A0A087XJC6_POEFO Loading...

Cytochrome P-450AROM

Catalyzes the formation of aromatic C18 estrogens from C19 androgens.

AlphaFold DB , UniProt , Accession A0A087XJC6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 529 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	45.3	Very low	54.6	Low	217 Å²	217	110.1 Å²	110.1	100%	1.069	64%	0.635	S	S	*	*				0	-20.9	0	-78.1	-157.3	-157.7	0	0	114.8
2	A	49.1	Very low	56.8	Low	87 Å²	87	112.9 Å²	112.9	72%	0.719	64%	0.635	S	S	*	*			trans	-76.8	-20.9	-177.5	0	0	0	0	0	115.7
3	V	48.3	Very low	58.7	Low	134 Å²	134	112.7 Å²	112.7	81%	0.812	63%	0.63	S	S	*	*	H	α-helix	trans	-80.1	-19.8	-179.1	-178.2	0	0	0	0	112.7
4	L	47.5	Very low	60.6	Low	117 Å²	117	107.5 Å²	107.5	61%	0.613	62%	0.615	S	S	*	*	H	α-helix	trans	-85.2	-15.5	178.4	-85.9	156.8	0	0	0	113.5	S7 Y8	L4-S7 PolarHBondContact O-OG 2.84Å; L4-Y8 WeakPolarHBondContact O-CD2 3.47Å; L4-Y8 VanDerWaalsContact O-CE2 3.25Å; L4-Y8 WeakPolarHBondContact O-CE2 3.33Å
5	L	48.1	Very low	62.4	Low	138 Å²	138	103.4 Å²	103.4	72%	0.723	60%	0.599	S	S	*	*	H	α-helix	trans	-89	-26.3	178.8	-80.3	155.8	0	0	0	112.8
6	G	49.8	Very low	64.1	Low	41 Å²	41	101.6 Å²	101.6	42%	0.423	59%	0.594	S	S	.	*	H	α-helix	trans	-71.9	-31.1	177.7	0	0	0	0	0	113.9	S9	G6-S9 PolarHBondContact O-OG 3.11Å
7	S	54.2	Low	65.6	Low	65 Å²	65	102.2 Å²	102.2	46%	0.455	59%	0.593	S	S	.	*	H	α-helix	trans	-76.8	-25.2	-175.3	56.2	0	0	0	0	114.5	L4 P11	L4-S7 PolarHBondContact O-OG 2.84Å; S7-P11 WeakPolarHBondContact O-CD 3.27Å
8	Y	55	Low	67.1	Low	142 Å²	142	104.3 Å²	104.3	56%	0.557	59%	0.594	S	S	*	*	H	α-helix	trans	-82.6	-22.2	176.7	-66.1	-75.7	0	0	0	113.1	L4 P11 F12	L4-Y8 WeakPolarHBondContact O-CD2 3.47Å; L4-Y8 VanDerWaalsContact O-CE2 3.25Å; L4-Y8 WeakPolarHBondContact O-CE2 3.33Å; Y8-P11 WeakPolarHBondContact O-CD 3.45Å; Y8-F12 WeakPolarHBondContact O-CD2 3.45Å; Y8-F12 PolarHBondContact O-N 2.95Å
9	S	61.5	Low	68.5	Low	56 Å²	56	104.2 Å²	104.2	39%	0.392	59%	0.59	S	S	.	*	H	α-helix	trans	-68.5	-36.5	-176.5	67.8	0	0	0	0	114.2	G6 F12 L13	G6-S9 PolarHBondContact O-OG 3.11Å; S9-F12 PolarHBondContact O-N 2.88Å; S9-L13 WeakPolarHBondContact O-CB 3.21Å; S9-L13 PolarHBondContact O-N 3.12Å
10	L	66.3	Low	69.6	Low	133 Å²	133	101.8 Å²	101.8	70%	0.696	58%	0.584	S	S	*	*	H	α-helix	trans	-65.3	-47.4	177.6	-94.2	111.1	0	0	0	113.5	F12 L13 G14	L10-F12 VanDerWaalsContact C-N 3.34Å; L10-F12 PolarHBondContact O-N 3.5Å; L10-L13 PolarHBondContact O-N 3.29Å; L10-G14 PolarHBondContact O-N 3.32Å
11	P	75.5	Confident	70.7	Confident	81 Å²	81	99 Å²	99	53%	0.526	57%	0.574	S	S	.	*	H	α-helix	trans	-58.2	-39.9	173.4	-26.1	31.3	0	0	0	113.9	S7 Y8 G14 A15	S7-P11 WeakPolarHBondContact O-CD 3.27Å; Y8-P11 WeakPolarHBondContact O-CD 3.45Å; P11-G14 PolarHBondContact O-N 2.74Å; P11-A15 WeakPolarHBondContact O-CB 3.18Å; P11-A15 PolarHBondContact O-N 2.78Å
12	F	80.8	Confident	73	Confident	144 Å²	144	93 Å²	93	63%	0.632	55%	0.545	S	S	*	.	H	α-helix	trans	-69.2	-38.5	178	-79.4	-66.3	0	0	0	112.7	Y8 S9 L10 S16	Y8-F12 WeakPolarHBondContact O-CD2 3.45Å; Y8-F12 PolarHBondContact O-N 2.95Å; S9-F12 PolarHBondContact O-N 2.88Å; L10-F12 VanDerWaalsContact C-N 3.34Å; L10-F12 PolarHBondContact O-N 3.5Å; F12-S16 WeakPolarHBondContact O-CB 3.29Å; F12-S16 PolarHBondContact O-N 3.04Å; F12-S16 PolarHBondContact O-OG 3.3Å
13	L	81.8	Confident	75	Confident	110 Å²	110	92.8 Å²	92.8	58%	0.576	54%	0.535	S	S	*	.	H	α-helix	trans	-63	-45.2	171.3	-100.8	149	0	0	0	111.4	S9 L10 S16 I17	S9-L13 WeakPolarHBondContact O-CB 3.21Å; S9-L13 PolarHBondContact O-N 3.12Å; L10-L13 PolarHBondContact O-N 3.29Å; L13-S16 PolarHBondContact O-N 3.49Å; L13-I17 VanDerWaalsContact O-CG1 3.28Å; L13-I17 WeakPolarHBondContact O-CG1 3.38Å; L13-I17 PolarHBondContact O-N 2.95Å
14	G	85.1	Confident	77.2	Confident	40 Å²	40	93.3 Å²	93.3	41%	0.412	52%	0.523	S	S	.	.	H	α-helix	trans	-60.5	-45.4	175.7	0	0	0	0	0	112.8	L10 P11 S16 I17 F18	L10-G14 PolarHBondContact O-N 3.32Å; P11-G14 PolarHBondContact O-N 2.74Å; G14-S16 PolarHBondContact O-N 2.88Å; G14-I17 PolarHBondContact O-N 3.23Å; G14-F18 WeakPolarHBondContact O-CB 3.34Å; G14-F18 PolarHBondContact O-N 3.31Å
15	A	88.4	Confident	79.2	Confident	46 Å²	46	92.1 Å²	92.1	38%	0.38	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-40.4	175.6	0	0	0	0	0	112.1	P11 F18 I19	P11-A15 WeakPolarHBondContact O-CB 3.18Å; P11-A15 PolarHBondContact O-N 2.78Å; A15-F18 PolarHBondContact O-N 3.04Å; A15-I19 WeakPolarHBondContact O-CB 3.45Å; A15-I19 WeakPolarHBondContact O-CG1 3.26Å; A15-I19 PolarHBondContact O-N 3.39Å
16	S	88.6	Confident	81.2	Confident	74 Å²	74	89 Å²	89	52%	0.517	50%	0.503	S	S	.	.	H	α-helix	trans	-66.9	-42.3	178.5	-58.6	0	0	0	0	112.1	F12 L13 G14 I19 A20	F12-S16 WeakPolarHBondContact O-CB 3.29Å; F12-S16 PolarHBondContact O-N 3.04Å; F12-S16 PolarHBondContact O-OG 3.3Å; L13-S16 PolarHBondContact O-N 3.49Å; G14-S16 PolarHBondContact O-N 2.88Å; S16-I19 PolarHBondContact O-N 3.18Å; S16-A20 VanDerWaalsContact O-CB 3.25Å; S16-A20 WeakPolarHBondContact O-CB 3.48Å; S16-A20 PolarHBondContact O-N 3.31Å
17	I	90.7	Very high	83.2	Confident	113 Å²	113	94 Å²	94	58%	0.579	51%	0.511	S	S	*	.	H	α-helix	trans	-64.1	-42.7	174.5	-67.4	166	0	0	0	110.3	L13 G14 A20 A21	L13-I17 VanDerWaalsContact O-CG1 3.28Å; L13-I17 WeakPolarHBondContact O-CG1 3.38Å; L13-I17 PolarHBondContact O-N 2.95Å; G14-I17 PolarHBondContact O-N 3.23Å; I17-A20 PolarHBondContact O-N 2.76Å; I17-A21 VanDerWaalsContact O-CB 3.27Å; I17-A21 WeakPolarHBondContact O-CB 3.47Å; I17-A21 PolarHBondContact O-N 3.24Å
18	F	92.4	Very high	84.9	Confident	139 Å²	139	95.2 Å²	95.2	61%	0.61	51%	0.509	S	S	*	.	H	α-helix	trans	-62.5	-46.4	177	179.5	-97.8	0	0	0	112	G14 A15 A21 L22	G14-F18 WeakPolarHBondContact O-CB 3.34Å; G14-F18 PolarHBondContact O-N 3.31Å; A15-F18 PolarHBondContact O-N 3.04Å; F18-A21 PolarHBondContact O-N 2.75Å; F18-L22 HydrophobicContact CE1-CD2 4.37Å; F18-L22 WeakPolarHBondContact O-CB 3.37Å; F18-L22 PolarHBondContact O-N 2.93Å
19	I	92.6	Very high	86.4	Confident	102 Å²	102	94.2 Å²	94.2	52%	0.523	51%	0.513	S	S	.	.	H	α-helix	trans	-61.6	-49.5	176.1	-69.1	164.9	0	0	0	109.7	A15 S16 A21 L22 T23	A15-I19 WeakPolarHBondContact O-CB 3.45Å; A15-I19 WeakPolarHBondContact O-CG1 3.26Å; A15-I19 PolarHBondContact O-N 3.39Å; S16-I19 PolarHBondContact O-N 3.18Å; I19-A21 VanDerWaalsContact C-N 3.33Å; I19-A21 PolarHBondContact O-N 2.65Å; I19-L22 CarbonylContact O-C 3.6Å; I19-L22 PolarHBondContact O-N 3.01Å; I19-L22 VanDerWaalsContact O-N 3.11Å; I19-T23 PolarHBondContact O-N 3.14Å; I19-T23 PolarHBondContact O-OG1 3.29Å
20	A	91.8	Very high	87.7	Confident	56 Å²	56	95.7 Å²	95.7	46%	0.463	52%	0.516	S	S	.	.	H	α-helix	trans	-56.5	-46.8	178.9	0	0	0	0	0	111.6	S16 I17 T23 Y24	S16-A20 VanDerWaalsContact O-CB 3.25Å; S16-A20 WeakPolarHBondContact O-CB 3.48Å; S16-A20 PolarHBondContact O-N 3.31Å; I17-A20 PolarHBondContact O-N 2.76Å; A20-T23 WeakPolarHBondContact CA-OG1 3.32Å; A20-T23 PolarHBondContact O-N 3.16Å; A20-T23 PolarHBondContact O-OG1 3.37Å; A20-Y24 WeakPolarHBondContact O-CB 3.21Å; A20-Y24 PolarHBondContact O-N 3.07Å
21	A	91.9	Very high	88.8	Confident	45 Å²	45	91.7 Å²	91.7	37%	0.372	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-44	175.6	0	0	0	0	0	111.9	I17 F18 I19 Y24 I25	I17-A21 VanDerWaalsContact O-CB 3.27Å; I17-A21 WeakPolarHBondContact O-CB 3.47Å; I17-A21 PolarHBondContact O-N 3.24Å; F18-A21 PolarHBondContact O-N 2.75Å; I19-A21 VanDerWaalsContact C-N 3.33Å; I19-A21 PolarHBondContact O-N 2.65Å; A21-Y24 PolarHBondContact O-N 3.43Å; A21-I25 WeakPolarHBondContact O-CB 3.47Å; A21-I25 VanDerWaalsContact O-CG1 3.23Å; A21-I25 WeakPolarHBondContact O-CG1 3.47Å; A21-I25 PolarHBondContact O-N 2.84Å
22	L	93.1	Very high	89.5	Confident	91 Å²	91	89.3 Å²	89.3	48%	0.476	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-44.3	177.3	-174.2	64.9	0	0	0	111.8	F18 I19 I25 T26	F18-L22 HydrophobicContact CE1-CD2 4.37Å; F18-L22 WeakPolarHBondContact O-CB 3.37Å; F18-L22 PolarHBondContact O-N 2.93Å; I19-L22 CarbonylContact O-C 3.6Å; I19-L22 PolarHBondContact O-N 3.01Å; I19-L22 VanDerWaalsContact O-N 3.11Å; L22-I25 PolarHBondContact O-N 3.42Å; L22-T26 HydrophobicContact CD1-CG2 4.38Å; L22-T26 WeakPolarHBondContact O-CB 3.38Å; L22-T26 VanDerWaalsContact O-CG2 3.28Å; L22-T26 WeakPolarHBondContact O-CG2 3.4Å; L22-T26 PolarHBondContact O-N 3.39Å; L22-T26 PolarHBondContact O-OG1 3.38Å
23	T	92.4	Very high	89.9	Confident	81 Å²	81	83.5 Å²	83.5	50%	0.497	46%	0.463	S	S	.	.	H	α-helix	trans	-62.5	-41.1	173.8	25	0	0	0	0	112.1	I19 A20 T26 Y27	I19-T23 PolarHBondContact O-N 3.14Å; I19-T23 PolarHBondContact O-OG1 3.29Å; A20-T23 WeakPolarHBondContact CA-OG1 3.32Å; A20-T23 PolarHBondContact O-N 3.16Å; A20-T23 PolarHBondContact O-OG1 3.37Å; T23-T26 VanDerWaalsContact CA-OG1 3.3Å; T23-T26 WeakPolarHBondContact CA-OG1 3.17Å; T23-T26 PolarHBondContact O-OG1 3.33Å; T23-Y27 WeakPolarHBondContact O-CB 3.34Å; T23-Y27 PolarHBondContact O-N 3.15Å
24	Y	93	Very high	90.4	Very high	145 Å²	145	81.4 Å²	81.4	57%	0.569	45%	0.452	S	S	*	.	H	α-helix	trans	-64.6	-46.2	177.8	179.2	-102.4	0	0	0	111.4	A20 A21 Y27 Q28	A20-Y24 WeakPolarHBondContact O-CB 3.21Å; A20-Y24 PolarHBondContact O-N 3.07Å; A21-Y24 PolarHBondContact O-N 3.43Å; Y24-Y27 PolarHBondContact O-N 3.48Å; Y24-Q28 HydrophobicContact CD1-CG 4.39Å; Y24-Q28 HydrophobicContact CE1-CG 4.02Å; Y24-Q28 HydrophobicContact CE2-CG 4.15Å; Y24-Q28 WeakPolarHBondContact O-CB 3.49Å; Y24-Q28 VanDerWaalsContact O-CG 3.27Å; Y24-Q28 WeakPolarHBondContact O-CG 3.45Å; Y24-Q28 PolarHBondContact O-N 2.89Å; Y24-Q28 PolarHBondContact OH-NE2 2.78Å
25	I	90.5	Very high	90.7	Very high	93 Å²	93	84.6 Å²	84.6	48%	0.477	46%	0.456	S	S	.	.	H	α-helix	trans	-62.8	-47.4	177.7	-69.1	165.7	0	0	0	110.7	A21 L22 Y27 Q28 L29	A21-I25 WeakPolarHBondContact O-CB 3.47Å; A21-I25 VanDerWaalsContact O-CG1 3.23Å; A21-I25 WeakPolarHBondContact O-CG1 3.47Å; A21-I25 PolarHBondContact O-N 2.84Å; L22-I25 PolarHBondContact O-N 3.42Å; I25-Y27 PolarHBondContact O-N 2.84Å; I25-Q28 PolarHBondContact O-N 3.39Å; I25-L29 HydrophobicContact CG2-CD1 3.94Å; I25-L29 HydrophobicContact CG2-CG 4.43Å; I25-L29 VanDerWaalsContact O-CG 3.31Å; I25-L29 WeakPolarHBondContact O-CG 3.44Å; I25-L29 PolarHBondContact O-N 3.4Å
26	T	89.8	Confident	90.9	Very high	71 Å²	71	84.4 Å²	84.4	44%	0.436	45%	0.447	S	S	.	.	H	α-helix	trans	-64.6	-40.1	179.1	50.4	0	0	0	0	112	L22 T23 L29 L30	L22-T26 HydrophobicContact CD1-CG2 4.38Å; L22-T26 WeakPolarHBondContact O-CB 3.38Å; L22-T26 VanDerWaalsContact O-CG2 3.28Å; L22-T26 WeakPolarHBondContact O-CG2 3.4Å; L22-T26 PolarHBondContact O-N 3.39Å; L22-T26 PolarHBondContact O-OG1 3.38Å; T23-T26 VanDerWaalsContact CA-OG1 3.3Å; T23-T26 WeakPolarHBondContact CA-OG1 3.17Å; T23-T26 PolarHBondContact O-OG1 3.33Å; T26-L29 PolarHBondContact O-N 2.85Å; T26-L30 VanDerWaalsContact O-CB 3.22Å; T26-L30 WeakPolarHBondContact O-CB 3.33Å; T26-L30 PolarHBondContact O-N 3.31Å
27	Y	92.4	Very high	91	Very high	148 Å²	148	84 Å²	84	58%	0.58	43%	0.434	S	S	*	.	H	α-helix	trans	-60.4	-46.8	173	173.7	-100.6	0	0	0	111.9	T23 Y24 I25 L29 L30 S31	T23-Y27 WeakPolarHBondContact O-CB 3.34Å; T23-Y27 PolarHBondContact O-N 3.15Å; Y24-Y27 PolarHBondContact O-N 3.48Å; I25-Y27 PolarHBondContact O-N 2.84Å; Y27-L29 PolarHBondContact O-N 3.09Å; Y27-L30 PolarHBondContact O-N 2.95Å; Y27-S31 WeakPolarHBondContact O-CB 3.37Å; Y27-S31 PolarHBondContact O-N 2.88Å
28	Q	88.8	Confident	91	Very high	89 Å²	89	84.7 Å²	84.7	42%	0.416	43%	0.433	S	S	.	.	H	α-helix	trans	-62.5	-44.6	178.9	-72.3	-69.1	3.7	0	0	112	Y24 I25 G32	Y24-Q28 HydrophobicContact CD1-CG 4.39Å; Y24-Q28 HydrophobicContact CE1-CG 4.02Å; Y24-Q28 HydrophobicContact CE2-CG 4.15Å; Y24-Q28 WeakPolarHBondContact O-CB 3.49Å; Y24-Q28 VanDerWaalsContact O-CG 3.27Å; Y24-Q28 WeakPolarHBondContact O-CG 3.45Å; Y24-Q28 PolarHBondContact O-N 2.89Å; Y24-Q28 PolarHBondContact OH-NE2 2.78Å; I25-Q28 PolarHBondContact O-N 3.39Å; Q28-G32 PolarHBondContact O-N 3.33Å
29	L	87.4	Confident	90.9	Very high	121 Å²	121	79.3 Å²	79.3	63%	0.634	42%	0.417	S	S	*	.	H	α-helix	trans	-63.7	-46	177.2	-69.8	174.2	0	0	0	111.8	I25 T26 Y27 Y33	I25-L29 HydrophobicContact CG2-CD1 3.94Å; I25-L29 HydrophobicContact CG2-CG 4.43Å; I25-L29 VanDerWaalsContact O-CG 3.31Å; I25-L29 WeakPolarHBondContact O-CG 3.44Å; I25-L29 PolarHBondContact O-N 3.4Å; T26-L29 PolarHBondContact O-N 2.85Å; Y27-L29 PolarHBondContact O-N 3.09Å; L29-Y33 VanDerWaalsContact O-CB 3.27Å; L29-Y33 WeakPolarHBondContact O-CB 3.44Å; L29-Y33 PolarHBondContact O-N 3Å
30	L	89.3	Confident	90.9	Very high	87 Å²	87	74.5 Å²	74.5	46%	0.455	39%	0.392	S	S	.	.	H	α-helix	trans	-68.5	-43.8	-179.2	-173.7	66.8	0	0	0	111.6	T26 Y27 Y33 L34	T26-L30 VanDerWaalsContact O-CB 3.22Å; T26-L30 WeakPolarHBondContact O-CB 3.33Å; T26-L30 PolarHBondContact O-N 3.31Å; Y27-L30 PolarHBondContact O-N 2.95Å; L30-Y33 HydrophobicContact CD1-CD1 4.48Å; L30-Y33 PolarHBondContact O-N 3.04Å; L30-L34 HydrophobicContact CD1-CD1 4.43Å; L30-L34 HydrophobicContact CD1-CG 4.35Å; L30-L34 HydrophobicContact CG-CD1 4.02Å; L30-L34 HydrophobicContact CG-CG 4.33Å; L30-L34 WeakPolarHBondContact O-CB 3.36Å; L30-L34 VanDerWaalsContact O-CG 3.29Å; L30-L34 WeakPolarHBondContact O-CG 3.5Å; L30-L34 PolarHBondContact O-N 3.46Å
31	S	89.3	Confident	90.8	Very high	50 Å²	50	79.3 Å²	79.3	35%	0.35	40%	0.403	S	S	.	.	H	α-helix	trans	-60.8	-47.4	176.6	-178.9	0	0	0	0	111.1	Y27 Y33 L34 H35	Y27-S31 WeakPolarHBondContact O-CB 3.37Å; Y27-S31 PolarHBondContact O-N 2.88Å; S31-Y33 VanDerWaalsContact C-N 3.33Å; S31-Y33 PolarHBondContact O-N 2.99Å; S31-L34 PolarHBondContact O-N 2.8Å; S31-H35 WeakPolarHBondContact O-CB 3.46Å; S31-H35 PolarHBondContact O-N 3.07Å
32	G	88.7	Confident	90.8	Very high	31 Å²	31	80.9 Å²	80.9	32%	0.32	41%	0.411	S	S	.	.	H	α-helix	trans	-63.1	-37.8	175.6	0	0	0	0	0	113.1	Q28 K36	Q28-G32 PolarHBondContact O-N 3.33Å; G32-K36 VanDerWaalsContact O-CE 3.25Å; G32-K36 WeakPolarHBondContact O-CE 3.49Å; G32-K36 WeakPolarHBondContact O-CG 3.38Å; G32-K36 PolarHBondContact O-N 2.86Å
33	Y	90.3	Very high	90.8	Very high	22 Å²	22	76.7 Å²	76.7	9%	0.086	39%	0.389	C	S	.	.	H	α-helix	trans	-64.6	-51.6	173.7	169.4	-94.2	0	0	0	111.8	L29 L30 S31 H35 K36 W37 P51 W86 P89	L29-Y33 VanDerWaalsContact O-CB 3.27Å; L29-Y33 WeakPolarHBondContact O-CB 3.44Å; L29-Y33 PolarHBondContact O-N 3Å; L30-Y33 HydrophobicContact CD1-CD1 4.48Å; L30-Y33 PolarHBondContact O-N 3.04Å; S31-Y33 VanDerWaalsContact C-N 3.33Å; S31-Y33 PolarHBondContact O-N 2.99Å; Y33-H35 VanDerWaalsContact C-N 3.34Å; Y33-H35 PolarHBondContact O-N 3.02Å; Y33-K36 PolarHBondContact O-N 3.23Å; Y33-K36 VanDerWaalsContact O-N 3.16Å; Y33-W37 HydrophobicContact CE1-CB 4.36Å; Y33-W37 HydrophobicContact CE2-CE3 4.25Å; Y33-W37 AromaticContact CZ-CE3 3.74Å; Y33-W37 WeakPolarHBondContact O-CB 3.47Å; Y33-W37 PolarHBondContact O-N 3.29Å; Y33-W37 WeakPolarHBondContact OH-CZ3 3.35Å; Y33-P51 VanDerWaalsContact CZ-O 3.25Å; Y33-P51 WeakPolarHBondContact OH-CA 3.48Å; Y33-P51 PolarHBondContact OH-O 3.18Å; Y33-W86 HydrophobicContact CD2-CH2 4.37Å; Y33-W86 AromaticContact CD2-CZ3 3.85Å; Y33-W86 HydrophobicContact CD2-CZ3 3.85Å; Y33-W86 HydrophobicContact CE2-CE3 4.07Å; Y33-W86 HydrophobicContact CE2-CH2 4.12Å; Y33-W86 AromaticContact CE2-CZ3 3.52Å; Y33-W86 HydrophobicContact CE2-CZ3 3.52Å; Y33-P89 HydrophobicContact CD2-CB 4.36Å
34	L	91.4	Very high	90.9	Very high	66 Å²	66	74.8 Å²	74.8	35%	0.346	38%	0.378	S	S	.	.	H	α-helix	trans	-62.3	-40.4	-179.5	-71.7	175.6	0	0	0	111.7	L30 S31 K36 W37 F38	L30-L34 HydrophobicContact CD1-CD1 4.43Å; L30-L34 HydrophobicContact CD1-CG 4.35Å; L30-L34 HydrophobicContact CG-CD1 4.02Å; L30-L34 HydrophobicContact CG-CG 4.33Å; L30-L34 WeakPolarHBondContact O-CB 3.36Å; L30-L34 VanDerWaalsContact O-CG 3.29Å; L30-L34 WeakPolarHBondContact O-CG 3.5Å; L30-L34 PolarHBondContact O-N 3.46Å; S31-L34 PolarHBondContact O-N 2.8Å; L34-K36 VanDerWaalsContact C-N 3.32Å; L34-K36 PolarHBondContact O-N 2.97Å; L34-W37 PolarHBondContact O-N 3.02Å; L34-F38 HydrophobicContact CB-CD2 4.26Å; L34-F38 HydrophobicContact CB-CE2 4.19Å; L34-F38 HydrophobicContact CD2-CE2 4.01Å; L34-F38 WeakPolarHBondContact O-CD2 3.2Å; L34-F38 PolarHBondContact O-N 3.01Å
35	H	91.5	Very high	90.8	Very high	106 Å²	106	69 Å²	69	49%	0.491	36%	0.362	S	S	.	.	H	α-helix	trans	-55.7	-47.7	174.2	178.4	77.8	0	0	0	111.5	S31 Y33 G39	S31-H35 WeakPolarHBondContact O-CB 3.46Å; S31-H35 PolarHBondContact O-N 3.07Å; Y33-H35 VanDerWaalsContact C-N 3.34Å; Y33-H35 PolarHBondContact O-N 3.02Å; H35-G39 PolarHBondContact O-N 3.02Å
36	K	92.8	Very high	90.4	Very high	43 Å²	43	66.2 Å²	66.2	19%	0.187	35%	0.35	C	S	.	.	H	α-helix	trans	-67.7	-42	177.5	-68.7	-179.7	-64.2	-178.3	0	112.2	G32 Y33 L34 G39 M40 W86 P91 P403	G32-K36 VanDerWaalsContact O-CE 3.25Å; G32-K36 WeakPolarHBondContact O-CE 3.49Å; G32-K36 WeakPolarHBondContact O-CG 3.38Å; G32-K36 PolarHBondContact O-N 2.86Å; Y33-K36 PolarHBondContact O-N 3.23Å; Y33-K36 VanDerWaalsContact O-N 3.16Å; L34-K36 VanDerWaalsContact C-N 3.32Å; L34-K36 PolarHBondContact O-N 2.97Å; K36-G39 PolarHBondContact O-N 3.04Å; K36-M40 WeakPolarHBondContact O-CB 3.25Å; K36-M40 WeakPolarHBondContact O-CG 3.43Å; K36-M40 PolarHBondContact O-N 3.36Å; K36-W86 HydrophobicContact CB-CH2 3.9Å; K36-W86 HydrophobicContact CB-CZ2 4.5Å; K36-P91 HydrophobicContact CB-CG 4.32Å; K36-P91 HydrophobicContact CD-CG 3.91Å; K36-P403 HydrophobicContact CB-CG 4.16Å; K36-P403 HydrophobicContact CG-CB 4.34Å; K36-P403 HydrophobicContact CG-CG 3.97Å
37	W	91.2	Very high	90	Very high	64 Å²	64	65.6 Å²	65.6	24%	0.242	36%	0.357	C	S	.	.	H	α-helix	trans	-58.4	-50.9	178.9	-175.7	-96	0	0	0	112.3	Y33 L34 K41 T49 W86	Y33-W37 HydrophobicContact CE1-CB 4.36Å; Y33-W37 HydrophobicContact CE2-CE3 4.25Å; Y33-W37 AromaticContact CZ-CE3 3.74Å; Y33-W37 WeakPolarHBondContact O-CB 3.47Å; Y33-W37 PolarHBondContact O-N 3.29Å; Y33-W37 WeakPolarHBondContact OH-CZ3 3.35Å; L34-W37 PolarHBondContact O-N 3.02Å; W37-K41 PolarHBondContact O-N 3.2Å; W37-T49 HydrophobicContact CH2-CG2 3.8Å; W37-T49 HydrophobicContact CZ3-CG2 3.89Å; W37-W86 HydrophobicContact CB-CH2 4.39Å; W37-W86 HydrophobicContact CB-CZ2 4.38Å; W37-W86 HydrophobicContact CE3-CD2 4.04Å; W37-W86 AromaticContact CE3-CE2 3.72Å; W37-W86 HydrophobicContact CE3-CE3 4.39Å; W37-W86 HydrophobicContact CE3-CH2 4.16Å; W37-W86 AromaticContact CE3-CZ2 3.8Å; W37-W86 HydrophobicContact CE3-CZ2 3.8Å; W37-W86 HydrophobicContact CE3-CZ3 4.44Å; W37-W86 HydrophobicContact CZ3-CD2 4.06Å; W37-W86 HydrophobicContact CZ3-CG 4.18Å
38	F	91.3	Very high	89.4	Confident	128 Å²	128	66 Å²	66	56%	0.561	36%	0.363	S	S	*	.	H	α-helix	trans	-72.3	-38.7	177.9	-68.9	-61.5	0	0	0	112.3	L34 M40 K41	L34-F38 HydrophobicContact CB-CD2 4.26Å; L34-F38 HydrophobicContact CB-CE2 4.19Å; L34-F38 HydrophobicContact CD2-CE2 4.01Å; L34-F38 WeakPolarHBondContact O-CD2 3.2Å; L34-F38 PolarHBondContact O-N 3.01Å; F38-M40 VanDerWaalsContact C-N 3.28Å; F38-M40 PolarHBondContact O-N 3.44Å; F38-K41 VanDerWaalsContact O-CB 3.27Å; F38-K41 WeakPolarHBondContact O-CB 3.21Å; F38-K41 PolarHBondContact O-N 2.8Å; F38-K41 VanDerWaalsContact O-N 3.15Å
39	G	89.3	Confident	89.2	Confident	27 Å²	27	62.7 Å²	62.7	28%	0.278	35%	0.348	S	S	.	.	H	α-helix	trans	-60.9	-35.5	178.4	0	0	0	0	0	113.2	H35 K36	H35-G39 PolarHBondContact O-N 3.02Å; K36-G39 PolarHBondContact O-N 3.04Å
40	M	92.8	Very high	89	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	5.3	178.9	-63.9	-178.9	71.5	0	0	113.4	K36 F38 S42 I43 K84 W86 P91 V93 V402 P403 A406	K36-M40 WeakPolarHBondContact O-CB 3.25Å; K36-M40 WeakPolarHBondContact O-CG 3.43Å; K36-M40 PolarHBondContact O-N 3.36Å; F38-M40 VanDerWaalsContact C-N 3.28Å; F38-M40 PolarHBondContact O-N 3.44Å; M40-S42 VanDerWaalsContact C-N 3.29Å; M40-S42 PolarHBondContact O-N 2.76Å; M40-I43 HydrophobicContact CB-CD1 4.05Å; M40-I43 HydrophobicContact CE-CD1 3.98Å; M40-I43 HydrophobicContact CG-CD1 4.05Å; M40-I43 WeakPolarHBondContact O-CB 3.28Å; M40-I43 PolarHBondContact O-N 3.16Å; M40-I43 VanDerWaalsContact O-N 3.14Å; M40-K84 HydrophobicContact CB-CD 4.22Å; M40-K84 HydrophobicContact CE-CB 3.87Å; M40-K84 WeakPolarHBondContact O-CD 3.23Å; M40-K84 PolarHBondContact O-NZ 3.3Å; M40-W86 HydrophobicContact SD-CZ2 4.33Å; M40-P91 HydrophobicContact CE-CB 4.19Å; M40-P91 HydrophobicContact SD-CB 3.56Å; M40-P91 VanDerWaalsContact SD-CB 3.56Å; M40-P91 HydrophobicContact SD-CG 4.25Å; M40-V93 HydrophobicContact CE-CB 4.38Å; M40-V402 HydrophobicContact CE-CG1 4.49Å; M40-P403 VanDerWaalsContact CG-CD 3.43Å; M40-P403 HydrophobicContact CG-CG 3.86Å; M40-P403 HydrophobicContact SD-CG 4.36Å; M40-A406 HydrophobicContact SD-CB 4.06Å
41	K	89.8	Confident	88.5	Confident	157 Å²	157	61.7 Å²	61.7	68%	0.683	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-38.6	-173.8	-171.7	177.9	179	-176.8	0	112.9	W37 F38 I43 K84	W37-K41 PolarHBondContact O-N 3.2Å; F38-K41 VanDerWaalsContact O-CB 3.27Å; F38-K41 WeakPolarHBondContact O-CB 3.21Å; F38-K41 PolarHBondContact O-N 2.8Å; F38-K41 VanDerWaalsContact O-N 3.15Å; K41-I43 VanDerWaalsContact C-N 3.31Å; K41-I43 PolarHBondContact O-N 2.84Å; K41-K84 PolarHBondContact O-NZ 2.89Å; K41-K84 VanDerWaalsContact O-NZ 3.16Å
