.04Å
27	L	75.6	Confident	71.8	Confident	89 Å²	89	104.5 Å²	104.5	47%	0.466	52%	0.523	S	S	.	.	H	α-helix	trans	-60.3	-46.6	173.6	-91.3	145.9	0	0	0	111.4	V23 M24 L29 Y30 Y31	V23-L27 HydrophobicContact CG1-CD1 3.82Å; V23-L27 WeakPolarHBondContact O-CB 3.44Å; V23-L27 PolarHBondContact O-N 3.31Å; M24-L27 PolarHBondContact O-N 2.71Å; L27-L29 PolarHBondContact O-N 3.44Å; L27-Y30 WeakPolarHBondContact O-CB 3.38Å; L27-Y30 PolarHBondContact O-N 3.33Å; L27-Y31 HydrophobicContact CD2-CE2 4.06Å; L27-Y31 WeakPolarHBondContact O-CD2 3.33Å; L27-Y31 PolarHBondContact O-N 3.29Å
28	Q	79.1	Confident	70.9	Confident	115 Å²	115	105.3 Å²	105.3	54%	0.537	53%	0.532	S	S	.	.	H	α-helix	trans	-64.5	-40.3	178.4	-170.3	168.3	-2.5	0	0	111.9	M24 R25 Y30 Y31 L32	M24-Q28 VanDerWaalsContact O-CB 3.31Å; M24-Q28 WeakPolarHBondContact O-CB 3.47Å; M24-Q28 PolarHBondContact O-N 3.15Å; R25-Q28 PolarHBondContact O-N 3.23Å; Q28-Y30 VanDerWaalsContact C-N 3.34Å; Q28-Y31 PolarHBondContact O-N 2.83Å; Q28-L32 HydrophobicContact CG-CD1 4.34Å; Q28-L32 WeakPolarHBondContact O-CB 3.34Å; Q28-L32 VanDerWaalsContact O-CG 3.29Å; Q28-L32 WeakPolarHBondContact O-CG 3.36Å; Q28-L32 PolarHBondContact O-N 3.17Å
29	L	71.8	Confident	69.9	Low	99 Å²	99	111.5 Å²	111.5	52%	0.518	55%	0.554	S	S	.	*	H	α-helix	trans	-65.3	-39.3	174.3	-165.7	74.1	0	0	0	111.3	R25 F26 L27 L32 L33	R25-L29 VanDerWaalsContact O-CB 3.27Å; R25-L29 WeakPolarHBondContact O-CB 3.27Å; R25-L29 PolarHBondContact O-N 3.34Å; F26-L29 PolarHBondContact O-N 3.15Å; L27-L29 PolarHBondContact O-N 3.44Å; L29-L32 PolarHBondContact O-N 3.49Å; L29-L33 HydrophobicContact CD1-CD1 4.49Å; L29-L33 HydrophobicContact CG-CD1 3.97Å; L29-L33 WeakPolarHBondContact O-CB 3.49Å; L29-L33 WeakPolarHBondContact O-CD1 3.33Å; L29-L33 PolarHBondContact O-N 3.49Å
30	Y	72.4	Confident	68.7	Low	128 Å²	128	108.7 Å²	108.7	50%	0.502	55%	0.55	S	S	.	*	H	α-helix	trans	-61.3	-47.5	174.2	176.7	-93.6	0	0	0	111.6	F26 L27 Q28 L33 Q34	F26-Y30 VanDerWaalsContact O-CB 3.28Å; F26-Y30 WeakPolarHBondContact O-CB 3.43Å; F26-Y30 PolarHBondContact O-N 3.04Å; L27-Y30 WeakPolarHBondContact O-CB 3.38Å; L27-Y30 PolarHBondContact O-N 3.33Å; Q28-Y30 VanDerWaalsContact C-N 3.34Å; Y30-L33 PolarHBondContact O-N 3.13Å; Y30-Q34 HydrophobicContact CE1-CG 4.28Å; Y30-Q34 VanDerWaalsContact CE1-NE2 3.33Å; Y30-Q34 WeakPolarHBondContact O-CG 3.45Å; Y30-Q34 PolarHBondContact O-N 3.13Å; Y30-Q34 PolarHBondContact OH-NE2 3.17Å
31	Y	70.6	Confident	67.6	Low	149 Å²	149	106.6 Å²	106.6	58%	0.584	54%	0.541	S	S	*	.	H	α-helix	trans	-63	-41.4	175.2	-84.1	-71.6	0	0	0	112.2	L27 Q28 Q34 A35	L27-Y31 HydrophobicContact CD2-CE2 4.06Å; L27-Y31 WeakPolarHBondContact O-CD2 3.33Å; L27-Y31 PolarHBondContact O-N 3.29Å; Q28-Y31 PolarHBondContact O-N 2.83Å; Y31-Q34 PolarHBondContact O-N 3.44Å; Y31-A35 WeakPolarHBondContact O-CB 3.41Å; Y31-A35 PolarHBondContact O-N 2.91Å
32	L	72.8	Confident	66.2	Low	100 Å²	100	113 Å²	113	52%	0.524	56%	0.558	S	S	.	*	H	α-helix	trans	-63.6	-41.2	174.9	-75.2	170.1	0	0	0	111.7	Q28 L29 Q34 A35 V36	Q28-L32 HydrophobicContact CG-CD1 4.34Å; Q28-L32 WeakPolarHBondContact O-CB 3.34Å; Q28-L32 VanDerWaalsContact O-CG 3.29Å; Q28-L32 WeakPolarHBondContact O-CG 3.36Å; Q28-L32 PolarHBondContact O-N 3.17Å; L29-L32 PolarHBondContact O-N 3.49Å; L32-Q34 VanDerWaalsContact C-N 3.3Å; L32-Q34 PolarHBondContact O-N 3.36Å; L32-A35 PolarHBondContact O-N 3.44Å; L32-V36 WeakPolarHBondContact O-CG2 3.4Å; L32-V36 PolarHBondContact O-N 2.89Å
33	L	67	Low	65.2	Low	114 Å²	114	116.2 Å²	116.2	60%	0.597	57%	0.569	S	S	*	*	H	α-helix	trans	-62.8	-36.8	175	-105.7	99.6	0	0	0	112.3	L29 Y30 A35	L29-L33 HydrophobicContact CD1-CD1 4.49Å; L29-L33 HydrophobicContact CG-CD1 3.97Å; L29-L33 WeakPolarHBondContact O-CB 3.49Å; L29-L33 WeakPolarHBondContact O-CD1 3.33Å; L29-L33 PolarHBondContact O-N 3.49Å; Y30-L33 PolarHBondContact O-N 3.13Å; L33-A35 VanDerWaalsContact C-N 3.35Å
34	Q	68.6	Low	64.1	Low	95 Å²	95	117.2 Å²	117.2	44%	0.444	57%	0.57	S	S	.	*	H	α-helix	trans	-70.9	-30.3	175.3	-72.1	-167	-21.9	0	0	113.1	Y30 Y31 L32 V36	Y30-Q34 HydrophobicContact CE1-CG 4.28Å; Y30-Q34 VanDerWaalsContact CE1-NE2 3.33Å; Y30-Q34 WeakPolarHBondContact O-CG 3.45Å; Y30-Q34 PolarHBondContact O-N 3.13Å; Y30-Q34 PolarHBondContact OH-NE2 3.17Å; Y31-Q34 PolarHBondContact O-N 3.44Å; L32-Q34 VanDerWaalsContact C-N 3.3Å; L32-Q34 PolarHBondContact O-N 3.36Å; Q34-V36 VanDerWaalsContact C-N 3.34Å
35	A	67.4	Low	62.7	Low	73 Å²	73	116.5 Å²	116.5	60%	0.603	57%	0.567	S	S	*	*	H	α-helix	trans	-76.4	-18.4	179.1	0	0	0	0	0	113.4	Y31 L32 L33 P37	Y31-A35 WeakPolarHBondContact O-CB 3.41Å; Y31-A35 PolarHBondContact O-N 2.91Å; L32-A35 PolarHBondContact O-N 3.44Å; L33-A35 VanDerWaalsContact C-N 3.35Å; A35-P37 VanDerWaalsContact O-CD 3.26Å; A35-P37 WeakPolarHBondContact O-CD 3.35Å
36	V	61.4	Low	61.9	Low	58 Å²	58	112.3 Å²	112.3	35%	0.352	56%	0.561	S	S	.	*	S	Bend	trans	-74.8	118.1	177	178.3	0	0	0	0	109.9	L32 Q34 T38 F41	L32-V36 WeakPolarHBondContact O-CG2 3.4Å; L32-V36 PolarHBondContact O-N 2.89Å; Q34-V36 VanDerWaalsContact C-N 3.34Å; V36-T38 PolarHBondContact O-N 3.18Å; V36-F41 HydrophobicContact CG1-CB 3.83Å; V36-F41 HydrophobicContact CG1-CD2 3.8Å; V36-F41 HydrophobicContact CG1-CG 4.14Å
37	P	51.7	Low	60.6	Low	100 Å²	100	114.1 Å²	114.1	65%	0.649	56%	0.563	S	S	*	*			trans	-60.2	117.4	175.6	-20	32.2	0	0	0	110	A35 K39 G40	A35-P37 VanDerWaalsContact O-CD 3.26Å; A35-P37 WeakPolarHBondContact O-CD 3.35Å; P37-K39 PolarHBondContact O-N 3.29Å; P37-G40 PolarHBondContact O-N 3.49Å
38	T	57.4	Low	59.4	Low	116 Å²	116	113.5 Å²	113.5	71%	0.712	56%	0.563	S	S	*	*	H	α-helix	trans	-53.7	-20.5	-174.3	46.9	0	0	0	0	114.6	V36	V36-T38 PolarHBondContact O-N 3.18Å
39	K	54.7	Low	58.1	Low	197 Å²	197	111.5 Å²	111.5	86%	0.857	56%	0.562	S	S	*	*	H	α-helix	trans	-74.6	-24.3	177.9	-65.2	-174.3	179.3	-179.9	0	113.9	P37	P37-K39 PolarHBondContact O-N 3.29Å
40	G	49.8	Very low	56.8	Low	36 Å²	36	114.4 Å²	114.4	37%	0.371	57%	0.57	S	S	.	*	H	α-helix	trans	-93.8	-35.7	-178	0	0	0	0	0	114.6	P37 W42 K43 I44	P37-G40 PolarHBondContact O-N 3.49Å; G40-W42 PolarHBondContact O-N 3.47Å; G40-K43 WeakPolarHBondContact O-CB 3.32Å; G40-K43 PolarHBondContact O-N 3.28Å; G40-K43 VanDerWaalsContact O-N 3.13Å; G40-I44 PolarHBondContact O-N 3.43Å
41	F	51.6	Low	55.4	Low	91 Å²	91	112 Å²	112	40%	0.399	57%	0.573	S	S	.	*	H	α-helix	trans	-65.8	-38.7	-171.7	-161.9	-107.8	0	0	0	113.3	V36 K43 I44 M45	V36-F41 HydrophobicContact CG1-CB 3.83Å; V36-F41 HydrophobicContact CG1-CD2 3.8Å; V36-F41 HydrophobicContact CG1-CG 4.14Å; F41-K43 VanDerWaalsContact C-N 3.28Å; F41-K43 PolarHBondContact O-N 3.02Å; F41-I44 PolarHBondContact O-N 2.82Å; F41-M45 HydrophobicContact CD1-CE 4Å; F41-M45 HydrophobicContact CE1-CE 3.42Å; F41-M45 VanDerWaalsContact CE1-CE 3.42Å; F41-M45 HydrophobicContact CZ-CE 4.33Å; F41-M45 PolarHBondContact O-N 2.84Å
42	W	48.5	Very low	53.9	Low	198 Å²	198	113.9 Å²	113.9	75%	0.75	58%	0.579	S	S	*	*	H	α-helix	trans	-62.9	-34.9	175	-91.8	64	0	0	0	112.3	G40 I44 M45 V46	G40-W42 PolarHBondContact O-N 3.47Å; W42-I44 VanDerWaalsContact C-N 3.31Å; W42-I44 PolarHBondContact O-N 3.07Å; W42-M45 PolarHBondContact O-N 3.22Å; W42-V46 VanDerWaalsContact O-CB 3.28Å; W42-V46 WeakPolarHBondContact O-CB 3.21Å; W42-V46 WeakPolarHBondContact O-CG2 3.49Å; W42-V46 PolarHBondContact O-N 2.97Å
43	K	53	Low	52.3	Low	158 Å²	158	112.4 Å²	112.4	69%	0.687	58%	0.576	S	S	*	*	H	α-helix	trans	-68	-33.7	178	-145.9	174.8	-172.6	177.3	0	111.6	G40 F41 R47	G40-K43 WeakPolarHBondContact O-CB 3.32Å; G40-K43 PolarHBondContact O-N 3.28Å; G40-K43 VanDerWaalsContact O-N 3.13Å; F41-K43 VanDerWaalsContact C-N 3.28Å; F41-K43 PolarHBondContact O-N 3.02Å; K43-R47 VanDerWaalsContact O-CB 3.31Å; K43-R47 WeakPolarHBondContact O-CB 3.38Å; K43-R47 PolarHBondContact O-N 3.47Å
44	I	51.6	Low	51	Low	106 Å²	106	110.2 Å²	110.2	54%	0.544	58%	0.575	S	S	.	*	H	α-helix	trans	-74.9	-47.1	175.4	-64	165.5	0	0	0	110.5	G40 F41 W42 V46 R47 V48	G40-I44 PolarHBondContact O-N 3.43Å; F41-I44 PolarHBondContact O-N 2.82Å; W42-I44 VanDerWaalsContact C-N 3.31Å; W42-I44 PolarHBondContact O-N 3.07Å; I44-V46 PolarHBondContact O-N 3.35Å; I44-R47 WeakPolarHBondContact O-CB 3.42Å; I44-R47 PolarHBondContact O-N 3.37Å; I44-R47 VanDerWaalsContact O-N 3.11Å; I44-V48 HydrophobicContact CG2-CG2 4.42Å; I44-V48 WeakPolarHBondContact O-CG2 3.35Å; I44-V48 PolarHBondContact O-N 3.43Å
45	M	46	Very low	49.4	Very low	106 Å²	106	113.2 Å²	113.2	52%	0.522	59%	0.593	S	S	.	*	H	α-helix	trans	-66.4	-39	-177.8	-154.8	-164.3	-73	0	0	112.1	F41 W42 R47 V48 S49	F41-M45 HydrophobicContact CD1-CE 4Å; F41-M45 HydrophobicContact CE1-CE 3.42Å; F41-M45 VanDerWaalsContact CE1-CE 3.42Å; F41-M45 HydrophobicContact CZ-CE 4.33Å; F41-M45 PolarHBondContact O-N 2.84Å; W42-M45 PolarHBondContact O-N 3.22Å; M45-R47 VanDerWaalsContact C-N 3.32Å; M45-R47 PolarHBondContact O-N 3.47Å; M45-V48 PolarHBondContact O-N 2.96Å; M45-S49 PolarHBondContact O-N 2.91Å
46	V	55.4	Low	47.9	Very low	87 Å²	87	118.2 Å²	118.2	53%	0.527	60%	0.601	S	S	.	*	H	α-helix	trans	-63.6	-37.8	172.2	172.1	0	0	0	0	111.1	W42 I44 S49 K50	W42-V46 VanDerWaalsContact O-CB 3.28Å; W42-V46 WeakPolarHBondContact O-CB 3.21Å; W42-V46 WeakPolarHBondContact O-CG2 3.49Å; W42-V46 PolarHBondContact O-N 2.97Å; I44-V46 PolarHBondContact O-N 3.35Å; V46-S49 PolarHBondContact O-N 3.07Å; V46-K50 WeakPolarHBondContact O-CB 3.36Å; V46-K50 PolarHBondContact O-N 3.34Å
47	R	45.5	Very low	46.5	Very low	181 Å²	181	126.1 Å²	126.1	68%	0.683	63%	0.625	S	S	*	*	H	α-helix	trans	-67.4	-38.2	175.4	-173.7	172.8	-104.6	141.6	-8.5	112.1	K43 I44 M45 K50 S51	K43-R47 VanDerWaalsContact O-CB 3.31Å; K43-R47 WeakPolarHBondContact O-CB 3.38Å; K43-R47 PolarHBondContact O-N 3.47Å; I44-R47 WeakPolarHBondContact O-CB 3.42Å; I44-R47 PolarHBondContact O-N 3.37Å; I44-R47 VanDerWaalsContact O-N 3.11Å; M45-R47 VanDerWaalsContact C-N 3.32Å; M45-R47 PolarHBondContact O-N 3.47Å; R47-K50 PolarHBondContact O-N 3.25Å; R47-S51 PolarHBondContact O-N 2.82Å
48	V	52.1	Low	45.6	Very low	76 Å²	76	130.7 Å²	130.7	46%	0.461	63%	0.634	S	S	.	*	H	α-helix	trans	-68	-42.1	175.3	174.5	0	0	0	0	111.7	I44 M45 S51 R52	I44-V48 HydrophobicContact CG2-CG2 4.42Å; I44-V48 WeakPolarHBondContact O-CG2 3.35Å; I44-V48 PolarHBondContact O-N 3.43Å; M45-V48 PolarHBondContact O-N 2.96Å; V48-S51 PolarHBondContact O-N 3.06Å; V48-R52 PolarHBondContact O-N 2.9Å
49	S	50.9	Low	44.4	Very low	74 Å²	74	134.2 Å²	134.2	52%	0.517	64%	0.643	S	S	.	*	H	α-helix	trans	-66.2	-36.5	175.1	-85.1	0	0	0	0	112.6	M45 V46 R52 S53	M45-S49 PolarHBondContact O-N 2.91Å; V46-S49 PolarHBondContact O-N 3.07Å; S49-R52 PolarHBondContact O-N 3.19Å; S49-S53 PolarHBondContact O-N 2.91Å; S49-S53 PolarHBondContact O-OG 2.93Å
50	K	44.2	Very low	43.1	Very low	159 Å²	159	129.3 Å²	129.3	69%	0.691	63%	0.633	S	S	*	*	H	α-helix	trans	-71.3	-34.8	176.5	-152.7	171.3	-172.9	176	0	112.2	V46 R47 S53 A54	V46-K50 WeakPolarHBondContact O-CB 3.36Å; V46-K50 PolarHBondContact O-N 3.34Å; R47-K50 PolarHBondContact O-N 3.25Å; K50-S53 WeakPolarHBondContact CA-OG 3.49Å; K50-S53 PolarHBondContact O-OG 3.44Å; K50-A54 WeakPolarHBondContact O-CB 3.22Å; K50-A54 PolarHBondContact O-N 3.11Å
51	S	44.3	Very low	42.1	Very low	79 Å²	79	136.4 Å²	136.4	55%	0.552	65%	0.654	S	S	*	*	H	α-helix	trans	-69.9	-36.6	170.7	-82.6	0	0	0	0	113	R47 V48 A54 L55	R47-S51 PolarHBondContact O-N 2.82Å; V48-S51 PolarHBondContact O-N 3.06Å; S51-A54 PolarHBondContact O-N 2.83Å; S51-L55 WeakPolarHBondContact O-CB 3.36Å; S51-L55 PolarHBondContact O-N 2.85Å
52	R	37.7	Very low	41	Very low	188 Å²	188	138.7 Å²	138.7	71%	0.709	67%	0.67	S	S	*	*	H	α-helix	trans	-67.6	-36.7	174.8	-85.3	-173.9	174.7	-169.5	-1.4	113	V48 S49 L55 K56	V48-R52 PolarHBondContact O-N 2.9Å; S49-R52 PolarHBondContact O-N 3.19Å; R52-L55 PolarHBondContact O-N 3.13Å; R52-K56 PolarHBondContact O-N 2.91Å
53	S	38.9	Very low	40	Very low	68 Å²	68	135.2 Å²	135.2	48%	0.476	68%	0.675	S	S	.	*	H	α-helix	trans	-76.1	-27.9	175.1	42.7	0	0	0	0	113	S49 K50 R57	S49-S53 PolarHBondContact O-N 2.91Å; S49-S53 PolarHBondContact O-OG 2.93Å; K50-S53 WeakPolarHBondContact CA-OG 3.49Å; K50-S53 PolarHBondContact O-OG 3.44Å; S53-R57 PolarHBondContact O-N 3.18Å
54	A	40	Very low	38.8	Very low	68 Å²	68	134.4 Å²	134.4	56%	0.562	68%	0.678	S	S	*	*	H	α-helix	trans	-69.5	-37.5	168.9	0	0	0	0	0	112.3	K50 S51 K56	K50-A54 WeakPolarHBondContact O-CB 3.22Å; K50-A54 PolarHBondContact O-N 3.11Å; S51-A54 PolarHBondContact O-N 2.83Å; A54-K56 VanDerWaalsContact C-N 3.32Å; A54-K56 PolarHBondContact O-N 3.47Å
55	L	35	Very low	38.1	Very low	158 Å²	158	134.6 Å²	134.6	83%	0.827	69%	0.689	S	S	*	*	H	α-helix	trans	-73.3	-23.3	178.1	-153.8	71.1	0	0	0	112.9	S51 R52	S51-L55 WeakPolarHBondContact O-CB 3.36Å; S51-L55 PolarHBondContact O-N 2.85Å; R52-L55 PolarHBondContact O-N 3.13Å
56	K	37	Very low	37.5	Very low	179 Å²	179	135.6 Å²	135.6	78%	0.778	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-0.2	178.5	-93.6	-171.6	171.2	-169.7	0	115.8	R52 A54 K58	R52-K56 PolarHBondContact O-N 2.91Å; A54-K56 VanDerWaalsContact C-N 3.32Å; A54-K56 PolarHBondContact O-N 3.47Å; K56-K58 PolarHBondContact O-N 3.22Å
57	R	31.9	Very low	36.3	Very low	223 Å²	223	138.3 Å²	138.3	84%	0.842	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	20	177.8	-158.2	179.8	-74.8	168.3	-5.6	113.9	S53	S53-R57 PolarHBondContact O-N 3.18Å
58	K	31.3	Very low	35.7	Very low	197 Å²	197	137.8 Å²	137.8	86%	0.857	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	9	178.1	-118.5	-177.7	-178.9	-176.7	0	116	K56	K56-K58 PolarHBondContact O-N 3.22Å
59	E	33.4	Very low	34.7	Very low	190 Å²	190	141.5 Å²	141.5	89%	0.888	74%	0.736	S	S	*	*			trans	-125.9	107.5	167.2	-106.1	166.9	172.1	0	0	110
60	S	27	Very low	34.1	Very low	94 Å²	94	144 Å²	144	66%	0.657	75%	0.748	S	S	*	*			trans	-96.1	139.6	-175.3	57.5	0	0	0	0	109.8
61	F	29.5	Very low	33.7	Very low	184 Å²	184	140.7 Å²	140.7	81%	0.807	75%	0.75	S	S	*	*			trans	92.7	115	154.2	-62	-69.5	0	0	0	120.1
62	L	27.5	Very low	33.3	Very low	139 Å²	139	144.3 Å²	144.3	73%	0.728	76%	0.758	S	S	*	*			trans	82.8	90.6	138.5	-62.8	164.6	0	0	0	118.2	N64	L62-N64 WeakPolarHBondContact CD2-OD1 3.32Å
63	C	28.4	Very low	32.9	Very low	126 Å²	126	143.3 Å²	143.3	85%	0.851	76%	0.764	S	S	*	*			trans	-128.2	106.4	139.6	-167.5	0	0	0	0	107.9	S65	C63-S65 PolarHBondContact O-N 3.39Å
64	N	28.3	Very low	32.6	Very low	141 Å²	141	147.4 Å²	147.4	75%	0.754	78%	0.776	S	S	*	*			trans	-75.3	101.9	176.5	-59.2	-23.2	0	0	0	107.5	L62	L62-N64 WeakPolarHBondContact CD2-OD1 3.32Å
65	S	36.8	Very low	32.3	Very low	110 Å²	110	149.9 Å²	149.9	77%	0.769	78%	0.784	S	S	*	*			trans	-103.9	109.1	162.3	179.9	0	0	0	0	107.1	C63	C63-S65 PolarHBondContact O-N 3.39Å
66	V	31.9	Very low	32.2	Very low	126 Å²	126	145.2 Å²	145.2	76%	0.764	77%	0.774	S	S	*	*			trans	-12.9	126.8	160.6	-178.5	0	0	0	0	113.7	M68	V66-M68 PolarHBondContact O-N 3.27Å
67	D	31.2	Very low	32.1	Very low	144 Å²	144	144.6 Å²	144.6	77%	0.77	78%	0.779	S	S	*	*			trans	-36.8	108.8	178.3	-55.4	-64.6	0	0	0	113.4
68	M	32.3	Very low	32.1	Very low	171 Å²	171	139.7 Å²	139.7	84%	0.842	77%	0.774	S	S	*	*			trans	-92.5	100.8	146.4	-82	-154.9	77.5	0	0	106.5	V66 V70	V66-M68 PolarHBondContact O-N 3.27Å; M68-V70 VanDerWaalsContact C-N 3.26Å; M68-V70 PolarHBondContact O-N 3.15Å
69	D	32.2	Very low	32.1	Very low	154 Å²	154	141 Å²	141	82%	0.824	77%	0.773	S	S	*	*			trans	-53	91.4	162.6	-78.4	-43.6	0	0	0	109.3	A71	D69-A71 VanDerWaalsContact C-N 3.31Å; D69-A71 PolarHBondContact O-N 2.74Å
70	V	38	Very low	32.2	Very low	127 Å²	127	136.9 Å²	136.9	77%	0.77	76%	0.761	S	S	*	*			trans	-85.7	87.5	164.8	-179.6	0	0	0	0	105.7	M68 E72	M68-V70 VanDerWaalsContact C-N 3.26Å; M68-V70 PolarHBondContact O-N 3.15Å; V70-E72 PolarHBondContact O-N 3.45Å; V70-E72 VanDerWaalsContact O-N 3.13Å
71	A	35.7	Very low	32.1	Very low	88 Å²	88	140.9 Å²	140.9	73%	0.727	77%	0.77	S	S	*	*			trans	-48.8	120.2	169.3	0	0	0	0	0	109.4	D69 M73	D69-A71 VanDerWaalsContact C-N 3.31Å; D69-A71 PolarHBondContact O-N 2.74Å; A71-M73 VanDerWaalsContact C-N 3.31Å; A71-M73 PolarHBondContact O-N 3.14Å
72	E	34.3	Very low	32.3	Very low	155 Å²	155	141.1 Å²	141.1	72%	0.724	77%	0.766	S	S	*	*			trans	-63.6	85.2	176.5	-178.6	173.7	-164.1	0	0	109.8	V70 Q74	V70-E72 PolarHBondContact O-N 3.45Å; V70-E72 VanDerWaalsContact O-N 3.13Å; E72-Q74 VanDerWaalsContact C-N 3.32Å; E72-Q74 HydrophobicContact CG-CG 3.84Å; E72-Q74 PolarHBondContact O-N 3.32Å; E72-Q74 PolarHBondContact OE1-NE2 3.05Å
73	M	30.8	Very low	32.8	Very low	168 Å²	168	139.9 Å²	139.9	83%	0.828	77%	0.767	S	S	*	*			trans	-89.3	79	165.4	-155.8	173.4	171.2	0	0	108.4	A71 T75	A71-M73 VanDerWaalsContact C-N 3.31Å; A71-M73 PolarHBondContact O-N 3.14Å; M73-T75 PolarHBondContact O-N 3.49Å
74	Q	32	Very low	33	Very low	154 Å²	154	142.7 Å²	142.7	72%	0.72	76%	0.759	S	S	*	*			trans	-66.2	80.2	162.1	-74.2	-174.3	8.9	0	0	109.5	E72	E72-Q74 VanDerWaalsContact C-N 3.32Å; E72-Q74 HydrophobicContact CG-CG 3.84Å; E72-Q74 PolarHBondContact O-N 3.32Å; E72-Q74 PolarHBondContact OE1-NE2 3.05Å
75	T	33	Very low	33.2	Very low	119 Å²	119	141.4 Å²	141.4	73%	0.73	75%	0.752	S	S	*	*			trans	-158	117.6	156.8	-23	0	0	0	0	111.5	M73	M73-T75 PolarHBondContact O-N 3.49Å
76	G	33.4	Very low	33.3	Very low	60 Å²	60	143.6 Å²	143.6	62%	0.619	74%	0.743	S	S	*	*			trans	90.4	89.5	157.9	0	0	0	0	0	116.2	T78	G76-T78 PolarHBondContact O-N 3.36Å
77	N	35.9	Very low	34	Very low	167 Å²	167	140.5 Å²	140.5	89%	0.893	72%	0.721	S	S	*	*			trans	-55.1	79.7	156.8	-180	34.2	0	0	0	110.5	R79	N77-R79 PolarHBondContact O-N 3.22Å
78	T	31.9	Very low	34.1	Very low	119 Å²	119	141.7 Å²	141.7	73%	0.73	72%	0.72	S	S	*	*			trans	-86.3	106.8	169	52	0	0	0	0	107.5	G76 V80	G76-T78 PolarHBondContact O-N 3.36Å; T78-V80 PolarHBondContact O-N 2.91Å
79	R	31.5	Very low	34.5	Very low	225 Å²	225	139.7 Å²	139.7	85%	0.849	71%	0.708	S	S	*	*			trans	-51.9	105.1	170.9	-173.7	-178	-170.9	-170.3	2.8	108	N77 Q81	N77-R79 PolarHBondContact O-N 3.22Å; R79-Q81 VanDerWaalsContact C-N 3.33Å; R79-Q81 PolarHBondContact O-N 3.42Å
80	V	34	Very low	35	Very low	104 Å²	104	141.7 Å²	141.7	63%	0.63	71%	0.71	S	S	*	*			trans	-58.3	98.3	175.3	178.6	0	0	0	0	107.8	T78 Y82	T78-V80 PolarHBondContact O-N 2.91Å; V80-Y82 HydrophobicContact CB-CE2 4.46Å; V80-Y82 HydrophobicContact CG1-CD2 4.28Å; V80-Y82 HydrophobicContact CG1-CE1 4.28Å; V80-Y82 HydrophobicContact CG1-CE2 3.88Å; V80-Y82 PolarHBondContact O-N 3.11Å
81	Q	25.3	Very low	35.2	Very low	178 Å²	178	141.4 Å²	141.4	83%	0.832	71%	0.708	S	S	*	*			trans	-84.1	93.7	179.2	-166.5	176.9	15.9	0	0	106.8	R79	R79-Q81 VanDerWaalsContact C-N 3.33Å; R79-Q81 PolarHBondContact O-N 3.42Å
