G4VHH4_SCHMA Loading...

Saposin B-type domain-containing protein

AlphaFold DB , UniProt , Accession G4VHH4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 195 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	61.1	Low	70	Confident	201 Å²	201	129.1 Å²	129.1	99%	0.99	63%	0.631	S	S	*	*				0	-42	0	-79.9	-159.9	143.4	0	0	113	T3 K4 I5	M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 3.31Å; M1-K4 PolarHBondContact O-N 3.18Å; M1-I5 PolarHBondContact O-N 2.9Å
2	L	63.2	Low	69.9	Low	129 Å²	129	127.3 Å²	127.3	68%	0.675	63%	0.625	S	S	*	*	H	α-helix	trans	-53.9	-39	178.8	-77.1	136.4	0	0	0	115	K4 I5 F6	L2-K4 VanDerWaalsContact C-N 3.3Å; L2-K4 PolarHBondContact O-N 3.43Å; L2-I5 PolarHBondContact O-N 2.93Å; L2-I5 VanDerWaalsContact O-N 3.13Å; L2-F6 HydrophobicContact CD2-CE2 4.4Å; L2-F6 VanDerWaalsContact O-CD2 3.32Å; L2-F6 WeakPolarHBondContact O-CD2 3.35Å; L2-F6 PolarHBondContact O-N 3.28Å
3	T	64	Low	69.4	Low	112 Å²	112	119.7 Å²	119.7	69%	0.687	60%	0.599	S	S	*	*	H	α-helix	trans	-63.3	-31.5	179.7	0.4	0	0	0	0	113.9	M1 F7	M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 3.31Å; T3-F7 PolarHBondContact O-N 3.02Å
4	K	67.1	Low	68.6	Low	167 Å²	167	116.1 Å²	116.1	73%	0.726	58%	0.582	S	S	*	*	H	α-helix	trans	-74.8	-34.1	175.1	-68.7	-173.7	175.7	-175.4	0	111.7	M1 L2 F7 I8	M1-K4 PolarHBondContact O-N 3.18Å; L2-K4 VanDerWaalsContact C-N 3.3Å; L2-K4 PolarHBondContact O-N 3.43Å; K4-F7 PolarHBondContact O-N 3.34Å; K4-I8 WeakPolarHBondContact O-CG1 3.34Å; K4-I8 PolarHBondContact O-N 3.42Å
5	I	74.9	Confident	67.5	Low	92 Å²	92	117.5 Å²	117.5	47%	0.472	58%	0.583	S	S	.	*	H	α-helix	trans	-68.5	-43.8	176.8	-64.8	169.9	0	0	0	110.3	M1 L2 F7 I8 I9	M1-I5 PolarHBondContact O-N 2.9Å; L2-I5 PolarHBondContact O-N 2.93Å; L2-I5 VanDerWaalsContact O-N 3.13Å; I5-F7 VanDerWaalsContact C-N 3.34Å; I5-F7 PolarHBondContact O-N 3.12Å; I5-I8 PolarHBondContact O-N 3.07Å; I5-I9 HydrophobicContact CG2-CD1 3.73Å; I5-I9 HydrophobicContact CG2-CG1 4.42Å; I5-I9 VanDerWaalsContact O-CG1 3.28Å; I5-I9 WeakPolarHBondContact O-CG1 3.29Å; I5-I9 PolarHBondContact O-N 3.4Å
6	F	73.6	Confident	66.7	Low	138 Å²	138	115.6 Å²	115.6	61%	0.605	58%	0.584	S	S	*	*	H	α-helix	trans	-62.6	-38.4	174.5	-84.6	-76	0	0	0	112.7	L2 I9 F10	L2-F6 HydrophobicContact CD2-CE2 4.4Å; L2-F6 VanDerWaalsContact O-CD2 3.32Å; L2-F6 WeakPolarHBondContact O-CD2 3.35Å; L2-F6 PolarHBondContact O-N 3.28Å; F6-I9 PolarHBondContact O-N 2.75Å; F6-F10 WeakPolarHBondContact O-CB 3.45Å; F6-F10 PolarHBondContact O-N 2.74Å
7	F	74.2	Confident	65.8	Low	138 Å²	138	115.3 Å²	115.3	61%	0.605	59%	0.59	S	S	*	*	H	α-helix	trans	-64.9	-41.9	174.7	-114.2	-85.9	0	0	0	112.5	T3 K4 I5 F10 L11	T3-F7 PolarHBondContact O-N 3.02Å; K4-F7 PolarHBondContact O-N 3.34Å; I5-F7 VanDerWaalsContact C-N 3.34Å; I5-F7 PolarHBondContact O-N 3.12Å; F7-F10 PolarHBondContact O-N 2.94Å; F7-L11 WeakPolarHBondContact O-CB 3.36Å; F7-L11 WeakPolarHBondContact O-CG 3.37Å; F7-L11 PolarHBondContact O-N 3.21Å
8	I	73.5	Confident	64.8	Low	99 Å²	99	115.4 Å²	115.4	51%	0.508	59%	0.591	S	S	.	*	H	α-helix	trans	-65.5	-44.1	176.7	-70	169.8	0	0	0	110.6	K4 I5 F10 L11 I12	K4-I8 WeakPolarHBondContact O-CG1 3.34Å; K4-I8 PolarHBondContact O-N 3.42Å; I5-I8 PolarHBondContact O-N 3.07Å; I8-F10 VanDerWaalsContact C-N 3.33Å; I8-F10 PolarHBondContact O-N 2.77Å; I8-L11 PolarHBondContact O-N 3Å; I8-I12 HydrophobicContact CG2-CD1 3.59Å; I8-I12 HydrophobicContact CG2-CG1 4.38Å; I8-I12 WeakPolarHBondContact O-CB 3.38Å; I8-I12 WeakPolarHBondContact O-CD1 3.07Å; I8-I12 WeakPolarHBondContact O-CG1 3.45Å; I8-I12 PolarHBondContact O-N 3.21Å
9	I	73.3	Confident	63.7	Low	104 Å²	104	115.5 Å²	115.5	53%	0.533	59%	0.587	S	S	.	*	H	α-helix	trans	-64.1	-38.4	176.3	-65.2	168.6	0	0	0	111	I5 F6 I12 G13	I5-I9 HydrophobicContact CG2-CD1 3.73Å; I5-I9 HydrophobicContact CG2-CG1 4.42Å; I5-I9 VanDerWaalsContact O-CG1 3.28Å; I5-I9 WeakPolarHBondContact O-CG1 3.29Å; I5-I9 PolarHBondContact O-N 3.4Å; F6-I9 PolarHBondContact O-N 2.75Å; I9-I12 PolarHBondContact O-N 3.18Å; I9-G13 PolarHBondContact O-N 3.34Å
10	F	74.1	Confident	62.8	Low	136 Å²	136	114 Å²	114	60%	0.596	60%	0.601	S	S	*	*	H	α-helix	trans	-69.4	-38.8	176.8	-164.9	-103	0	0	0	112.3	F6 F7 I8 G13 L14	F6-F10 WeakPolarHBondContact O-CB 3.45Å; F6-F10 PolarHBondContact O-N 2.74Å; F7-F10 PolarHBondContact O-N 2.94Å; I8-F10 VanDerWaalsContact C-N 3.33Å; I8-F10 PolarHBondContact O-N 2.77Å; F10-G13 PolarHBondContact O-N 3.12Å; F10-L14 HydrophobicContact CD1-CD1 3.49Å; F10-L14 VanDerWaalsContact CD1-CD1 3.49Å; F10-L14 HydrophobicContact CD1-CG 4.29Å; F10-L14 HydrophobicContact CE1-CD1 3.35Å; F10-L14 HydrophobicContact CE1-CG 4.13Å; F10-L14 HydrophobicContact CG-CD1 4.43Å; F10-L14 HydrophobicContact CZ-CD1 4.18Å; F10-L14 VanDerWaalsContact O-CB 3.32Å; F10-L14 WeakPolarHBondContact O-CB 3.36Å; F10-L14 WeakPolarHBondContact O-CG 3.36Å; F10-L14 PolarHBondContact O-N 3.14Å
11	L	70.8	Confident	62.2	Low	104 Å²	104	117.4 Å²	117.4	55%	0.545	61%	0.614	S	S	.	*	H	α-helix	trans	-67.2	-39.3	173.9	-71.6	171.7	0	0	0	112	F7 I8 K15	F7-L11 WeakPolarHBondContact O-CB 3.36Å; F7-L11 WeakPolarHBondContact O-CG 3.37Å; F7-L11 PolarHBondContact O-N 3.21Å; I8-L11 PolarHBondContact O-N 3Å; L11-K15 WeakPolarHBondContact O-CB 3.43Å; L11-K15 PolarHBondContact O-N 3.24Å; L11-K15 VanDerWaalsContact O-N 3.1Å
12	I	69.1	Low	61.6	Low	108 Å²	108	109.7 Å²	109.7	55%	0.554	58%	0.579	S	S	*	*	H	α-helix	trans	-67.7	-40.8	173.7	-66.2	165.3	0	0	0	110.3	I8 I9 K15 S16	I8-I12 HydrophobicContact CG2-CD1 3.59Å; I8-I12 HydrophobicContact CG2-CG1 4.38Å; I8-I12 WeakPolarHBondContact O-CB 3.38Å; I8-I12 WeakPolarHBondContact O-CD1 3.07Å; I8-I12 WeakPolarHBondContact O-CG1 3.45Å; I8-I12 PolarHBondContact O-N 3.21Å; I9-I12 PolarHBondContact O-N 3.18Å; I12-K15 WeakPolarHBondContact O-CB 3.29Å; I12-K15 PolarHBondContact O-N 2.88Å; I12-S16 PolarHBondContact O-N 3.38Å; I12-S16 PolarHBondContact O-OG 3.37Å
13	G	64	Low	60.7	Low	28 Å²	28	106.2 Å²	106.2	29%	0.289	56%	0.561	S	S	.	*	H	α-helix	trans	-67.8	-38.1	178.3	0	0	0	0	0	114.1	I9 F10 S16 T17	I9-G13 PolarHBondContact O-N 3.34Å; F10-G13 PolarHBondContact O-N 3.12Å; G13-S16 WeakPolarHBondContact CA-OG 3.34Å; G13-S16 PolarHBondContact O-N 3.17Å; G13-S16 PolarHBondContact O-OG 3.16Å; G13-T17 PolarHBondContact O-N 3.44Å; G13-T17 PolarHBondContact O-OG1 3.02Å
14	L	57.8	Low	59.8	Low	69 Å²	69	108.3 Å²	108.3	36%	0.361	56%	0.563	S	S	.	*	H	α-helix	trans	-66.5	-37.3	171.9	-84.9	164.6	0	0	0	111.7	F10 S16 T17 I18	F10-L14 HydrophobicContact CD1-CD1 3.49Å; F10-L14 VanDerWaalsContact CD1-CD1 3.49Å; F10-L14 HydrophobicContact CD1-CG 4.29Å; F10-L14 HydrophobicContact CE1-CD1 3.35Å; F10-L14 HydrophobicContact CE1-CG 4.13Å; F10-L14 HydrophobicContact CG-CD1 4.43Å; F10-L14 HydrophobicContact CZ-CD1 4.18Å; F10-L14 VanDerWaalsContact O-CB 3.32Å; F10-L14 WeakPolarHBondContact O-CB 3.36Å; F10-L14 WeakPolarHBondContact O-CG 3.36Å; F10-L14 PolarHBondContact O-N 3.14Å; L14-S16 PolarHBondContact O-N 2.99Å; L14-T17 PolarHBondContact O-N 3.43Å; L14-I18 HydrophobicContact CD2-CD1 3.89Å
15	K	51.4	Low	59	Low	138 Å²	138	103.9 Å²	103.9	60%	0.6	55%	0.553	S	S	*	*	H	α-helix	trans	-62.6	-31.6	174.9	-166.5	176.3	-179.8	-176.5	0	112	L11 I12 I23	L11-K15 WeakPolarHBondContact O-CB 3.43Å; L11-K15 PolarHBondContact O-N 3.24Å; L11-K15 VanDerWaalsContact O-N 3.1Å; I12-K15 WeakPolarHBondContact O-CB 3.29Å; I12-K15 PolarHBondContact O-N 2.88Å; K15-I23 HydrophobicContact CG-CD1 4.08Å
16	S	54.5	Low	57.8	Low	86 Å²	86	102.5 Å²	102.5	60%	0.601	55%	0.551	S	S	*	*	H	α-helix	trans	-86.9	-13.8	-179.8	48.5	0	0	0	0	116	I12 G13 L14	I12-S16 PolarHBondContact O-N 3.38Å; I12-S16 PolarHBondContact O-OG 3.37Å; G13-S16 WeakPolarHBondContact CA-OG 3.34Å; G13-S16 PolarHBondContact O-N 3.17Å; G13-S16 PolarHBondContact O-OG 3.16Å; L14-S16 PolarHBondContact O-N 2.99Å
17	T	51.7	Low	56.9	Low	111 Å²	111	100.2 Å²	100.2	68%	0.681	54%	0.544	S	S	*	.	H	α-helix	trans	-110.4	-12.5	-171.6	41.2	0	0	0	0	114.9	G13 L14	G13-T17 PolarHBondContact O-N 3.44Å; G13-T17 PolarHBondContact O-OG1 3.02Å; L14-T17 PolarHBondContact O-N 3.43Å
18	I	47.5	Very low	56.2	Low	117 Å²	117	98 Å²	98	60%	0.6	54%	0.539	S	S	*	.	H	α-helix	trans	-114.4	-20.3	-177.7	-60.8	174.9	0	0	0	112.5	L14	L14-I18 HydrophobicContact CD2-CD1 3.89Å
19	F	44.5	Very low	55.5	Low	118 Å²	118	100.2 Å²	100.2	52%	0.518	55%	0.547	S	S	.	.			trans	-127.6	68.9	-174	-83	-68.9	0	0	0	111.9	E21 S22 I23	F19-E21 PolarHBondContact O-N 3.31Å; F19-S22 VanDerWaalsContact CD1-CB 3.41Å; F19-S22 WeakPolarHBondContact CD1-OG 3.18Å; F19-S22 VanDerWaalsContact CE1-OG 3.3Å; F19-S22 WeakPolarHBondContact CE1-OG 3.44Å; F19-S22 WeakPolarHBondContact CG-OG 3.36Å; F19-I23 HydrophobicContact CB-CG1 4.44Å
20	G	46.3	Very low	54.9	Low	84 Å²	84	102.5 Å²	102.5	87%	0.866	55%	0.553	S	S	*	*	S	Bend	trans	-75.4	-1.3	172.1	0	0	0	0	0	114.6
21	E	49.2	Very low	54.3	Low	187 Å²	187	101.5 Å²	101.5	87%	0.874	55%	0.551	S	S	*	*	S	Bend	trans	-145.4	3.1	-167.9	-138.7	163.6	-173.5	0	0	114.8	F19	F19-E21 PolarHBondContact O-N 3.31Å
22	S	49.3	Very low	54	Low	38 Å²	38	103.3 Å²	103.3	27%	0.266	56%	0.557	S	S	.	*	S	Bend	trans	-116.6	-8.2	-178.8	81.7	0	0	0	0	115.3	F19 S25 S26	F19-S22 VanDerWaalsContact CD1-CB 3.41Å; F19-S22 WeakPolarHBondContact CD1-OG 3.18Å; F19-S22 VanDerWaalsContact CE1-OG 3.3Å; F19-S22 WeakPolarHBondContact CE1-OG 3.44Å; F19-S22 WeakPolarHBondContact CG-OG 3.36Å; S22-S25 PolarHBondContact O-OG 3.4Å; S22-S26 PolarHBondContact O-OG 3.49Å
23	I	45	Very low	54	Low	57 Å²	57	103.5 Å²	103.5	29%	0.292	56%	0.558	S	S	.	*	H	α-helix	trans	-80.1	-33.5	-178.3	-64.4	177.6	0	0	0	109.7	K15 F19 S26 I27	K15-I23 HydrophobicContact CG-CD1 4.08Å; F19-I23 HydrophobicContact CB-CG1 4.44Å; I23-S26 PolarHBondContact O-OG 2.78Å; I23-I27 HydrophobicContact CG2-CD1 3.57Å; I23-I27 HydrophobicContact CG2-CG1 4.26Å; I23-I27 WeakPolarHBondContact O-CB 3.35Å; I23-I27 WeakPolarHBondContact O-CD1 3.41Å; I23-I27 WeakPolarHBondContact O-CG1 3.16Å; I23-I27 PolarHBondContact O-N 2.96Å
24	E	44.8	Very low	54.3	Low	155 Å²	155	107.1 Å²	107.1	72%	0.724	57%	0.567	S	S	*	*	H	α-helix	trans	-72.5	-36.3	-179.2	-154.3	160.6	-155.2	0	0	112.5	N28	E24-N28 WeakPolarHBondContact O-CB 3.03Å; E24-N28 VanDerWaalsContact O-CG 3.22Å; E24-N28 PolarHBondContact O-N 3.09Å; E24-N28 PolarHBondContact O-ND2 3.42Å
25	S	50.6	Low	55.1	Low	75 Å²	75	107 Å²	107	52%	0.524	57%	0.571	S	S	.	*	H	α-helix	trans	-69.2	-39	175.1	59.7	0	0	0	0	113.1	S22 N28 E29	S22-S25 PolarHBondContact O-OG 3.4Å; S25-N28 PolarHBondContact O-N 3.18Å; S25-E29 WeakPolarHBondContact O-CB 3.44Å; S25-E29 PolarHBondContact O-N 2.04Å
26	S	48.8	Very low	56.4	Low	62 Å²	62	103.7 Å²	103.7	43%	0.434	56%	0.558	S	S	.	*	H	α-helix	trans	-75.2	-28.3	177.8	50.2	0	0	0	0	113.2	S22 I23 F30	S22-S26 PolarHBondContact O-OG 3.49Å; I23-S26 PolarHBondContact O-OG 2.78Å; S26-F30 WeakPolarHBondContact O-CB 3.38Å; S26-F30 PolarHBondContact O-N 3.43Å
27	I	55.8	Low	57.7	Low	90 Å²	90	104.4 Å²	104.4	46%	0.462	55%	0.554	S	S	.	*	H	α-helix	trans	-69.3	-45.6	169.3	-70.3	168.8	0	0	0	110.3	I23 E29 F30 E31	I23-I27 HydrophobicContact CG2-CD1 3.57Å; I23-I27 HydrophobicContact CG2-CG1 4.26Å; I23-I27 WeakPolarHBondContact O-CB 3.35Å; I23-I27 WeakPolarHBondContact O-CD1 3.41Å; I23-I27 WeakPolarHBondContact O-CG1 3.16Å; I23-I27 PolarHBondContact O-N 2.96Å; I27-E29 VanDerWaalsContact C-N 3.33Å; I27-E29 PolarHBondContact O-N 3.14Å; I27-F30 PolarHBondContact O-N 3.32Å; I27-E31 WeakPolarHBondContact O-CB 3.06Å; I27-E31 PolarHBondContact O-N 3.26Å
28	N	57.9	Low	59.4	Low	92 Å²	92	102 Å²	102	49%	0.492	54%	0.537	S	S	.	.	H	α-helix	trans	-61.5	-39.5	177.4	-74.7	-15	0	0	0	112.4	E24 S25 Q32	E24-N28 WeakPolarHBondContact O-CB 3.03Å; E24-N28 VanDerWaalsContact O-CG 3.22Å; E24-N28 PolarHBondContact O-N 3.09Å; E24-N28 PolarHBondContact O-ND2 3.42Å; S25-N28 PolarHBondContact O-N 3.18Å; N28-Q32 WeakPolarHBondContact O-CB 3.18Å; N28-Q32 PolarHBondContact O-N 3.1Å
29	E	59.2	Low	61.4	Low	146 Å²	146	97.1 Å²	97.1	68%	0.682	51%	0.513	S	S	*	.	H	α-helix	trans	-67.4	-39	177	-167.9	175.6	-174.8	0	0	112	S25 I27 L33	S25-E29 WeakPolarHBondContact O-CB 3.44Å; S25-E29 PolarHBondContact O-N 2.04Å; I27-E29 VanDerWaalsContact C-N 3.33Å; I27-E29 PolarHBondContact O-N 3.14Å; E29-L33 VanDerWaalsContact O-CB 3.29Å; E29-L33 WeakPolarHBondContact O-CB 3.2Å; E29-L33 PolarHBondContact O-N 3.12Å
30	F	61.3	Low	63.3	Low	151 Å²	151	93.8 Å²	93.8	66%	0.662	50%	0.499	S	S	*	.	H	α-helix	trans	-70	-40.7	176.1	-175.5	-98	0	0	0	112.6	S26 I27 L33 H34	S26-F30 WeakPolarHBondContact O-CB 3.38Å; S26-F30 PolarHBondContact O-N 3.43Å; I27-F30 PolarHBondContact O-N 3.32Å; F30-L33 PolarHBondContact O-N 2.79Å; F30-H34 WeakPolarHBondContact O-CB 3.45Å; F30-H34 PolarHBondContact O-N 3.05Å
31	E	61.3	Low	65.2	Low	115 Å²	115	93 Å²	93	54%	0.537	48%	0.477	S	S	.	.	H	α-helix	trans	-67.5	-41	177.3	-167.4	167.3	-172.8	0	0	111.1	I27 H34 C35	I27-E31 WeakPolarHBondContact O-CB 3.06Å; I27-E31 PolarHBondContact O-N 3.26Å; E31-H34 PolarHBondContact O-N 3.24Å; E31-C35 PolarHBondContact O-N 3.06Å; E31-C35 PolarHBondContact O-SG 2.05Å; E31-C35 VanDerWaalsContact O-SG 3.4Å
32	Q	64.7	Low	67.2	Low	143 Å²	143	84.8 Å²	84.8	67%	0.668	44%	0.441	S	S	*	.	H	α-helix	trans	-64.5	-41.8	174.6	-170.1	172.1	9	0	0	112	N28 H34 C35 Q36	N28-Q32 WeakPolarHBondContact O-CB 3.18Å; N28-Q32 PolarHBondContact O-N 3.1Å; Q32-H34 VanDerWaalsContact C-N 3.32Å; Q32-H34 PolarHBondContact O-N 2.76Å; Q32-C35 PolarHBondContact O-N 3.09Å; Q32-Q36 WeakPolarHBondContact O-CB 3.29Å; Q32-Q36 PolarHBondContact O-N 3.41Å
33	L	69.4	Low	69.1	Low	112 Å²	112	83.1 Å²	83.1	59%	0.586	43%	0.428	S	S	*	.	H	α-helix	trans	-63.3	-38.9	175.4	-174.2	66.8	0	0	0	111.8	E29 F30 Q36 L37	E29-L33 VanDerWaalsContact O-CB 3.29Å; E29-L33 WeakPolarHBondContact O-CB 3.2Å; E29-L33 PolarHBondContact O-N 3.12Å; F30-L33 PolarHBondContact O-N 2.79Å; L33-Q36 PolarHBondContact O-N 2.91Å; L33-L37 WeakPolarHBondContact O-CB 3.33Å; L33-L37 PolarHBondContact O-N 3.41Å
34	H	69.2	Low	71.1	Confident	103 Å²	103	83.6 Å²	83.6	48%	0.477	43%	0.431	S	S	.	.	H	α-helix	trans	-66.8	-44	176.9	-176.5	-102.5	0	0	0	112	F30 E31 Q32 Q36 L37 I38	F30-H34 WeakPolarHBondContact O-CB 3.45Å; F30-H34 PolarHBondContact O-N 3.05Å; E31-H34 PolarHBondContact O-N 3.24Å; Q32-H34 VanDerWaalsContact C-N 3.32Å; Q32-H34 PolarHBondContact O-N 2.76Å; H34-Q36 PolarHBondContact O-N 3.35Å; H34-L37 PolarHBondContact O-N 3.41Å; H34-I38 WeakPolarHBondContact CE1-CD1 3.43Å; H34-I38 WeakPolarHBondContact O-CG1 3.31Å; H34-I38 PolarHBondContact O-N 3.21Å; H34-I38 VanDerWaalsContact O-N 3.09Å