42	S	91.8	Very high	88.1	Confident	79 Å²	79	67 Å²	67	55%	0.552	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-21	-179.1	55.5	0	0	0	0	114.4	M40 F400	M40-S42 VanDerWaalsContact C-N 3.29Å; M40-S42 PolarHBondContact O-N 2.76Å; S42-F400 VanDerWaalsContact O-CE1 3.25Å; S42-F400 WeakPolarHBondContact O-CE1 3.38Å
43	I	94.2	Very high	87.9	Confident	3 Å²	3	69.4 Å²	69.4	2%	0.015	36%	0.361	C	S	.	.	S	Bend	trans	-70.1	132.2	179.9	-63.5	169.4	0	0	0	109.6	M40 K41 L82 K84 F400 V402	M40-I43 HydrophobicContact CB-CD1 4.05Å; M40-I43 HydrophobicContact CE-CD1 3.98Å; M40-I43 HydrophobicContact CG-CD1 4.05Å; M40-I43 WeakPolarHBondContact O-CB 3.28Å; M40-I43 PolarHBondContact O-N 3.16Å; M40-I43 VanDerWaalsContact O-N 3.14Å; K41-I43 VanDerWaalsContact C-N 3.31Å; K41-I43 PolarHBondContact O-N 2.84Å; I43-L82 HydrophobicContact CB-CD1 4.3Å; I43-L82 HydrophobicContact CD1-CD1 4.27Å; I43-L82 HydrophobicContact CG1-CD1 4.08Å; I43-L82 HydrophobicContact CG2-CD1 3.34Å; I43-K84 HydrophobicContact CB-CB 4.4Å; I43-K84 HydrophobicContact CB-CD 4.11Å; I43-K84 HydrophobicContact CB-CG 4.44Å; I43-K84 HydrophobicContact CG2-CB 3.73Å; I43-K84 HydrophobicContact CG2-CD 4.29Å; I43-K84 HydrophobicContact CG2-CG 4.07Å; I43-K84 WeakPolarHBondContact O-CE 3.46Å; I43-K84 PolarHBondContact O-NZ 2.85Å; I43-K84 VanDerWaalsContact O-NZ 3.1Å; I43-F400 HydrophobicContact CB-CD1 4.45Å; I43-F400 HydrophobicContact CD1-CB 4.42Å; I43-F400 HydrophobicContact CG1-CB 3.81Å; I43-F400 HydrophobicContact CG1-CD1 3.87Å; I43-F400 HydrophobicContact CG1-CG 4.02Å; I43-V402 HydrophobicContact CD1-CG2 3.97Å
44	P	93.5	Very high	87.8	Confident	40 Å²	40	68.5 Å²	68.5	26%	0.26	36%	0.357	S	S	.	.			trans	-54.8	143.4	173.5	-24.6	34.2	0	0	0	111.7	F77 A80 F83 K84 F400	P44-F77 HydrophobicContact CB-CD1 4Å; P44-F77 HydrophobicContact CB-CE1 3.81Å; P44-A80 HydrophobicContact CG-CB 4.21Å; P44-F83 HydrophobicContact CB-CB 4.43Å; P44-F83 CarbonylContact O-C 3.47Å; P44-F83 WeakPolarHBondContact O-CA 3.44Å; P44-F83 WeakPolarHBondContact O-CB 3.49Å; P44-K84 PolarHBondContact O-N 3.31Å; P44-F400 HydrophobicContact CG-CZ 4.36Å
45	G	90.8	Very high	87.6	Confident	23 Å²	23	65.5 Å²	65.5	24%	0.237	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-143.6	168.7	178.7	0	0	0	0	0	111.4	G47 F77	G45-G47 PolarHBondContact O-N 2.97Å; G45-F77 VanDerWaalsContact C-CZ 3.49Å; G45-F77 VanDerWaalsContact O-CZ 3.23Å; G45-F77 WeakPolarHBondContact O-CZ 2.98Å
46	T	83.3	Confident	87.4	Confident	36 Å²	36	60.7 Å²	60.7	22%	0.221	32%	0.321	C	S	.	.	S	Bend	trans	-69.7	10.6	-171.1	52.5	0	0	0	0	115.3	F73 F77 F83 I85	T46-F73 HydrophobicContact CG2-CD1 4.12Å; T46-F73 HydrophobicContact CG2-CD2 4.35Å; T46-F73 HydrophobicContact CG2-CE1 4.14Å; T46-F73 HydrophobicContact CG2-CE2 4.37Å; T46-F73 HydrophobicContact CG2-CG 4.23Å; T46-F73 HydrophobicContact CG2-CZ 4.26Å; T46-F77 HydrophobicContact CG2-CE2 4.04Å; T46-F83 HydrophobicContact CG2-CD2 4.35Å; T46-F83 HydrophobicContact CG2-CE2 4.28Å; T46-I85 HydrophobicContact CG2-CG1 4.49Å
47	G	81.1	Confident	87.1	Confident	57 Å²	57	64.2 Å²	64.2	59%	0.588	34%	0.341	S	S	*	.	S	Bend	trans	126.3	-135.5	178.5	0	0	0	0	0	112.7	G45 T49	G45-G47 PolarHBondContact O-N 2.97Å; G47-T49 PolarHBondContact O-N 3.31Å
48	F	79.1	Confident	86.8	Confident	158 Å²	158	64.1 Å²	64.1	69%	0.693	34%	0.344	S	S	*	.			trans	-79.6	110.7	177.8	-174	-92.9	0	0	0	110.9	Y50	F48-Y50 HydrophobicContact CD1-CD1 4.37Å; F48-Y50 HydrophobicContact CD1-CE1 4.17Å; F48-Y50 HydrophobicContact CD1-CE2 4.37Å; F48-Y50 AromaticContact CE1-CD1 3.8Å; F48-Y50 HydrophobicContact CE1-CD1 3.8Å; F48-Y50 AromaticContact CE1-CE1 3.77Å; F48-Y50 HydrophobicContact CE1-CE1 3.77Å; F48-Y50 HydrophobicContact CE1-CG 4.3Å
49	T	84.2	Confident	86.6	Confident	18 Å²	18	58.9 Å²	58.9	11%	0.11	32%	0.321	C	S	.	.			trans	-93.6	125.6	176.7	-56.2	0	0	0	0	110.5	W37 G47 D55 W86	W37-T49 HydrophobicContact CH2-CG2 3.8Å; W37-T49 HydrophobicContact CZ3-CG2 3.89Å; G47-T49 PolarHBondContact O-N 3.31Å; T49-D55 PolarHBondContact OG1-OD1 2.91Å; T49-D55 VanDerWaalsContact OG1-OD1 3.07Å; T49-W86 HydrophobicContact CG2-CB 3.69Å; T49-W86 HydrophobicContact CG2-CG 3.94Å
50	Y	84.4	Confident	86.4	Confident	127 Å²	127	63 Å²	63	50%	0.498	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-74	137.7	176.2	-65.8	-86	0	0	0	110.9	F48 F52 G54	F48-Y50 HydrophobicContact CD1-CD1 4.37Å; F48-Y50 HydrophobicContact CD1-CE1 4.17Å; F48-Y50 HydrophobicContact CD1-CE2 4.37Å; F48-Y50 AromaticContact CE1-CD1 3.8Å; F48-Y50 HydrophobicContact CE1-CD1 3.8Å; F48-Y50 AromaticContact CE1-CE1 3.77Å; F48-Y50 HydrophobicContact CE1-CE1 3.77Å; F48-Y50 HydrophobicContact CE1-CG 4.3Å; Y50-F52 PolarHBondContact O-N 2.9Å; Y50-G54 PolarHBondContact N-O 3.43Å; Y50-G54 WeakPolarHBondContact O-CA 3.31Å; Y50-G54 PolarHBondContact O-N 3.25Å
51	P	77.9	Confident	85.7	Confident	61 Å²	61	66.7 Å²	66.7	40%	0.396	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-40.2	-175.1	-28.6	35.3	0	0	0	115.6	Y33	Y33-P51 VanDerWaalsContact CZ-O 3.25Å; Y33-P51 WeakPolarHBondContact OH-CA 3.48Å; Y33-P51 PolarHBondContact OH-O 3.18Å
52	F	79.9	Confident	85.2	Confident	161 Å²	161	63.6 Å²	63.6	71%	0.706	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-27	-174.7	-62.9	-70.7	0	0	0	114.4	Y50 G88	Y50-F52 PolarHBondContact O-N 2.9Å; F52-G88 CarbonylContact O-C 3.45Å; F52-G88 VanDerWaalsContact O-CA 3.23Å; F52-G88 WeakPolarHBondContact O-CA 3.43Å
53	I	85	Confident	84.3	Confident	82 Å²	82	60.5 Å²	60.5	42%	0.421	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-24.7	-179.6	-61.6	174	0	0	0	110.1	A56 L57 G88	I53-A56 HydrophobicContact CG2-CB 4.12Å; I53-A56 WeakPolarHBondContact O-CB 3.36Å; I53-A56 PolarHBondContact O-N 2.75Å; I53-L57 HydrophobicContact CD1-CD1 4.47Å; I53-L57 HydrophobicContact CG2-CD1 3.95Å; I53-L57 HydrophobicContact CG2-CG 3.74Å; I53-G88 WeakPolarHBondContact O-CA 3.28Å; I53-G88 PolarHBondContact O-N 2.8Å
54	G	88.2	Confident	83.3	Confident	2 Å²	2	61 Å²	61	2%	0.021	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	64.4	-134.2	-171.7	0	0	0	0	0	110.6	Y50	Y50-G54 PolarHBondContact N-O 3.43Å; Y50-G54 WeakPolarHBondContact O-CA 3.31Å; Y50-G54 PolarHBondContact O-N 3.25Å
55	D	88.6	Confident	82.6	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.016	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	4.9	177.4	-57.5	-51.1	0	0	0	111.2	T49 L57 M58 I85 W86	T49-D55 PolarHBondContact OG1-OD1 2.91Å; T49-D55 VanDerWaalsContact OG1-OD1 3.07Å; D55-L57 PolarHBondContact O-N 3.37Å; D55-M58 HydrophobicContact CB-CE 3.4Å; D55-M58 VanDerWaalsContact CB-CE 3.4Å; D55-M58 HydrophobicContact CB-CG 4.45Å; D55-M58 HydrophobicContact CB-SD 3.8Å; D55-M58 WeakPolarHBondContact O-CG 3.44Å; D55-M58 PolarHBondContact O-N 3.34Å; D55-I85 HydrophobicContact CB-CG2 4.09Å; D55-I85 WeakPolarHBondContact OD2-CA 3.42Å; D55-W86 WeakPolarHBondContact CA-O 3.44Å; D55-W86 WeakPolarHBondContact CB-O 3.35Å; D55-W86 PolarHBondContact N-O 2.74Å; D55-W86 PolarHBondContact OD2-N 2.7Å
56	A	87.3	Confident	82.3	Confident	6 Å²	6	63.3 Å²	63.3	5%	0.05	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-54.1	-35.2	-169.6	0	0	0	0	0	114.7	I53 M58 F59 V87 P230	I53-A56 HydrophobicContact CG2-CB 4.12Å; I53-A56 WeakPolarHBondContact O-CB 3.36Å; I53-A56 PolarHBondContact O-N 2.75Å; A56-M58 PolarHBondContact O-N 3.02Å; A56-F59 PolarHBondContact O-N 2.98Å; A56-V87 HydrophobicContact CB-CG1 4.13Å; A56-P230 HydrophobicContact CB-CB 4.01Å; A56-P230 HydrophobicContact CB-CG 4.02Å
57	L	85.3	Confident	82.3	Confident	117 Å²	117	61.9 Å²	61.9	61%	0.613	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-70.4	-15.6	-178.4	-65.7	171.4	0	0	0	113.7	I53 D55 W231	I53-L57 HydrophobicContact CD1-CD1 4.47Å; I53-L57 HydrophobicContact CG2-CD1 3.95Å; I53-L57 HydrophobicContact CG2-CG 3.74Å; D55-L57 PolarHBondContact O-N 3.37Å; L57-W231 HydrophobicContact CD2-CZ3 4.04Å
58	M	86.1	Confident	82.4	Confident	61 Å²	61	61.2 Å²	61.2	30%	0.3	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-81.7	-19.8	179.4	84.1	-170.6	42	0	0	112.6	D55 A56 K60 Q69 F73	D55-M58 HydrophobicContact CB-CE 3.4Å; D55-M58 VanDerWaalsContact CB-CE 3.4Å; D55-M58 HydrophobicContact CB-CG 4.45Å; D55-M58 HydrophobicContact CB-SD 3.8Å; D55-M58 WeakPolarHBondContact O-CG 3.44Å; D55-M58 PolarHBondContact O-N 3.34Å; A56-M58 PolarHBondContact O-N 3.02Å; M58-K60 PolarHBondContact O-N 3.26Å; M58-Q69 PolarHBondContact O-NE2 3.19Å; M58-Q69 PolarHBondContact O-OE1 3.43Å; M58-F73 HydrophobicContact CG-CZ 4.27Å; M58-F73 HydrophobicContact SD-CE2 4.2Å; M58-F73 HydrophobicContact SD-CZ 3.7Å
59	F	86	Confident	82.9	Confident	18 Å²	18	55.4 Å²	55.4	8%	0.079	29%	0.292	C	S	.	.			trans	-71.1	130.4	-173.4	-70.3	-61.9	0	0	0	112.7	A56 F66 I70 F73 I85 V87	A56-F59 PolarHBondContact O-N 2.98Å; F59-F66 HydrophobicContact CB-CD2 4.19Å; F59-F66 HydrophobicContact CB-CE2 4.07Å; F59-F66 AromaticContact CD1-CD2 3.96Å; F59-F66 HydrophobicContact CD1-CD2 3.96Å; F59-F66 AromaticContact CD1-CE2 3.42Å; F59-F66 HydrophobicContact CD1-CE2 3.42Å; F59-F66 VanDerWaalsContact CD1-CE2 3.42Å; F59-F66 HydrophobicContact CD1-CZ 4.39Å; F59-F66 HydrophobicContact CE1-CE2 4.14Å; F59-F66 HydrophobicContact CG-CD2 4.41Å; F59-F66 AromaticContact CG-CE2 3.88Å; F59-F66 HydrophobicContact CG-CE2 3.88Å; F59-I70 HydrophobicContact CE1-CD1 3.88Å; F59-F73 HydrophobicContact CE1-CE2 4.22Å; F59-I85 HydrophobicContact CE2-CG2 4.03Å; F59-I85 HydrophobicContact CZ-CD1 4.18Å; F59-I85 HydrophobicContact CZ-CG2 3.59Å; F59-V87 HydrophobicContact CE2-CG2 3.81Å; F59-V87 HydrophobicContact CZ-CG2 4.47Å
60	K	85.8	Confident	83.1	Confident	115 Å²	115	55.3 Å²	55.3	50%	0.5	29%	0.291	S	S	.	.			trans	-71.2	144.1	170.5	-57.1	-61.3	-175.9	178.6	0	109.9	M58 D65 F66 Q69	M58-K60 PolarHBondContact O-N 3.26Å; K60-D65 HydrophobicContact CB-CB 3.82Å; K60-D65 HydrophobicContact CG-CB 4.04Å; K60-F66 HydrophobicContact CB-CB 4.48Å; K60-F66 WeakPolarHBondContact O-CB 3.25Å; K60-F66 WeakPolarHBondContact O-CD2 3.37Å; K60-Q69 VanDerWaalsContact N-OE1 3.1Å
61	T	77.7	Confident	83.2	Confident	77 Å²	77	50.4 Å²	50.4	47%	0.472	27%	0.274	S	S	.	.	S	Bend	trans	-89	-30.8	-179.5	52.4	0	0	0	0	112.5	T229 W231	T61-T229 HydrophobicContact CG2-CG2 4.23Å; T61-W231 HydrophobicContact CG2-CZ2 4.09Å
62	N	79.3	Confident	83.9	Confident	91 Å²	91	48.9 Å²	48.9	49%	0.487	27%	0.269	S	S	.	.	S	Bend	trans	-65.4	133.5	173.5	-178	-73.5	0	0	0	110.2	G64 D65 F66	N62-G64 PolarHBondContact O-N 3.15Å; N62-G64 PolarHBondContact OD1-N 3.01Å; N62-D65 HydrophobicContact CB-CB 4.19Å; N62-D65 PolarHBondContact O-N 3.18Å; N62-D65 PolarHBondContact OD1-N 3.07Å; N62-F66 WeakPolarHBondContact O-CB 3.39Å; N62-F66 PolarHBondContact O-N 3.33Å
63	A	73	Confident	84.4	Confident	15 Å²	15	42.5 Å²	42.5	12%	0.124	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-40.1	-173.5	0	0	0	0	0	113.6	F67 I491 D493	A63-F67 WeakPolarHBondContact O-CB 3.14Å; A63-F67 PolarHBondContact O-N 2.87Å; A63-F67 VanDerWaalsContact O-N 3.07Å; A63-I491 HydrophobicContact CB-CG2 3.36Å; A63-D493 HydrophobicContact CB-CB 4.34Å
64	G	72.3	Confident	84.8	Confident	14 Å²	14	38.7 Å²	38.7	14%	0.144	22%	0.221	C	C	.	.	H	α-helix	trans	-69.3	-48.1	178.3	0	0	0	0	0	111.6	N62 F66 F67 G68	N62-G64 PolarHBondContact O-N 3.15Å; N62-G64 PolarHBondContact OD1-N 3.01Å; G64-F66 VanDerWaalsContact C-N 3.33Å; G64-F66 PolarHBondContact O-N 3.31Å; G64-F67 PolarHBondContact O-N 3.36Å; G64-G68 PolarHBondContact O-N 2.97Å
65	D	80.4	Confident	84.9	Confident	84 Å²	84	43.2 Å²	43.2	45%	0.449	24%	0.242	S	C	.	.	H	α-helix	trans	-64.8	-38.2	178.4	-64.5	-25.2	0	0	0	112.1	K60 N62 G68 Q69	K60-D65 HydrophobicContact CB-CB 3.82Å; K60-D65 HydrophobicContact CG-CB 4.04Å; N62-D65 HydrophobicContact CB-CB 4.19Å; N62-D65 PolarHBondContact O-N 3.18Å; N62-D65 PolarHBondContact OD1-N 3.07Å; D65-G68 PolarHBondContact O-N 3.32Å; D65-Q69 VanDerWaalsContact O-CB 3.26Å; D65-Q69 WeakPolarHBondContact O-CB 3.31Å; D65-Q69 PolarHBondContact O-N 3.33Å
66	F	83.6	Confident	85.1	Confident	26 Å²	26	48.9 Å²	48.9	11%	0.114	27%	0.273	C	S	.	.	H	α-helix	trans	-61.5	-47.9	174.9	177.7	-95.2	0	0	0	110.8	F59 K60 N62 G64 Q69 I70 R228 F386	F59-F66 HydrophobicContact CB-CD2 4.19Å; F59-F66 HydrophobicContact CB-CE2 4.07Å; F59-F66 AromaticContact CD1-CD2 3.96Å; F59-F66 HydrophobicContact CD1-CD2 3.96Å; F59-F66 AromaticContact CD1-CE2 3.42Å; F59-F66 HydrophobicContact CD1-CE2 3.42Å; F59-F66 VanDerWaalsContact CD1-CE2 3.42Å; F59-F66 HydrophobicContact CD1-CZ 4.39Å; F59-F66 HydrophobicContact CE1-CE2 4.14Å; F59-F66 HydrophobicContact CG-CD2 4.41Å; F59-F66 AromaticContact CG-CE2 3.88Å; F59-F66 HydrophobicContact CG-CE2 3.88Å; K60-F66 HydrophobicContact CB-CB 4.48Å; K60-F66 WeakPolarHBondContact O-CB 3.25Å; K60-F66 WeakPolarHBondContact O-CD2 3.37Å; N62-F66 WeakPolarHBondContact O-CB 3.39Å; N62-F66 PolarHBondContact O-N 3.33Å; G64-F66 VanDerWaalsContact C-N 3.33Å; G64-F66 PolarHBondContact O-N 3.31Å; F66-Q69 WeakPolarHBondContact O-CB 3.4Å; F66-Q69 PolarHBondContact O-N 3.2Å; F66-I70 HydrophobicContact CD1-CG1 4.3Å; F66-I70 HydrophobicContact CE1-CD1 4.5Å; F66-I70 HydrophobicContact CE1-CG1 3.89Å; F66-I70 HydrophobicContact CE2-CD1 4.49Å; F66-I70 HydrophobicContact CZ-CD1 4.13Å; F66-I70 HydrophobicContact CZ-CG1 4.02Å; F66-I70 WeakPolarHBondContact O-CG1 3.34Å; F66-I70 PolarHBondContact O-N 2.88Å; F66-R228 HydrophobicContact CD1-CG 3.85Å; F66-R228 HydrophobicContact CD2-CB 4.5Å; F66-R228 HydrophobicContact CD2-CG 4.35Å; F66-R228 HydrophobicContact CE1-CG 3.94Å; F66-R228 HydrophobicContact CE2-CG 4.42Å; F66-R228 HydrophobicContact CG-CG 4.07Å; F66-R228 HydrophobicContact CZ-CG 4.23Å; F66-F386 HydrophobicContact CE1-CZ 4.32Å
67	F	83	Confident	85.3	Confident	7 Å²	7	50.3 Å²	50.3	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-46.3	178.2	-178.2	-113.6	0	0	0	112	A63 G64 Q69 I70 V71 P385 F386 Y413 P490 G492	A63-F67 WeakPolarHBondContact O-CB 3.14Å; A63-F67 PolarHBondContact O-N 2.87Å; A63-F67 VanDerWaalsContact O-N 3.07Å; G64-F67 PolarHBondContact O-N 3.36Å; F67-Q69 PolarHBondContact O-N 2.99Å; F67-I70 PolarHBondContact O-N 2.64Å; F67-I70 VanDerWaalsContact O-N 3.14Å; F67-V71 HydrophobicContact CD1-CG2 4.39Å; F67-V71 HydrophobicContact CD2-CG2 4.4Å; F67-V71 HydrophobicContact CE1-CG2 3.93Å; F67-V71 HydrophobicContact CE2-CG2 3.93Å; F67-V71 HydrophobicContact CZ-CG2 3.69Å; F67-V71 WeakPolarHBondContact O-CG2 3.42Å; F67-V71 PolarHBondContact O-N 3.48Å; F67-P385 HydrophobicContact CD2-CG 4.49Å; F67-P385 HydrophobicContact CE2-CB 3.63Å; F67-P385 HydrophobicContact CE2-CG 3.95Å; F67-P385 HydrophobicContact CZ-CB 3.9Å; F67-P385 HydrophobicContact CZ-CG 4.46Å; F67-F386 HydrophobicContact CD2-CD1 4.35Å; F67-F386 HydrophobicContact CD2-CE1 4.03Å; F67-F386 HydrophobicContact CE2-CD1 4.32Å; F67-F386 HydrophobicContact CE2-CE1 4.42Å; F67-Y413 HydrophobicContact CE1-CD2 4.29Å; F67-Y413 HydrophobicContact CE1-CE2 4.28Å; F67-Y413 HydrophobicContact CE1-CG 4.43Å; F67-Y413 HydrophobicContact CZ-CD1 4.02Å; F67-Y413 AromaticContact CZ-CD2 3.73Å; F67-Y413 HydrophobicContact CZ-CD2 3.73Å; F67-Y413 HydrophobicContact CZ-CE1 4.45Å; F67-Y413 HydrophobicContact CZ-CE2 4.18Å; F67-Y413 AromaticContact CZ-CG 3.64Å; F67-Y413 HydrophobicContact CZ-CG 3.64Å; F67-P490 HydrophobicContact CD1-CB 4.29Å; F67-P490 WeakPolarHBondContact CD1-O 3.27Å; F67-P490 HydrophobicContact CE1-CB 4Å; F67-G492 VanDerWaalsContact CG-CA 3.48Å
68	G	84.1	Confident	85.5	Confident	42 Å²	42	50.4 Å²	50.4	43%	0.433	27%	0.273	S	S	.	.	H	α-helix	trans	-57.3	-38.1	174.4	0	0	0	0	0	112.5	G64 D65 V71 G72	G64-G68 PolarHBondContact O-N 2.97Å; D65-G68 PolarHBondContact O-N 3.32Å; G68-V71 PolarHBondContact O-N 2.88Å; G68-G72 PolarHBondContact O-N 2.93Å
69	Q	89.3	Confident	85.6	Confident	36 Å²	36	54.7 Å²	54.7	17%	0.168	30%	0.297	C	S	.	.	H	α-helix	trans	-64.6	-45.8	174.3	175.9	177.1	49.5	0	0	112.4	M58 K60 D65 F66 F67 V71 G72 F73	M58-Q69 PolarHBondContact O-NE2 3.19Å; M58-Q69 PolarHBondContact O-OE1 3.43Å; K60-Q69 VanDerWaalsContact N-OE1 3.1Å; D65-Q69 VanDerWaalsContact O-CB 3.26Å; D65-Q69 WeakPolarHBondContact O-CB 3.31Å; D65-Q69 PolarHBondContact O-N 3.33Å; F66-Q69 WeakPolarHBondContact O-CB 3.4Å; F66-Q69 PolarHBondContact O-N 3.2Å; F67-Q69 PolarHBondContact O-N 2.99Å; Q69-V71 VanDerWaalsContact C-N 3.34Å; Q69-V71 PolarHBondContact O-N 3.36Å; Q69-G72 PolarHBondContact O-N 3.43Å; Q69-F73 HydrophobicContact CG-CD2 4.27Å; Q69-F73 HydrophobicContact CG-CE1 4.32Å; Q69-F73 HydrophobicContact CG-CE2 3.65Å; Q69-F73 HydrophobicContact CG-CZ 3.67Å; Q69-F73 WeakPolarHBondContact O-CG 3.3Å; Q69-F73 PolarHBondContact O-N 2.96Å
70	I	88.2	Confident	85.8	Confident	17 Å²	17	54.7 Å²	54.7	9%	0.087	30%	0.301	C	S	.	.	H	α-helix	trans	-61.4	-44.2	177.3	-65.2	-61	0	0	0	110.7	F59 F66 F67 F73 T74 I411	F59-I70 HydrophobicContact CE1-CD1 3.88Å; F66-I70 HydrophobicContact CD1-CG1 4.3Å; F66-I70 HydrophobicContact CE1-CD1 4.5Å; F66-I70 HydrophobicContact CE1-CG1 3.89Å; F66-I70 HydrophobicContact CE2-CD1 4.49Å; F66-I70 HydrophobicContact CZ-CD1 4.13Å; F66-I70 HydrophobicContact CZ-CG1 4.02Å; F66-I70 WeakPolarHBondContact O-CG1 3.34Å; F66-I70 PolarHBondContact O-N 2.88Å; F67-I70 PolarHBondContact O-N 2.64Å; F67-I70 VanDerWaalsContact O-N 3.14Å; I70-F73 HydrophobicContact CD1-CD2 4.44Å; I70-F73 PolarHBondContact O-N 3.35Å; I70-T74 PolarHBondContact O-N 3.22Å; I70-I411 HydrophobicContact CG2-CD1 3.76Å; I70-I411 HydrophobicContact CG2-CG1 4.41Å
71	V	87	Confident	85.9	Confident	24 Å²	24	50.8 Å²	50.8	15%	0.145	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-43	175.5	175.2	0	0	0	0	110.7	F67 G68 Q69 F73 T74 Q75 Y413	F67-V71 HydrophobicContact CD1-CG2 4.39Å; F67-V71 HydrophobicContact CD2-CG2 4.4Å; F67-V71 HydrophobicContact CE1-CG2 3.93Å; F67-V71 HydrophobicContact CE2-CG2 3.93Å; F67-V71 HydrophobicContact CZ-CG2 3.69Å; F67-V71 WeakPolarHBondContact O-CG2 3.42Å; F67-V71 PolarHBondContact O-N 3.48Å; G68-V71 PolarHBondContact O-N 2.88Å; Q69-V71 VanDerWaalsContact C-N 3.34Å; Q69-V71 PolarHBondContact O-N 3.36Å; V71-F73 VanDerWaalsContact C-N 3.35Å; V71-F73 PolarHBondContact O-N 2.9Å; V71-T74 PolarHBondContact O-N 3.41Å; V71-T74 PolarHBondContact O-OG1 2.87Å; V71-Q75 PolarHBondContact O-N 3.28Å; V71-Q75 VanDerWaalsContact O-N 3.16Å; V71-Y413 HydrophobicContact CG1-CD1 4.31Å; V71-Y413 HydrophobicContact CG1-CE1 4.14Å; V71-Y413 HydrophobicContact CG2-CD1 3.72Å; V71-Y413 HydrophobicContact CG2-CE1 4.03Å
72	G	90.8	Very high	86.7	Confident	28 Å²	28	47.1 Å²	47.1	29%	0.289	26%	0.264	S	S	.	.	H	α-helix	trans	-55.1	-46.8	175.3	0	0	0	0	0	112.4	G68 Q69 T74 Q75 D76	G68-G72 PolarHBondContact O-N 2.93Å; Q69-G72 PolarHBondContact O-N 3.43Å; G72-T74 VanDerWaalsContact C-N 3.3Å; G72-T74 PolarHBondContact O-N 3.18Å; G72-Q75 WeakPolarHBondContact O-CA 3.39Å; G72-Q75 WeakPolarHBondContact O-CB 3.35Å; G72-Q75 PolarHBondContact O-N 2.94Å; G72-D76 PolarHBondContact O-N 2.82Å
73	F	92.4	Very high	87.5	Confident	28 Å²	28	42.8 Å²	42.8	12%	0.123	24%	0.241	C	C	.	.	H	α-helix	trans	-59.2	-40.1	174.4	-65	-32.3	0	0	0	112.5	T46 M58 F59 Q69 I70 V71 Q75 D76 F77 F83 I85	T46-F73 HydrophobicContact CG2-CD1 4.12Å; T46-F73 HydrophobicContact CG2-CD2 4.35Å; T46-F73 HydrophobicContact CG2-CE1 4.14Å; T46-F73 HydrophobicContact CG2-CE2 4.37Å; T46-F73 HydrophobicContact CG2-CG 4.23Å; T46-F73 HydrophobicContact CG2-CZ 4.26Å; M58-F73 HydrophobicContact CG-CZ 4.27Å; M58-F73 HydrophobicContact SD-CE2 4.2Å; M58-F73 HydrophobicContact SD-CZ 3.7Å; F59-F73 HydrophobicContact CE1-CE2 4.22Å; Q69-F73 HydrophobicContact CG-CD2 4.27Å; Q69-F73 HydrophobicContact CG-CE1 4.32Å; Q69-F73 HydrophobicContact CG-CE2 3.65Å; Q69-F73 HydrophobicContact CG-CZ 3.67Å; Q69-F73 WeakPolarHBondContact O-CG 3.3Å; Q69-F73 PolarHBondContact O-N 2.96Å; I70-F73 HydrophobicContact CD1-CD2 4.44Å; I70-F73 PolarHBondContact O-N 3.35Å; V71-F73 VanDerWaalsContact C-N 3.35Å; V71-F73 PolarHBondContact O-N 2.9Å; F73-Q75 PolarHBondContact O-N 2.96Å; F73-D76 PolarHBondContact O-N 2.97Å; F73-F77 VanDerWaalsContact O-CD2 3.28Å; F73-F77 WeakPolarHBondContact O-CD2 3.37Å; F73-F77 PolarHBondContact O-N 3.11Å; F73-F83 HydrophobicContact CB-CE1 4.47Å; F73-F83 HydrophobicContact CB-CE2 4.01Å; F73-F83 HydrophobicContact CB-CZ 3.66Å; F73-I85 HydrophobicContact CD2-CD1 4.43Å
74	T	92	Very high	88.5	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-64.6	-26.6	176.8	66.6	0	0	0	0	113.2	I70 V71 G72 K78 F83 F96 I411 T414	I70-T74 PolarHBondContact O-N 3.22Å; V71-T74 PolarHBondContact O-N 3.41Å; V71-T74 PolarHBondContact O-OG1 2.87Å; G72-T74 VanDerWaalsContact C-N 3.3Å; G72-T74 PolarHBondContact O-N 3.18Å; T74-K78 PolarHBondContact O-N 3.37Å; T74-F83 HydrophobicContact CG2-CE1 4.28Å; T74-F96 HydrophobicContact CG2-CD1 4.05Å; T74-F96 HydrophobicContact CG2-CG 4.33Å; T74-I411 HydrophobicContact CG2-CB 4.39Å; T74-I411 HydrophobicContact CG2-CG1 4.12Å; T74-I411 HydrophobicContact CG2-CG2 4.33Å; T74-T414 HydrophobicContact CG2-CG2 4.41Å; T74-T414 WeakPolarHBondContact OG1-CG2 3.42Å; T74-T414 PolarHBondContact OG1-OG1 2.65Å