82	Y	33.9	Very low	35.3	Very low	189 Å²	189	142.5 Å²	142.5	74%	0.741	71%	0.705	S	S	*	*			trans	-59.1	130.8	169.2	-67.2	-82.2	0	0	0	108.9	V80 R84	V80-Y82 HydrophobicContact CB-CE2 4.46Å; V80-Y82 HydrophobicContact CG1-CD2 4.28Å; V80-Y82 HydrophobicContact CG1-CE1 4.28Å; V80-Y82 HydrophobicContact CG1-CE2 3.88Å; V80-Y82 PolarHBondContact O-N 3.11Å; Y82-R84 PolarHBondContact O-N 3.49Å
83	P	37.3	Very low	35.4	Very low	113 Å²	113	139.8 Å²	139.8	73%	0.734	70%	0.704	S	S	*	*			trans	-58	105.3	175.4	-23.5	33.2	0	0	0	109.7	L85	P83-L85 PolarHBondContact O-N 2.84Å
84	R	33	Very low	35.7	Very low	185 Å²	185	137.5 Å²	137.5	70%	0.698	70%	0.701	S	S	*	*			trans	-74.2	96	174	-165.6	175.6	175.9	175.7	-1.8	106.7	Y82 R86	Y82-R84 PolarHBondContact O-N 3.49Å; R84-R86 PolarHBondContact O-N 3.06Å
85	L	33.5	Very low	35.9	Very low	113 Å²	113	138.9 Å²	138.9	59%	0.592	71%	0.711	S	S	*	*			trans	-64.1	93.9	179.8	-67.3	170.1	0	0	0	110.1	P83 M87	P83-L85 PolarHBondContact O-N 2.84Å; L85-M87 VanDerWaalsContact C-N 3.28Å; L85-M87 PolarHBondContact O-N 3.43Å
86	R	38.5	Very low	35.9	Very low	157 Å²	157	136.9 Å²	136.9	59%	0.592	71%	0.707	S	S	*	*			trans	-89.7	45.4	175.4	-58	-155.4	-145.8	-157.7	8.2	112.9	R84 E89	R84-R86 PolarHBondContact O-N 3.06Å; R86-E89 WeakPolarHBondContact CD-OE2 3.39Å; R86-E89 IonicContact NH1-OE2 3.48Å; R86-E89 PolarHBondContact NH1-OE2 2.96Å
87	M	46.3	Very low	36	Very low	61 Å²	61	141.6 Å²	141.6	30%	0.3	72%	0.718	S	S	.	*			trans	-72.1	-30.4	-176.1	-71.6	-89.7	-99.4	0	0	112.8	L85 F117 I120	L85-M87 VanDerWaalsContact C-N 3.28Å; L85-M87 PolarHBondContact O-N 3.43Å; M87-F117 HydrophobicContact CE-CD1 4.48Å; M87-F117 HydrophobicContact CE-CE1 4.09Å; M87-F117 HydrophobicContact CE-CZ 4.15Å; M87-I120 HydrophobicContact CE-CD1 3.85Å
88	F	33.4	Very low	35.7	Very low	168 Å²	168	138.7 Å²	138.7	74%	0.737	71%	0.711	S	S	*	*	H	α-helix	trans	-86.9	-8.1	-175.6	-68.8	-73.7	0	0	0	115.1	K90 V92	F88-K90 VanDerWaalsContact C-N 3.26Å; F88-K90 PolarHBondContact O-N 3.39Å; F88-V92 PolarHBondContact O-N 3.03Å
89	E	41.6	Very low	35.8	Very low	130 Å²	130	138.7 Å²	138.7	61%	0.607	71%	0.711	S	S	*	*	H	α-helix	trans	-72.6	-22.6	179.5	-150.7	166.3	-156.8	0	0	111.7	R86	R86-E89 WeakPolarHBondContact CD-OE2 3.39Å; R86-E89 IonicContact NH1-OE2 3.48Å; R86-E89 PolarHBondContact NH1-OE2 2.96Å
90	K	41.5	Very low	35.9	Very low	196 Å²	196	136.5 Å²	136.5	85%	0.852	71%	0.711	S	S	*	*	H	α-helix	trans	-101.6	-19.5	178.4	-70.9	-171.8	176.9	-171.8	0	115.3	F88	F88-K90 VanDerWaalsContact C-N 3.26Å; F88-K90 PolarHBondContact O-N 3.39Å
91	V	42.8	Very low	35.9	Very low	120 Å²	120	139.4 Å²	139.4	73%	0.727	72%	0.721	S	S	*	*	H	α-helix	trans	-95.1	-16	-177.5	-165.1	0	0	0	0	112
92	V	37.3	Very low	36.2	Very low	112 Å²	112	138 Å²	138	68%	0.679	72%	0.72	S	S	*	*	S	Bend	trans	-108.9	76.3	174.4	-172.1	0	0	0	0	109.7	F88	F88-V92 PolarHBondContact O-N 3.03Å
93	S	35.7	Very low	36.7	Very low	98 Å²	98	134.5 Å²	134.5	69%	0.685	72%	0.723	S	S	*	*	S	Bend	trans	-149.1	149	157.9	-81	0	0	0	0	109.8
94	P	37.4	Very low	36.7	Very low	120 Å²	120	133.9 Å²	133.9	78%	0.779	72%	0.721	S	S	*	*			trans	-87.2	152.2	-138.2	-11.6	29.3	0	0	0	115	A96	P94-A96 PolarHBondContact O-N 3.38Å
95	I	36.5	Very low	37.2	Very low	182 Å²	182	130.4 Å²	130.4	93%	0.933	72%	0.723	S	S	*	*			trans	-55.5	100.3	168.6	-61.3	163.1	0	0	0	109
96	A	33.7	Very low	37.6	Very low	78 Å²	78	128.6 Å²	128.6	65%	0.645	72%	0.719	S	S	*	*			trans	-150.2	99.1	165.6	0	0	0	0	0	109.6	P94	P94-A96 PolarHBondContact O-N 3.38Å
97	N	34.5	Very low	38.3	Very low	159 Å²	159	125.5 Å²	125.5	85%	0.85	72%	0.718	S	S	*	*			trans	53.5	119.2	146.4	-54.2	-16.6	0	0	0	119.9
98	S	30.2	Very low	38.8	Very low	105 Å²	105	127.3 Å²	127.3	73%	0.734	74%	0.737	S	S	*	*				135.4	110.3	118.8	-159.1	0	0	0	0	114.1
99	T	34.1	Very low	40	Very low	120 Å²	120	126.7 Å²	126.7	74%	0.736	74%	0.736	S	S	*	*				59.6	125.8	123.2	-38.6	0	0	0	0	121.1
100	Q	34.4	Very low	41.1	Very low	179 Å²	179	125.2 Å²	125.2	84%	0.836	73%	0.732	S	S	*	*			trans	83.2	98.6	159.9	-84.5	-174.9	20.1	0	0	119.1	D102	Q100-D102 PolarHBondContact O-N 3.48Å
101	L	32.6	Very low	42.6	Very low	164 Å²	164	122.8 Å²	122.8	86%	0.859	72%	0.722	S	S	*	*			trans	-62	100.6	161.5	-73	150.5	0	0	0	110.7
102	D	32.5	Very low	44.4	Very low	149 Å²	149	122 Å²	122	80%	0.797	71%	0.714	S	S	*	*			trans	-101.9	109.5	150.7	-90	-32.2	0	0	0	108.4	Q100 S104	Q100-D102 PolarHBondContact O-N 3.48Å; D102-S104 PolarHBondContact O-N 3.21Å
103	S	43.4	Very low	46.7	Very low	116 Å²	116	120.6 Å²	120.6	81%	0.811	70%	0.702	S	S	*	*			trans	-75.3	88.5	178.3	-61.8	0	0	0	0	109.2
104	S	38.3	Very low	49	Very low	99 Å²	99	119.8 Å²	119.8	69%	0.692	69%	0.693	S	S	*	*			trans	-109.7	127.9	164.4	-72.2	0	0	0	0	109.4	D102 S106	D102-S104 PolarHBondContact O-N 3.21Å; S104-S106 PolarHBondContact O-N 3.29Å; S104-S106 VanDerWaalsContact O-N 3.09Å
105	P	42.9	Very low	51.3	Low	113 Å²	113	116.1 Å²	116.1	73%	0.734	67%	0.673	S	S	*	*			trans	-80.8	96.4	-172	12.4	0.6	0	0	0	111.1	T107	P105-T107 PolarHBondContact O-N 3.3Å; P105-T107 PolarHBondContact O-OG1 2.79Å
106	S	41.3	Very low	53.7	Low	74 Å²	74	110.8 Å²	110.8	52%	0.517	64%	0.644	S	S	.	*			trans	-72.2	75.2	167.7	53.2	0	0	0	0	110.7	S104 S108	S104-S106 PolarHBondContact O-N 3.29Å; S104-S106 VanDerWaalsContact O-N 3.09Å; S106-S108 PolarHBondContact O-N 2.95Å; S106-S108 VanDerWaalsContact O-N 3.12Å
107	T	53	Low	56.4	Low	93 Å²	93	112.7 Å²	112.7	57%	0.571	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	0.9	-170.5	14	0	0	0	0	115.4	P105 K111	P105-T107 PolarHBondContact O-N 3.3Å; P105-T107 PolarHBondContact O-OG1 2.79Å; T107-K111 VanDerWaalsContact O-CD 3.29Å; T107-K111 WeakPolarHBondContact O-CD 3.44Å; T107-K111 VanDerWaalsContact O-CE 3.23Å; T107-K111 WeakPolarHBondContact O-CE 3.34Å; T107-K111 WeakPolarHBondContact O-CG 3.5Å
108	S	57.4	Low	59	Low	98 Å²	98	110.5 Å²	110.5	69%	0.685	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-44.7	-173.4	-176.5	0	0	0	0	113.8	S106	S106-S108 PolarHBondContact O-N 2.95Å; S106-S108 VanDerWaalsContact O-N 3.12Å
109	E	58.4	Low	61.8	Low	155 Å²	155	113.2 Å²	113.2	72%	0.724	62%	0.617	S	S	*	*	H	α-helix	trans	-73.7	-38.3	-175.6	-64.9	-169.6	157.5	0	0	112.5	K111 N112 L113	E109-K111 VanDerWaalsContact C-N 3.27Å; E109-K111 PolarHBondContact O-N 3.06Å; E109-N112 PolarHBondContact O-N 3.02Å; E109-L113 PolarHBondContact O-N 3.37Å; E109-L113 VanDerWaalsContact O-N 3.07Å
110	D	66.1	Low	64.6	Low	99 Å²	99	110.6 Å²	110.6	53%	0.529	60%	0.597	S	S	.	*	H	α-helix	trans	-61.5	-35	177.9	-77	-23.3	0	0	0	112.6	T114	D110-T114 VanDerWaalsContact O-CB 3.3Å; D110-T114 WeakPolarHBondContact O-CB 3.11Å; D110-T114 PolarHBondContact O-N 2.99Å; D110-T114 PolarHBondContact O-OG1 2.89Å
111	K	72.7	Confident	67.3	Low	146 Å²	146	108.4 Å²	108.4	64%	0.635	58%	0.582	S	S	*	*	H	α-helix	trans	-67	-39.1	178	-67.1	-177.8	-176.7	175.3	0	111.7	T107 E109 A115	T107-K111 VanDerWaalsContact O-CD 3.29Å; T107-K111 WeakPolarHBondContact O-CD 3.44Å; T107-K111 VanDerWaalsContact O-CE 3.23Å; T107-K111 WeakPolarHBondContact O-CE 3.34Å; T107-K111 WeakPolarHBondContact O-CG 3.5Å; E109-K111 VanDerWaalsContact C-N 3.27Å; E109-K111 PolarHBondContact O-N 3.06Å; K111-A115 WeakPolarHBondContact O-CB 3.43Å; K111-A115 PolarHBondContact O-N 3.19Å
112	N	81.1	Confident	70.1	Confident	104 Å²	104	103.6 Å²	103.6	56%	0.556	56%	0.56	S	S	*	*	H	α-helix	trans	-69.3	-45.7	177.9	-171	-29.7	0	0	0	111.1	E109 T114 A115 Q116	E109-N112 PolarHBondContact O-N 3.02Å; N112-T114 VanDerWaalsContact C-N 3.34Å; N112-T114 PolarHBondContact O-N 3.48Å; N112-A115 PolarHBondContact O-N 2.55Å; N112-Q116 WeakPolarHBondContact O-CG 3.47Å; N112-Q116 PolarHBondContact O-N 2.93Å
113	L	83.8	Confident	73	Confident	82 Å²	82	101.5 Å²	101.5	43%	0.429	55%	0.548	S	S	.	.	H	α-helix	trans	-60.5	-45.1	177.7	-171.8	70	0	0	0	111.3	E109 A115 Q116 F117	E109-L113 PolarHBondContact O-N 3.37Å; E109-L113 VanDerWaalsContact O-N 3.07Å; L113-A115 PolarHBondContact O-N 3.13Å; L113-Q116 WeakPolarHBondContact O-CB 3.15Å; L113-Q116 PolarHBondContact O-N 2.99Å; L113-F117 HydrophobicContact CD1-CD2 4.37Å; L113-F117 HydrophobicContact CD1-CE2 3.87Å; L113-F117 HydrophobicContact CD2-CE2 3.98Å; L113-F117 HydrophobicContact CG-CD2 3.92Å; L113-F117 HydrophobicContact CG-CE2 3.61Å; L113-F117 VanDerWaalsContact O-CD2 3.25Å; L113-F117 WeakPolarHBondContact O-CD2 3.47Å; L113-F117 PolarHBondContact O-N 2.91Å
114	T	84.8	Confident	75.3	Confident	81 Å²	81	101.4 Å²	101.4	50%	0.497	54%	0.538	S	S	.	.	H	α-helix	trans	-58.9	-46.5	175.4	-55.2	0	0	0	0	111.2	D110 N112 Q116 F117 E118	D110-T114 VanDerWaalsContact O-CB 3.3Å; D110-T114 WeakPolarHBondContact O-CB 3.11Å; D110-T114 PolarHBondContact O-N 2.99Å; D110-T114 PolarHBondContact O-OG1 2.89Å; N112-T114 VanDerWaalsContact C-N 3.34Å; N112-T114 PolarHBondContact O-N 3.48Å; T114-Q116 VanDerWaalsContact C-N 3.29Å; T114-Q116 PolarHBondContact O-N 3.02Å; T114-F117 PolarHBondContact O-N 3.4Å; T114-E118 WeakPolarHBondContact O-CG 3.5Å; T114-E118 PolarHBondContact O-N 2.92Å
115	A	85.6	Confident	77.9	Confident	43 Å²	43	101 Å²	101	36%	0.355	53%	0.527	S	S	.	.	H	α-helix	trans	-62.8	-33.1	177.5	0	0	0	0	0	113.3	K111 N112 L113 R119	K111-A115 WeakPolarHBondContact O-CB 3.43Å; K111-A115 PolarHBondContact O-N 3.19Å; N112-A115 PolarHBondContact O-N 2.55Å; L113-A115 PolarHBondContact O-N 3.13Å; A115-R119 VanDerWaalsContact O-CG 3.28Å; A115-R119 WeakPolarHBondContact O-CG 3.46Å; A115-R119 PolarHBondContact O-N 2.86Å; A115-R119 VanDerWaalsContact O-N 3.16Å
116	Q	86.5	Confident	80.3	Confident	70 Å²	70	101.9 Å²	101.9	33%	0.327	52%	0.52	S	S	.	.	H	α-helix	trans	-68.9	-43.7	173.8	-73	-89.8	33.3	0	0	111.8	N112 L113 T114 E118 R119 I120	N112-Q116 WeakPolarHBondContact O-CG 3.47Å; N112-Q116 PolarHBondContact O-N 2.93Å; L113-Q116 WeakPolarHBondContact O-CB 3.15Å; L113-Q116 PolarHBondContact O-N 2.99Å; T114-Q116 VanDerWaalsContact C-N 3.29Å; T114-Q116 PolarHBondContact O-N 3.02Å; Q116-E118 PolarHBondContact O-N 3.26Å; Q116-R119 PolarHBondContact O-N 2.93Å; Q116-I120 WeakPolarHBondContact O-CG1 3.43Å; Q116-I120 PolarHBondContact O-N 2.9Å
117	F	89.9	Confident	82.8	Confident	118 Å²	118	102.3 Å²	102.3	52%	0.518	52%	0.519	S	S	.	.	H	α-helix	trans	-60.4	-44.3	175.6	-82.2	-65.5	0	0	0	111.8	M87 L113 T114 R119 I120 Y121	M87-F117 HydrophobicContact CE-CD1 4.48Å; M87-F117 HydrophobicContact CE-CE1 4.09Å; M87-F117 HydrophobicContact CE-CZ 4.15Å; L113-F117 HydrophobicContact CD1-CD2 4.37Å; L113-F117 HydrophobicContact CD1-CE2 3.87Å; L113-F117 HydrophobicContact CD2-CE2 3.98Å; L113-F117 HydrophobicContact CG-CD2 3.92Å; L113-F117 HydrophobicContact CG-CE2 3.61Å; L113-F117 VanDerWaalsContact O-CD2 3.25Å; L113-F117 WeakPolarHBondContact O-CD2 3.47Å; L113-F117 PolarHBondContact O-N 2.91Å; T114-F117 PolarHBondContact O-N 3.4Å; F117-R119 VanDerWaalsContact C-N 3.33Å; F117-R119 PolarHBondContact O-N 3.35Å; F117-I120 PolarHBondContact O-N 3.39Å; F117-Y121 WeakPolarHBondContact O-CB 3.48Å; F117-Y121 PolarHBondContact O-N 3.13Å
118	E	89.8	Confident	84.9	Confident	112 Å²	112	101 Å²	101	52%	0.523	51%	0.514	S	S	.	.	H	α-helix	trans	-60.8	-40.2	176.4	-74.2	-60.1	153	0	0	112.6	T114 Q116 Y121 T122	T114-E118 WeakPolarHBondContact O-CG 3.5Å; T114-E118 PolarHBondContact O-N 2.92Å; Q116-E118 PolarHBondContact O-N 3.26Å; E118-Y121 PolarHBondContact O-N 2.9Å; E118-T122 VanDerWaalsContact O-CB 3.31Å; E118-T122 WeakPolarHBondContact O-CB 3.48Å; E118-T122 PolarHBondContact O-N 2.83Å; E118-T122 PolarHBondContact O-OG1 3.37Å
119	R	90.1	Very high	86.7	Confident	163 Å²	163	99.2 Å²	99.2	62%	0.615	51%	0.505	S	S	*	.	H	α-helix	trans	-62.9	-45.4	174.2	-73.5	172.1	-171.1	-176.2	3.1	111.8	A115 Q116 F117 T122 L123	A115-R119 VanDerWaalsContact O-CG 3.28Å; A115-R119 WeakPolarHBondContact O-CG 3.46Å; A115-R119 PolarHBondContact O-N 2.86Å; A115-R119 VanDerWaalsContact O-N 3.16Å; Q116-R119 PolarHBondContact O-N 2.93Å; F117-R119 VanDerWaalsContact C-N 3.33Å; F117-R119 PolarHBondContact O-N 3.35Å; R119-T122 PolarHBondContact O-N 3.46Å; R119-L123 WeakPolarHBondContact O-CB 3.26Å; R119-L123 VanDerWaalsContact O-CG 3.29Å; R119-L123 WeakPolarHBondContact O-CG 3.43Å; R119-L123 PolarHBondContact O-N 3.01Å
120	I	91.4	Very high	88.4	Confident	65 Å²	65	95.2 Å²	95.2	33%	0.333	49%	0.494	S	S	.	.	H	α-helix	trans	-64.8	-44.9	179.1	-68.6	169.2	0	0	0	110.5	M87 Q116 F117 T122 L123 L124	M87-I120 HydrophobicContact CE-CD1 3.85Å; Q116-I120 WeakPolarHBondContact O-CG1 3.43Å; Q116-I120 PolarHBondContact O-N 2.9Å; F117-I120 PolarHBondContact O-N 3.39Å; I120-T122 VanDerWaalsContact C-N 3.34Å; I120-T122 PolarHBondContact O-N 3.42Å; I120-L123 PolarHBondContact O-N 3.45Å; I120-L124 WeakPolarHBondContact O-CB 3.34Å; I120-L124 PolarHBondContact O-N 2.88Å
121	Y	91.9	Very high	89.8	Confident	133 Å²	133	95.6 Å²	95.6	52%	0.522	50%	0.495	S	S	.	.	H	α-helix	trans	-61.2	-44.4	177.7	-175.3	-107.5	0	0	0	111.3	F117 E118 L123 L124 L125	F117-Y121 WeakPolarHBondContact O-CB 3.48Å; F117-Y121 PolarHBondContact O-N 3.13Å; E118-Y121 PolarHBondContact O-N 2.9Å; Y121-L123 VanDerWaalsContact C-N 3.35Å; Y121-L123 PolarHBondContact O-N 3.03Å; Y121-L124 WeakPolarHBondContact O-CB 3.31Å; Y121-L124 PolarHBondContact O-N 3.45Å; Y121-L125 HydrophobicContact CD1-CD1 3.92Å; Y121-L125 HydrophobicContact CD1-CG 4.41Å; Y121-L125 HydrophobicContact CE1-CD1 3.49Å; Y121-L125 VanDerWaalsContact CE1-CD1 3.49Å; Y121-L125 HydrophobicContact CE1-CG 4.08Å; Y121-L125 WeakPolarHBondContact O-CG 3.35Å; Y121-L125 PolarHBondContact O-N 2.91Å
122	T	90.4	Very high	90.8	Very high	62 Å²	62	91.8 Å²	91.8	38%	0.38	49%	0.486	S	S	.	.	H	α-helix	trans	-60.1	-42.7	174	-59.5	0	0	0	0	112.1	E118 R119 I120 L125 K126	E118-T122 VanDerWaalsContact O-CB 3.31Å; E118-T122 WeakPolarHBondContact O-CB 3.48Å; E118-T122 PolarHBondContact O-N 2.83Å; E118-T122 PolarHBondContact O-OG1 3.37Å; R119-T122 PolarHBondContact O-N 3.46Å; I120-T122 VanDerWaalsContact C-N 3.34Å; I120-T122 PolarHBondContact O-N 3.42Å; T122-L125 PolarHBondContact O-N 3.41Å; T122-K126 WeakPolarHBondContact O-CG 3.44Å; T122-K126 PolarHBondContact O-N 3.17Å
123	L	93.5	Very high	91.5	Very high	106 Å²	106	92.5 Å²	92.5	56%	0.555	49%	0.487	S	S	*	.	H	α-helix	trans	-64.7	-40.1	175.5	-73.3	171.6	0	0	0	111.7	R119 I120 Y121 K126 V127	R119-L123 WeakPolarHBondContact O-CB 3.26Å; R119-L123 VanDerWaalsContact O-CG 3.29Å; R119-L123 WeakPolarHBondContact O-CG 3.43Å; R119-L123 PolarHBondContact O-N 3.01Å; I120-L123 PolarHBondContact O-N 3.45Å; Y121-L123 VanDerWaalsContact C-N 3.35Å; Y121-L123 PolarHBondContact O-N 3.03Å; L123-K126 PolarHBondContact O-N 2.81Å; L123-V127 WeakPolarHBondContact O-CG2 3.35Å; L123-V127 PolarHBondContact O-N 3.45Å
124	L	91.8	Very high	92	Very high	113 Å²	113	93.2 Å²	93.2	59%	0.592	49%	0.49	S	S	*	.	H	α-helix	trans	-63.3	-43.3	177.2	-173.4	68.7	0	0	0	111.4	I120 Y121 V127 S128	I120-L124 WeakPolarHBondContact O-CB 3.34Å; I120-L124 PolarHBondContact O-N 2.88Å; Y121-L124 WeakPolarHBondContact O-CB 3.31Å; Y121-L124 PolarHBondContact O-N 3.45Å; L124-V127 PolarHBondContact O-N 2.92Å; L124-S128 WeakPolarHBondContact O-CB 3.46Å; L124-S128 PolarHBondContact O-N 3.17Å
125	L	93.3	Very high	92.5	Very high	91 Å²	91	93.2 Å²	93.2	48%	0.476	49%	0.487	S	S	.	.	H	α-helix	trans	-61.1	-43.7	174.3	-71.9	177.6	0	0	0	111.8	Y121 T122 S128 A129	Y121-L125 HydrophobicContact CD1-CD1 3.92Å; Y121-L125 HydrophobicContact CD1-CG 4.41Å; Y121-L125 HydrophobicContact CE1-CD1 3.49Å; Y121-L125 VanDerWaalsContact CE1-CD1 3.49Å; Y121-L125 HydrophobicContact CE1-CG 4.08Å; Y121-L125 WeakPolarHBondContact O-CG 3.35Å; Y121-L125 PolarHBondContact O-N 2.91Å; T122-L125 PolarHBondContact O-N 3.41Å; L125-S128 PolarHBondContact O-N 3.48Å; L125-A129 WeakPolarHBondContact O-CB 3.43Å; L125-A129 PolarHBondContact O-N 2.87Å
126	K	93.9	Very high	92.9	Very high	131 Å²	131	95 Å²	95	57%	0.57	49%	0.494	S	S	*	.	H	α-helix	trans	-61.3	-47	176	-74.3	177.6	179.9	-176.9	0	112.1	T122 L123 S128 A129 S130	T122-K126 WeakPolarHBondContact O-CG 3.44Å; T122-K126 PolarHBondContact O-N 3.17Å; L123-K126 PolarHBondContact O-N 2.81Å; K126-S128 VanDerWaalsContact C-N 3.33Å; K126-S128 PolarHBondContact O-N 2.91Å; K126-A129 PolarHBondContact O-N 3.44Å; K126-S130 PolarHBondContact O-N 3.47Å; K126-S130 PolarHBondContact O-OG 3.18Å
127	V	94.5	Very high	93.2	Very high	83 Å²	83	95.4 Å²	95.4	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-62.1	-42.9	177.4	170.7	0	0	0	0	110.9	L123 L124 A129 S130 I131	L123-V127 WeakPolarHBondContact O-CG2 3.35Å; L123-V127 PolarHBondContact O-N 3.45Å; L124-V127 PolarHBondContact O-N 2.92Å; V127-A129 VanDerWaalsContact C-N 3.35Å; V127-A129 PolarHBondContact O-N 3.17Å; V127-S130 PolarHBondContact O-N 3.33Å; V127-I131 HydrophobicContact CG1-CD1 3.84Å; V127-I131 HydrophobicContact CG1-CG1 4.44Å; V127-I131 WeakPolarHBondContact O-CG1 3.36Å; V127-I131 PolarHBondContact O-N 3.49Å
128	S	95.1	Very high	93.4	Very high	67 Å²	67	95.2 Å²	95.2	47%	0.469	50%	0.5	S	S	.	.	H	α-helix	trans	-60.6	-42.3	176.8	-174.7	0	0	0	0	112.4	L124 L125 K126 I131 S132	L124-S128 WeakPolarHBondContact O-CB 3.46Å; L124-S128 PolarHBondContact O-N 3.17Å; L125-S128 PolarHBondContact O-N 3.48Å; K126-S128 VanDerWaalsContact C-N 3.33Å; K126-S128 PolarHBondContact O-N 2.91Å; S128-I131 PolarHBondContact O-N 3.42Å; S128-S132 PolarHBondContact O-N 3.34Å; S128-S132 PolarHBondContact O-OG 3.36Å
129	A	95.2	Very high	93.4	Very high	59 Å²	59	96 Å²	96	49%	0.488	50%	0.502	S	S	.	.	H	α-helix	trans	-62.7	-46.8	174.7	0	0	0	0	0	111.9	L125 K126 V127 I131 S132 E133	L125-A129 WeakPolarHBondContact O-CB 3.43Å; L125-A129 PolarHBondContact O-N 2.87Å; K126-A129 PolarHBondContact O-N 3.44Å; V127-A129 VanDerWaalsContact C-N 3.35Å; V127-A129 PolarHBondContact O-N 3.17Å; A129-I131 VanDerWaalsContact C-N 3.34Å; A129-I131 PolarHBondContact O-N 3.36Å; A129-S132 WeakPolarHBondContact O-CB 3.33Å; A129-S132 PolarHBondContact O-N 3.36Å; A129-S132 VanDerWaalsContact O-N 3.14Å; A129-E133 PolarHBondContact O-N 3.13Å
130	S	94.8	Very high	93.4	Very high	72 Å²	72	93 Å²	93	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-62.3	-37.5	177.5	-60.7	0	0	0	0	113.2	K126 V127 S132 L134	K126-S130 PolarHBondContact O-N 3.47Å; K126-S130 PolarHBondContact O-OG 3.18Å; V127-S130 PolarHBondContact O-N 3.33Å; S130-S132 VanDerWaalsContact C-N 3.34Å; S130-L134 WeakPolarHBondContact O-CB 3.35Å; S130-L134 PolarHBondContact O-N 2.92Å
131	I	95	Very high	93.2	Very high	107 Å²	107	93.8 Å²	93.8	55%	0.549	51%	0.505	S	S	.	.	H	α-helix	trans	-65.3	-41	174.6	-69.7	168	0	0	0	110.6	V127 S128 A129 L134 N135	V127-I131 HydrophobicContact CG1-CD1 3.84Å; V127-I131 HydrophobicContact CG1-CG1 4.44Å; V127-I131 WeakPolarHBondContact O-CG1 3.36Å; V127-I131 PolarHBondContact O-N 3.49Å; S128-I131 PolarHBondContact O-N 3.42Å; A129-I131 VanDerWaalsContact C-N 3.34Å; A129-I131 PolarHBondContact O-N 3.36Å; I131-L134 PolarHBondContact O-N 2.88Å; I131-N135 WeakPolarHBondContact O-CB 3.07Å; I131-N135 PolarHBondContact O-N 2.97Å