35	C	74.1	Confident	73.1	Confident	66 Å²	66	80.6 Å²	80.6	45%	0.446	42%	0.419	S	S	.	.	H	α-helix	trans	-62.2	-41.5	175.2	-72.2	0	0	0	0	112.1	E31 Q32 I38 C39	E31-C35 PolarHBondContact O-N 3.06Å; E31-C35 PolarHBondContact O-SG 2.05Å; E31-C35 VanDerWaalsContact O-SG 3.4Å; Q32-C35 PolarHBondContact O-N 3.09Å; C35-I38 PolarHBondContact O-N 3.15Å; C35-C39 PolarHBondContact O-N 3.37Å; C35-C39 VanDerWaalsContact O-N 3.11Å
36	Q	79	Confident	75.1	Confident	69 Å²	69	77.7 Å²	77.7	32%	0.322	40%	0.398	S	S	.	.	H	α-helix	trans	-62.9	-46.7	176.2	-177.5	173.8	-10.6	0	0	111.8	Q32 L33 H34 I38 C39 E40	Q32-Q36 WeakPolarHBondContact O-CB 3.29Å; Q32-Q36 PolarHBondContact O-N 3.41Å; L33-Q36 PolarHBondContact O-N 2.91Å; H34-Q36 PolarHBondContact O-N 3.35Å; Q36-I38 VanDerWaalsContact C-N 3.32Å; Q36-I38 PolarHBondContact O-N 3.49Å; Q36-C39 PolarHBondContact O-N 2.97Å; Q36-E40 HydrophobicContact CG-CG 4.31Å; Q36-E40 WeakPolarHBondContact CG-OE1 3.38Å; Q36-E40 PolarHBondContact NE2-OE1 2.85Å; Q36-E40 WeakPolarHBondContact O-CB 3.38Å; Q36-E40 WeakPolarHBondContact O-CG 3.01Å; Q36-E40 PolarHBondContact O-N 3.11Å
37	L	83.1	Confident	77	Confident	101 Å²	101	76.6 Å²	76.6	53%	0.529	39%	0.385	S	S	.	.	H	α-helix	trans	-61	-39.5	179.6	-179.3	63.3	0	0	0	112.4	L33 H34 T41	L33-L37 WeakPolarHBondContact O-CB 3.33Å; L33-L37 PolarHBondContact O-N 3.41Å; H34-L37 PolarHBondContact O-N 3.41Å; L37-T41 VanDerWaalsContact O-CB 3.28Å; L37-T41 WeakPolarHBondContact O-CB 3.44Å; L37-T41 PolarHBondContact O-N 3.34Å; L37-T41 PolarHBondContact O-OG1 3.33Å
38	I	86.9	Confident	78.5	Confident	62 Å²	62	72.5 Å²	72.5	32%	0.318	37%	0.365	S	S	.	.	H	α-helix	trans	-63.4	-47.7	176.3	-72.7	171.3	0	0	0	110.7	H34 C35 Q36 T41 C42 L112	H34-I38 WeakPolarHBondContact CE1-CD1 3.43Å; H34-I38 WeakPolarHBondContact O-CG1 3.31Å; H34-I38 PolarHBondContact O-N 3.21Å; H34-I38 VanDerWaalsContact O-N 3.09Å; C35-I38 PolarHBondContact O-N 3.15Å; Q36-I38 VanDerWaalsContact C-N 3.32Å; Q36-I38 PolarHBondContact O-N 3.49Å; I38-T41 PolarHBondContact O-N 3.33Å; I38-C42 PolarHBondContact O-N 3.09Å; I38-L112 HydrophobicContact CG2-CB 4Å; I38-L112 HydrophobicContact CG2-CD2 3.74Å; I38-L112 HydrophobicContact CG2-CG 4.28Å
39	C	88.1	Confident	80	Confident	13 Å²	13	72.3 Å²	72.3	9%	0.088	36%	0.363	C	S	.	.	H	α-helix	trans	-59	-51.9	177.8	178.6	0	0	0	0	111	C35 Q36 T41 C42 V43 L112 C113	C35-C39 PolarHBondContact O-N 3.37Å; C35-C39 VanDerWaalsContact O-N 3.11Å; Q36-C39 PolarHBondContact O-N 2.97Å; C39-T41 VanDerWaalsContact C-N 3.3Å; C39-T41 PolarHBondContact O-N 3.12Å; C39-C42 WeakPolarHBondContact O-CB 3.38Å; C39-C42 PolarHBondContact O-N 3.45Å; C39-C42 VanDerWaalsContact O-N 3.11Å; C39-V43 WeakPolarHBondContact O-CG2 3.1Å; C39-V43 PolarHBondContact O-N 2.67Å; C39-L112 WeakPolarHBondContact CA-O 3.41Å; C39-L112 WeakPolarHBondContact CB-O 3.18Å; C39-C113 WeakPolarHBondContact CA-SG 3.17Å; C39-C113 HydrophobicContact CB-CB 4.08Å; C39-C113 WeakPolarHBondContact CB-SG 3.38Å; C39-C113 WeakPolarHBondContact SG-CB 3.17Å; C39-C113 CovalentContact SG-SG 2.04Å; C39-C113 PolarHBondContact SG-SG 3.49Å
40	E	85.6	Confident	81.5	Confident	49 Å²	49	69.2 Å²	69.2	23%	0.229	35%	0.345	C	S	.	.	H	α-helix	trans	-58.3	-42.1	179.6	-74.4	179.2	-174.4	0	0	112.1	Q36 V43 M44 M121	Q36-E40 HydrophobicContact CG-CG 4.31Å; Q36-E40 WeakPolarHBondContact CG-OE1 3.38Å; Q36-E40 PolarHBondContact NE2-OE1 2.85Å; Q36-E40 WeakPolarHBondContact O-CB 3.38Å; Q36-E40 WeakPolarHBondContact O-CG 3.01Å; Q36-E40 PolarHBondContact O-N 3.11Å; E40-V43 PolarHBondContact O-N 2.74Å; E40-M44 WeakPolarHBondContact O-CB 3.27Å; E40-M44 PolarHBondContact O-N 3.45Å; E40-M121 HydrophobicContact CB-CE 3.85Å; E40-M121 HydrophobicContact CB-SD 4.12Å; E40-M121 HydrophobicContact CG-CE 4.28Å; E40-M121 HydrophobicContact CG-SD 4.14Å
41	T	86.6	Confident	82.9	Confident	67 Å²	67	63.3 Å²	63.3	41%	0.411	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-44.8	176.2	-59.6	0	0	0	0	111	L37 I38 C39 M44 N45	L37-T41 VanDerWaalsContact O-CB 3.28Å; L37-T41 WeakPolarHBondContact O-CB 3.44Å; L37-T41 PolarHBondContact O-N 3.34Å; L37-T41 PolarHBondContact O-OG1 3.33Å; I38-T41 PolarHBondContact O-N 3.33Å; C39-T41 VanDerWaalsContact C-N 3.3Å; C39-T41 PolarHBondContact O-N 3.12Å; T41-M44 PolarHBondContact O-N 3.35Å; T41-N45 PolarHBondContact O-N 2.93Å; T41-N45 PolarHBondContact O-ND2 3.27Å
42	C	90.6	Very high	84.1	Confident	15 Å²	15	59.9 Å²	59.9	10%	0.101	30%	0.303	C	S	.	.	H	α-helix	trans	-60.1	-50.4	176.2	178.1	0	0	0	0	111.3	I38 C39 M44 N45 V46 C107 L112	I38-C42 PolarHBondContact O-N 3.09Å; C39-C42 WeakPolarHBondContact O-CB 3.38Å; C39-C42 PolarHBondContact O-N 3.45Å; C39-C42 VanDerWaalsContact O-N 3.11Å; C42-M44 VanDerWaalsContact C-N 3.29Å; C42-M44 PolarHBondContact O-N 3.42Å; C42-N45 WeakPolarHBondContact O-CB 3.49Å; C42-N45 PolarHBondContact O-N 3.47Å; C42-V46 WeakPolarHBondContact O-CG2 3.46Å; C42-V46 PolarHBondContact O-N 2.85Å; C42-C107 HydrophobicContact CB-CB 3.82Å; C42-C107 WeakPolarHBondContact CB-SG 3.48Å; C42-C107 WeakPolarHBondContact SG-CA 3.13Å; C42-C107 WeakPolarHBondContact SG-CB 3.38Å; C42-C107 CovalentContact SG-SG 2.04Å; C42-C107 PolarHBondContact SG-SG 2.94Å; C42-L112 HydrophobicContact CB-CB 4.34Å; C42-L112 HydrophobicContact CB-CD1 3.84Å
43	V	89.8	Confident	85.4	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-62	-39.2	-178.1	177.6	0	0	0	0	110.7	C39 E40 N45 V46 R47 V103 Y104 C107	C39-V43 WeakPolarHBondContact O-CG2 3.1Å; C39-V43 PolarHBondContact O-N 2.67Å; E40-V43 PolarHBondContact O-N 2.74Å; V43-N45 VanDerWaalsContact C-N 3.34Å; V43-N45 PolarHBondContact O-N 3.02Å; V43-V46 PolarHBondContact O-N 3.16Å; V43-R47 VanDerWaalsContact CG1-CZ 3.47Å; V43-R47 VanDerWaalsContact CG1-NH1 3.33Å; V43-R47 WeakPolarHBondContact O-CG 3.39Å; V43-R47 PolarHBondContact O-N 3.34Å; V43-V103 HydrophobicContact CG1-CB 4.22Å; V43-V103 HydrophobicContact CG1-CG2 3.95Å; V43-Y104 HydrophobicContact CG1-CD1 4.45Å; V43-Y104 HydrophobicContact CG1-CE1 4.11Å; V43-Y104 HydrophobicContact CG2-CD1 3.71Å; V43-Y104 HydrophobicContact CG2-CE1 3.83Å; V43-Y104 HydrophobicContact CG2-CG 4.45Å; V43-C107 HydrophobicContact CG2-CB 4.32Å; V43-C107 PolarHBondContact N-SG 2.84Å; V43-C107 VanDerWaalsContact N-SG 3.36Å
44	M	86	Confident	86.5	Confident	68 Å²	68	52.1 Å²	52.1	34%	0.335	27%	0.267	S	S	.	.	H	α-helix	trans	-60	-42.8	174	-174.1	-173	-62.5	0	0	112	E40 T41 C42 R47 G48 M121 F128	E40-M44 WeakPolarHBondContact O-CB 3.27Å; E40-M44 PolarHBondContact O-N 3.45Å; T41-M44 PolarHBondContact O-N 3.35Å; C42-M44 VanDerWaalsContact C-N 3.29Å; C42-M44 PolarHBondContact O-N 3.42Å; M44-R47 PolarHBondContact O-N 2.9Å; M44-G48 PolarHBondContact O-N 3.39Å; M44-M121 HydrophobicContact CE-CE 3.7Å; M44-F128 HydrophobicContact SD-CZ 4.36Å
45	N	87.7	Confident	87.4	Confident	92 Å²	92	50 Å²	50	49%	0.492	26%	0.257	S	S	.	.	H	α-helix	trans	-66.4	-43.4	176.8	-82	-83.3	0	0	0	111.8	T41 C42 V43 R47 G48 I49	T41-N45 PolarHBondContact O-N 2.93Å; T41-N45 PolarHBondContact O-ND2 3.27Å; C42-N45 WeakPolarHBondContact O-CB 3.49Å; C42-N45 PolarHBondContact O-N 3.47Å; V43-N45 VanDerWaalsContact C-N 3.34Å; V43-N45 PolarHBondContact O-N 3.02Å; N45-R47 VanDerWaalsContact C-N 3.33Å; N45-R47 PolarHBondContact O-N 2.87Å; N45-G48 PolarHBondContact O-N 2.82Å; N45-G48 VanDerWaalsContact O-N 3.14Å; N45-I49 WeakPolarHBondContact O-CG1 3.41Å; N45-I49 PolarHBondContact O-N 2.89Å
46	V	91.1	Very high	88.1	Confident	13 Å²	13	48.2 Å²	48.2	8%	0.079	25%	0.245	C	C	.	.	H	α-helix	trans	-61.8	-42.2	176.5	178.1	0	0	0	0	110.8	C42 V43 G48 I49 R50 M101 V103 P106	C42-V46 WeakPolarHBondContact O-CG2 3.46Å; C42-V46 PolarHBondContact O-N 2.85Å; V43-V46 PolarHBondContact O-N 3.16Å; V46-G48 VanDerWaalsContact C-N 3.32Å; V46-G48 PolarHBondContact O-N 3.37Å; V46-I49 PolarHBondContact O-N 2.98Å; V46-R50 WeakPolarHBondContact O-CB 3.45Å; V46-R50 PolarHBondContact O-N 3.49Å; V46-M101 HydrophobicContact CG1-CE 4.41Å; V46-V103 HydrophobicContact CG1-CB 4.19Å; V46-V103 HydrophobicContact CG1-CG1 4.41Å; V46-P106 HydrophobicContact CG1-CG 3.97Å; V46-P106 HydrophobicContact CG2-CB 3.99Å; V46-P106 HydrophobicContact CG2-CG 4.25Å
47	R	89.2	Confident	88.4	Confident	39 Å²	39	46.6 Å²	46.6	15%	0.147	24%	0.237	C	C	.	.	H	α-helix	trans	-58.5	-43.6	173.1	-76	177	180	124.9	4.9	111.9	V43 M44 N45 R50 W51 V103 Y104 M121 Y129	V43-R47 VanDerWaalsContact CG1-CZ 3.47Å; V43-R47 VanDerWaalsContact CG1-NH1 3.33Å; V43-R47 WeakPolarHBondContact O-CG 3.39Å; V43-R47 PolarHBondContact O-N 3.34Å; M44-R47 PolarHBondContact O-N 2.9Å; N45-R47 VanDerWaalsContact C-N 3.33Å; N45-R47 PolarHBondContact O-N 2.87Å; R47-R50 PolarHBondContact O-N 2.89Å; R47-W51 WeakPolarHBondContact O-CB 3.27Å; R47-W51 PolarHBondContact O-N 3.1Å; R47-V103 HydrophobicContact CG-CB 3.92Å; R47-V103 HydrophobicContact CG-CG1 3.64Å; R47-V103 HydrophobicContact CG-CG2 4.28Å; R47-Y104 PolarHBondContact NH2-OH 3.01Å; R47-M121 PolarHBondContact NH1-SD 3.35Å; R47-Y129 WeakPolarHBondContact CB-OH 3.19Å
48	G	87.5	Confident	88.6	Confident	5 Å²	5	42.7 Å²	42.7	5%	0.052	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-46.4	176.8	0	0	0	0	0	112.8	M44 N45 V46 R50 W51 L52	M44-G48 PolarHBondContact O-N 3.39Å; N45-G48 PolarHBondContact O-N 2.82Å; N45-G48 VanDerWaalsContact O-N 3.14Å; V46-G48 VanDerWaalsContact C-N 3.32Å; V46-G48 PolarHBondContact O-N 3.37Å; G48-R50 VanDerWaalsContact C-N 3.31Å; G48-R50 PolarHBondContact O-N 3.41Å; G48-W51 PolarHBondContact O-N 2.89Å; G48-L52 WeakPolarHBondContact O-CB 3.26Å; G48-L52 VanDerWaalsContact O-CG 3.23Å; G48-L52 WeakPolarHBondContact O-CG 3.49Å; G48-L52 PolarHBondContact O-N 3.42Å
49	I	90.1	Very high	88.9	Confident	88 Å²	88	40.5 Å²	40.5	45%	0.451	20%	0.204	S	C	.	.	H	α-helix	trans	-60.5	-42.5	175.7	-66.9	164.6	0	0	0	110.7	N45 V46 L52 L53	N45-I49 WeakPolarHBondContact O-CG1 3.41Å; N45-I49 PolarHBondContact O-N 2.89Å; V46-I49 PolarHBondContact O-N 2.98Å; I49-L52 WeakPolarHBondContact O-CB 3.31Å; I49-L52 PolarHBondContact O-N 3.38Å; I49-L53 HydrophobicContact CG2-CD1 3.76Å; I49-L53 HydrophobicContact CG2-CG 4.25Å; I49-L53 WeakPolarHBondContact O-CB 3.44Å; I49-L53 VanDerWaalsContact O-CG 3.3Å; I49-L53 WeakPolarHBondContact O-CG 3.23Å; I49-L53 PolarHBondContact O-N 2.85Å
50	R	90.9	Very high	88.9	Confident	81 Å²	81	43.8 Å²	43.8	31%	0.306	22%	0.217	S	C	.	.	H	α-helix	trans	-59.8	-49.9	175.1	174.4	165.7	-173.9	-115	4.9	111.3	V46 R47 G48 L52 L53 L54 V98 V99	V46-R50 WeakPolarHBondContact O-CB 3.45Å; V46-R50 PolarHBondContact O-N 3.49Å; R47-R50 PolarHBondContact O-N 2.89Å; G48-R50 VanDerWaalsContact C-N 3.31Å; G48-R50 PolarHBondContact O-N 3.41Å; R50-L52 VanDerWaalsContact C-N 3.29Å; R50-L52 PolarHBondContact O-N 3.03Å; R50-L53 PolarHBondContact O-N 3.09Å; R50-L54 HydrophobicContact CG-CD1 4.25Å; R50-L54 VanDerWaalsContact O-CG 3.31Å; R50-L54 WeakPolarHBondContact O-CG 3.33Å; R50-L54 PolarHBondContact O-N 3.45Å; R50-V98 HydrophobicContact CB-CG1 4.2Å; R50-V98 HydrophobicContact CG-CG1 3.67Å; R50-V98 PolarHBondContact NE-O 2.85Å; R50-V98 WeakPolarHBondContact O-CG1 3.36Å; R50-V99 PolarHBondContact NH2-O 3.32Å
51	W	89.2	Confident	89	Confident	26 Å²	26	43 Å²	43	10%	0.098	22%	0.216	C	C	.	.	H	α-helix	trans	-56.4	-44.4	176.5	179.8	90.9	0	0	0	111.9	R47 G48 L54 Q55 D126 Y129 T130 L133	R47-W51 WeakPolarHBondContact O-CB 3.27Å; R47-W51 PolarHBondContact O-N 3.1Å; G48-W51 PolarHBondContact O-N 2.89Å; W51-L54 PolarHBondContact O-N 3.44Å; W51-Q55 WeakPolarHBondContact O-CG 3.29Å; W51-Q55 PolarHBondContact O-NE2 3.27Å; W51-D126 HydrophobicContact CZ2-CB 4.47Å; W51-D126 PolarHBondContact NE1-OD1 2.97Å; W51-Y129 HydrophobicContact CB-CD2 4.06Å; W51-Y129 HydrophobicContact CB-CG 4.1Å; W51-Y129 HydrophobicContact CD2-CD2 4.38Å; W51-Y129 HydrophobicContact CD2-CG 4.11Å; W51-Y129 HydrophobicContact CE3-CG 4.33Å; W51-Y129 AromaticContact CG-CD2 3.9Å; W51-Y129 HydrophobicContact CG-CD2 3.9Å; W51-Y129 AromaticContact CG-CG 3.99Å; W51-Y129 HydrophobicContact CG-CG 3.99Å; W51-T130 VanDerWaalsContact CH2-CA 3.48Å; W51-T130 WeakPolarHBondContact CH2-OG1 3.46Å; W51-T130 WeakPolarHBondContact CZ2-OG1 3.41Å; W51-L133 HydrophobicContact CZ3-CB 4.39Å; W51-L133 HydrophobicContact CZ3-CD2 4.34Å
52	L	88	Confident	89.1	Confident	43 Å²	43	42.3 Å²	42.3	23%	0.225	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-50.5	176.9	-72.3	174.5	0	0	0	112.1	G48 I49 R50 L54 Q55 T58 L133	G48-L52 WeakPolarHBondContact O-CB 3.26Å; G48-L52 VanDerWaalsContact O-CG 3.23Å; G48-L52 WeakPolarHBondContact O-CG 3.49Å; G48-L52 PolarHBondContact O-N 3.42Å; I49-L52 WeakPolarHBondContact O-CB 3.31Å; I49-L52 PolarHBondContact O-N 3.38Å; R50-L52 VanDerWaalsContact C-N 3.29Å; R50-L52 PolarHBondContact O-N 3.03Å; L52-L54 PolarHBondContact O-N 3.09Å; L52-Q55 VanDerWaalsContact O-CB 3.29Å; L52-Q55 WeakPolarHBondContact O-CB 3.31Å; L52-Q55 PolarHBondContact O-N 3.01Å; L52-T58 HydrophobicContact CB-CG2 4.26Å; L52-T58 WeakPolarHBondContact O-CB 3.42Å; L52-T58 WeakPolarHBondContact O-CG2 3.5Å; L52-T58 PolarHBondContact O-OG1 3.46Å; L52-L133 HydrophobicContact CD1-CD1 4.41Å; L52-L133 HydrophobicContact CD2-CB 3.8Å; L52-L133 HydrophobicContact CD2-CD1 3.44Å; L52-L133 VanDerWaalsContact CD2-CD1 3.44Å; L52-L133 HydrophobicContact CD2-CD2 3.55Å; L52-L133 HydrophobicContact CD2-CG 3.75Å
53	L	92	Very high	89.2	Confident	32 Å²	32	42 Å²	42	17%	0.168	21%	0.207	C	C	.	.	H	α-helix	trans	-72.6	-14.3	-177.7	-64	174.9	0	0	0	113.2	I49 R50 Q55 T58 R59 I62 V94 V98	I49-L53 HydrophobicContact CG2-CD1 3.76Å; I49-L53 HydrophobicContact CG2-CG 4.25Å; I49-L53 WeakPolarHBondContact O-CB 3.44Å; I49-L53 VanDerWaalsContact O-CG 3.3Å; I49-L53 WeakPolarHBondContact O-CG 3.23Å; I49-L53 PolarHBondContact O-N 2.85Å; R50-L53 PolarHBondContact O-N 3.09Å; L53-Q55 VanDerWaalsContact C-N 3.26Å; L53-T58 HydrophobicContact CD2-CG2 4.3Å; L53-R59 WeakPolarHBondContact O-CD 3.34Å; L53-R59 WeakPolarHBondContact O-CG 3.46Å; L53-R59 PolarHBondContact O-NH1 3.47Å; L53-I62 HydrophobicContact CD2-CD1 3.4Å; L53-V94 HydrophobicContact CB-CG1 4.24Å; L53-V94 HydrophobicContact CD1-CG1 4.47Å; L53-V94 HydrophobicContact CD2-CG1 4.19Å; L53-V98 HydrophobicContact CB-CB 4.34Å; L53-V98 HydrophobicContact CB-CG1 3.98Å; L53-V98 HydrophobicContact CB-CG2 3.67Å; L53-V98 HydrophobicContact CD1-CG2 3.74Å; L53-V98 HydrophobicContact CG-CG2 4.38Å