75	Q	91	Very high	89.6	Confident	97 Å²	97	43 Å²	43	45%	0.453	24%	0.235	S	C	.	.	H	α-helix	trans	-77.3	-41.1	173.9	-63.9	-61	-20.9	0	0	112.1	V71 G72 F73 F77 K78	V71-Q75 PolarHBondContact O-N 3.28Å; V71-Q75 VanDerWaalsContact O-N 3.16Å; G72-Q75 WeakPolarHBondContact O-CA 3.39Å; G72-Q75 WeakPolarHBondContact O-CB 3.35Å; G72-Q75 PolarHBondContact O-N 2.94Å; F73-Q75 PolarHBondContact O-N 2.96Å; Q75-F77 PolarHBondContact O-N 3.28Å; Q75-K78 WeakPolarHBondContact O-CB 3.45Å; Q75-K78 WeakPolarHBondContact O-CG 3.4Å; Q75-K78 PolarHBondContact O-N 2.86Å
76	D	92.4	Very high	90.2	Very high	123 Å²	123	39.1 Å²	39.1	66%	0.658	22%	0.215	S	C	*	.	H	α-helix	trans	-61.3	-34.4	175.6	-64.8	-23.9	0	0	0	111.6	G72 F73	G72-D76 PolarHBondContact O-N 2.82Å; F73-D76 PolarHBondContact O-N 2.97Å
77	F	92.4	Very high	90.5	Very high	35 Å²	35	38.4 Å²	38.4	15%	0.154	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	18.7	178.9	-70.7	-82	0	0	0	113.9	P44 G45 T46 F73 Q75 D79 A80 F83 F96	P44-F77 HydrophobicContact CB-CD1 4Å; P44-F77 HydrophobicContact CB-CE1 3.81Å; G45-F77 VanDerWaalsContact C-CZ 3.49Å; G45-F77 VanDerWaalsContact O-CZ 3.23Å; G45-F77 WeakPolarHBondContact O-CZ 2.98Å; T46-F77 HydrophobicContact CG2-CE2 4.04Å; F73-F77 VanDerWaalsContact O-CD2 3.28Å; F73-F77 WeakPolarHBondContact O-CD2 3.37Å; F73-F77 PolarHBondContact O-N 3.11Å; Q75-F77 PolarHBondContact O-N 3.28Å; F77-D79 PolarHBondContact O-N 3.09Å; F77-D79 VanDerWaalsContact O-N 3.1Å; F77-A80 HydrophobicContact CB-CB 4.46Å; F77-A80 HydrophobicContact CD1-CB 4.37Å; F77-A80 PolarHBondContact O-N 3.44Å; F77-A80 VanDerWaalsContact O-O 3.05Å; F77-F83 HydrophobicContact CB-CB 4.31Å; F77-F83 HydrophobicContact CB-CD1 3.68Å; F77-F83 HydrophobicContact CB-CE1 4.3Å; F77-F83 HydrophobicContact CB-CG 4.21Å; F77-F83 HydrophobicContact CD1-CB 3.76Å; F77-F83 HydrophobicContact CD1-CG 4.31Å; F77-F83 HydrophobicContact CD2-CB 4.17Å; F77-F83 AromaticContact CD2-CD1 3.94Å; F77-F83 HydrophobicContact CD2-CD1 3.94Å; F77-F83 HydrophobicContact CD2-CD2 4.11Å; F77-F83 HydrophobicContact CD2-CE1 4.36Å; F77-F83 HydrophobicContact CD2-CE2 4.45Å; F77-F83 AromaticContact CD2-CG 3.84Å; F77-F83 HydrophobicContact CD2-CG 3.84Å; F77-F83 HydrophobicContact CE1-CB 4.14Å; F77-F83 HydrophobicContact CE2-CD2 4.32Å; F77-F83 HydrophobicContact CE2-CG 4.37Å; F77-F83 HydrophobicContact CG-CB 3.8Å; F77-F83 AromaticContact CG-CD1 3.82Å; F77-F83 HydrophobicContact CG-CD1 3.82Å; F77-F83 AromaticContact CG-CG 3.84Å; F77-F83 HydrophobicContact CG-CG 3.84Å; F77-F96 HydrophobicContact CB-CZ 4.39Å; F77-F96 WeakPolarHBondContact O-CZ 3.18Å
78	K	87.9	Confident	90.7	Very high	120 Å²	120	38.7 Å²	38.7	52%	0.522	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.1	-176.1	70.5	-176.3	-176	179.4	0	114.6	T74 Q75 A80	T74-K78 PolarHBondContact O-N 3.37Å; Q75-K78 WeakPolarHBondContact O-CB 3.45Å; Q75-K78 WeakPolarHBondContact O-CG 3.4Å; Q75-K78 PolarHBondContact O-N 2.86Å; K78-A80 VanDerWaalsContact C-N 3.33Å
79	D	87.8	Confident	90.9	Very high	151 Å²	151	40.7 Å²	40.7	81%	0.807	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-9	-178.9	-59.3	-45.4	0	0	0	112	F77	F77-D79 PolarHBondContact O-N 3.09Å; F77-D79 VanDerWaalsContact O-N 3.1Å
80	A	91.1	Very high	91	Very high	18 Å²	18	40.2 Å²	40.2	15%	0.149	22%	0.221	C	C	.	.	S	Bend	trans	-100.4	142.1	175.8	0	0	0	0	0	110.6	P44 F77 K78 L82 F96	P44-A80 HydrophobicContact CG-CB 4.21Å; F77-A80 HydrophobicContact CB-CB 4.46Å; F77-A80 HydrophobicContact CD1-CB 4.37Å; F77-A80 PolarHBondContact O-N 3.44Å; F77-A80 VanDerWaalsContact O-O 3.05Å; K78-A80 VanDerWaalsContact C-N 3.33Å; A80-L82 PolarHBondContact O-N 2.94Å; A80-F96 WeakPolarHBondContact O-CZ 3.35Å
81	P	88.5	Confident	91.2	Very high	32 Å²	32	39.4 Å²	39.4	21%	0.208	22%	0.217	C	C	.	.	S	Bend	trans	-70.6	-18.6	-177.5	28.2	-35.6	0	0	0	114.1	N100 N398 F400	P81-N100 PolarHBondContact O-ND2 3.11Å; P81-N398 HydrophobicContact CB-CB 3.65Å; P81-N398 VanDerWaalsContact CB-ND2 3.26Å; P81-N398 WeakPolarHBondContact CB-ND2 3.37Å; P81-N398 HydrophobicContact CG-CB 3.81Å; P81-F400 HydrophobicContact CG-CD2 4.14Å; P81-F400 HydrophobicContact CG-CE2 3.62Å
82	L	94.6	Very high	91.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.212	C	C	.	.			trans	-170.1	162	-179.5	59.7	98.4	0	0	0	109.2	I43 A80 V93 V94 L95 L397 F400	I43-L82 HydrophobicContact CB-CD1 4.3Å; I43-L82 HydrophobicContact CD1-CD1 4.27Å; I43-L82 HydrophobicContact CG1-CD1 4.08Å; I43-L82 HydrophobicContact CG2-CD1 3.34Å; A80-L82 PolarHBondContact O-N 2.94Å; L82-V93 HydrophobicContact CB-CG2 4.18Å; L82-V93 HydrophobicContact CD1-CG2 3.57Å; L82-V93 HydrophobicContact CG-CG2 4.32Å; L82-V94 WeakPolarHBondContact CA-O 3.38Å; L82-V94 WeakPolarHBondContact CB-O 3.42Å; L82-L95 HydrophobicContact CB-CD2 3.83Å; L82-L95 HydrophobicContact CD2-CD2 4.39Å; L82-L397 HydrophobicContact CD2-CB 3.42Å; L82-L397 VanDerWaalsContact CD2-CB 3.42Å; L82-L397 HydrophobicContact CD2-CD1 4.32Å; L82-F400 HydrophobicContact CD1-CB 4.48Å; L82-F400 HydrophobicContact CD1-CD2 4.27Å; L82-F400 HydrophobicContact CD1-CG 4.42Å; L82-F400 HydrophobicContact CD2-CB 4.46Å; L82-F400 HydrophobicContact CD2-CD2 4.06Å; L82-F400 HydrophobicContact CG-CD2 4.14Å
83	F	95.4	Very high	91.8	Very high	1 Å²	1	37.5 Å²	37.5	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	167	169	67.7	-85.1	0	0	0	111.1	P44 T46 F73 T74 F77 I85 V93 V94 F96	P44-F83 HydrophobicContact CB-CB 4.43Å; P44-F83 CarbonylContact O-C 3.47Å; P44-F83 WeakPolarHBondContact O-CA 3.44Å; P44-F83 WeakPolarHBondContact O-CB 3.49Å; T46-F83 HydrophobicContact CG2-CD2 4.35Å; T46-F83 HydrophobicContact CG2-CE2 4.28Å; F73-F83 HydrophobicContact CB-CE1 4.47Å; F73-F83 HydrophobicContact CB-CE2 4.01Å; F73-F83 HydrophobicContact CB-CZ 3.66Å; T74-F83 HydrophobicContact CG2-CE1 4.28Å; F77-F83 HydrophobicContact CB-CB 4.31Å; F77-F83 HydrophobicContact CB-CD1 3.68Å; F77-F83 HydrophobicContact CB-CE1 4.3Å; F77-F83 HydrophobicContact CB-CG 4.21Å; F77-F83 HydrophobicContact CD1-CB 3.76Å; F77-F83 HydrophobicContact CD1-CG 4.31Å; F77-F83 HydrophobicContact CD2-CB 4.17Å; F77-F83 AromaticContact CD2-CD1 3.94Å; F77-F83 HydrophobicContact CD2-CD1 3.94Å; F77-F83 HydrophobicContact CD2-CD2 4.11Å; F77-F83 HydrophobicContact CD2-CE1 4.36Å; F77-F83 HydrophobicContact CD2-CE2 4.45Å; F77-F83 AromaticContact CD2-CG 3.84Å; F77-F83 HydrophobicContact CD2-CG 3.84Å; F77-F83 HydrophobicContact CE1-CB 4.14Å; F77-F83 HydrophobicContact CE2-CD2 4.32Å; F77-F83 HydrophobicContact CE2-CG 4.37Å; F77-F83 HydrophobicContact CG-CB 3.8Å; F77-F83 AromaticContact CG-CD1 3.82Å; F77-F83 HydrophobicContact CG-CD1 3.82Å; F77-F83 AromaticContact CG-CG 3.84Å; F77-F83 HydrophobicContact CG-CG 3.84Å; F83-I85 HydrophobicContact CD2-CG1 4.04Å; F83-I85 HydrophobicContact CE2-CD1 3.71Å; F83-I85 HydrophobicContact CE2-CG1 3.68Å; F83-I85 HydrophobicContact CZ-CD1 4.46Å; F83-V93 CarbonylContact O-C 3.52Å; F83-V93 WeakPolarHBondContact O-CA 3.46Å; F83-V94 HydrophobicContact CD1-CB 3.98Å; F83-V94 HydrophobicContact CD1-CG1 4.39Å; F83-V94 HydrophobicContact CD2-CB 4.31Å; F83-V94 HydrophobicContact CD2-CG2 4.21Å; F83-V94 HydrophobicContact CE1-CB 3.56Å; F83-V94 HydrophobicContact CE1-CG1 3.55Å; F83-V94 HydrophobicContact CE1-CG2 4.21Å; F83-V94 HydrophobicContact CE2-CB 3.97Å; F83-V94 HydrophobicContact CE2-CG1 4.45Å; F83-V94 HydrophobicContact CE2-CG2 3.7Å; F83-V94 HydrophobicContact CG-CB 4.32Å; F83-V94 HydrophobicContact CZ-CB 3.55Å; F83-V94 HydrophobicContact CZ-CG1 3.59Å; F83-V94 HydrophobicContact CZ-CG2 3.68Å; F83-V94 PolarHBondContact N-O 2.91Å; F83-V94 PolarHBondContact O-N 3.15Å; F83-F96 AromaticContact CD1-CE1 3.67Å; F83-F96 HydrophobicContact CD1-CE1 3.67Å; F83-F96 HydrophobicContact CD1-CZ 4.39Å; F83-F96 HydrophobicContact CE1-CD1 4.28Å; F83-F96 AromaticContact CE1-CE1 3.74Å; F83-F96 HydrophobicContact CE1-CE1 3.74Å
84	K	94.9	Very high	92	Very high	28 Å²	28	36.3 Å²	36.3	12%	0.122	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	152.1	178	71.4	-174.6	168.6	-161	0	111.9	M40 K41 I43 P44 F92	M40-K84 HydrophobicContact CB-CD 4.22Å; M40-K84 HydrophobicContact CE-CB 3.87Å; M40-K84 WeakPolarHBondContact O-CD 3.23Å; M40-K84 PolarHBondContact O-NZ 3.3Å; K41-K84 PolarHBondContact O-NZ 2.89Å; K41-K84 VanDerWaalsContact O-NZ 3.16Å; I43-K84 HydrophobicContact CB-CB 4.4Å; I43-K84 HydrophobicContact CB-CD 4.11Å; I43-K84 HydrophobicContact CB-CG 4.44Å; I43-K84 HydrophobicContact CG2-CB 3.73Å; I43-K84 HydrophobicContact CG2-CD 4.29Å; I43-K84 HydrophobicContact CG2-CG 4.07Å; I43-K84 WeakPolarHBondContact O-CE 3.46Å; I43-K84 PolarHBondContact O-NZ 2.85Å; I43-K84 VanDerWaalsContact O-NZ 3.1Å; P44-K84 PolarHBondContact O-N 3.31Å; K84-F92 VanDerWaalsContact CA-O 3.26Å; K84-F92 WeakPolarHBondContact CA-O 3.44Å
85	I	94.3	Very high	92.2	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	139.6	170.4	-62.4	179.8	0	0	0	107.1	T46 D55 F59 F73 F83 V87 F92 V94	T46-I85 HydrophobicContact CG2-CG1 4.49Å; D55-I85 HydrophobicContact CB-CG2 4.09Å; D55-I85 WeakPolarHBondContact OD2-CA 3.42Å; F59-I85 HydrophobicContact CE2-CG2 4.03Å; F59-I85 HydrophobicContact CZ-CD1 4.18Å; F59-I85 HydrophobicContact CZ-CG2 3.59Å; F73-I85 HydrophobicContact CD2-CD1 4.43Å; F83-I85 HydrophobicContact CD2-CG1 4.04Å; F83-I85 HydrophobicContact CE2-CD1 3.71Å; F83-I85 HydrophobicContact CE2-CG1 3.68Å; F83-I85 HydrophobicContact CZ-CD1 4.46Å; I85-V87 HydrophobicContact CG2-CG2 4.12Å; I85-F92 HydrophobicContact CB-CB 4.42Å; I85-F92 PolarHBondContact N-O 2.98Å; I85-F92 WeakPolarHBondContact O-CA 3.21Å; I85-F92 WeakPolarHBondContact O-CB 3.44Å; I85-F92 PolarHBondContact O-N 3.12Å; I85-V94 HydrophobicContact CD1-CG2 3.85Å; I85-V94 HydrophobicContact CG1-CG2 4.14Å
86	W	92.9	Very high	92.4	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.015	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.3	167.8	-73.6	78.7	0	0	0	110.6	Y33 K36 W37 M40 T49 D55 P91	Y33-W86 HydrophobicContact CD2-CH2 4.37Å; Y33-W86 AromaticContact CD2-CZ3 3.85Å; Y33-W86 HydrophobicContact CD2-CZ3 3.85Å; Y33-W86 HydrophobicContact CE2-CE3 4.07Å; Y33-W86 HydrophobicContact CE2-CH2 4.12Å; Y33-W86 AromaticContact CE2-CZ3 3.52Å; Y33-W86 HydrophobicContact CE2-CZ3 3.52Å; K36-W86 HydrophobicContact CB-CH2 3.9Å; K36-W86 HydrophobicContact CB-CZ2 4.5Å; W37-W86 HydrophobicContact CB-CH2 4.39Å; W37-W86 HydrophobicContact CB-CZ2 4.38Å; W37-W86 HydrophobicContact CE3-CD2 4.04Å; W37-W86 AromaticContact CE3-CE2 3.72Å; W37-W86 HydrophobicContact CE3-CE3 4.39Å; W37-W86 HydrophobicContact CE3-CH2 4.16Å; W37-W86 AromaticContact CE3-CZ2 3.8Å; W37-W86 HydrophobicContact CE3-CZ2 3.8Å; W37-W86 HydrophobicContact CE3-CZ3 4.44Å; W37-W86 HydrophobicContact CZ3-CD2 4.06Å; W37-W86 HydrophobicContact CZ3-CG 4.18Å; M40-W86 HydrophobicContact SD-CZ2 4.33Å; T49-W86 HydrophobicContact CG2-CB 3.69Å; T49-W86 HydrophobicContact CG2-CG 3.94Å; D55-W86 WeakPolarHBondContact CA-O 3.44Å; D55-W86 WeakPolarHBondContact CB-O 3.35Å; D55-W86 PolarHBondContact N-O 2.74Å; D55-W86 PolarHBondContact OD2-N 2.7Å; W86-P91 HydrophobicContact CD2-CB 3.95Å; W86-P91 HydrophobicContact CE3-CB 3.94Å; W86-P91 HydrophobicContact CE3-CG 4.33Å; W86-P91 HydrophobicContact CH2-CB 3.66Å; W86-P91 HydrophobicContact CH2-CG 3.67Å; W86-P91 HydrophobicContact CZ2-CB 3.63Å; W86-P91 HydrophobicContact CZ2-CG 4.14Å; W86-P91 HydrophobicContact CZ3-CB 3.8Å; W86-P91 HydrophobicContact CZ3-CG 3.77Å
87	V	90.8	Very high	92.5	Very high	11 Å²	11	27.4 Å²	27.4	7%	0.067	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	101.5	170.2	-171.7	0	0	0	0	107.8	A56 F59 I85 I90 F92 P230 W233	A56-V87 HydrophobicContact CB-CG1 4.13Å; F59-V87 HydrophobicContact CE2-CG2 3.81Å; F59-V87 HydrophobicContact CZ-CG2 4.47Å; I85-V87 HydrophobicContact CG2-CG2 4.12Å; V87-I90 PolarHBondContact N-O 3.17Å; V87-I90 WeakPolarHBondContact O-CB 3.49Å; V87-I90 PolarHBondContact O-N 2.68Å; V87-I90 VanDerWaalsContact O-N 3.1Å; V87-F92 HydrophobicContact CB-CD2 4.35Å; V87-F92 HydrophobicContact CB-CE2 3.87Å; V87-F92 HydrophobicContact CG2-CD2 3.91Å; V87-F92 HydrophobicContact CG2-CE2 3.78Å; V87-P230 HydrophobicContact CG1-CB 3.55Å; V87-P230 HydrophobicContact CG1-CG 3.39Å; V87-W233 HydrophobicContact CB-CH2 3.73Å; V87-W233 HydrophobicContact CB-CZ3 3.94Å; V87-W233 HydrophobicContact CG1-CE3 4.38Å; V87-W233 HydrophobicContact CG1-CH2 3.42Å; V87-W233 VanDerWaalsContact CG1-CH2 3.42Å; V87-W233 HydrophobicContact CG1-CZ2 3.99Å; V87-W233 HydrophobicContact CG1-CZ3 3.63Å; V87-W233 HydrophobicContact CG2-CH2 4.36Å
88	G	87.4	Confident	92.6	Very high	13 Å²	13	25.8 Å²	25.8	13%	0.134	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	-129.9	-165.6	0	0	0	0	0	111.2	F52 I53 I90	F52-G88 CarbonylContact O-C 3.45Å; F52-G88 VanDerWaalsContact O-CA 3.23Å; F52-G88 WeakPolarHBondContact O-CA 3.43Å; I53-G88 WeakPolarHBondContact O-CA 3.28Å; I53-G88 PolarHBondContact O-N 2.8Å; G88-I90 PolarHBondContact O-N 3.49Å
89	P	87.5	Confident	92.9	Very high	83 Å²	83	22.8 Å²	22.8	54%	0.539	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	4.7	179	35	-35.8	0	0	0	114	Y33 P91	Y33-P89 HydrophobicContact CD2-CB 4.36Å; P89-P91 WeakPolarHBondContact O-CD 3.23Å
90	I	91.2	Very high	93.2	Very high	26 Å²	26	15.6 Å²	15.6	13%	0.133	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.2	-172.1	-59.1	170.6	0	0	0	109.3	V87 G88 F92 F115 W233 N407	V87-I90 PolarHBondContact N-O 3.17Å; V87-I90 WeakPolarHBondContact O-CB 3.49Å; V87-I90 PolarHBondContact O-N 2.68Å; V87-I90 VanDerWaalsContact O-N 3.1Å; G88-I90 PolarHBondContact O-N 3.49Å; I90-F92 HydrophobicContact CB-CE2 3.97Å; I90-F92 HydrophobicContact CB-CZ 4.47Å; I90-F92 HydrophobicContact CG2-CD2 4.24Å; I90-F92 HydrophobicContact CG2-CE1 4.46Å; I90-F92 HydrophobicContact CG2-CE2 3.45Å; I90-F92 VanDerWaalsContact CG2-CE2 3.45Å; I90-F92 HydrophobicContact CG2-CZ 3.6Å; I90-F92 WeakPolarHBondContact O-CD2 3.44Å; I90-F92 WeakPolarHBondContact O-CE2 3.42Å; I90-F115 HydrophobicContact CD1-CB 4.31Å; I90-F115 HydrophobicContact CD1-CD1 3.47Å; I90-F115 VanDerWaalsContact CD1-CD1 3.47Å; I90-F115 HydrophobicContact CD1-CD2 4.12Å; I90-F115 HydrophobicContact CD1-CE1 3.69Å; I90-F115 HydrophobicContact CD1-CE2 4.31Å; I90-F115 HydrophobicContact CD1-CG 3.7Å; I90-F115 HydrophobicContact CD1-CZ 4.12Å; I90-W233 HydrophobicContact CB-CZ3 4.47Å; I90-W233 HydrophobicContact CD1-CE3 3.88Å; I90-W233 HydrophobicContact CD1-CZ3 3.59Å; I90-N407 WeakPolarHBondContact CG2-ND2 3.39Å
91	P	93.7	Very high	93.4	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.006	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	139.6	176.1	22.4	-20.3	0	0	0	111.9	K36 M40 W86 P89 A406 N407	K36-P91 HydrophobicContact CB-CG 4.32Å; K36-P91 HydrophobicContact CD-CG 3.91Å; M40-P91 HydrophobicContact CE-CB 4.19Å; M40-P91 HydrophobicContact SD-CB 3.56Å; M40-P91 VanDerWaalsContact SD-CB 3.56Å; M40-P91 HydrophobicContact SD-CG 4.25Å; W86-P91 HydrophobicContact CD2-CB 3.95Å; W86-P91 HydrophobicContact CE3-CB 3.94Å; W86-P91 HydrophobicContact CE3-CG 4.33Å; W86-P91 HydrophobicContact CH2-CB 3.66Å; W86-P91 HydrophobicContact CH2-CG 3.67Å; W86-P91 HydrophobicContact CZ2-CB 3.63Å; W86-P91 HydrophobicContact CZ2-CG 4.14Å; W86-P91 HydrophobicContact CZ3-CB 3.8Å; W86-P91 HydrophobicContact CZ3-CG 3.77Å; P89-P91 WeakPolarHBondContact O-CD 3.23Å; P91-A406 HydrophobicContact CB-CB 4.35Å; P91-A406 HydrophobicContact CG-CB 4.14Å; P91-N407 PolarHBondContact O-N 3.09Å; P91-N407 PolarHBondContact O-ND2 2.89Å
92	F	94.6	Very high	93.8	Very high	11 Å²	11	17.5 Å²	17.5	5%	0.048	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	140.9	171.6	-63	-91.8	0	0	0	110.3	K84 I85 V87 I90 W233 N407 I409	K84-F92 VanDerWaalsContact CA-O 3.26Å; K84-F92 WeakPolarHBondContact CA-O 3.44Å; I85-F92 HydrophobicContact CB-CB 4.42Å; I85-F92 PolarHBondContact N-O 2.98Å; I85-F92 WeakPolarHBondContact O-CA 3.21Å; I85-F92 WeakPolarHBondContact O-CB 3.44Å; I85-F92 PolarHBondContact O-N 3.12Å; V87-F92 HydrophobicContact CB-CD2 4.35Å; V87-F92 HydrophobicContact CB-CE2 3.87Å; V87-F92 HydrophobicContact CG2-CD2 3.91Å; V87-F92 HydrophobicContact CG2-CE2 3.78Å; I90-F92 HydrophobicContact CB-CE2 3.97Å; I90-F92 HydrophobicContact CB-CZ 4.47Å; I90-F92 HydrophobicContact CG2-CD2 4.24Å; I90-F92 HydrophobicContact CG2-CE1 4.46Å; I90-F92 HydrophobicContact CG2-CE2 3.45Å; I90-F92 VanDerWaalsContact CG2-CE2 3.45Å; I90-F92 HydrophobicContact CG2-CZ 3.6Å; I90-F92 WeakPolarHBondContact O-CD2 3.44Å; I90-F92 WeakPolarHBondContact O-CE2 3.42Å; F92-W233 HydrophobicContact CE2-CH2 4.17Å; F92-W233 HydrophobicContact CZ-CH2 4.07Å; F92-N407 CarbonylContact C-O 3.4Å; F92-N407 WeakPolarHBondContact CA-O 3.17Å; F92-N407 HydrophobicContact CD1-CB 3.4Å; F92-N407 HydrophobicContact CE1-CB 3.59Å; F92-N407 HydrophobicContact CG-CB 4.22Å; F92-I409 HydrophobicContact CB-CD1 3.95Å; F92-I409 HydrophobicContact CB-CG1 4.23Å; F92-I409 HydrophobicContact CD1-CD1 3.45Å; F92-I409 VanDerWaalsContact CD1-CD1 3.45Å; F92-I409 HydrophobicContact CD1-CG1 3.56Å; F92-I409 HydrophobicContact CE1-CD1 4.19Å; F92-I409 HydrophobicContact CE1-CG1 4.38Å; F92-I409 HydrophobicContact CG-CD1 3.9Å; F92-I409 HydrophobicContact CG-CG1 4.29Å
93	V	95.9	Very high	93.8	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.9	166.2	63	0	0	0	0	108	M40 L82 F83 L95 V402 N407 A408 I409	M40-V93 HydrophobicContact CE-CB 4.38Å; L82-V93 HydrophobicContact CB-CG2 4.18Å; L82-V93 HydrophobicContact CD1-CG2 3.57Å; L82-V93 HydrophobicContact CG-CG2 4.32Å; F83-V93 CarbonylContact O-C 3.52Å; F83-V93 WeakPolarHBondContact O-CA 3.46Å; V93-L95 HydrophobicContact CG1-CD2 4.47Å; V93-L95 HydrophobicContact CG2-CD2 3.87Å; V93-V402 HydrophobicContact CG1-CG1 4.24Å; V93-N407 PolarHBondContact N-O 3.15Å; V93-A408 HydrophobicContact CG1-CB 3.87Å; V93-A408 CarbonylContact O-C 3.46Å; V93-A408 WeakPolarHBondContact O-CA 3.22Å; V93-I409 PolarHBondContact O-N 3.13Å
94	V	96.3	Very high	93.7	Very high	4 Å²	4	21.9 Å²	21.9	2%	0.024	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123.4	-175.8	-173.8	0	0	0	0	109	L82 F83 I85 F96 I411	L82-V94 WeakPolarHBondContact CA-O 3.38Å; L82-V94 WeakPolarHBondContact CB-O 3.42Å; F83-V94 HydrophobicContact CD1-CB 3.98Å; F83-V94 HydrophobicContact CD1-CG1 4.39Å; F83-V94 HydrophobicContact CD2-CB 4.31Å; F83-V94 HydrophobicContact CD2-CG2 4.21Å; F83-V94 HydrophobicContact CE1-CB 3.56Å; F83-V94 HydrophobicContact CE1-CG1 3.55Å; F83-V94 HydrophobicContact CE1-CG2 4.21Å; F83-V94 HydrophobicContact CE2-CB 3.97Å; F83-V94 HydrophobicContact CE2-CG1 4.45Å; F83-V94 HydrophobicContact CE2-CG2 3.7Å; F83-V94 HydrophobicContact CG-CB 4.32Å; F83-V94 HydrophobicContact CZ-CB 3.55Å; F83-V94 HydrophobicContact CZ-CG1 3.59Å; F83-V94 HydrophobicContact CZ-CG2 3.68Å; F83-V94 PolarHBondContact N-O 2.91Å; F83-V94 PolarHBondContact O-N 3.15Å; I85-V94 HydrophobicContact CD1-CG2 3.85Å; I85-V94 HydrophobicContact CG1-CG2 4.14Å; V94-F96 HydrophobicContact CG1-CD1 4.34Å; V94-I411 HydrophobicContact CG1-CD1 4.04Å; V94-I411 HydrophobicContact CG1-CG1 3.5Å; V94-I411 VanDerWaalsContact CG1-CG1 3.5Å
95	L	96.2	Very high	93.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.9	-174.4	-50.2	-177.6	0	0	0	109.8	L82 V93 N100 V101 I104 L397 A408 I409 I410 I411	L82-L95 HydrophobicContact CB-CD2 3.83Å; L82-L95 HydrophobicContact CD2-CD2 4.39Å; V93-L95 HydrophobicContact CG1-CD2 4.47Å; V93-L95 HydrophobicContact CG2-CD2 3.87Å; L95-N100 HydrophobicContact CD1-CB 4.49Å; L95-N100 HydrophobicContact CD2-CB 4.13Å; L95-V101 HydrophobicContact CB-CG2 4.3Å; L95-I104 HydrophobicContact CD1-CB 4.47Å; L95-I104 HydrophobicContact CD1-CG1 3.61Å; L95-L397 HydrophobicContact CD1-CD1 4.26Å; L95-L397 HydrophobicContact CD2-CD1 3.83Å; L95-A408 HydrophobicContact CD1-CB 3.95Å; L95-I409 PolarHBondContact N-O 3.12Å; L95-I410 HydrophobicContact CB-CG1 4.34Å; L95-I410 HydrophobicContact CD1-CG1 4.37Å; L95-I410 WeakPolarHBondContact O-CA 3.43Å; L95-I411 PolarHBondContact O-N 3.05Å
96	F	94.8	Very high	93.6	Very high	5 Å²	5	22.9 Å²	22.9	2%	0.022	13%	0.129	C	C	.	.			trans	-141.9	8.4	-179.7	49.3	-86.9	0	0	0	112.8	T74 F77 A80 F83 V94 I411 T414 L415	T74-F96 HydrophobicContact CG2-CD1 4.05Å; T74-F96 HydrophobicContact CG2-CG 4.33Å; F77-F96 HydrophobicContact CB-CZ 4.39Å; F77-F96 WeakPolarHBondContact O-CZ 3.18Å; A80-F96 WeakPolarHBondContact O-CZ 3.35Å; F83-F96 AromaticContact CD1-CE1 3.67Å; F83-F96 HydrophobicContact CD1-CE1 3.67Å; F83-F96 HydrophobicContact CD1-CZ 4.39Å; F83-F96 HydrophobicContact CE1-CD1 4.28Å; F83-F96 AromaticContact CE1-CE1 3.74Å; F83-F96 HydrophobicContact CE1-CE1 3.74Å; V94-F96 HydrophobicContact CG1-CD1 4.34Å; F96-I411 HydrophobicContact CB-CB 4.5Å; F96-T414 HydrophobicContact CB-CG2 3.96Å; F96-T414 HydrophobicContact CD2-CG2 4.29Å; F96-T414 HydrophobicContact CG-CG2 4.33Å; F96-L415 WeakPolarHBondContact O-CA 3.47Å; F96-L415 WeakPolarHBondContact O-CD1 3.38Å