132	S	93.5	Very high	92.9	Very high	65 Å²	65	93 Å²	93	46%	0.455	51%	0.509	S	S	.	.	H	α-helix	trans	-63.5	-44.4	178.6	-60.6	0	0	0	0	111.6	S128 A129 S130 N135 T136	S128-S132 PolarHBondContact O-N 3.34Å; S128-S132 PolarHBondContact O-OG 3.36Å; A129-S132 WeakPolarHBondContact O-CB 3.33Å; A129-S132 PolarHBondContact O-N 3.36Å; A129-S132 VanDerWaalsContact O-N 3.14Å; S130-S132 VanDerWaalsContact C-N 3.34Å; S132-N135 PolarHBondContact O-N 3.47Å; S132-T136 PolarHBondContact O-N 2.9Å; S132-T136 PolarHBondContact O-OG1 2.86Å
133	E	95.7	Very high	92.5	Very high	120 Å²	120	92.9 Å²	92.9	56%	0.561	51%	0.511	S	S	*	.	H	α-helix	trans	-61.8	-43.5	174.7	-174.4	-177.5	178.5	0	0	112.1	A129 N135 T136 N137	A129-E133 PolarHBondContact O-N 3.13Å; E133-N135 VanDerWaalsContact C-N 3.31Å; E133-N135 PolarHBondContact O-N 2.88Å; E133-T136 WeakPolarHBondContact CA-OG1 3.41Å; E133-T136 PolarHBondContact O-N 3.44Å; E133-T136 PolarHBondContact O-OG1 3.24Å; E133-N137 WeakPolarHBondContact O-CB 3.47Å; E133-N137 VanDerWaalsContact O-CG 3.24Å; E133-N137 PolarHBondContact O-N 3.39Å; E133-N137 PolarHBondContact O-ND2 3.26Å
134	L	95.4	Very high	91.7	Very high	96 Å²	96	95.2 Å²	95.2	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-61.1	-41.8	175.8	-176.5	63.6	0	0	0	111.5	S130 I131 T136 N137 M138	S130-L134 WeakPolarHBondContact O-CB 3.35Å; S130-L134 PolarHBondContact O-N 2.92Å; I131-L134 PolarHBondContact O-N 2.88Å; L134-T136 PolarHBondContact O-N 3.06Å; L134-N137 PolarHBondContact O-N 2.02Å; L134-M138 HydrophobicContact CD1-CE 4.23Å; L134-M138 HydrophobicContact CD2-CE 4.13Å; L134-M138 HydrophobicContact CG-CE 4.02Å; L134-M138 WeakPolarHBondContact O-CG 3.4Å; L134-M138 PolarHBondContact O-N 3.43Å
135	N	94.9	Very high	90.8	Very high	82 Å²	82	95 Å²	95	44%	0.439	51%	0.511	S	S	.	.	H	α-helix	trans	-64.9	-38.3	177.7	-169.2	27.1	0	0	0	111.9	I131 S132 E133 M138 K139	I131-N135 WeakPolarHBondContact O-CB 3.07Å; I131-N135 PolarHBondContact O-N 2.97Å; S132-N135 PolarHBondContact O-N 3.47Å; E133-N135 VanDerWaalsContact C-N 3.31Å; E133-N135 PolarHBondContact O-N 2.88Å; N135-M138 PolarHBondContact O-N 3.15Å; N135-K139 WeakPolarHBondContact O-CG 3.47Å; N135-K139 PolarHBondContact O-N 3.19Å
136	T	93.8	Very high	89.5	Confident	81 Å²	81	96 Å²	96	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-65.9	-40.8	173.7	49.5	0	0	0	0	111.9	S132 E133 L134 K139 L140	S132-T136 PolarHBondContact O-N 2.9Å; S132-T136 PolarHBondContact O-OG1 2.86Å; E133-T136 WeakPolarHBondContact CA-OG1 3.41Å; E133-T136 PolarHBondContact O-N 3.44Å; E133-T136 PolarHBondContact O-OG1 3.24Å; L134-T136 PolarHBondContact O-N 3.06Å; T136-K139 PolarHBondContact O-N 3.35Å; T136-L140 PolarHBondContact O-N 3.5Å
137	N	93.8	Very high	87.9	Confident	77 Å²	77	97 Å²	97	41%	0.412	53%	0.533	S	S	.	.	H	α-helix	trans	-65	-40.8	176.6	-68.6	-19.9	0	0	0	111.4	E133 L134 L140 V141	E133-N137 WeakPolarHBondContact O-CB 3.47Å; E133-N137 VanDerWaalsContact O-CG 3.24Å; E133-N137 PolarHBondContact O-N 3.39Å; E133-N137 PolarHBondContact O-ND2 3.26Å; L134-N137 PolarHBondContact O-N 2.02Å; N137-L140 PolarHBondContact O-N 3.03Å; N137-V141 VanDerWaalsContact O-CG2 3.31Å; N137-V141 WeakPolarHBondContact O-CG2 3.26Å; N137-V141 PolarHBondContact O-N 2.67Å
138	M	93.1	Very high	86.2	Confident	114 Å²	114	99.4 Å²	99.4	56%	0.562	53%	0.533	S	S	*	.	H	α-helix	trans	-62.5	-42.7	174.8	-76.6	-175.9	176.5	0	0	112.4	L134 N135 V141 L142	L134-M138 HydrophobicContact CD1-CE 4.23Å; L134-M138 HydrophobicContact CD2-CE 4.13Å; L134-M138 HydrophobicContact CG-CE 4.02Å; L134-M138 WeakPolarHBondContact O-CG 3.4Å; L134-M138 PolarHBondContact O-N 3.43Å; N135-M138 PolarHBondContact O-N 3.15Å; M138-V141 PolarHBondContact O-N 3.24Å; M138-L142 WeakPolarHBondContact O-CB 3.28Å; M138-L142 PolarHBondContact O-N 3.05Å
139	K	91.1	Very high	84.6	Confident	128 Å²	128	102.7 Å²	102.7	56%	0.557	54%	0.541	S	S	*	.	H	α-helix	trans	-62.2	-42.3	175.2	-73.7	172.8	-177.5	176.3	0	111.9	N135 T136 L142 S143	N135-K139 WeakPolarHBondContact O-CG 3.47Å; N135-K139 PolarHBondContact O-N 3.19Å; T136-K139 PolarHBondContact O-N 3.35Å; K139-L142 PolarHBondContact O-N 3Å; K139-S143 PolarHBondContact O-N 3.18Å
140	L	88.9	Confident	83.3	Confident	102 Å²	102	103.2 Å²	103.2	53%	0.534	54%	0.536	S	S	.	.	H	α-helix	trans	-61.3	-48.7	176.1	-179.3	64.6	0	0	0	110.8	T136 N137 L142 S143 K144	T136-L140 PolarHBondContact O-N 3.5Å; N137-L140 PolarHBondContact O-N 3.03Å; L140-L142 PolarHBondContact O-N 3.28Å; L140-S143 PolarHBondContact O-N 3.2Å; L140-S143 PolarHBondContact O-OG 3.31Å; L140-K144 WeakPolarHBondContact O-CG 3.29Å; L140-K144 PolarHBondContact O-N 3.2Å
141	V	86.7	Confident	81.9	Confident	80 Å²	80	102.6 Å²	102.6	49%	0.485	53%	0.53	S	S	.	.	H	α-helix	trans	-58.1	-47.8	176	171.8	0	0	0	0	110.7	N137 M138 S143 K144 F145	N137-V141 VanDerWaalsContact O-CG2 3.31Å; N137-V141 WeakPolarHBondContact O-CG2 3.26Å; N137-V141 PolarHBondContact O-N 2.67Å; M138-V141 PolarHBondContact O-N 3.24Å; V141-S143 VanDerWaalsContact C-N 3.32Å; V141-S143 PolarHBondContact O-N 2.88Å; V141-K144 WeakPolarHBondContact O-CB 3.27Å; V141-K144 PolarHBondContact O-N 3.19Å; V141-K144 VanDerWaalsContact O-N 3.09Å; V141-F145 HydrophobicContact CG1-CD2 3.92Å; V141-F145 HydrophobicContact CG1-CE2 3.55Å; V141-F145 WeakPolarHBondContact O-CD2 3.15Å; V141-F145 PolarHBondContact O-N 2.91Å
142	L	85.9	Confident	80.8	Confident	116 Å²	116	104.4 Å²	104.4	61%	0.607	53%	0.53	S	S	*	.	H	α-helix	trans	-62.8	-36.9	-179.6	-170.2	64.9	0	0	0	112.7	M138 K139 L140 K144 F145 T146	M138-L142 WeakPolarHBondContact O-CB 3.28Å; M138-L142 PolarHBondContact O-N 3.05Å; K139-L142 PolarHBondContact O-N 3Å; L140-L142 PolarHBondContact O-N 3.28Å; L142-K144 VanDerWaalsContact C-N 3.29Å; L142-K144 PolarHBondContact O-N 3Å; L142-F145 PolarHBondContact O-N 3.27Å; L142-F145 VanDerWaalsContact O-N 3.09Å; L142-T146 PolarHBondContact O-N 3.16Å; L142-T146 PolarHBondContact O-OG1 3.03Å
143	S	82	Confident	80.1	Confident	61 Å²	61	106 Å²	106	43%	0.427	53%	0.531	S	S	.	.	H	α-helix	trans	-61.5	-37.3	174.5	75.2	0	0	0	0	112.1	K139 L140 V141 F145 T146	K139-S143 PolarHBondContact O-N 3.18Å; L140-S143 PolarHBondContact O-N 3.2Å; L140-S143 PolarHBondContact O-OG 3.31Å; V141-S143 VanDerWaalsContact C-N 3.32Å; V141-S143 PolarHBondContact O-N 2.88Å; S143-F145 PolarHBondContact O-N 3.44Å; S143-T146 PolarHBondContact O-N 2.96Å
144	K	77.4	Confident	79.5	Confident	154 Å²	154	100.8 Å²	100.8	67%	0.67	51%	0.506	S	S	*	.	H	α-helix	trans	-69.1	-19.9	175.7	-61.5	-67.3	-177.3	-178.1	0	113.4	L140 V141 L142	L140-K144 WeakPolarHBondContact O-CG 3.29Å; L140-K144 PolarHBondContact O-N 3.2Å; V141-K144 WeakPolarHBondContact O-CB 3.27Å; V141-K144 PolarHBondContact O-N 3.19Å; V141-K144 VanDerWaalsContact O-N 3.09Å; L142-K144 VanDerWaalsContact C-N 3.29Å; L142-K144 PolarHBondContact O-N 3Å
145	F	72.7	Confident	78.9	Confident	108 Å²	108	99 Å²	99	47%	0.474	50%	0.496	S	S	.	.	H	α-helix	trans	-88.2	-23.2	174.5	-78	-78.7	0	0	0	113.5	V141 L142 S143 R148	V141-F145 HydrophobicContact CG1-CD2 3.92Å; V141-F145 HydrophobicContact CG1-CE2 3.55Å; V141-F145 WeakPolarHBondContact O-CD2 3.15Å; V141-F145 PolarHBondContact O-N 2.91Å; L142-F145 PolarHBondContact O-N 3.27Å; L142-F145 VanDerWaalsContact O-N 3.09Å; S143-F145 PolarHBondContact O-N 3.44Å; F145-R148 VanDerWaalsContact CE1-NH2 3.33Å; F145-R148 WeakPolarHBondContact O-CG 3.46Å
146	T	65.7	Low	78.1	Confident	113 Å²	113	95.3 Å²	95.3	69%	0.693	48%	0.478	S	S	*	.	H	α-helix	trans	-77.7	-32.1	-174.4	-53.4	0	0	0	0	112.6	L142 S143 R148	L142-T146 PolarHBondContact O-N 3.16Å; L142-T146 PolarHBondContact O-OG1 3.03Å; S143-T146 PolarHBondContact O-N 2.96Å; T146-R148 PolarHBondContact O-N 3.11Å
147	D	60	Low	76.9	Confident	153 Å²	153	94.1 Å²	94.1	82%	0.818	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	21.9	-177.8	-155.6	17.5	0	0	0	114.1	Q149	D147-Q149 PolarHBondContact O-N 3.41Å
148	R	60.2	Low	75.4	Confident	132 Å²	132	98 Å²	98	50%	0.498	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-85.6	119.3	-176.5	-71	-172.8	176	-162.5	-1.2	110.2	F145 T146	F145-R148 VanDerWaalsContact CE1-NH2 3.33Å; F145-R148 WeakPolarHBondContact O-CG 3.46Å; T146-R148 PolarHBondContact O-N 3.11Å
149	Q	60.5	Low	74	Confident	136 Å²	136	95.6 Å²	95.6	64%	0.636	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-53.5	143.4	162.3	-63.9	-161.2	-9.4	0	0	110.2	D147 P151	D147-Q149 PolarHBondContact O-N 3.41Å; Q149-P151 WeakPolarHBondContact O-CD 3.3Å; Q149-P151 VanDerWaalsContact O-N 3.1Å
150	D	67.4	Low	73.4	Confident	71 Å²	71	92.6 Å²	92.6	38%	0.38	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-48.6	120.3	173.5	-179.3	-9.1	0	0	0	107.6	R152 Q153	D150-R152 PolarHBondContact O-N 3.44Å; D150-R152 WeakPolarHBondContact OD1-CB 3.42Å; D150-R152 PolarHBondContact OD1-N 3.2Å; D150-R152 IonicContact OD1-NE 3.3Å; D150-R152 IonicContact OD2-NE 3.06Å; D150-Q153 HydrophobicContact CB-CB 4.44Å; D150-Q153 PolarHBondContact O-N 3.34Å
151	P	65.3	Low	73	Confident	58 Å²	58	88.3 Å²	88.3	38%	0.377	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-35.8	177.6	-23.4	28.2	0	0	0	112.1	Q149 Q153 Y209	Q149-P151 WeakPolarHBondContact O-CD 3.3Å; Q149-P151 VanDerWaalsContact O-N 3.1Å; P151-Q153 VanDerWaalsContact C-N 3.27Å; P151-Q153 PolarHBondContact O-N 3.03Å; P151-Y209 PolarHBondContact O-OH 2.96Å
152	R	72.8	Confident	73.1	Confident	145 Å²	145	91.3 Å²	91.3	55%	0.547	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-15.1	-174.4	-65.5	-171.7	-81.7	-163.8	-6.3	114.4	D150 Q162 F163 Y209	D150-R152 PolarHBondContact O-N 3.44Å; D150-R152 WeakPolarHBondContact OD1-CB 3.42Å; D150-R152 PolarHBondContact OD1-N 3.2Å; D150-R152 IonicContact OD1-NE 3.3Å; D150-R152 IonicContact OD2-NE 3.06Å; R152-Q162 WeakPolarHBondContact O-CA 2.8Å; R152-F163 PolarHBondContact O-N 3.22Å; R152-Y209 VanDerWaalsContact CA-OH 3.26Å; R152-Y209 WeakPolarHBondContact CA-OH 3.22Å; R152-Y209 PolarHBondContact N-OH 3.46Å
153	Q	78.5	Confident	73.4	Confident	100 Å²	100	86.1 Å²	86.1	47%	0.467	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125	178.4	-167.3	174.3	9.5	0	0	109.7	D150 P151 S160 Q161	D150-Q153 HydrophobicContact CB-CB 4.44Å; D150-Q153 PolarHBondContact O-N 3.34Å; P151-Q153 VanDerWaalsContact C-N 3.27Å; P151-Q153 PolarHBondContact O-N 3.03Å; Q153-S160 PolarHBondContact NE2-OG 3.07Å; Q153-S160 VanDerWaalsContact NE2-OG 3.11Å; Q153-Q161 WeakPolarHBondContact CA-O 3.42Å
154	F	83.5	Confident	74	Confident	10 Å²	10	85.8 Å²	85.8	4%	0.044	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	117.7	174.3	179.1	-101.8	0	0	0	109.7	C156 Q161 F163 L174 V183 R186 F187 M190	F154-C156 PolarHBondContact O-N 2.9Å; F154-Q161 PolarHBondContact N-O 2.79Å; F154-Q161 PolarHBondContact O-N 3.5Å; F154-F163 HydrophobicContact CB-CD2 4.21Å; F154-F163 HydrophobicContact CB-CE2 3.48Å; F154-F163 VanDerWaalsContact CB-CE2 3.48Å; F154-F163 HydrophobicContact CB-CZ 4.31Å; F154-F163 HydrophobicContact CG-CE2 4.14Å; F154-L174 HydrophobicContact CD1-CD1 4.07Å; F154-L174 HydrophobicContact CE1-CD1 3.84Å; F154-V183 HydrophobicContact CE1-CG1 3.87Å; F154-V183 HydrophobicContact CZ-CG1 3.62Å; F154-R186 HydrophobicContact CE2-CB 4.2Å; F154-F187 HydrophobicContact CD1-CD2 4.46Å; F154-F187 HydrophobicContact CD2-CD2 4.31Å; F154-F187 HydrophobicContact CE1-CD2 4.13Å; F154-F187 HydrophobicContact CE2-CB 3.79Å; F154-F187 AromaticContact CE2-CD2 3.98Å; F154-F187 HydrophobicContact CE2-CD2 3.98Å; F154-F187 HydrophobicContact CE2-CG 4.4Å; F154-F187 HydrophobicContact CZ-CB 3.64Å; F154-F187 AromaticContact CZ-CD2 3.88Å; F154-F187 HydrophobicContact CZ-CD2 3.88Å; F154-F187 HydrophobicContact CZ-CG 4.22Å; F154-M190 HydrophobicContact CD2-CE 4.44Å
155	D	83.4	Confident	74.9	Confident	57 Å²	57	78.5 Å²	78.5	31%	0.305	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	109.8	178.6	172.8	38.1	0	0	0	111.1	G157 R186	D155-G157 PolarHBondContact O-N 2.7Å; D155-G157 WeakPolarHBondContact OD1-CA 3.45Å; D155-G157 PolarHBondContact OD1-N 2.93Å; D155-R186 PolarHBondContact O-NH2 3.21Å; D155-R186 IonicContact OD2-NH1 2.73Å; D155-R186 PolarHBondContact OD2-NH1 3.11Å
156	C	76.8	Confident	75.9	Confident	6 Å²	6	76.1 Å²	76.1	4%	0.041	41%	0.411	C	S	.	.			trans	-79.1	-2.8	176.2	-130.3	0	0	0	0	112.4	F154 L158 S159 C177	F154-C156 PolarHBondContact O-N 2.9Å; C156-L158 PolarHBondContact O-N 2.79Å; C156-S159 WeakPolarHBondContact CB-O 3.47Å; C156-S159 PolarHBondContact N-O 3.47Å; C156-C177 HydrophobicContact CB-CB 4.09Å; C156-C177 WeakPolarHBondContact CB-SG 3.34Å; C156-C177 WeakPolarHBondContact SG-CB 3.35Å; C156-C177 CovalentContact SG-SG 2.02Å; C156-C177 PolarHBondContact SG-SG 2.81Å
157	G	69.9	Low	77.3	Confident	56 Å²	56	72.2 Å²	72.2	58%	0.577	39%	0.388	S	S	*	.	S	Bend	trans	77.4	-32.9	-169.5	0	0	0	0	0	113.8	D155	D155-G157 PolarHBondContact O-N 2.7Å; D155-G157 WeakPolarHBondContact OD1-CA 3.45Å; D155-G157 PolarHBondContact OD1-N 2.93Å
158	L	61.5	Low	78.9	Confident	157 Å²	157	68.1 Å²	68.1	82%	0.822	36%	0.364	S	S	*	.	S	Bend	trans	-96.3	-28.4	175.5	-60.9	176.3	0	0	0	113.3	C156	C156-L158 PolarHBondContact O-N 2.79Å
159	S	64.8	Low	80.6	Confident	64 Å²	64	68.1 Å²	68.1	45%	0.448	37%	0.37	S	S	.	.			trans	-157.7	143.9	179.3	-178.1	0	0	0	0	110.4	C156 Q161	C156-S159 WeakPolarHBondContact CB-O 3.47Å; C156-S159 PolarHBondContact N-O 3.47Å; S159-Q161 PolarHBondContact O-N 3.03Å
160	S	77.4	Confident	82.2	Confident	66 Å²	66	65 Å²	65	46%	0.462	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	115.8	167.3	-79.8	0	0	0	0	109.2	Q153	Q153-S160 PolarHBondContact NE2-OG 3.07Å; Q153-S160 VanDerWaalsContact NE2-OG 3.11Å
161	Q	81.3	Confident	83.5	Confident	11 Å²	11	61.8 Å²	61.8	5%	0.051	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.6	175.5	-68	-173.9	1.6	0	0	110.4	Q153 F154 S159 L165 L174	Q153-Q161 WeakPolarHBondContact CA-O 3.42Å; F154-Q161 PolarHBondContact N-O 2.79Å; F154-Q161 PolarHBondContact O-N 3.5Å; S159-Q161 PolarHBondContact O-N 3.03Å; Q161-L165 HydrophobicContact CB-CD2 4.09Å; Q161-L165 HydrophobicContact CG-CD2 4.42Å; Q161-L174 VanDerWaalsContact NE2-CA 3.29Å; Q161-L174 VanDerWaalsContact NE2-N 3.12Å
162	Q	87.7	Confident	84.9	Confident	143 Å²	143	60.7 Å²	60.7	67%	0.668	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	119.6	171.1	-170.4	175.2	24.1	0	0	109.7	R152	R152-Q162 WeakPolarHBondContact O-CA 2.8Å
163	F	92.3	Very high	85.9	Confident	7 Å²	7	56.6 Å²	56.6	3%	0.031	33%	0.328	C	S	.	.	S	Bend	trans	-83.8	144.5	176.8	-73.3	-61.5	0	0	0	112.2	R152 F154 L165 L174 F187 M190 Y209 I210	R152-F163 PolarHBondContact O-N 3.22Å; F154-F163 HydrophobicContact CB-CD2 4.21Å; F154-F163 HydrophobicContact CB-CE2 3.48Å; F154-F163 VanDerWaalsContact CB-CE2 3.48Å; F154-F163 HydrophobicContact CB-CZ 4.31Å; F154-F163 HydrophobicContact CG-CE2 4.14Å; F163-L165 HydrophobicContact CD1-CD2 4.17Å; F163-L165 HydrophobicContact CD1-CG 3.87Å; F163-L165 HydrophobicContact CE1-CD1 3.96Å; F163-L165 HydrophobicContact CE1-CD2 4.13Å; F163-L165 HydrophobicContact CE1-CG 3.74Å; F163-L174 HydrophobicContact CE1-CD2 4.12Å; F163-L174 HydrophobicContact CZ-CD2 4.07Å; F163-F187 HydrophobicContact CZ-CE2 4.1Å; F163-M190 HydrophobicContact CD2-CE 4.48Å; F163-M190 HydrophobicContact CE2-CE 3.76Å; F163-M190 HydrophobicContact CZ-CE 4.3Å; F163-Y209 HydrophobicContact CB-CD1 4.09Å; F163-Y209 HydrophobicContact CB-CE1 3.68Å; F163-Y209 WeakPolarHBondContact CB-O 3.24Å; F163-Y209 HydrophobicContact CD2-CD1 4.31Å; F163-Y209 AromaticContact CD2-CE1 3.59Å; F163-Y209 HydrophobicContact CD2-CE1 3.59Å; F163-Y209 HydrophobicContact CE2-CE1 4.38Å; F163-Y209 HydrophobicContact CG-CD1 4.09Å; F163-Y209 AromaticContact CG-CE1 3.71Å; F163-Y209 HydrophobicContact CG-CE1 3.71Å; F163-I210 WeakPolarHBondContact CD1-O 3.19Å; F163-I210 HydrophobicContact CE1-CB 4.34Å; F163-I210 HydrophobicContact CE1-CG1 4.37Å; F163-I210 HydrophobicContact CE1-CG2 4.12Å
164	P	94.7	Very high	86.7	Confident	55 Å²	55	51.8 Å²	51.8	36%	0.357	31%	0.306	S	S	.	.	S	Bend	cis	-80.1	142.3	-2.7	31.5	-34.6	0	0	0	113.5	Y209 K212	P164-Y209 WeakPolarHBondContact CA-O 3.45Å; P164-Y209 WeakPolarHBondContact CB-O 3.42Å; P164-K212 HydrophobicContact CB-CG 3.97Å; P164-K212 HydrophobicContact CG-CG 3.73Å
165	L	95.6	Very high	87.2	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-63.6	139.7	177.4	-57.9	-178.6	0	0	0	111	Q161 F163 E170 L171 L174 I210 K212	Q161-L165 HydrophobicContact CB-CD2 4.09Å; Q161-L165 HydrophobicContact CG-CD2 4.42Å; F163-L165 HydrophobicContact CD1-CD2 4.17Å; F163-L165 HydrophobicContact CD1-CG 3.87Å; F163-L165 HydrophobicContact CE1-CD1 3.96Å; F163-L165 HydrophobicContact CE1-CD2 4.13Å; F163-L165 HydrophobicContact CE1-CG 3.74Å; L165-E170 HydrophobicContact CB-CB 4.19Å; L165-E170 HydrophobicContact CD1-CB 4.31Å; L165-E170 HydrophobicContact CD2-CB 4.06Å; L165-E170 HydrophobicContact CG-CB 4.4Å; L165-L171 HydrophobicContact CD1-CB 4.3Å; L165-L171 HydrophobicContact CD1-CD1 3.85Å; L165-L174 HydrophobicContact CD1-CB 4.22Å; L165-L174 HydrophobicContact CD1-CD2 4.05Å; L165-I210 WeakPolarHBondContact CB-O 3.36Å; L165-I210 WeakPolarHBondContact CG-O 3.28Å; L165-I210 PolarHBondContact N-O 3.34Å; L165-K212 WeakPolarHBondContact O-CB 3.43Å; L165-K212 WeakPolarHBondContact O-CG 3.44Å; L165-K212 PolarHBondContact O-N 3.47Å
166	S	94.2	Very high	87.8	Confident	57 Å²	57	52.4 Å²	52.4	40%	0.399	32%	0.317	S	S	.	.			trans	-111.5	-11.9	-169.4	65.2	0	0	0	0	114.4	E170 V215	S166-E170 WeakPolarHBondContact CA-OE2 3.4Å; S166-E170 PolarHBondContact N-OE2 2.87Å; S166-E170 PolarHBondContact OG-OE2 3.32Å; S166-V215 VanDerWaalsContact O-CG2 3.26Å; S166-V215 WeakPolarHBondContact O-CG2 3.4Å
167	S	95	Very high	88.7	Confident	32 Å²	32	52.5 Å²	52.5	22%	0.224	32%	0.318	C	S	.	.	S	Bend	trans	-132.1	163.9	177	99.1	0	0	0	0	113.6	E169 E170 L171	S167-E169 VanDerWaalsContact C-N 3.33Å; S167-E169 WeakPolarHBondContact CB-OE2 3.45Å; S167-E169 PolarHBondContact OG-N 2.71Å; S167-E169 PolarHBondContact OG-OE2 3.47Å; S167-E170 PolarHBondContact N-OE2 2.83Å; S167-E170 VanDerWaalsContact N-OE2 3.08Å; S167-E170 PolarHBondContact OG-N 3.32Å; S167-L171 PolarHBondContact O-N 2.9Å
168	E	94.9	Very high	89.9	Confident	67 Å²	67	49.9 Å²	49.9	31%	0.313	29%	0.291	S	S	.	.	H	α-helix	trans	-71.1	-31.4	177.1	164.8	146.5	172.6	0	0	112	L171 G172 R228	E168-L171 PolarHBondContact O-N 2.66Å; E168-G172 PolarHBondContact O-N 3.28Å; E168-R228 IonicContact OE1-CZ 3.36Å; E168-R228 IonicContact OE1-NE 2.82Å; E168-R228 PolarHBondContact OE1-NE 3.31Å; E168-R228 IonicContact OE1-NH1 3.17Å; E168-R228 PolarHBondContact OE1-NH1 3Å; E168-R228 IonicContact OE1-NH2 3.7Å; E168-R228 PolarHBondContact OE1-NH2 3.33Å; E168-R228 IonicContact OE2-CZ 2.66Å; E168-R228 VanDerWaalsContact OE2-CZ 3.3Å; E168-R228 IonicContact OE2-NE 3.84Å; E168-R228 IonicContact OE2-NH2 3.87Å; E168-R228 PolarHBondContact OE2-NH2 3.04Å