54	L	91.2	Very high	89.1	Confident	61 Å²	61	44.7 Å²	44.7	32%	0.319	22%	0.22	S	C	.	.	H	α-helix	trans	-72.9	-20.3	167.5	-73.4	169.7	0	0	0	112.4	R50 W51 L52 R59 V98 V99	R50-L54 HydrophobicContact CG-CD1 4.25Å; R50-L54 VanDerWaalsContact O-CG 3.31Å; R50-L54 WeakPolarHBondContact O-CG 3.33Å; R50-L54 PolarHBondContact O-N 3.45Å; W51-L54 PolarHBondContact O-N 3.44Å; L52-L54 PolarHBondContact O-N 3.09Å; L54-R59 PolarHBondContact O-NH1 3.13Å; L54-V98 HydrophobicContact CD2-CG1 4.08Å; L54-V98 HydrophobicContact CG-CG1 3.89Å; L54-V99 HydrophobicContact CD2-CG2 3.79Å
55	Q	88	Confident	89.1	Confident	59 Å²	59	43.9 Å²	43.9	28%	0.276	22%	0.217	S	C	.	.	S	Bend	trans	-77.4	128	176.3	-51.7	-54.6	-39.8	0	0	111.7	W51 L52 L53 Y57 T58 R59	W51-Q55 WeakPolarHBondContact O-CG 3.29Å; W51-Q55 PolarHBondContact O-NE2 3.27Å; L52-Q55 VanDerWaalsContact O-CB 3.29Å; L52-Q55 WeakPolarHBondContact O-CB 3.31Å; L52-Q55 PolarHBondContact O-N 3.01Å; L53-Q55 VanDerWaalsContact C-N 3.26Å; Q55-Y57 VanDerWaalsContact C-N 3.32Å; Q55-Y57 HydrophobicContact CB-CD1 3.7Å; Q55-Y57 HydrophobicContact CB-CE1 3.29Å; Q55-Y57 HydrophobicContact CB-CG 4.48Å; Q55-Y57 HydrophobicContact CG-CE1 3.68Å; Q55-Y57 PolarHBondContact O-N 2.92Å; Q55-T58 PolarHBondContact O-N 3.18Å; Q55-R59 PolarHBondContact O-N 2.89Å
56	S	90.5	Very high	89.3	Confident	28 Å²	28	42.3 Å²	42.3	20%	0.196	21%	0.208	C	C	.	.	H	α-helix	trans	-59.9	-42	-178.6	79.2	0	0	0	0	112.2	T58 R59 K60	S56-T58 PolarHBondContact O-N 2.93Å; S56-R59 PolarHBondContact O-N 3.44Å; S56-K60 VanDerWaalsContact O-CG 3.3Å; S56-K60 WeakPolarHBondContact O-CG 3.42Å; S56-K60 PolarHBondContact O-N 3.25Å
57	Y	85.2	Confident	89.3	Confident	35 Å²	35	43.1 Å²	43.1	14%	0.137	21%	0.214	C	C	.	.	H	α-helix	trans	-61.6	-42.5	178	72.8	-94.8	0	0	0	111.5	Q55 R59 K60 T61 L133	Q55-Y57 VanDerWaalsContact C-N 3.32Å; Q55-Y57 HydrophobicContact CB-CD1 3.7Å; Q55-Y57 HydrophobicContact CB-CE1 3.29Å; Q55-Y57 HydrophobicContact CB-CG 4.48Å; Q55-Y57 HydrophobicContact CG-CE1 3.68Å; Q55-Y57 PolarHBondContact O-N 2.92Å; Y57-R59 PolarHBondContact O-N 3.49Å; Y57-K60 PolarHBondContact O-N 3.34Å; Y57-T61 WeakPolarHBondContact O-CB 3.35Å; Y57-T61 PolarHBondContact O-N 2.89Å; Y57-T61 PolarHBondContact O-OG1 3.46Å; Y57-L133 HydrophobicContact CE2-CD2 3.83Å; Y57-L133 WeakPolarHBondContact OH-CD2 3.37Å
58	T	87.3	Confident	89.2	Confident	18 Å²	18	41.7 Å²	41.7	11%	0.11	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-45.4	-179.4	-68	0	0	0	0	110.3	L52 L53 Q55 S56 K60 T61 I62	L52-T58 HydrophobicContact CB-CG2 4.26Å; L52-T58 WeakPolarHBondContact O-CB 3.42Å; L52-T58 WeakPolarHBondContact O-CG2 3.5Å; L52-T58 PolarHBondContact O-OG1 3.46Å; L53-T58 HydrophobicContact CD2-CG2 4.3Å; Q55-T58 PolarHBondContact O-N 3.18Å; S56-T58 PolarHBondContact O-N 2.93Å; T58-K60 VanDerWaalsContact C-N 3.34Å; T58-K60 PolarHBondContact O-N 3.32Å; T58-T61 PolarHBondContact O-N 2.9Å; T58-I62 HydrophobicContact CG2-CD1 3.84Å; T58-I62 HydrophobicContact CG2-CG1 4.48Å; T58-I62 VanDerWaalsContact O-CG1 3.31Å; T58-I62 WeakPolarHBondContact O-CG1 3.31Å; T58-I62 PolarHBondContact O-N 2.96Å
59	R	91.3	Very high	89.2	Confident	16 Å²	16	45.7 Å²	45.7	6%	0.06	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-41	176.8	-65.3	-169.4	-59.5	-84.8	-2.5	112	L53 L54 Q55 S56 Y57 I62 A63 E91 V94	L53-R59 WeakPolarHBondContact O-CD 3.34Å; L53-R59 WeakPolarHBondContact O-CG 3.46Å; L53-R59 PolarHBondContact O-NH1 3.47Å; L54-R59 PolarHBondContact O-NH1 3.13Å; Q55-R59 PolarHBondContact O-N 2.89Å; S56-R59 PolarHBondContact O-N 3.44Å; Y57-R59 PolarHBondContact O-N 3.49Å; R59-I62 PolarHBondContact O-N 3.33Å; R59-A63 WeakPolarHBondContact O-CB 3.36Å; R59-A63 PolarHBondContact O-N 3.41Å; R59-E91 HydrophobicContact CB-CG 3.87Å; R59-E91 WeakPolarHBondContact CD-O 3.13Å; R59-E91 IonicContact CZ-OE1 3.68Å; R59-E91 VanDerWaalsContact NE-CG 3.28Å; R59-E91 PolarHBondContact NE-O 3Å; R59-E91 IonicContact NE-OE1 3.74Å; R59-E91 IonicContact NH2-OE1 3.81Å; R59-E91 PolarHBondContact NH2-OE1 3.17Å; R59-E91 VanDerWaalsContact NH2-OE1 3.09Å; R59-V94 HydrophobicContact CG-CB 4.44Å; R59-V94 HydrophobicContact CG-CG1 3.92Å
60	K	90	Very high	89.3	Confident	82 Å²	82	41.5 Å²	41.5	36%	0.357	21%	0.208	S	C	.	.	H	α-helix	trans	-63.1	-46.1	176.3	-72.9	169.9	-174.9	167.9	0	111.6	S56 Y57 T58 I62 A63 E64 E91	S56-K60 VanDerWaalsContact O-CG 3.3Å; S56-K60 WeakPolarHBondContact O-CG 3.42Å; S56-K60 PolarHBondContact O-N 3.25Å; Y57-K60 PolarHBondContact O-N 3.34Å; T58-K60 VanDerWaalsContact C-N 3.34Å; T58-K60 PolarHBondContact O-N 3.32Å; K60-I62 PolarHBondContact O-N 3.18Å; K60-A63 WeakPolarHBondContact O-CB 3.39Å; K60-A63 PolarHBondContact O-N 3.05Å; K60-E64 WeakPolarHBondContact O-CG 3.44Å; K60-E64 PolarHBondContact O-N 3.11Å; K60-E91 WeakPolarHBondContact CE-OE2 3.42Å
61	T	86.3	Confident	89.2	Confident	34 Å²	34	38.5 Å²	38.5	21%	0.209	20%	0.198	C	C	.	.	H	α-helix	trans	-59.9	-46.6	176.4	-59.3	0	0	0	0	111.4	Y57 T58 A63 E64 L65 N185	Y57-T61 WeakPolarHBondContact O-CB 3.35Å; Y57-T61 PolarHBondContact O-N 2.89Å; Y57-T61 PolarHBondContact O-OG1 3.46Å; T58-T61 PolarHBondContact O-N 2.9Å; T61-A63 VanDerWaalsContact C-N 3.32Å; T61-A63 PolarHBondContact O-N 3.39Å; T61-E64 PolarHBondContact O-N 3.23Å; T61-L65 WeakPolarHBondContact O-CB 3.3Å; T61-L65 PolarHBondContact O-N 2.99Å; T61-N185 HydrophobicContact CG2-CB 3.66Å; T61-N185 VanDerWaalsContact CG2-CG 3.49Å; T61-N185 PolarHBondContact OG1-OD1 2.93Å
62	I	89.8	Confident	89	Confident	52 Å²	52	42.8 Å²	42.8	27%	0.267	22%	0.218	S	C	.	.	H	α-helix	trans	-62.1	-41.1	175.9	-66.8	169	0	0	0	110.7	L53 T58 R59 K60 L65 L66 F90	L53-I62 HydrophobicContact CD2-CD1 3.4Å; T58-I62 HydrophobicContact CG2-CD1 3.84Å; T58-I62 HydrophobicContact CG2-CG1 4.48Å; T58-I62 VanDerWaalsContact O-CG1 3.31Å; T58-I62 WeakPolarHBondContact O-CG1 3.31Å; T58-I62 PolarHBondContact O-N 2.96Å; R59-I62 PolarHBondContact O-N 3.33Å; K60-I62 PolarHBondContact O-N 3.18Å; I62-L65 PolarHBondContact O-N 3.49Å; I62-L66 HydrophobicContact CG2-CD1 3.68Å; I62-L66 HydrophobicContact CG2-CG 4.13Å; I62-L66 WeakPolarHBondContact O-CB 3.32Å; I62-L66 VanDerWaalsContact O-CG 3.3Å; I62-L66 WeakPolarHBondContact O-CG 3.36Å; I62-L66 PolarHBondContact O-N 3.39Å; I62-F90 HydrophobicContact CB-CE1 4.37Å; I62-F90 HydrophobicContact CG2-CE1 3.96Å; I62-F90 HydrophobicContact CG2-CZ 3.69Å
63	A	91.8	Very high	88.9	Confident	7 Å²	7	45.3 Å²	45.3	6%	0.058	23%	0.227	C	C	.	.	H	α-helix	trans	-61.4	-46.8	177.6	0	0	0	0	0	111.8	R59 K60 T61 S67 F86 F90	R59-A63 WeakPolarHBondContact O-CB 3.36Å; R59-A63 PolarHBondContact O-N 3.41Å; K60-A63 WeakPolarHBondContact O-CB 3.39Å; K60-A63 PolarHBondContact O-N 3.05Å; T61-A63 VanDerWaalsContact C-N 3.32Å; T61-A63 PolarHBondContact O-N 3.39Å; A63-S67 VanDerWaalsContact O-CB 3.27Å; A63-S67 WeakPolarHBondContact O-CB 3.49Å; A63-S67 PolarHBondContact O-N 2.91Å; A63-F86 WeakPolarHBondContact CB-O 3.25Å; A63-F90 HydrophobicContact CB-CD1 3.45Å; A63-F90 VanDerWaalsContact CB-CD1 3.45Å; A63-F90 HydrophobicContact CB-CE1 3.82Å; A63-F90 HydrophobicContact CB-CG 4.35Å
64	E	88.6	Confident	88.5	Confident	60 Å²	60	48.3 Å²	48.3	28%	0.28	25%	0.248	S	C	.	.	H	α-helix	trans	-59.9	-46.3	175.7	-72.3	-174.3	162.1	0	0	110.9	K60 T61 S67 V181 K184 N185	K60-E64 WeakPolarHBondContact O-CG 3.44Å; K60-E64 PolarHBondContact O-N 3.11Å; T61-E64 PolarHBondContact O-N 3.23Å; E64-S67 WeakPolarHBondContact O-CB 3.3Å; E64-S67 PolarHBondContact O-N 3.45Å; E64-S67 PolarHBondContact O-OG 3.37Å; E64-V181 HydrophobicContact CB-CG1 3.65Å; E64-V181 HydrophobicContact CB-CG2 4.39Å; E64-K184 IonicContact OE1-NZ 3.95Å; E64-N185 PolarHBondContact OE2-ND2 3.47Å; E64-N185 VanDerWaalsContact OE2-ND2 3.13Å
65	L	86.1	Confident	88.4	Confident	51 Å²	51	53.7 Å²	53.7	27%	0.267	27%	0.266	S	S	.	.	H	α-helix	trans	-60.5	-50.2	-179.4	-167.6	70.6	0	0	0	111.7	T61 I62 S67 V68 F178 V181 I182	T61-L65 WeakPolarHBondContact O-CB 3.3Å; T61-L65 PolarHBondContact O-N 2.99Å; I62-L65 PolarHBondContact O-N 3.49Å; L65-S67 VanDerWaalsContact C-N 3.3Å; L65-S67 PolarHBondContact O-N 3.1Å; L65-V68 WeakPolarHBondContact O-CB 3.4Å; L65-V68 PolarHBondContact O-N 3.33Å; L65-F178 HydrophobicContact CD1-CD2 3.55Å; L65-F178 HydrophobicContact CD1-CE1 4.38Å; L65-F178 HydrophobicContact CD1-CE2 3.08Å; L65-F178 HydrophobicContact CD1-CG 4.38Å; L65-F178 HydrophobicContact CD1-CZ 3.54Å; L65-F178 HydrophobicContact CD2-CE2 4.34Å; L65-F178 HydrophobicContact CG-CD2 4.28Å; L65-F178 HydrophobicContact CG-CE2 3.55Å; L65-F178 HydrophobicContact CG-CZ 4.15Å; L65-V181 HydrophobicContact CD1-CG1 4.45Å; L65-I182 HydrophobicContact CD1-CD1 3.91Å; L65-I182 HydrophobicContact CD1-CG1 3.68Å
66	L	90.7	Very high	88.5	Confident	58 Å²	58	59.4 Å²	59.4	30%	0.304	29%	0.29	S	S	.	.	H	α-helix	trans	-69.9	-27.3	179.4	-66.3	177.3	0	0	0	112.3	I62 V68 L69 F86 F90	I62-L66 HydrophobicContact CG2-CD1 3.68Å; I62-L66 HydrophobicContact CG2-CG 4.13Å; I62-L66 WeakPolarHBondContact O-CB 3.32Å; I62-L66 VanDerWaalsContact O-CG 3.3Å; I62-L66 WeakPolarHBondContact O-CG 3.36Å; I62-L66 PolarHBondContact O-N 3.39Å; L66-V68 PolarHBondContact O-N 3.27Å; L66-V68 VanDerWaalsContact O-N 3.16Å; L66-L69 HydrophobicContact CD2-CD1 4Å; L66-L69 VanDerWaalsContact O-CB 3.29Å; L66-L69 WeakPolarHBondContact O-CB 3.46Å; L66-L69 PolarHBondContact O-N 3.04Å; L66-F86 HydrophobicContact CB-CD1 3.87Å; L66-F86 HydrophobicContact CB-CE1 3.33Å; L66-F86 HydrophobicContact CB-CE2 4.21Å; L66-F86 HydrophobicContact CB-CZ 3.53Å; L66-F86 HydrophobicContact CD1-CE1 3.73Å; L66-F86 HydrophobicContact CD1-CZ 4.3Å; L66-F86 HydrophobicContact CG-CE1 4.19Å; L66-F90 HydrophobicContact CD1-CE2 3.96Å; L66-F90 HydrophobicContact CD1-CZ 3.83Å
67	S	91.5	Very high	88.7	Confident	31 Å²	31	64.8 Å²	64.8	22%	0.217	31%	0.312	C	S	.	.	H	α-helix	trans	-62.1	-23.1	177.3	83.1	0	0	0	0	113.4	A63 E64 L65 L69 C70	A63-S67 VanDerWaalsContact O-CB 3.27Å; A63-S67 WeakPolarHBondContact O-CB 3.49Å; A63-S67 PolarHBondContact O-N 2.91Å; E64-S67 WeakPolarHBondContact O-CB 3.3Å; E64-S67 PolarHBondContact O-N 3.45Å; E64-S67 PolarHBondContact O-OG 3.37Å; L65-S67 VanDerWaalsContact C-N 3.3Å; L65-S67 PolarHBondContact O-N 3.1Å; S67-L69 VanDerWaalsContact C-N 3.26Å; S67-L69 PolarHBondContact O-N 2.95Å; S67-C70 WeakPolarHBondContact O-CB 3.46Å; S67-C70 PolarHBondContact O-N 2.92Å; S67-C70 PolarHBondContact O-SG 2.95Å; S67-C70 VanDerWaalsContact O-SG 3.4Å
68	V	86.8	Confident	89.1	Confident	9 Å²	9	65.3 Å²	65.3	6%	0.055	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-64.1	-36	175	179.8	0	0	0	0	110.8	L65 L66 C70 N71 S174 F178	L65-V68 WeakPolarHBondContact O-CB 3.4Å; L65-V68 PolarHBondContact O-N 3.33Å; L66-V68 PolarHBondContact O-N 3.27Å; L66-V68 VanDerWaalsContact O-N 3.16Å; V68-C70 PolarHBondContact O-N 3.32Å; V68-C70 VanDerWaalsContact O-N 3.09Å; V68-N71 WeakPolarHBondContact O-CB 3.26Å; V68-N71 PolarHBondContact O-N 3.13Å; V68-N71 PolarHBondContact O-ND2 2.81Å; V68-S174 VanDerWaalsContact CG1-O 3.26Å; V68-S174 WeakPolarHBondContact CG1-O 3.32Å; V68-F178 HydrophobicContact CB-CD2 4.28Å; V68-F178 HydrophobicContact CG1-CB 4.12Å; V68-F178 HydrophobicContact CG1-CD2 4.41Å; V68-F178 HydrophobicContact CG2-CB 4.39Å; V68-F178 HydrophobicContact CG2-CD2 4.27Å
69	L	88.3	Confident	89.4	Confident	89 Å²	89	68.1 Å²	68.1	47%	0.466	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-60.3	-24.4	178.1	-56.8	-179.9	0	0	0	111.9	L66 S67 N71 F72	L66-L69 HydrophobicContact CD2-CD1 4Å; L66-L69 VanDerWaalsContact O-CB 3.29Å; L66-L69 WeakPolarHBondContact O-CB 3.46Å; L66-L69 PolarHBondContact O-N 3.04Å; S67-L69 VanDerWaalsContact C-N 3.26Å; S67-L69 PolarHBondContact O-N 2.95Å; L69-N71 PolarHBondContact O-N 3.32Å; L69-N71 VanDerWaalsContact O-N 3.14Å; L69-F72 HydrophobicContact CB-CD2 4.41Å; L69-F72 HydrophobicContact CD2-CD2 4.25Å; L69-F72 HydrophobicContact CD2-CE2 3.89Å; L69-F72 WeakPolarHBondContact O-CB 3.31Å; L69-F72 VanDerWaalsContact O-CD2 3.31Å; L69-F72 WeakPolarHBondContact O-CD2 3.32Å; L69-F72 PolarHBondContact O-N 3.21Å; L69-F72 VanDerWaalsContact O-N 3.1Å
70	C	91.5	Very high	89.6	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-61.7	-23	175.6	-57.9	0	0	0	0	113.2	S67 V68 F72 F73 R79 C82 K83 F86	S67-C70 WeakPolarHBondContact O-CB 3.46Å; S67-C70 PolarHBondContact O-N 2.92Å; S67-C70 PolarHBondContact O-SG 2.95Å; S67-C70 VanDerWaalsContact O-SG 3.4Å; V68-C70 PolarHBondContact O-N 3.32Å; V68-C70 VanDerWaalsContact O-N 3.09Å; C70-F72 PolarHBondContact O-N 3.41Å; C70-F73 PolarHBondContact O-N 2.89Å; C70-R79 WeakPolarHBondContact O-CG 3.49Å; C70-C82 WeakPolarHBondContact CA-SG 3.47Å; C70-C82 HydrophobicContact CB-CB 3.61Å; C70-C82 WeakPolarHBondContact CB-SG 3.3Å; C70-C82 WeakPolarHBondContact SG-CB 3.39Å; C70-C82 PolarHBondContact SG-O 3Å; C70-C82 CovalentContact SG-SG 2.04Å; C70-C82 PolarHBondContact SG-SG 2.95Å; C70-K83 HydrophobicContact CB-CG 3.68Å; C70-K83 PolarHBondContact SG-N 3.36Å; C70-K83 VanDerWaalsContact SG-N 3.43Å; C70-F86 VanDerWaalsContact SG-CD2 3.59Å
71	N	89.2	Confident	89.8	Confident	18 Å²	18	71.9 Å²	71.9	10%	0.096	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-67.5	-20.1	178	-67.7	-34.2	0	0	0	112.8	V68 L69 F73 K83 S174	V68-N71 WeakPolarHBondContact O-CB 3.26Å; V68-N71 PolarHBondContact O-N 3.13Å; V68-N71 PolarHBondContact O-ND2 2.81Å; L69-N71 PolarHBondContact O-N 3.32Å; L69-N71 VanDerWaalsContact O-N 3.14Å; N71-F73 VanDerWaalsContact C-N 3.26Å; N71-F73 PolarHBondContact O-N 3.21Å; N71-K83 WeakPolarHBondContact OD1-CE 3.48Å; N71-K83 PolarHBondContact OD1-NZ 3.11Å; N71-S174 WeakPolarHBondContact CB-OG 3.46Å; N71-S174 PolarHBondContact ND2-OG 2.74Å
72	F	85.3	Confident	90.3	Very high	116 Å²	116	71.4 Å²	71.4	51%	0.509	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-72.2	-16.3	175.8	-66	-66.5	0	0	0	113.6	L69 C70 P74 F171	L69-F72 HydrophobicContact CB-CD2 4.41Å; L69-F72 HydrophobicContact CD2-CD2 4.25Å; L69-F72 HydrophobicContact CD2-CE2 3.89Å; L69-F72 WeakPolarHBondContact O-CB 3.31Å; L69-F72 VanDerWaalsContact O-CD2 3.31Å; L69-F72 WeakPolarHBondContact O-CD2 3.32Å; L69-F72 PolarHBondContact O-N 3.21Å; L69-F72 VanDerWaalsContact O-N 3.1Å; C70-F72 PolarHBondContact O-N 3.41Å; F72-P74 WeakPolarHBondContact O-CD 3.32Å; F72-F171 AromaticContact CE1-CD2 3.94Å; F72-F171 HydrophobicContact CE1-CD2 3.94Å; F72-F171 HydrophobicContact CE1-CE2 4.23Å; F72-F171 HydrophobicContact CZ-CD2 4.44Å; F72-F171 HydrophobicContact CZ-CE2 4.37Å