97	H	94.2	Very high	93.5	Very high	28 Å²	28	25.5 Å²	25.5	13%	0.13	14%	0.143	C	C	.	.	S	Bend	trans	-114.7	138.8	173.1	-69.7	-60.2	0	0	0	111.4	E99 N100 V101 D418 R420	H97-E99 VanDerWaalsContact C-N 3.26Å; H97-E99 WeakPolarHBondContact CB-OE2 3.41Å; H97-E99 PolarHBondContact O-N 3.24Å; H97-N100 PolarHBondContact O-N 2.75Å; H97-V101 WeakPolarHBondContact O-CG2 3.33Å; H97-V101 PolarHBondContact O-N 3.18Å; H97-V101 VanDerWaalsContact O-N 3.14Å; H97-D418 IonicContact CE1-OD2 3.5Å; H97-D418 IonicContact ND1-OD2 3.3Å; H97-D418 PolarHBondContact ND1-OD2 3.04Å; H97-D418 VanDerWaalsContact ND1-OD2 3.15Å; H97-R420 PolarHBondContact ND1-NH2 3.22Å; H97-R420 VanDerWaalsContact ND1-NH2 3.11Å
98	A	94.9	Very high	93.4	Very high	2 Å²	2	28.2 Å²	28.2	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-56.2	-37.1	-171	0	0	0	0	0	113.4	N100 V101 E102 L415 Y421 A445	A98-N100 VanDerWaalsContact C-N 3.34Å; A98-N100 PolarHBondContact O-N 2.85Å; A98-V101 PolarHBondContact O-N 2.75Å; A98-E102 WeakPolarHBondContact O-CB 3.48Å; A98-E102 PolarHBondContact O-N 3.37Å; A98-L415 HydrophobicContact CB-CD1 4.17Å; A98-Y421 HydrophobicContact CB-CD2 4.47Å; A98-Y421 HydrophobicContact CB-CE2 3.82Å; A98-A445 HydrophobicContact CB-CB 4.09Å
99	E	94.4	Very high	93.5	Very high	56 Å²	56	30.3 Å²	30.3	26%	0.262	17%	0.172	S	C	.	.	H	α-helix	trans	-65.2	-36.9	-176.4	-55.5	83.7	171.8	0	0	112.2	H97 K103 R420 Y421	H97-E99 VanDerWaalsContact C-N 3.26Å; H97-E99 WeakPolarHBondContact CB-OE2 3.41Å; H97-E99 PolarHBondContact O-N 3.24Å; E99-K103 WeakPolarHBondContact O-CG 3.46Å; E99-R420 IonicContact OE1-CZ 3.81Å; E99-R420 IonicContact OE1-NH1 3.64Å; E99-R420 PolarHBondContact OE1-NH1 3.37Å; E99-R420 IonicContact OE1-NH2 2.95Å; E99-R420 PolarHBondContact OE1-NH2 3.01Å; E99-R420 IonicContact OE2-CZ 2.73Å; E99-R420 IonicContact OE2-NH1 3.63Å; E99-R420 IonicContact OE2-NH2 2.71Å; E99-R420 PolarHBondContact OE2-NH2 3.4Å; E99-R420 VanDerWaalsContact OE2-NH2 3.16Å; E99-Y421 PolarHBondContact OE1-OH 3.25Å
100	N	94.5	Very high	93.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-80	-36.4	175.6	-72.6	-34	0	0	0	111.5	P81 L95 H97 A98 E102 K103 I104 N398	P81-N100 PolarHBondContact O-ND2 3.11Å; L95-N100 HydrophobicContact CD1-CB 4.49Å; L95-N100 HydrophobicContact CD2-CB 4.13Å; H97-N100 PolarHBondContact O-N 2.75Å; A98-N100 VanDerWaalsContact C-N 3.34Å; A98-N100 PolarHBondContact O-N 2.85Å; N100-E102 VanDerWaalsContact C-N 3.34Å; N100-K103 PolarHBondContact O-N 2.72Å; N100-I104 PolarHBondContact O-N 2.82Å; N100-N398 PolarHBondContact ND2-ND2 2.67Å; N100-N398 VanDerWaalsContact ND2-ND2 3.17Å; N100-N398 VanDerWaalsContact OD1-CG 3.28Å; N100-N398 PolarHBondContact OD1-N 3.12Å; N100-N398 PolarHBondContact OD1-ND2 3.25Å; N100-N398 PolarHBondContact OD1-OD1 3.34Å
101	V	95.6	Very high	93.4	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.4	-42.7	176.9	173.8	0	0	0	0	110.8	L95 H97 A98 K103 I104 L105 I410 L415 Y444	L95-V101 HydrophobicContact CB-CG2 4.3Å; H97-V101 WeakPolarHBondContact O-CG2 3.33Å; H97-V101 PolarHBondContact O-N 3.18Å; H97-V101 VanDerWaalsContact O-N 3.14Å; A98-V101 PolarHBondContact O-N 2.75Å; V101-K103 PolarHBondContact O-N 3.01Å; V101-I104 PolarHBondContact O-N 3.22Å; V101-L105 HydrophobicContact CG1-CD1 3.57Å; V101-L105 HydrophobicContact CG1-CG 4.05Å; V101-L105 WeakPolarHBondContact O-CB 3.41Å; V101-L105 WeakPolarHBondContact O-CG 3.25Å; V101-L105 PolarHBondContact O-N 2.89Å; V101-I410 HydrophobicContact CG1-CD1 4.49Å; V101-I410 HydrophobicContact CG1-CG2 4.18Å; V101-I410 HydrophobicContact CG2-CG1 4.35Å; V101-I410 HydrophobicContact CG2-CG2 3.85Å; V101-L415 HydrophobicContact CG1-CD2 4.3Å; V101-L415 HydrophobicContact CG2-CD1 4.24Å; V101-L415 HydrophobicContact CG2-CD2 4.12Å; V101-Y444 HydrophobicContact CG1-CD1 4.39Å
102	E	95.4	Very high	93.4	Very high	90 Å²	90	28 Å²	28	42%	0.421	16%	0.156	S	C	.	.	H	α-helix	trans	-57.6	-47.5	175.5	175.5	164.2	-152.9	0	0	112.1	A98 N100 I104 L105 G106 Y444	A98-E102 WeakPolarHBondContact O-CB 3.48Å; A98-E102 PolarHBondContact O-N 3.37Å; N100-E102 VanDerWaalsContact C-N 3.34Å; E102-I104 PolarHBondContact O-N 2.91Å; E102-L105 PolarHBondContact O-N 3.28Å; E102-G106 WeakPolarHBondContact O-CA 3.36Å; E102-G106 PolarHBondContact O-N 3.23Å; E102-Y444 HydrophobicContact CB-CD1 4.37Å; E102-Y444 HydrophobicContact CB-CD2 3.5Å; E102-Y444 HydrophobicContact CB-CE2 4.06Å; E102-Y444 HydrophobicContact CB-CG 3.69Å; E102-Y444 HydrophobicContact CG-CD2 3.47Å; E102-Y444 VanDerWaalsContact CG-CD2 3.47Å; E102-Y444 HydrophobicContact CG-CE2 3.59Å; E102-Y444 HydrophobicContact CG-CG 4.17Å
103	K	94.3	Very high	93.3	Very high	93 Å²	93	28.8 Å²	28.8	40%	0.404	16%	0.159	S	C	.	.	H	α-helix	trans	-59	-34	178.6	-73.1	175	178.1	176	0	113.1	E99 N100 V101 N107 N396 L397	E99-K103 WeakPolarHBondContact O-CG 3.46Å; N100-K103 PolarHBondContact O-N 2.72Å; V101-K103 PolarHBondContact O-N 3.01Å; K103-N107 WeakPolarHBondContact O-CB 3.41Å; K103-N396 PolarHBondContact NZ-O 3.07Å; K103-L397 HydrophobicContact CB-CD2 3.97Å; K103-L397 HydrophobicContact CD-CD2 3.97Å
104	I	95.1	Very high	93.1	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-83.1	-48.2	179.3	-60.6	-48.3	0	0	0	111.6	L95 N100 V101 E102 H110 R389 L391 L397 A408	L95-I104 HydrophobicContact CD1-CB 4.47Å; L95-I104 HydrophobicContact CD1-CG1 3.61Å; N100-I104 PolarHBondContact O-N 2.82Å; V101-I104 PolarHBondContact O-N 3.22Å; E102-I104 PolarHBondContact O-N 2.91Å; I104-H110 HydrophobicContact CG2-CB 4.49Å; I104-R389 HydrophobicContact CG2-CB 4.22Å; I104-R389 HydrophobicContact CG2-CG 4.1Å; I104-L391 HydrophobicContact CD1-CD2 3.59Å; I104-L391 HydrophobicContact CG1-CD2 4.49Å; I104-L391 HydrophobicContact CG2-CD2 4.47Å; I104-L397 HydrophobicContact CD1-CD1 4.29Å; I104-L397 HydrophobicContact CD1-CD2 3.95Å; I104-L397 HydrophobicContact CG1-CD2 4.36Å; I104-A408 HydrophobicContact CG1-CB 4.34Å; I104-A408 HydrophobicContact CG2-CB 4.27Å
105	L	94.6	Very high	92.7	Very high	11 Å²	11	31.6 Å²	31.6	6%	0.058	17%	0.172	C	C	.	.	H	α-helix	trans	-80.9	-26.6	-173.7	-62.7	-172	0	0	0	113.9	V101 E102 N107 F387 R389 I410 Y444 A451 G452	V101-L105 HydrophobicContact CG1-CD1 3.57Å; V101-L105 HydrophobicContact CG1-CG 4.05Å; V101-L105 WeakPolarHBondContact O-CB 3.41Å; V101-L105 WeakPolarHBondContact O-CG 3.25Å; V101-L105 PolarHBondContact O-N 2.89Å; E102-L105 PolarHBondContact O-N 3.28Å; L105-N107 VanDerWaalsContact C-N 3.31Å; L105-F387 HydrophobicContact CD1-CE2 4.16Å; L105-F387 HydrophobicContact CD1-CZ 4Å; L105-F387 HydrophobicContact CD2-CE2 3.97Å; L105-R389 HydrophobicContact CD2-CG 4.48Å; L105-I410 HydrophobicContact CD1-CD1 4.09Å; L105-I410 HydrophobicContact CD2-CD1 3.61Å; L105-I410 HydrophobicContact CG-CD1 3.84Å; L105-Y444 HydrophobicContact CB-CD1 3.95Å; L105-Y444 HydrophobicContact CB-CE1 3.54Å; L105-Y444 HydrophobicContact CD1-CD1 4.27Å; L105-A451 HydrophobicContact CD1-CB 4.18Å; L105-G452 WeakPolarHBondContact O-CA 3.48Å
106	G	91.7	Very high	92.3	Very high	42 Å²	42	32.7 Å²	32.7	43%	0.433	18%	0.181	S	C	.	.	S	Bend	trans	-75.8	-17.7	172.5	0	0	0	0	0	113.4	E102 P108 Y444	E102-G106 WeakPolarHBondContact O-CA 3.36Å; E102-G106 PolarHBondContact O-N 3.23Å; G106-P108 WeakPolarHBondContact O-CD 3.45Å; G106-Y444 WeakPolarHBondContact CA-OH 3.44Å
107	N	90.9	Very high	92.1	Very high	58 Å²	58	34.1 Å²	34.1	31%	0.31	19%	0.186	S	C	.	.			trans	-87.7	117.3	-176.4	-170.7	-21.9	0	0	0	112	K103 L105 V109 H110	K103-N107 WeakPolarHBondContact O-CB 3.41Å; L105-N107 VanDerWaalsContact C-N 3.31Å; N107-V109 PolarHBondContact O-N 2.85Å; N107-V109 VanDerWaalsContact O-N 3.12Å; N107-V109 VanDerWaalsContact OD1-CB 3.24Å; N107-V109 WeakPolarHBondContact OD1-CB 3.41Å; N107-V109 WeakPolarHBondContact OD1-CG2 3.42Å; N107-V109 PolarHBondContact OD1-N 3.49Å; N107-H110 PolarHBondContact O-N 3.33Å
108	P	87.8	Confident	92	Very high	68 Å²	68	38.3 Å²	38.3	44%	0.442	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-5.1	-179.2	32.2	-38.5	0	0	0	114.3	G106 L111 L453	G106-P108 WeakPolarHBondContact O-CD 3.45Å; P108-L111 VanDerWaalsContact O-CD1 3.29Å; P108-L111 WeakPolarHBondContact O-CD1 3.45Å; P108-L111 WeakPolarHBondContact O-CG 3.37Å; P108-L453 HydrophobicContact CB-CD1 3.59Å
109	V	89.9	Confident	91.8	Very high	58 Å²	58	38.6 Å²	38.6	35%	0.352	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-35.7	174.9	174.5	0	0	0	0	111.3	N107 L111 C392 D393	N107-V109 PolarHBondContact O-N 2.85Å; N107-V109 VanDerWaalsContact O-N 3.12Å; N107-V109 VanDerWaalsContact OD1-CB 3.24Å; N107-V109 WeakPolarHBondContact OD1-CB 3.41Å; N107-V109 WeakPolarHBondContact OD1-CG2 3.42Å; N107-V109 PolarHBondContact OD1-N 3.49Å; V109-L111 PolarHBondContact O-N 3.32Å; V109-C392 HydrophobicContact CG1-CB 3.68Å; V109-C392 WeakPolarHBondContact O-CB 3.41Å; V109-C392 PolarHBondContact O-SG 3.41Å; V109-C392 VanDerWaalsContact O-SG 3.34Å; V109-D393 HydrophobicContact CG1-CB 4.25Å; V109-D393 WeakPolarHBondContact CG1-OD2 3.27Å
110	H	89.8	Confident	91.7	Very high	7 Å²	7	36.3 Å²	36.3	3%	0.032	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	46.9	-175.1	-56.3	-36	0	0	0	112.6	I104 N107 C392	I104-H110 HydrophobicContact CG2-CB 4.49Å; N107-H110 PolarHBondContact O-N 3.33Å; H110-C392 PolarHBondContact ND1-N 3.36Å
111	L	87.4	Confident	91.7	Very high	11 Å²	11	39.6 Å²	39.6	6%	0.058	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-30.9	-179.6	-65.6	172.7	0	0	0	112.5	P108 V109 W136 R389 L453 R454	P108-L111 VanDerWaalsContact O-CD1 3.29Å; P108-L111 WeakPolarHBondContact O-CD1 3.45Å; P108-L111 WeakPolarHBondContact O-CG 3.37Å; V109-L111 PolarHBondContact O-N 3.32Å; L111-W136 HydrophobicContact CD1-CE3 4.13Å; L111-W136 HydrophobicContact CD1-CZ3 4.14Å; L111-W136 HydrophobicContact CD2-CE3 4.46Å; L111-W136 HydrophobicContact CD2-CH2 4.49Å; L111-W136 HydrophobicContact CD2-CZ3 4.07Å; L111-R389 PolarHBondContact O-NH1 2.92Å; L111-L453 HydrophobicContact CD2-CB 3.77Å; L111-L453 HydrophobicContact CD2-CD1 3.97Å; L111-R454 HydrophobicContact CD2-CG 3.6Å; L111-R454 PolarHBondContact O-NH1 2.73Å
112	T	92.4	Very high	91.6	Very high	42 Å²	42	42.2 Å²	42.2	26%	0.258	23%	0.227	S	C	.	.	S	Bend	trans	-66.3	133.8	-171	-53.7	0	0	0	0	111.4	T132 R389 S390 C392	T112-T132 PolarHBondContact OG1-OG1 2.8Å; T112-R389 WeakPolarHBondContact O-CA 3.47Å; T112-S390 PolarHBondContact O-N 2.86Å; T112-C392 PolarHBondContact OG1-SG 2.89Å; T112-C392 VanDerWaalsContact OG1-SG 3.4Å
113	K	92.8	Very high	91.4	Very high	28 Å²	28	38 Å²	38	12%	0.122	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-71.3	153.1	175	-68.9	-66.7	-169.1	165.1	0	110.9	Y117 L129	K113-Y117 HydrophobicContact CB-CD1 4.3Å; K113-Y117 HydrophobicContact CB-CD2 3.69Å; K113-Y117 HydrophobicContact CB-CE2 4.26Å; K113-Y117 HydrophobicContact CB-CG 3.7Å; K113-Y117 HydrophobicContact CD-CD1 4.19Å; K113-Y117 HydrophobicContact CD-CD2 4.22Å; K113-Y117 HydrophobicContact CD-CE1 3.99Å; K113-Y117 HydrophobicContact CD-CE2 3.98Å; K113-Y117 HydrophobicContact CD-CG 4.31Å; K113-Y117 HydrophobicContact CG-CD1 4.25Å; K113-Y117 HydrophobicContact CG-CD2 4.35Å; K113-Y117 HydrophobicContact CG-CG 4.15Å; K113-L129 WeakPolarHBondContact CE-O 3.28Å; K113-L129 WeakPolarHBondContact CG-O 3.47Å
114	A	91.9	Very high	91.3	Very high	3 Å²	3	33.6 Å²	33.6	3%	0.025	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-65.6	165.3	177.8	0	0	0	0	0	112.6	A116 Y117 A388 N407	A114-A116 PolarHBondContact O-N 3.15Å; A114-A116 VanDerWaalsContact O-N 3.14Å; A114-Y117 HydrophobicContact CB-CD2 4.32Å; A114-Y117 WeakPolarHBondContact O-CD2 3.13Å; A114-Y117 PolarHBondContact O-N 2.97Å; A114-Y117 VanDerWaalsContact O-N 3.12Å; A114-A388 HydrophobicContact CB-CB 3.39Å; A114-A388 PolarHBondContact N-O 3.25Å; A114-N407 VanDerWaalsContact CA-OD1 3.25Å; A114-N407 WeakPolarHBondContact CA-OD1 3.25Å; A114-N407 HydrophobicContact CB-CB 4.15Å; A114-N407 VanDerWaalsContact CB-OD1 3.25Å; A114-N407 WeakPolarHBondContact CB-OD1 3.25Å
115	F	88.6	Confident	91.2	Very high	61 Å²	61	34.4 Å²	34.4	27%	0.268	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-51.9	-38.4	-178	177.3	-96.5	0	0	0	114.2	I90 Y117 K118 F119 W233 N407	I90-F115 HydrophobicContact CD1-CB 4.31Å; I90-F115 HydrophobicContact CD1-CD1 3.47Å; I90-F115 VanDerWaalsContact CD1-CD1 3.47Å; I90-F115 HydrophobicContact CD1-CD2 4.12Å; I90-F115 HydrophobicContact CD1-CE1 3.69Å; I90-F115 HydrophobicContact CD1-CE2 4.31Å; I90-F115 HydrophobicContact CD1-CG 3.7Å; I90-F115 HydrophobicContact CD1-CZ 4.12Å; F115-Y117 PolarHBondContact O-N 2.62Å; F115-Y117 VanDerWaalsContact O-N 3.09Å; F115-K118 HydrophobicContact CD2-CD 3.82Å; F115-K118 HydrophobicContact CE2-CD 3.8Å; F115-K118 VanDerWaalsContact O-CB 3.31Å; F115-K118 WeakPolarHBondContact O-CB 3.4Å; F115-K118 WeakPolarHBondContact O-CG 3.43Å; F115-K118 PolarHBondContact O-N 2.86Å; F115-F119 HydrophobicContact CD1-CZ 4.49Å; F115-F119 HydrophobicContact CE1-CE2 4.46Å; F115-F119 AromaticContact CE1-CZ 3.82Å; F115-F119 HydrophobicContact CE1-CZ 3.82Å; F115-W233 HydrophobicContact CD1-CE3 4.1Å; F115-W233 HydrophobicContact CD1-CZ3 4.19Å; F115-W233 HydrophobicContact CE1-CD2 4.12Å; F115-W233 AromaticContact CE1-CE3 3.74Å; F115-W233 HydrophobicContact CE1-CE3 3.74Å; F115-W233 HydrophobicContact CE1-CZ3 4.29Å; F115-N407 PolarHBondContact N-OD1 3.06Å
116	A	87	Confident	91.1	Very high	22 Å²	22	36.2 Å²	36.2	18%	0.182	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-59.4	-22.6	-178	0	0	0	0	0	114.4	A114 K118 F119 Q227	A114-A116 PolarHBondContact O-N 3.15Å; A114-A116 VanDerWaalsContact O-N 3.14Å; A116-K118 PolarHBondContact O-N 2.83Å; A116-F119 WeakPolarHBondContact O-CD2 2.99Å; A116-F119 PolarHBondContact O-N 3.12Å; A116-Q227 HydrophobicContact CB-CG 4.39Å; A116-Q227 PolarHBondContact O-NE2 2.89Å
117	Y	91.2	Very high	91	Very high	36 Å²	36	34.2 Å²	34.2	14%	0.141	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-71.2	-15.4	176.3	-72.4	-95.8	0	0	0	113	K113 A114 F115 F119 L120 H121 L129	K113-Y117 HydrophobicContact CB-CD1 4.3Å; K113-Y117 HydrophobicContact CB-CD2 3.69Å; K113-Y117 HydrophobicContact CB-CE2 4.26Å; K113-Y117 HydrophobicContact CB-CG 3.7Å; K113-Y117 HydrophobicContact CD-CD1 4.19Å; K113-Y117 HydrophobicContact CD-CD2 4.22Å; K113-Y117 HydrophobicContact CD-CE1 3.99Å; K113-Y117 HydrophobicContact CD-CE2 3.98Å; K113-Y117 HydrophobicContact CD-CG 4.31Å; K113-Y117 HydrophobicContact CG-CD1 4.25Å; K113-Y117 HydrophobicContact CG-CD2 4.35Å; K113-Y117 HydrophobicContact CG-CG 4.15Å; A114-Y117 HydrophobicContact CB-CD2 4.32Å; A114-Y117 WeakPolarHBondContact O-CD2 3.13Å; A114-Y117 PolarHBondContact O-N 2.97Å; A114-Y117 VanDerWaalsContact O-N 3.12Å; F115-Y117 PolarHBondContact O-N 2.62Å; F115-Y117 VanDerWaalsContact O-N 3.09Å; Y117-F119 PolarHBondContact O-N 2.71Å; Y117-L120 HydrophobicContact CD1-CD1 4.03Å; Y117-L120 WeakPolarHBondContact O-CB 3.29Å; Y117-L120 PolarHBondContact O-N 3.28Å; Y117-H121 PolarHBondContact O-CD2 3.31Å; Y117-L129 HydrophobicContact CD1-CD1 4.44Å; Y117-L129 HydrophobicContact CD1-CG 4.41Å; Y117-L129 HydrophobicContact CE1-CD1 4.04Å; Y117-L129 HydrophobicContact CE1-CG 4.45Å
118	K	91.6	Very high	91	Very high	116 Å²	116	31.9 Å²	31.9	50%	0.504	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-61.1	-27.6	174.3	-70.7	-174.4	176.8	-173.3	0	112.6	F115 A116 L120 H121	F115-K118 HydrophobicContact CD2-CD 3.82Å; F115-K118 HydrophobicContact CE2-CD 3.8Å; F115-K118 VanDerWaalsContact O-CB 3.31Å; F115-K118 WeakPolarHBondContact O-CB 3.4Å; F115-K118 WeakPolarHBondContact O-CG 3.43Å; F115-K118 PolarHBondContact O-N 2.86Å; A116-K118 PolarHBondContact O-N 2.83Å; K118-L120 PolarHBondContact O-N 3.07Å; K118-H121 WeakPolarHBondContact O-CB 3.16Å; K118-H121 PolarHBondContact O-N 3.23Å; K118-H121 VanDerWaalsContact O-N 3.08Å
119	F	91.6	Very high	91.3	Very high	7 Å²	7	29.7 Å²	29.7	3%	0.031	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-70.3	-14.6	177.6	-53	-48.7	0	0	0	113.2	F115 A116 Y117 V223 R226 Q227 W233	F115-F119 HydrophobicContact CD1-CZ 4.49Å; F115-F119 HydrophobicContact CE1-CE2 4.46Å; F115-F119 AromaticContact CE1-CZ 3.82Å; F115-F119 HydrophobicContact CE1-CZ 3.82Å; A116-F119 WeakPolarHBondContact O-CD2 2.99Å; A116-F119 PolarHBondContact O-N 3.12Å; Y117-F119 PolarHBondContact O-N 2.71Å; F119-V223 HydrophobicContact CB-CG1 4.43Å; F119-R226 HydrophobicContact CD1-CG 4.3Å; F119-R226 HydrophobicContact CG-CG 4.33Å; F119-Q227 HydrophobicContact CD2-CG 3.76Å; F119-W233 HydrophobicContact CE1-CB 4.43Å; F119-W233 HydrophobicContact CE1-CG 4.48Å; F119-W233 AromaticContact CE2-CD1 3.68Å; F119-W233 HydrophobicContact CE2-CD2 4.31Å; F119-W233 HydrophobicContact CE2-CG 4.07Å; F119-W233 AromaticContact CE2-NE1 3.68Å; F119-W233 HydrophobicContact CZ-CB 3.82Å; F119-W233 AromaticContact CZ-CD1 3.43Å; F119-W233 VanDerWaalsContact CZ-CD1 3.43Å; F119-W233 HydrophobicContact CZ-CD2 4.03Å; F119-W233 AromaticContact CZ-CG 3.49Å; F119-W233 HydrophobicContact CZ-CG 3.49Å; F119-W233 VanDerWaalsContact CZ-CG 3.49Å; F119-W233 AromaticContact CZ-NE1 3.9Å
120	L	92.3	Very high	91.4	Very high	9 Å²	9	27.4 Å²	27.4	5%	0.047	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-87.9	-15.2	171.4	-70.4	163.9	0	0	0	112.8	Y117 K118 W123 L124 L129 T130 V223 F317	Y117-L120 HydrophobicContact CD1-CD1 4.03Å; Y117-L120 WeakPolarHBondContact O-CB 3.29Å; Y117-L120 PolarHBondContact O-N 3.28Å; K118-L120 PolarHBondContact O-N 3.07Å; L120-W123 HydrophobicContact CD2-CE3 4.07Å; L120-W123 PolarHBondContact O-N 3.29Å; L120-L124 HydrophobicContact CB-CD1 4.21Å; L120-L124 HydrophobicContact CB-CG 4.45Å; L120-L124 HydrophobicContact CD2-CD1 4.11Å; L120-L124 PolarHBondContact O-N 2.86Å; L120-L129 HydrophobicContact CD1-CD2 3.93Å; L120-T130 HydrophobicContact CB-CG2 4.16Å; L120-V223 HydrophobicContact CD2-CG1 3.72Å; L120-V223 HydrophobicContact CD2-CG2 4.44Å; L120-V223 HydrophobicContact CG-CG1 4.03Å; L120-F317 HydrophobicContact CD2-CE1 4.18Å
121	H	94	Very high	91.6	Very high	69 Å²	69	27.3 Å²	27.3	32%	0.319	15%	0.146	S	C	.	.	H	α-helix	trans	-59.9	-38.7	-177.6	-70.9	-168.9	0	0	0	114	Y117 K118 W123 G125	Y117-H121 PolarHBondContact O-CD2 3.31Å; K118-H121 WeakPolarHBondContact O-CB 3.16Å; K118-H121 PolarHBondContact O-N 3.23Å; K118-H121 VanDerWaalsContact O-N 3.08Å; H121-W123 PolarHBondContact O-N 3.4Å; H121-G125 WeakPolarHBondContact O-CA 3.34Å; H121-G125 PolarHBondContact O-N 2.95Å
122	P	93.3	Very high	91.7	Very high	54 Å²	54	29.9 Å²	29.9	35%	0.351	16%	0.162	S	C	.	.	H	α-helix	trans	-59.2	-33.1	174.9	-25.3	35.9	0	0	0	112.4	L251 H255	P122-L251 HydrophobicContact CB-CD2 3.96Å; P122-L251 WeakPolarHBondContact O-CD1 3.37Å; P122-L251 WeakPolarHBondContact O-CD2 3.37Å; P122-H255 PolarHBondContact O-CE1 3.3Å
123	W	92.1	Very high	91.5	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-85.5	-58	-179	-175.1	17.8	0	0	0	113.5	L120 H121 M219 L251 L254 H255 F317	L120-W123 HydrophobicContact CD2-CE3 4.07Å; L120-W123 PolarHBondContact O-N 3.29Å; H121-W123 PolarHBondContact O-N 3.4Å; W123-M219 HydrophobicContact CD2-CG 3.64Å; W123-M219 HydrophobicContact CE3-CG 3.55Å; W123-M219 HydrophobicContact CG-CG 4.11Å; W123-M219 HydrophobicContact CH2-CB 4.39Å; W123-M219 HydrophobicContact CH2-CG 4.24Å; W123-M219 HydrophobicContact CZ2-CG 4.37Å; W123-M219 HydrophobicContact CZ3-CB 4.4Å; W123-M219 HydrophobicContact CZ3-CG 3.87Å; W123-L251 HydrophobicContact CB-CD1 3.98Å; W123-L251 HydrophobicContact CG-CD1 4.23Å; W123-L254 HydrophobicContact CZ2-CD1 4.17Å; W123-H255 PolarHBondContact O-NE2 3Å; W123-F317 HydrophobicContact CE3-CG 4.47Å; W123-F317 HydrophobicContact CH2-CB 3.76Å; W123-F317 HydrophobicContact CH2-CD1 4.47Å; W123-F317 AromaticContact CH2-CD2 3.11Å; W123-F317 HydrophobicContact CH2-CD2 3.11Å; W123-F317 AromaticContact CH2-CE2 3.75Å; W123-F317 HydrophobicContact CH2-CE2 3.75Å; W123-F317 AromaticContact CH2-CG 3.52Å; W123-F317 HydrophobicContact CH2-CG 3.52Å; W123-F317 HydrophobicContact CZ2-CB 3.89Å; W123-F317 HydrophobicContact CZ2-CD2 4.08Å; W123-F317 HydrophobicContact CZ2-CG 4.17Å; W123-F317 HydrophobicContact CZ3-CB 4.27Å; W123-F317 HydrophobicContact CZ3-CD1 4.2Å; W123-F317 AromaticContact CZ3-CD2 3.38Å; W123-F317 HydrophobicContact CZ3-CD2 3.38Å; W123-F317 HydrophobicContact CZ3-CE1 4.4Å; W123-F317 AromaticContact CZ3-CE2 3.61Å; W123-F317 HydrophobicContact CZ3-CE2 3.61Å; W123-F317 AromaticContact CZ3-CG 3.67Å; W123-F317 HydrophobicContact CZ3-CG 3.67Å; W123-F317 HydrophobicContact CZ3-CZ 4.12Å