169	E	94.4	Very high	91.5	Very high	131 Å²	131	48.3 Å²	48.3	61%	0.612	28%	0.279	S	S	*	.	H	α-helix	trans	-69.6	-41.7	176.7	-56.2	74.6	-161.1	0	0	111.4	S167 L171 G172 T173	S167-E169 VanDerWaalsContact C-N 3.33Å; S167-E169 WeakPolarHBondContact CB-OE2 3.45Å; S167-E169 PolarHBondContact OG-N 2.71Å; S167-E169 PolarHBondContact OG-OE2 3.47Å; E169-L171 VanDerWaalsContact C-N 3.31Å; E169-L171 PolarHBondContact O-N 2.97Å; E169-G172 PolarHBondContact O-N 3.31Å; E169-T173 WeakPolarHBondContact O-CB 3.45Å; E169-T173 PolarHBondContact O-N 3.37Å; E169-T173 PolarHBondContact O-OG1 3.18Å
170	E	94	Very high	93	Very high	71 Å²	71	50.9 Å²	50.9	33%	0.332	28%	0.284	S	S	.	.	H	α-helix	trans	-61.1	-42.9	174.3	-69.7	178.2	144.3	0	0	110.9	L165 S166 S167 T173 L174	L165-E170 HydrophobicContact CB-CB 4.19Å; L165-E170 HydrophobicContact CD1-CB 4.31Å; L165-E170 HydrophobicContact CD2-CB 4.06Å; L165-E170 HydrophobicContact CG-CB 4.4Å; S166-E170 WeakPolarHBondContact CA-OE2 3.4Å; S166-E170 PolarHBondContact N-OE2 2.87Å; S166-E170 PolarHBondContact OG-OE2 3.32Å; S167-E170 PolarHBondContact N-OE2 2.83Å; S167-E170 VanDerWaalsContact N-OE2 3.08Å; S167-E170 PolarHBondContact OG-N 3.32Å; E170-T173 WeakPolarHBondContact O-CB 3.42Å; E170-T173 PolarHBondContact O-N 3.35Å; E170-L174 PolarHBondContact O-N 3.15Å
171	L	94.8	Very high	93.8	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-67.9	-37.7	177.4	-166.8	65.2	0	0	0	111.9	L165 S167 E168 E169 T173 L174 D175 I210 M211 V215 F219 F235	L165-L171 HydrophobicContact CD1-CB 4.3Å; L165-L171 HydrophobicContact CD1-CD1 3.85Å; S167-L171 PolarHBondContact O-N 2.9Å; E168-L171 PolarHBondContact O-N 2.66Å; E169-L171 VanDerWaalsContact C-N 3.31Å; E169-L171 PolarHBondContact O-N 2.97Å; L171-T173 VanDerWaalsContact C-N 3.34Å; L171-L174 HydrophobicContact CD1-CD2 4.38Å; L171-L174 WeakPolarHBondContact O-CB 3.4Å; L171-L174 PolarHBondContact O-N 3.42Å; L171-D175 PolarHBondContact O-N 3.49Å; L171-I210 HydrophobicContact CD1-CG2 3.91Å; L171-M211 HydrophobicContact CD2-SD 4.4Å; L171-V215 HydrophobicContact CD2-CG1 3.99Å; L171-F219 HydrophobicContact CD2-CE2 3.56Å; L171-F219 HydrophobicContact CD2-CZ 3.46Å; L171-F219 VanDerWaalsContact CD2-CZ 3.46Å; L171-F235 HydrophobicContact CD1-CD1 3.95Å; L171-F235 HydrophobicContact CD1-CE1 3.52Å; L171-F235 HydrophobicContact CD1-CE2 4.37Å; L171-F235 HydrophobicContact CD1-CZ 3.74Å; L171-F235 HydrophobicContact CD2-CE1 3.86Å; L171-F235 HydrophobicContact CD2-CZ 3.95Å; L171-F235 HydrophobicContact CG-CD1 4.34Å; L171-F235 HydrophobicContact CG-CE1 3.66Å; L171-F235 HydrophobicContact CG-CZ 4.13Å
172	G	94.6	Very high	94.3	Very high	35 Å²	35	59.1 Å²	59.1	36%	0.361	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-38.9	172	0	0	0	0	0	112.7	E168 E169 D175 A176	E168-G172 PolarHBondContact O-N 3.28Å; E169-G172 PolarHBondContact O-N 3.31Å; G172-D175 PolarHBondContact O-N 2.74Å; G172-A176 WeakPolarHBondContact O-CB 3.42Å; G172-A176 PolarHBondContact O-N 3.42Å
173	T	94.4	Very high	94.6	Very high	58 Å²	58	52.8 Å²	52.8	36%	0.356	29%	0.289	S	S	.	.	H	α-helix	trans	-63.1	-44.9	174.5	-55.7	0	0	0	0	110.9	E169 E170 L171 D175 A176 C177	E169-T173 WeakPolarHBondContact O-CB 3.45Å; E169-T173 PolarHBondContact O-N 3.37Å; E169-T173 PolarHBondContact O-OG1 3.18Å; E170-T173 WeakPolarHBondContact O-CB 3.42Å; E170-T173 PolarHBondContact O-N 3.35Å; L171-T173 VanDerWaalsContact C-N 3.34Å; T173-D175 PolarHBondContact O-N 2.96Å; T173-A176 PolarHBondContact O-N 2.96Å; T173-C177 PolarHBondContact O-N 2.85Å; T173-C177 PolarHBondContact O-SG 3.5Å
174	L	95.1	Very high	94.7	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-56.9	-50.5	173.4	178.1	58.1	0	0	0	110.7	F154 Q161 F163 L165 E170 L171 A176 C177 L178 F187 I210 F235	F154-L174 HydrophobicContact CD1-CD1 4.07Å; F154-L174 HydrophobicContact CE1-CD1 3.84Å; Q161-L174 VanDerWaalsContact NE2-CA 3.29Å; Q161-L174 VanDerWaalsContact NE2-N 3.12Å; F163-L174 HydrophobicContact CE1-CD2 4.12Å; F163-L174 HydrophobicContact CZ-CD2 4.07Å; L165-L174 HydrophobicContact CD1-CB 4.22Å; L165-L174 HydrophobicContact CD1-CD2 4.05Å; E170-L174 PolarHBondContact O-N 3.15Å; L171-L174 HydrophobicContact CD1-CD2 4.38Å; L171-L174 WeakPolarHBondContact O-CB 3.4Å; L171-L174 PolarHBondContact O-N 3.42Å; L174-A176 VanDerWaalsContact C-N 3.29Å; L174-A176 PolarHBondContact O-N 3.42Å; L174-C177 PolarHBondContact O-N 3.45Å; L174-L178 HydrophobicContact CD1-CD1 4.11Å; L174-L178 HydrophobicContact CD1-CD2 4.49Å; L174-L178 HydrophobicContact CD1-CG 4.17Å; L174-L178 HydrophobicContact CG-CD1 4.07Å; L174-L178 VanDerWaalsContact O-CG 3.28Å; L174-L178 WeakPolarHBondContact O-CG 3.48Å; L174-L178 PolarHBondContact O-N 2.84Å; L174-L178 VanDerWaalsContact O-N 3.15Å; L174-F187 HydrophobicContact CD1-CD2 4.17Å; L174-F187 HydrophobicContact CD1-CE2 4Å; L174-F187 HydrophobicContact CD2-CE2 4.07Å; L174-F187 HydrophobicContact CD2-CZ 4.17Å; L174-I210 HydrophobicContact CD2-CG2 4.21Å; L174-F235 HydrophobicContact CD2-CB 4.12Å; L174-F235 HydrophobicContact CD2-CG 4.46Å; L174-F235 HydrophobicContact CG-CB 4.4Å
175	D	95.5	Very high	94.7	Very high	22 Å²	22	57.4 Å²	57.4	12%	0.118	31%	0.305	C	S	.	.	H	α-helix	trans	-60.7	-40	-177.3	-148.4	74.4	0	0	0	112.1	L171 G172 T173 L178 C233 R234 F235	L171-D175 PolarHBondContact O-N 3.49Å; G172-D175 PolarHBondContact O-N 2.74Å; T173-D175 PolarHBondContact O-N 2.96Å; D175-L178 PolarHBondContact O-N 3.36Å; D175-C233 WeakPolarHBondContact OD1-CA 3.34Å; D175-R234 WeakPolarHBondContact O-CD 3.32Å; D175-R234 WeakPolarHBondContact OD1-CA 3.45Å; D175-R234 WeakPolarHBondContact OD1-CB 3.33Å; D175-R234 PolarHBondContact OD1-N 2.93Å; D175-R234 PolarHBondContact OD2-N 3.47Å; D175-R234 IonicContact OD2-NH1 2.91Å; D175-R234 PolarHBondContact OD2-NH1 3.44Å; D175-F235 WeakPolarHBondContact OD1-CD1 3.48Å; D175-F235 PolarHBondContact OD1-N 2.86Å
176	A	95.2	Very high	94.5	Very high	57 Å²	57	62.5 Å²	62.5	47%	0.471	32%	0.324	S	S	.	.	H	α-helix	trans	-64.8	-45.7	175.9	0	0	0	0	0	112.3	G172 T173 L174 L178 E179	G172-A176 WeakPolarHBondContact O-CB 3.42Å; G172-A176 PolarHBondContact O-N 3.42Å; T173-A176 PolarHBondContact O-N 2.96Å; L174-A176 VanDerWaalsContact C-N 3.29Å; L174-A176 PolarHBondContact O-N 3.42Å; A176-L178 PolarHBondContact O-N 2.88Å; A176-E179 VanDerWaalsContact O-CB 3.24Å; A176-E179 WeakPolarHBondContact O-CB 3.33Å; A176-E179 PolarHBondContact O-N 3.48Å
177	C	94.5	Very high	94.5	Very high	9 Å²	9	59.8 Å²	59.8	6%	0.061	31%	0.305	C	S	.	.	H	α-helix	trans	-63.5	-30.2	179	-58.9	0	0	0	0	113.1	C156 T173 L174 E179 Q180 V183	C156-C177 HydrophobicContact CB-CB 4.09Å; C156-C177 WeakPolarHBondContact CB-SG 3.34Å; C156-C177 WeakPolarHBondContact SG-CB 3.35Å; C156-C177 CovalentContact SG-SG 2.02Å; C156-C177 PolarHBondContact SG-SG 2.81Å; T173-C177 PolarHBondContact O-N 2.85Å; T173-C177 PolarHBondContact O-SG 3.5Å; L174-C177 PolarHBondContact O-N 3.45Å; C177-E179 PolarHBondContact O-N 3.11Å; C177-E179 VanDerWaalsContact O-N 3.16Å; C177-Q180 WeakPolarHBondContact O-CB 3.4Å; C177-Q180 PolarHBondContact O-N 3.41Å; C177-V183 HydrophobicContact CB-CG1 3.97Å
178	L	95.8	Very high	94.5	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-4.6	-179.9	-67.8	174.2	0	0	0	113.9	L174 D175 A176 Q180 V183 R184 F187 R234 F235	L174-L178 HydrophobicContact CD1-CD1 4.11Å; L174-L178 HydrophobicContact CD1-CD2 4.49Å; L174-L178 HydrophobicContact CD1-CG 4.17Å; L174-L178 HydrophobicContact CG-CD1 4.07Å; L174-L178 VanDerWaalsContact O-CG 3.28Å; L174-L178 WeakPolarHBondContact O-CG 3.48Å; L174-L178 PolarHBondContact O-N 2.84Å; L174-L178 VanDerWaalsContact O-N 3.15Å; D175-L178 PolarHBondContact O-N 3.36Å; A176-L178 PolarHBondContact O-N 2.88Å; L178-Q180 VanDerWaalsContact C-N 3.28Å; L178-V183 HydrophobicContact CD2-CG1 4.41Å; L178-R184 HydrophobicContact CD2-CB 4.34Å; L178-R184 PolarHBondContact O-NH1 3.41Å; L178-R184 VanDerWaalsContact O-NH1 3.11Å; L178-F187 HydrophobicContact CD1-CD1 3.99Å; L178-F187 HydrophobicContact CD1-CE1 4.02Å; L178-F187 HydrophobicContact CD1-CG 4.47Å; L178-F187 HydrophobicContact CD2-CB 3.48Å; L178-F187 VanDerWaalsContact CD2-CB 3.48Å; L178-F187 HydrophobicContact CD2-CD1 3.7Å; L178-F187 HydrophobicContact CD2-CD2 4.31Å; L178-F187 HydrophobicContact CD2-CG 3.59Å; L178-R234 HydrophobicContact CB-CB 4.29Å; L178-F235 VanDerWaalsContact CD1-CA 3.42Å; L178-F235 HydrophobicContact CD1-CB 3.46Å; L178-F235 VanDerWaalsContact CD1-CB 3.46Å
179	E	95.6	Very high	94.3	Very high	123 Å²	123	59.1 Å²	59.1	58%	0.575	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-40	164.3	-173.4	161.1	-138.3	0	0	111.2	A176 C177 K181 R184	A176-E179 VanDerWaalsContact O-CB 3.24Å; A176-E179 WeakPolarHBondContact O-CB 3.33Å; A176-E179 PolarHBondContact O-N 3.48Å; C177-E179 PolarHBondContact O-N 3.11Å; C177-E179 VanDerWaalsContact O-N 3.16Å; E179-K181 PolarHBondContact O-N 3.32Å; E179-R184 PolarHBondContact O-NH1 3.39Å; E179-R184 VanDerWaalsContact O-NH1 3.15Å
180	Q	95.1	Very high	94.2	Very high	118 Å²	118	53.7 Å²	53.7	55%	0.551	28%	0.283	S	S	*	.	S	Bend	trans	-71.6	126.8	178.1	-58.2	-56.1	-42	0	0	110.8	C177 L178 D182 V183 R184	C177-Q180 WeakPolarHBondContact O-CB 3.4Å; C177-Q180 PolarHBondContact O-N 3.41Å; L178-Q180 VanDerWaalsContact C-N 3.28Å; Q180-D182 PolarHBondContact O-N 2.97Å; Q180-V183 HydrophobicContact CB-CB 4.27Å; Q180-V183 HydrophobicContact CB-CG2 3.95Å; Q180-V183 PolarHBondContact O-N 3.22Å; Q180-R184 WeakPolarHBondContact O-CB 3.45Å; Q180-R184 PolarHBondContact O-N 3.04Å
181	K	94.7	Very high	94.2	Very high	130 Å²	130	50.3 Å²	50.3	57%	0.565	27%	0.267	S	S	*	.	H	α-helix	trans	-58.8	-46.6	-175.4	-178.2	178.5	176.8	-170	0	112.5	E179 V183 R184 D185	E179-K181 PolarHBondContact O-N 3.32Å; K181-V183 VanDerWaalsContact C-N 3.32Å; K181-V183 PolarHBondContact O-N 2.87Å; K181-R184 WeakPolarHBondContact O-CB 3.23Å; K181-R184 PolarHBondContact O-N 3.15Å; K181-R184 VanDerWaalsContact O-N 3.16Å; K181-D185 VanDerWaalsContact O-CG 3.3Å; K181-D185 PolarHBondContact O-N 3.45Å
182	D	93.1	Very high	94	Very high	120 Å²	120	53.6 Å²	53.6	64%	0.642	29%	0.287	S	S	*	.	H	α-helix	trans	-66.3	-35.5	-176.7	-56	-44.1	0	0	0	112.4	Q180 R186	Q180-D182 PolarHBondContact O-N 2.97Å; D182-R186 WeakPolarHBondContact O-CG 3.39Å; D182-R186 PolarHBondContact O-N 3.16Å; D182-R186 VanDerWaalsContact O-N 3.11Å
183	V	93.5	Very high	93.8	Very high	11 Å²	11	57.5 Å²	57.5	7%	0.067	29%	0.291	C	S	.	.	H	α-helix	trans	-67.8	-44.3	174	-177.5	0	0	0	0	109.9	F154 C177 L178 Q180 K181 D185 R186 F187	F154-V183 HydrophobicContact CE1-CG1 3.87Å; F154-V183 HydrophobicContact CZ-CG1 3.62Å; C177-V183 HydrophobicContact CB-CG1 3.97Å; L178-V183 HydrophobicContact CD2-CG1 4.41Å; Q180-V183 HydrophobicContact CB-CB 4.27Å; Q180-V183 HydrophobicContact CB-CG2 3.95Å; Q180-V183 PolarHBondContact O-N 3.22Å; K181-V183 VanDerWaalsContact C-N 3.32Å; K181-V183 PolarHBondContact O-N 2.87Å; V183-D185 VanDerWaalsContact C-N 3.35Å; V183-D185 PolarHBondContact O-N 3.41Å; V183-R186 PolarHBondContact O-N 3.41Å; V183-F187 WeakPolarHBondContact O-CB 3.5Å; V183-F187 PolarHBondContact O-N 2.93Å
184	R	94.4	Very high	93.5	Very high	82 Å²	82	55.8 Å²	55.8	31%	0.309	28%	0.28	S	S	.	.	H	α-helix	trans	-60.4	-42.6	176.4	-175.1	174.5	60.2	-106.1	2.4	112.2	L178 E179 Q180 K181 F187 M188	L178-R184 HydrophobicContact CD2-CB 4.34Å; L178-R184 PolarHBondContact O-NH1 3.41Å; L178-R184 VanDerWaalsContact O-NH1 3.11Å; E179-R184 PolarHBondContact O-NH1 3.39Å; E179-R184 VanDerWaalsContact O-NH1 3.15Å; Q180-R184 WeakPolarHBondContact O-CB 3.45Å; Q180-R184 PolarHBondContact O-N 3.04Å; K181-R184 WeakPolarHBondContact O-CB 3.23Å; K181-R184 PolarHBondContact O-N 3.15Å; K181-R184 VanDerWaalsContact O-N 3.16Å; R184-F187 WeakPolarHBondContact O-CB 3.3Å; R184-F187 PolarHBondContact O-N 3.29Å; R184-M188 HydrophobicContact CG-CG 4.42Å; R184-M188 WeakPolarHBondContact O-CB 3.34Å; R184-M188 WeakPolarHBondContact O-CG 3.48Å; R184-M188 PolarHBondContact O-N 3.02Å
185	D	93.7	Very high	93.2	Very high	77 Å²	77	56.5 Å²	56.5	41%	0.412	28%	0.283	S	S	.	.	H	α-helix	trans	-66.6	-40.3	179.2	-68.4	-13.7	0	0	0	111.3	K181 V183 M188 A189	K181-D185 VanDerWaalsContact O-CG 3.3Å; K181-D185 PolarHBondContact O-N 3.45Å; V183-D185 VanDerWaalsContact C-N 3.35Å; V183-D185 PolarHBondContact O-N 3.41Å; D185-M188 PolarHBondContact O-N 3.34Å; D185-A189 WeakPolarHBondContact O-CB 3.34Å; D185-A189 PolarHBondContact O-N 2.97Å
186	R	92	Very high	92.9	Very high	108 Å²	108	59.6 Å²	59.6	41%	0.408	30%	0.3	S	S	.	.	H	α-helix	trans	-62.1	-41.8	170.9	-73	-171.7	-69.3	166.3	0.9	112.2	F154 D155 D182 V183 A189 M190	F154-R186 HydrophobicContact CE2-CB 4.2Å; D155-R186 PolarHBondContact O-NH2 3.21Å; D155-R186 IonicContact OD2-NH1 2.73Å; D155-R186 PolarHBondContact OD2-NH1 3.11Å; D182-R186 WeakPolarHBondContact O-CG 3.39Å; D182-R186 PolarHBondContact O-N 3.16Å; D182-R186 VanDerWaalsContact O-N 3.11Å; V183-R186 PolarHBondContact O-N 3.41Å; R186-A189 PolarHBondContact O-N 3.46Å; R186-M190 PolarHBondContact O-N 2.83Å
187	F	94.5	Very high	92.6	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.4	-46.7	177	-172.3	-111.6	0	0	0	111	F154 F163 L174 L178 V183 R184 A189 M190 L191 I210 F235 C238	F154-F187 HydrophobicContact CD1-CD2 4.46Å; F154-F187 HydrophobicContact CD2-CD2 4.31Å; F154-F187 HydrophobicContact CE1-CD2 4.13Å; F154-F187 HydrophobicContact CE2-CB 3.79Å; F154-F187 AromaticContact CE2-CD2 3.98Å; F154-F187 HydrophobicContact CE2-CD2 3.98Å; F154-F187 HydrophobicContact CE2-CG 4.4Å; F154-F187 HydrophobicContact CZ-CB 3.64Å; F154-F187 AromaticContact CZ-CD2 3.88Å; F154-F187 HydrophobicContact CZ-CD2 3.88Å; F154-F187 HydrophobicContact CZ-CG 4.22Å; F163-F187 HydrophobicContact CZ-CE2 4.1Å; L174-F187 HydrophobicContact CD1-CD2 4.17Å; L174-F187 HydrophobicContact CD1-CE2 4Å; L174-F187 HydrophobicContact CD2-CE2 4.07Å; L174-F187 HydrophobicContact CD2-CZ 4.17Å; L178-F187 HydrophobicContact CD1-CD1 3.99Å; L178-F187 HydrophobicContact CD1-CE1 4.02Å; L178-F187 HydrophobicContact CD1-CG 4.47Å; L178-F187 HydrophobicContact CD2-CB 3.48Å; L178-F187 VanDerWaalsContact CD2-CB 3.48Å; L178-F187 HydrophobicContact CD2-CD1 3.7Å; L178-F187 HydrophobicContact CD2-CD2 4.31Å; L178-F187 HydrophobicContact CD2-CG 3.59Å; V183-F187 WeakPolarHBondContact O-CB 3.5Å; V183-F187 PolarHBondContact O-N 2.93Å; R184-F187 WeakPolarHBondContact O-CB 3.3Å; R184-F187 PolarHBondContact O-N 3.29Å; F187-A189 VanDerWaalsContact C-N 3.34Å; F187-A189 PolarHBondContact O-N 3.4Å; F187-M190 HydrophobicContact CD2-CE 3.4Å; F187-M190 VanDerWaalsContact CD2-CE 3.4Å; F187-M190 HydrophobicContact CE2-CE 3.33Å; F187-M190 HydrophobicContact CG-CE 4.39Å; F187-M190 HydrophobicContact CZ-CE 4.29Å; F187-M190 WeakPolarHBondContact O-CB 3.24Å; F187-M190 PolarHBondContact O-N 3.33Å; F187-M190 VanDerWaalsContact O-N 3.13Å; F187-L191 HydrophobicContact CD1-CD1 3.71Å; F187-L191 HydrophobicContact CD1-CG 4.18Å; F187-L191 HydrophobicContact CE1-CD1 3.51Å; F187-L191 HydrophobicContact CE1-CD2 4.22Å; F187-L191 HydrophobicContact CE1-CG 4.02Å; F187-L191 HydrophobicContact CZ-CD1 4.23Å; F187-L191 HydrophobicContact CZ-CD2 4.1Å; F187-L191 HydrophobicContact CZ-CG 4.31Å; F187-L191 VanDerWaalsContact O-CG 3.32Å; F187-L191 WeakPolarHBondContact O-CG 3.45Å; F187-L191 PolarHBondContact O-N 3.43Å; F187-I210 HydrophobicContact CZ-CD1 3.95Å; F187-I210 HydrophobicContact CZ-CG1 4.47Å; F187-F235 HydrophobicContact CE1-CB 4.03Å; F187-F235 HydrophobicContact CZ-CB 4.12Å; F187-C238 HydrophobicContact CD1-CB 3.78Å; F187-C238 HydrophobicContact CE1-CB 3.88Å
188	M	94.2	Very high	92.6	Very high	30 Å²	30	65.4 Å²	65.4	15%	0.148	32%	0.322	C	S	.	.	H	α-helix	trans	-58.1	-44.4	175.8	-71.4	-69.8	-70	0	0	112	R184 D185 M190 L191 T192 C238 A242	R184-M188 HydrophobicContact CG-CG 4.42Å; R184-M188 WeakPolarHBondContact O-CB 3.34Å; R184-M188 WeakPolarHBondContact O-CG 3.48Å; R184-M188 PolarHBondContact O-N 3.02Å; D185-M188 PolarHBondContact O-N 3.34Å; M188-M190 VanDerWaalsContact C-N 3.32Å; M188-M190 PolarHBondContact O-N 3.32Å; M188-L191 WeakPolarHBondContact O-CB 3.25Å; M188-L191 PolarHBondContact O-N 3.13Å; M188-L191 HydrophobicContact SD-CD1 4.33Å; M188-T192 PolarHBondContact O-N 3.36Å; M188-T192 PolarHBondContact O-OG1 3.09Å; M188-T192 VanDerWaalsContact O-OG1 3.07Å; M188-C238 HydrophobicContact SD-CB 3.61Å; M188-A242 HydrophobicContact CE-CB 3.79Å; M188-A242 HydrophobicContact SD-CB 4.07Å
189	A	91.6	Very high	92.6	Very high	55 Å²	55	66 Å²	66	46%	0.455	33%	0.326	S	S	.	.	H	α-helix	trans	-62.7	-37.7	176	0	0	0	0	0	112.6	D185 R186 F187 R193	D185-A189 WeakPolarHBondContact O-CB 3.34Å; D185-A189 PolarHBondContact O-N 2.97Å; R186-A189 PolarHBondContact O-N 3.46Å; F187-A189 VanDerWaalsContact C-N 3.34Å; F187-A189 PolarHBondContact O-N 3.4Å; A189-R193 WeakPolarHBondContact O-CG 3.44Å; A189-R193 PolarHBondContact O-N 3.37Å
190	M	92	Very high	92.6	Very high	16 Å²	16	64 Å²	64	8%	0.079	32%	0.315	C	S	.	.	H	α-helix	trans	-64	-45.7	172.7	177.8	-86.9	-72.5	0	0	111.1	F154 F163 R186 F187 M188 T192 R193 L194 Y209	F154-M190 HydrophobicContact CD2-CE 4.44Å; F163-M190 HydrophobicContact CD2-CE 4.48Å; F163-M190 HydrophobicContact CE2-CE 3.76Å; F163-M190 HydrophobicContact CZ-CE 4.3Å; R186-M190 PolarHBondContact O-N 2.83Å; F187-M190 HydrophobicContact CD2-CE 3.4Å; F187-M190 VanDerWaalsContact CD2-CE 3.4Å; F187-M190 HydrophobicContact CE2-CE 3.33Å; F187-M190 HydrophobicContact CG-CE 4.39Å; F187-M190 HydrophobicContact CZ-CE 4.29Å; F187-M190 WeakPolarHBondContact O-CB 3.24Å; F187-M190 PolarHBondContact O-N 3.33Å; F187-M190 VanDerWaalsContact O-N 3.13Å; M188-M190 VanDerWaalsContact C-N 3.32Å; M188-M190 PolarHBondContact O-N 3.32Å; M190-T192 PolarHBondContact O-N 3.09Å; M190-R193 WeakPolarHBondContact O-CB 3.42Å; M190-R193 PolarHBondContact O-N 3.24Å; M190-L194 PolarHBondContact O-N 3.07Å; M190-L194 HydrophobicContact SD-CD1 3.42Å; M190-L194 WeakPolarHBondContact SD-CD1 3.49Å; M190-L194 HydrophobicContact SD-CG 4.2Å; M190-Y209 HydrophobicContact SD-CE1 3.99Å
191	L	94.3	Very high	92.7	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-45.4	177.1	-66.8	177.1	0	0	0	112.3	F187 M188 R193 L194 M195 I206 I210 C238 V239 A242	F187-L191 HydrophobicContact CD1-CD1 3.71Å; F187-L191 HydrophobicContact CD1-CG 4.18Å; F187-L191 HydrophobicContact CE1-CD1 3.51Å; F187-L191 HydrophobicContact CE1-CD2 4.22Å; F187-L191 HydrophobicContact CE1-CG 4.02Å; F187-L191 HydrophobicContact CZ-CD1 4.23Å; F187-L191 HydrophobicContact CZ-CD2 4.1Å; F187-L191 HydrophobicContact CZ-CG 4.31Å; F187-L191 VanDerWaalsContact O-CG 3.32Å; F187-L191 WeakPolarHBondContact O-CG 3.45Å; F187-L191 PolarHBondContact O-N 3.43Å; M188-L191 WeakPolarHBondContact O-CB 3.25Å; M188-L191 PolarHBondContact O-N 3.13Å; M188-L191 HydrophobicContact SD-CD1 4.33Å; L191-R193 PolarHBondContact O-N 3.41Å; L191-R193 VanDerWaalsContact O-N 3.12Å; L191-L194 PolarHBondContact O-N 2.92Å; L191-M195 WeakPolarHBondContact O-CG 3.26Å; L191-M195 PolarHBondContact O-N 3.48Å; L191-I206 HydrophobicContact CD2-CG2 3.59Å; L191-I210 HydrophobicContact CD2-CD1 4.33Å; L191-C238 HydrophobicContact CD1-CB 4.1Å; L191-V239 HydrophobicContact CD1-CB 4.47Å; L191-V239 HydrophobicContact CD1-CG2 3.87Å; L191-V239 HydrophobicContact CD2-CG2 4.02Å; L191-A242 HydrophobicContact CB-CB 4.03Å; L191-A242 HydrophobicContact CD1-CB 4.27Å