73	F	86.2	Confident	90.5	Very high	95 Å²	95	72.4 Å²	72.4	42%	0.417	35%	0.353	S	S	.	.			trans	-68.5	122.4	172.2	-74	-76.9	0	0	0	110.2	C70 N71 Y75 P78 R79 C82	C70-F73 PolarHBondContact O-N 2.89Å; N71-F73 VanDerWaalsContact C-N 3.26Å; N71-F73 PolarHBondContact O-N 3.21Å; F73-Y75 VanDerWaalsContact C-N 3.33Å; F73-Y75 PolarHBondContact O-N 3.2Å; F73-P78 HydrophobicContact CB-CB 4.24Å; F73-P78 HydrophobicContact CD1-CB 3.86Å; F73-P78 HydrophobicContact CG-CB 4.11Å; F73-R79 HydrophobicContact CB-CB 4.03Å; F73-R79 PolarHBondContact O-NE 3.43Å; F73-R79 PolarHBondContact O-NH2 3.37Å; F73-C82 HydrophobicContact CD2-CB 4.11Å; F73-C82 HydrophobicContact CE2-CB 3.94Å
74	P	83.6	Confident	90.7	Very high	95 Å²	95	80.1 Å²	80.1	62%	0.617	38%	0.381	S	S	*	.	S	Bend	trans	-70.7	-30.2	-175.8	25.9	-33.2	0	0	0	112.4	F72	F72-P74 WeakPolarHBondContact O-CD 3.32Å
75	Y	89.4	Confident	91.1	Very high	174 Å²	174	81.2 Å²	81.2	68%	0.682	39%	0.385	S	S	*	.	S	Bend	trans	-95.2	140.2	-175.9	-54.6	-67.2	0	0	0	112.3	F73 Q77 P78 R79	F73-Y75 VanDerWaalsContact C-N 3.33Å; F73-Y75 PolarHBondContact O-N 3.2Å; Y75-Q77 VanDerWaalsContact C-N 3.34Å; Y75-Q77 PolarHBondContact O-N 3.46Å; Y75-P78 WeakPolarHBondContact O-CD 3.49Å; Y75-R79 WeakPolarHBondContact O-CB 3.16Å; Y75-R79 PolarHBondContact O-N 2.98Å
76	K	90.1	Very high	91.5	Very high	180 Å²	180	80.4 Å²	80.4	78%	0.783	38%	0.379	S	S	*	.	H	α-helix	trans	-57.6	-41.3	-176.3	-69.3	-176.2	179.5	179.1	0	113.4	A80	K76-A80 VanDerWaalsContact O-CB 3.29Å; K76-A80 WeakPolarHBondContact O-CB 3.14Å; K76-A80 PolarHBondContact O-N 3.01Å
77	Q	94.4	Very high	91.6	Very high	140 Å²	140	86.3 Å²	86.3	65%	0.654	40%	0.402	S	S	*	.	H	α-helix	trans	-69.8	-53.6	-175	-68.7	-66.3	-5.4	0	0	112.6	Y75 R79 A80 Q81	Y75-Q77 VanDerWaalsContact C-N 3.34Å; Y75-Q77 PolarHBondContact O-N 3.46Å; Q77-R79 VanDerWaalsContact C-N 3.31Å; Q77-R79 PolarHBondContact O-N 3.43Å; Q77-A80 PolarHBondContact O-N 2.84Å; Q77-A80 VanDerWaalsContact O-N 3.12Å; Q77-Q81 PolarHBondContact O-N 3.31Å
78	P	93.7	Very high	91.5	Very high	47 Å²	47	86.9 Å²	86.9	31%	0.305	41%	0.413	S	S	.	.	H	α-helix	trans	-55.4	-43	172.6	-27.2	34.2	0	0	0	113.3	F73 Y75 A80 Q81 C82	F73-P78 HydrophobicContact CB-CB 4.24Å; F73-P78 HydrophobicContact CD1-CB 3.86Å; F73-P78 HydrophobicContact CG-CB 4.11Å; Y75-P78 WeakPolarHBondContact O-CD 3.49Å; P78-A80 PolarHBondContact O-N 3.35Å; P78-Q81 PolarHBondContact O-N 3.14Å; P78-C82 WeakPolarHBondContact O-CB 3.12Å; P78-C82 PolarHBondContact O-N 3.47Å
79	R	93.4	Very high	91.8	Very high	76 Å²	76	89.7 Å²	89.7	29%	0.287	43%	0.432	S	S	.	.	H	α-helix	trans	-57.4	-46.9	175.2	-179.5	-179.1	-53.7	171.1	2.6	111.8	C70 F73 Y75 Q77 K83	C70-R79 WeakPolarHBondContact O-CG 3.49Å; F73-R79 HydrophobicContact CB-CB 4.03Å; F73-R79 PolarHBondContact O-NE 3.43Å; F73-R79 PolarHBondContact O-NH2 3.37Å; Y75-R79 WeakPolarHBondContact O-CB 3.16Å; Y75-R79 PolarHBondContact O-N 2.98Å; Q77-R79 VanDerWaalsContact C-N 3.31Å; Q77-R79 PolarHBondContact O-N 3.43Å; R79-K83 WeakPolarHBondContact O-CG 3.31Å; R79-K83 PolarHBondContact O-N 2.86Å
80	A	94.3	Very high	92.2	Very high	32 Å²	32	86.6 Å²	86.6	26%	0.264	42%	0.415	S	S	.	.	H	α-helix	trans	-67.5	-37.2	179.8	0	0	0	0	0	112.4	K76 Q77 P78 R84	K76-A80 VanDerWaalsContact O-CB 3.29Å; K76-A80 WeakPolarHBondContact O-CB 3.14Å; K76-A80 PolarHBondContact O-N 3.01Å; Q77-A80 PolarHBondContact O-N 2.84Å; Q77-A80 VanDerWaalsContact O-N 3.12Å; P78-A80 PolarHBondContact O-N 3.35Å; A80-R84 WeakPolarHBondContact O-CG 3.34Å; A80-R84 PolarHBondContact O-N 3.39Å
81	Q	95.3	Very high	92.3	Very high	145 Å²	145	89.4 Å²	89.4	68%	0.678	43%	0.428	S	S	*	.	H	α-helix	trans	-66.2	-46.5	175.9	-173	177.9	19.6	0	0	111.4	Q77 P78 K83 R84 F85	Q77-Q81 PolarHBondContact O-N 3.31Å; P78-Q81 PolarHBondContact O-N 3.14Å; Q81-K83 PolarHBondContact O-N 2.77Å; Q81-R84 PolarHBondContact O-N 3.32Å; Q81-R84 VanDerWaalsContact O-N 3.16Å; Q81-F85 PolarHBondContact O-N 2.86Å
82	C	96.3	Very high	92.5	Very high	24 Å²	24	90.2 Å²	90.2	16%	0.162	44%	0.44	C	S	.	.	H	α-helix	trans	-57.5	-47	175	179.7	0	0	0	0	111.5	C70 F73 P78 R84 F85 F86	C70-C82 WeakPolarHBondContact CA-SG 3.47Å; C70-C82 HydrophobicContact CB-CB 3.61Å; C70-C82 WeakPolarHBondContact CB-SG 3.3Å; C70-C82 WeakPolarHBondContact SG-CB 3.39Å; C70-C82 PolarHBondContact SG-O 3Å; C70-C82 CovalentContact SG-SG 2.04Å; C70-C82 PolarHBondContact SG-SG 2.95Å; F73-C82 HydrophobicContact CD2-CB 4.11Å; F73-C82 HydrophobicContact CE2-CB 3.94Å; P78-C82 WeakPolarHBondContact O-CB 3.12Å; P78-C82 PolarHBondContact O-N 3.47Å; C82-R84 VanDerWaalsContact C-N 3.32Å; C82-R84 PolarHBondContact O-N 3.23Å; C82-F85 WeakPolarHBondContact O-CB 3.25Å; C82-F85 PolarHBondContact O-N 3.1Å; C82-F86 WeakPolarHBondContact O-CD2 3.33Å; C82-F86 PolarHBondContact O-N 2.97Å
83	K	94.6	Very high	93	Very high	73 Å²	73	89.3 Å²	89.3	32%	0.317	44%	0.44	S	S	.	.	H	α-helix	trans	-62.9	-36.6	176.7	-72.7	-171.1	179.5	-166.5	0	112.8	C70 N71 R79 Q81 F85 K87	C70-K83 HydrophobicContact CB-CG 3.68Å; C70-K83 PolarHBondContact SG-N 3.36Å; C70-K83 VanDerWaalsContact SG-N 3.43Å; N71-K83 WeakPolarHBondContact OD1-CE 3.48Å; N71-K83 PolarHBondContact OD1-NZ 3.11Å; R79-K83 WeakPolarHBondContact O-CG 3.31Å; R79-K83 PolarHBondContact O-N 2.86Å; Q81-K83 PolarHBondContact O-N 2.77Å; K83-F85 VanDerWaalsContact C-N 3.33Å; K83-K87 WeakPolarHBondContact O-CB 3.48Å; K83-K87 VanDerWaalsContact O-CG 3.31Å; K83-K87 WeakPolarHBondContact O-CG 3.31Å; K83-K87 PolarHBondContact O-N 3.06Å; K83-K87 VanDerWaalsContact O-N 3.09Å
84	R	95.7	Very high	93.4	Very high	170 Å²	170	86 Å²	86	64%	0.642	43%	0.428	S	S	*	.	H	α-helix	trans	-65.9	-36.1	175.6	-79	-175.2	-119.6	-167.9	-0.7	112.2	A80 Q81 C82 K87 G88	A80-R84 WeakPolarHBondContact O-CG 3.34Å; A80-R84 PolarHBondContact O-N 3.39Å; Q81-R84 PolarHBondContact O-N 3.32Å; Q81-R84 VanDerWaalsContact O-N 3.16Å; C82-R84 VanDerWaalsContact C-N 3.32Å; C82-R84 PolarHBondContact O-N 3.23Å; R84-K87 PolarHBondContact O-N 3.01Å; R84-G88 PolarHBondContact O-N 3.45Å
85	F	96.6	Very high	93.9	Very high	82 Å²	82	84.8 Å²	84.8	36%	0.36	41%	0.414	S	S	.	.	H	α-helix	trans	-59.8	-50.4	176.4	174.5	-102.3	0	0	0	111.7	Q81 C82 K83 K87 G88 P89 F90 L93	Q81-F85 PolarHBondContact O-N 2.86Å; C82-F85 WeakPolarHBondContact O-CB 3.25Å; C82-F85 PolarHBondContact O-N 3.1Å; K83-F85 VanDerWaalsContact C-N 3.33Å; F85-K87 VanDerWaalsContact C-N 3.34Å; F85-K87 PolarHBondContact O-N 3.42Å; F85-G88 PolarHBondContact O-N 3.23Å; F85-P89 HydrophobicContact CD2-CG 3.71Å; F85-P89 HydrophobicContact CE2-CG 4.31Å; F85-P89 HydrophobicContact CG-CG 4.41Å; F85-P89 WeakPolarHBondContact O-CD 3.46Å; F85-P89 WeakPolarHBondContact O-CG 3.32Å; F85-F90 HydrophobicContact CD1-CB 4.41Å; F85-F90 HydrophobicContact CE1-CB 4.14Å; F85-F90 AromaticContact CE1-CD2 3.65Å; F85-F90 HydrophobicContact CE1-CD2 3.65Å; F85-F90 HydrophobicContact CE1-CG 4.36Å; F85-F90 HydrophobicContact CZ-CB 4.37Å; F85-F90 HydrophobicContact CZ-CD2 4.04Å; F85-F90 WeakPolarHBondContact O-CB 3.44Å; F85-F90 PolarHBondContact O-N 3.06Å; F85-F90 VanDerWaalsContact O-N 3.11Å; F85-L93 HydrophobicContact CE2-CD1 3.61Å; F85-L93 HydrophobicContact CZ-CD1 4.07Å
86	F	95.2	Very high	94.2	Very high	34 Å²	34	81.2 Å²	81.2	15%	0.149	41%	0.406	C	S	.	.	H	α-helix	trans	-71.9	-24.4	178.6	-68.3	-67.5	0	0	0	114.1	A63 L66 C70 C82 G88 F90	A63-F86 WeakPolarHBondContact CB-O 3.25Å; L66-F86 HydrophobicContact CB-CD1 3.87Å; L66-F86 HydrophobicContact CB-CE1 3.33Å; L66-F86 HydrophobicContact CB-CE2 4.21Å; L66-F86 HydrophobicContact CB-CZ 3.53Å; L66-F86 HydrophobicContact CD1-CE1 3.73Å; L66-F86 HydrophobicContact CD1-CZ 4.3Å; L66-F86 HydrophobicContact CG-CE1 4.19Å; C70-F86 VanDerWaalsContact SG-CD2 3.59Å; C82-F86 WeakPolarHBondContact O-CD2 3.33Å; C82-F86 PolarHBondContact O-N 2.97Å; F86-G88 VanDerWaalsContact C-N 3.32Å; F86-F90 HydrophobicContact CD1-CB 4.12Å; F86-F90 HydrophobicContact CD1-CD1 4.29Å; F86-F90 AromaticContact CD1-CD2 3.73Å; F86-F90 HydrophobicContact CD1-CD2 3.73Å; F86-F90 HydrophobicContact CD1-CE2 4.2Å; F86-F90 AromaticContact CD1-CG 3.77Å; F86-F90 HydrophobicContact CD1-CG 3.77Å; F86-F90 AromaticContact CE1-CD2 3.64Å; F86-F90 HydrophobicContact CE1-CD2 3.64Å; F86-F90 AromaticContact CE1-CE2 3.8Å; F86-F90 HydrophobicContact CE1-CE2 3.8Å; F86-F90 HydrophobicContact CE1-CG 4.18Å; F86-F90 HydrophobicContact CE1-CZ 4.46Å
87	K	91.3	Very high	94.3	Very high	182 Å²	182	79 Å²	79	79%	0.791	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.7	174.9	-75.6	-173.5	176.1	-162.9	0	114.8	K83 R84 F85	K83-K87 WeakPolarHBondContact O-CB 3.48Å; K83-K87 VanDerWaalsContact O-CG 3.31Å; K83-K87 WeakPolarHBondContact O-CG 3.31Å; K83-K87 PolarHBondContact O-N 3.06Å; K83-K87 VanDerWaalsContact O-N 3.09Å; R84-K87 PolarHBondContact O-N 3.01Å; F85-K87 VanDerWaalsContact C-N 3.34Å; F85-K87 PolarHBondContact O-N 3.42Å
88	G	89.9	Confident	94.3	Very high	43 Å²	43	72.3 Å²	72.3	44%	0.443	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.5	-94.3	-173.6	0	0	0	0	0	112.2	R84 F85 F86 F90	R84-G88 PolarHBondContact O-N 3.45Å; F85-G88 PolarHBondContact O-N 3.23Å; F86-G88 VanDerWaalsContact C-N 3.32Å; G88-F90 PolarHBondContact O-N 3.13Å; G88-F90 VanDerWaalsContact O-N 3.12Å
89	P	94.6	Very high	94.2	Very high	69 Å²	69	72.8 Å²	72.8	45%	0.448	37%	0.368	S	S	.	.	H	α-helix	trans	-62.1	-24.6	-167.7	24.7	-36.3	0	0	0	114.8	F85 E91 G92 L93	F85-P89 HydrophobicContact CD2-CG 3.71Å; F85-P89 HydrophobicContact CE2-CG 4.31Å; F85-P89 HydrophobicContact CG-CG 4.41Å; F85-P89 WeakPolarHBondContact O-CD 3.46Å; F85-P89 WeakPolarHBondContact O-CG 3.32Å; P89-E91 PolarHBondContact O-N 3.18Å; P89-G92 PolarHBondContact O-N 2.67Å; P89-L93 HydrophobicContact CB-CD1 4.21Å; P89-L93 WeakPolarHBondContact O-CB 3.48Å; P89-L93 VanDerWaalsContact O-CG 3.27Å; P89-L93 WeakPolarHBondContact O-CG 3.29Å; P89-L93 PolarHBondContact O-N 2.99Å
90	F	95.4	Very high	93.9	Very high	23 Å²	23	75.7 Å²	75.7	10%	0.101	39%	0.389	C	S	.	.	H	α-helix	trans	-54.6	-46.7	-176.6	178.2	-94.5	0	0	0	113.4	I62 A63 L66 F85 F86 G88 G92 L93 V94	I62-F90 HydrophobicContact CB-CE1 4.37Å; I62-F90 HydrophobicContact CG2-CE1 3.96Å; I62-F90 HydrophobicContact CG2-CZ 3.69Å; A63-F90 HydrophobicContact CB-CD1 3.45Å; A63-F90 VanDerWaalsContact CB-CD1 3.45Å; A63-F90 HydrophobicContact CB-CE1 3.82Å; A63-F90 HydrophobicContact CB-CG 4.35Å; L66-F90 HydrophobicContact CD1-CE2 3.96Å; L66-F90 HydrophobicContact CD1-CZ 3.83Å; F85-F90 HydrophobicContact CD1-CB 4.41Å; F85-F90 HydrophobicContact CE1-CB 4.14Å; F85-F90 AromaticContact CE1-CD2 3.65Å; F85-F90 HydrophobicContact CE1-CD2 3.65Å; F85-F90 HydrophobicContact CE1-CG 4.36Å; F85-F90 HydrophobicContact CZ-CB 4.37Å; F85-F90 HydrophobicContact CZ-CD2 4.04Å; F85-F90 WeakPolarHBondContact O-CB 3.44Å; F85-F90 PolarHBondContact O-N 3.06Å; F85-F90 VanDerWaalsContact O-N 3.11Å; F86-F90 HydrophobicContact CD1-CB 4.12Å; F86-F90 HydrophobicContact CD1-CD1 4.29Å; F86-F90 AromaticContact CD1-CD2 3.73Å; F86-F90 HydrophobicContact CD1-CD2 3.73Å; F86-F90 HydrophobicContact CD1-CE2 4.2Å; F86-F90 AromaticContact CD1-CG 3.77Å; F86-F90 HydrophobicContact CD1-CG 3.77Å; F86-F90 AromaticContact CE1-CD2 3.64Å; F86-F90 HydrophobicContact CE1-CD2 3.64Å; F86-F90 AromaticContact CE1-CE2 3.8Å; F86-F90 HydrophobicContact CE1-CE2 3.8Å; F86-F90 HydrophobicContact CE1-CG 4.18Å; F86-F90 HydrophobicContact CE1-CZ 4.46Å; G88-F90 PolarHBondContact O-N 3.13Å; G88-F90 VanDerWaalsContact O-N 3.12Å; F90-G92 PolarHBondContact O-N 3Å; F90-L93 PolarHBondContact O-N 3.29Å; F90-V94 HydrophobicContact CD1-CG2 4.29Å; F90-V94 HydrophobicContact CD2-CG2 4.25Å; F90-V94 HydrophobicContact CE1-CG2 3.89Å; F90-V94 HydrophobicContact CE2-CG2 3.83Å; F90-V94 HydrophobicContact CG-CG2 4.48Å; F90-V94 HydrophobicContact CZ-CG2 3.64Å; F90-V94 WeakPolarHBondContact O-CG2 3.47Å; F90-V94 PolarHBondContact O-N 3.46Å
91	E	93.3	Very high	93.6	Very high	59 Å²	59	76.2 Å²	76.2	28%	0.276	39%	0.387	S	S	.	.	H	α-helix	trans	-61.6	-47	-177.1	-173.5	-178.4	169.2	0	0	111.6	R59 K60 P89 V94 H95	R59-E91 HydrophobicContact CB-CG 3.87Å; R59-E91 WeakPolarHBondContact CD-O 3.13Å; R59-E91 IonicContact CZ-OE1 3.68Å; R59-E91 VanDerWaalsContact NE-CG 3.28Å; R59-E91 PolarHBondContact NE-O 3Å; R59-E91 IonicContact NE-OE1 3.74Å; R59-E91 IonicContact NH2-OE1 3.81Å; R59-E91 PolarHBondContact NH2-OE1 3.17Å; R59-E91 VanDerWaalsContact NH2-OE1 3.09Å; K60-E91 WeakPolarHBondContact CE-OE2 3.42Å; P89-E91 PolarHBondContact O-N 3.18Å; E91-V94 PolarHBondContact O-N 3.17Å; E91-H95 WeakPolarHBondContact O-CB 3.31Å; E91-H95 PolarHBondContact O-N 2.98Å
92	G	93.5	Very high	93.3	Very high	35 Å²	35	71 Å²	71	36%	0.361	37%	0.366	S	S	.	.	H	α-helix	trans	-65.2	-42.4	178.8	0	0	0	0	0	112.5	P89 F90 V94 H95 D96	P89-G92 PolarHBondContact O-N 2.67Å; F90-G92 PolarHBondContact O-N 3Å; G92-V94 VanDerWaalsContact C-N 3.35Å; G92-V94 PolarHBondContact O-N 3.34Å; G92-H95 PolarHBondContact O-N 3.23Å; G92-D96 WeakPolarHBondContact O-CB 3.47Å; G92-D96 PolarHBondContact O-N 2.88Å
93	L	95.5	Very high	93	Very high	97 Å²	97	70.7 Å²	70.7	51%	0.508	36%	0.363	S	S	.	.	H	α-helix	trans	-61.1	-42.7	177.3	-72.2	170.8	0	0	0	112.3	F85 P89 F90 F97	F85-L93 HydrophobicContact CE2-CD1 3.61Å; F85-L93 HydrophobicContact CZ-CD1 4.07Å; P89-L93 HydrophobicContact CB-CD1 4.21Å; P89-L93 WeakPolarHBondContact O-CB 3.48Å; P89-L93 VanDerWaalsContact O-CG 3.27Å; P89-L93 WeakPolarHBondContact O-CG 3.29Å; P89-L93 PolarHBondContact O-N 2.99Å; F90-L93 PolarHBondContact O-N 3.29Å; L93-F97 VanDerWaalsContact O-CB 3.31Å; L93-F97 WeakPolarHBondContact O-CB 3.45Å; L93-F97 PolarHBondContact O-N 3.37Å; L93-F97 VanDerWaalsContact O-N 3.09Å
94	V	95.3	Very high	92.7	Very high	25 Å²	25	68.3 Å²	68.3	15%	0.152	35%	0.352	C	S	.	.	H	α-helix	trans	-67.7	-43.2	177	173.3	0	0	0	0	110.6	L53 R59 F90 E91 G92 F97 V98	L53-V94 HydrophobicContact CB-CG1 4.24Å; L53-V94 HydrophobicContact CD1-CG1 4.47Å; L53-V94 HydrophobicContact CD2-CG1 4.19Å; R59-V94 HydrophobicContact CG-CB 4.44Å; R59-V94 HydrophobicContact CG-CG1 3.92Å; F90-V94 HydrophobicContact CD1-CG2 4.29Å; F90-V94 HydrophobicContact CD2-CG2 4.25Å; F90-V94 HydrophobicContact CE1-CG2 3.89Å; F90-V94 HydrophobicContact CE2-CG2 3.83Å; F90-V94 HydrophobicContact CG-CG2 4.48Å; F90-V94 HydrophobicContact CZ-CG2 3.64Å; F90-V94 WeakPolarHBondContact O-CG2 3.47Å; F90-V94 PolarHBondContact O-N 3.46Å; E91-V94 PolarHBondContact O-N 3.17Å; G92-V94 VanDerWaalsContact C-N 3.35Å; G92-V94 PolarHBondContact O-N 3.34Å; V94-F97 PolarHBondContact O-N 3.41Å; V94-V98 HydrophobicContact CG1-CG2 4.11Å; V94-V98 WeakPolarHBondContact O-CB 3.22Å; V94-V98 WeakPolarHBondContact O-CG2 3.29Å; V94-V98 PolarHBondContact O-N 3.37Å