124	L	92.1	Very high	91.3	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-97.8	-1.8	-170	-48.3	-177.7	0	0	0	112.8	L120 G127 L129 D313 F317	L120-L124 HydrophobicContact CB-CD1 4.21Å; L120-L124 HydrophobicContact CB-CG 4.45Å; L120-L124 HydrophobicContact CD2-CD1 4.11Å; L120-L124 PolarHBondContact O-N 2.86Å; L124-G127 PolarHBondContact O-N 3.07Å; L124-L129 HydrophobicContact CD1-CD2 3.92Å; L124-D313 HydrophobicContact CD2-CB 4.17Å; L124-F317 HydrophobicContact CD1-CD1 3.79Å; L124-F317 HydrophobicContact CD1-CE1 4.39Å; L124-F317 HydrophobicContact CD2-CB 4.09Å; L124-F317 HydrophobicContact CD2-CD1 4.48Å
125	G	92.3	Very high	91.3	Very high	18 Å²	18	38.2 Å²	38.2	19%	0.186	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	-139.2	-169.7	0	0	0	0	0	112.1	H121 T130	H121-G125 WeakPolarHBondContact O-CA 3.34Å; H121-G125 PolarHBondContact O-N 2.95Å; G125-T130 PolarHBondContact O-OG1 3.15Å
126	T	92.2	Very high	91.5	Very high	49 Å²	49	35.8 Å²	35.8	30%	0.301	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	46.3	175.2	52.9	0	0	0	0	111.5	T130 S131 K135 E310	T126-T130 WeakPolarHBondContact CA-OG1 3.12Å; T126-S131 WeakPolarHBondContact O-CB 3.47Å; T126-K135 WeakPolarHBondContact O-CE 3.44Å; T126-K135 PolarHBondContact O-NZ 3.42Å; T126-K135 PolarHBondContact OG1-NZ 3.13Å; T126-E310 VanDerWaalsContact N-CD 3.33Å; T126-E310 PolarHBondContact N-OE1 3.27Å; T126-E310 PolarHBondContact OG1-OE1 3.49Å
127	G	89.1	Confident	91.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	-69.9	-167.6	173.2	0	0	0	0	0	113.8	L124 L129 T130 S131 E311	L124-G127 PolarHBondContact O-N 3.07Å; G127-L129 VanDerWaalsContact C-N 3.27Å; G127-L129 PolarHBondContact O-N 3.28Å; G127-T130 PolarHBondContact O-N 2.91Å; G127-S131 WeakPolarHBondContact O-CB 3.18Å; G127-S131 PolarHBondContact O-N 2.73Å; G127-S131 PolarHBondContact O-OG 2.66Å; G127-E311 WeakPolarHBondContact CA-OE1 3.45Å
128	L	92.8	Very high	91.6	Very high	8 Å²	8	42 Å²	42	4%	0.042	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-35.1	-173.2	-173.2	68.3	0	0	0	114.2	W136 R139 R140 L143 E311 F315 R454 I457	L128-W136 VanDerWaalsContact O-CD1 3.24Å; L128-R139 HydrophobicContact CD1-CB 4.03Å; L128-R140 HydrophobicContact CD1-CB 3.88Å; L128-L143 HydrophobicContact CB-CD1 4.15Å; L128-L143 HydrophobicContact CD1-CD1 4.3Å; L128-L143 HydrophobicContact CD2-CD1 3.95Å; L128-L143 HydrophobicContact CG-CD1 4.36Å; L128-E311 VanDerWaalsContact CB-OE2 3.24Å; L128-E311 WeakPolarHBondContact CB-OE2 3.37Å; L128-E311 PolarHBondContact N-OE1 2.72Å; L128-E311 PolarHBondContact N-OE2 3.29Å; L128-E311 VanDerWaalsContact N-OE2 3.1Å; L128-F315 HydrophobicContact CD2-CZ 4.05Å; L128-R454 PolarHBondContact O-NH2 3.29Å; L128-I457 HydrophobicContact CD2-CB 4.19Å; L128-I457 HydrophobicContact CD2-CD1 3.81Å; L128-I457 HydrophobicContact CD2-CG2 3.79Å
129	L	93	Very high	91.5	Very high	22 Å²	22	37 Å²	37	12%	0.115	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-50.2	-179.3	176.9	54.9	0	0	0	112.3	K113 Y117 L120 L124 G127 T314 E318 R454	K113-L129 WeakPolarHBondContact CE-O 3.28Å; K113-L129 WeakPolarHBondContact CG-O 3.47Å; Y117-L129 HydrophobicContact CD1-CD1 4.44Å; Y117-L129 HydrophobicContact CD1-CG 4.41Å; Y117-L129 HydrophobicContact CE1-CD1 4.04Å; Y117-L129 HydrophobicContact CE1-CG 4.45Å; L120-L129 HydrophobicContact CD1-CD2 3.93Å; L124-L129 HydrophobicContact CD1-CD2 3.92Å; G127-L129 VanDerWaalsContact C-N 3.27Å; G127-L129 PolarHBondContact O-N 3.28Å; L129-T314 HydrophobicContact CB-CG2 3.94Å; L129-E318 WeakPolarHBondContact CB-OE1 3.49Å; L129-E318 WeakPolarHBondContact CD1-OE1 3.34Å; L129-E318 VanDerWaalsContact CD2-OE1 3.22Å; L129-E318 WeakPolarHBondContact CD2-OE1 3.38Å; L129-E318 VanDerWaalsContact CG-OE1 3.27Å; L129-E318 WeakPolarHBondContact CG-OE1 3.26Å; L129-R454 PolarHBondContact O-NH2 2.98Å
130	T	92.9	Very high	91.5	Very high	11 Å²	11	38.6 Å²	38.6	7%	0.067	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-22.3	-165.1	55.3	0	0	0	0	113	L120 G125 T126 G127	L120-T130 HydrophobicContact CB-CG2 4.16Å; G125-T130 PolarHBondContact O-OG1 3.15Å; T126-T130 WeakPolarHBondContact CA-OG1 3.12Å; G127-T130 PolarHBondContact O-N 2.91Å
131	S	92.4	Very high	91.3	Very high	5 Å²	5	44.6 Å²	44.6	4%	0.035	23%	0.225	C	C	.	.			trans	-59.8	160.6	177.2	55.3	0	0	0	0	114	T126 G127 W136 R454	T126-S131 WeakPolarHBondContact O-CB 3.47Å; G127-S131 WeakPolarHBondContact O-CB 3.18Å; G127-S131 PolarHBondContact O-N 2.73Å; G127-S131 PolarHBondContact O-OG 2.66Å; S131-W136 WeakPolarHBondContact OG-CA 3.4Å; S131-W136 WeakPolarHBondContact OG-CB 3.42Å; S131-R454 PolarHBondContact O-NH1 2.93Å; S131-R454 PolarHBondContact O-NH2 3.38Å
132	T	90.6	Very high	91	Very high	65 Å²	65	42.5 Å²	42.5	40%	0.399	22%	0.216	S	C	.	.			trans	-137.2	169.7	179.2	-169	0	0	0	0	111.2	T112 W136	T112-T132 PolarHBondContact OG1-OG1 2.8Å; T132-W136 PolarHBondContact O-N 3.29Å
133	G	88.4	Confident	90.7	Very high	33 Å²	33	40 Å²	40	34%	0.34	20%	0.199	S	C	.	.	H	α-helix	trans	59	-137.2	171.4	0	0	0	0	0	113.9	W136 R137	G133-W136 PolarHBondContact O-N 3.39Å; G133-R137 WeakPolarHBondContact O-CG 3.48Å; G133-R137 PolarHBondContact O-N 3.44Å
134	Q	89	Confident	90.5	Very high	153 Å²	153	43 Å²	43	72%	0.715	22%	0.218	S	C	*	.	H	α-helix	trans	-66.2	-43.5	-176.4	-171.7	175.7	0.1	0	0	112.5	W136 R137 Q138	Q134-W136 VanDerWaalsContact C-N 3.29Å; Q134-W136 PolarHBondContact O-N 3.36Å; Q134-R137 PolarHBondContact O-N 2.96Å; Q134-R137 VanDerWaalsContact O-N 3.07Å; Q134-Q138 WeakPolarHBondContact O-CB 3.49Å; Q134-Q138 PolarHBondContact O-N 2.67Å
135	K	89.9	Confident	90.2	Very high	62 Å²	62	46.6 Å²	46.6	27%	0.27	24%	0.242	S	C	.	.	H	α-helix	trans	-53.9	-48	176.9	-177.9	170.7	179.5	175	0	110.7	T126 R137 Q138 R139 D307 E310	T126-K135 WeakPolarHBondContact O-CE 3.44Å; T126-K135 PolarHBondContact O-NZ 3.42Å; T126-K135 PolarHBondContact OG1-NZ 3.13Å; K135-R137 PolarHBondContact O-N 3.47Å; K135-Q138 PolarHBondContact O-N 2.83Å; K135-R139 HydrophobicContact CG-CG 4.34Å; K135-R139 WeakPolarHBondContact O-CB 3.36Å; K135-R139 VanDerWaalsContact O-CG 3.26Å; K135-R139 WeakPolarHBondContact O-CG 3.41Å; K135-R139 PolarHBondContact O-N 3.4Å; K135-D307 IonicContact NZ-OD1 3.29Å; K135-E310 IonicContact NZ-OE1 3.57Å; K135-E310 IonicContact NZ-OE2 3.28Å; K135-E310 PolarHBondContact NZ-OE2 2.91Å
136	W	93.1	Very high	89.5	Confident	10 Å²	10	46.1 Å²	46.1	4%	0.038	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-45.2	177.4	175.5	76.4	0	0	0	112.8	L111 L128 S131 T132 G133 Q134 Q138 R139 R140 L453 R454	L111-W136 HydrophobicContact CD1-CE3 4.13Å; L111-W136 HydrophobicContact CD1-CZ3 4.14Å; L111-W136 HydrophobicContact CD2-CE3 4.46Å; L111-W136 HydrophobicContact CD2-CH2 4.49Å; L111-W136 HydrophobicContact CD2-CZ3 4.07Å; L128-W136 VanDerWaalsContact O-CD1 3.24Å; S131-W136 WeakPolarHBondContact OG-CA 3.4Å; S131-W136 WeakPolarHBondContact OG-CB 3.42Å; T132-W136 PolarHBondContact O-N 3.29Å; G133-W136 PolarHBondContact O-N 3.39Å; Q134-W136 VanDerWaalsContact C-N 3.29Å; Q134-W136 PolarHBondContact O-N 3.36Å; W136-Q138 VanDerWaalsContact C-N 3.34Å; W136-Q138 PolarHBondContact O-N 3.02Å; W136-R139 PolarHBondContact O-N 2.96Å; W136-R140 HydrophobicContact CH2-CB 4.27Å; W136-R140 HydrophobicContact CH2-CG 4.13Å; W136-R140 HydrophobicContact CZ2-CB 3.84Å; W136-R140 HydrophobicContact CZ2-CG 3.75Å; W136-R140 VanDerWaalsContact O-CB 3.3Å; W136-R140 WeakPolarHBondContact O-CB 2.91Å; W136-R140 PolarHBondContact O-N 2.94Å; W136-L453 HydrophobicContact CH2-CB 3.89Å; W136-L453 WeakPolarHBondContact CH2-O 3.46Å; W136-L453 WeakPolarHBondContact CZ2-O 3.5Å; W136-L453 HydrophobicContact CZ3-CB 4.38Å; W136-R454 VanDerWaalsContact CD1-CZ 3.43Å; W136-R454 HydrophobicContact CZ2-CG 4.22Å; W136-R454 VanDerWaalsContact NE1-CD 3.33Å
137	R	91.3	Very high	89	Confident	145 Å²	145	44.8 Å²	44.8	55%	0.547	23%	0.225	S	C	.	.	H	α-helix	trans	-61.2	-44	-179.9	-71.3	-180	-179.2	-178.3	0	111.5	G133 Q134 K135 R140 K141	G133-R137 WeakPolarHBondContact O-CG 3.48Å; G133-R137 PolarHBondContact O-N 3.44Å; Q134-R137 PolarHBondContact O-N 2.96Å; Q134-R137 VanDerWaalsContact O-N 3.07Å; K135-R137 PolarHBondContact O-N 3.47Å; R137-R140 PolarHBondContact O-N 2.97Å; R137-K141 WeakPolarHBondContact O-CB 3.17Å; R137-K141 PolarHBondContact O-N 2.7Å
138	Q	89.4	Confident	88.6	Confident	44 Å²	44	49.8 Å²	49.8	21%	0.206	25%	0.248	C	C	.	.	H	α-helix	trans	-62.8	-50.9	177.3	-175.9	-174.1	3.2	0	0	111.3	Q134 K135 W136 R140 K141 I142	Q134-Q138 WeakPolarHBondContact O-CB 3.49Å; Q134-Q138 PolarHBondContact O-N 2.67Å; K135-Q138 PolarHBondContact O-N 2.83Å; W136-Q138 VanDerWaalsContact C-N 3.34Å; W136-Q138 PolarHBondContact O-N 3.02Å; Q138-R140 VanDerWaalsContact C-N 3.35Å; Q138-R140 PolarHBondContact O-N 3.3Å; Q138-K141 PolarHBondContact O-N 3.47Å; Q138-I142 HydrophobicContact CG-CD1 3.99Å; Q138-I142 WeakPolarHBondContact O-CB 3.49Å; Q138-I142 WeakPolarHBondContact O-CG1 3.42Å; Q138-I142 PolarHBondContact O-N 3.41Å
139	R	88.8	Confident	87.7	Confident	10 Å²	10	53.8 Å²	53.8	4%	0.038	27%	0.265	C	S	.	.	H	α-helix	trans	-56	-48.7	174.8	-67.1	-63	176.5	-150.4	-19.8	111.1	L128 K135 W136 K141 I142 L143 D307 E311	L128-R139 HydrophobicContact CD1-CB 4.03Å; K135-R139 HydrophobicContact CG-CG 4.34Å; K135-R139 WeakPolarHBondContact O-CB 3.36Å; K135-R139 VanDerWaalsContact O-CG 3.26Å; K135-R139 WeakPolarHBondContact O-CG 3.41Å; K135-R139 PolarHBondContact O-N 3.4Å; W136-R139 PolarHBondContact O-N 2.96Å; R139-K141 VanDerWaalsContact C-N 3.33Å; R139-K141 PolarHBondContact O-N 2.94Å; R139-I142 PolarHBondContact O-N 3.02Å; R139-L143 HydrophobicContact CB-CD1 4.5Å; R139-L143 VanDerWaalsContact O-CB 3.31Å; R139-L143 WeakPolarHBondContact O-CB 3.34Å; R139-L143 WeakPolarHBondContact O-CG 3.4Å; R139-L143 PolarHBondContact O-N 3.27Å; R139-D307 IonicContact CZ-OD1 3.89Å; R139-D307 IonicContact NH2-OD1 3.72Å; R139-D307 PolarHBondContact NH2-OD1 2.9Å; R139-D307 IonicContact NH2-OD2 2.75Å; R139-D307 PolarHBondContact NH2-OD2 3.44Å; R139-E311 WeakPolarHBondContact CD-OE1 3.47Å; R139-E311 WeakPolarHBondContact CG-OE1 3.32Å; R139-E311 IonicContact NE-OE1 2.73Å
140	R	91.9	Very high	86.9	Confident	41 Å²	41	56.1 Å²	56.1	16%	0.155	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-42.4	180	-175.1	59.4	-178.7	-125.1	-5.6	112.1	L128 W136 R137 Q138 L143 T144 N455	L128-R140 HydrophobicContact CD1-CB 3.88Å; W136-R140 HydrophobicContact CH2-CB 4.27Å; W136-R140 HydrophobicContact CH2-CG 4.13Å; W136-R140 HydrophobicContact CZ2-CB 3.84Å; W136-R140 HydrophobicContact CZ2-CG 3.75Å; W136-R140 VanDerWaalsContact O-CB 3.3Å; W136-R140 WeakPolarHBondContact O-CB 2.91Å; W136-R140 PolarHBondContact O-N 2.94Å; R137-R140 PolarHBondContact O-N 2.97Å; Q138-R140 VanDerWaalsContact C-N 3.35Å; Q138-R140 PolarHBondContact O-N 3.3Å; R140-L143 PolarHBondContact O-N 3.22Å; R140-T144 PolarHBondContact NE-OG1 3.46Å; R140-T144 WeakPolarHBondContact O-CB 3.45Å; R140-T144 PolarHBondContact O-N 3.41Å; R140-T144 PolarHBondContact O-OG1 3.1Å; R140-N455 PolarHBondContact NH1-O 2.74Å; R140-N455 PolarHBondContact NH2-OD1 3.26Å
141	K	89.7	Confident	86.2	Confident	134 Å²	134	56.8 Å²	56.8	58%	0.583	29%	0.287	S	S	*	.	H	α-helix	trans	-63.7	-46.3	178.2	-178.3	178.6	171.9	-174.1	0	111.8	R137 Q138 R139 L143 P145 E298	R137-K141 WeakPolarHBondContact O-CB 3.17Å; R137-K141 PolarHBondContact O-N 2.7Å; Q138-K141 PolarHBondContact O-N 3.47Å; R139-K141 VanDerWaalsContact C-N 3.33Å; R139-K141 PolarHBondContact O-N 2.94Å; K141-L143 VanDerWaalsContact C-N 3.34Å; K141-L143 PolarHBondContact O-N 3.46Å; K141-P145 VanDerWaalsContact O-CD 3.23Å; K141-P145 WeakPolarHBondContact O-CD 3.45Å; K141-E298 IonicContact NZ-OE1 2.69Å; K141-E298 PolarHBondContact NZ-OE1 2.93Å
142	I	86.2	Confident	85.7	Confident	25 Å²	25	56.7 Å²	56.7	13%	0.128	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-41.6	177.7	-76.5	167.1	0	0	0	111.6	Q138 R139 P145 T295 L303	Q138-I142 HydrophobicContact CG-CD1 3.99Å; Q138-I142 WeakPolarHBondContact O-CB 3.49Å; Q138-I142 WeakPolarHBondContact O-CG1 3.42Å; Q138-I142 PolarHBondContact O-N 3.41Å; R139-I142 PolarHBondContact O-N 3.02Å; I142-P145 WeakPolarHBondContact O-CD 3.24Å; I142-T295 HydrophobicContact CB-CG2 4.26Å; I142-T295 HydrophobicContact CD1-CG2 4.43Å; I142-T295 HydrophobicContact CG1-CG2 4.04Å; I142-T295 HydrophobicContact CG2-CG2 3.44Å; I142-T295 VanDerWaalsContact CG2-CG2 3.44Å; I142-L303 HydrophobicContact CD1-CD2 4.39Å
143	L	87.5	Confident	85.3	Confident	1 Å²	1	56 Å²	56	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-85.7	-29.2	-171.4	-65.4	175.9	0	0	0	114	L128 R139 R140 K141 P145 T146 F288 L292 E311 F315 I457	L128-L143 HydrophobicContact CB-CD1 4.15Å; L128-L143 HydrophobicContact CD1-CD1 4.3Å; L128-L143 HydrophobicContact CD2-CD1 3.95Å; L128-L143 HydrophobicContact CG-CD1 4.36Å; R139-L143 HydrophobicContact CB-CD1 4.5Å; R139-L143 VanDerWaalsContact O-CB 3.31Å; R139-L143 WeakPolarHBondContact O-CB 3.34Å; R139-L143 WeakPolarHBondContact O-CG 3.4Å; R139-L143 PolarHBondContact O-N 3.27Å; R140-L143 PolarHBondContact O-N 3.22Å; K141-L143 VanDerWaalsContact C-N 3.34Å; K141-L143 PolarHBondContact O-N 3.46Å; L143-P145 VanDerWaalsContact C-CD 3.45Å; L143-T146 WeakPolarHBondContact O-CB 3.45Å; L143-T146 PolarHBondContact O-N 3.45Å; L143-T146 PolarHBondContact O-OG1 3Å; L143-F288 HydrophobicContact CD2-CE1 4.45Å; L143-F288 HydrophobicContact CD2-CE2 3.66Å; L143-F288 HydrophobicContact CD2-CZ 3.33Å; L143-F288 HydrophobicContact CG-CZ 4.41Å; L143-L292 HydrophobicContact CD2-CD2 3.48Å; L143-L292 VanDerWaalsContact CD2-CD2 3.48Å; L143-L292 HydrophobicContact CD2-CG 4.42Å; L143-E311 HydrophobicContact CD1-CG 4.25Å; L143-E311 WeakPolarHBondContact CD1-OE2 3.44Å; L143-F315 HydrophobicContact CD1-CE2 3.87Å; L143-F315 HydrophobicContact CD1-CZ 4.14Å; L143-I457 HydrophobicContact CB-CD1 3.73Å
144	T	88.4	Confident	85	Confident	66 Å²	66	57.3 Å²	57.3	41%	0.405	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-55.5	-41.1	-175.2	-64.1	0	0	0	0	114.1	R140 T146 F147	R140-T144 PolarHBondContact NE-OG1 3.46Å; R140-T144 WeakPolarHBondContact O-CB 3.45Å; R140-T144 PolarHBondContact O-N 3.41Å; R140-T144 PolarHBondContact O-OG1 3.1Å; T144-T146 PolarHBondContact O-N 3.27Å; T144-F147 PolarHBondContact O-N 3.46Å; T144-F147 VanDerWaalsContact O-N 3.16Å
145	P	84.7	Confident	85	Confident	77 Å²	77	50.5 Å²	50.5	50%	0.5	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-57.7	-29.8	176.6	-26.6	35.5	0	0	0	114	K141 I142 L143 F147 H148 I151	K141-P145 VanDerWaalsContact O-CD 3.23Å; K141-P145 WeakPolarHBondContact O-CD 3.45Å; I142-P145 WeakPolarHBondContact O-CD 3.24Å; L143-P145 VanDerWaalsContact C-CD 3.45Å; P145-F147 PolarHBondContact O-N 3.04Å; P145-H148 WeakPolarHBondContact O-CB 3.28Å; P145-H148 PolarHBondContact O-N 3.47Å; P145-I151 WeakPolarHBondContact O-CD1 3.48Å
146	T	79.2	Confident	85.1	Confident	8 Å²	8	48 Å²	48	5%	0.049	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-66.7	-21.1	-179	69.6	0	0	0	0	113.5	L143 T144 I151 F288 M291	L143-T146 WeakPolarHBondContact O-CB 3.45Å; L143-T146 PolarHBondContact O-N 3.45Å; L143-T146 PolarHBondContact O-OG1 3Å; T144-T146 PolarHBondContact O-N 3.27Å; T146-I151 WeakPolarHBondContact O-CG2 3.4Å; T146-F288 HydrophobicContact CG2-CD2 4.12Å; T146-F288 HydrophobicContact CG2-CE2 4.06Å; T146-F288 WeakPolarHBondContact OG1-CE2 3.47Å; T146-M291 HydrophobicContact CG2-CB 3.99Å; T146-M291 HydrophobicContact CG2-CE 3.72Å; T146-M291 HydrophobicContact CG2-CG 4.45Å; T146-M291 HydrophobicContact CG2-SD 3.63Å
147	F	80.8	Confident	85	Confident	20 Å²	20	52.1 Å²	52.1	9%	0.088	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-98.2	15	176.2	-63.3	-83.9	0	0	0	112.3	T144 P145 F288 F315 I457 F461	T144-F147 PolarHBondContact O-N 3.46Å; T144-F147 VanDerWaalsContact O-N 3.16Å; P145-F147 PolarHBondContact O-N 3.04Å; F147-F288 HydrophobicContact CE2-CE2 4.02Å; F147-F288 HydrophobicContact CZ-CD2 4.48Å; F147-F288 HydrophobicContact CZ-CE2 4.27Å; F147-F315 HydrophobicContact CE1-CE1 4.2Å; F147-F315 AromaticContact CE2-CE1 3.59Å; F147-F315 HydrophobicContact CE2-CE1 3.59Å; F147-F315 AromaticContact CE2-CZ 3.79Å; F147-F315 HydrophobicContact CE2-CZ 3.79Å; F147-F315 AromaticContact CZ-CD1 3.78Å; F147-F315 HydrophobicContact CZ-CD1 3.78Å; F147-F315 AromaticContact CZ-CE1 3.16Å; F147-F315 HydrophobicContact CZ-CE1 3.16Å; F147-F315 AromaticContact CZ-CZ 3.84Å; F147-F315 HydrophobicContact CZ-CZ 3.84Å; F147-I457 HydrophobicContact CD2-CD1 3.71Å; F147-I457 HydrophobicContact CD2-CG1 3.6Å; F147-I457 HydrophobicContact CD2-CG2 4.42Å; F147-I457 HydrophobicContact CE2-CD1 3.84Å; F147-I457 HydrophobicContact CE2-CG1 3.99Å; F147-I457 HydrophobicContact CE2-CG2 4.05Å; F147-I457 HydrophobicContact CG-CG1 4.24Å; F147-I457 HydrophobicContact CZ-CG2 4.34Å; F147-F461 HydrophobicContact CD1-CB 4.29Å; F147-F461 HydrophobicContact CE1-CB 4.45Å
148	H	80.1	Confident	85.1	Confident	106 Å²	106	45.5 Å²	45.5	49%	0.491	23%	0.233	S	C	.	.	S	Bend	trans	-72.7	148.6	172.6	-168.4	-96.3	0	0	0	111.1	P145 S150 I151 L152	P145-H148 WeakPolarHBondContact O-CB 3.28Å; P145-H148 PolarHBondContact O-N 3.47Å; H148-S150 PolarHBondContact ND1-OG 2.88Å; H148-S150 PolarHBondContact O-N 3.26Å; H148-S150 VanDerWaalsContact O-N 3.08Å; H148-I151 PolarHBondContact O-N 3.29Å; H148-L152 PolarHBondContact O-N 2.7Å; H148-L152 VanDerWaalsContact O-N 3.14Å
149	F	73.9	Confident	85.5	Confident	91 Å²	91	43.4 Å²	43.4	40%	0.399	22%	0.223	S	C	.	.	H	α-helix	trans	-54.7	-33.7	-172.6	-179.6	-93.6	0	0	0	114.3	I151 L152 T153 T361	F149-I151 VanDerWaalsContact C-N 3.28Å; F149-I151 PolarHBondContact O-N 2.89Å; F149-L152 PolarHBondContact O-N 3.24Å; F149-T153 PolarHBondContact O-N 3.38Å; F149-T153 VanDerWaalsContact O-N 3.16Å; F149-T153 PolarHBondContact O-OG1 3.46Å; F149-T361 HydrophobicContact CD2-CG2 4.3Å; F149-T361 HydrophobicContact CE1-CG2 4.14Å; F149-T361 HydrophobicContact CE2-CG2 3.2Å; F149-T361 HydrophobicContact CZ-CG2 3.1Å
150	S	76.2	Confident	85.8	Confident	71 Å²	71	43.8 Å²	43.8	50%	0.497	23%	0.226	S	C	.	.	H	α-helix	trans	-60.2	-36.5	177.5	48.4	0	0	0	0	112.9	H148	H148-S150 PolarHBondContact ND1-OG 2.88Å; H148-S150 PolarHBondContact O-N 3.26Å; H148-S150 VanDerWaalsContact O-N 3.08Å
151	I	78.9	Confident	86	Confident	26 Å²	26	44.3 Å²	44.3	13%	0.133	23%	0.231	C	C	.	.	H	α-helix	trans	-86.8	-37.5	-179.7	-64.9	160.3	0	0	0	110.4	P145 T146 H148 F149 T153 D154 F155 M291	P145-I151 WeakPolarHBondContact O-CD1 3.48Å; T146-I151 WeakPolarHBondContact O-CG2 3.4Å; H148-I151 PolarHBondContact O-N 3.29Å; F149-I151 VanDerWaalsContact C-N 3.28Å; F149-I151 PolarHBondContact O-N 2.89Å; I151-T153 PolarHBondContact O-N 3.25Å; I151-T153 VanDerWaalsContact O-N 3.11Å; I151-D154 WeakPolarHBondContact O-CB 3.48Å; I151-D154 PolarHBondContact O-N 2.95Å; I151-F155 HydrophobicContact CG2-CE1 4.35Å; I151-F155 HydrophobicContact CG2-CE2 3.9Å; I151-F155 HydrophobicContact CG2-CZ 3.72Å; I151-F155 PolarHBondContact O-N 3.12Å; I151-M291 HydrophobicContact CD1-SD 3.63Å; I151-M291 HydrophobicContact CG1-SD 4.37Å; I151-M291 HydrophobicContact CG2-CE 3.83Å; I151-M291 HydrophobicContact CG2-SD 4.14Å
152	L	80.9	Confident	86.4	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-58	-27.1	175	-63.2	-179.7	0	0	0	112.6	H148 F149 D154 F155 L156 R460 F461 M464	H148-L152 PolarHBondContact O-N 2.7Å; H148-L152 VanDerWaalsContact O-N 3.14Å; F149-L152 PolarHBondContact O-N 3.24Å; L152-D154 VanDerWaalsContact C-N 3.28Å; L152-D154 PolarHBondContact O-N 2.98Å; L152-F155 HydrophobicContact CD2-CD2 3.79Å; L152-F155 HydrophobicContact CD2-CE2 4.17Å; L152-F155 WeakPolarHBondContact O-CB 3.31Å; L152-F155 PolarHBondContact O-N 2.64Å; L152-L156 PolarHBondContact O-N 3.21Å; L152-R460 HydrophobicContact CD1-CB 3.75Å; L152-F461 HydrophobicContact CD2-CB 4.09Å; L152-F461 HydrophobicContact CD2-CD2 4.02Å; L152-M464 HydrophobicContact CB-CE 3.75Å; L152-M464 HydrophobicContact CB-SD 4.09Å; L152-M464 HydrophobicContact CD1-CE 4.33Å
153	T	82.6	Confident	86.9	Confident	51 Å²	51	37.1 Å²	37.1	31%	0.313	20%	0.199	S	C	.	.	H	α-helix	trans	-63.9	-33.1	175.6	-56.5	0	0	0	0	112.3	F149 I151 F155 L156	F149-T153 PolarHBondContact O-N 3.38Å; F149-T153 VanDerWaalsContact O-N 3.16Å; F149-T153 PolarHBondContact O-OG1 3.46Å; I151-T153 PolarHBondContact O-N 3.25Å; I151-T153 VanDerWaalsContact O-N 3.11Å; T153-F155 VanDerWaalsContact C-N 3.34Å; T153-L156 WeakPolarHBondContact O-CB 3.49Å; T153-L156 PolarHBondContact O-N 3.26Å
154	D	82.6	Confident	87.4	Confident	59 Å²	59	42.8 Å²	42.8	32%	0.316	23%	0.225	S	C	.	.	H	α-helix	trans	-71.7	-33.4	175.2	-67.1	-20.1	0	0	0	111.1	I151 L152 L156	I151-D154 WeakPolarHBondContact O-CB 3.48Å; I151-D154 PolarHBondContact O-N 2.95Å; L152-D154 VanDerWaalsContact C-N 3.28Å; L152-D154 PolarHBondContact O-N 2.98Å; D154-L156 VanDerWaalsContact C-N 3.33Å