192	T	91	Very high	92.8	Very high	73 Å²	73	54.6 Å²	54.6	45%	0.448	28%	0.277	S	S	.	.	H	α-helix	trans	-55.8	-32.8	179	-58	0	0	0	0	112.7	M188 M190	M188-T192 PolarHBondContact O-N 3.36Å; M188-T192 PolarHBondContact O-OG1 3.09Å; M188-T192 VanDerWaalsContact O-OG1 3.07Å; M190-T192 PolarHBondContact O-N 3.09Å
193	R	88.7	Confident	93	Very high	117 Å²	117	48.9 Å²	48.9	44%	0.442	25%	0.247	S	C	.	.	H	α-helix	trans	-76.6	-22.3	178.1	-68.5	166.2	45.7	-173.8	-7.6	114.1	A189 M190 L191	A189-R193 WeakPolarHBondContact O-CG 3.44Å; A189-R193 PolarHBondContact O-N 3.37Å; M190-R193 WeakPolarHBondContact O-CB 3.42Å; M190-R193 PolarHBondContact O-N 3.24Å; L191-R193 PolarHBondContact O-N 3.41Å; L191-R193 VanDerWaalsContact O-N 3.12Å
194	L	89.5	Confident	93.2	Very high	23 Å²	23	52.4 Å²	52.4	12%	0.12	26%	0.259	C	S	.	.	H	α-helix	trans	-86.7	-14.1	-177.9	-69.3	177.1	0	0	0	113.3	M190 L191 Y205 I206 Y209	M190-L194 PolarHBondContact O-N 3.07Å; M190-L194 HydrophobicContact SD-CD1 3.42Å; M190-L194 WeakPolarHBondContact SD-CD1 3.49Å; M190-L194 HydrophobicContact SD-CG 4.2Å; L191-L194 PolarHBondContact O-N 2.92Å; L194-Y205 HydrophobicContact CB-CD1 4.39Å; L194-Y205 HydrophobicContact CB-CE1 4.02Å; L194-Y205 HydrophobicContact CD2-CE1 4.09Å; L194-Y205 VanDerWaalsContact O-CD1 3.26Å; L194-Y205 WeakPolarHBondContact O-CD1 3.36Å; L194-Y205 VanDerWaalsContact O-CE1 3.29Å; L194-Y205 WeakPolarHBondContact O-CE1 3.2Å; L194-I206 HydrophobicContact CB-CG1 4.26Å; L194-Y209 HydrophobicContact CD1-CD1 3.43Å; L194-Y209 VanDerWaalsContact CD1-CD1 3.43Å; L194-Y209 HydrophobicContact CD1-CD2 4.14Å; L194-Y209 HydrophobicContact CD1-CE1 3.63Å; L194-Y209 HydrophobicContact CD1-CE2 4.32Å; L194-Y209 HydrophobicContact CD1-CG 3.69Å; L194-Y209 HydrophobicContact CD2-CD2 4.05Å; L194-Y209 HydrophobicContact CD2-CE2 3.87Å; L194-Y209 HydrophobicContact CD2-CG 4.43Å
195	M	89	Confident	93.3	Very high	14 Å²	14	54 Å²	54	7%	0.069	27%	0.266	C	S	.	.			trans	-75.7	143.6	-171.8	-65.6	160.8	85.3	0	0	112.2	L191 I206 A242 L243 R246 F247	L191-M195 WeakPolarHBondContact O-CG 3.26Å; L191-M195 PolarHBondContact O-N 3.48Å; M195-I206 HydrophobicContact CG-CD1 3.74Å; M195-A242 WeakPolarHBondContact CE-O 3.26Å; M195-A242 HydrophobicContact SD-CB 4.45Å; M195-L243 HydrophobicContact CE-CB 4.13Å; M195-L243 HydrophobicContact CE-CD2 3.41Å; M195-L243 VanDerWaalsContact CE-CD2 3.41Å; M195-L243 HydrophobicContact CE-CG 3.87Å; M195-L243 HydrophobicContact CG-CD2 4.37Å; M195-R246 VanDerWaalsContact C-NH1 3.3Å; M195-R246 HydrophobicContact CE-CB 3.46Å; M195-R246 VanDerWaalsContact CE-CB 3.46Å; M195-R246 HydrophobicContact CE-CG 4.08Å; M195-R246 PolarHBondContact O-NH1 3.22Å; M195-R246 HydrophobicContact SD-CB 4.33Å; M195-F247 HydrophobicContact CE-CD2 4.2Å; M195-F247 HydrophobicContact CE-CE2 3.88Å
196	D	88.5	Confident	93.5	Very high	88 Å²	88	50.4 Å²	50.4	47%	0.471	25%	0.246	S	C	.	.			trans	-97.9	-171.8	173.1	-157.8	-7.6	0	0	0	110	S202 R246 F247	D196-S202 PolarHBondContact N-OG 2.9Å; D196-S202 PolarHBondContact O-OG 3.12Å; D196-R246 PolarHBondContact O-NH2 3.41Å; D196-R246 VanDerWaalsContact O-NH2 3.12Å; D196-F247 VanDerWaalsContact O-CZ 3.29Å; D196-F247 WeakPolarHBondContact O-CZ 3.16Å
197	D	89.2	Confident	93.8	Very high	132 Å²	132	45.2 Å²	45.2	71%	0.706	23%	0.227	S	C	*	.	S	Bend	trans	-85.8	-1.1	-178.6	-67.7	-26.5	0	0	0	114.4	R246 F247	D197-R246 IonicContact OD1-NH2 3.82Å; D197-R246 PolarHBondContact OD1-NH2 2.98Å; D197-F247 WeakPolarHBondContact O-CE1 3.36Å
198	D	94.3	Very high	93.9	Very high	56 Å²	56	47.7 Å²	47.7	30%	0.299	24%	0.244	S	C	.	.	S	Bend	trans	-117.3	130.2	174.9	170.5	64.3	0	0	0	111.7	K200 T201 S202	D198-K200 PolarHBondContact O-N 3.44Å; D198-K200 PolarHBondContact OD2-N 2.93Å; D198-T201 PolarHBondContact O-N 3.4Å; D198-T201 WeakPolarHBondContact OD2-CB 3.17Å; D198-T201 PolarHBondContact OD2-N 3.11Å; D198-T201 PolarHBondContact OD2-OG1 2.86Å; D198-S202 VanDerWaalsContact O-CB 3.25Å; D198-S202 WeakPolarHBondContact O-CB 3.28Å; D198-S202 PolarHBondContact O-N 3.37Å; D198-S202 PolarHBondContact O-OG 3.49Å
199	P	95.4	Very high	93.9	Very high	14 Å²	14	47.6 Å²	47.6	9%	0.091	24%	0.242	C	C	.	.	H	α-helix	trans	-63.7	-38.7	-177.5	21.9	-33.5	0	0	0	113.3	M203 F247 L257 L260 Y261	P199-M203 WeakPolarHBondContact O-CB 3.25Å; P199-M203 PolarHBondContact O-N 3.48Å; P199-F247 HydrophobicContact CB-CD2 3.92Å; P199-F247 HydrophobicContact CB-CE2 4.07Å; P199-F247 HydrophobicContact CB-CG 4.16Å; P199-F247 HydrophobicContact CB-CZ 4.42Å; P199-L257 HydrophobicContact CB-CD2 4.42Å; P199-L260 HydrophobicContact CG-CD1 4.04Å; P199-Y261 HydrophobicContact CB-CE1 3.84Å
200	K	96.6	Very high	94.2	Very high	79 Å²	79	45 Å²	45	34%	0.343	22%	0.22	S	C	.	.	H	α-helix	trans	-71.1	-42.7	-178.1	-72.1	-179.8	-78.2	-170.5	0	111.2	D198 M203 R204 L260 A264	D198-K200 PolarHBondContact O-N 3.44Å; D198-K200 PolarHBondContact OD2-N 2.93Å; K200-M203 PolarHBondContact O-N 3.31Å; K200-R204 WeakPolarHBondContact O-CG 3.48Å; K200-R204 PolarHBondContact O-N 3.48Å; K200-R204 VanDerWaalsContact O-N 3.17Å; K200-L260 HydrophobicContact CD-CD2 3.79Å; K200-L260 HydrophobicContact CG-CB 4.14Å; K200-L260 HydrophobicContact CG-CD2 4.14Å; K200-A264 HydrophobicContact CB-CB 4.14Å; K200-A264 HydrophobicContact CG-CB 4.21Å
201	T	96	Very high	94.4	Very high	51 Å²	51	44.2 Å²	44.2	31%	0.313	22%	0.217	S	C	.	.	H	α-helix	trans	-68.9	-42.3	178.6	-58.4	0	0	0	0	110.8	D198 M203 R204 Y205	D198-T201 PolarHBondContact O-N 3.4Å; D198-T201 WeakPolarHBondContact OD2-CB 3.17Å; D198-T201 PolarHBondContact OD2-N 3.11Å; D198-T201 PolarHBondContact OD2-OG1 2.86Å; T201-M203 PolarHBondContact O-N 2.99Å; T201-R204 PolarHBondContact O-N 3.42Å; T201-R204 PolarHBondContact OG1-NH2 3.21Å; T201-R204 VanDerWaalsContact OG1-NH2 3.13Å; T201-Y205 VanDerWaalsContact O-CB 3.28Å; T201-Y205 WeakPolarHBondContact O-CB 3.39Å; T201-Y205 PolarHBondContact O-N 3.07Å
202	S	97.2	Very high	94.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59	-46.2	173.6	-62.1	0	0	0	0	112.1	D196 D198 R204 Y205 I206 L243	D196-S202 PolarHBondContact N-OG 2.9Å; D196-S202 PolarHBondContact O-OG 3.12Å; D198-S202 VanDerWaalsContact O-CB 3.25Å; D198-S202 WeakPolarHBondContact O-CB 3.28Å; D198-S202 PolarHBondContact O-N 3.37Å; D198-S202 PolarHBondContact O-OG 3.49Å; S202-R204 PolarHBondContact O-N 2.86Å; S202-Y205 PolarHBondContact O-N 2.84Å; S202-I206 WeakPolarHBondContact O-CB 3.31Å; S202-I206 VanDerWaalsContact O-CG1 3.23Å; S202-I206 WeakPolarHBondContact O-CG1 3.27Å; S202-I206 PolarHBondContact O-N 2.96Å; S202-L243 VanDerWaalsContact CB-CD2 3.47Å
203	M	97.8	Very high	94.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.9	-51.5	176.6	178.7	58.4	86	0	0	111.8	P199 K200 T201 Y205 I206 L207 Y236 V239 R240 L243 Y261 A264	P199-M203 WeakPolarHBondContact O-CB 3.25Å; P199-M203 PolarHBondContact O-N 3.48Å; K200-M203 PolarHBondContact O-N 3.31Å; T201-M203 PolarHBondContact O-N 2.99Å; M203-Y205 VanDerWaalsContact C-N 3.35Å; M203-Y205 PolarHBondContact O-N 3.38Å; M203-I206 PolarHBondContact O-N 3.25Å; M203-L207 HydrophobicContact CG-CD1 4.27Å; M203-L207 WeakPolarHBondContact O-CG 3.29Å; M203-L207 PolarHBondContact O-N 3.22Å; M203-L207 HydrophobicContact SD-CD1 4.12Å; M203-L207 HydrophobicContact SD-CG 4.18Å; M203-Y236 HydrophobicContact CE-CE2 4.09Å; M203-Y236 HydrophobicContact SD-CE2 4.19Å; M203-V239 HydrophobicContact CE-CG1 4Å; M203-V239 HydrophobicContact SD-CG1 3.61Å; M203-R240 HydrophobicContact CE-CG 4.07Å; M203-L243 HydrophobicContact CB-CD1 3.99Å; M203-L243 HydrophobicContact CE-CD1 3.37Å; M203-L243 HydrophobicContact SD-CD1 3.9Å; M203-Y261 HydrophobicContact CE-CD1 4.06Å; M203-Y261 HydrophobicContact CE-CG 3.83Å; M203-A264 HydrophobicContact CB-CB 4.02Å; M203-A264 HydrophobicContact CG-CB 3.99Å
204	R	97.5	Very high	95.2	Very high	86 Å²	86	44 Å²	44	33%	0.325	22%	0.216	S	C	.	.	H	α-helix	trans	-63.9	-39.7	180	-67.2	-176.7	-62	-139.5	-2.6	112.6	K200 T201 S202 S208 A264 Y268	K200-R204 WeakPolarHBondContact O-CG 3.48Å; K200-R204 PolarHBondContact O-N 3.48Å; K200-R204 VanDerWaalsContact O-N 3.17Å; T201-R204 PolarHBondContact O-N 3.42Å; T201-R204 PolarHBondContact OG1-NH2 3.21Å; T201-R204 VanDerWaalsContact OG1-NH2 3.13Å; S202-R204 PolarHBondContact O-N 2.86Å; R204-S208 WeakPolarHBondContact O-CB 3.4Å; R204-S208 PolarHBondContact O-N 3.37Å; R204-S208 PolarHBondContact O-OG 3.12Å; R204-A264 HydrophobicContact CG-CB 4.34Å; R204-Y268 HydrophobicContact CB-CD2 4.4Å
205	Y	96.7	Very high	95.5	Very high	116 Å²	116	43 Å²	43	46%	0.455	21%	0.211	S	C	.	.	H	α-helix	trans	-63.9	-48	178.6	178.1	-102.5	0	0	0	110.9	L194 T201 S202 M203 L207 S208 Y209	L194-Y205 HydrophobicContact CB-CD1 4.39Å; L194-Y205 HydrophobicContact CB-CE1 4.02Å; L194-Y205 HydrophobicContact CD2-CE1 4.09Å; L194-Y205 VanDerWaalsContact O-CD1 3.26Å; L194-Y205 WeakPolarHBondContact O-CD1 3.36Å; L194-Y205 VanDerWaalsContact O-CE1 3.29Å; L194-Y205 WeakPolarHBondContact O-CE1 3.2Å; T201-Y205 VanDerWaalsContact O-CB 3.28Å; T201-Y205 WeakPolarHBondContact O-CB 3.39Å; T201-Y205 PolarHBondContact O-N 3.07Å; S202-Y205 PolarHBondContact O-N 2.84Å; M203-Y205 VanDerWaalsContact C-N 3.35Å; M203-Y205 PolarHBondContact O-N 3.38Å; Y205-L207 PolarHBondContact O-N 3.28Å; Y205-S208 CarbonylContact O-C 3.59Å; Y205-S208 WeakPolarHBondContact O-CB 3.37Å; Y205-S208 PolarHBondContact O-N 2.77Å; Y205-S208 VanDerWaalsContact O-N 3.17Å; Y205-Y209 WeakPolarHBondContact O-CB 3.46Å; Y205-Y209 PolarHBondContact O-N 3.45Å
206	I	97.1	Very high	96	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.1	-43.5	178.5	-70.1	167.5	0	0	0	111.4	L191 L194 M195 S202 M203 S208 Y209 I210 V239 L243	L191-I206 HydrophobicContact CD2-CG2 3.59Å; L194-I206 HydrophobicContact CB-CG1 4.26Å; M195-I206 HydrophobicContact CG-CD1 3.74Å; S202-I206 WeakPolarHBondContact O-CB 3.31Å; S202-I206 VanDerWaalsContact O-CG1 3.23Å; S202-I206 WeakPolarHBondContact O-CG1 3.27Å; S202-I206 PolarHBondContact O-N 2.96Å; M203-I206 PolarHBondContact O-N 3.25Å; I206-S208 VanDerWaalsContact C-N 3.31Å; I206-S208 PolarHBondContact O-N 2.92Å; I206-Y209 WeakPolarHBondContact O-CB 3.49Å; I206-Y209 PolarHBondContact O-N 2.91Å; I206-Y209 VanDerWaalsContact O-N 3.13Å; I206-I210 HydrophobicContact CG2-CD1 3.68Å; I206-I210 HydrophobicContact CG2-CG1 4.36Å; I206-I210 WeakPolarHBondContact O-CG1 3.45Å; I206-I210 PolarHBondContact O-N 3.09Å; I206-V239 HydrophobicContact CB-CG1 4.33Å; I206-V239 HydrophobicContact CD1-CG1 4.29Å; I206-V239 HydrophobicContact CG2-CB 4.31Å; I206-V239 HydrophobicContact CG2-CG1 3.75Å; I206-V239 HydrophobicContact CG2-CG2 3.51Å; I206-L243 HydrophobicContact CD1-CD2 4.45Å
207	L	98.1	Very high	96.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63	-38.8	176	-66.2	175.9	0	0	0	112	M203 Y205 Y209 I210 M211 Y236 T265 Y268	M203-L207 HydrophobicContact CG-CD1 4.27Å; M203-L207 WeakPolarHBondContact O-CG 3.29Å; M203-L207 PolarHBondContact O-N 3.22Å; M203-L207 HydrophobicContact SD-CD1 4.12Å; M203-L207 HydrophobicContact SD-CG 4.18Å; Y205-L207 PolarHBondContact O-N 3.28Å; L207-Y209 VanDerWaalsContact C-N 3.27Å; L207-Y209 PolarHBondContact O-N 3.09Å; L207-I210 PolarHBondContact O-N 3.35Å; L207-M211 HydrophobicContact CB-CE 4.23Å; L207-M211 HydrophobicContact CD2-CE 3.92Å; L207-M211 WeakPolarHBondContact O-CG 3.36Å; L207-M211 PolarHBondContact O-N 3.22Å; L207-M211 VanDerWaalsContact O-N 3.11Å; L207-Y236 HydrophobicContact CD2-CD2 4.34Å; L207-T265 HydrophobicContact CD1-CG2 4.24Å; L207-Y268 HydrophobicContact CB-CD1 3.97Å; L207-Y268 HydrophobicContact CB-CD2 4.18Å; L207-Y268 HydrophobicContact CB-CE1 3.72Å; L207-Y268 HydrophobicContact CB-CE2 3.94Å; L207-Y268 HydrophobicContact CB-CG 4.2Å; L207-Y268 HydrophobicContact CD1-CD1 3.73Å; L207-Y268 HydrophobicContact CD1-CE1 4.27Å; L207-Y268 HydrophobicContact CD1-CG 3.94Å; L207-Y268 PolarHBondContact O-OH 3.28Å
208	S	96.7	Very high	96.8	Very high	51 Å²	51	37.1 Å²	37.1	36%	0.357	18%	0.18	S	C	.	.	H	α-helix	trans	-66.1	-31.4	174.4	-54.2	0	0	0	0	112.5	R204 Y205 I206 Y268	R204-S208 WeakPolarHBondContact O-CB 3.4Å; R204-S208 PolarHBondContact O-N 3.37Å; R204-S208 PolarHBondContact O-OG 3.12Å; Y205-S208 CarbonylContact O-C 3.59Å; Y205-S208 WeakPolarHBondContact O-CB 3.37Å; Y205-S208 PolarHBondContact O-N 2.77Å; Y205-S208 VanDerWaalsContact O-N 3.17Å; I206-S208 VanDerWaalsContact C-N 3.31Å; I206-S208 PolarHBondContact O-N 2.92Å; S208-Y268 WeakPolarHBondContact OG-CE2 3.45Å
209	Y	95.7	Very high	97	Very high	28 Å²	28	34.6 Å²	34.6	11%	0.11	17%	0.166	C	C	.	.	H	α-helix	trans	-71.6	-43.7	176.5	-173.7	-91.4	0	0	0	111.2	P151 R152 F163 P164 M190 L194 Y205 I206 L207	P151-Y209 PolarHBondContact O-OH 2.96Å; R152-Y209 VanDerWaalsContact CA-OH 3.26Å; R152-Y209 WeakPolarHBondContact CA-OH 3.22Å; R152-Y209 PolarHBondContact N-OH 3.46Å; F163-Y209 HydrophobicContact CB-CD1 4.09Å; F163-Y209 HydrophobicContact CB-CE1 3.68Å; F163-Y209 WeakPolarHBondContact CB-O 3.24Å; F163-Y209 HydrophobicContact CD2-CD1 4.31Å; F163-Y209 AromaticContact CD2-CE1 3.59Å; F163-Y209 HydrophobicContact CD2-CE1 3.59Å; F163-Y209 HydrophobicContact CE2-CE1 4.38Å; F163-Y209 HydrophobicContact CG-CD1 4.09Å; F163-Y209 AromaticContact CG-CE1 3.71Å; F163-Y209 HydrophobicContact CG-CE1 3.71Å; P164-Y209 WeakPolarHBondContact CA-O 3.45Å; P164-Y209 WeakPolarHBondContact CB-O 3.42Å; M190-Y209 HydrophobicContact SD-CE1 3.99Å; L194-Y209 HydrophobicContact CD1-CD1 3.43Å; L194-Y209 VanDerWaalsContact CD1-CD1 3.43Å; L194-Y209 HydrophobicContact CD1-CD2 4.14Å; L194-Y209 HydrophobicContact CD1-CE1 3.63Å; L194-Y209 HydrophobicContact CD1-CE2 4.32Å; L194-Y209 HydrophobicContact CD1-CG 3.69Å; L194-Y209 HydrophobicContact CD2-CD2 4.05Å; L194-Y209 HydrophobicContact CD2-CE2 3.87Å; L194-Y209 HydrophobicContact CD2-CG 4.43Å; Y205-Y209 WeakPolarHBondContact O-CB 3.46Å; Y205-Y209 PolarHBondContact O-N 3.45Å; I206-Y209 WeakPolarHBondContact O-CB 3.49Å; I206-Y209 PolarHBondContact O-N 2.91Å; I206-Y209 VanDerWaalsContact O-N 3.13Å; L207-Y209 VanDerWaalsContact C-N 3.27Å; L207-Y209 PolarHBondContact O-N 3.09Å
210	I	96.3	Very high	97.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-72.4	-42.1	-175.6	-69.2	167.9	0	0	0	111.7	F163 L165 L171 L174 F187 L191 I206 L207 F235 V239	F163-I210 WeakPolarHBondContact CD1-O 3.19Å; F163-I210 HydrophobicContact CE1-CB 4.34Å; F163-I210 HydrophobicContact CE1-CG1 4.37Å; F163-I210 HydrophobicContact CE1-CG2 4.12Å; L165-I210 WeakPolarHBondContact CB-O 3.36Å; L165-I210 WeakPolarHBondContact CG-O 3.28Å; L165-I210 PolarHBondContact N-O 3.34Å; L171-I210 HydrophobicContact CD1-CG2 3.91Å; L174-I210 HydrophobicContact CD2-CG2 4.21Å; F187-I210 HydrophobicContact CZ-CD1 3.95Å; F187-I210 HydrophobicContact CZ-CG1 4.47Å; L191-I210 HydrophobicContact CD2-CD1 4.33Å; I206-I210 HydrophobicContact CG2-CD1 3.68Å; I206-I210 HydrophobicContact CG2-CG1 4.36Å; I206-I210 WeakPolarHBondContact O-CG1 3.45Å; I206-I210 PolarHBondContact O-N 3.09Å; L207-I210 PolarHBondContact O-N 3.35Å; I210-F235 HydrophobicContact CD1-CD2 4.03Å; I210-F235 HydrophobicContact CG2-CD2 4.23Å; I210-F235 HydrophobicContact CG2-CE2 4.23Å; I210-V239 HydrophobicContact CD1-CG2 3.78Å
211	M	96.8	Very high	97.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-139.5	142.9	-170.2	57	177.4	161.1	0	0	113.2	L171 L207 V215 A216 I230 Y268 F269	L171-M211 HydrophobicContact CD2-SD 4.4Å; L207-M211 HydrophobicContact CB-CE 4.23Å; L207-M211 HydrophobicContact CD2-CE 3.92Å; L207-M211 WeakPolarHBondContact O-CG 3.36Å; L207-M211 PolarHBondContact O-N 3.22Å; L207-M211 VanDerWaalsContact O-N 3.11Å; M211-V215 HydrophobicContact CB-CB 4.3Å; M211-V215 HydrophobicContact CB-CG1 4.4Å; M211-A216 HydrophobicContact CE-CB 4.35Å; M211-A216 HydrophobicContact CG-CB 4.32Å; M211-A216 HydrophobicContact SD-CB 3.95Å; M211-I230 HydrophobicContact CE-CD1 4.18Å; M211-Y268 HydrophobicContact CE-CE1 3.87Å; M211-F269 HydrophobicContact CE-CE1 3.67Å; M211-F269 HydrophobicContact CE-CZ 3.95Å
212	K	96.8	Very high	97.2	Very high	84 Å²	84	35.3 Å²	35.3	37%	0.365	17%	0.171	S	C	.	.			trans	-67.3	155.4	173.3	-70.7	-173.9	-174.8	171.8	0	111.1	P164 L165 E214 V215 A216	P164-K212 HydrophobicContact CB-CG 3.97Å; P164-K212 HydrophobicContact CG-CG 3.73Å; L165-K212 WeakPolarHBondContact O-CB 3.43Å; L165-K212 WeakPolarHBondContact O-CG 3.44Å; L165-K212 PolarHBondContact O-N 3.47Å; K212-E214 WeakPolarHBondContact CB-OE2 3.47Å; K212-E214 PolarHBondContact O-N 2.83Å; K212-E214 VanDerWaalsContact O-N 3.15Å; K212-V215 PolarHBondContact O-N 2.83Å; K212-A216 PolarHBondContact O-N 2.86Å
213	P	97.5	Very high	97.2	Very high	21 Å²	21	36.5 Å²	36.5	14%	0.136	18%	0.183	C	C	.	.	H	α-helix	trans	-52.4	-36.2	175.1	-26.8	34.9	0	0	0	113.5	V215 A216 I217 M272 V276	P213-V215 VanDerWaalsContact C-N 3.27Å; P213-V215 PolarHBondContact O-N 3.38Å; P213-A216 PolarHBondContact O-N 3.31Å; P213-I217 WeakPolarHBondContact O-CG2 3.34Å; P213-I217 PolarHBondContact O-N 3Å; P213-I217 VanDerWaalsContact O-N 3.15Å; P213-M272 HydrophobicContact CB-SD 3.98Å; P213-M272 HydrophobicContact CG-SD 3.89Å; P213-V276 HydrophobicContact CB-CG2 3.73Å
214	E	95.8	Very high	97.1	Very high	80 Å²	80	40.1 Å²	40.1	37%	0.374	21%	0.206	S	C	.	.	H	α-helix	trans	-62.9	-29.4	-179.8	-67.2	69.6	-152.7	0	0	113.2	K212 I217 R279	K212-E214 WeakPolarHBondContact CB-OE2 3.47Å; K212-E214 PolarHBondContact O-N 2.83Å; K212-E214 VanDerWaalsContact O-N 3.15Å; E214-I217 VanDerWaalsContact O-CG1 3.28Å; E214-I217 WeakPolarHBondContact O-CG1 3.47Å; E214-R279 IonicContact OE1-CZ 3.36Å; E214-R279 IonicContact OE1-NH1 3.27Å; E214-R279 PolarHBondContact OE1-NH1 2.88Å; E214-R279 IonicContact OE2-NH1 3.53Å
215	V	97.6	Very high	97	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.024	24%	0.235	C	C	.	.	H	α-helix	trans	-85.9	-42	172.9	-178.5	0	0	0	0	110.2	S166 L171 M211 K212 P213 I217 N218 F219	S166-V215 VanDerWaalsContact O-CG2 3.26Å; S166-V215 WeakPolarHBondContact O-CG2 3.4Å; L171-V215 HydrophobicContact CD2-CG1 3.99Å; M211-V215 HydrophobicContact CB-CB 4.3Å; M211-V215 HydrophobicContact CB-CG1 4.4Å; K212-V215 PolarHBondContact O-N 2.83Å; P213-V215 VanDerWaalsContact C-N 3.27Å; P213-V215 PolarHBondContact O-N 3.38Å; V215-I217 VanDerWaalsContact C-N 3.25Å; V215-I217 PolarHBondContact O-N 2.95Å; V215-N218 WeakPolarHBondContact O-CB 3.19Å; V215-N218 PolarHBondContact O-N 3.38Å; V215-N218 VanDerWaalsContact O-N 3.13Å; V215-F219 HydrophobicContact CG1-CE2 4.14Å; V215-F219 WeakPolarHBondContact O-CD2 3.48Å