95	H	94.9	Very high	92.4	Very high	70 Å²	70	66 Å²	66	32%	0.324	35%	0.349	S	S	.	.	H	α-helix	trans	-56.7	-53	175.7	172.8	-88.4	0	0	0	111.6	E91 G92 F97 V98 V99	E91-H95 WeakPolarHBondContact O-CB 3.31Å; E91-H95 PolarHBondContact O-N 2.98Å; G92-H95 PolarHBondContact O-N 3.23Å; H95-F97 VanDerWaalsContact C-N 3.28Å; H95-F97 PolarHBondContact O-N 3.45Å; H95-V98 PolarHBondContact O-N 3.24Å; H95-V98 VanDerWaalsContact O-N 3.13Å; H95-V99 VanDerWaalsContact O-CG2 3.32Å; H95-V99 WeakPolarHBondContact O-CG2 3.49Å; H95-V99 PolarHBondContact O-N 2.9Å
96	D	94.3	Very high	92.2	Very high	99 Å²	99	63.6 Å²	63.6	53%	0.529	34%	0.342	S	S	.	.	H	α-helix	trans	-64.2	-34.9	-175.8	-65.9	-11	0	0	0	112.3	G92 N100	G92-D96 WeakPolarHBondContact O-CB 3.47Å; G92-D96 PolarHBondContact O-N 2.88Å; D96-N100 PolarHBondContact O-ND2 3.28Å; D96-N100 VanDerWaalsContact O-ND2 3.1Å
97	F	93.8	Very high	92	Very high	133 Å²	133	62 Å²	62	58%	0.583	34%	0.335	S	S	*	.	H	α-helix	trans	-64.2	-50.3	172.1	176.5	-104.8	0	0	0	111.7	L93 V94 H95 N100 M101	L93-F97 VanDerWaalsContact O-CB 3.31Å; L93-F97 WeakPolarHBondContact O-CB 3.45Å; L93-F97 PolarHBondContact O-N 3.37Å; L93-F97 VanDerWaalsContact O-N 3.09Å; V94-F97 PolarHBondContact O-N 3.41Å; H95-F97 VanDerWaalsContact C-N 3.28Å; H95-F97 PolarHBondContact O-N 3.45Å; F97-N100 PolarHBondContact O-N 3.32Å; F97-M101 HydrophobicContact CD1-SD 4.48Å; F97-M101 HydrophobicContact CE1-CE 4.1Å; F97-M101 HydrophobicContact CE1-CG 4.42Å; F97-M101 HydrophobicContact CE1-SD 3.77Å; F97-M101 HydrophobicContact CZ-CE 4.31Å; F97-M101 HydrophobicContact CZ-SD 4.33Å; F97-M101 WeakPolarHBondContact O-CB 3.46Å; F97-M101 PolarHBondContact O-N 2.71Å; F97-M101 VanDerWaalsContact O-N 3.14Å
98	V	92.9	Very high	92	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-73.7	-32.2	-171.1	173.2	0	0	0	0	112.8	R50 L53 L54 V94 H95 N100 M101	R50-V98 HydrophobicContact CB-CG1 4.2Å; R50-V98 HydrophobicContact CG-CG1 3.67Å; R50-V98 PolarHBondContact NE-O 2.85Å; R50-V98 WeakPolarHBondContact O-CG1 3.36Å; L53-V98 HydrophobicContact CB-CB 4.34Å; L53-V98 HydrophobicContact CB-CG1 3.98Å; L53-V98 HydrophobicContact CB-CG2 3.67Å; L53-V98 HydrophobicContact CD1-CG2 3.74Å; L53-V98 HydrophobicContact CG-CG2 4.38Å; L54-V98 HydrophobicContact CD2-CG1 4.08Å; L54-V98 HydrophobicContact CG-CG1 3.89Å; V94-V98 HydrophobicContact CG1-CG2 4.11Å; V94-V98 WeakPolarHBondContact O-CB 3.22Å; V94-V98 WeakPolarHBondContact O-CG2 3.29Å; V94-V98 PolarHBondContact O-N 3.37Å; H95-V98 PolarHBondContact O-N 3.24Å; H95-V98 VanDerWaalsContact O-N 3.13Å; V98-N100 PolarHBondContact O-N 2.9Å; V98-M101 PolarHBondContact O-N 3.17Å
99	V	91.5	Very high	92	Very high	57 Å²	57	64.2 Å²	64.2	35%	0.345	33%	0.329	S	S	.	.	H	α-helix	trans	-57.1	-41.2	175.7	166.8	0	0	0	0	111	R50 L54 H95	R50-V99 PolarHBondContact NH2-O 3.32Å; L54-V99 HydrophobicContact CD2-CG2 3.79Å; H95-V99 VanDerWaalsContact O-CG2 3.32Å; H95-V99 WeakPolarHBondContact O-CG2 3.49Å; H95-V99 PolarHBondContact O-N 2.9Å
100	N	87.9	Confident	91.9	Very high	137 Å²	137	66.2 Å²	66.2	73%	0.733	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	3.3	-176.1	-58.7	-63	0	0	0	113.8	D96 F97 V98 S102	D96-N100 PolarHBondContact O-ND2 3.28Å; D96-N100 VanDerWaalsContact O-ND2 3.1Å; F97-N100 PolarHBondContact O-N 3.32Å; V98-N100 PolarHBondContact O-N 2.9Å; N100-S102 PolarHBondContact O-N 3.36Å
101	M	87.8	Confident	91.6	Very high	44 Å²	44	68.1 Å²	68.1	22%	0.217	36%	0.362	C	S	.	.			trans	-70.2	127.4	-177.3	-175.5	178.1	-167.4	0	0	111.5	V46 F97 V98 P106	V46-M101 HydrophobicContact CG1-CE 4.41Å; F97-M101 HydrophobicContact CD1-SD 4.48Å; F97-M101 HydrophobicContact CE1-CE 4.1Å; F97-M101 HydrophobicContact CE1-CG 4.42Å; F97-M101 HydrophobicContact CE1-SD 3.77Å; F97-M101 HydrophobicContact CZ-CE 4.31Å; F97-M101 HydrophobicContact CZ-SD 4.33Å; F97-M101 WeakPolarHBondContact O-CB 3.46Å; F97-M101 PolarHBondContact O-N 2.71Å; F97-M101 VanDerWaalsContact O-N 3.14Å; V98-M101 PolarHBondContact O-N 3.17Å; M101-P106 HydrophobicContact CE-CG 3.63Å
102	S	89.9	Confident	91.4	Very high	34 Å²	34	68.5 Å²	68.5	24%	0.238	37%	0.365	C	S	.	.			trans	-68.7	140.1	168.1	177.2	0	0	0	0	110.9	N100 Y104 E105 P106	N100-S102 PolarHBondContact O-N 3.36Å; S102-Y104 VanDerWaalsContact C-N 3.33Å; S102-Y104 PolarHBondContact OG-N 3.02Å; S102-E105 VanDerWaalsContact CB-OE2 3.25Å; S102-E105 WeakPolarHBondContact CB-OE2 3.22Å; S102-E105 PolarHBondContact OG-N 3.27Å; S102-P106 WeakPolarHBondContact O-CD 3.47Å
103	V	89.4	Confident	91.1	Very high	19 Å²	19	67.2 Å²	67.2	12%	0.115	35%	0.351	C	S	.	.	S	Bend	trans	-82.8	-13.4	175	-60	0	0	0	0	112.9	V43 V46 R47	V43-V103 HydrophobicContact CG1-CB 4.22Å; V43-V103 HydrophobicContact CG1-CG2 3.95Å; V46-V103 HydrophobicContact CG1-CB 4.19Å; V46-V103 HydrophobicContact CG1-CG1 4.41Å; R47-V103 HydrophobicContact CG-CB 3.92Å; R47-V103 HydrophobicContact CG-CG1 3.64Å; R47-V103 HydrophobicContact CG-CG2 4.28Å
104	Y	87.9	Confident	90.4	Very high	22 Å²	22	71.3 Å²	71.3	9%	0.086	37%	0.367	C	S	.	.	S	Bend	trans	-98.7	-39.6	-178.8	-69.8	-85.8	0	0	0	112.7	V43 R47 S102 P106 C107 Q108 V116 Q117	V43-Y104 HydrophobicContact CG1-CD1 4.45Å; V43-Y104 HydrophobicContact CG1-CE1 4.11Å; V43-Y104 HydrophobicContact CG2-CD1 3.71Å; V43-Y104 HydrophobicContact CG2-CE1 3.83Å; V43-Y104 HydrophobicContact CG2-CG 4.45Å; R47-Y104 PolarHBondContact NH2-OH 3.01Å; S102-Y104 VanDerWaalsContact C-N 3.33Å; S102-Y104 PolarHBondContact OG-N 3.02Å; Y104-P106 VanDerWaalsContact C-CD 3.48Å; Y104-C107 WeakPolarHBondContact O-CA 3.21Å; Y104-C107 WeakPolarHBondContact O-CB 3.39Å; Y104-C107 PolarHBondContact O-N 3.32Å; Y104-Q108 PolarHBondContact O-N 3.05Å; Y104-V116 HydrophobicContact CD2-CG1 4.17Å; Y104-V116 HydrophobicContact CG-CG1 4.15Å; Y104-Q117 HydrophobicContact CE1-CB 4.39Å; Y104-Q117 WeakPolarHBondContact CE1-O 3.27Å; Y104-Q117 PolarHBondContact OH-O 2.9Å
105	E	90.4	Very high	89.1	Confident	123 Å²	123	74.2 Å²	74.2	58%	0.575	39%	0.385	S	S	*	.	H	α-helix	trans	-54.9	-42	-174.8	-71.6	175	154	0	0	113.5	S102 C107 Q108 Y109	S102-E105 VanDerWaalsContact CB-OE2 3.25Å; S102-E105 WeakPolarHBondContact CB-OE2 3.22Å; S102-E105 PolarHBondContact OG-N 3.27Å; E105-C107 VanDerWaalsContact C-N 3.27Å; E105-C107 PolarHBondContact O-N 2.93Å; E105-Q108 PolarHBondContact O-N 3.49Å; E105-Y109 VanDerWaalsContact O-CB 3.27Å; E105-Y109 WeakPolarHBondContact O-CB 3.4Å; E105-Y109 PolarHBondContact O-N 3.19Å
106	P	91.3	Very high	87.4	Confident	31 Å²	31	74.1 Å²	74.1	20%	0.201	39%	0.389	C	S	.	.	H	α-helix	trans	-61.9	-36.5	176	-22.5	34.1	0	0	0	112.6	V46 M101 S102 Y104 Y109 L110	V46-P106 HydrophobicContact CG1-CG 3.97Å; V46-P106 HydrophobicContact CG2-CB 3.99Å; V46-P106 HydrophobicContact CG2-CG 4.25Å; M101-P106 HydrophobicContact CE-CG 3.63Å; S102-P106 WeakPolarHBondContact O-CD 3.47Å; Y104-P106 VanDerWaalsContact C-CD 3.48Å; P106-Y109 PolarHBondContact O-N 3.35Å; P106-L110 WeakPolarHBondContact O-CB 3.49Å; P106-L110 WeakPolarHBondContact O-CG 3.42Å; P106-L110 PolarHBondContact O-N 3.44Å
107	C	91.8	Very high	85.7	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-73.5	-36.9	179.6	-59.5	0	0	0	0	112.1	C42 V43 Y104 E105 L110 G111 L112 C113	C42-C107 HydrophobicContact CB-CB 3.82Å; C42-C107 WeakPolarHBondContact CB-SG 3.48Å; C42-C107 WeakPolarHBondContact SG-CA 3.13Å; C42-C107 WeakPolarHBondContact SG-CB 3.38Å; C42-C107 CovalentContact SG-SG 2.04Å; C42-C107 PolarHBondContact SG-SG 2.94Å; V43-C107 HydrophobicContact CG2-CB 4.32Å; V43-C107 PolarHBondContact N-SG 2.84Å; V43-C107 VanDerWaalsContact N-SG 3.36Å; Y104-C107 WeakPolarHBondContact O-CA 3.21Å; Y104-C107 WeakPolarHBondContact O-CB 3.39Å; Y104-C107 PolarHBondContact O-N 3.32Å; E105-C107 VanDerWaalsContact C-N 3.27Å; E105-C107 PolarHBondContact O-N 2.93Å; C107-L110 PolarHBondContact O-N 3.49Å; C107-G111 PolarHBondContact O-N 2.89Å; C107-L112 WeakPolarHBondContact O-CB 3.45Å; C107-L112 PolarHBondContact O-N 3.4Å; C107-C113 HydrophobicContact CB-CB 4.23Å; C107-C113 WeakPolarHBondContact CB-SG 3.47Å; C107-C113 PolarHBondContact O-N 3.34Å
108	Q	90.5	Very high	83.9	Confident	62 Å²	62	74.8 Å²	74.8	29%	0.29	39%	0.391	S	S	.	.	H	α-helix	trans	-66.3	-43	171.8	-65.8	-178.7	-66.9	0	0	111.5	Y104 E105 L110 G111 C113	Y104-Q108 PolarHBondContact O-N 3.05Å; E105-Q108 PolarHBondContact O-N 3.49Å; Q108-L110 PolarHBondContact O-N 3.27Å; Q108-G111 WeakPolarHBondContact O-CA 3.2Å; Q108-G111 PolarHBondContact O-N 3.37Å; Q108-C113 WeakPolarHBondContact CA-O 2.81Å; Q108-C113 HydrophobicContact CG-CB 3.98Å; Q108-C113 WeakPolarHBondContact CG-O 3.47Å
109	Y	91.2	Very high	81.8	Confident	209 Å²	209	83.6 Å²	83.6	82%	0.82	43%	0.432	S	S	*	.	H	α-helix	trans	-59	-36.6	176	179.7	-94.4	0	0	0	112	E105 P106 G111	E105-Y109 VanDerWaalsContact O-CB 3.27Å; E105-Y109 WeakPolarHBondContact O-CB 3.4Å; E105-Y109 PolarHBondContact O-N 3.19Å; P106-Y109 PolarHBondContact O-N 3.35Å; Y109-G111 PolarHBondContact O-N 3.05Å
110	L	91.7	Very high	79.9	Confident	111 Å²	111	86.2 Å²	86.2	58%	0.581	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-1.8	174.4	-67.5	171.5	0	0	0	113.9	P106 C107 Q108 L112	P106-L110 WeakPolarHBondContact O-CB 3.49Å; P106-L110 WeakPolarHBondContact O-CG 3.42Å; P106-L110 PolarHBondContact O-N 3.44Å; C107-L110 PolarHBondContact O-N 3.49Å; Q108-L110 PolarHBondContact O-N 3.27Å; L110-L112 HydrophobicContact CB-CD1 3.96Å; L110-L112 HydrophobicContact CB-CG 3.79Å; L110-L112 HydrophobicContact CD1-CD1 4.14Å; L110-L112 PolarHBondContact O-N 2.89Å
111	G	89.7	Confident	78.3	Confident	64 Å²	64	82.6 Å²	82.6	66%	0.66	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	17.9	-176.4	0	0	0	0	0	114.1	C107 Q108 Y109	C107-G111 PolarHBondContact O-N 2.89Å; Q108-G111 WeakPolarHBondContact O-CA 3.2Å; Q108-G111 PolarHBondContact O-N 3.37Å; Y109-G111 PolarHBondContact O-N 3.05Å
112	L	89.2	Confident	76.9	Confident	67 Å²	67	90.4 Å²	90.4	35%	0.351	46%	0.456	S	S	.	.	S	Bend	trans	-90.7	-17.7	-177.8	-56.7	-178.2	0	0	0	112.7	I38 C39 C42 C107 L110	I38-L112 HydrophobicContact CG2-CB 4Å; I38-L112 HydrophobicContact CG2-CD2 3.74Å; I38-L112 HydrophobicContact CG2-CG 4.28Å; C39-L112 WeakPolarHBondContact CA-O 3.41Å; C39-L112 WeakPolarHBondContact CB-O 3.18Å; C42-L112 HydrophobicContact CB-CB 4.34Å; C42-L112 HydrophobicContact CB-CD1 3.84Å; C107-L112 WeakPolarHBondContact O-CB 3.45Å; C107-L112 PolarHBondContact O-N 3.4Å; L110-L112 HydrophobicContact CB-CD1 3.96Å; L110-L112 HydrophobicContact CB-CG 3.79Å; L110-L112 HydrophobicContact CD1-CD1 4.14Å; L110-L112 PolarHBondContact O-N 2.89Å
113	C	86.9	Confident	75.5	Confident	8 Å²	8	93 Å²	93	5%	0.054	47%	0.473	C	S	.	.			trans	-132.2	131.2	175.2	-62.9	0	0	0	0	109.4	C39 C107 Q108	C39-C113 WeakPolarHBondContact CA-SG 3.17Å; C39-C113 HydrophobicContact CB-CB 4.08Å; C39-C113 WeakPolarHBondContact CB-SG 3.38Å; C39-C113 WeakPolarHBondContact SG-CB 3.17Å; C39-C113 CovalentContact SG-SG 2.04Å; C39-C113 PolarHBondContact SG-SG 3.49Å; C107-C113 HydrophobicContact CB-CB 4.23Å; C107-C113 WeakPolarHBondContact CB-SG 3.47Å; C107-C113 PolarHBondContact O-N 3.34Å; Q108-C113 WeakPolarHBondContact CA-O 2.81Å; Q108-C113 HydrophobicContact CG-CB 3.98Å; Q108-C113 WeakPolarHBondContact CG-O 3.47Å
114	E	79.4	Confident	74.2	Confident	182 Å²	182	93.7 Å²	93.7	85%	0.85	48%	0.479	S	S	*	.	S	Bend	trans	-83.2	-39.2	178.9	-64.4	-175.9	168.7	0	0	112.5
115	T	69	Low	73.5	Confident	86 Å²	86	97.3 Å²	97.3	53%	0.528	50%	0.5	S	S	.	.	S	Bend	trans	-131.6	150.1	-175.4	52.7	0	0	0	0	111.1	Q117	T115-Q117 PolarHBondContact O-N 3.4Å
116	V	59.6	Low	72.7	Confident	69 Å²	69	96.6 Å²	96.6	42%	0.418	50%	0.5	S	S	.	.			trans	-69.5	99.2	171.6	-175.4	0	0	0	0	107	Y104 E118	Y104-V116 HydrophobicContact CD2-CG1 4.17Å; Y104-V116 HydrophobicContact CG-CG1 4.15Å; V116-E118 VanDerWaalsContact C-N 3.31Å; V116-E118 HydrophobicContact CG1-CG 3.99Å; V116-E118 PolarHBondContact O-N 2.85Å; V116-E118 VanDerWaalsContact O-N 3.12Å
117	Q	58.7	Low	72.1	Confident	79 Å²	79	98.1 Å²	98.1	37%	0.369	51%	0.511	S	S	.	.			trans	-82.9	82.8	171.1	-67.4	-173.4	2.3	0	0	108.2	Y104 T115 E119	Y104-Q117 HydrophobicContact CE1-CB 4.39Å; Y104-Q117 WeakPolarHBondContact CE1-O 3.27Å; Y104-Q117 PolarHBondContact OH-O 2.9Å; T115-Q117 PolarHBondContact O-N 3.4Å; Q117-E119 PolarHBondContact O-N 3.28Å
118	E	54.8	Low	71.6	Confident	167 Å²	167	102.1 Å²	102.1	78%	0.78	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-20	-169.2	-113.5	165.7	-170.1	0	0	115.1	V116	V116-E118 VanDerWaalsContact C-N 3.31Å; V116-E118 HydrophobicContact CG1-CG 3.99Å; V116-E118 PolarHBondContact O-N 2.85Å; V116-E118 VanDerWaalsContact O-N 3.12Å
119	E	50.4	Low	71	Confident	185 Å²	185	99.8 Å²	99.8	86%	0.864	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.1	3.3	-163.9	-74	-170.7	151.4	0	0	118.1	Q117 M121	Q117-E119 PolarHBondContact O-N 3.28Å; E119-M121 PolarHBondContact O-N 3.31Å
120	L	51.4	Low	70.2	Confident	112 Å²	112	92.1 Å²	92.1	59%	0.586	49%	0.492	S	S	*	.			trans	-105.9	72.3	-175.2	-140.2	80.7	0	0	0	112.9
121	M	53.4	Low	69.6	Low	61 Å²	61	92 Å²	92	30%	0.3	49%	0.492	S	S	.	.			trans	-179.1	120.2	152.6	-101.5	165.5	139	0	0	109.7	E40 M44 R47 E119 S123	E40-M121 HydrophobicContact CB-CE 3.85Å; E40-M121 HydrophobicContact CB-SD 4.12Å; E40-M121 HydrophobicContact CG-CE 4.28Å; E40-M121 HydrophobicContact CG-SD 4.14Å; M44-M121 HydrophobicContact CE-CE 3.7Å; R47-M121 PolarHBondContact NH1-SD 3.35Å; E119-M121 PolarHBondContact O-N 3.31Å; M121-S123 PolarHBondContact O-N 3.4Å
122	K	57.7	Low	69	Low	208 Å²	208	92.5 Å²	92.5	90%	0.904	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-55.2	124.8	161.9	-76.3	-177.6	177.3	179.2	0	107.4	P124	K122-P124 WeakPolarHBondContact O-CD 3.23Å
123	S	60.3	Low	68.2	Low	87 Å²	87	90.1 Å²	90.1	61%	0.608	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-58.5	129.5	172.3	62.1	0	0	0	0	107.8	M121 D125	M121-S123 PolarHBondContact O-N 3.4Å; S123-D125 PolarHBondContact O-N 2.89Å