155	F	88.9	Confident	87.8	Confident	11 Å²	11	42.3 Å²	42.3	5%	0.048	22%	0.22	C	C	.	.	H	α-helix	trans	-71.1	-28.2	175.7	-58.3	-25.6	0	0	0	112.9	I151 L152 T153 Q157 V158 M159 T196 Q286 M291 F461	I151-F155 HydrophobicContact CG2-CE1 4.35Å; I151-F155 HydrophobicContact CG2-CE2 3.9Å; I151-F155 HydrophobicContact CG2-CZ 3.72Å; I151-F155 PolarHBondContact O-N 3.12Å; L152-F155 HydrophobicContact CD2-CD2 3.79Å; L152-F155 HydrophobicContact CD2-CE2 4.17Å; L152-F155 WeakPolarHBondContact O-CB 3.31Å; L152-F155 PolarHBondContact O-N 2.64Å; T153-F155 VanDerWaalsContact C-N 3.34Å; F155-Q157 PolarHBondContact O-N 3.48Å; F155-V158 WeakPolarHBondContact O-CB 3.44Å; F155-V158 PolarHBondContact O-N 3.07Å; F155-M159 HydrophobicContact CB-CE 4.24Å; F155-M159 WeakPolarHBondContact O-CG 3.45Å; F155-M159 PolarHBondContact O-N 3.38Å; F155-T196 HydrophobicContact CB-CG2 3.74Å; F155-T196 HydrophobicContact CD1-CG2 3.74Å; F155-T196 HydrophobicContact CG-CG2 3.82Å; F155-Q286 WeakPolarHBondContact CE1-O 3.31Å; F155-M291 HydrophobicContact CZ-CE 4.35Å; F155-F461 HydrophobicContact CB-CE2 4.17Å; F155-F461 AromaticContact CD2-CD2 3.75Å; F155-F461 HydrophobicContact CD2-CD2 3.75Å; F155-F461 AromaticContact CD2-CE2 3.72Å; F155-F461 HydrophobicContact CD2-CE2 3.72Å; F155-F461 HydrophobicContact CE2-CD2 4.36Å; F155-F461 HydrophobicContact CE2-CE2 4.4Å; F155-F461 HydrophobicContact CG-CE2 4.14Å
156	L	91.9	Very high	88.3	Confident	8 Å²	8	38.7 Å²	38.7	4%	0.042	20%	0.196	C	C	.	.	H	α-helix	trans	-57	-35.8	177	-177.3	56.8	0	0	0	112.1	L152 T153 D154 M159 N160 L364 M464 V468	L152-L156 PolarHBondContact O-N 3.21Å; T153-L156 WeakPolarHBondContact O-CB 3.49Å; T153-L156 PolarHBondContact O-N 3.26Å; D154-L156 VanDerWaalsContact C-N 3.33Å; L156-M159 PolarHBondContact O-N 2.89Å; L156-N160 PolarHBondContact O-N 3.03Å; L156-N160 PolarHBondContact O-ND2 2.71Å; L156-L364 HydrophobicContact CD1-CD1 3.95Å; L156-L364 HydrophobicContact CD2-CD1 4.27Å; L156-M464 HydrophobicContact CB-SD 4.22Å; L156-M464 HydrophobicContact CD1-CG 4.32Å; L156-M464 HydrophobicContact CD1-SD 4.37Å; L156-V468 HydrophobicContact CD1-CG2 3.41Å; L156-V468 VanDerWaalsContact CD1-CG2 3.41Å
157	Q	91.4	Very high	89.1	Confident	98 Å²	98	39 Å²	39	46%	0.458	20%	0.198	S	C	.	.	H	α-helix	trans	-63	-45.5	176	-172	176.1	18.1	0	0	111.4	F155 N160 E161	F155-Q157 PolarHBondContact O-N 3.48Å; Q157-N160 PolarHBondContact O-N 3.17Å; Q157-E161 WeakPolarHBondContact O-CG 3.43Å; Q157-E161 PolarHBondContact O-N 3.2Å
158	V	93.9	Very high	89.8	Confident	5 Å²	5	42.5 Å²	42.5	3%	0.03	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-44.6	177.4	175.6	0	0	0	0	110.8	F155 N160 E161 Q162 E195 T196	F155-V158 WeakPolarHBondContact O-CB 3.44Å; F155-V158 PolarHBondContact O-N 3.07Å; V158-N160 VanDerWaalsContact C-N 3.32Å; V158-N160 PolarHBondContact O-N 2.95Å; V158-E161 PolarHBondContact O-N 3.11Å; V158-Q162 HydrophobicContact CG1-CG 4.24Å; V158-Q162 WeakPolarHBondContact O-CG 3.49Å; V158-Q162 PolarHBondContact O-N 2.95Å; V158-E195 HydrophobicContact CB-CG 4.48Å; V158-E195 HydrophobicContact CG1-CB 3.68Å; V158-E195 HydrophobicContact CG1-CG 3.65Å; V158-E195 HydrophobicContact CG2-CG 3.95Å; V158-T196 HydrophobicContact CB-CG2 3.83Å; V158-T196 HydrophobicContact CG1-CG2 3.74Å; V158-T196 HydrophobicContact CG2-CG2 4.23Å
159	M	96.3	Very high	90.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.3	-42.5	178.3	-66.6	171.2	-179.9	0	0	112	F155 L156 A163 I192 F461 M464 E465 V468	F155-M159 HydrophobicContact CB-CE 4.24Å; F155-M159 WeakPolarHBondContact O-CG 3.45Å; F155-M159 PolarHBondContact O-N 3.38Å; L156-M159 PolarHBondContact O-N 2.89Å; M159-A163 WeakPolarHBondContact O-CB 3.46Å; M159-A163 PolarHBondContact O-N 2.82Å; M159-I192 HydrophobicContact CG-CD1 4.48Å; M159-I192 HydrophobicContact CG-CG2 3.88Å; M159-F461 HydrophobicContact CE-CD1 4.2Å; M159-F461 HydrophobicContact CE-CD2 3.61Å; M159-F461 HydrophobicContact CE-CE1 3.97Å; M159-F461 HydrophobicContact CE-CE2 3.35Å; M159-F461 HydrophobicContact CE-CG 4.03Å; M159-F461 HydrophobicContact CE-CZ 3.54Å; M159-M464 HydrophobicContact CE-CB 4.5Å; M159-M464 HydrophobicContact CE-CG 4.34Å; M159-M464 HydrophobicContact CE-SD 4.46Å; M159-M464 HydrophobicContact SD-CB 4.31Å; M159-M464 HydrophobicContact SD-CG 3.69Å; M159-M464 HydrophobicContact SD-SD 4.1Å; M159-E465 HydrophobicContact CE-CB 3.88Å; M159-E465 HydrophobicContact SD-CB 4.06Å; M159-V468 HydrophobicContact CB-CB 4.27Å; M159-V468 HydrophobicContact CB-CG1 3.92Å; M159-V468 HydrophobicContact CB-CG2 4.4Å
160	N	96.4	Very high	91.2	Very high	19 Å²	19	35 Å²	35	10%	0.102	18%	0.18	C	C	.	.	H	α-helix	trans	-64.7	-46.2	175.9	-80.7	-82.4	0	0	0	111.9	L156 Q157 V158 Q162 A163 E164 P358 I359	L156-N160 PolarHBondContact O-N 3.03Å; L156-N160 PolarHBondContact O-ND2 2.71Å; Q157-N160 PolarHBondContact O-N 3.17Å; V158-N160 VanDerWaalsContact C-N 3.32Å; V158-N160 PolarHBondContact O-N 2.95Å; N160-Q162 VanDerWaalsContact C-N 3.35Å; N160-Q162 PolarHBondContact O-N 3.41Å; N160-A163 PolarHBondContact O-N 3.39Å; N160-E164 PolarHBondContact O-N 2.91Å; N160-P358 HydrophobicContact CB-CB 4.26Å; N160-I359 PolarHBondContact ND2-O 3.45Å; N160-I359 PolarHBondContact OD1-N 3.34Å
161	E	95.9	Very high	92	Very high	52 Å²	52	37.8 Å²	37.8	24%	0.243	19%	0.185	C	C	.	.	H	α-helix	trans	-59	-45	179.1	-74.8	174.4	-170.1	0	0	111.8	Q157 V158 E164 I165 K201 R285	Q157-E161 WeakPolarHBondContact O-CG 3.43Å; Q157-E161 PolarHBondContact O-N 3.2Å; V158-E161 PolarHBondContact O-N 3.11Å; E161-E164 PolarHBondContact O-N 3.33Å; E161-I165 WeakPolarHBondContact O-CG1 3.41Å; E161-I165 PolarHBondContact O-N 2.99Å; E161-K201 IonicContact OE2-NZ 3.55Å; E161-R285 IonicContact OE1-CZ 3.87Å; E161-R285 IonicContact OE1-NH1 3.7Å; E161-R285 PolarHBondContact OE1-NH1 2.9Å; E161-R285 IonicContact OE1-NH2 3.46Å; E161-R285 PolarHBondContact OE1-NH2 2.95Å; E161-R285 IonicContact OE2-CZ 3.77Å; E161-R285 IonicContact OE2-NH1 3.51Å; E161-R285 PolarHBondContact OE2-NH1 3.45Å; E161-R285 IonicContact OE2-NH2 2.77Å; E161-R285 PolarHBondContact OE2-NH2 3.01Å
162	Q	97.5	Very high	92.5	Very high	6 Å²	6	43 Å²	43	3%	0.028	21%	0.207	C	C	.	.	H	α-helix	trans	-73.4	-32	-179.8	-62.2	-58	-25.8	0	0	112.6	V158 N160 L166 C188 D191 I192 E195 Q205	V158-Q162 HydrophobicContact CG1-CG 4.24Å; V158-Q162 WeakPolarHBondContact O-CG 3.49Å; V158-Q162 PolarHBondContact O-N 2.95Å; N160-Q162 VanDerWaalsContact C-N 3.35Å; N160-Q162 PolarHBondContact O-N 3.41Å; Q162-L166 PolarHBondContact O-N 2.82Å; Q162-L166 VanDerWaalsContact O-N 3.12Å; Q162-C188 PolarHBondContact O-SG 3.47Å; Q162-C188 VanDerWaalsContact O-SG 3.41Å; Q162-D191 HydrophobicContact CG-CB 4.29Å; Q162-I192 HydrophobicContact CB-CD1 4.06Å; Q162-I192 HydrophobicContact CB-CG1 3.45Å; Q162-I192 VanDerWaalsContact CB-CG1 3.45Å; Q162-I192 HydrophobicContact CG-CG1 3.76Å; Q162-E195 PolarHBondContact NE2-OE2 2.85Å; Q162-Q205 PolarHBondContact O-NE2 3.21Å; Q162-Q205 VanDerWaalsContact O-NE2 3.1Å; Q162-Q205 VanDerWaalsContact OE1-NE2 3.11Å
163	A	97.2	Very high	92.8	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-68.2	-35.6	173.6	0	0	0	0	0	112.2	M159 N160 L166 V167 V468 V469	M159-A163 WeakPolarHBondContact O-CB 3.46Å; M159-A163 PolarHBondContact O-N 2.82Å; N160-A163 PolarHBondContact O-N 3.39Å; A163-L166 WeakPolarHBondContact O-CB 3.48Å; A163-L166 PolarHBondContact O-N 2.94Å; A163-V167 WeakPolarHBondContact O-CG2 3.19Å; A163-V167 PolarHBondContact O-N 3.37Å; A163-V468 HydrophobicContact CB-CG1 4.24Å; A163-V469 HydrophobicContact CB-CG2 4.27Å
164	E	96.6	Very high	93	Very high	121 Å²	121	44.5 Å²	44.5	57%	0.565	21%	0.211	S	C	*	.	H	α-helix	trans	-63.8	-45.6	174.5	-173.7	170.8	-157.8	0	0	111.3	N160 E161 L166 V167 E168	N160-E164 PolarHBondContact O-N 2.91Å; E161-E164 PolarHBondContact O-N 3.33Å; E164-L166 VanDerWaalsContact C-N 3.25Å; E164-L166 PolarHBondContact O-N 3.32Å; E164-V167 PolarHBondContact O-N 2.93Å; E164-V167 VanDerWaalsContact O-N 3.11Å; E164-E168 WeakPolarHBondContact O-CG 3.48Å; E164-E168 PolarHBondContact O-N 2.87Å
165	I	96.9	Very high	92.8	Very high	56 Å²	56	44.4 Å²	44.4	29%	0.287	22%	0.224	S	C	.	.	H	α-helix	trans	-58.1	-40.3	174.1	-65.5	166.1	0	0	0	111.2	E161 K169 Q205	E161-I165 WeakPolarHBondContact O-CG1 3.41Å; E161-I165 PolarHBondContact O-N 2.99Å; I165-K169 HydrophobicContact CG2-CD 4.38Å; I165-K169 WeakPolarHBondContact O-CG 3.37Å; I165-K169 PolarHBondContact O-N 2.92Å; I165-Q205 HydrophobicContact CG2-CB 4.38Å
166	L	96.3	Very high	92.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.7	-47.5	175.9	176.1	62.7	0	0	0	110.8	Q162 A163 E164 E168 K169 L170 D184 V185 C188 V469 I473	Q162-L166 PolarHBondContact O-N 2.82Å; Q162-L166 VanDerWaalsContact O-N 3.12Å; A163-L166 WeakPolarHBondContact O-CB 3.48Å; A163-L166 PolarHBondContact O-N 2.94Å; E164-L166 VanDerWaalsContact C-N 3.25Å; E164-L166 PolarHBondContact O-N 3.32Å; L166-E168 PolarHBondContact O-N 3.38Å; L166-K169 WeakPolarHBondContact O-CB 3.48Å; L166-K169 PolarHBondContact O-N 2.9Å; L166-K169 VanDerWaalsContact O-N 3.09Å; L166-L170 HydrophobicContact CD1-CD1 4.21Å; L166-L170 HydrophobicContact CD1-CD2 4.46Å; L166-L170 HydrophobicContact CD1-CG 4.11Å; L166-L170 HydrophobicContact CG-CD1 4.05Å; L166-L170 HydrophobicContact CG-CG 4.34Å; L166-L170 WeakPolarHBondContact O-CG 3.37Å; L166-L170 PolarHBondContact O-N 3.05Å; L166-D184 HydrophobicContact CD1-CB 3.65Å; L166-V185 HydrophobicContact CD2-CG2 4.32Å; L166-C188 HydrophobicContact CB-CB 4.24Å; L166-C188 HydrophobicContact CD1-CB 4.43Å; L166-C188 HydrophobicContact CD2-CB 3.92Å; L166-C188 HydrophobicContact CG-CB 4.43Å; L166-V469 HydrophobicContact CD2-CG1 3.81Å; L166-I473 HydrophobicContact CD2-CD1 4.02Å; L166-I473 HydrophobicContact CD2-CG1 4.44Å
167	V	95.3	Very high	92	Very high	16 Å²	16	53.6 Å²	53.6	10%	0.097	28%	0.275	C	S	.	.	H	α-helix	trans	-57.2	-47.5	178	166.1	0	0	0	0	111	A163 E164 K169 L170 E171 N476 F477	A163-V167 WeakPolarHBondContact O-CG2 3.19Å; A163-V167 PolarHBondContact O-N 3.37Å; E164-V167 PolarHBondContact O-N 2.93Å; E164-V167 VanDerWaalsContact O-N 3.11Å; V167-K169 PolarHBondContact O-N 3.49Å; V167-L170 PolarHBondContact O-N 3.17Å; V167-E171 WeakPolarHBondContact O-CB 3.19Å; V167-E171 PolarHBondContact O-N 3.32Å; V167-N476 HydrophobicContact CG1-CB 4.06Å; V167-F477 HydrophobicContact CB-CE2 4.39Å; V167-F477 HydrophobicContact CG1-CE2 3.92Å; V167-F477 HydrophobicContact CG1-CZ 4.13Å; V167-F477 HydrophobicContact CG2-CE2 4.36Å
168	E	95.3	Very high	91.3	Very high	92 Å²	92	52.3 Å²	52.3	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-58.9	-34.7	176.7	-70.4	-178.6	-176.3	0	0	112.8	E164 L166 K172	E164-E168 WeakPolarHBondContact O-CG 3.48Å; E164-E168 PolarHBondContact O-N 2.87Å; L166-E168 PolarHBondContact O-N 3.38Å; E168-K172 WeakPolarHBondContact O-CG 3.5Å; E168-K172 PolarHBondContact O-N 2.82Å
169	K	92.7	Very high	90.6	Very high	38 Å²	38	53.6 Å²	53.6	17%	0.165	28%	0.282	C	S	.	.	H	α-helix	trans	-73	-41.9	177.2	-78.4	176.2	176.5	167.7	0	112.2	I165 L166 V167 E171 K172 Q205 S206	I165-K169 HydrophobicContact CG2-CD 4.38Å; I165-K169 WeakPolarHBondContact O-CG 3.37Å; I165-K169 PolarHBondContact O-N 2.92Å; L166-K169 WeakPolarHBondContact O-CB 3.48Å; L166-K169 PolarHBondContact O-N 2.9Å; L166-K169 VanDerWaalsContact O-N 3.09Å; V167-K169 PolarHBondContact O-N 3.49Å; K169-E171 VanDerWaalsContact C-N 3.34Å; K169-K172 PolarHBondContact O-N 2.67Å; K169-Q205 HydrophobicContact CD-CB 4.32Å; K169-Q205 PolarHBondContact NZ-O 3.37Å; K169-S206 VanDerWaalsContact NZ-N 3.17Å; K169-S206 PolarHBondContact NZ-OG 3.31Å
170	L	91.4	Very high	89.6	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-65	-40.6	175.8	-65.4	178.3	0	0	0	110.5	L166 V167 K172 K173 A174 F179 C181 D184 I473 F477	L166-L170 HydrophobicContact CD1-CD1 4.21Å; L166-L170 HydrophobicContact CD1-CD2 4.46Å; L166-L170 HydrophobicContact CD1-CG 4.11Å; L166-L170 HydrophobicContact CG-CD1 4.05Å; L166-L170 HydrophobicContact CG-CG 4.34Å; L166-L170 WeakPolarHBondContact O-CG 3.37Å; L166-L170 PolarHBondContact O-N 3.05Å; V167-L170 PolarHBondContact O-N 3.17Å; L170-K172 VanDerWaalsContact C-N 3.3Å; L170-K172 PolarHBondContact O-N 2.89Å; L170-K173 CarbonylContact O-C 3.59Å; L170-K173 WeakPolarHBondContact O-CA 3.21Å; L170-K173 PolarHBondContact O-N 3.33Å; L170-A174 WeakPolarHBondContact O-CB 2.99Å; L170-A174 PolarHBondContact O-N 3.04Å; L170-F179 HydrophobicContact CD2-CE2 3.6Å; L170-F179 HydrophobicContact CD2-CZ 3.8Å; L170-C181 HydrophobicContact CD2-CB 3.99Å; L170-D184 HydrophobicContact CD2-CB 4.35Å; L170-I473 HydrophobicContact CD1-CD1 4.25Å; L170-I473 HydrophobicContact CD1-CG1 4.03Å; L170-F477 HydrophobicContact CB-CE2 3.84Å; L170-F477 HydrophobicContact CB-CZ 3.91Å; L170-F477 HydrophobicContact CD1-CE2 4.37Å
171	E	92.3	Very high	89	Confident	129 Å²	129	55.4 Å²	55.4	60%	0.603	29%	0.292	S	S	*	.	H	α-helix	trans	-57.5	-41.7	177.4	-169.5	179.9	-166	0	0	112.1	V167 K169 K173 A174 F477	V167-E171 WeakPolarHBondContact O-CB 3.19Å; V167-E171 PolarHBondContact O-N 3.32Å; K169-E171 VanDerWaalsContact C-N 3.34Å; E171-K173 PolarHBondContact O-N 3.24Å; E171-A174 PolarHBondContact O-N 3.41Å; E171-F477 HydrophobicContact CB-CE1 4.22Å; E171-F477 HydrophobicContact CB-CZ 3.97Å
172	K	91	Very high	88.3	Confident	136 Å²	136	54.3 Å²	54.3	59%	0.591	29%	0.286	S	S	*	.	H	α-helix	trans	-64.7	-23.8	176.8	-70.9	168.1	-172.7	166	0	113.5	E168 K169 L170 K176	E168-K172 WeakPolarHBondContact O-CG 3.5Å; E168-K172 PolarHBondContact O-N 2.82Å; K169-K172 PolarHBondContact O-N 2.67Å; L170-K172 VanDerWaalsContact C-N 3.3Å; L170-K172 PolarHBondContact O-N 2.89Å; K172-K176 WeakPolarHBondContact O-CD 3.36Å; K172-K176 VanDerWaalsContact O-CE 3.26Å; K172-K176 WeakPolarHBondContact O-CE 3.44Å; K172-K176 PolarHBondContact O-NZ 2.71Å
173	K	87.4	Confident	87.6	Confident	76 Å²	76	56.9 Å²	56.9	33%	0.33	31%	0.305	S	S	.	.	H	α-helix	trans	-98.1	-25	178.5	-62.3	179.8	-171	179.1	0	112.2	L170 E171 K176 F179 D184	L170-K173 CarbonylContact O-C 3.59Å; L170-K173 WeakPolarHBondContact O-CA 3.21Å; L170-K173 PolarHBondContact O-N 3.33Å; E171-K173 PolarHBondContact O-N 3.24Å; K173-K176 WeakPolarHBondContact O-CB 3.2Å; K173-K176 PolarHBondContact O-N 2.75Å; K173-F179 HydrophobicContact CB-CD1 3.9Å; K173-F179 HydrophobicContact CB-CD2 4.34Å; K173-F179 HydrophobicContact CB-CE1 3.63Å; K173-F179 HydrophobicContact CB-CE2 4.09Å; K173-F179 HydrophobicContact CB-CG 4.25Å; K173-F179 HydrophobicContact CB-CZ 3.73Å; K173-F179 HydrophobicContact CD-CD2 3.79Å; K173-F179 HydrophobicContact CD-CE2 3.8Å; K173-F179 HydrophobicContact CD-CG 4.28Å; K173-F179 HydrophobicContact CD-CZ 4.31Å; K173-D184 IonicContact NZ-OD1 3.15Å; K173-D184 PolarHBondContact NZ-OD1 3.23Å; K173-D184 IonicContact NZ-OD2 3.92Å; K173-D184 PolarHBondContact NZ-OD2 2.95Å
174	A	86.1	Confident	87.2	Confident	10 Å²	10	57.6 Å²	57.6	8%	0.083	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	141.3	-176.3	0	0	0	0	0	111.3	L170 E171 K176 F477 V504 P506	L170-A174 WeakPolarHBondContact O-CB 2.99Å; L170-A174 PolarHBondContact O-N 3.04Å; E171-A174 PolarHBondContact O-N 3.41Å; A174-K176 PolarHBondContact O-N 3.3Å; A174-F477 HydrophobicContact CB-CD1 4.26Å; A174-F477 HydrophobicContact CB-CE1 4.02Å; A174-V504 WeakPolarHBondContact CA-O 3.14Å; A174-P506 HydrophobicContact CB-CB 4.15Å; A174-P506 HydrophobicContact CB-CG 3.88Å
175	G	78.5	Confident	87	Confident	56 Å²	56	51.9 Å²	51.9	58%	0.577	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	-0.5	-179.7	0	0	0	0	0	115.7	V504	G175-V504 PolarHBondContact N-O 3.48Å
176	K	84.3	Confident	86.6	Confident	173 Å²	173	49.3 Å²	49.3	75%	0.752	27%	0.269	S	S	*	.	S	Bend	trans	-96.3	10.8	177.4	-61	178.4	-179.8	169.4	0	113.9	K172 K173 A174	K172-K176 WeakPolarHBondContact O-CD 3.36Å; K172-K176 VanDerWaalsContact O-CE 3.26Å; K172-K176 WeakPolarHBondContact O-CE 3.44Å; K172-K176 PolarHBondContact O-NZ 2.71Å; K173-K176 WeakPolarHBondContact O-CB 3.2Å; K173-K176 PolarHBondContact O-N 2.75Å; A174-K176 PolarHBondContact O-N 3.3Å
177	G	78.8	Confident	86.4	Confident	40 Å²	40	49.6 Å²	49.6	41%	0.412	27%	0.27	S	S	.	.	S	Bend	trans	110.6	-177.3	-175.6	0	0	0	0	0	112.9
178	S	77.2	Confident	86.4	Confident	71 Å²	71	48.8 Å²	48.8	50%	0.497	27%	0.265	S	S	.	.			trans	-70.2	137	177.8	60.8	0	0	0	0	111.4	C482 T503	S178-C482 WeakPolarHBondContact CB-SG 3.39Å; S178-T503 VanDerWaalsContact CA-OG1 3.29Å; S178-T503 WeakPolarHBondContact CA-OG1 3.04Å; S178-T503 WeakPolarHBondContact CB-OG1 3.33Å
179	F	78.8	Confident	86.3	Confident	31 Å²	31	44.4 Å²	44.4	14%	0.136	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-140.1	165.2	174.5	64.3	-88.4	0	0	0	111.3	L170 K173 C181 L502 V504	L170-F179 HydrophobicContact CD2-CE2 3.6Å; L170-F179 HydrophobicContact CD2-CZ 3.8Å; K173-F179 HydrophobicContact CB-CD1 3.9Å; K173-F179 HydrophobicContact CB-CD2 4.34Å; K173-F179 HydrophobicContact CB-CE1 3.63Å; K173-F179 HydrophobicContact CB-CE2 4.09Å; K173-F179 HydrophobicContact CB-CG 4.25Å; K173-F179 HydrophobicContact CB-CZ 3.73Å; K173-F179 HydrophobicContact CD-CD2 3.79Å; K173-F179 HydrophobicContact CD-CE2 3.8Å; K173-F179 HydrophobicContact CD-CG 4.28Å; K173-F179 HydrophobicContact CD-CZ 4.31Å; F179-C181 HydrophobicContact CD2-CB 4.27Å; F179-C181 HydrophobicContact CE2-CB 3.77Å; F179-L502 CarbonylContact C-O 3.43Å; F179-L502 PolarHBondContact N-O 3.43Å; F179-L502 VanDerWaalsContact N-O 3.16Å; F179-L502 CarbonylContact O-C 3.22Å; F179-L502 PolarHBondContact O-N 2.92Å; F179-V504 HydrophobicContact CE1-CB 3.78Å; F179-V504 HydrophobicContact CE1-CG2 3.98Å; F179-V504 HydrophobicContact CE2-CG2 4.32Å; F179-V504 HydrophobicContact CZ-CB 3.71Å; F179-V504 HydrophobicContact CZ-CG2 3.55Å
180	N	76.4	Confident	86.3	Confident	54 Å²	54	42.6 Å²	42.6	29%	0.289	24%	0.237	S	C	.	.			trans	-90.3	110.4	175.1	-176.8	-8.7	0	0	0	109.3	F182 T500	N180-F182 WeakPolarHBondContact OD1-CA 3.28Å; N180-F182 WeakPolarHBondContact OD1-CB 3.45Å; N180-F182 PolarHBondContact OD1-N 3.41Å; N180-T500 VanDerWaalsContact CG-O 3.26Å; N180-T500 PolarHBondContact OD1-O 2.91Å
181	C	82.6	Confident	86.5	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.02	24%	0.238	C	C	.	.			trans	-88.7	-1.6	176.3	75.6	0	0	0	0	113.6	L170 F179 S183 D184 V185 L502	L170-C181 HydrophobicContact CD2-CB 3.99Å; F179-C181 HydrophobicContact CD2-CB 4.27Å; F179-C181 HydrophobicContact CE2-CB 3.77Å; C181-S183 VanDerWaalsContact C-N 3.32Å; C181-S183 PolarHBondContact O-N 3.38Å; C181-D184 PolarHBondContact O-N 2.99Å; C181-D184 VanDerWaalsContact O-N 3.11Å; C181-V185 WeakPolarHBondContact O-CG2 3.48Å; C181-V185 PolarHBondContact O-N 3.06Å; C181-L502 WeakPolarHBondContact SG-CD1 3.5Å
182	F	81	Confident	86.6	Confident	30 Å²	30	36.6 Å²	36.6	13%	0.132	21%	0.209	C	C	.	.	H	α-helix	trans	-55.6	-48.4	179.2	-173.1	-86	0	0	0	111.7	N180 D184 V185 T186 N328 L497	N180-F182 WeakPolarHBondContact OD1-CA 3.28Å; N180-F182 WeakPolarHBondContact OD1-CB 3.45Å; N180-F182 PolarHBondContact OD1-N 3.41Å; F182-D184 VanDerWaalsContact C-N 3.33Å; F182-D184 PolarHBondContact O-N 3.2Å; F182-V185 PolarHBondContact O-N 3.32Å; F182-T186 WeakPolarHBondContact CE1-OG1 3.25Å; F182-T186 WeakPolarHBondContact O-CB 3.38Å; F182-T186 PolarHBondContact O-N 2.83Å; F182-T186 PolarHBondContact O-OG1 3.49Å; F182-N328 WeakPolarHBondContact CA-OD1 3.26Å; F182-N328 HydrophobicContact CD2-CB 3.53Å; F182-N328 WeakPolarHBondContact CD2-ND2 3.43Å; F182-N328 HydrophobicContact CE2-CB 3.77Å; F182-N328 WeakPolarHBondContact CE2-ND2 3.43Å; F182-N328 PolarHBondContact O-ND2 3.19Å; F182-L497 HydrophobicContact CD2-CB 4.02Å; F182-L497 HydrophobicContact CD2-CD1 3.67Å; F182-L497 HydrophobicContact CD2-CG 4.21Å; F182-L497 HydrophobicContact CE2-CB 3.93Å; F182-L497 HydrophobicContact CE2-CD1 3.68Å; F182-L497 HydrophobicContact CE2-CG 3.9Å
183	S	83	Confident	86.6	Confident	59 Å²	59	30.5 Å²	30.5	41%	0.413	18%	0.183	S	C	.	.	H	α-helix	trans	-63	-40.7	178.4	-171.9	0	0	0	0	111.3	C181 T186 L187	C181-S183 VanDerWaalsContact C-N 3.32Å; C181-S183 PolarHBondContact O-N 3.38Å; S183-T186 PolarHBondContact O-N 2.86Å; S183-L187 WeakPolarHBondContact O-CB 3.35Å; S183-L187 WeakPolarHBondContact O-CD1 3.2Å; S183-L187 WeakPolarHBondContact O-CG 3.44Å; S183-L187 PolarHBondContact O-N 3.5Å
184	D	90.4	Very high	86.8	Confident	17 Å²	17	26.9 Å²	26.9	9%	0.091	17%	0.167	C	C	.	.	H	α-helix	trans	-65.3	-45.3	-179.2	-60.6	-54.4	0	0	0	111.1	L166 L170 K173 C181 F182 L187 C188	L166-D184 HydrophobicContact CD1-CB 3.65Å; L170-D184 HydrophobicContact CD2-CB 4.35Å; K173-D184 IonicContact NZ-OD1 3.15Å; K173-D184 PolarHBondContact NZ-OD1 3.23Å; K173-D184 IonicContact NZ-OD2 3.92Å; K173-D184 PolarHBondContact NZ-OD2 2.95Å; C181-D184 PolarHBondContact O-N 2.99Å; C181-D184 VanDerWaalsContact O-N 3.11Å; F182-D184 VanDerWaalsContact C-N 3.33Å; F182-D184 PolarHBondContact O-N 3.2Å; D184-L187 PolarHBondContact O-N 2.89Å; D184-C188 PolarHBondContact O-N 2.87Å
185	V	90.7	Very high	87	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.2	-40.5	176.9	174.3	0	0	0	0	111.4	L166 C181 F182 C188 A189 M327 L331	L166-V185 HydrophobicContact CD2-CG2 4.32Å; C181-V185 WeakPolarHBondContact O-CG2 3.48Å; C181-V185 PolarHBondContact O-N 3.06Å; F182-V185 PolarHBondContact O-N 3.32Å; V185-C188 WeakPolarHBondContact O-CB 3.33Å; V185-C188 PolarHBondContact O-N 3.31Å; V185-A189 PolarHBondContact O-N 3.25Å; V185-M327 HydrophobicContact CG1-CB 3.71Å; V185-M327 HydrophobicContact CG1-CE 3.83Å; V185-M327 HydrophobicContact CG1-SD 4.26Å; V185-L331 HydrophobicContact CG2-CD1 3.88Å