216	A	98	Very high	96.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60	-31	-175.3	0	0	0	0	0	113.7	M211 K212 P213 N218 F219 Y268 F269 M272	M211-A216 HydrophobicContact CE-CB 4.35Å; M211-A216 HydrophobicContact CG-CB 4.32Å; M211-A216 HydrophobicContact SD-CB 3.95Å; K212-A216 PolarHBondContact O-N 2.86Å; P213-A216 PolarHBondContact O-N 3.31Å; A216-N218 PolarHBondContact O-N 3.22Å; A216-N218 VanDerWaalsContact O-N 3.17Å; A216-F219 PolarHBondContact O-N 2.87Å; A216-F219 VanDerWaalsContact O-N 3.15Å; A216-Y268 HydrophobicContact CB-CE1 3.9Å; A216-F269 HydrophobicContact CB-CD1 4.23Å; A216-F269 HydrophobicContact CB-CE1 4.19Å; A216-F269 WeakPolarHBondContact O-CD1 3.35Å; A216-F269 WeakPolarHBondContact O-CE1 3.43Å; A216-M272 HydrophobicContact CB-CB 4.02Å; A216-M272 HydrophobicContact CB-CG 3.75Å
217	I	97.2	Very high	96.9	Very high	44 Å²	44	44.6 Å²	44.6	23%	0.226	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-19.5	179	56	166.8	0	0	0	114.2	P213 E214 V215 F219 K227 R273 V276	P213-I217 WeakPolarHBondContact O-CG2 3.34Å; P213-I217 PolarHBondContact O-N 3Å; P213-I217 VanDerWaalsContact O-N 3.15Å; E214-I217 VanDerWaalsContact O-CG1 3.28Å; E214-I217 WeakPolarHBondContact O-CG1 3.47Å; V215-I217 VanDerWaalsContact C-N 3.25Å; V215-I217 PolarHBondContact O-N 2.95Å; I217-F219 PolarHBondContact O-N 3.29Å; I217-K227 VanDerWaalsContact O-CE 3.28Å; I217-K227 WeakPolarHBondContact O-CE 3.46Å; I217-K227 PolarHBondContact O-NZ 3.16Å; I217-R273 HydrophobicContact CG2-CB 4.41Å; I217-V276 HydrophobicContact CD1-CG1 4.28Å; I217-V276 HydrophobicContact CG2-CB 4.16Å; I217-V276 HydrophobicContact CG2-CG2 3.83Å
218	N	97.5	Very high	96.8	Very high	66 Å²	66	49.2 Å²	49.2	35%	0.353	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	0.4	179.2	-62	-20.6	0	0	0	112.9	V215 A216 K227 R228	V215-N218 WeakPolarHBondContact O-CB 3.19Å; V215-N218 PolarHBondContact O-N 3.38Å; V215-N218 VanDerWaalsContact O-N 3.13Å; A216-N218 PolarHBondContact O-N 3.22Å; A216-N218 VanDerWaalsContact O-N 3.17Å; N218-K227 CarbonylContact O-C 3.58Å; N218-K227 WeakPolarHBondContact O-CA 3.33Å; N218-K227 WeakPolarHBondContact O-CB 3.44Å; N218-R228 PolarHBondContact O-N 2.65Å
219	F	98.2	Very high	96.9	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.009	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	154.3	-177.8	-69.8	-90.7	0	0	0	112.8	L171 V215 A216 I217 R228 I230 F269	L171-F219 HydrophobicContact CD2-CE2 3.56Å; L171-F219 HydrophobicContact CD2-CZ 3.46Å; L171-F219 VanDerWaalsContact CD2-CZ 3.46Å; V215-F219 HydrophobicContact CG1-CE2 4.14Å; V215-F219 WeakPolarHBondContact O-CD2 3.48Å; A216-F219 PolarHBondContact O-N 2.87Å; A216-F219 VanDerWaalsContact O-N 3.15Å; I217-F219 PolarHBondContact O-N 3.29Å; F219-R228 CarbonylContact C-O 3.58Å; F219-R228 VanDerWaalsContact CA-O 3.31Å; F219-R228 WeakPolarHBondContact CA-O 3.3Å; F219-R228 HydrophobicContact CD1-CB 3.88Å; F219-R228 HydrophobicContact CE1-CB 3.85Å; F219-I230 HydrophobicContact CB-CD1 4.33Å; F219-I230 HydrophobicContact CD1-CB 4.32Å; F219-I230 HydrophobicContact CD1-CD1 3.65Å; F219-I230 HydrophobicContact CE1-CD1 4.01Å; F219-I230 HydrophobicContact CG-CD1 3.97Å; F219-F269 HydrophobicContact CB-CD1 4.22Å; F219-F269 HydrophobicContact CB-CE1 3.61Å; F219-F269 HydrophobicContact CB-CE2 4.3Å; F219-F269 HydrophobicContact CB-CZ 3.66Å
220	T	97.9	Very high	97	Very high	31 Å²	31	46 Å²	46	19%	0.19	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	172.3	160.2	65.4	0	0	0	0	109.1	G223 T224 K227 R228 I230	T220-G223 WeakPolarHBondContact OG1-CA 3.43Å; T220-G223 PolarHBondContact OG1-N 2.84Å; T220-G223 PolarHBondContact OG1-O 3.47Å; T220-T224 HydrophobicContact CG2-CG2 4.09Å; T220-K227 HydrophobicContact CG2-CB 4.01Å; T220-K227 HydrophobicContact CG2-CD 3.55Å; T220-K227 HydrophobicContact CG2-CG 4.42Å; T220-R228 PolarHBondContact N-O 3.45Å; T220-I230 PolarHBondContact O-N 2.95Å
221	L	98.1	Very high	97.1	Very high	9 Å²	9	50.1 Å²	50.1	5%	0.047	28%	0.279	C	S	.	.	S	Bend	trans	-56.8	-54.4	179.8	-176.5	68.4	0	0	0	111.9	I230 Q231 D262 T265 Q266	L221-I230 HydrophobicContact CD1-CG2 4.17Å; L221-Q231 HydrophobicContact CD1-CG 3.79Å; L221-Q231 HydrophobicContact CG-CG 4.2Å; L221-Q231 WeakPolarHBondContact O-CB 3.29Å; L221-Q231 WeakPolarHBondContact O-CG 3.37Å; L221-Q231 PolarHBondContact O-N 3.25Å; L221-D262 HydrophobicContact CD2-CB 3.76Å; L221-T265 HydrophobicContact CD1-CG2 3.83Å; L221-Q266 HydrophobicContact CB-CG 3.94Å; L221-Q266 HydrophobicContact CD2-CG 3.94Å
222	L	97.1	Very high	97.1	Very high	119 Å²	119	58.7 Å²	58.7	62%	0.623	32%	0.316	S	S	*	.	S	Bend	trans	-103.8	-5.1	-173.5	-56.7	-177.7	0	0	0	114	A229	L222-A229 WeakPolarHBondContact O-CB 3.27Å
223	G	96.6	Very high	97.1	Very high	25 Å²	25	55.7 Å²	55.7	26%	0.258	31%	0.305	S	S	.	.			trans	86.7	162.4	-171	0	0	0	0	0	113	T220 K227	T220-G223 WeakPolarHBondContact OG1-CA 3.43Å; T220-G223 PolarHBondContact OG1-N 2.84Å; T220-G223 PolarHBondContact OG1-O 3.47Å; G223-K227 WeakPolarHBondContact CA-O 3.28Å
224	T	96	Very high	97.1	Very high	77 Å²	77	60.3 Å²	60.3	47%	0.472	32%	0.32	S	S	.	.			trans	-140.1	-178.5	168.1	66.3	0	0	0	0	108.5	T220 S226 K227	T220-T224 HydrophobicContact CG2-CG2 4.09Å; T224-S226 PolarHBondContact O-N 3.2Å; T224-S226 PolarHBondContact OG1-N 2.98Å; T224-S226 PolarHBondContact OG1-OG 3.43Å; T224-K227 PolarHBondContact N-O 2.84Å; T224-K227 PolarHBondContact O-N 3.26Å; T224-K227 WeakPolarHBondContact OG1-CB 3.43Å; T224-K227 PolarHBondContact OG1-N 3.25Å
225	S	95	Very high	97.2	Very high	134 Å²	134	56.5 Å²	56.5	94%	0.937	30%	0.302	S	S	*	.	S	Bend	trans	-59.4	-27.7	174.2	53.8	0	0	0	0	113.6
226	S	95.3	Very high	97.2	Very high	100 Å²	100	56.4 Å²	56.4	70%	0.699	30%	0.301	S	S	*	.	S	Bend	trans	-111.6	-2.8	-176.4	56.6	0	0	0	0	114.5	T224	T224-S226 PolarHBondContact O-N 3.2Å; T224-S226 PolarHBondContact OG1-N 2.98Å; T224-S226 PolarHBondContact OG1-OG 3.43Å
227	K	96.5	Very high	97.2	Very high	62 Å²	62	58.2 Å²	58.2	27%	0.27	32%	0.32	S	S	.	.	S	Bend	trans	-139	142.4	-172.8	-59.9	-175.2	177.1	-151.1	0	111.8	I217 N218 T220 G223 T224	I217-K227 VanDerWaalsContact O-CE 3.28Å; I217-K227 WeakPolarHBondContact O-CE 3.46Å; I217-K227 PolarHBondContact O-NZ 3.16Å; N218-K227 CarbonylContact O-C 3.58Å; N218-K227 WeakPolarHBondContact O-CA 3.33Å; N218-K227 WeakPolarHBondContact O-CB 3.44Å; T220-K227 HydrophobicContact CG2-CB 4.01Å; T220-K227 HydrophobicContact CG2-CD 3.55Å; T220-K227 HydrophobicContact CG2-CG 4.42Å; G223-K227 WeakPolarHBondContact CA-O 3.28Å; T224-K227 PolarHBondContact N-O 2.84Å; T224-K227 PolarHBondContact O-N 3.26Å; T224-K227 WeakPolarHBondContact OG1-CB 3.43Å; T224-K227 PolarHBondContact OG1-N 3.25Å
228	R	97	Very high	97.3	Very high	97 Å²	97	56.5 Å²	56.5	37%	0.366	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	150.8	-178.8	-64.3	-173.6	-62.5	168.4	3.8	111.5	E168 N218 F219 T220	E168-R228 IonicContact OE1-CZ 3.36Å; E168-R228 IonicContact OE1-NE 2.82Å; E168-R228 PolarHBondContact OE1-NE 3.31Å; E168-R228 IonicContact OE1-NH1 3.17Å; E168-R228 PolarHBondContact OE1-NH1 3Å; E168-R228 IonicContact OE1-NH2 3.7Å; E168-R228 PolarHBondContact OE1-NH2 3.33Å; E168-R228 IonicContact OE2-CZ 2.66Å; E168-R228 VanDerWaalsContact OE2-CZ 3.3Å; E168-R228 IonicContact OE2-NE 3.84Å; E168-R228 IonicContact OE2-NH2 3.87Å; E168-R228 PolarHBondContact OE2-NH2 3.04Å; N218-R228 PolarHBondContact O-N 2.65Å; F219-R228 CarbonylContact C-O 3.58Å; F219-R228 VanDerWaalsContact CA-O 3.31Å; F219-R228 WeakPolarHBondContact CA-O 3.3Å; F219-R228 HydrophobicContact CD1-CB 3.88Å; F219-R228 HydrophobicContact CE1-CB 3.85Å; T220-R228 PolarHBondContact N-O 3.45Å
229	A	97.9	Very high	97.3	Very high	12 Å²	12	53.3 Å²	53.3	10%	0.099	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	114.4	176.8	0	0	0	0	0	110.3	L222 Q231 K232	L222-A229 WeakPolarHBondContact O-CB 3.27Å; A229-Q231 PolarHBondContact O-N 3.46Å; A229-K232 HydrophobicContact CB-CD 4.06Å; A229-K232 HydrophobicContact CB-CG 3.98Å; A229-K232 PolarHBondContact O-N 2.86Å; A229-K232 VanDerWaalsContact O-N 3.13Å
230	I	98.1	Very high	97.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-61.7	-30.5	177.1	-157.9	71.8	0	0	0	111.7	M211 F219 T220 L221 K232 C233 F235 Y236 T265 F269	M211-I230 HydrophobicContact CE-CD1 4.18Å; F219-I230 HydrophobicContact CB-CD1 4.33Å; F219-I230 HydrophobicContact CD1-CB 4.32Å; F219-I230 HydrophobicContact CD1-CD1 3.65Å; F219-I230 HydrophobicContact CE1-CD1 4.01Å; F219-I230 HydrophobicContact CG-CD1 3.97Å; T220-I230 PolarHBondContact O-N 2.95Å; L221-I230 HydrophobicContact CD1-CG2 4.17Å; I230-K232 PolarHBondContact O-N 3.27Å; I230-K232 VanDerWaalsContact O-N 3.11Å; I230-C233 WeakPolarHBondContact O-CB 3.44Å; I230-C233 PolarHBondContact O-N 3.49Å; I230-F235 HydrophobicContact CD1-CE1 4.3Å; I230-F235 HydrophobicContact CD1-CE2 4.03Å; I230-F235 HydrophobicContact CD1-CZ 3.41Å; I230-F235 VanDerWaalsContact CD1-CZ 3.41Å; I230-F235 HydrophobicContact CG1-CZ 4.34Å; I230-Y236 HydrophobicContact CG1-CD2 3.81Å; I230-Y236 HydrophobicContact CG1-CE2 4.5Å; I230-Y236 HydrophobicContact CG1-CG 3.88Å; I230-Y236 HydrophobicContact CG2-CD1 4.19Å; I230-Y236 HydrophobicContact CG2-CD2 4.12Å; I230-Y236 HydrophobicContact CG2-CE1 4.13Å; I230-Y236 HydrophobicContact CG2-CE2 4.08Å; I230-Y236 HydrophobicContact CG2-CG 4.17Å; I230-Y236 WeakPolarHBondContact O-CB 3.18Å; I230-Y236 WeakPolarHBondContact O-CD1 3.43Å; I230-T265 HydrophobicContact CG2-CG2 3.89Å; I230-F269 HydrophobicContact CB-CE2 3.98Å; I230-F269 HydrophobicContact CB-CZ 3.94Å; I230-F269 HydrophobicContact CD1-CZ 3.87Å; I230-F269 HydrophobicContact CG1-CE2 4.27Å; I230-F269 HydrophobicContact CG1-CZ 3.84Å; I230-F269 HydrophobicContact CG2-CE2 3.91Å; I230-F269 HydrophobicContact CG2-CZ 4.33Å
231	Q	97.4	Very high	97.2	Very high	86 Å²	86	56.7 Å²	56.7	40%	0.402	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-60.5	-21.3	178.5	-81.1	-172.7	-10.3	0	0	113.1	L221 A229 Y236	L221-Q231 HydrophobicContact CD1-CG 3.79Å; L221-Q231 HydrophobicContact CG-CG 4.2Å; L221-Q231 WeakPolarHBondContact O-CB 3.29Å; L221-Q231 WeakPolarHBondContact O-CG 3.37Å; L221-Q231 PolarHBondContact O-N 3.25Å; A229-Q231 PolarHBondContact O-N 3.46Å; Q231-Y236 HydrophobicContact CB-CE1 4.47Å; Q231-Y236 HydrophobicContact CG-CD1 4.43Å; Q231-Y236 HydrophobicContact CG-CE1 3.79Å
232	K	97.1	Very high	97.1	Very high	179 Å²	179	56.4 Å²	56.4	78%	0.778	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-85.3	-9.6	177.2	-63.2	-175.5	-179.6	-177.3	0	113.2	A229 I230	A229-K232 HydrophobicContact CB-CD 4.06Å; A229-K232 HydrophobicContact CB-CG 3.98Å; A229-K232 PolarHBondContact O-N 2.86Å; A229-K232 VanDerWaalsContact O-N 3.13Å; I230-K232 PolarHBondContact O-N 3.27Å; I230-K232 VanDerWaalsContact O-N 3.11Å
233	C	97.9	Very high	97.1	Very high	21 Å²	21	50.7 Å²	50.7	14%	0.142	28%	0.281	C	S	.	.			trans	-84	131.1	179	-57.9	0	0	0	0	110.8	D175 I230 F235 Y236 G237	D175-C233 WeakPolarHBondContact OD1-CA 3.34Å; I230-C233 WeakPolarHBondContact O-CB 3.44Å; I230-C233 PolarHBondContact O-N 3.49Å; C233-F235 VanDerWaalsContact C-N 3.33Å; C233-F235 HydrophobicContact CB-CD1 3.6Å; C233-F235 HydrophobicContact CB-CE1 3.36Å; C233-F235 HydrophobicContact CB-CG 4.46Å; C233-F235 HydrophobicContact CB-CZ 4.08Å; C233-F235 PolarHBondContact O-N 3.37Å; C233-Y236 WeakPolarHBondContact O-CB 3.46Å; C233-Y236 PolarHBondContact O-N 2.95Å; C233-G237 PolarHBondContact O-N 3.03Å; C233-G237 VanDerWaalsContact O-N 3.16Å
234	R	97.7	Very high	97.1	Very high	118 Å²	118	50.3 Å²	50.3	45%	0.445	27%	0.274	S	S	.	.	H	α-helix	trans	-59.8	-40.2	175.2	-66.8	173.9	-177.2	75.3	-6	112.3	D175 L178 Y236 G237 C238	D175-R234 WeakPolarHBondContact O-CD 3.32Å; D175-R234 WeakPolarHBondContact OD1-CA 3.45Å; D175-R234 WeakPolarHBondContact OD1-CB 3.33Å; D175-R234 PolarHBondContact OD1-N 2.93Å; D175-R234 PolarHBondContact OD2-N 3.47Å; D175-R234 IonicContact OD2-NH1 2.91Å; D175-R234 PolarHBondContact OD2-NH1 3.44Å; L178-R234 HydrophobicContact CB-CB 4.29Å; R234-Y236 PolarHBondContact O-N 3.36Å; R234-G237 WeakPolarHBondContact O-CA 3.45Å; R234-G237 PolarHBondContact O-N 3.2Å; R234-G237 VanDerWaalsContact O-N 3.11Å; R234-C238 PolarHBondContact O-N 3.18Å; R234-C238 PolarHBondContact O-SG 2.86Å
235	F	97.1	Very high	97	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.1	-38.5	178.2	76.5	-96.1	0	0	0	111.1	L171 L174 D175 L178 F187 I210 I230 C233 C238 V239	L171-F235 HydrophobicContact CD1-CD1 3.95Å; L171-F235 HydrophobicContact CD1-CE1 3.52Å; L171-F235 HydrophobicContact CD1-CE2 4.37Å; L171-F235 HydrophobicContact CD1-CZ 3.74Å; L171-F235 HydrophobicContact CD2-CE1 3.86Å; L171-F235 HydrophobicContact CD2-CZ 3.95Å; L171-F235 HydrophobicContact CG-CD1 4.34Å; L171-F235 HydrophobicContact CG-CE1 3.66Å; L171-F235 HydrophobicContact CG-CZ 4.13Å; L174-F235 HydrophobicContact CD2-CB 4.12Å; L174-F235 HydrophobicContact CD2-CG 4.46Å; L174-F235 HydrophobicContact CG-CB 4.4Å; D175-F235 WeakPolarHBondContact OD1-CD1 3.48Å; D175-F235 PolarHBondContact OD1-N 2.86Å; L178-F235 VanDerWaalsContact CD1-CA 3.42Å; L178-F235 HydrophobicContact CD1-CB 3.46Å; L178-F235 VanDerWaalsContact CD1-CB 3.46Å; F187-F235 HydrophobicContact CE1-CB 4.03Å; F187-F235 HydrophobicContact CZ-CB 4.12Å; I210-F235 HydrophobicContact CD1-CD2 4.03Å; I210-F235 HydrophobicContact CG2-CD2 4.23Å; I210-F235 HydrophobicContact CG2-CE2 4.23Å; I230-F235 HydrophobicContact CD1-CE1 4.3Å; I230-F235 HydrophobicContact CD1-CE2 4.03Å; I230-F235 HydrophobicContact CD1-CZ 3.41Å; I230-F235 VanDerWaalsContact CD1-CZ 3.41Å; I230-F235 HydrophobicContact CG1-CZ 4.34Å; C233-F235 VanDerWaalsContact C-N 3.33Å; C233-F235 HydrophobicContact CB-CD1 3.6Å; C233-F235 HydrophobicContact CB-CE1 3.36Å; C233-F235 HydrophobicContact CB-CG 4.46Å; C233-F235 HydrophobicContact CB-CZ 4.08Å; C233-F235 PolarHBondContact O-N 3.37Å; F235-C238 WeakPolarHBondContact O-CB 3.32Å; F235-C238 PolarHBondContact O-N 3.44Å; F235-V239 WeakPolarHBondContact O-CG2 3.28Å; F235-V239 PolarHBondContact O-N 2.9Å
236	Y	98.4	Very high	97	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-67.8	-38.5	176.7	179.1	-102.7	0	0	0	111.7	M203 L207 I230 Q231 C233 R234 C238 V239 R240 T265	M203-Y236 HydrophobicContact CE-CE2 4.09Å; M203-Y236 HydrophobicContact SD-CE2 4.19Å; L207-Y236 HydrophobicContact CD2-CD2 4.34Å; I230-Y236 HydrophobicContact CG1-CD2 3.81Å; I230-Y236 HydrophobicContact CG1-CE2 4.5Å; I230-Y236 HydrophobicContact CG1-CG 3.88Å; I230-Y236 HydrophobicContact CG2-CD1 4.19Å; I230-Y236 HydrophobicContact CG2-CD2 4.12Å; I230-Y236 HydrophobicContact CG2-CE1 4.13Å; I230-Y236 HydrophobicContact CG2-CE2 4.08Å; I230-Y236 HydrophobicContact CG2-CG 4.17Å; I230-Y236 WeakPolarHBondContact O-CB 3.18Å; I230-Y236 WeakPolarHBondContact O-CD1 3.43Å; Q231-Y236 HydrophobicContact CB-CE1 4.47Å; Q231-Y236 HydrophobicContact CG-CD1 4.43Å; Q231-Y236 HydrophobicContact CG-CE1 3.79Å; C233-Y236 WeakPolarHBondContact O-CB 3.46Å; C233-Y236 PolarHBondContact O-N 2.95Å; R234-Y236 PolarHBondContact O-N 3.36Å; Y236-C238 VanDerWaalsContact C-N 3.3Å; Y236-C238 PolarHBondContact O-N 3.42Å; Y236-V239 PolarHBondContact O-N 2.85Å; Y236-R240 HydrophobicContact CD1-CG 4.44Å; Y236-R240 VanDerWaalsContact CE1-CD 3.42Å; Y236-R240 HydrophobicContact CE1-CG 4.04Å; Y236-R240 HydrophobicContact CE2-CG 4.46Å; Y236-R240 WeakPolarHBondContact O-CG 3.39Å; Y236-R240 PolarHBondContact O-N 3.42Å; Y236-R240 PolarHBondContact OH-NH1 3.3Å; Y236-T265 HydrophobicContact CE2-CG2 3.9Å; Y236-T265 PolarHBondContact OH-OG1 2.95Å
237	G	97.9	Very high	97	Very high	38 Å²	38	47.4 Å²	47.4	39%	0.392	23%	0.228	S	C	.	.	H	α-helix	trans	-56.9	-42.6	169.3	0	0	0	0	0	112.7	C233 R234 R240 S241	C233-G237 PolarHBondContact O-N 3.03Å; C233-G237 VanDerWaalsContact O-N 3.16Å; R234-G237 WeakPolarHBondContact O-CA 3.45Å; R234-G237 PolarHBondContact O-N 3.2Å; R234-G237 VanDerWaalsContact O-N 3.11Å; G237-R240 PolarHBondContact O-N 2.96Å; G237-S241 WeakPolarHBondContact O-CB 3.45Å; G237-S241 PolarHBondContact O-N 3.18Å
238	C	97.9	Very high	96.9	Very high	8 Å²	8	48.7 Å²	48.7	5%	0.054	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-45.9	174.9	-61.7	0	0	0	0	111.5	F187 M188 L191 R234 F235 Y236 R240 S241 A242	F187-C238 HydrophobicContact CD1-CB 3.78Å; F187-C238 HydrophobicContact CE1-CB 3.88Å; M188-C238 HydrophobicContact SD-CB 3.61Å; L191-C238 HydrophobicContact CD1-CB 4.1Å; R234-C238 PolarHBondContact O-N 3.18Å; R234-C238 PolarHBondContact O-SG 2.86Å; F235-C238 WeakPolarHBondContact O-CB 3.32Å; F235-C238 PolarHBondContact O-N 3.44Å; Y236-C238 VanDerWaalsContact C-N 3.3Å; Y236-C238 PolarHBondContact O-N 3.42Å; C238-R240 VanDerWaalsContact C-N 3.33Å; C238-R240 PolarHBondContact O-N 3.5Å; C238-S241 PolarHBondContact O-N 3.37Å; C238-A242 WeakPolarHBondContact O-CB 3.47Å; C238-A242 PolarHBondContact O-N 2.8Å
239	V	98	Very high	96.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.5	-47.2	176	174.8	0	0	0	0	111.3	L191 M203 I206 I210 F235 Y236 A242 L243	L191-V239 HydrophobicContact CD1-CB 4.47Å; L191-V239 HydrophobicContact CD1-CG2 3.87Å; L191-V239 HydrophobicContact CD2-CG2 4.02Å; M203-V239 HydrophobicContact CE-CG1 4Å; M203-V239 HydrophobicContact SD-CG1 3.61Å; I206-V239 HydrophobicContact CB-CG1 4.33Å; I206-V239 HydrophobicContact CD1-CG1 4.29Å; I206-V239 HydrophobicContact CG2-CB 4.31Å; I206-V239 HydrophobicContact CG2-CG1 3.75Å; I206-V239 HydrophobicContact CG2-CG2 3.51Å; I210-V239 HydrophobicContact CD1-CG2 3.78Å; F235-V239 WeakPolarHBondContact O-CG2 3.28Å; F235-V239 PolarHBondContact O-N 2.9Å; Y236-V239 PolarHBondContact O-N 2.85Å; V239-A242 PolarHBondContact O-N 2.9Å; V239-L243 HydrophobicContact CG1-CD1 3.72Å; V239-L243 WeakPolarHBondContact O-CB 3.34Å; V239-L243 WeakPolarHBondContact O-CD1 3.44Å; V239-L243 VanDerWaalsContact O-CG 3.28Å; V239-L243 WeakPolarHBondContact O-CG 3.47Å; V239-L243 PolarHBondContact O-N 3.5Å