124	P	64	Low	67.5	Low	35 Å²	35	94 Å²	94	23%	0.227	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-49.4	140.3	160.6	-21.9	32.2	0	0	0	108.7	K122 F128 Y129	K122-P124 WeakPolarHBondContact O-CD 3.23Å; P124-F128 HydrophobicContact CB-CB 3.6Å; P124-F128 HydrophobicContact CB-CD1 3.37Å; P124-F128 HydrophobicContact CB-CD2 4.42Å; P124-F128 HydrophobicContact CB-CE1 4.15Å; P124-F128 HydrophobicContact CB-CG 3.54Å; P124-F128 HydrophobicContact CG-CD1 3.9Å; P124-F128 HydrophobicContact CG-CE1 4.18Å; P124-F128 HydrophobicContact CG-CG 4.39Å; P124-Y129 HydrophobicContact CB-CE2 4.06Å; P124-Y129 WeakPolarHBondContact CD-OH 3.47Å; P124-Y129 HydrophobicContact CG-CE2 4.43Å
125	D	71.6	Confident	67.4	Low	98 Å²	98	91.9 Å²	91.9	52%	0.524	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-64.6	165.6	176.9	61.8	36.5	0	0	0	111	S123 S127 F128	S123-D125 PolarHBondContact O-N 2.89Å; D125-S127 PolarHBondContact O-N 2.75Å; D125-S127 WeakPolarHBondContact OD1-CA 3.45Å; D125-S127 WeakPolarHBondContact OD1-CB 3.37Å; D125-S127 PolarHBondContact OD1-N 3.45Å; D125-S127 PolarHBondContact OD1-OG 2.92Å; D125-F128 WeakPolarHBondContact O-CB 3.4Å; D125-F128 PolarHBondContact O-N 3.21Å; D125-F128 PolarHBondContact OD1-N 3.36Å
126	D	73.4	Confident	67.5	Low	108 Å²	108	90.9 Å²	90.9	58%	0.578	47%	0.467	S	S	*	.	H	α-helix	trans	-57.5	-24	178.8	-66.3	-31.2	0	0	0	112.5	W51 Y129 T130	W51-D126 HydrophobicContact CZ2-CB 4.47Å; W51-D126 PolarHBondContact NE1-OD1 2.97Å; D126-Y129 PolarHBondContact O-N 3.12Å; D126-T130 WeakPolarHBondContact O-CB 3.33Å; D126-T130 PolarHBondContact O-N 2.92Å; D126-T130 PolarHBondContact O-OG1 3.06Å
127	S	79.3	Confident	68.1	Low	62 Å²	62	90.9 Å²	90.9	43%	0.434	46%	0.464	S	S	.	.	H	α-helix	trans	-69.5	-36.1	177.7	90.5	0	0	0	0	111.8	D125 T130 N131	D125-S127 PolarHBondContact O-N 2.75Å; D125-S127 WeakPolarHBondContact OD1-CA 3.45Å; D125-S127 WeakPolarHBondContact OD1-CB 3.37Å; D125-S127 PolarHBondContact OD1-N 3.45Å; D125-S127 PolarHBondContact OD1-OG 2.92Å; S127-T130 PolarHBondContact O-N 2.88Å; S127-N131 WeakPolarHBondContact O-CB 3.44Å; S127-N131 VanDerWaalsContact O-CG 3.24Å; S127-N131 PolarHBondContact O-N 3.46Å; S127-N131 PolarHBondContact O-ND2 3.36Å
128	F	81.9	Confident	68.6	Low	85 Å²	85	89.6 Å²	89.6	37%	0.373	46%	0.464	S	S	.	.	H	α-helix	trans	-59	-48.8	173.7	175	-96.5	0	0	0	111	M44 P124 D125 N131 L132	M44-F128 HydrophobicContact SD-CZ 4.36Å; P124-F128 HydrophobicContact CB-CB 3.6Å; P124-F128 HydrophobicContact CB-CD1 3.37Å; P124-F128 HydrophobicContact CB-CD2 4.42Å; P124-F128 HydrophobicContact CB-CE1 4.15Å; P124-F128 HydrophobicContact CB-CG 3.54Å; P124-F128 HydrophobicContact CG-CD1 3.9Å; P124-F128 HydrophobicContact CG-CE1 4.18Å; P124-F128 HydrophobicContact CG-CG 4.39Å; D125-F128 WeakPolarHBondContact O-CB 3.4Å; D125-F128 PolarHBondContact O-N 3.21Å; D125-F128 PolarHBondContact OD1-N 3.36Å; F128-N131 PolarHBondContact O-N 3.47Å; F128-L132 HydrophobicContact CE1-CD2 4.3Å; F128-L132 WeakPolarHBondContact O-CB 3.28Å; F128-L132 PolarHBondContact O-N 2.87Å
129	Y	76.8	Confident	69.5	Low	12 Å²	12	85.2 Å²	85.2	5%	0.047	45%	0.445	C	S	.	.	H	α-helix	trans	-71	-34.8	-179.1	-64.4	-61.8	0	0	0	112.7	R47 W51 P124 D126 L132 L133	R47-Y129 WeakPolarHBondContact CB-OH 3.19Å; W51-Y129 HydrophobicContact CB-CD2 4.06Å; W51-Y129 HydrophobicContact CB-CG 4.1Å; W51-Y129 HydrophobicContact CD2-CD2 4.38Å; W51-Y129 HydrophobicContact CD2-CG 4.11Å; W51-Y129 HydrophobicContact CE3-CG 4.33Å; W51-Y129 AromaticContact CG-CD2 3.9Å; W51-Y129 HydrophobicContact CG-CD2 3.9Å; W51-Y129 AromaticContact CG-CG 3.99Å; W51-Y129 HydrophobicContact CG-CG 3.99Å; P124-Y129 HydrophobicContact CB-CE2 4.06Å; P124-Y129 WeakPolarHBondContact CD-OH 3.47Å; P124-Y129 HydrophobicContact CG-CE2 4.43Å; D126-Y129 PolarHBondContact O-N 3.12Å; Y129-L132 PolarHBondContact O-N 3.14Å; Y129-L133 WeakPolarHBondContact O-CB 3.45Å; Y129-L133 PolarHBondContact O-N 3.03Å
130	T	75.9	Confident	70.5	Confident	49 Å²	49	79.4 Å²	79.4	30%	0.301	42%	0.422	S	S	.	.	H	α-helix	trans	-60.2	-49	172.2	-57	0	0	0	0	111.1	W51 D126 S127 L132 L133 M134	W51-T130 VanDerWaalsContact CH2-CA 3.48Å; W51-T130 WeakPolarHBondContact CH2-OG1 3.46Å; W51-T130 WeakPolarHBondContact CZ2-OG1 3.41Å; D126-T130 WeakPolarHBondContact O-CB 3.33Å; D126-T130 PolarHBondContact O-N 2.92Å; D126-T130 PolarHBondContact O-OG1 3.06Å; S127-T130 PolarHBondContact O-N 2.88Å; T130-L132 PolarHBondContact O-N 3.03Å; T130-L133 WeakPolarHBondContact O-CB 3.07Å; T130-L133 PolarHBondContact O-N 3.11Å; T130-M134 WeakPolarHBondContact O-CG 3.3Å; T130-M134 PolarHBondContact O-N 3.15Å
131	N	78.1	Confident	71.4	Confident	107 Å²	107	77 Å²	77	57%	0.572	41%	0.407	S	S	*	.	H	α-helix	trans	-64.8	-40.3	178.9	-72.3	-38	0	0	0	112.1	S127 F128 L133 M134 K135	S127-N131 WeakPolarHBondContact O-CB 3.44Å; S127-N131 VanDerWaalsContact O-CG 3.24Å; S127-N131 PolarHBondContact O-N 3.46Å; S127-N131 PolarHBondContact O-ND2 3.36Å; F128-N131 PolarHBondContact O-N 3.47Å; N131-L133 VanDerWaalsContact C-N 3.35Å; N131-M134 PolarHBondContact O-N 3.44Å; N131-K135 WeakPolarHBondContact O-CB 3.4Å; N131-K135 PolarHBondContact O-N 3.04Å; N131-K135 VanDerWaalsContact O-N 3.12Å
132	L	76.3	Confident	72.4	Confident	76 Å²	76	80.2 Å²	80.2	40%	0.398	42%	0.421	S	S	.	.	H	α-helix	trans	-60.3	-46.4	174.7	-179	60.4	0	0	0	110.7	F128 Y129 T130 K135 T136	F128-L132 HydrophobicContact CE1-CD2 4.3Å; F128-L132 WeakPolarHBondContact O-CB 3.28Å; F128-L132 PolarHBondContact O-N 2.87Å; Y129-L132 PolarHBondContact O-N 3.14Å; T130-L132 PolarHBondContact O-N 3.03Å; L132-K135 PolarHBondContact O-N 3.46Å; L132-T136 WeakPolarHBondContact O-CB 2.98Å; L132-T136 PolarHBondContact O-N 3.09Å; L132-T136 PolarHBondContact O-OG1 2.83Å
133	L	72.7	Confident	73.2	Confident	16 Å²	16	74.2 Å²	74.2	8%	0.084	40%	0.399	C	S	.	.	H	α-helix	trans	-59.4	-50.6	177.5	-179.2	58.5	0	0	0	112.2	W51 L52 Y57 Y129 T130 N131 K135 T136 L137	W51-L133 HydrophobicContact CZ3-CB 4.39Å; W51-L133 HydrophobicContact CZ3-CD2 4.34Å; L52-L133 HydrophobicContact CD1-CD1 4.41Å; L52-L133 HydrophobicContact CD2-CB 3.8Å; L52-L133 HydrophobicContact CD2-CD1 3.44Å; L52-L133 VanDerWaalsContact CD2-CD1 3.44Å; L52-L133 HydrophobicContact CD2-CD2 3.55Å; L52-L133 HydrophobicContact CD2-CG 3.75Å; Y57-L133 HydrophobicContact CE2-CD2 3.83Å; Y57-L133 WeakPolarHBondContact OH-CD2 3.37Å; Y129-L133 WeakPolarHBondContact O-CB 3.45Å; Y129-L133 PolarHBondContact O-N 3.03Å; T130-L133 WeakPolarHBondContact O-CB 3.07Å; T130-L133 PolarHBondContact O-N 3.11Å; N131-L133 VanDerWaalsContact C-N 3.35Å; L133-K135 PolarHBondContact O-N 3.29Å; L133-T136 PolarHBondContact O-N 2.78Å; L133-T136 VanDerWaalsContact O-N 3.11Å; L133-L137 HydrophobicContact CD1-CD1 3.88Å; L133-L137 HydrophobicContact CD1-CD2 4.3Å; L133-L137 HydrophobicContact CD1-CG 3.76Å; L133-L137 HydrophobicContact CD2-CD1 4.25Å; L133-L137 HydrophobicContact CG-CD1 3.77Å; L133-L137 HydrophobicContact CG-CG 4.1Å; L133-L137 WeakPolarHBondContact O-CB 3.4Å; L133-L137 WeakPolarHBondContact O-CG 3.46Å; L133-L137 PolarHBondContact O-N 3.32Å
134	M	72.6	Confident	73.6	Confident	90 Å²	90	71.7 Å²	71.7	44%	0.443	38%	0.379	S	S	.	.	H	α-helix	trans	-57.3	-41.5	-178.2	-70.4	-59	-74.5	0	0	111.2	T130 N131 S138 F191	T130-M134 WeakPolarHBondContact O-CG 3.3Å; T130-M134 PolarHBondContact O-N 3.15Å; N131-M134 PolarHBondContact O-N 3.44Å; M134-S138 PolarHBondContact O-N 3.37Å; M134-S138 VanDerWaalsContact O-N 3.09Å; M134-F191 HydrophobicContact CE-CE2 3.91Å; M134-F191 HydrophobicContact CE-CZ 4.11Å; M134-F191 HydrophobicContact SD-CE1 4.02Å; M134-F191 HydrophobicContact SD-CE2 3.54Å; M134-F191 VanDerWaalsContact SD-CE2 3.54Å; M134-F191 HydrophobicContact SD-CZ 3.17Å; M134-F191 WeakPolarHBondContact SD-CZ 3.32Å
135	K	76.9	Confident	74	Confident	138 Å²	138	75.3 Å²	75.3	60%	0.6	39%	0.393	S	S	*	.	H	α-helix	trans	-69.4	-40.3	176.2	-171.6	176.2	-178.6	-178.7	0	112.7	N131 L132 L133 S138 I139	N131-K135 WeakPolarHBondContact O-CB 3.4Å; N131-K135 PolarHBondContact O-N 3.04Å; N131-K135 VanDerWaalsContact O-N 3.12Å; L132-K135 PolarHBondContact O-N 3.46Å; L133-K135 PolarHBondContact O-N 3.29Å; K135-S138 PolarHBondContact O-N 3.11Å; K135-S138 PolarHBondContact O-OG 3.36Å; K135-I139 HydrophobicContact CG-CD1 4.24Å; K135-I139 VanDerWaalsContact O-CG1 3.32Å; K135-I139 WeakPolarHBondContact O-CG1 3.07Å; K135-I139 PolarHBondContact O-N 2.04Å; K135-I139 VanDerWaalsContact O-N 3.15Å
136	T	72.7	Confident	74.2	Confident	65 Å²	65	74.3 Å²	74.3	40%	0.399	39%	0.393	S	S	.	.	H	α-helix	trans	-66.2	-42	176.3	-62.3	0	0	0	0	110.9	L132 L133 S138 I139 V140	L132-T136 WeakPolarHBondContact O-CB 2.98Å; L132-T136 PolarHBondContact O-N 3.09Å; L132-T136 PolarHBondContact O-OG1 2.83Å; L133-T136 PolarHBondContact O-N 2.78Å; L133-T136 VanDerWaalsContact O-N 3.11Å; T136-S138 VanDerWaalsContact C-N 3.33Å; T136-S138 PolarHBondContact O-N 3Å; T136-I139 PolarHBondContact O-N 2.91Å; T136-V140 HydrophobicContact CG2-CG2 4.04Å; T136-V140 VanDerWaalsContact O-CB 3.3Å; T136-V140 WeakPolarHBondContact O-CB 3.36Å; T136-V140 WeakPolarHBondContact O-CG2 3.03Å; T136-V140 PolarHBondContact O-N 2.89Å
137	L	70.4	Confident	74.3	Confident	68 Å²	68	74.7 Å²	74.7	36%	0.356	39%	0.394	S	S	.	.	H	α-helix	trans	-62.9	-38.5	177.1	-72.9	174.8	0	0	0	111.9	L133 K141	L133-L137 HydrophobicContact CD1-CD1 3.88Å; L133-L137 HydrophobicContact CD1-CD2 4.3Å; L133-L137 HydrophobicContact CD1-CG 3.76Å; L133-L137 HydrophobicContact CD2-CD1 4.25Å; L133-L137 HydrophobicContact CG-CD1 3.77Å; L133-L137 HydrophobicContact CG-CG 4.1Å; L133-L137 WeakPolarHBondContact O-CB 3.4Å; L133-L137 WeakPolarHBondContact O-CG 3.46Å; L133-L137 PolarHBondContact O-N 3.32Å; L137-K141 VanDerWaalsContact O-CB 3.28Å; L137-K141 WeakPolarHBondContact O-CB 3.43Å; L137-K141 PolarHBondContact O-N 3.37Å
138	S	70.6	Confident	74.1	Confident	53 Å²	53	73.7 Å²	73.7	37%	0.371	38%	0.383	S	S	.	.	H	α-helix	trans	-65.2	-45.2	175.9	68	0	0	0	0	111.9	M134 K135 T136 K141 E142	M134-S138 PolarHBondContact O-N 3.37Å; M134-S138 VanDerWaalsContact O-N 3.09Å; K135-S138 PolarHBondContact O-N 3.11Å; K135-S138 PolarHBondContact O-OG 3.36Å; T136-S138 VanDerWaalsContact C-N 3.33Å; T136-S138 PolarHBondContact O-N 3Å; S138-K141 PolarHBondContact O-N 2.94Å; S138-E142 WeakPolarHBondContact O-CG 3.39Å; S138-E142 PolarHBondContact O-N 2.04Å; S138-E142 VanDerWaalsContact O-N 3.11Å
139	I	73.2	Confident	74.1	Confident	75 Å²	75	72.2 Å²	72.2	39%	0.385	38%	0.381	S	S	.	.	H	α-helix	trans	-62.7	-47.8	176.7	-66.2	165.4	0	0	0	110.3	K135 T136 K141 E142 D143	K135-I139 HydrophobicContact CG-CD1 4.24Å; K135-I139 VanDerWaalsContact O-CG1 3.32Å; K135-I139 WeakPolarHBondContact O-CG1 3.07Å; K135-I139 PolarHBondContact O-N 2.04Å; K135-I139 VanDerWaalsContact O-N 3.15Å; T136-I139 PolarHBondContact O-N 2.91Å; I139-K141 VanDerWaalsContact C-N 3.29Å; I139-K141 PolarHBondContact O-N 3.34Å; I139-E142 PolarHBondContact O-N 3.42Å; I139-D143 WeakPolarHBondContact O-CB 3.49Å; I139-D143 PolarHBondContact O-N 3.11Å
140	V	71.1	Confident	74.4	Confident	62 Å²	62	76.8 Å²	76.8	38%	0.376	41%	0.412	S	S	.	.	H	α-helix	trans	-62.4	-37.8	-179.8	168.6	0	0	0	0	111.2	T136 I144	T136-V140 HydrophobicContact CG2-CG2 4.04Å; T136-V140 VanDerWaalsContact O-CB 3.3Å; T136-V140 WeakPolarHBondContact O-CB 3.36Å; T136-V140 WeakPolarHBondContact O-CG2 3.03Å; T136-V140 PolarHBondContact O-N 2.89Å; V140-I144 HydrophobicContact CG1-CD1 3.39Å; V140-I144 HydrophobicContact CG1-CG1 4.13Å; V140-I144 WeakPolarHBondContact O-CB 3.39Å; V140-I144 WeakPolarHBondContact O-CD1 3.4Å; V140-I144 WeakPolarHBondContact O-CG1 3.36Å; V140-I144 PolarHBondContact O-N 3.11Å
141	K	71	Confident	74.8	Confident	62 Å²	62	80.3 Å²	80.3	27%	0.27	43%	0.425	S	S	.	.	H	α-helix	trans	-61.2	-51.9	175	-175.9	-175.4	-174.8	159.5	0	111.2	L137 S138 I139 D143 I144 E145 S186	L137-K141 VanDerWaalsContact O-CB 3.28Å; L137-K141 WeakPolarHBondContact O-CB 3.43Å; L137-K141 PolarHBondContact O-N 3.37Å; S138-K141 PolarHBondContact O-N 2.94Å; I139-K141 VanDerWaalsContact C-N 3.29Å; I139-K141 PolarHBondContact O-N 3.34Å; K141-D143 PolarHBondContact O-N 2.78Å; K141-I144 PolarHBondContact O-N 3.02Å; K141-E145 VanDerWaalsContact CE-OE1 3.29Å; K141-E145 WeakPolarHBondContact CE-OE1 3.46Å; K141-E145 WeakPolarHBondContact O-CG 3.2Å; K141-E145 PolarHBondContact O-N 2.93Å; K141-S186 VanDerWaalsContact CE-OG 3.31Å; K141-S186 WeakPolarHBondContact CE-OG 3.2Å; K141-S186 PolarHBondContact NZ-OG 3.45Å
142	E	73.2	Confident	75.1	Confident	129 Å²	129	76.9 Å²	76.9	60%	0.603	41%	0.41	S	S	*	.	H	α-helix	trans	-60.6	-45.6	179.6	-70.6	172.4	-172.3	0	0	111.3	S138 I139 S146	S138-E142 WeakPolarHBondContact O-CG 3.39Å; S138-E142 PolarHBondContact O-N 2.04Å; S138-E142 VanDerWaalsContact O-N 3.11Å; I139-E142 PolarHBondContact O-N 3.42Å; E142-S146 WeakPolarHBondContact O-CB 3.36Å; E142-S146 PolarHBondContact O-N 2.86Å; E142-S146 VanDerWaalsContact O-N 3.11Å
143	D	75.1	Confident	75.4	Confident	82 Å²	82	74.1 Å²	74.1	44%	0.439	40%	0.396	S	S	.	.	H	α-helix	trans	-64.4	-45.2	179	-75.8	-13.3	0	0	0	111.4	I139 K141 E145 S146 I147	I139-D143 WeakPolarHBondContact O-CB 3.49Å; I139-D143 PolarHBondContact O-N 3.11Å; K141-D143 PolarHBondContact O-N 2.78Å; D143-E145 PolarHBondContact O-N 3.44Å; D143-S146 PolarHBondContact O-N 3.26Å; D143-S146 PolarHBondContact O-OG 3.19Å; D143-I147 HydrophobicContact CB-CD1 4.43Å; D143-I147 WeakPolarHBondContact O-CB 3.47Å; D143-I147 WeakPolarHBondContact O-CG1 3.12Å; D143-I147 PolarHBondContact O-N 3.42Å
144	I	69	Low	76	Confident	34 Å²	34	79.2 Å²	79.2	17%	0.174	42%	0.419	C	S	.	.	H	α-helix	trans	-63.1	-44.6	-179.8	-75.3	171.6	0	0	0	111.4	V140 K141 S146 I147 I148 I182	V140-I144 HydrophobicContact CG1-CD1 3.39Å; V140-I144 HydrophobicContact CG1-CG1 4.13Å; V140-I144 WeakPolarHBondContact O-CB 3.39Å; V140-I144 WeakPolarHBondContact O-CD1 3.4Å; V140-I144 WeakPolarHBondContact O-CG1 3.36Å; V140-I144 PolarHBondContact O-N 3.11Å; K141-I144 PolarHBondContact O-N 3.02Å; I144-S146 PolarHBondContact O-N 3.06Å; I144-I147 PolarHBondContact O-N 2.74Å; I144-I148 HydrophobicContact CG2-CD1 3.81Å; I144-I148 HydrophobicContact CG2-CG1 4.19Å; I144-I148 PolarHBondContact O-N 3.02Å; I144-I182 HydrophobicContact CD1-CD1 3.87Å; I144-I182 HydrophobicContact CD1-CG1 4.24Å; I144-I182 HydrophobicContact CD1-CG2 3.73Å; I144-I182 HydrophobicContact CG2-CD1 4.09Å; I144-I182 HydrophobicContact CG2-CG2 4.08Å
145	E	71.3	Confident	76.6	Confident	111 Å²	111	80.6 Å²	80.6	52%	0.519	42%	0.424	S	S	.	.	H	α-helix	trans	-62.9	-33.8	178.2	-72.5	176.2	-177.5	0	0	111.3	K141 D143	K141-E145 VanDerWaalsContact CE-OE1 3.29Å; K141-E145 WeakPolarHBondContact CE-OE1 3.46Å; K141-E145 WeakPolarHBondContact O-CG 3.2Å; K141-E145 PolarHBondContact O-N 2.93Å; D143-E145 PolarHBondContact O-N 3.44Å