186	T	89	Confident	87.6	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.012	14%	0.141	C	C	.	.	H	α-helix	trans	-66.9	-41.1	179.8	-50.5	0	0	0	0	111.8	F182 S183 C188 A189 L190 Y217 A324	F182-T186 WeakPolarHBondContact CE1-OG1 3.25Å; F182-T186 WeakPolarHBondContact O-CB 3.38Å; F182-T186 PolarHBondContact O-N 2.83Å; F182-T186 PolarHBondContact O-OG1 3.49Å; S183-T186 PolarHBondContact O-N 2.86Å; T186-C188 VanDerWaalsContact C-N 3.31Å; T186-C188 PolarHBondContact O-N 2.96Å; T186-A189 PolarHBondContact O-N 2.77Å; T186-L190 WeakPolarHBondContact O-CB 3.36Å; T186-L190 PolarHBondContact O-N 3.43Å; T186-Y217 HydrophobicContact CG2-CE1 4.05Å; T186-Y217 WeakPolarHBondContact CG2-OH 3.37Å; T186-A324 HydrophobicContact CG2-CB 3.84Å
187	L	92.1	Very high	87.6	Confident	6 Å²	6	16.7 Å²	16.7	3%	0.031	11%	0.106	C	C	.	.	H	α-helix	trans	-67.4	-32.9	175.5	-65	168.5	0	0	0	112	S183 D184 L190 D191 A204 Q205 V213	S183-L187 WeakPolarHBondContact O-CB 3.35Å; S183-L187 WeakPolarHBondContact O-CD1 3.2Å; S183-L187 WeakPolarHBondContact O-CG 3.44Å; S183-L187 PolarHBondContact O-N 3.5Å; D184-L187 PolarHBondContact O-N 2.89Å; L187-L190 PolarHBondContact O-N 2.92Å; L187-D191 PolarHBondContact O-N 3.49Å; L187-A204 HydrophobicContact CD2-CB 4.12Å; L187-Q205 HydrophobicContact CB-CB 4.46Å; L187-Q205 HydrophobicContact CB-CG 4.02Å; L187-V213 HydrophobicContact CD2-CG1 3.87Å
188	C	95.6	Very high	87.9	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.6	-50.2	172.5	-176.9	0	0	0	0	111.3	Q162 L166 D184 V185 T186 L190 D191 I192 Q205	Q162-C188 PolarHBondContact O-SG 3.47Å; Q162-C188 VanDerWaalsContact O-SG 3.41Å; L166-C188 HydrophobicContact CB-CB 4.24Å; L166-C188 HydrophobicContact CD1-CB 4.43Å; L166-C188 HydrophobicContact CD2-CB 3.92Å; L166-C188 HydrophobicContact CG-CB 4.43Å; D184-C188 PolarHBondContact O-N 2.87Å; V185-C188 WeakPolarHBondContact O-CB 3.33Å; V185-C188 PolarHBondContact O-N 3.31Å; T186-C188 VanDerWaalsContact C-N 3.31Å; T186-C188 PolarHBondContact O-N 2.96Å; C188-L190 VanDerWaalsContact C-N 3.27Å; C188-L190 PolarHBondContact O-N 3.14Å; C188-D191 PolarHBondContact O-N 3.08Å; C188-I192 VanDerWaalsContact O-CG1 3.32Å; C188-I192 WeakPolarHBondContact O-CG1 3.38Å; C188-I192 PolarHBondContact O-N 2.91Å; C188-Q205 HydrophobicContact CB-CG 4.28Å
189	A	93.8	Very high	88.2	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-58.8	-39.5	176.2	0	0	0	0	0	112.1	V185 T186 I192 I193 H320 A324 M327 E465	V185-A189 PolarHBondContact O-N 3.25Å; T186-A189 PolarHBondContact O-N 2.77Å; A189-I192 PolarHBondContact O-N 2.89Å; A189-I193 PolarHBondContact O-N 3.39Å; A189-H320 HydrophobicContact CB-CB 4.12Å; A189-A324 HydrophobicContact CB-CB 4.05Å; A189-M327 HydrophobicContact CB-CE 3.95Å; A189-E465 WeakPolarHBondContact CA-OE1 3.15Å; A189-E465 WeakPolarHBondContact CB-OE1 3.42Å
190	L	92.3	Very high	88.5	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-65	-43.9	177.2	-177.5	59.6	0	0	0	112.4	T186 L187 C188 I192 I193 C194 I202 A204 V213 H320	T186-L190 WeakPolarHBondContact O-CB 3.36Å; T186-L190 PolarHBondContact O-N 3.43Å; L187-L190 PolarHBondContact O-N 2.92Å; C188-L190 VanDerWaalsContact C-N 3.27Å; C188-L190 PolarHBondContact O-N 3.14Å; L190-I192 VanDerWaalsContact C-N 3.35Å; L190-I193 HydrophobicContact CD1-CG2 4.24Å; L190-I193 WeakPolarHBondContact O-CG2 3.42Å; L190-I193 PolarHBondContact O-N 3.37Å; L190-C194 VanDerWaalsContact O-CB 3.3Å; L190-C194 WeakPolarHBondContact O-CB 3.12Å; L190-C194 PolarHBondContact O-N 2.94Å; L190-C194 PolarHBondContact O-SG 2.81Å; L190-C194 VanDerWaalsContact O-SG 3.38Å; L190-I202 HydrophobicContact CD2-CD1 4.23Å; L190-I202 HydrophobicContact CG-CD1 4.02Å; L190-A204 HydrophobicContact CB-CB 4.49Å; L190-A204 HydrophobicContact CD2-CB 4.01Å; L190-A204 HydrophobicContact CG-CB 4.27Å; L190-V213 HydrophobicContact CD2-CG1 4.35Å; L190-V213 HydrophobicContact CD2-CG2 3.83Å; L190-H320 HydrophobicContact CB-CB 4.2Å; L190-H320 HydrophobicContact CD1-CB 4.33Å
191	D	94.6	Very high	89	Confident	4 Å²	4	15.8 Å²	15.8	2%	0.021	8%	0.083	C	C	.	.	H	α-helix	trans	-63.6	-40	173.8	-90.9	-33.1	0	0	0	111.6	Q162 L187 C188 C194 E195 I202 Y203 A204 Q205	Q162-D191 HydrophobicContact CG-CB 4.29Å; L187-D191 PolarHBondContact O-N 3.49Å; C188-D191 PolarHBondContact O-N 3.08Å; D191-C194 PolarHBondContact O-N 3.43Å; D191-E195 WeakPolarHBondContact O-CB 3.37Å; D191-E195 PolarHBondContact O-N 3.04Å; D191-I202 VanDerWaalsContact OD1-CG1 3.23Å; D191-I202 WeakPolarHBondContact OD1-CG1 3.31Å; D191-Y203 WeakPolarHBondContact OD1-CA 3.34Å; D191-Y203 PolarHBondContact OD1-N 3.16Å; D191-A204 VanDerWaalsContact CG-N 3.29Å; D191-A204 PolarHBondContact OD1-N 3.19Å; D191-A204 PolarHBondContact OD2-N 3.06Å; D191-Q205 WeakPolarHBondContact OD2-CG 3.32Å; D191-Q205 PolarHBondContact OD2-N 3.42Å
192	I	95.1	Very high	89.1	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-60.3	-50.8	176.3	-70.5	170.9	0	0	0	110.7	M159 Q162 C188 A189 L190 E195 T196 F461 E465 V469	M159-I192 HydrophobicContact CG-CD1 4.48Å; M159-I192 HydrophobicContact CG-CG2 3.88Å; Q162-I192 HydrophobicContact CB-CD1 4.06Å; Q162-I192 HydrophobicContact CB-CG1 3.45Å; Q162-I192 VanDerWaalsContact CB-CG1 3.45Å; Q162-I192 HydrophobicContact CG-CG1 3.76Å; C188-I192 VanDerWaalsContact O-CG1 3.32Å; C188-I192 WeakPolarHBondContact O-CG1 3.38Å; C188-I192 PolarHBondContact O-N 2.91Å; A189-I192 PolarHBondContact O-N 2.89Å; L190-I192 VanDerWaalsContact C-N 3.35Å; I192-E195 PolarHBondContact O-N 3.5Å; I192-T196 HydrophobicContact CG2-CG2 4.35Å; I192-T196 WeakPolarHBondContact O-CB 3.23Å; I192-T196 VanDerWaalsContact O-CG2 3.28Å; I192-T196 WeakPolarHBondContact O-CG2 3.29Å; I192-T196 PolarHBondContact O-N 3.44Å; I192-T196 PolarHBondContact O-OG1 3.35Å; I192-F461 HydrophobicContact CG2-CE1 4.45Å; I192-F461 HydrophobicContact CG2-CZ 3.94Å; I192-E465 HydrophobicContact CD1-CG 3.91Å; I192-E465 HydrophobicContact CG2-CG 4.26Å; I192-V469 HydrophobicContact CD1-CG2 4.01Å
193	I	92.2	Very high	89.6	Confident	9 Å²	9	22.3 Å²	22.3	5%	0.046	11%	0.109	C	C	.	.	H	α-helix	trans	-69.2	-37.5	-178.7	-164.6	63.2	0	0	0	111.5	A189 L190 E195 T196 A197 F315 H320 F461	A189-I193 PolarHBondContact O-N 3.39Å; L190-I193 HydrophobicContact CD1-CG2 4.24Å; L190-I193 WeakPolarHBondContact O-CG2 3.42Å; L190-I193 PolarHBondContact O-N 3.37Å; I193-E195 PolarHBondContact O-N 3.05Å; I193-T196 PolarHBondContact O-OG1 3.27Å; I193-A197 HydrophobicContact CD1-CB 4.07Å; I193-A197 HydrophobicContact CG1-CB 4.19Å; I193-A197 WeakPolarHBondContact O-CA 3.39Å; I193-A197 WeakPolarHBondContact O-CB 3.13Å; I193-A197 PolarHBondContact O-N 2.97Å; I193-F315 WeakPolarHBondContact CG1-O 3.44Å; I193-H320 HydrophobicContact CG2-CB 3.8Å; I193-F461 HydrophobicContact CD1-CE1 4.17Å; I193-F461 HydrophobicContact CD1-CZ 4.15Å
194	C	90.6	Very high	89.8	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-64.9	-39.9	177	-78.6	0	0	0	0	112	L190 D191 M198 G199 R200 I202	L190-C194 VanDerWaalsContact O-CB 3.3Å; L190-C194 WeakPolarHBondContact O-CB 3.12Å; L190-C194 PolarHBondContact O-N 2.94Å; L190-C194 PolarHBondContact O-SG 2.81Å; L190-C194 VanDerWaalsContact O-SG 3.38Å; D191-C194 PolarHBondContact O-N 3.43Å; C194-M198 HydrophobicContact CB-CE 3.73Å; C194-M198 WeakPolarHBondContact O-CA 3.22Å; C194-M198 VanDerWaalsContact O-CB 3.26Å; C194-M198 WeakPolarHBondContact O-CB 3.11Å; C194-M198 PolarHBondContact O-N 3.07Å; C194-M198 VanDerWaalsContact O-N 3.08Å; C194-M198 WeakPolarHBondContact SG-CE 3.32Å; C194-G199 PolarHBondContact O-N 2.96Å; C194-R200 CarbonylContact C-O 3.51Å; C194-R200 VanDerWaalsContact C-O 3.32Å; C194-R200 PolarHBondContact O-N 3.41Å; C194-I202 HydrophobicContact CB-CD1 4.11Å; C194-I202 HydrophobicContact CB-CG1 3.98Å; C194-I202 HydrophobicContact CB-CG2 4.09Å; C194-I202 VanDerWaalsContact SG-CD1 3.52Å
195	E	91.3	Very high	89.9	Confident	18 Å²	18	19.5 Å²	19.5	8%	0.084	9%	0.089	C	C	.	.	H	α-helix	trans	-75.5	-41.3	178.2	-175.1	171.7	175.1	0	0	112.2	V158 Q162 D191 I192 I193 G199 R200 K201 R285	V158-E195 HydrophobicContact CB-CG 4.48Å; V158-E195 HydrophobicContact CG1-CB 3.68Å; V158-E195 HydrophobicContact CG1-CG 3.65Å; V158-E195 HydrophobicContact CG2-CG 3.95Å; Q162-E195 PolarHBondContact NE2-OE2 2.85Å; D191-E195 WeakPolarHBondContact O-CB 3.37Å; D191-E195 PolarHBondContact O-N 3.04Å; I192-E195 PolarHBondContact O-N 3.5Å; I193-E195 PolarHBondContact O-N 3.05Å; E195-G199 WeakPolarHBondContact O-CA 3.1Å; E195-G199 PolarHBondContact O-N 3.06Å; E195-R200 PolarHBondContact N-O 2.92Å; E195-K201 VanDerWaalsContact CD-CE 3.44Å; E195-K201 HydrophobicContact CG-CG 4.42Å; E195-K201 WeakPolarHBondContact OE1-CE 3.49Å; E195-K201 IonicContact OE1-NZ 3.85Å; E195-K201 VanDerWaalsContact OE2-CE 3.29Å; E195-K201 WeakPolarHBondContact OE2-CE 3.45Å; E195-K201 IonicContact OE2-NZ 3.62Å; E195-R285 IonicContact OE1-NH1 3.23Å; E195-R285 PolarHBondContact OE1-NH1 3.04Å; E195-R285 VanDerWaalsContact OE1-NH1 3.13Å
196	T	89.6	Confident	89.8	Confident	3 Å²	3	23.7 Å²	23.7	2%	0.018	12%	0.119	C	C	.	.	H	α-helix	trans	-75.2	-39.6	179.4	56.7	0	0	0	0	113.1	F155 V158 I192 I193 A287 F288 F461	F155-T196 HydrophobicContact CB-CG2 3.74Å; F155-T196 HydrophobicContact CD1-CG2 3.74Å; F155-T196 HydrophobicContact CG-CG2 3.82Å; V158-T196 HydrophobicContact CB-CG2 3.83Å; V158-T196 HydrophobicContact CG1-CG2 3.74Å; V158-T196 HydrophobicContact CG2-CG2 4.23Å; I192-T196 HydrophobicContact CG2-CG2 4.35Å; I192-T196 WeakPolarHBondContact O-CB 3.23Å; I192-T196 VanDerWaalsContact O-CG2 3.28Å; I192-T196 WeakPolarHBondContact O-CG2 3.29Å; I192-T196 PolarHBondContact O-N 3.44Å; I192-T196 PolarHBondContact O-OG1 3.35Å; I193-T196 PolarHBondContact O-OG1 3.27Å; T196-A287 WeakPolarHBondContact O-CA 3.44Å; T196-F288 PolarHBondContact O-N 3.43Å; T196-F461 HydrophobicContact CG2-CE2 4.11Å; T196-F461 HydrophobicContact CG2-CZ 4.28Å; T196-F461 WeakPolarHBondContact OG1-CZ 3.15Å
197	A	85.8	Confident	89.7	Confident	4 Å²	4	27.6 Å²	27.6	3%	0.033	14%	0.139	C	C	.	.	H	α-helix	trans	-83.5	-47.7	-176.9	0	0	0	0	0	112.6	I193 F288 L289	I193-A197 HydrophobicContact CD1-CB 4.07Å; I193-A197 HydrophobicContact CG1-CB 4.19Å; I193-A197 WeakPolarHBondContact O-CA 3.39Å; I193-A197 WeakPolarHBondContact O-CB 3.13Å; I193-A197 PolarHBondContact O-N 2.97Å; A197-F288 HydrophobicContact CB-CB 4.29Å; A197-F288 WeakPolarHBondContact O-CB 3.47Å; A197-F288 PolarHBondContact O-N 3.47Å; A197-L289 WeakPolarHBondContact O-CB 3.03Å; A197-L289 PolarHBondContact O-N 3.02Å
198	M	84.1	Confident	89.2	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-99.3	-13.7	-176.4	-74.4	-175.3	-69.7	0	0	114	C194 R200 F257 T258 V261 V312 M316	C194-M198 HydrophobicContact CB-CE 3.73Å; C194-M198 WeakPolarHBondContact O-CA 3.22Å; C194-M198 VanDerWaalsContact O-CB 3.26Å; C194-M198 WeakPolarHBondContact O-CB 3.11Å; C194-M198 PolarHBondContact O-N 3.07Å; C194-M198 VanDerWaalsContact O-N 3.08Å; C194-M198 WeakPolarHBondContact SG-CE 3.32Å; M198-R200 HydrophobicContact CB-CB 4.44Å; M198-R200 PolarHBondContact O-N 2.89Å; M198-F257 HydrophobicContact CE-CE1 3.84Å; M198-F257 HydrophobicContact SD-CE1 3.91Å; M198-T258 HydrophobicContact SD-CG2 4.48Å; M198-V261 HydrophobicContact CB-CG1 3.83Å; M198-V261 HydrophobicContact CG-CG1 4.02Å; M198-V261 HydrophobicContact SD-CB 4.31Å; M198-V261 HydrophobicContact SD-CG1 3.95Å; M198-V261 HydrophobicContact SD-CG2 4.18Å; M198-V312 HydrophobicContact CG-CG1 3.79Å; M198-V312 HydrophobicContact SD-CG1 4.13Å; M198-M316 HydrophobicContact CE-CG 3.91Å; M198-M316 HydrophobicContact CE-SD 3.31Å; M198-M316 WeakPolarHBondContact CE-SD 3.23Å; M198-M316 HydrophobicContact CG-SD 4.3Å; M198-M316 HydrophobicContact SD-CG 4.25Å; M198-M316 HydrophobicContact SD-SD 3.33Å
199	G	83.8	Confident	88.6	Confident	20 Å²	20	35.2 Å²	35.2	21%	0.206	18%	0.18	C	C	.	.	S	Bend	trans	71.3	16.9	-171.9	0	0	0	0	0	113	C194 E195 R265	C194-G199 PolarHBondContact O-N 2.96Å; E195-G199 WeakPolarHBondContact O-CA 3.1Å; E195-G199 PolarHBondContact O-N 3.06Å; G199-R265 PolarHBondContact O-NH2 3.14Å
200	R	84.3	Confident	88.2	Confident	72 Å²	72	36.4 Å²	36.4	27%	0.272	19%	0.188	S	C	.	.			trans	-118.9	125.8	-175.1	-171.3	170.6	-173.1	146.2	14.8	110.9	C194 E195 M198 I202 E264	C194-R200 CarbonylContact C-O 3.51Å; C194-R200 VanDerWaalsContact C-O 3.32Å; C194-R200 PolarHBondContact O-N 3.41Å; E195-R200 PolarHBondContact N-O 2.92Å; M198-R200 HydrophobicContact CB-CB 4.44Å; M198-R200 PolarHBondContact O-N 2.89Å; R200-I202 HydrophobicContact CG-CG2 4.36Å; R200-I202 PolarHBondContact O-N 3.33Å; R200-E264 IonicContact CZ-OE2 2.67Å; R200-E264 IonicContact NH1-OE1 2.74Å; R200-E264 IonicContact NH1-OE2 3.7Å; R200-E264 PolarHBondContact NH1-OE2 3.08Å; R200-E264 IonicContact NH2-OE2 3.89Å
201	K	86.7	Confident	88	Confident	84 Å²	84	42.5 Å²	42.5	37%	0.365	22%	0.217	S	C	.	.			trans	-74.9	115.5	166.4	-60.5	-167.5	177.1	-155.9	0	108.3	E161 E195 Y203	E161-K201 IonicContact OE2-NZ 3.55Å; E195-K201 VanDerWaalsContact CD-CE 3.44Å; E195-K201 HydrophobicContact CG-CG 4.42Å; E195-K201 WeakPolarHBondContact OE1-CE 3.49Å; E195-K201 IonicContact OE1-NZ 3.85Å; E195-K201 VanDerWaalsContact OE2-CE 3.29Å; E195-K201 WeakPolarHBondContact OE2-CE 3.45Å; E195-K201 IonicContact OE2-NZ 3.62Å; K201-Y203 HydrophobicContact CB-CD1 4.49Å; K201-Y203 HydrophobicContact CB-CD2 4.43Å; K201-Y203 HydrophobicContact CB-CE1 4.01Å; K201-Y203 HydrophobicContact CB-CE2 3.94Å; K201-Y203 HydrophobicContact CD-CE1 4.24Å
202	I	85.8	Confident	87.7	Confident	27 Å²	27	43 Å²	43	14%	0.138	22%	0.219	C	C	.	.			trans	-98.4	-13	175.8	65.6	163.1	0	0	0	112.1	L190 D191 C194 R200 A204 Y212 F257	L190-I202 HydrophobicContact CD2-CD1 4.23Å; L190-I202 HydrophobicContact CG-CD1 4.02Å; D191-I202 VanDerWaalsContact OD1-CG1 3.23Å; D191-I202 WeakPolarHBondContact OD1-CG1 3.31Å; C194-I202 HydrophobicContact CB-CD1 4.11Å; C194-I202 HydrophobicContact CB-CG1 3.98Å; C194-I202 HydrophobicContact CB-CG2 4.09Å; C194-I202 VanDerWaalsContact SG-CD1 3.52Å; R200-I202 HydrophobicContact CG-CG2 4.36Å; R200-I202 PolarHBondContact O-N 3.33Å; I202-A204 HydrophobicContact CD1-CB 3.83Å; I202-A204 HydrophobicContact CG1-CB 4Å; I202-A204 PolarHBondContact O-N 2.93Å; I202-Y212 HydrophobicContact CD1-CD1 4.05Å; I202-Y212 HydrophobicContact CD1-CE1 3.93Å; I202-F257 HydrophobicContact CG2-CE1 4.4Å; I202-F257 HydrophobicContact CG2-CE2 4.45Å; I202-F257 HydrophobicContact CG2-CZ 3.62Å
203	Y	90.4	Very high	87.2	Confident	144 Å²	144	43.1 Å²	43.1	57%	0.565	22%	0.219	S	C	*	.			trans	59.1	36.5	178.5	-51.4	-78.4	0	0	0	112.2	D191 K201 Q205 S206 D207	D191-Y203 WeakPolarHBondContact OD1-CA 3.34Å; D191-Y203 PolarHBondContact OD1-N 3.16Å; K201-Y203 HydrophobicContact CB-CD1 4.49Å; K201-Y203 HydrophobicContact CB-CD2 4.43Å; K201-Y203 HydrophobicContact CB-CE1 4.01Å; K201-Y203 HydrophobicContact CB-CE2 3.94Å; K201-Y203 HydrophobicContact CD-CE1 4.24Å; Y203-Q205 PolarHBondContact O-N 3.33Å; Y203-S206 PolarHBondContact O-N 3.22Å; Y203-D207 PolarHBondContact O-N 2.96Å
204	A	88	Confident	87	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-37.6	-178.5	0	0	0	0	0	111.9	L187 L190 D191 I202 S206 D207 S208 V213	L187-A204 HydrophobicContact CD2-CB 4.12Å; L190-A204 HydrophobicContact CB-CB 4.49Å; L190-A204 HydrophobicContact CD2-CB 4.01Å; L190-A204 HydrophobicContact CG-CB 4.27Å; D191-A204 VanDerWaalsContact CG-N 3.29Å; D191-A204 PolarHBondContact OD1-N 3.19Å; D191-A204 PolarHBondContact OD2-N 3.06Å; I202-A204 HydrophobicContact CD1-CB 3.83Å; I202-A204 HydrophobicContact CG1-CB 4Å; I202-A204 PolarHBondContact O-N 2.93Å; A204-S206 PolarHBondContact O-N 3.33Å; A204-D207 CarbonylContact O-C 3.43Å; A204-S208 PolarHBondContact O-N 2.84Å; A204-V213 HydrophobicContact CB-CG2 3.95Å
205	Q	91.4	Very high	87.1	Confident	16 Å²	16	47.8 Å²	47.8	8%	0.075	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-32.8	176.3	-65.6	-172.8	69.9	0	0	111.7	Q162 I165 K169 L187 C188 D191 Y203	Q162-Q205 PolarHBondContact O-NE2 3.21Å; Q162-Q205 VanDerWaalsContact O-NE2 3.1Å; Q162-Q205 VanDerWaalsContact OE1-NE2 3.11Å; I165-Q205 HydrophobicContact CG2-CB 4.38Å; K169-Q205 HydrophobicContact CD-CB 4.32Å; K169-Q205 PolarHBondContact NZ-O 3.37Å; L187-Q205 HydrophobicContact CB-CB 4.46Å; L187-Q205 HydrophobicContact CB-CG 4.02Å; C188-Q205 HydrophobicContact CB-CG 4.28Å; D191-Q205 WeakPolarHBondContact OD2-CG 3.32Å; D191-Q205 PolarHBondContact OD2-N 3.42Å; Y203-Q205 PolarHBondContact O-N 3.33Å
206	S	89.3	Confident	86.8	Confident	89 Å²	89	47.1 Å²	47.1	62%	0.622	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-30.3	-173.7	-63.5	0	0	0	0	113.2	K169 Y203 A204	K169-S206 VanDerWaalsContact NZ-N 3.17Å; K169-S206 PolarHBondContact NZ-OG 3.31Å; Y203-S206 PolarHBondContact O-N 3.22Å; A204-S206 PolarHBondContact O-N 3.33Å
207	D	87.4	Confident	86.5	Confident	84 Å²	84	49.1 Å²	49.1	45%	0.449	25%	0.245	S	C	.	.			trans	-124.7	74.8	174.1	-175.9	14.1	0	0	0	110.3	Y203 A204 E209 S210	Y203-D207 PolarHBondContact O-N 2.96Å; A204-D207 CarbonylContact O-C 3.43Å; D207-E209 PolarHBondContact O-N 3.5Å; D207-E209 PolarHBondContact OD1-N 2.63Å; D207-S210 WeakPolarHBondContact O-CB 3.5Å; D207-S210 PolarHBondContact O-N 3.44Å; D207-S210 PolarHBondContact O-OG 2.87Å; D207-S210 PolarHBondContact OD1-N 3.24Å
208	S	81.9	Confident	86.6	Confident	47 Å²	47	53.7 Å²	53.7	33%	0.329	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.3	176.8	64.1	0	0	0	0	112.9	A204	A204-S208 PolarHBondContact O-N 2.84Å
209	E	82	Confident	86.9	Confident	118 Å²	118	53.7 Å²	53.7	55%	0.551	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	0.3	-176	-67.4	-59	112.7	0	0	113.2	D207 K214	D207-E209 PolarHBondContact O-N 3.5Å; D207-E209 PolarHBondContact OD1-N 2.63Å; E209-K214 WeakPolarHBondContact O-CD 3.35Å; E209-K214 WeakPolarHBondContact O-CE 3.33Å; E209-K214 PolarHBondContact O-NZ 3.45Å; E209-K214 WeakPolarHBondContact OE2-CE 3.5Å; E209-K214 IonicContact OE2-NZ 2.66Å; E209-K214 PolarHBondContact OE2-NZ 2.98Å
210	S	86.6	Confident	87	Confident	25 Å²	25	53 Å²	53	18%	0.175	25%	0.253	C	S	.	.			trans	-55	143.8	176.7	69.3	0	0	0	0	111.5	D207 Y212 V213 K214	D207-S210 WeakPolarHBondContact O-CB 3.5Å; D207-S210 PolarHBondContact O-N 3.44Å; D207-S210 PolarHBondContact O-OG 2.87Å; D207-S210 PolarHBondContact OD1-N 3.24Å; S210-Y212 PolarHBondContact O-N 3.01Å; S210-V213 PolarHBondContact O-N 2.89Å; S210-V213 WeakPolarHBondContact OG-CB 3.22Å; S210-V213 WeakPolarHBondContact OG-CG2 3.22Å; S210-K214 PolarHBondContact O-N 2.75Å
211	E	87.8	Confident	87	Confident	128 Å²	128	51.7 Å²	51.7	60%	0.598	25%	0.251	S	S	*	.	H	α-helix	trans	-59.9	-36.2	-174.4	-168.4	178.3	-159.2	0	0	111.9	C215 I253	E211-C215 WeakPolarHBondContact O-CB 3.35Å; E211-C215 PolarHBondContact O-N 3.28Å; E211-C215 PolarHBondContact O-SG 3.11Å; E211-I253 HydrophobicContact CG-CD1 4.17Å; E211-I253 HydrophobicContact CG-CG2 4.19Å; E211-I253 WeakPolarHBondContact OE1-CD1 3.39Å
212	Y	87.1	Confident	87.2	Confident	16 Å²	16	47.8 Å²	47.8	6%	0.063	24%	0.235	C	C	.	.	H	α-helix	trans	-63.8	-50.4	177.5	174.9	-97.7	0	0	0	112.1	I202 S210 K214 C215 V216 L254 F257 M316	I202-Y212 HydrophobicContact CD1-CD1 4.05Å; I202-Y212 HydrophobicContact CD1-CE1 3.93Å; S210-Y212 PolarHBondContact O-N 3.01Å; Y212-K214 VanDerWaalsContact C-N 3.33Å; Y212-K214 PolarHBondContact O-N 2.98Å; Y212-C215 PolarHBondContact O-N 2.98Å; Y212-V216 HydrophobicContact CD1-CG2 4.41Å; Y212-V216 HydrophobicContact CE1-CG2 3.97Å; Y212-V216 HydrophobicContact CE2-CG2 4.24Å; Y212-V216 WeakPolarHBondContact O-CG2 3.32Å; Y212-V216 PolarHBondContact O-N 3.39Å; Y212-L254 HydrophobicContact CD2-CD2 3.98Å; Y212-L254 HydrophobicContact CE2-CD2 3.89Å; Y212-F257 HydrophobicContact CD2-CB 3.75Å; Y212-F257 AromaticContact CD2-CD1 3.57Å; Y212-F257 HydrophobicContact CD2-CD1 3.57Å; Y212-F257 HydrophobicContact CD2-CD2 4.07Å; Y212-F257 HydrophobicContact CD2-CE1 4.19Å; Y212-F257 AromaticContact CD2-CG 3.5Å; Y212-F257 HydrophobicContact CD2-CG 3.5Å; Y212-F257 HydrophobicContact CE1-CE1 4.38Å; Y212-F257 HydrophobicContact CE2-CB 4.05Å; Y212-F257 AromaticContact CE2-CD1 3.28Å; Y212-F257 HydrophobicContact CE2-CD1 3.28Å; Y212-F257 AromaticContact CE2-CE1 3.85Å; Y212-F257 HydrophobicContact CE2-CE1 3.85Å; Y212-F257 AromaticContact CE2-CG 3.73Å; Y212-F257 HydrophobicContact CE2-CG 3.73Å; Y212-F257 HydrophobicContact CG-CD1 4.33Å; Y212-F257 HydrophobicContact CG-CD2 4.36Å; Y212-F257 HydrophobicContact CG-CG 4.22Å; Y212-F257 AromaticContact CZ-CD1 3.86Å; Y212-F257 AromaticContact CZ-CE1 3.95Å; Y212-M316 HydrophobicContact CE2-CE 4.1Å; Y212-M316 WeakPolarHBondContact OH-CE 3.42Å; Y212-M316 PolarHBondContact OH-SD 3.1Å