240	R	97.6	Very high	96.5	Very high	52 Å²	52	52.6 Å²	52.6	20%	0.196	28%	0.279	C	S	.	.	H	α-helix	trans	-62.3	-45.7	176.7	-70.5	-177.9	71.6	96.2	-8.5	112.2	M203 Y236 G237 C238 A242 L243 T244 A258 Y261 D262	M203-R240 HydrophobicContact CE-CG 4.07Å; Y236-R240 HydrophobicContact CD1-CG 4.44Å; Y236-R240 VanDerWaalsContact CE1-CD 3.42Å; Y236-R240 HydrophobicContact CE1-CG 4.04Å; Y236-R240 HydrophobicContact CE2-CG 4.46Å; Y236-R240 WeakPolarHBondContact O-CG 3.39Å; Y236-R240 PolarHBondContact O-N 3.42Å; Y236-R240 PolarHBondContact OH-NH1 3.3Å; G237-R240 PolarHBondContact O-N 2.96Å; C238-R240 VanDerWaalsContact C-N 3.33Å; C238-R240 PolarHBondContact O-N 3.5Å; R240-A242 VanDerWaalsContact C-N 3.35Å; R240-A242 PolarHBondContact O-N 3.43Å; R240-L243 PolarHBondContact O-N 2.91Å; R240-T244 WeakPolarHBondContact O-CB 3.4Å; R240-T244 PolarHBondContact O-N 3.31Å; R240-T244 PolarHBondContact O-OG1 3.47Å; R240-T244 VanDerWaalsContact O-OG1 3.07Å; R240-A258 VanDerWaalsContact NH2-CB 3.29Å; R240-Y261 HydrophobicContact CG-CD2 4.43Å; R240-D262 IonicContact CZ-OD1 3.55Å; R240-D262 IonicContact NH1-OD1 3.94Å; R240-D262 PolarHBondContact NH1-OD1 3.16Å; R240-D262 IonicContact NH2-OD1 3.07Å
241	S	96.8	Very high	96.2	Very high	52 Å²	52	57.3 Å²	57.3	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-43.7	179	179.7	0	0	0	0	111.5	G237 C238 L243 T244 N245	G237-S241 WeakPolarHBondContact O-CB 3.45Å; G237-S241 PolarHBondContact O-N 3.18Å; C238-S241 PolarHBondContact O-N 3.37Å; S241-L243 PolarHBondContact O-N 3.39Å; S241-T244 PolarHBondContact O-N 2.85Å; S241-N245 WeakPolarHBondContact O-CB 3.4Å; S241-N245 PolarHBondContact O-N 3.37Å; S241-N245 PolarHBondContact O-ND2 3.17Å; S241-N245 PolarHBondContact O-OD1 3.01Å
242	A	96.1	Very high	96	Very high	2 Å²	2	56 Å²	56	2%	0.017	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-42.9	177.6	0	0	0	0	0	111.5	M188 L191 M195 C238 V239 R240 N245 R246	M188-A242 HydrophobicContact CE-CB 3.79Å; M188-A242 HydrophobicContact SD-CB 4.07Å; L191-A242 HydrophobicContact CB-CB 4.03Å; L191-A242 HydrophobicContact CD1-CB 4.27Å; M195-A242 WeakPolarHBondContact CE-O 3.26Å; M195-A242 HydrophobicContact SD-CB 4.45Å; C238-A242 WeakPolarHBondContact O-CB 3.47Å; C238-A242 PolarHBondContact O-N 2.8Å; V239-A242 PolarHBondContact O-N 2.9Å; R240-A242 VanDerWaalsContact C-N 3.35Å; R240-A242 PolarHBondContact O-N 3.43Å; A242-N245 PolarHBondContact O-N 3.41Å; A242-R246 PolarHBondContact O-N 2.93Å
243	L	96.7	Very high	95.9	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62	-48.8	174.4	-71.1	162.5	0	0	0	112.5	M195 S202 M203 I206 V239 R240 S241 N245 R246 F247 Y261	M195-L243 HydrophobicContact CE-CB 4.13Å; M195-L243 HydrophobicContact CE-CD2 3.41Å; M195-L243 VanDerWaalsContact CE-CD2 3.41Å; M195-L243 HydrophobicContact CE-CG 3.87Å; M195-L243 HydrophobicContact CG-CD2 4.37Å; S202-L243 VanDerWaalsContact CB-CD2 3.47Å; M203-L243 HydrophobicContact CB-CD1 3.99Å; M203-L243 HydrophobicContact CE-CD1 3.37Å; M203-L243 HydrophobicContact SD-CD1 3.9Å; I206-L243 HydrophobicContact CD1-CD2 4.45Å; V239-L243 HydrophobicContact CG1-CD1 3.72Å; V239-L243 WeakPolarHBondContact O-CB 3.34Å; V239-L243 WeakPolarHBondContact O-CD1 3.44Å; V239-L243 VanDerWaalsContact O-CG 3.28Å; V239-L243 WeakPolarHBondContact O-CG 3.47Å; V239-L243 PolarHBondContact O-N 3.5Å; R240-L243 PolarHBondContact O-N 2.91Å; S241-L243 PolarHBondContact O-N 3.39Å; L243-N245 VanDerWaalsContact C-N 3.32Å; L243-N245 PolarHBondContact O-N 2.99Å; L243-R246 PolarHBondContact O-N 3.49Å; L243-F247 HydrophobicContact CD2-CD2 4.11Å; L243-F247 HydrophobicContact CD2-CE2 3.79Å; L243-F247 WeakPolarHBondContact O-CD2 3.44Å; L243-F247 PolarHBondContact O-N 2.7Å; L243-Y261 HydrophobicContact CB-CE1 3.67Å; L243-Y261 HydrophobicContact CB-CE2 4.07Å; L243-Y261 VanDerWaalsContact CB-CZ 3.42Å; L243-Y261 VanDerWaalsContact CB-OH 3.3Å; L243-Y261 WeakPolarHBondContact CB-OH 3.33Å; L243-Y261 HydrophobicContact CD1-CD1 4.12Å; L243-Y261 HydrophobicContact CD1-CE1 4Å; L243-Y261 HydrophobicContact CD2-CE1 4.47Å; L243-Y261 HydrophobicContact CG-CE1 4.28Å; L243-Y261 PolarHBondContact O-OH 3.34Å
244	T	96.5	Very high	95.8	Very high	17 Å²	17	56.3 Å²	56.3	10%	0.104	31%	0.312	C	S	.	.	H	α-helix	trans	-59	-45.8	176.5	-60.6	0	0	0	0	110.7	R240 S241 R246 F247 L248 E254 Y261	R240-T244 WeakPolarHBondContact O-CB 3.4Å; R240-T244 PolarHBondContact O-N 3.31Å; R240-T244 PolarHBondContact O-OG1 3.47Å; R240-T244 VanDerWaalsContact O-OG1 3.07Å; S241-T244 PolarHBondContact O-N 2.85Å; T244-R246 PolarHBondContact O-N 3.4Å; T244-F247 PolarHBondContact O-N 3.49Å; T244-L248 HydrophobicContact CG2-CB 4.19Å; T244-L248 HydrophobicContact CG2-CD2 4.26Å; T244-L248 WeakPolarHBondContact O-CB 3.45Å; T244-L248 PolarHBondContact O-N 2.9Å; T244-E254 HydrophobicContact CG2-CG 4.28Å; T244-Y261 PolarHBondContact N-OH 2.72Å
245	N	94.5	Very high	95.7	Very high	122 Å²	122	58 Å²	58	65%	0.652	32%	0.322	S	S	*	.	H	α-helix	trans	-60.2	-30.3	179.3	-70.4	-10.7	0	0	0	113.5	S241 A242 L243	S241-N245 WeakPolarHBondContact O-CB 3.4Å; S241-N245 PolarHBondContact O-N 3.37Å; S241-N245 PolarHBondContact O-ND2 3.17Å; S241-N245 PolarHBondContact O-OD1 3.01Å; A242-N245 PolarHBondContact O-N 3.41Å; L243-N245 VanDerWaalsContact C-N 3.32Å; L243-N245 PolarHBondContact O-N 2.99Å
246	R	94.3	Very high	95.7	Very high	100 Å²	100	61 Å²	61	38%	0.377	34%	0.338	S	S	.	.	H	α-helix	trans	-84.7	-38.2	177.5	-176.5	159.4	170.9	-176.3	-10.7	113.7	M195 D196 D197 A242 L243 T244	M195-R246 VanDerWaalsContact C-NH1 3.3Å; M195-R246 HydrophobicContact CE-CB 3.46Å; M195-R246 VanDerWaalsContact CE-CB 3.46Å; M195-R246 HydrophobicContact CE-CG 4.08Å; M195-R246 PolarHBondContact O-NH1 3.22Å; M195-R246 HydrophobicContact SD-CB 4.33Å; D196-R246 PolarHBondContact O-NH2 3.41Å; D196-R246 VanDerWaalsContact O-NH2 3.12Å; D197-R246 IonicContact OD1-NH2 3.82Å; D197-R246 PolarHBondContact OD1-NH2 2.98Å; A242-R246 PolarHBondContact O-N 2.93Å; L243-R246 PolarHBondContact O-N 3.49Å; T244-R246 PolarHBondContact O-N 3.4Å
247	F	95.3	Very high	95.6	Very high	28 Å²	28	60.9 Å²	60.9	12%	0.123	34%	0.337	C	S	.	.	H	α-helix	trans	-103.9	-13.4	-168.6	-69.6	-68.4	0	0	0	114.6	M195 D196 D197 P199 L243 T244 S249 L257	M195-F247 HydrophobicContact CE-CD2 4.2Å; M195-F247 HydrophobicContact CE-CE2 3.88Å; D196-F247 VanDerWaalsContact O-CZ 3.29Å; D196-F247 WeakPolarHBondContact O-CZ 3.16Å; D197-F247 WeakPolarHBondContact O-CE1 3.36Å; P199-F247 HydrophobicContact CB-CD2 3.92Å; P199-F247 HydrophobicContact CB-CE2 4.07Å; P199-F247 HydrophobicContact CB-CG 4.16Å; P199-F247 HydrophobicContact CB-CZ 4.42Å; L243-F247 HydrophobicContact CD2-CD2 4.11Å; L243-F247 HydrophobicContact CD2-CE2 3.79Å; L243-F247 WeakPolarHBondContact O-CD2 3.44Å; L243-F247 PolarHBondContact O-N 2.7Å; T244-F247 PolarHBondContact O-N 3.49Å; F247-S249 PolarHBondContact O-N 3.49Å; F247-L257 HydrophobicContact CB-CD1 4.16Å; F247-L257 HydrophobicContact CB-CD2 3.79Å
248	L	94.4	Very high	95.6	Very high	89 Å²	89	60.1 Å²	60.1	47%	0.466	33%	0.328	S	S	.	.			trans	-62.9	126.3	174.6	-172.2	65.5	0	0	0	109.4	T244 E254 L257	T244-L248 HydrophobicContact CG2-CB 4.19Å; T244-L248 HydrophobicContact CG2-CD2 4.26Å; T244-L248 WeakPolarHBondContact O-CB 3.45Å; T244-L248 PolarHBondContact O-N 2.9Å; L248-E254 HydrophobicContact CD1-CB 4.29Å; L248-L257 HydrophobicContact CB-CD1 4.29Å; L248-L257 HydrophobicContact CD1-CD1 4.37Å
249	S	94.1	Very high	95.6	Very high	53 Å²	53	64.7 Å²	64.7	37%	0.371	35%	0.347	S	S	.	.			trans	-150.7	174.3	-179	65.9	0	0	0	0	110.2	F247 S251 I252	F247-S249 PolarHBondContact O-N 3.49Å; S249-S251 PolarHBondContact O-N 3.06Å; S249-S251 PolarHBondContact OG-N 2.91Å; S249-S251 PolarHBondContact OG-OG 3.38Å; S249-I252 PolarHBondContact N-O 2.96Å; S249-I252 CarbonylContact O-C 3.53Å; S249-I252 PolarHBondContact O-N 2.98Å; S249-I252 PolarHBondContact OG-N 3.13Å
250	S	92.5	Very high	95.5	Very high	137 Å²	137	66.7 Å²	66.7	96%	0.958	36%	0.357	S	S	*	.	S	Bend	trans	-59.7	-26.6	171.8	53.8	0	0	0	0	113.1
251	S	91.8	Very high	95.5	Very high	99 Å²	99	64.2 Å²	64.2	69%	0.692	35%	0.348	S	S	*	.	S	Bend	trans	-87.5	-23.5	-178.4	67.9	0	0	0	0	114.3	S249	S249-S251 PolarHBondContact O-N 3.06Å; S249-S251 PolarHBondContact OG-N 2.91Å; S249-S251 PolarHBondContact OG-OG 3.38Å
252	I	93.5	Very high	95.6	Very high	60 Å²	60	63.7 Å²	63.7	31%	0.308	34%	0.341	S	S	.	.	S	Bend	trans	-132.5	115.5	-176.6	-51.6	176.7	0	0	0	108.8	S249 L257	S249-I252 PolarHBondContact N-O 2.96Å; S249-I252 CarbonylContact O-C 3.53Å; S249-I252 PolarHBondContact O-N 2.98Å; S249-I252 PolarHBondContact OG-N 3.13Å; I252-L257 HydrophobicContact CG2-CD1 4.42Å; I252-L257 HydrophobicContact CG2-CD2 3.72Å; I252-L257 HydrophobicContact CG2-CG 3.67Å
253	N	94.8	Very high	95.7	Very high	79 Å²	79	69 Å²	69	42%	0.422	37%	0.367	S	S	.	.			trans	-83	166.4	176.8	67.8	58.6	0	0	0	112.4	K255 D256 L257	N253-K255 VanDerWaalsContact C-N 3.33Å; N253-K255 PolarHBondContact O-N 2.93Å; N253-K255 WeakPolarHBondContact OD1-CA 3.47Å; N253-K255 WeakPolarHBondContact OD1-CB 3.31Å; N253-K255 PolarHBondContact OD1-N 3.28Å; N253-D256 PolarHBondContact ND2-OD2 3.45Å; N253-D256 PolarHBondContact O-N 3.46Å; N253-D256 PolarHBondContact OD1-N 3.47Å; N253-D256 PolarHBondContact OD1-OD2 3.42Å; N253-L257 PolarHBondContact O-N 3.32Å; N253-L257 VanDerWaalsContact O-N 3.16Å
254	E	95.1	Very high	95.8	Very high	127 Å²	127	69.1 Å²	69.1	59%	0.593	37%	0.368	S	S	*	.	H	α-helix	trans	-62.8	-34.9	-178.6	-172.3	176.2	-175.6	0	0	113.6	T244 L248 D256 L257 A258	T244-E254 HydrophobicContact CG2-CG 4.28Å; L248-E254 HydrophobicContact CD1-CB 4.29Å; E254-D256 PolarHBondContact O-N 2.91Å; E254-L257 PolarHBondContact O-N 3.21Å; E254-A258 WeakPolarHBondContact O-CB 3.41Å; E254-A258 PolarHBondContact O-N 3.46Å
255	K	96.2	Very high	95.9	Very high	152 Å²	152	68.3 Å²	68.3	66%	0.661	36%	0.363	S	S	*	.	H	α-helix	trans	-67.3	-38.4	-179.2	-174.3	178.1	-177.9	177.6	0	111.7	N253 A258 K259	N253-K255 VanDerWaalsContact C-N 3.33Å; N253-K255 PolarHBondContact O-N 2.93Å; N253-K255 WeakPolarHBondContact OD1-CA 3.47Å; N253-K255 WeakPolarHBondContact OD1-CB 3.31Å; N253-K255 PolarHBondContact OD1-N 3.28Å; K255-A258 PolarHBondContact O-N 3.46Å; K255-K259 WeakPolarHBondContact O-CG 3.41Å; K255-K259 PolarHBondContact O-N 2.97Å
256	D	96.6	Very high	96	Very high	63 Å²	63	67.5 Å²	67.5	34%	0.337	36%	0.355	S	S	.	.	H	α-helix	trans	-75.1	-37.1	178	-66.4	-36	0	0	0	111.3	N253 E254 A258 K259 L260	N253-D256 PolarHBondContact ND2-OD2 3.45Å; N253-D256 PolarHBondContact O-N 3.46Å; N253-D256 PolarHBondContact OD1-N 3.47Å; N253-D256 PolarHBondContact OD1-OD2 3.42Å; E254-D256 PolarHBondContact O-N 2.91Å; D256-A258 VanDerWaalsContact C-N 3.34Å; D256-A258 PolarHBondContact O-N 2.88Å; D256-K259 PolarHBondContact O-N 3.25Å; D256-K259 IonicContact OD1-NZ 2.9Å; D256-K259 PolarHBondContact OD1-NZ 3.11Å; D256-L260 WeakPolarHBondContact O-CG 3.42Å; D256-L260 PolarHBondContact O-N 2.97Å; D256-L260 VanDerWaalsContact O-N 3.09Å
257	L	97.3	Very high	96.2	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-58.9	-44.6	168.1	-72.1	175.5	0	0	0	111.9	P199 F247 L248 I252 N253 E254 K259 L260 Y261	P199-L257 HydrophobicContact CB-CD2 4.42Å; F247-L257 HydrophobicContact CB-CD1 4.16Å; F247-L257 HydrophobicContact CB-CD2 3.79Å; L248-L257 HydrophobicContact CB-CD1 4.29Å; L248-L257 HydrophobicContact CD1-CD1 4.37Å; I252-L257 HydrophobicContact CG2-CD1 4.42Å; I252-L257 HydrophobicContact CG2-CD2 3.72Å; I252-L257 HydrophobicContact CG2-CG 3.67Å; N253-L257 PolarHBondContact O-N 3.32Å; N253-L257 VanDerWaalsContact O-N 3.16Å; E254-L257 PolarHBondContact O-N 3.21Å; L257-K259 VanDerWaalsContact C-N 3.32Å; L257-K259 PolarHBondContact O-N 3.17Å; L257-L260 HydrophobicContact CD2-CD1 4.43Å; L257-L260 WeakPolarHBondContact O-CB 3.37Å; L257-L260 PolarHBondContact O-N 2.93Å; L257-L260 VanDerWaalsContact O-N 3.09Å; L257-Y261 HydrophobicContact CB-CE2 3.82Å; L257-Y261 VanDerWaalsContact O-CD2 3.27Å; L257-Y261 WeakPolarHBondContact O-CD2 3.03Å; L257-Y261 PolarHBondContact O-N 2.97Å
258	A	97	Very high	96.4	Very high	23 Å²	23	63.8 Å²	63.8	19%	0.19	35%	0.348	C	S	.	.	H	α-helix	trans	-57.1	-44.4	178.5	0	0	0	0	0	112.2	R240 E254 K255 D256 Y261 D262	R240-A258 VanDerWaalsContact NH2-CB 3.29Å; E254-A258 WeakPolarHBondContact O-CB 3.41Å; E254-A258 PolarHBondContact O-N 3.46Å; K255-A258 PolarHBondContact O-N 3.46Å; D256-A258 VanDerWaalsContact C-N 3.34Å; D256-A258 PolarHBondContact O-N 2.88Å; A258-Y261 PolarHBondContact O-N 2.94Å; A258-D262 WeakPolarHBondContact O-CB 3.35Å; A258-D262 PolarHBondContact O-N 3.41Å
259	K	97.5	Very high	96.5	Very high	104 Å²	104	60.2 Å²	60.2	45%	0.452	33%	0.328	S	S	.	.	H	α-helix	trans	-61.6	-44.1	174.6	-66.9	169.8	-168.8	158.8	0	111.8	K255 D256 L257 Y261 D262 M263	K255-K259 WeakPolarHBondContact O-CG 3.41Å; K255-K259 PolarHBondContact O-N 2.97Å; D256-K259 PolarHBondContact O-N 3.25Å; D256-K259 IonicContact OD1-NZ 2.9Å; D256-K259 PolarHBondContact OD1-NZ 3.11Å; L257-K259 VanDerWaalsContact C-N 3.32Å; L257-K259 PolarHBondContact O-N 3.17Å; K259-Y261 VanDerWaalsContact C-N 3.33Å; K259-Y261 PolarHBondContact O-N 3.28Å; K259-D262 PolarHBondContact O-N 2.95Å; K259-M263 WeakPolarHBondContact O-CB 3.33Å; K259-M263 VanDerWaalsContact O-CG 3.25Å; K259-M263 WeakPolarHBondContact O-CG 3.48Å; K259-M263 PolarHBondContact O-N 3.3Å
260	L	97.4	Very high	96.6	Very high	42 Å²	42	62 Å²	62	22%	0.22	33%	0.331	C	S	.	.	H	α-helix	trans	-60.9	-42.8	178.4	-69.5	172.6	0	0	0	111.6	P199 K200 D256 L257 A264	P199-L260 HydrophobicContact CG-CD1 4.04Å; K200-L260 HydrophobicContact CD-CD2 3.79Å; K200-L260 HydrophobicContact CG-CB 4.14Å; K200-L260 HydrophobicContact CG-CD2 4.14Å; D256-L260 WeakPolarHBondContact O-CG 3.42Å; D256-L260 PolarHBondContact O-N 2.97Å; D256-L260 VanDerWaalsContact O-N 3.09Å; L257-L260 HydrophobicContact CD2-CD1 4.43Å; L257-L260 WeakPolarHBondContact O-CB 3.37Å; L257-L260 PolarHBondContact O-N 2.93Å; L257-L260 VanDerWaalsContact O-N 3.09Å; L260-A264 VanDerWaalsContact O-CB 3.28Å; L260-A264 WeakPolarHBondContact O-CB 3.42Å; L260-A264 PolarHBondContact O-N 3.46Å
261	Y	98.1	Very high	96.9	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.9	-42.9	176.7	-60.2	-24.5	0	0	0	112.2	P199 M203 R240 L243 T244 L257 A258 K259 A264 T265	P199-Y261 HydrophobicContact CB-CE1 3.84Å; M203-Y261 HydrophobicContact CE-CD1 4.06Å; M203-Y261 HydrophobicContact CE-CG 3.83Å; R240-Y261 HydrophobicContact CG-CD2 4.43Å; L243-Y261 HydrophobicContact CB-CE1 3.67Å; L243-Y261 HydrophobicContact CB-CE2 4.07Å; L243-Y261 VanDerWaalsContact CB-CZ 3.42Å; L243-Y261 VanDerWaalsContact CB-OH 3.3Å; L243-Y261 WeakPolarHBondContact CB-OH 3.33Å; L243-Y261 HydrophobicContact CD1-CD1 4.12Å; L243-Y261 HydrophobicContact CD1-CE1 4Å; L243-Y261 HydrophobicContact CD2-CE1 4.47Å; L243-Y261 HydrophobicContact CG-CE1 4.28Å; L243-Y261 PolarHBondContact O-OH 3.34Å; T244-Y261 PolarHBondContact N-OH 2.72Å; L257-Y261 HydrophobicContact CB-CE2 3.82Å; L257-Y261 VanDerWaalsContact O-CD2 3.27Å; L257-Y261 WeakPolarHBondContact O-CD2 3.03Å; L257-Y261 PolarHBondContact O-N 2.97Å; A258-Y261 PolarHBondContact O-N 2.94Å; K259-Y261 VanDerWaalsContact C-N 3.33Å; K259-Y261 PolarHBondContact O-N 3.28Å; Y261-A264 PolarHBondContact O-N 3.41Å; Y261-T265 VanDerWaalsContact O-CB 3.24Å; Y261-T265 WeakPolarHBondContact O-CB 3.49Å; Y261-T265 PolarHBondContact O-N 3.04Å; Y261-T265 PolarHBondContact O-OG1 2.98Å
262	D	98.2	Very high	97.1	Very high	41 Å²	41	54.1 Å²	54.1	22%	0.219	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-45.1	179.6	-69.1	-10	0	0	0	111	L221 R240 A258 K259 T265 Q266	L221-D262 HydrophobicContact CD2-CB 3.76Å; R240-D262 IonicContact CZ-OD1 3.55Å; R240-D262 IonicContact NH1-OD1 3.94Å; R240-D262 PolarHBondContact NH1-OD1 3.16Å; R240-D262 IonicContact NH2-OD1 3.07Å; A258-D262 WeakPolarHBondContact O-CB 3.35Å; A258-D262 PolarHBondContact O-N 3.41Å; K259-D262 PolarHBondContact O-N 2.95Å; D262-T265 PolarHBondContact O-N 3.44Å; D262-Q266 WeakPolarHBondContact O-CB 3.17Å; D262-Q266 VanDerWaalsContact O-CG 3.3Å; D262-Q266 WeakPolarHBondContact O-CG 3.28Å; D262-Q266 PolarHBondContact O-N 2.99Å
263	M	98.2	Very high	97.2	Very high	113 Å²	113	55.7 Å²	55.7	56%	0.557	27%	0.272	S	S	*	.	H	α-helix	trans	-59.9	-46.6	173.9	-69.6	172.6	70.4	0	0	111.9	K259 T265 Q266 S267	K259-M263 WeakPolarHBondContact O-CB 3.33Å; K259-M263 VanDerWaalsContact O-CG 3.25Å; K259-M263 WeakPolarHBondContact O-CG 3.48Å; K259-M263 PolarHBondContact O-N 3.3Å; M263-T265 VanDerWaalsContact C-N 3.33Å; M263-T265 PolarHBondContact O-N 3.14Å; M263-Q266 PolarHBondContact O-N 3.28Å; M263-S267 WeakPolarHBondContact O-CB 3.31Å; M263-S267 PolarHBondContact O-N 2.89Å
264	A	98.2	Very high	97.3	Very high	3 Å²	3	54 Å²	54	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-40.3	179.4	0	0	0	0	0	112.1	K200 M203 R204 L260 Y261 Y268	K200-A264 HydrophobicContact CB-CB 4.14Å; K200-A264 HydrophobicContact CG-CB 4.21Å; M203-A264 HydrophobicContact CB-CB 4.02Å; M203-A264 HydrophobicContact CG-CB 3.99Å; R204-A264 HydrophobicContact CG-CB 4.34Å; L260-A264 VanDerWaalsContact O-CB 3.28Å; L260-A264 WeakPolarHBondContact O-CB 3.42Å; L260-A264 PolarHBondContact O-N 3.46Å; Y261-A264 PolarHBondContact O-N 3.41Å; A264-Y268 VanDerWaalsContact O-CB 3.27Å; A264-Y268 WeakPolarHBondContact O-CB 3.34Å; A264-Y268 PolarHBondContact O-N 3.47Å
265	T	98.5	Very high	97.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-69.2	-42.9	179.7	-59.1	0	0	0	0	111.6	L207 L221 I230 Y236 Y261 D262 M263 Y268 F269	L207-T265 HydrophobicContact CD1-CG2 4.24Å; L221-T265 HydrophobicContact CD1-CG2 3.83Å; I230-T265 HydrophobicContact CG2-CG2 3.89Å; Y236-T265 HydrophobicContact CE2-CG2 3.9Å; Y236-T265 PolarHBondContact OH-OG1 2.95Å; Y261-T265 VanDerWaalsContact O-CB 3.24Å; Y261-T265 WeakPolarHBondContact O-CB 3.49Å; Y261-T265 PolarHBondContact O-N 3.04Å; Y261-T265 PolarHBondContact O-OG1 2.98Å; D262-T265 PolarHBondContact O-N 3.44Å; M263-T265 VanDerWaalsContact C-N 3.33Å; M263-T265 PolarHBondContact O-N 3.14Å; T265-Y268 WeakPolarHBondContact O-CB 3.35Å; T265-Y268 PolarHBondContact O-N 3.41Å; T265-F269 HydrophobicContact CG2-CD2 3.95Å; T265-F269 HydrophobicContact CG2-CE2 3.45Å; T265-F269 VanDerWaalsContact CG2-CE2 3.45Å; T265-F269 HydrophobicContact CG2-CZ 4.36Å; T265-F269 WeakPolarHBondContact O-CD2 3.44Å; T265-F269 PolarHBondContact O-N 3.35Å; T265-F269 VanDerWaalsContact O-N 3.14Å
266	Q	98.2	Very high	97.3	Very high	104 Å²	104	46.9 Å²	46.9	49%	0.486	23%	0.233	S	C	.	.	H	α-helix	trans	-62.7	-47.7	174.5	-73.5	174.4	-18.3	0	0	111.7	L221 D262 M263 Y268 F269 H270	L221-Q266 HydrophobicContact CB-CG 3.94Å; L221-Q266 HydrophobicContact CD2-CG 3.94Å; D262-Q266 WeakPolarHBondContact O-CB 3.17Å; D262-Q266 VanDerWaalsContact O-CG 3.3Å; D262-Q266 WeakPolarHBondContact O-CG 3.28Å; D262-Q266 PolarHBondContact O-N 2.99Å; M263-Q266 PolarHBondContact O-N 3.28Å; Q266-Y268 VanDerWaalsContact C-N 3.3Å; Q266-Y268 PolarHBondContact O-N 3.39Å; Q266-F269 PolarHBondContact O-N 3.28Å; Q266-H270 PolarHBondContact O-N 3.22Å