146	S	75.9	Confident	77.1	Confident	77 Å²	77	75.7 Å²	75.7	54%	0.538	41%	0.409	S	S	.	.	H	α-helix	trans	-74.4	-35.1	175.8	82.1	0	0	0	0	113.7	E142 D143 I144	E142-S146 WeakPolarHBondContact O-CB 3.36Å; E142-S146 PolarHBondContact O-N 2.86Å; E142-S146 VanDerWaalsContact O-N 3.11Å; D143-S146 PolarHBondContact O-N 3.26Å; D143-S146 PolarHBondContact O-OG 3.19Å; I144-S146 PolarHBondContact O-N 3.06Å
147	I	75.6	Confident	77.6	Confident	116 Å²	116	72.6 Å²	72.6	60%	0.595	39%	0.39	S	S	*	.	H	α-helix	trans	-84.2	-43.5	-174.7	-68	166.9	0	0	0	111.3	D143 I144 T149 S152	D143-I147 HydrophobicContact CB-CD1 4.43Å; D143-I147 WeakPolarHBondContact O-CB 3.47Å; D143-I147 WeakPolarHBondContact O-CG1 3.12Å; D143-I147 PolarHBondContact O-N 3.42Å; I144-I147 PolarHBondContact O-N 2.74Å; I147-T149 PolarHBondContact O-N 2.86Å; I147-S152 PolarHBondContact O-OG 3.41Å
148	I	75.8	Confident	78.3	Confident	41 Å²	41	72.7 Å²	72.7	21%	0.21	39%	0.394	C	S	.	.	S	Bend	trans	-94.7	65.9	-171.9	-45.3	-174.7	0	0	0	110.2	I144 I153 F178 I179	I144-I148 HydrophobicContact CG2-CD1 3.81Å; I144-I148 HydrophobicContact CG2-CG1 4.19Å; I144-I148 PolarHBondContact O-N 3.02Å; I148-I153 HydrophobicContact CG2-CD1 4.08Å; I148-I153 HydrophobicContact CG2-CG1 3.97Å; I148-F178 HydrophobicContact CD1-CD1 3.91Å; I148-F178 HydrophobicContact CD1-CE1 3.79Å; I148-I179 HydrophobicContact CB-CD1 4.43Å; I148-I179 HydrophobicContact CB-CG1 4.42Å; I148-I179 HydrophobicContact CG2-CD1 3.62Å; I148-I179 HydrophobicContact CG2-CG1 3.84Å
149	T	82.1	Confident	79	Confident	53 Å²	53	78.7 Å²	78.7	33%	0.325	41%	0.413	S	S	.	.			trans	-79	155.2	173.5	67.9	0	0	0	0	111.2	I147 E151 S152 I153	I147-T149 PolarHBondContact O-N 2.86Å; T149-E151 PolarHBondContact O-N 2.92Å; T149-S152 PolarHBondContact N-OG 2.93Å; T149-S152 WeakPolarHBondContact O-CB 3.36Å; T149-S152 PolarHBondContact O-N 3.41Å; T149-S152 PolarHBondContact O-OG 3.46Å; T149-S152 PolarHBondContact OG1-N 2.99Å; T149-S152 VanDerWaalsContact OG1-N 3.13Å; T149-I153 WeakPolarHBondContact O-CG1 3.45Å; T149-I153 PolarHBondContact O-N 2.99Å; T149-I153 VanDerWaalsContact O-N 3.1Å
150	P	83.3	Confident	79.7	Confident	108 Å²	108	80.8 Å²	80.8	70%	0.701	42%	0.424	S	S	*	.	H	α-helix	trans	-52.3	-37.5	173.6	-27.8	35.6	0	0	0	113.4	I153 E154	P150-I153 PolarHBondContact O-N 3.27Å; P150-E154 PolarHBondContact O-N 2.69Å
151	E	84.8	Confident	80.6	Confident	123 Å²	123	78.2 Å²	78.2	58%	0.575	41%	0.409	S	S	*	.	H	α-helix	trans	-63.2	-44.7	175.4	-175.3	-178.2	178.1	0	0	112	T149 I153 E154 Q155	T149-E151 PolarHBondContact O-N 2.92Å; E151-I153 VanDerWaalsContact C-N 3.27Å; E151-I153 PolarHBondContact O-N 3.48Å; E151-E154 PolarHBondContact O-N 3.49Å; E151-Q155 HydrophobicContact CG-CG 4.49Å; E151-Q155 WeakPolarHBondContact O-CB 3.33Å; E151-Q155 VanDerWaalsContact O-CG 3.31Å; E151-Q155 WeakPolarHBondContact O-CG 3.38Å; E151-Q155 PolarHBondContact O-N 3.22Å; E151-Q155 PolarHBondContact OE1-NE2 2.91Å
152	S	84.1	Confident	81.4	Confident	36 Å²	36	80.1 Å²	80.1	25%	0.252	43%	0.431	S	S	.	.	H	α-helix	trans	-61.4	-37.2	177	76.8	0	0	0	0	112.1	I147 T149 A156	I147-S152 PolarHBondContact O-OG 3.41Å; T149-S152 PolarHBondContact N-OG 2.93Å; T149-S152 WeakPolarHBondContact O-CB 3.36Å; T149-S152 PolarHBondContact O-N 3.41Å; T149-S152 PolarHBondContact O-OG 3.46Å; T149-S152 PolarHBondContact OG1-N 2.99Å; T149-S152 VanDerWaalsContact OG1-N 3.13Å; S152-A156 VanDerWaalsContact O-CB 3.26Å; S152-A156 WeakPolarHBondContact O-CB 3.37Å; S152-A156 PolarHBondContact O-N 3.34Å
153	I	82.6	Confident	82	Confident	18 Å²	18	78.2 Å²	78.2	9%	0.092	43%	0.432	C	S	.	.	H	α-helix	trans	-65.9	-47.3	177.4	-61.7	170.1	0	0	0	109.8	I148 T149 P150 E151 A156 A157 F171 E172 A175 I179	I148-I153 HydrophobicContact CG2-CD1 4.08Å; I148-I153 HydrophobicContact CG2-CG1 3.97Å; T149-I153 WeakPolarHBondContact O-CG1 3.45Å; T149-I153 PolarHBondContact O-N 2.99Å; T149-I153 VanDerWaalsContact O-N 3.1Å; P150-I153 PolarHBondContact O-N 3.27Å; E151-I153 VanDerWaalsContact C-N 3.27Å; E151-I153 PolarHBondContact O-N 3.48Å; I153-A156 PolarHBondContact O-N 3.12Å; I153-A157 VanDerWaalsContact O-CB 3.23Å; I153-A157 WeakPolarHBondContact O-CB 3.48Å; I153-A157 PolarHBondContact O-N 2.96Å; I153-F171 HydrophobicContact CG2-CD1 4.27Å; I153-F171 HydrophobicContact CG2-CE1 4.16Å; I153-E172 HydrophobicContact CG2-CB 4.49Å; I153-E172 HydrophobicContact CG2-CG 4.11Å; I153-A175 HydrophobicContact CD1-CB 3.96Å; I153-A175 HydrophobicContact CG1-CB 4.01Å; I153-A175 HydrophobicContact CG2-CB 3.77Å; I153-I179 HydrophobicContact CD1-CD1 3.84Å
154	E	84.6	Confident	82.7	Confident	122 Å²	122	78.4 Å²	78.4	57%	0.57	43%	0.432	S	S	*	.	H	α-helix	trans	-63.4	-43.5	179.5	-173.9	178.8	176.9	0	0	111.8	P150 E151 A157 T158	P150-E154 PolarHBondContact O-N 2.69Å; E151-E154 PolarHBondContact O-N 3.49Å; E154-A157 PolarHBondContact O-N 3.35Å; E154-T158 WeakPolarHBondContact O-CB 3.34Å; E154-T158 PolarHBondContact O-N 3.38Å; E154-T158 PolarHBondContact O-OG1 3.23Å
155	Q	85.1	Confident	83.7	Confident	120 Å²	120	82.2 Å²	82.2	56%	0.561	45%	0.453	S	S	*	.	H	α-helix	trans	-62.2	-46.2	175.9	-72.6	179.1	6.1	0	0	111.6	E151 T158 K159	E151-Q155 HydrophobicContact CG-CG 4.49Å; E151-Q155 WeakPolarHBondContact O-CB 3.33Å; E151-Q155 VanDerWaalsContact O-CG 3.31Å; E151-Q155 WeakPolarHBondContact O-CG 3.38Å; E151-Q155 PolarHBondContact O-N 3.22Å; E151-Q155 PolarHBondContact OE1-NE2 2.91Å; Q155-T158 PolarHBondContact O-N 2.95Å; Q155-K159 WeakPolarHBondContact O-CB 3.32Å; Q155-K159 PolarHBondContact O-N 3.43Å
156	A	86.8	Confident	84.5	Confident	35 Å²	35	81.7 Å²	81.7	29%	0.289	46%	0.458	S	S	.	.	H	α-helix	trans	-64.6	-43.1	177.2	0	0	0	0	0	111.8	S152 I153 K159 L160 F171	S152-A156 VanDerWaalsContact O-CB 3.26Å; S152-A156 WeakPolarHBondContact O-CB 3.37Å; S152-A156 PolarHBondContact O-N 3.34Å; I153-A156 PolarHBondContact O-N 3.12Å; A156-K159 PolarHBondContact O-N 2.85Å; A156-L160 VanDerWaalsContact O-CB 3.31Å; A156-L160 WeakPolarHBondContact O-CB 3.28Å; A156-L160 WeakPolarHBondContact O-CG 3.38Å; A156-L160 PolarHBondContact O-N 3.11Å; A156-F171 HydrophobicContact CB-CE1 3.9Å; A156-F171 HydrophobicContact CB-CZ 3.77Å
157	A	84.6	Confident	85	Confident	0 Å²	0	80.5 Å²	80.5	0%	0	45%	0.449	C	S	.	.	H	α-helix	trans	-60.1	-49	177	0	0	0	0	0	110.9	I153 E154 K159 L160 C161 I168 F171	I153-A157 VanDerWaalsContact O-CB 3.23Å; I153-A157 WeakPolarHBondContact O-CB 3.48Å; I153-A157 PolarHBondContact O-N 2.96Å; E154-A157 PolarHBondContact O-N 3.35Å; A157-K159 VanDerWaalsContact C-N 3.33Å; A157-K159 PolarHBondContact O-N 2.85Å; A157-L160 PolarHBondContact O-N 2.91Å; A157-C161 WeakPolarHBondContact O-CB 3.29Å; A157-C161 PolarHBondContact O-N 3.37Å; A157-C161 PolarHBondContact O-SG 3.49Å; A157-I168 HydrophobicContact CB-CG1 4.39Å; A157-I168 HydrophobicContact CB-CG2 4.13Å; A157-F171 HydrophobicContact CB-CB 4.38Å; A157-F171 HydrophobicContact CB-CD1 3.58Å; A157-F171 HydrophobicContact CB-CE1 4.17Å; A157-F171 HydrophobicContact CB-CG 4.15Å
158	T	84.8	Confident	85.4	Confident	69 Å²	69	76.1 Å²	76.1	42%	0.423	43%	0.426	S	S	.	.	H	α-helix	trans	-61.2	-43.5	-179.9	-58.4	0	0	0	0	111.3	E154 Q155 S162	E154-T158 WeakPolarHBondContact O-CB 3.34Å; E154-T158 PolarHBondContact O-N 3.38Å; E154-T158 PolarHBondContact O-OG1 3.23Å; Q155-T158 PolarHBondContact O-N 2.95Å; T158-S162 PolarHBondContact O-N 2.97Å
159	K	85.8	Confident	86	Confident	179 Å²	179	82.8 Å²	82.8	78%	0.778	45%	0.449	S	S	*	.	H	α-helix	trans	-66.5	-45.8	179.1	-172.6	178.2	-178.3	179.9	0	112.7	Q155 A156 A157	Q155-K159 WeakPolarHBondContact O-CB 3.32Å; Q155-K159 PolarHBondContact O-N 3.43Å; A156-K159 PolarHBondContact O-N 2.85Å; A157-K159 VanDerWaalsContact C-N 3.33Å; A157-K159 PolarHBondContact O-N 2.85Å
160	L	87.6	Confident	86.2	Confident	119 Å²	119	82.9 Å²	82.9	62%	0.623	45%	0.449	S	S	*	.	H	α-helix	trans	-77.1	-35.9	-176.1	-71.6	170	0	0	0	112.6	A156 A157 F171	A156-L160 VanDerWaalsContact O-CB 3.31Å; A156-L160 WeakPolarHBondContact O-CB 3.28Å; A156-L160 WeakPolarHBondContact O-CG 3.38Å; A156-L160 PolarHBondContact O-N 3.11Å; A157-L160 PolarHBondContact O-N 2.91Å; L160-F171 HydrophobicContact CD1-CD2 4.11Å; L160-F171 HydrophobicContact CD1-CE2 3.39Å; L160-F171 HydrophobicContact CD1-CZ 3.94Å
161	C	88.6	Confident	86.2	Confident	8 Å²	8	79.3 Å²	79.3	5%	0.054	42%	0.423	C	S	.	.	H	α-helix	trans	-92.9	-5.6	-173.4	-65.7	0	0	0	0	114.1	A157 S163 D164 C167 I168	A157-C161 WeakPolarHBondContact O-CB 3.29Å; A157-C161 PolarHBondContact O-N 3.37Å; A157-C161 PolarHBondContact O-SG 3.49Å; C161-S163 PolarHBondContact O-N 3.5Å; C161-S163 VanDerWaalsContact O-N 3.12Å; C161-D164 WeakPolarHBondContact O-CB 3.21Å; C161-D164 PolarHBondContact O-N 3.45Å; C161-C167 VanDerWaalsContact CA-SG 3.51Å; C161-C167 HydrophobicContact CB-CB 3.52Å; C161-C167 WeakPolarHBondContact CB-SG 3.48Å; C161-C167 WeakPolarHBondContact SG-CB 3.42Å; C161-C167 CovalentContact SG-SG 2.05Å; C161-C167 PolarHBondContact SG-SG 3.43Å; C161-I168 HydrophobicContact CB-CD1 4.46Å; C161-I168 HydrophobicContact CB-CG1 3.57Å; C161-I168 PolarHBondContact SG-N 3.44Å
162	S	89.4	Confident	86.2	Confident	103 Å²	103	76.7 Å²	76.7	72%	0.72	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	43.7	178	-61.2	0	0	0	0	112.7	T158 D164	T158-S162 PolarHBondContact O-N 2.97Å; S162-D164 VanDerWaalsContact C-N 3.3Å; S162-D164 PolarHBondContact O-N 2.72Å
163	S	84.2	Confident	86.4	Confident	89 Å²	89	81.6 Å²	81.6	62%	0.622	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	9.4	-177.1	-48.4	0	0	0	0	117	C161 N165	C161-S163 PolarHBondContact O-N 3.5Å; C161-S163 VanDerWaalsContact O-N 3.12Å; S163-N165 PolarHBondContact O-N 3.09Å; S163-N165 VanDerWaalsContact O-N 3.14Å
164	D	90.1	Very high	86.3	Confident	85 Å²	85	81 Å²	81	46%	0.455	43%	0.425	S	S	.	.			trans	-69.5	108	169.9	-176.3	-80.8	0	0	0	110.9	C161 S162 T166 C167 I168	C161-D164 WeakPolarHBondContact O-CB 3.21Å; C161-D164 PolarHBondContact O-N 3.45Å; S162-D164 VanDerWaalsContact C-N 3.3Å; S162-D164 PolarHBondContact O-N 2.72Å; D164-T166 PolarHBondContact O-N 2.96Å; D164-T166 WeakPolarHBondContact OD1-CA 3.43Å; D164-T166 WeakPolarHBondContact OD1-CB 3.14Å; D164-T166 PolarHBondContact OD1-N 3.39Å; D164-C167 HydrophobicContact CB-CB 3.93Å; D164-C167 WeakPolarHBondContact O-CB 3.29Å; D164-C167 PolarHBondContact O-N 2.93Å; D164-C167 WeakPolarHBondContact OD1-CB 3.41Å; D164-C167 PolarHBondContact OD1-N 2.55Å; D164-I168 WeakPolarHBondContact O-CG1 3.35Å; D164-I168 PolarHBondContact O-N 2.8Å
165	N	90.2	Very high	86.2	Confident	114 Å²	114	76 Å²	76	61%	0.61	40%	0.404	S	S	*	.	H	α-helix	trans	-60.7	-28.9	-176.4	-75	-38.1	0	0	0	113.9	S163 R169	S163-N165 PolarHBondContact O-N 3.09Å; S163-N165 VanDerWaalsContact O-N 3.14Å; N165-R169 VanDerWaalsContact O-CG 3.29Å; N165-R169 WeakPolarHBondContact O-CG 3.47Å; N165-R169 PolarHBondContact O-N 3.4Å
166	T	88.9	Confident	86.2	Confident	101 Å²	101	74.4 Å²	74.4	62%	0.62	40%	0.399	S	S	*	.	H	α-helix	trans	-74.8	-41.6	179.8	-55.4	0	0	0	0	110.3	D164 T170	D164-T166 PolarHBondContact O-N 2.96Å; D164-T166 WeakPolarHBondContact OD1-CA 3.43Å; D164-T166 WeakPolarHBondContact OD1-CB 3.14Å; D164-T166 PolarHBondContact OD1-N 3.39Å; T166-T170 WeakPolarHBondContact O-CB 3.4Å; T166-T170 PolarHBondContact O-N 3.47Å; T166-T170 VanDerWaalsContact O-N 3.09Å; T166-T170 PolarHBondContact O-OG1 3.45Å
167	C	85	Confident	86	Confident	51 Å²	51	74.5 Å²	74.5	35%	0.345	40%	0.395	S	S	.	.	H	α-helix	trans	-61.9	-49.6	172.7	177.6	0	0	0	0	110.6	C161 D164 R169 T170 F171	C161-C167 VanDerWaalsContact CA-SG 3.51Å; C161-C167 HydrophobicContact CB-CB 3.52Å; C161-C167 WeakPolarHBondContact CB-SG 3.48Å; C161-C167 WeakPolarHBondContact SG-CB 3.42Å; C161-C167 CovalentContact SG-SG 2.05Å; C161-C167 PolarHBondContact SG-SG 3.43Å; D164-C167 HydrophobicContact CB-CB 3.93Å; D164-C167 WeakPolarHBondContact O-CB 3.29Å; D164-C167 PolarHBondContact O-N 2.93Å; D164-C167 WeakPolarHBondContact OD1-CB 3.41Å; D164-C167 PolarHBondContact OD1-N 2.55Å; C167-R169 PolarHBondContact O-N 3.01Å; C167-T170 CarbonylContact O-C 3.59Å; C167-T170 PolarHBondContact O-N 2.89Å; C167-F171 WeakPolarHBondContact O-CB 3.34Å; C167-F171 PolarHBondContact O-N 2.98Å
168	I	85.5	Confident	85.7	Confident	25 Å²	25	77.3 Å²	77.3	13%	0.128	41%	0.407	C	S	.	.	H	α-helix	trans	-55.7	-52.9	-179.6	-69.9	169.4	0	0	0	110.3	A157 C161 D164 T170 F171 E172	A157-I168 HydrophobicContact CB-CG1 4.39Å; A157-I168 HydrophobicContact CB-CG2 4.13Å; C161-I168 HydrophobicContact CB-CD1 4.46Å; C161-I168 HydrophobicContact CB-CG1 3.57Å; C161-I168 PolarHBondContact SG-N 3.44Å; D164-I168 WeakPolarHBondContact O-CG1 3.35Å; D164-I168 PolarHBondContact O-N 2.8Å; I168-T170 VanDerWaalsContact C-N 3.26Å; I168-T170 PolarHBondContact O-N 3.29Å; I168-F171 WeakPolarHBondContact O-CB 3.46Å; I168-F171 PolarHBondContact O-N 3.39Å; I168-F171 VanDerWaalsContact O-N 3.12Å; I168-E172 HydrophobicContact CG2-CG 4.33Å; I168-E172 WeakPolarHBondContact CG2-OE1 3.15Å; I168-E172 WeakPolarHBondContact O-CG 3.42Å; I168-E172 PolarHBondContact O-N 3.46Å
169	R	87.9	Confident	85.5	Confident	181 Å²	181	76.3 Å²	76.3	68%	0.683	40%	0.398	S	S	*	.	H	α-helix	trans	-59.9	-35.8	178.1	-71.3	174.9	-176.5	175.9	2	113.2	N165 C167 K173	N165-R169 VanDerWaalsContact O-CG 3.29Å; N165-R169 WeakPolarHBondContact O-CG 3.47Å; N165-R169 PolarHBondContact O-N 3.4Å; C167-R169 PolarHBondContact O-N 3.01Å; R169-K173 VanDerWaalsContact O-CB 3.29Å; R169-K173 WeakPolarHBondContact O-CB 3.34Å; R169-K173 PolarHBondContact O-N 3.38Å; R169-K173 VanDerWaalsContact O-N 3.15Å
170	T	85.5	Confident	85.2	Confident	55 Å²	55	74.8 Å²	74.8	34%	0.337	39%	0.388	S	S	.	.	H	α-helix	trans	-72.4	-38.1	178.6	-57.5	0	0	0	0	111.2	T166 C167 I168 S174	T166-T170 WeakPolarHBondContact O-CB 3.4Å; T166-T170 PolarHBondContact O-N 3.47Å; T166-T170 VanDerWaalsContact O-N 3.09Å; T166-T170 PolarHBondContact O-OG1 3.45Å; C167-T170 CarbonylContact O-C 3.59Å; C167-T170 PolarHBondContact O-N 2.89Å; I168-T170 VanDerWaalsContact C-N 3.26Å; I168-T170 PolarHBondContact O-N 3.29Å; T170-S174 WeakPolarHBondContact O-CB 3.3Å; T170-S174 PolarHBondContact O-N 2.99Å; T170-S174 PolarHBondContact O-OG 3.01Å