267	S	97.9	Very high	97.2	Very high	47 Å²	47	49.3 Å²	49.3	33%	0.329	24%	0.242	S	C	.	.	H	α-helix	trans	-58.5	-42.9	175.4	-177.5	0	0	0	0	111.3	M263 F269 H270 D271	M263-S267 WeakPolarHBondContact O-CB 3.31Å; M263-S267 PolarHBondContact O-N 2.89Å; S267-F269 PolarHBondContact O-N 3.34Å; S267-H270 WeakPolarHBondContact O-CB 3.38Å; S267-H270 PolarHBondContact O-N 3.29Å; S267-D271 WeakPolarHBondContact O-CB 3.5Å; S267-D271 PolarHBondContact O-N 2.92Å
268	Y	98.5	Very high	97.1	Very high	3 Å²	3	55.5 Å²	55.5	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-57	-51.4	177.8	174.5	-97	0	0	0	112.2	R204 L207 S208 M211 A216 A264 T265 Q266 H270 D271 M272	R204-Y268 HydrophobicContact CB-CD2 4.4Å; L207-Y268 HydrophobicContact CB-CD1 3.97Å; L207-Y268 HydrophobicContact CB-CD2 4.18Å; L207-Y268 HydrophobicContact CB-CE1 3.72Å; L207-Y268 HydrophobicContact CB-CE2 3.94Å; L207-Y268 HydrophobicContact CB-CG 4.2Å; L207-Y268 HydrophobicContact CD1-CD1 3.73Å; L207-Y268 HydrophobicContact CD1-CE1 4.27Å; L207-Y268 HydrophobicContact CD1-CG 3.94Å; L207-Y268 PolarHBondContact O-OH 3.28Å; S208-Y268 WeakPolarHBondContact OG-CE2 3.45Å; M211-Y268 HydrophobicContact CE-CE1 3.87Å; A216-Y268 HydrophobicContact CB-CE1 3.9Å; A264-Y268 VanDerWaalsContact O-CB 3.27Å; A264-Y268 WeakPolarHBondContact O-CB 3.34Å; A264-Y268 PolarHBondContact O-N 3.47Å; T265-Y268 WeakPolarHBondContact O-CB 3.35Å; T265-Y268 PolarHBondContact O-N 3.41Å; Q266-Y268 VanDerWaalsContact C-N 3.3Å; Q266-Y268 PolarHBondContact O-N 3.39Å; Y268-H270 VanDerWaalsContact C-N 3.33Å; Y268-H270 PolarHBondContact O-N 3.32Å; Y268-D271 PolarHBondContact O-N 2.88Å; Y268-M272 HydrophobicContact CD1-CG 4.16Å; Y268-M272 HydrophobicContact CD2-CE 3.69Å; Y268-M272 HydrophobicContact CD2-CG 4.38Å; Y268-M272 HydrophobicContact CE1-CG 3.66Å; Y268-M272 HydrophobicContact CE2-CE 3.36Å; Y268-M272 HydrophobicContact CE2-CG 3.9Å; Y268-M272 HydrophobicContact CE2-SD 3.85Å; Y268-M272 HydrophobicContact CG-CG 4.49Å; Y268-M272 WeakPolarHBondContact O-CG 3.33Å; Y268-M272 PolarHBondContact O-N 3.04Å
269	F	98.1	Very high	97	Very high	15 Å²	15	59.4 Å²	59.4	7%	0.066	28%	0.279	C	S	.	.	H	α-helix	trans	-67.5	-34.1	-179.4	-68.6	-54.3	0	0	0	113	M211 A216 F219 I230 T265 Q266 S267 M272 R273	M211-F269 HydrophobicContact CE-CE1 3.67Å; M211-F269 HydrophobicContact CE-CZ 3.95Å; A216-F269 HydrophobicContact CB-CD1 4.23Å; A216-F269 HydrophobicContact CB-CE1 4.19Å; A216-F269 WeakPolarHBondContact O-CD1 3.35Å; A216-F269 WeakPolarHBondContact O-CE1 3.43Å; F219-F269 HydrophobicContact CB-CD1 4.22Å; F219-F269 HydrophobicContact CB-CE1 3.61Å; F219-F269 HydrophobicContact CB-CE2 4.3Å; F219-F269 HydrophobicContact CB-CZ 3.66Å; I230-F269 HydrophobicContact CB-CE2 3.98Å; I230-F269 HydrophobicContact CB-CZ 3.94Å; I230-F269 HydrophobicContact CD1-CZ 3.87Å; I230-F269 HydrophobicContact CG1-CE2 4.27Å; I230-F269 HydrophobicContact CG1-CZ 3.84Å; I230-F269 HydrophobicContact CG2-CE2 3.91Å; I230-F269 HydrophobicContact CG2-CZ 4.33Å; T265-F269 HydrophobicContact CG2-CD2 3.95Å; T265-F269 HydrophobicContact CG2-CE2 3.45Å; T265-F269 VanDerWaalsContact CG2-CE2 3.45Å; T265-F269 HydrophobicContact CG2-CZ 4.36Å; T265-F269 WeakPolarHBondContact O-CD2 3.44Å; T265-F269 PolarHBondContact O-N 3.35Å; T265-F269 VanDerWaalsContact O-N 3.14Å; Q266-F269 PolarHBondContact O-N 3.28Å; S267-F269 PolarHBondContact O-N 3.34Å; F269-M272 PolarHBondContact O-N 3.48Å; F269-R273 PolarHBondContact O-N 3.46Å; F269-R273 VanDerWaalsContact O-N 3.13Å
270	H	96.1	Very high	96.7	Very high	91 Å²	91	59.8 Å²	59.8	42%	0.421	28%	0.282	S	S	.	.	H	α-helix	trans	-59	-50.2	170.9	-173.5	-76.3	0	0	0	110.7	Q266 S267 Y268 M272 R273 D274	Q266-H270 PolarHBondContact O-N 3.22Å; S267-H270 WeakPolarHBondContact O-CB 3.38Å; S267-H270 PolarHBondContact O-N 3.29Å; Y268-H270 VanDerWaalsContact C-N 3.33Å; Y268-H270 PolarHBondContact O-N 3.32Å; H270-M272 PolarHBondContact O-N 3.35Å; H270-R273 PolarHBondContact CD2-NH2 3.18Å; H270-R273 VanDerWaalsContact CD2-NH2 3.29Å; H270-R273 PolarHBondContact CE1-NH2 2.83Å; H270-R273 PolarHBondContact NE2-NH2 3.43Å; H270-R273 WeakPolarHBondContact O-CB 3.45Å; H270-R273 PolarHBondContact O-N 2.91Å; H270-D274 IonicContact CE1-OD1 2.92Å; H270-D274 IonicContact CE1-OD2 2.77Å; H270-D274 PolarHBondContact CE1-OD2 3.48Å; H270-D274 IonicContact ND1-OD2 3.86Å; H270-D274 PolarHBondContact ND1-OD2 3.04Å; H270-D274 PolarHBondContact O-N 3.21Å; H270-D274 VanDerWaalsContact O-N 3.13Å
271	D	97.4	Very high	96.4	Very high	64 Å²	64	65.4 Å²	65.4	34%	0.342	30%	0.3	S	S	.	.	H	α-helix	trans	-63.7	-39.1	179.5	-66.2	-19	0	0	0	112.5	S267 Y268 R273 D274 K275	S267-D271 WeakPolarHBondContact O-CB 3.5Å; S267-D271 PolarHBondContact O-N 2.92Å; Y268-D271 PolarHBondContact O-N 2.88Å; D271-R273 VanDerWaalsContact C-N 3.35Å; D271-D274 PolarHBondContact O-N 2.93Å; D271-K275 WeakPolarHBondContact O-CB 3.34Å; D271-K275 VanDerWaalsContact O-CG 3.27Å; D271-K275 WeakPolarHBondContact O-CG 3.08Å; D271-K275 PolarHBondContact O-N 3.44Å
272	M	97.5	Very high	96.2	Very high	5 Å²	5	72.2 Å²	72.2	3%	0.025	33%	0.326	C	S	.	.	H	α-helix	trans	-64	-40.6	177.6	-68.2	-47.2	112.1	0	0	111.8	P213 A216 Y268 F269 H270 K275 V276	P213-M272 HydrophobicContact CB-SD 3.98Å; P213-M272 HydrophobicContact CG-SD 3.89Å; A216-M272 HydrophobicContact CB-CB 4.02Å; A216-M272 HydrophobicContact CB-CG 3.75Å; Y268-M272 HydrophobicContact CD1-CG 4.16Å; Y268-M272 HydrophobicContact CD2-CE 3.69Å; Y268-M272 HydrophobicContact CD2-CG 4.38Å; Y268-M272 HydrophobicContact CE1-CG 3.66Å; Y268-M272 HydrophobicContact CE2-CE 3.36Å; Y268-M272 HydrophobicContact CE2-CG 3.9Å; Y268-M272 HydrophobicContact CE2-SD 3.85Å; Y268-M272 HydrophobicContact CG-CG 4.49Å; Y268-M272 WeakPolarHBondContact O-CG 3.33Å; Y268-M272 PolarHBondContact O-N 3.04Å; F269-M272 PolarHBondContact O-N 3.48Å; H270-M272 PolarHBondContact O-N 3.35Å; M272-K275 HydrophobicContact CE-CD 3.89Å; M272-K275 PolarHBondContact O-N 2.91Å; M272-K275 HydrophobicContact SD-CD 4.02Å; M272-V276 WeakPolarHBondContact O-CG2 3.44Å; M272-V276 PolarHBondContact O-N 3.29Å
273	R	95.3	Very high	95.8	Very high	93 Å²	93	74.9 Å²	74.9	35%	0.351	34%	0.34	S	S	.	.	H	α-helix	trans	-59.5	-48.6	174.2	-175.9	-166.3	66.4	-160.6	-8.2	110.8	I217 F269 H270 D271 K275 V276 Q277	I217-R273 HydrophobicContact CG2-CB 4.41Å; F269-R273 PolarHBondContact O-N 3.46Å; F269-R273 VanDerWaalsContact O-N 3.13Å; H270-R273 PolarHBondContact CD2-NH2 3.18Å; H270-R273 VanDerWaalsContact CD2-NH2 3.29Å; H270-R273 PolarHBondContact CE1-NH2 2.83Å; H270-R273 PolarHBondContact NE2-NH2 3.43Å; H270-R273 WeakPolarHBondContact O-CB 3.45Å; H270-R273 PolarHBondContact O-N 2.91Å; D271-R273 VanDerWaalsContact C-N 3.35Å; R273-K275 VanDerWaalsContact C-N 3.3Å; R273-K275 PolarHBondContact O-N 2.92Å; R273-V276 PolarHBondContact O-N 2.84Å; R273-Q277 HydrophobicContact CG-CG 4.47Å; R273-Q277 WeakPolarHBondContact O-CB 3.5Å; R273-Q277 VanDerWaalsContact O-CG 3.3Å; R273-Q277 WeakPolarHBondContact O-CG 3.43Å; R273-Q277 PolarHBondContact O-N 3.2Å
274	D	96.1	Very high	95.4	Very high	43 Å²	43	75.3 Å²	75.3	23%	0.23	34%	0.338	C	S	.	.	H	α-helix	trans	-64.2	-37.5	-179.7	-65.2	0.1	0	0	0	111.2	H270 D271 K278	H270-D274 IonicContact CE1-OD1 2.92Å; H270-D274 IonicContact CE1-OD2 2.77Å; H270-D274 PolarHBondContact CE1-OD2 3.48Å; H270-D274 IonicContact ND1-OD2 3.86Å; H270-D274 PolarHBondContact ND1-OD2 3.04Å; H270-D274 PolarHBondContact O-N 3.21Å; H270-D274 VanDerWaalsContact O-N 3.13Å; D271-D274 PolarHBondContact O-N 2.93Å; D274-K278 WeakPolarHBondContact O-CB 3.41Å; D274-K278 VanDerWaalsContact O-CG 3.23Å; D274-K278 WeakPolarHBondContact O-CG 3.25Å; D274-K278 PolarHBondContact O-N 3.01Å
275	K	95.7	Very high	94.9	Very high	100 Å²	100	79.6 Å²	79.6	44%	0.435	36%	0.358	S	S	.	.	H	α-helix	trans	-61.4	-48.2	174.1	-77.1	177.2	-173.3	-176	0	112.1	D271 M272 R273 K278 R279	D271-K275 WeakPolarHBondContact O-CB 3.34Å; D271-K275 VanDerWaalsContact O-CG 3.27Å; D271-K275 WeakPolarHBondContact O-CG 3.08Å; D271-K275 PolarHBondContact O-N 3.44Å; M272-K275 HydrophobicContact CE-CD 3.89Å; M272-K275 PolarHBondContact O-N 2.91Å; M272-K275 HydrophobicContact SD-CD 4.02Å; R273-K275 VanDerWaalsContact C-N 3.3Å; R273-K275 PolarHBondContact O-N 2.92Å; K275-K278 PolarHBondContact O-N 3.19Å; K275-R279 WeakPolarHBondContact O-CG 3.29Å; K275-R279 PolarHBondContact O-N 3Å; K275-R279 VanDerWaalsContact O-N 3.1Å
276	V	96.1	Very high	94.3	Very high	31 Å²	31	84.2 Å²	84.2	19%	0.188	38%	0.379	C	S	.	.	H	α-helix	trans	-66.2	-43.7	179.6	173.5	0	0	0	0	110.9	P213 I217 M272 R273 K278 R279 H280	P213-V276 HydrophobicContact CB-CG2 3.73Å; I217-V276 HydrophobicContact CD1-CG1 4.28Å; I217-V276 HydrophobicContact CG2-CB 4.16Å; I217-V276 HydrophobicContact CG2-CG2 3.83Å; M272-V276 WeakPolarHBondContact O-CG2 3.44Å; M272-V276 PolarHBondContact O-N 3.29Å; R273-V276 PolarHBondContact O-N 2.84Å; V276-K278 VanDerWaalsContact C-N 3.35Å; V276-K278 PolarHBondContact O-N 3.41Å; V276-R279 WeakPolarHBondContact O-CB 3.4Å; V276-R279 PolarHBondContact O-N 3.29Å; V276-R279 VanDerWaalsContact O-N 3.11Å; V276-H280 PolarHBondContact O-N 3.2Å
277	Q	94.6	Very high	93.5	Very high	113 Å²	113	84 Å²	84	53%	0.528	38%	0.382	S	S	.	.	H	α-helix	trans	-59.8	-43.1	176.3	-73.7	175	-11.5	0	0	112.3	R273 R279 H280 R281	R273-Q277 HydrophobicContact CG-CG 4.47Å; R273-Q277 WeakPolarHBondContact O-CB 3.5Å; R273-Q277 VanDerWaalsContact O-CG 3.3Å; R273-Q277 WeakPolarHBondContact O-CG 3.43Å; R273-Q277 PolarHBondContact O-N 3.2Å; Q277-R279 VanDerWaalsContact C-N 3.31Å; Q277-R279 PolarHBondContact O-N 3.5Å; Q277-H280 PolarHBondContact O-N 3.5Å; Q277-R281 PolarHBondContact O-N 2.79Å
278	K	95.1	Very high	92.7	Very high	130 Å²	130	84.7 Å²	84.7	57%	0.565	39%	0.386	S	S	*	.	H	α-helix	trans	-64.9	-31.1	175.5	-75	174	-177.8	176.7	0	113	D274 K275 V276 R282	D274-K278 WeakPolarHBondContact O-CB 3.41Å; D274-K278 VanDerWaalsContact O-CG 3.23Å; D274-K278 WeakPolarHBondContact O-CG 3.25Å; D274-K278 PolarHBondContact O-N 3.01Å; K275-K278 PolarHBondContact O-N 3.19Å; V276-K278 VanDerWaalsContact C-N 3.35Å; V276-K278 PolarHBondContact O-N 3.41Å; K278-R282 WeakPolarHBondContact O-CG 3.38Å; K278-R282 PolarHBondContact O-N 2.69Å; K278-R282 PolarHBondContact O-NE 3.2Å; K278-R282 VanDerWaalsContact O-NE 3.09Å
279	R	93.7	Very high	91.6	Very high	106 Å²	106	90.4 Å²	90.4	40%	0.4	41%	0.413	S	S	.	.	H	α-helix	trans	-68.6	-46.9	172.6	-72.7	174.9	-177.7	177.4	-1.8	110.8	E214 K275 V276 Q277 R281 R282 N283	E214-R279 IonicContact OE1-CZ 3.36Å; E214-R279 IonicContact OE1-NH1 3.27Å; E214-R279 PolarHBondContact OE1-NH1 2.88Å; E214-R279 IonicContact OE2-NH1 3.53Å; K275-R279 WeakPolarHBondContact O-CG 3.29Å; K275-R279 PolarHBondContact O-N 3Å; K275-R279 VanDerWaalsContact O-N 3.1Å; V276-R279 WeakPolarHBondContact O-CB 3.4Å; V276-R279 PolarHBondContact O-N 3.29Å; V276-R279 VanDerWaalsContact O-N 3.11Å; Q277-R279 VanDerWaalsContact C-N 3.31Å; Q277-R279 PolarHBondContact O-N 3.5Å; R279-R281 VanDerWaalsContact C-N 3.31Å; R279-R281 PolarHBondContact O-N 3.35Å; R279-R282 PolarHBondContact O-N 3.04Å; R279-N283 PolarHBondContact O-N 3.47Å; R279-N283 PolarHBondContact O-OD1 3Å
280	H	91.8	Very high	90.6	Very high	111 Å²	111	94.1 Å²	94.1	51%	0.514	43%	0.431	S	S	.	.	H	α-helix	trans	-58.7	-41.5	178.3	-167.5	54.1	0	0	0	112.7	V276 Q277 N283 K284	V276-H280 PolarHBondContact O-N 3.2Å; Q277-H280 PolarHBondContact O-N 3.5Å; H280-N283 PolarHBondContact O-N 3.23Å; H280-K284 VanDerWaalsContact NE2-CE 3.28Å; H280-K284 WeakPolarHBondContact NE2-CE 3.31Å; H280-K284 WeakPolarHBondContact O-CG 3.49Å; H280-K284 PolarHBondContact O-N 3.16Å; H280-K284 VanDerWaalsContact O-N 3.09Å
281	R	91.8	Very high	89.7	Confident	161 Å²	161	96.1 Å²	96.1	61%	0.608	44%	0.444	S	S	*	.	H	α-helix	trans	-62	-46.2	177.4	-163.1	-176.7	76.9	-174.3	-0.5	112.2	Q277 R279 N283 K284 E285	Q277-R281 PolarHBondContact O-N 2.79Å; R279-R281 VanDerWaalsContact C-N 3.31Å; R279-R281 PolarHBondContact O-N 3.35Å; R281-N283 PolarHBondContact O-N 3.33Å; R281-K284 PolarHBondContact O-N 2.94Å; R281-E285 WeakPolarHBondContact CG-OE1 3.28Å; R281-E285 IonicContact NE-OE1 3.71Å; R281-E285 PolarHBondContact NE-OE1 3.45Å; R281-E285 WeakPolarHBondContact O-CG 3.49Å; R281-E285 PolarHBondContact O-N 3.18Å; R281-E285 VanDerWaalsContact O-N 3.07Å
282	R	92.9	Very high	88.6	Confident	143 Å²	143	101.5 Å²	101.5	54%	0.54	47%	0.465	S	S	.	.	H	α-helix	trans	-64.1	-39.5	178.7	-74.2	-179	-73.5	-173.5	1.8	112.5	K278 R279 K284 E285 H286	K278-R282 WeakPolarHBondContact O-CG 3.38Å; K278-R282 PolarHBondContact O-N 2.69Å; K278-R282 PolarHBondContact O-NE 3.2Å; K278-R282 VanDerWaalsContact O-NE 3.09Å; R279-R282 PolarHBondContact O-N 3.04Å; R282-K284 VanDerWaalsContact C-N 3.33Å; R282-K284 PolarHBondContact O-N 3.31Å; R282-E285 PolarHBondContact O-N 3.07Å; R282-H286 WeakPolarHBondContact O-CB 3.46Å; R282-H286 PolarHBondContact O-N 3.19Å
283	N	90.6	Very high	87.2	Confident	97 Å²	97	107.7 Å²	107.7	52%	0.519	50%	0.498	S	S	.	.	H	α-helix	trans	-66.4	-36.5	177.3	-69.4	10.8	0	0	0	111.8	R279 H280 R281 N287	R279-N283 PolarHBondContact O-N 3.47Å; R279-N283 PolarHBondContact O-OD1 3Å; H280-N283 PolarHBondContact O-N 3.23Å; R281-N283 PolarHBondContact O-N 3.33Å; N283-N287 WeakPolarHBondContact O-CB 3.42Å; N283-N287 PolarHBondContact O-N 2.96Å; N283-N287 PolarHBondContact O-OD1 3.03Å; N283-N287 VanDerWaalsContact O-OD1 3.13Å
284	K	88.8	Confident	85.3	Confident	121 Å²	121	111.1 Å²	111.1	53%	0.526	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-44.1	173.8	-75.7	-176.6	173.6	-174.9	0	112.3	H280 R281 R282 H286 N287 S288	H280-K284 VanDerWaalsContact NE2-CE 3.28Å; H280-K284 WeakPolarHBondContact NE2-CE 3.31Å; H280-K284 WeakPolarHBondContact O-CG 3.49Å; H280-K284 PolarHBondContact O-N 3.16Å; H280-K284 VanDerWaalsContact O-N 3.09Å; R281-K284 PolarHBondContact O-N 2.94Å; R282-K284 VanDerWaalsContact C-N 3.33Å; R282-K284 PolarHBondContact O-N 3.31Å; K284-H286 VanDerWaalsContact C-N 3.33Å; K284-N287 PolarHBondContact O-N 3.23Å; K284-S288 WeakPolarHBondContact O-CB 3.46Å; K284-S288 PolarHBondContact O-N 2.8Å; K284-S288 PolarHBondContact O-OG 2.89Å
285	E	87.8	Confident	83.4	Confident	94 Å²	94	118.3 Å²	118.3	44%	0.439	57%	0.565	S	S	.	*	H	α-helix	trans	-60.4	-44.8	177.5	-71.4	163.5	-169.6	0	0	110.4	R281 R282 S288 Q289	R281-E285 WeakPolarHBondContact CG-OE1 3.28Å; R281-E285 IonicContact NE-OE1 3.71Å; R281-E285 PolarHBondContact NE-OE1 3.45Å; R281-E285 WeakPolarHBondContact O-CG 3.49Å; R281-E285 PolarHBondContact O-N 3.18Å; R281-E285 VanDerWaalsContact O-N 3.07Å; R282-E285 PolarHBondContact O-N 3.07Å; E285-S288 PolarHBondContact O-N 2.91Å; E285-Q289 WeakPolarHBondContact O-CG 3.3Å; E285-Q289 PolarHBondContact O-N 3.12Å; E285-Q289 VanDerWaalsContact O-N 3.08Å
286	H	85.9	Confident	82.8	Confident	96 Å²	96	119.3 Å²	119.3	44%	0.444	57%	0.571	S	S	.	*	H	α-helix	trans	-64.1	-49.3	177.2	-173	45.6	0	0	0	113	R282 K284 S288 Q289 E290	R282-H286 WeakPolarHBondContact O-CB 3.46Å; R282-H286 PolarHBondContact O-N 3.19Å; K284-H286 VanDerWaalsContact C-N 3.33Å; H286-S288 PolarHBondContact O-N 3.42Å; H286-Q289 WeakPolarHBondContact O-CB 3.39Å; H286-Q289 PolarHBondContact O-N 3.21Å; H286-Q289 VanDerWaalsContact O-N 3.11Å; H286-E290 IonicContact CE1-OE1 3.03Å; H286-E290 IonicContact NE2-OE1 3.24Å; H286-E290 PolarHBondContact NE2-OE1 3.19Å; H286-E290 PolarHBondContact O-N 3.09Å
287	N	81.7	Confident	82.1	Confident	100 Å²	100	123.9 Å²	123.9	54%	0.535	59%	0.591	S	S	.	*	H	α-helix	trans	-64.1	-30.7	178.4	-67.7	10.7	0	0	0	112.4	N283 K284 L291	N283-N287 WeakPolarHBondContact O-CB 3.42Å; N283-N287 PolarHBondContact O-N 2.96Å; N283-N287 PolarHBondContact O-OD1 3.03Å; N283-N287 VanDerWaalsContact O-OD1 3.13Å; K284-N287 PolarHBondContact O-N 3.23Å; N287-L291 WeakPolarHBondContact O-CB 3.48Å; N287-L291 PolarHBondContact O-N 3.22Å
288	S	80.9	Confident	81.4	Confident	61 Å²	61	124.5 Å²	124.5	43%	0.427	60%	0.595	S	S	.	*	H	α-helix	trans	-68.7	-41.7	175	-54.9	0	0	0	0	110.6	K284 E285 H286 L291 F292	K284-S288 WeakPolarHBondContact O-CB 3.46Å; K284-S288 PolarHBondContact O-N 2.8Å; K284-S288 PolarHBondContact O-OG 2.89Å; E285-S288 PolarHBondContact O-N 2.91Å; H286-S288 PolarHBondContact O-N 3.42Å; S288-L291 PolarHBondContact O-N 2.87Å; S288-F292 WeakPolarHBondContact O-CD2 3.23Å; S288-F292 PolarHBondContact O-N 3.13Å
289	Q	76	Confident	80.6	Confident	123 Å²	123	124.2 Å²	124.2	58%	0.575	60%	0.597	S	S	*	*	H	α-helix	trans	-62.1	-47.1	175.6	-74.6	173.9	-28.1	0	0	111.9	E285 H286 L291 F292 D293	E285-Q289 WeakPolarHBondContact O-CG 3.3Å; E285-Q289 PolarHBondContact O-N 3.12Å; E285-Q289 VanDerWaalsContact O-N 3.08Å; H286-Q289 WeakPolarHBondContact O-CB 3.39Å; H286-Q289 PolarHBondContact O-N 3.21Å; H286-Q289 VanDerWaalsContact O-N 3.11Å; Q289-L291 VanDerWaalsContact C-N 3.26Å; Q289-L291 PolarHBondContact O-N 3.27Å; Q289-F292 PolarHBondContact O-N 2.94Å; Q289-F292 VanDerWaalsContact O-N 3.1Å; Q289-D293 PolarHBondContact O-N 2.72Å
290	E	76.1	Confident	79.7	Confident	93 Å²	93	125.3 Å²	125.3	44%	0.435	61%	0.609	S	S	.	*	H	α-helix	trans	-59.7	-36.6	177.2	-69.6	-174.6	160.1	0	0	112.4	H286 F292 D293 F294	H286-E290 IonicContact CE1-OE1 3.03Å; H286-E290 IonicContact NE2-OE1 3.24Å; H286-E290 PolarHBondContact NE2-OE1 3.19Å; H286-E290 PolarHBondContact O-N 3.09Å; E290-F292 VanDerWaalsContact C-N 3.31Å; E290-F292 PolarHBondContact O-N 2.81Å; E290-D293 PolarHBondContact O-N 2.75Å; E290-F294 WeakPolarHBondContact O-CD2 3.29Å
291	L	78.4	Confident	78.9	Confident	134 Å²	134	126.3 Å²	126.3	70%	0.702	62%	0.615	S	S	*	*	H	α-helix	trans	-66.6	-30	177.8	-172.7	65.5	0	0	0	113.1	N287 S288 Q289	N287-L291 WeakPolarHBondContact O-CB 3.48Å; N287-L291 PolarHBondContact O-N 3.22Å; S288-L291 PolarHBondContact O-N 2.87Å; Q289-L291 VanDerWaalsContact C-N 3.26Å; Q289-L291 PolarHBondContact O-N 3.27Å
292	F	74.7	Confident	78	Confident	177 Å²	177	123.8 Å²	123.8	78%	0.776	62%	0.616	S	S	*	*	H	α-helix	trans	-82.5	-15.9	175.5	-72.7	-69.8	0	0	0	113.3	S288 Q289 E290	S288-F292 WeakPolarHBondContact O-CD2 3.23Å; S288-F292 PolarHBondContact O-N 3.13Å; Q289-F292 PolarHBondContact O-N 2.94Å; Q289-F292 VanDerWaalsContact O-N 3.1Å; E290-F292 VanDerWaalsContact C-N 3.31Å; E290-F292 PolarHBondContact O-N 2.81Å
293	D	67.6	Low	76.9	Confident	135 Å²	135	122.3 Å²	122.3	72%	0.722	62%	0.622	S	S	*	*	S	Bend	trans	-92.6	2.8	-179.6	-74.1	-22.8	0	0	0	113.6	Q289 E290	Q289-D293 PolarHBondContact O-N 2.72Å; E290-D293 PolarHBondContact O-N 2.75Å
294	F	55.9	Low	75.7	Confident	165 Å²	165	124.4 Å²	124.4	72%	0.724	63%	0.63	S	S	*	*			trans	-85.3	118.3	169.9	-80.2	-80	0	0	0	110.8	E290	E290-F294 WeakPolarHBondContact O-CD2 3.29Å
295	P	54.9	Low	74.5	Confident	194 Å²	194	124.7 Å²	124.7	100%	1.26	64%	0.64	S	S	*	*			trans	-75.7	0	-172.2	30.9	-34.9	0	0	0	114.6

Retrieved 295 of 295 residues in 270 ms (Link to these results)

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