171	F	84.5	Confident	84.6	Confident	33 Å²	33	70.3 Å²	70.3	15%	0.145	37%	0.365	C	S	.	.	H	α-helix	trans	-65.3	-53.5	176.4	-176.1	-84.8	0	0	0	110.8	F72 I153 A156 A157 L160 C167 I168 K173 S174 A175	F72-F171 AromaticContact CE1-CD2 3.94Å; F72-F171 HydrophobicContact CE1-CD2 3.94Å; F72-F171 HydrophobicContact CE1-CE2 4.23Å; F72-F171 HydrophobicContact CZ-CD2 4.44Å; F72-F171 HydrophobicContact CZ-CE2 4.37Å; I153-F171 HydrophobicContact CG2-CD1 4.27Å; I153-F171 HydrophobicContact CG2-CE1 4.16Å; A156-F171 HydrophobicContact CB-CE1 3.9Å; A156-F171 HydrophobicContact CB-CZ 3.77Å; A157-F171 HydrophobicContact CB-CB 4.38Å; A157-F171 HydrophobicContact CB-CD1 3.58Å; A157-F171 HydrophobicContact CB-CE1 4.17Å; A157-F171 HydrophobicContact CB-CG 4.15Å; L160-F171 HydrophobicContact CD1-CD2 4.11Å; L160-F171 HydrophobicContact CD1-CE2 3.39Å; L160-F171 HydrophobicContact CD1-CZ 3.94Å; C167-F171 WeakPolarHBondContact O-CB 3.34Å; C167-F171 PolarHBondContact O-N 2.98Å; I168-F171 WeakPolarHBondContact O-CB 3.46Å; I168-F171 PolarHBondContact O-N 3.39Å; I168-F171 VanDerWaalsContact O-N 3.12Å; F171-K173 VanDerWaalsContact C-N 3.31Å; F171-K173 PolarHBondContact O-N 3.24Å; F171-S174 CarbonylContact O-C 3.59Å; F171-S174 WeakPolarHBondContact O-CA 3.4Å; F171-S174 WeakPolarHBondContact O-CB 3.42Å; F171-S174 PolarHBondContact O-N 3Å; F171-A175 PolarHBondContact O-N 3.18Å
172	E	84.8	Confident	83.9	Confident	67 Å²	67	71.1 Å²	71.1	31%	0.313	37%	0.369	S	S	.	.	H	α-helix	trans	-55.3	-46.6	177.9	-72.1	172	166.8	0	0	111.4	I153 I168 S174 A175 I176	I153-E172 HydrophobicContact CG2-CB 4.49Å; I153-E172 HydrophobicContact CG2-CG 4.11Å; I168-E172 HydrophobicContact CG2-CG 4.33Å; I168-E172 WeakPolarHBondContact CG2-OE1 3.15Å; I168-E172 WeakPolarHBondContact O-CG 3.42Å; I168-E172 PolarHBondContact O-N 3.46Å; E172-S174 VanDerWaalsContact C-N 3.3Å; E172-S174 PolarHBondContact O-N 3.19Å; E172-A175 PolarHBondContact O-N 3.27Å; E172-I176 WeakPolarHBondContact O-CG1 2.75Å; E172-I176 PolarHBondContact O-N 2.99Å
173	K	87	Confident	83.2	Confident	139 Å²	139	68.3 Å²	68.3	60%	0.604	35%	0.347	S	S	*	.	H	α-helix	trans	-59.2	-41.7	175.4	-177.5	176.1	-179.2	174.2	0	112.2	R169 F171 I176 D177	R169-K173 VanDerWaalsContact O-CB 3.29Å; R169-K173 WeakPolarHBondContact O-CB 3.34Å; R169-K173 PolarHBondContact O-N 3.38Å; R169-K173 VanDerWaalsContact O-N 3.15Å; F171-K173 VanDerWaalsContact C-N 3.31Å; F171-K173 PolarHBondContact O-N 3.24Å; K173-I176 PolarHBondContact O-N 3.41Å; K173-D177 WeakPolarHBondContact O-CB 3.43Å; K173-D177 VanDerWaalsContact O-CG 3.28Å; K173-D177 PolarHBondContact O-N 2.86Å
174	S	82.1	Confident	82.8	Confident	5 Å²	5	68.5 Å²	68.5	4%	0.035	34%	0.337	C	S	.	.	H	α-helix	trans	-68.5	-39.3	179.5	-57.9	0	0	0	0	111.7	V68 N71 T170 F171 E172 D177 F178	V68-S174 VanDerWaalsContact CG1-O 3.26Å; V68-S174 WeakPolarHBondContact CG1-O 3.32Å; N71-S174 WeakPolarHBondContact CB-OG 3.46Å; N71-S174 PolarHBondContact ND2-OG 2.74Å; T170-S174 WeakPolarHBondContact O-CB 3.3Å; T170-S174 PolarHBondContact O-N 2.99Å; T170-S174 PolarHBondContact O-OG 3.01Å; F171-S174 CarbonylContact O-C 3.59Å; F171-S174 WeakPolarHBondContact O-CA 3.4Å; F171-S174 WeakPolarHBondContact O-CB 3.42Å; F171-S174 PolarHBondContact O-N 3Å; E172-S174 VanDerWaalsContact C-N 3.3Å; E172-S174 PolarHBondContact O-N 3.19Å; S174-D177 PolarHBondContact O-N 2.82Å; S174-F178 WeakPolarHBondContact O-CB 3.35Å; S174-F178 PolarHBondContact O-N 3.24Å
175	A	82.8	Confident	81.7	Confident	17 Å²	17	65.2 Å²	65.2	14%	0.14	32%	0.319	C	S	.	.	H	α-helix	trans	-64.3	-43.4	174.5	0	0	0	0	0	111.7	I153 F171 E172 D177 F178 I179	I153-A175 HydrophobicContact CD1-CB 3.96Å; I153-A175 HydrophobicContact CG1-CB 4.01Å; I153-A175 HydrophobicContact CG2-CB 3.77Å; F171-A175 PolarHBondContact O-N 3.18Å; E172-A175 PolarHBondContact O-N 3.27Å; A175-D177 PolarHBondContact O-N 3.4Å; A175-F178 WeakPolarHBondContact O-CB 3.16Å; A175-F178 PolarHBondContact O-N 3.36Å; A175-I179 VanDerWaalsContact O-CG1 3.32Å; A175-I179 WeakPolarHBondContact O-CG1 3.4Å; A175-I179 PolarHBondContact O-N 2.79Å
176	I	83.4	Confident	80.4	Confident	87 Å²	87	61.3 Å²	61.3	45%	0.446	30%	0.301	S	S	.	.	H	α-helix	trans	-62.6	-43.5	174.7	-69.8	160.6	0	0	0	111.2	E172 K173 F178 I179 R180	E172-I176 WeakPolarHBondContact O-CG1 2.75Å; E172-I176 PolarHBondContact O-N 2.99Å; K173-I176 PolarHBondContact O-N 3.41Å; I176-F178 VanDerWaalsContact C-N 3.29Å; I176-F178 PolarHBondContact O-N 3.32Å; I176-I179 PolarHBondContact O-N 3.4Å; I176-R180 WeakPolarHBondContact O-CB 3.28Å; I176-R180 PolarHBondContact O-N 3.1Å
177	D	82.5	Confident	79.1	Confident	38 Å²	38	62.5 Å²	62.5	20%	0.203	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-37.1	176.8	-74.6	-17.6	0	0	0	111.2	K173 S174 A175 R180 V181	K173-D177 WeakPolarHBondContact O-CB 3.43Å; K173-D177 VanDerWaalsContact O-CG 3.28Å; K173-D177 PolarHBondContact O-N 2.86Å; S174-D177 PolarHBondContact O-N 2.82Å; A175-D177 PolarHBondContact O-N 3.4Å; D177-R180 PolarHBondContact O-N 2.78Å; D177-R180 IonicContact OD1-CZ 3.8Å; D177-R180 IonicContact OD1-NH1 2.74Å; D177-R180 PolarHBondContact OD1-NH1 2.84Å; D177-R180 IonicContact OD1-NH2 3.09Å; D177-V181 WeakPolarHBondContact O-CG2 3.32Å; D177-V181 PolarHBondContact O-N 3.39Å; D177-V181 VanDerWaalsContact O-N 3.11Å
178	F	79.6	Confident	77.7	Confident	59 Å²	59	61.6 Å²	61.6	26%	0.259	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-51.2	174.1	-171.1	-106.6	0	0	0	112.4	L65 V68 I148 S174 A175 I176 R180 V181 I182	L65-F178 HydrophobicContact CD1-CD2 3.55Å; L65-F178 HydrophobicContact CD1-CE1 4.38Å; L65-F178 HydrophobicContact CD1-CE2 3.08Å; L65-F178 HydrophobicContact CD1-CG 4.38Å; L65-F178 HydrophobicContact CD1-CZ 3.54Å; L65-F178 HydrophobicContact CD2-CE2 4.34Å; L65-F178 HydrophobicContact CG-CD2 4.28Å; L65-F178 HydrophobicContact CG-CE2 3.55Å; L65-F178 HydrophobicContact CG-CZ 4.15Å; V68-F178 HydrophobicContact CB-CD2 4.28Å; V68-F178 HydrophobicContact CG1-CB 4.12Å; V68-F178 HydrophobicContact CG1-CD2 4.41Å; V68-F178 HydrophobicContact CG2-CB 4.39Å; V68-F178 HydrophobicContact CG2-CD2 4.27Å; I148-F178 HydrophobicContact CD1-CD1 3.91Å; I148-F178 HydrophobicContact CD1-CE1 3.79Å; S174-F178 WeakPolarHBondContact O-CB 3.35Å; S174-F178 PolarHBondContact O-N 3.24Å; A175-F178 WeakPolarHBondContact O-CB 3.16Å; A175-F178 PolarHBondContact O-N 3.36Å; I176-F178 VanDerWaalsContact C-N 3.29Å; I176-F178 PolarHBondContact O-N 3.32Å; F178-R180 VanDerWaalsContact C-N 3.3Å; F178-R180 PolarHBondContact O-N 3.2Å; F178-V181 PolarHBondContact O-N 2.8Å; F178-I182 HydrophobicContact CD1-CD1 3.38Å; F178-I182 HydrophobicContact CE1-CD1 3.16Å; F178-I182 HydrophobicContact CE1-CG1 4.5Å; F178-I182 HydrophobicContact CE2-CD1 4.36Å; F178-I182 HydrophobicContact CG-CD1 4.07Å; F178-I182 HydrophobicContact CZ-CD1 3.7Å; F178-I182 PolarHBondContact O-N 3.3Å
179	I	79.7	Confident	76	Confident	48 Å²	48	67 Å²	67	25%	0.246	32%	0.323	C	S	.	.	H	α-helix	trans	-58	-45.9	177.8	-65	163.5	0	0	0	109.8	I148 I153 A175 I176 V181 I182 T183	I148-I179 HydrophobicContact CB-CD1 4.43Å; I148-I179 HydrophobicContact CB-CG1 4.42Å; I148-I179 HydrophobicContact CG2-CD1 3.62Å; I148-I179 HydrophobicContact CG2-CG1 3.84Å; I153-I179 HydrophobicContact CD1-CD1 3.84Å; A175-I179 VanDerWaalsContact O-CG1 3.32Å; A175-I179 WeakPolarHBondContact O-CG1 3.4Å; A175-I179 PolarHBondContact O-N 2.79Å; I176-I179 PolarHBondContact O-N 3.4Å; I179-V181 VanDerWaalsContact C-N 3.3Å; I179-V181 PolarHBondContact O-N 3.48Å; I179-I182 PolarHBondContact O-N 2.88Å; I179-I182 VanDerWaalsContact O-N 3.1Å; I179-T183 PolarHBondContact O-N 3.34Å; I179-T183 PolarHBondContact O-OG1 3.31Å; I179-T183 VanDerWaalsContact O-OG1 3.06Å
180	R	80.9	Confident	74.3	Confident	147 Å²	147	62.3 Å²	62.3	56%	0.555	31%	0.306	S	S	*	.	H	α-helix	trans	-58.2	-41.9	179	-169.2	-173.3	-61.8	118.2	4.3	112.2	I176 D177 F178 K184	I176-R180 WeakPolarHBondContact O-CB 3.28Å; I176-R180 PolarHBondContact O-N 3.1Å; D177-R180 PolarHBondContact O-N 2.78Å; D177-R180 IonicContact OD1-CZ 3.8Å; D177-R180 IonicContact OD1-NH1 2.74Å; D177-R180 PolarHBondContact OD1-NH1 2.84Å; D177-R180 IonicContact OD1-NH2 3.09Å; F178-R180 VanDerWaalsContact C-N 3.3Å; F178-R180 PolarHBondContact O-N 3.2Å; R180-K184 VanDerWaalsContact O-CB 3.25Å; R180-K184 WeakPolarHBondContact O-CB 3.41Å; R180-K184 PolarHBondContact O-N 2.85Å
181	V	74.8	Confident	72.6	Confident	24 Å²	24	64.1 Å²	64.1	15%	0.145	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-45	176.5	169.4	0	0	0	0	110.5	E64 L65 D177 F178 I179 N185	E64-V181 HydrophobicContact CB-CG1 3.65Å; E64-V181 HydrophobicContact CB-CG2 4.39Å; L65-V181 HydrophobicContact CD1-CG1 4.45Å; D177-V181 WeakPolarHBondContact O-CG2 3.32Å; D177-V181 PolarHBondContact O-N 3.39Å; D177-V181 VanDerWaalsContact O-N 3.11Å; F178-V181 PolarHBondContact O-N 2.8Å; I179-V181 VanDerWaalsContact C-N 3.3Å; I179-V181 PolarHBondContact O-N 3.48Å; V181-N185 WeakPolarHBondContact O-CB 3.17Å; V181-N185 PolarHBondContact O-N 3.05Å; V181-N185 VanDerWaalsContact O-N 3.11Å; V181-N185 PolarHBondContact O-ND2 3.47Å
182	I	72.6	Confident	70.7	Confident	26 Å²	26	66.9 Å²	66.9	13%	0.133	33%	0.333	C	S	.	.	H	α-helix	trans	-63.9	-49.4	179.3	-70.3	153.8	0	0	0	111.2	L65 I144 F178 I179 K184 N185 S186	L65-I182 HydrophobicContact CD1-CD1 3.91Å; L65-I182 HydrophobicContact CD1-CG1 3.68Å; I144-I182 HydrophobicContact CD1-CD1 3.87Å; I144-I182 HydrophobicContact CD1-CG1 4.24Å; I144-I182 HydrophobicContact CD1-CG2 3.73Å; I144-I182 HydrophobicContact CG2-CD1 4.09Å; I144-I182 HydrophobicContact CG2-CG2 4.08Å; F178-I182 HydrophobicContact CD1-CD1 3.38Å; F178-I182 HydrophobicContact CE1-CD1 3.16Å; F178-I182 HydrophobicContact CE1-CG1 4.5Å; F178-I182 HydrophobicContact CE2-CD1 4.36Å; F178-I182 HydrophobicContact CG-CD1 4.07Å; F178-I182 HydrophobicContact CZ-CD1 3.7Å; F178-I182 PolarHBondContact O-N 3.3Å; I179-I182 PolarHBondContact O-N 2.88Å; I179-I182 VanDerWaalsContact O-N 3.1Å; I182-K184 PolarHBondContact O-N 3.45Å; I182-N185 PolarHBondContact O-N 3.37Å; I182-S186 WeakPolarHBondContact O-CB 3.36Å; I182-S186 PolarHBondContact O-N 3.45Å
183	T	74.7	Confident	68.9	Low	44 Å²	44	69.7 Å²	69.7	27%	0.27	35%	0.35	S	S	.	.	H	α-helix	trans	-60	-47.6	-179.6	-52	0	0	0	0	111	I179 N185 S186 E187	I179-T183 PolarHBondContact O-N 3.34Å; I179-T183 PolarHBondContact O-OG1 3.31Å; I179-T183 VanDerWaalsContact O-OG1 3.06Å; T183-N185 VanDerWaalsContact C-N 3.3Å; T183-N185 PolarHBondContact O-N 2.85Å; T183-S186 WeakPolarHBondContact O-CB 3.34Å; T183-S186 PolarHBondContact O-N 3.22Å; T183-S186 PolarHBondContact O-OG 2.99Å; T183-E187 PolarHBondContact O-N 3.13Å
184	K	76.1	Confident	66.5	Low	92 Å²	92	69.3 Å²	69.3	40%	0.4	35%	0.354	S	S	.	.	H	α-helix	trans	-56.2	-43.5	177.4	-177.7	-170.3	172.2	-159.2	0	112.1	E64 R180 I182 S186	E64-K184 IonicContact OE1-NZ 3.95Å; R180-K184 VanDerWaalsContact O-CB 3.25Å; R180-K184 WeakPolarHBondContact O-CB 3.41Å; R180-K184 PolarHBondContact O-N 2.85Å; I182-K184 PolarHBondContact O-N 3.45Å; K184-S186 VanDerWaalsContact C-N 3.27Å; K184-S186 PolarHBondContact O-N 3.28Å
185	N	67.2	Low	64.4	Low	17 Å²	17	82 Å²	82	9%	0.091	41%	0.409	C	S	.	.	H	α-helix	trans	-75.9	-17.1	-179.5	-73.3	-68.5	0	0	0	113	T61 E64 V181 I182 T183 W190	T61-N185 HydrophobicContact CG2-CB 3.66Å; T61-N185 VanDerWaalsContact CG2-CG 3.49Å; T61-N185 PolarHBondContact OG1-OD1 2.93Å; E64-N185 PolarHBondContact OE2-ND2 3.47Å; E64-N185 VanDerWaalsContact OE2-ND2 3.13Å; V181-N185 WeakPolarHBondContact O-CB 3.17Å; V181-N185 PolarHBondContact O-N 3.05Å; V181-N185 VanDerWaalsContact O-N 3.11Å; V181-N185 PolarHBondContact O-ND2 3.47Å; I182-N185 PolarHBondContact O-N 3.37Å; T183-N185 VanDerWaalsContact C-N 3.3Å; T183-N185 PolarHBondContact O-N 2.85Å; N185-W190 PolarHBondContact OD1-NE1 3.31Å
186	S	63.2	Low	63.5	Low	31 Å²	31	85.2 Å²	85.2	22%	0.217	42%	0.423	C	S	.	.	H	α-helix	trans	-84.4	-16.5	178.1	81.1	0	0	0	0	114.7	K141 I182 T183 K184 G188	K141-S186 VanDerWaalsContact CE-OG 3.31Å; K141-S186 WeakPolarHBondContact CE-OG 3.2Å; K141-S186 PolarHBondContact NZ-OG 3.45Å; I182-S186 WeakPolarHBondContact O-CB 3.36Å; I182-S186 PolarHBondContact O-N 3.45Å; T183-S186 WeakPolarHBondContact O-CB 3.34Å; T183-S186 PolarHBondContact O-N 3.22Å; T183-S186 PolarHBondContact O-OG 2.99Å; K184-S186 VanDerWaalsContact C-N 3.27Å; K184-S186 PolarHBondContact O-N 3.28Å; S186-G188 VanDerWaalsContact C-N 3.27Å; S186-G188 PolarHBondContact O-N 3.46Å
187	E	62	Low	62.4	Low	126 Å²	126	85.1 Å²	85.1	59%	0.589	42%	0.422	S	S	*	.	S	Bend	trans	-85.3	9.3	-174	-73.2	178.5	167.7	0	0	114.1	T183 E189	T183-E187 PolarHBondContact O-N 3.13Å; E187-E189 VanDerWaalsContact C-N 3.29Å; E187-E189 PolarHBondContact O-N 3.17Å
188	G	54.8	Low	61.3	Low	33 Å²	33	87.7 Å²	87.7	34%	0.34	43%	0.434	S	S	.	.			trans	72.5	12.2	164.1	0	0	0	0	0	116.1	S186 W190	S186-G188 VanDerWaalsContact C-N 3.27Å; S186-G188 PolarHBondContact O-N 3.46Å; G188-W190 PolarHBondContact O-N 3.26Å
189	E	50.7	Low	60.3	Low	137 Å²	137	89.4 Å²	89.4	64%	0.64	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-7.1	177.3	-72	-171.7	155.1	0	0	114.3	E187	E187-E189 VanDerWaalsContact C-N 3.29Å; E187-E189 PolarHBondContact O-N 3.17Å
190	W	52.1	Low	59	Low	83 Å²	83	92 Å²	92	31%	0.314	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-3.7	-173.4	-58.6	100	0	0	0	115.1	N185 G188 S192	N185-W190 PolarHBondContact OD1-NE1 3.31Å; G188-W190 PolarHBondContact O-N 3.26Å; W190-S192 VanDerWaalsContact C-N 3.34Å
191	F	48.9	Very low	57.6	Low	93 Å²	93	88.3 Å²	88.3	41%	0.408	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	0.3	-177.2	-69.7	-73	0	0	0	114.6	M134	M134-F191 HydrophobicContact CE-CE2 3.91Å; M134-F191 HydrophobicContact CE-CZ 4.11Å; M134-F191 HydrophobicContact SD-CE1 4.02Å; M134-F191 HydrophobicContact SD-CE2 3.54Å; M134-F191 VanDerWaalsContact SD-CE2 3.54Å; M134-F191 HydrophobicContact SD-CZ 3.17Å; M134-F191 WeakPolarHBondContact SD-CZ 3.32Å
192	S	44.8	Very low	56.4	Low	91 Å²	91	92.9 Å²	92.9	64%	0.636	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-11.7	-175.9	57	0	0	0	0	115.7	W190	W190-S192 VanDerWaalsContact C-N 3.34Å
193	D	46.1	Very low	55.1	Low	127 Å²	127	98.1 Å²	98.1	68%	0.679	50%	0.498	S	S	*	.	S	Bend	trans	-112.7	-0.3	-161.3	-71.3	10.3	0	0	0	115.5
194	D	37.9	Very low	53.5	Low	130 Å²	130	102.6 Å²	102.6	70%	0.695	52%	0.517	S	S	*	.			trans	-133.6	33.5	-176.5	-86.4	-33.1	0	0	0	114.5
195	F	37.8	Very low	51.4	Low	271 Å²	271	103.5 Å²	103.5	100%	1.189	53%	0.527	S	S	*	.			trans	-123.6	0	164.9	-84.1	-78.4	0	0	0	112.7

Retrieved 195 of 195 residues in 292.6 ms (Link to these results)

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