213	V	85.4	Confident	87.4	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-57.9	-46.8	179.5	172.3	0	0	0	0	110.7	L187 L190 A204 S210 C215 V216 Y217	L187-V213 HydrophobicContact CD2-CG1 3.87Å; L190-V213 HydrophobicContact CD2-CG1 4.35Å; L190-V213 HydrophobicContact CD2-CG2 3.83Å; A204-V213 HydrophobicContact CB-CG2 3.95Å; S210-V213 PolarHBondContact O-N 2.89Å; S210-V213 WeakPolarHBondContact OG-CB 3.22Å; S210-V213 WeakPolarHBondContact OG-CG2 3.22Å; V213-C215 VanDerWaalsContact C-N 3.3Å; V213-C215 PolarHBondContact O-N 2.92Å; V213-V216 PolarHBondContact O-N 3.17Å; V213-Y217 HydrophobicContact CG1-CD2 4.03Å; V213-Y217 HydrophobicContact CG1-CE2 3.56Å; V213-Y217 WeakPolarHBondContact O-CD2 3.33Å; V213-Y217 PolarHBondContact O-N 3.23Å
214	K	88.6	Confident	87.1	Confident	97 Å²	97	40.4 Å²	40.4	42%	0.422	21%	0.206	S	C	.	.	H	α-helix	trans	-59.7	-39.9	175.7	-74.6	172.1	173.3	156.1	0	112.8	E209 S210 Y212 R218	E209-K214 WeakPolarHBondContact O-CD 3.35Å; E209-K214 WeakPolarHBondContact O-CE 3.33Å; E209-K214 PolarHBondContact O-NZ 3.45Å; E209-K214 WeakPolarHBondContact OE2-CE 3.5Å; E209-K214 IonicContact OE2-NZ 2.66Å; E209-K214 PolarHBondContact OE2-NZ 2.98Å; S210-K214 PolarHBondContact O-N 2.75Å; Y212-K214 VanDerWaalsContact C-N 3.33Å; Y212-K214 PolarHBondContact O-N 2.98Å; K214-R218 WeakPolarHBondContact O-CB 3.28Å; K214-R218 PolarHBondContact O-N 3.23Å
215	C	90.8	Very high	87.1	Confident	10 Å²	10	43 Å²	43	7%	0.068	22%	0.218	C	C	.	.	H	α-helix	trans	-69.1	-34.7	179.9	-73	0	0	0	0	112.7	E211 Y212 V213 R218 M219 T250 I253 L254	E211-C215 WeakPolarHBondContact O-CB 3.35Å; E211-C215 PolarHBondContact O-N 3.28Å; E211-C215 PolarHBondContact O-SG 3.11Å; Y212-C215 PolarHBondContact O-N 2.98Å; V213-C215 VanDerWaalsContact C-N 3.3Å; V213-C215 PolarHBondContact O-N 2.92Å; C215-R218 PolarHBondContact O-N 3.32Å; C215-M219 VanDerWaalsContact O-CB 3.3Å; C215-M219 WeakPolarHBondContact O-CB 3.49Å; C215-M219 PolarHBondContact O-N 3.32Å; C215-T250 HydrophobicContact CB-CG2 3.69Å; C215-T250 WeakPolarHBondContact O-CG2 3.36Å; C215-I253 HydrophobicContact CB-CG2 4.33Å; C215-I253 VanDerWaalsContact SG-CD1 3.52Å; C215-L254 HydrophobicContact CB-CD2 3.77Å; C215-L254 HydrophobicContact CB-CG 4.01Å
216	V	86.1	Confident	87.1	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.024	22%	0.216	C	C	.	.	H	α-helix	trans	-60.8	-55.4	175.6	173.2	0	0	0	0	109.9	Y212 V213 R218 M219 S220 L254 H320	Y212-V216 HydrophobicContact CD1-CG2 4.41Å; Y212-V216 HydrophobicContact CE1-CG2 3.97Å; Y212-V216 HydrophobicContact CE2-CG2 4.24Å; Y212-V216 WeakPolarHBondContact O-CG2 3.32Å; Y212-V216 PolarHBondContact O-N 3.39Å; V213-V216 PolarHBondContact O-N 3.17Å; V216-R218 VanDerWaalsContact C-N 3.33Å; V216-R218 PolarHBondContact O-N 2.88Å; V216-M219 PolarHBondContact O-N 3.2Å; V216-S220 PolarHBondContact O-N 3.22Å; V216-S220 PolarHBondContact O-OG 3.15Å; V216-L254 HydrophobicContact CG2-CD2 3.6Å; V216-H320 WeakPolarHBondContact CG1-NE2 3.45Å
217	Y	82.9	Confident	87	Confident	45 Å²	45	41.1 Å²	41.1	18%	0.176	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-43	178.2	-67.4	-60.1	0	0	0	112.8	T186 V213 M219 S220 D221	T186-Y217 HydrophobicContact CG2-CE1 4.05Å; T186-Y217 WeakPolarHBondContact CG2-OH 3.37Å; V213-Y217 HydrophobicContact CG1-CD2 4.03Å; V213-Y217 HydrophobicContact CG1-CE2 3.56Å; V213-Y217 WeakPolarHBondContact O-CD2 3.33Å; V213-Y217 PolarHBondContact O-N 3.23Å; Y217-M219 VanDerWaalsContact C-N 3.31Å; Y217-M219 PolarHBondContact O-N 3.4Å; Y217-S220 PolarHBondContact O-N 2.95Å; Y217-D221 PolarHBondContact O-N 3.49Å
218	R	89.2	Confident	87	Confident	100 Å²	100	38.4 Å²	38.4	38%	0.377	18%	0.183	S	C	.	.	H	α-helix	trans	-63	-39.2	178.9	-175.7	175.5	-174.1	171.8	3.4	111.9	K214 C215 V216 I222 N246 T250	K214-R218 WeakPolarHBondContact O-CB 3.28Å; K214-R218 PolarHBondContact O-N 3.23Å; C215-R218 PolarHBondContact O-N 3.32Å; V216-R218 VanDerWaalsContact C-N 3.33Å; V216-R218 PolarHBondContact O-N 2.88Å; R218-I222 HydrophobicContact CG-CD1 3.85Å; R218-I222 HydrophobicContact CG-CG1 4.42Å; R218-I222 WeakPolarHBondContact O-CB 3.26Å; R218-I222 WeakPolarHBondContact O-CG1 3.4Å; R218-I222 PolarHBondContact O-N 2.69Å; R218-N246 PolarHBondContact NH2-ND2 2.89Å; R218-N246 PolarHBondContact NH2-OD1 3.28Å; R218-T250 HydrophobicContact CB-CG2 4.24Å; R218-T250 HydrophobicContact CG-CG2 4.38Å
219	M	90.1	Very high	87.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.9	-43.6	177.9	-173.9	57.2	73.7	0	0	111.3	W123 C215 V216 Y217 D221 I222 V223 H247 T250 L251 L254	W123-M219 HydrophobicContact CD2-CG 3.64Å; W123-M219 HydrophobicContact CE3-CG 3.55Å; W123-M219 HydrophobicContact CG-CG 4.11Å; W123-M219 HydrophobicContact CH2-CB 4.39Å; W123-M219 HydrophobicContact CH2-CG 4.24Å; W123-M219 HydrophobicContact CZ2-CG 4.37Å; W123-M219 HydrophobicContact CZ3-CB 4.4Å; W123-M219 HydrophobicContact CZ3-CG 3.87Å; C215-M219 VanDerWaalsContact O-CB 3.3Å; C215-M219 WeakPolarHBondContact O-CB 3.49Å; C215-M219 PolarHBondContact O-N 3.32Å; V216-M219 PolarHBondContact O-N 3.2Å; Y217-M219 VanDerWaalsContact C-N 3.31Å; Y217-M219 PolarHBondContact O-N 3.4Å; M219-D221 PolarHBondContact O-N 3.29Å; M219-I222 PolarHBondContact O-N 2.67Å; M219-V223 HydrophobicContact CG-CG2 4.38Å; M219-V223 WeakPolarHBondContact O-CG2 3.45Å; M219-V223 PolarHBondContact O-N 3.23Å; M219-V223 HydrophobicContact SD-CG2 4.06Å; M219-H247 WeakPolarHBondContact CE-O 3.24Å; M219-T250 HydrophobicContact CB-CG2 4.1Å; M219-T250 HydrophobicContact CE-CG2 3.94Å; M219-L251 HydrophobicContact CE-CB 3.62Å; M219-L251 HydrophobicContact CE-CD1 4.09Å; M219-L251 HydrophobicContact CE-CG 4.46Å; M219-L251 VanDerWaalsContact CE-N 3.35Å; M219-L254 HydrophobicContact CB-CD1 3.71Å; M219-L254 HydrophobicContact CE-CD1 4.25Å; M219-L254 HydrophobicContact CG-CD1 3.99Å
220	S	85.3	Confident	87.7	Confident	5 Å²	5	31.5 Å²	31.5	4%	0.035	15%	0.147	C	C	.	.	H	α-helix	trans	-56.6	-48.7	174.1	-61.4	0	0	0	0	111.4	V216 Y217 I222 V223 S224 S495	V216-S220 PolarHBondContact O-N 3.22Å; V216-S220 PolarHBondContact O-OG 3.15Å; Y217-S220 PolarHBondContact O-N 2.95Å; S220-I222 PolarHBondContact O-N 3.06Å; S220-V223 PolarHBondContact O-N 3.02Å; S220-S224 VanDerWaalsContact O-CB 3.24Å; S220-S224 WeakPolarHBondContact O-CB 3.49Å; S220-S224 PolarHBondContact O-N 3.1Å; S220-S495 WeakPolarHBondContact CB-OG 3.33Å
221	D	84.3	Confident	87.8	Confident	45 Å²	45	35 Å²	35	24%	0.241	16%	0.157	C	C	.	.	H	α-helix	trans	-58	-48	176.9	-78.3	-22.5	0	0	0	111.8	Y217 M219 S224 H225 R496	Y217-D221 PolarHBondContact O-N 3.49Å; M219-D221 PolarHBondContact O-N 3.29Å; D221-S224 PolarHBondContact O-N 3.26Å; D221-H225 VanDerWaalsContact O-CB 3.22Å; D221-H225 WeakPolarHBondContact O-CB 3.38Å; D221-H225 PolarHBondContact O-N 3.16Å; D221-R496 IonicContact OD1-CZ 2.75Å; D221-R496 IonicContact OD1-NH1 3.95Å; D221-R496 PolarHBondContact OD1-NH1 3.46Å; D221-R496 IonicContact OD2-CZ 3.12Å; D221-R496 VanDerWaalsContact OD2-CZ 3.29Å; D221-R496 IonicContact OD2-NH1 2.82Å; D221-R496 PolarHBondContact OD2-NH1 2.85Å; D221-R496 IonicContact OD2-NH2 3.22Å; D221-R496 PolarHBondContact OD2-NH2 2.76Å; D221-R496 VanDerWaalsContact OD2-NH2 3.11Å
222	I	90.6	Very high	88	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-61.4	-48.1	-179.5	-74.9	170.8	0	0	0	111.3	R218 M219 S220 R226 Y238 E243 N246 H247	R218-I222 HydrophobicContact CG-CD1 3.85Å; R218-I222 HydrophobicContact CG-CG1 4.42Å; R218-I222 WeakPolarHBondContact O-CB 3.26Å; R218-I222 WeakPolarHBondContact O-CG1 3.4Å; R218-I222 PolarHBondContact O-N 2.69Å; M219-I222 PolarHBondContact O-N 2.67Å; S220-I222 PolarHBondContact O-N 3.06Å; I222-R226 WeakPolarHBondContact O-CB 3.4Å; I222-R226 PolarHBondContact O-N 3.01Å; I222-Y238 WeakPolarHBondContact CG2-OH 3.32Å; I222-E243 HydrophobicContact CG2-CB 4.45Å; I222-N246 HydrophobicContact CD1-CB 4.33Å; I222-H247 HydrophobicContact CG2-CB 4.03Å; I222-H247 WeakPolarHBondContact CG2-ND1 3.49Å
223	V	89.4	Confident	88.2	Confident	5 Å²	5	31.3 Å²	31.3	3%	0.03	14%	0.138	C	C	.	.	H	α-helix	trans	-65.3	-44.2	-178.6	171.4	0	0	0	0	110.4	F119 L120 M219 S220 R226 Q227	F119-V223 HydrophobicContact CB-CG1 4.43Å; L120-V223 HydrophobicContact CD2-CG1 3.72Å; L120-V223 HydrophobicContact CD2-CG2 4.44Å; L120-V223 HydrophobicContact CG-CG1 4.03Å; M219-V223 HydrophobicContact CG-CG2 4.38Å; M219-V223 WeakPolarHBondContact O-CG2 3.45Å; M219-V223 PolarHBondContact O-N 3.23Å; M219-V223 HydrophobicContact SD-CG2 4.06Å; S220-V223 PolarHBondContact O-N 3.02Å; V223-R226 PolarHBondContact O-N 2.99Å; V223-Q227 WeakPolarHBondContact O-CG 3.42Å; V223-Q227 PolarHBondContact O-N 3.39Å
224	S	84.8	Confident	88.5	Confident	12 Å²	12	33.8 Å²	33.8	8%	0.084	15%	0.154	C	C	.	.	H	α-helix	trans	-69.5	-39	-177.2	-156.7	0	0	0	0	112.3	S220 D221 R226 Q227 R228 D493	S220-S224 VanDerWaalsContact O-CB 3.24Å; S220-S224 WeakPolarHBondContact O-CB 3.49Å; S220-S224 PolarHBondContact O-N 3.1Å; D221-S224 PolarHBondContact O-N 3.26Å; S224-R226 PolarHBondContact O-N 2.96Å; S224-Q227 PolarHBondContact O-N 3.34Å; S224-R228 PolarHBondContact O-N 3.09Å; S224-R228 VanDerWaalsContact O-N 3.17Å; S224-R228 PolarHBondContact OG-NH1 2.82Å; S224-D493 WeakPolarHBondContact CB-OD1 3.21Å; S224-D493 WeakPolarHBondContact CB-OD2 3.44Å; S224-D493 PolarHBondContact OG-OD1 3.37Å; S224-D493 PolarHBondContact OG-OD2 2.87Å
225	H	87.8	Confident	88.7	Confident	53 Å²	53	33.8 Å²	33.8	25%	0.245	16%	0.159	C	C	.	.	H	α-helix	trans	-57.4	-49.8	169.8	177	-129.4	0	0	0	110.8	D221 Q227 R228 T229 F232 E243	D221-H225 VanDerWaalsContact O-CB 3.22Å; D221-H225 WeakPolarHBondContact O-CB 3.38Å; D221-H225 PolarHBondContact O-N 3.16Å; H225-Q227 VanDerWaalsContact C-N 3.31Å; H225-Q227 PolarHBondContact O-N 3.38Å; H225-R228 PolarHBondContact O-N 2.95Å; H225-R228 VanDerWaalsContact O-N 3.1Å; H225-T229 WeakPolarHBondContact O-CG2 3.44Å; H225-T229 PolarHBondContact O-N 3.3Å; H225-T229 VanDerWaalsContact O-N 3.1Å; H225-T229 PolarHBondContact O-OG1 3.26Å; H225-F232 AromaticContact CE1-CE2 3.93Å; H225-E243 IonicContact CE1-OE2 2.66Å; H225-E243 IonicContact ND1-OE2 3.71Å; H225-E243 PolarHBondContact ND1-OE2 2.99Å; H225-E243 VanDerWaalsContact ND1-OE2 3.09Å
226	R	91.2	Very high	88.7	Confident	8 Å²	8	39.4 Å²	39.4	3%	0.03	18%	0.182	C	C	.	.	H	α-helix	trans	-59.5	-39.1	178.6	-170.3	175.6	-174.5	-168.7	-6.5	112.9	F119 I222 V223 S224 R228 T229 F232 W233 D235 Y238	F119-R226 HydrophobicContact CD1-CG 4.3Å; F119-R226 HydrophobicContact CG-CG 4.33Å; I222-R226 WeakPolarHBondContact O-CB 3.4Å; I222-R226 PolarHBondContact O-N 3.01Å; V223-R226 PolarHBondContact O-N 2.99Å; S224-R226 PolarHBondContact O-N 2.96Å; R226-R228 VanDerWaalsContact C-N 3.33Å; R226-R228 PolarHBondContact O-N 3.37Å; R226-T229 WeakPolarHBondContact CA-OG1 3.26Å; R226-T229 PolarHBondContact O-N 2.94Å; R226-T229 PolarHBondContact O-OG1 3.27Å; R226-F232 HydrophobicContact CG-CB 4.34Å; R226-F232 PolarHBondContact NE-O 3.42Å; R226-F232 PolarHBondContact NH2-O 3.09Å; R226-W233 PolarHBondContact NH2-O 3.26Å; R226-W233 PolarHBondContact O-NE1 3.26Å; R226-D235 IonicContact CZ-OD1 2.63Å; R226-D235 IonicContact NH1-OD1 3.45Å; R226-D235 IonicContact NH2-OD1 3.54Å; R226-D235 PolarHBondContact NH2-OD1 3.16Å; R226-Y238 HydrophobicContact CB-CE2 4.33Å; R226-Y238 HydrophobicContact CG-CD2 4.23Å; R226-Y238 HydrophobicContact CG-CE2 4.14Å; R226-Y238 VanDerWaalsContact CZ-CD1 3.48Å
227	Q	88.4	Confident	89.1	Confident	58 Å²	58	41.3 Å²	41.3	27%	0.271	19%	0.192	S	C	.	.	H	α-helix	trans	-61.5	-39.5	176.3	-77.6	175.1	-8.1	0	0	112.4	A116 F119 V223 S224 H225 W233	A116-Q227 HydrophobicContact CB-CG 4.39Å; A116-Q227 PolarHBondContact O-NE2 2.89Å; F119-Q227 HydrophobicContact CD2-CG 3.76Å; V223-Q227 WeakPolarHBondContact O-CG 3.42Å; V223-Q227 PolarHBondContact O-N 3.39Å; S224-Q227 PolarHBondContact O-N 3.34Å; H225-Q227 VanDerWaalsContact C-N 3.31Å; H225-Q227 PolarHBondContact O-N 3.38Å; Q227-W233 PolarHBondContact O-NE1 3.35Å
228	R	86.6	Confident	89.6	Confident	27 Å²	27	39.2 Å²	39.2	10%	0.102	18%	0.184	C	C	.	.	H	α-helix	trans	-81.9	-12.1	180	-66.5	-173.8	-63.5	-92.2	0.8	114.8	F66 S224 H225 R226 P230 D493	F66-R228 HydrophobicContact CD1-CG 3.85Å; F66-R228 HydrophobicContact CD2-CB 4.5Å; F66-R228 HydrophobicContact CD2-CG 4.35Å; F66-R228 HydrophobicContact CE1-CG 3.94Å; F66-R228 HydrophobicContact CE2-CG 4.42Å; F66-R228 HydrophobicContact CG-CG 4.07Å; F66-R228 HydrophobicContact CZ-CG 4.23Å; S224-R228 PolarHBondContact O-N 3.09Å; S224-R228 VanDerWaalsContact O-N 3.17Å; S224-R228 PolarHBondContact OG-NH1 2.82Å; H225-R228 PolarHBondContact O-N 2.95Å; H225-R228 VanDerWaalsContact O-N 3.1Å; R226-R228 VanDerWaalsContact C-N 3.33Å; R226-R228 PolarHBondContact O-N 3.37Å; R228-P230 VanDerWaalsContact O-CD 3.3Å; R228-P230 WeakPolarHBondContact O-CD 3.4Å; R228-D493 IonicContact CZ-OD2 3.3Å; R228-D493 IonicContact NH1-OD1 3.76Å; R228-D493 IonicContact NH1-OD2 3.14Å; R228-D493 PolarHBondContact NH1-OD2 3.42Å; R228-D493 IonicContact NH2-OD2 3.07Å; R228-D493 PolarHBondContact NH2-OD2 3.21Å
229	T	89	Confident	89.8	Confident	1 Å²	1	39 Å²	39	1%	0.006	18%	0.184	C	C	.	.			trans	-112.5	92.8	-177.5	54.6	0	0	0	0	111.9	T61 H225 R226 W231 F232	T61-T229 HydrophobicContact CG2-CG2 4.23Å; H225-T229 WeakPolarHBondContact O-CG2 3.44Å; H225-T229 PolarHBondContact O-N 3.3Å; H225-T229 VanDerWaalsContact O-N 3.1Å; H225-T229 PolarHBondContact O-OG1 3.26Å; R226-T229 WeakPolarHBondContact CA-OG1 3.26Å; R226-T229 PolarHBondContact O-N 2.94Å; R226-T229 PolarHBondContact O-OG1 3.27Å; T229-W231 PolarHBondContact O-N 2.8Å; T229-W231 VanDerWaalsContact O-N 3.14Å; T229-F232 HydrophobicContact CG2-CD2 4.39Å; T229-F232 PolarHBondContact O-N 2.99Å; T229-F232 WeakPolarHBondContact OG1-CD2 3.43Å
230	P	90.1	Very high	89.9	Confident	19 Å²	19	46.9 Å²	46.9	12%	0.123	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-57.8	-30.7	-175.9	-28.6	37.9	0	0	0	114.8	A56 V87 R228 F232 W233	A56-P230 HydrophobicContact CB-CB 4.01Å; A56-P230 HydrophobicContact CB-CG 4.02Å; V87-P230 HydrophobicContact CG1-CB 3.55Å; V87-P230 HydrophobicContact CG1-CG 3.39Å; R228-P230 VanDerWaalsContact O-CD 3.3Å; R228-P230 WeakPolarHBondContact O-CD 3.4Å; P230-F232 PolarHBondContact O-N 3.46Å; P230-W233 HydrophobicContact CB-CD2 4.48Å; P230-W233 WeakPolarHBondContact O-CB 3.44Å; P230-W233 PolarHBondContact O-N 3.45Å; P230-W233 VanDerWaalsContact O-N 3.08Å
231	W	89.1	Confident	90.2	Very high	100 Å²	100	54.1 Å²	54.1	38%	0.379	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-62.8	-21.7	176.2	21.2	88.3	0	0	0	113.5	L57 T61 T229 I237	L57-W231 HydrophobicContact CD2-CZ3 4.04Å; T61-W231 HydrophobicContact CG2-CZ2 4.09Å; T229-W231 PolarHBondContact O-N 2.8Å; T229-W231 VanDerWaalsContact O-N 3.14Å; W231-I237 WeakPolarHBondContact O-CG2 3.26Å
232	F	91.8	Very high	90.4	Very high	34 Å²	34	53.3 Å²	53.3	15%	0.149	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-98.2	9.2	175.6	-67.4	-36.4	0	0	0	113.7	H225 R226 T229 P230 I237 Y238 F241	H225-F232 AromaticContact CE1-CE2 3.93Å; R226-F232 HydrophobicContact CG-CB 4.34Å; R226-F232 PolarHBondContact NE-O 3.42Å; R226-F232 PolarHBondContact NH2-O 3.09Å; T229-F232 HydrophobicContact CG2-CD2 4.39Å; T229-F232 PolarHBondContact O-N 2.99Å; T229-F232 WeakPolarHBondContact OG1-CD2 3.43Å; P230-F232 PolarHBondContact O-N 3.46Å; F232-I237 HydrophobicContact CD1-CG2 4.04Å; F232-I237 HydrophobicContact CE1-CG2 4.34Å; F232-Y238 HydrophobicContact CB-CD2 3.88Å; F232-Y238 HydrophobicContact CG-CD2 4.19Å; F232-F241 HydrophobicContact CE1-CB 4.29Å
233	W	91.8	Very high	90.4	Very high	31 Å²	31	55.9 Å²	55.9	12%	0.117	26%	0.263	C	S	.	.			trans	-69.3	-41.2	174.4	-68.3	7.8	0	0	0	112.6	V87 I90 F92 F115 F119 R226 Q227 P230 D235	V87-W233 HydrophobicContact CB-CH2 3.73Å; V87-W233 HydrophobicContact CB-CZ3 3.94Å; V87-W233 HydrophobicContact CG1-CE3 4.38Å; V87-W233 HydrophobicContact CG1-CH2 3.42Å; V87-W233 VanDerWaalsContact CG1-CH2 3.42Å; V87-W233 HydrophobicContact CG1-CZ2 3.99Å; V87-W233 HydrophobicContact CG1-CZ3 3.63Å; V87-W233 HydrophobicContact CG2-CH2 4.36Å; I90-W233 HydrophobicContact CB-CZ3 4.47Å; I90-W233 HydrophobicContact CD1-CE3 3.88Å; I90-W233 HydrophobicContact CD1-CZ3 3.59Å; F92-W233 HydrophobicContact CE2-CH2 4.17Å; F92-W233 HydrophobicContact CZ-CH2 4.07Å; F115-W233 HydrophobicContact CD1-CE3 4.1Å; F115-W233 HydrophobicContact CD1-CZ3 4.19Å; F115-W233 HydrophobicContact CE1-CD2 4.12Å; F115-W233 AromaticContact CE1-CE3 3.74Å; F115-W233 HydrophobicContact CE1-CE3 3.74Å; F115-W233 HydrophobicContact CE1-CZ3 4.29Å; F119-W233 HydrophobicContact CE1-CB 4.43Å; F119-W233 HydrophobicContact CE1-CG 4.48Å; F119-W233 AromaticContact CE2-CD1 3.68Å; F119-W233 HydrophobicContact CE2-CD2 4.31Å; F119-W233 HydrophobicContact CE2-CG 4.07Å; F119-W233 AromaticContact CE2-NE1 3.68Å; F119-W233 HydrophobicContact CZ-CB 3.82Å; F119-W233 AromaticContact CZ-CD1 3.43Å; F119-W233 VanDerWaalsContact CZ-CD1 3.43Å; F119-W233 HydrophobicContact CZ-CD2 4.03Å; F119-W233 AromaticContact CZ-CG 3.49Å; F119-W233 HydrophobicContact CZ-CG 3.49Å; F119-W233 VanDerWaalsContact CZ-CG 3.49Å; F119-W233 AromaticContact CZ-NE1 3.9Å; R226-W233 PolarHBondContact NH2-O 3.26Å; R226-W233 PolarHBondContact O-NE1 3.26Å; Q227-W233 PolarHBondContact O-NE1 3.35Å; P230-W233 HydrophobicContact CB-CD2 4.48Å; P230-W233 WeakPolarHBondContact O-CB 3.44Å; P230-W233 PolarHBondContact O-N 3.45Å; P230-W233 VanDerWaalsContact O-N 3.08Å; W233-D235 PolarHBondContact O-N 3.1Å
234	P	91.8	Very high	90.6	Very high	53 Å²	53	55.7 Å²	55.7	34%	0.344	26%	0.262	S	S	.	.	S	Bend	trans	-66	124.9	171.5	-20.5	34.9	0	0	0	111.1	F236 I237 Y238	P234-F236 VanDerWaalsContact C-N 3.28Å; P234-F236 HydrophobicContact CB-CD1 3.85Å; P234-F236 HydrophobicContact CB-CE1 3.74Å; P234-F236 PolarHBondContact O-N 2.86Å; P234-I237 HydrophobicContact CB-CD1 4.06Å; P234-I237 HydrophobicContact CB-CG1 4.09Å; P234-I237 HydrophobicContact CG-CD1 3.9Å; P234-I237 HydrophobicContact CG-CG1 4.46Å; P234-I237 PolarHBondContact O-N 3.42Å; P234-I237 VanDerWaalsContact O-N 3.13Å; P234-Y238 PolarHBondContact O-N 2.98Å; P234-Y238 VanDerWaalsContact O-N 3.1Å
235	D	91.3	Very high	90.9	Very high	97 Å²	97	63.1 Å²	63.1	52%	0.519	29%	0.293	S	S	.	.	H	α-helix	trans	-56.2	-41.7	-175.8	-68.6	-38.1	0	0	0	112.2	R226 W233 I237 Y238 Y239	R226-D235 IonicContact CZ-OD1 2.63Å; R226-D235 IonicContact NH1-OD1 3.45Å; R226-D235 IonicContact NH2-OD1 3.54Å; R226-D235 PolarHBondContact NH2-OD1 3.16Å; W233-D235 PolarHBondContact O-N 3.1Å; D235-I237 PolarHBondContact O-N 3.03Å; D235-Y238 PolarHBondContact O-N 3.41Å; D235-Y239 HydrophobicContact CB-CD2 4.39Å; D235-Y239 VanDerWaalsContact O-CD2 3.24Å; D235-Y239 WeakPolarHBondContact O-CD2 3.34Å; D235-Y239 PolarHBondContact O-N 3.1Å
236	F	92.5	Very high	91.1	Very high	129 Å²	129	63.7 Å²	63.7	57%	0.566	30%	0.298	S	S	*	.	H	α-helix	trans	-59.6	-45.9	179.7	83.6	-90.3	0	0	0	111.6	P234 Y238 Y239 F240	P234-F236 VanDerWaalsContact C-N 3.28Å; P234-F236 HydrophobicContact CB-CD1 3.85Å; P234-F236 HydrophobicContact CB-CE1 3.74Å; P234-F236 PolarHBondContact O-N 2.86Å; F236-Y238 VanDerWaalsContact C-N 3.29Å; F236-Y238 PolarHBondContact O-N 2.73Å; F236-Y239 PolarHBondContact O-N 3.49Å; F236-F240 WeakPolarHBondContact O-CD2 3.28Å; F236-F240 PolarHBondContact O-N 3.22Å
237	I	93.2	Very high	91.2	Very high	43 Å²	43	63.4 Å²	63.4	22%	0.221	30%	0.297	C	S	.	.	H	α-helix	trans	-63.6	-42.6	179.5	-56	179.4	0	0	0	109.5	W231 F232 P234 D235 Y239 F240 F241 G242	W231-I237 WeakPolarHBondContact O-CG2 3.26Å; F232-I237 HydrophobicContact CD1-CG2 4.04Å; F232-I237 HydrophobicContact CE1-CG2 4.34Å; P234-I237 HydrophobicContact CB-CD1 4.06Å; P234-I237 HydrophobicContact CB-CG1 4.09Å; P234-I237 HydrophobicContact CG-CD1 3.9Å; P234-I237 HydrophobicContact CG-CG1 4.46Å; P234-I237 PolarHBondContact O-N 3.42Å; P234-I237 VanDerWaalsContact O-N 3.13Å; D235-I237 PolarHBondContact O-N 3.03Å; I237-Y239 PolarHBondContact O-N 3.18Å; I237-F240 PolarHBondContact O-N 3.42Å; I237-F241 HydrophobicContact CG2-CB 4.38Å; I237-F241 HydrophobicContact CG2-CD2 4.03Å; I237-F241 WeakPolarHBondContact O-CA 3.49Å; I237-F241 WeakPolarHBondContact O-CB 3.19Å; I237-F241 PolarHBondContact O-N 3.48Å; I237-G242 PolarHBondContact O-N 3.49Å
238	Y	94.1	Very high	91.5	Very high	1 Å²	1	63.2 Å²	63.2	0%	0.004	30%	0.297	C	S	.	.	H	α-helix	trans	-63.5	-38.1	179.8	-177.5	-114.3	0	0	0	113.4	I222 R226 F232 P234 D235 F236 G242 E243 G244 H247	I222-Y238 WeakPolarHBondContact CG2-OH 3.32Å; R226-Y238 HydrophobicContact CB-CE2 4.33Å; R226-Y238 HydrophobicContact CG-CD2 4.23Å; R226-Y238 HydrophobicContact CG-CE2 4.14Å; R226-Y238 VanDerWaalsContact CZ-CD1 3.48Å; F232-Y238 HydrophobicContact CB-CD2 3.88Å; F232-Y238 HydrophobicContact CG-CD2 4.19Å; P234-Y238 PolarHBondContact O-N 2.98Å; P234-Y238 VanDerWaalsContact O-N 3.1Å; D235-Y238 PolarHBondContact O-N 3.41Å; F236-Y238 VanDerWaalsContact C-N 3.29Å; F236-Y238 PolarHBondContact O-N 2.73Å; Y238-G242 CarbonylContact O-C 3.6Å; Y238-G242 VanDerWaalsContact O-C 3.22Å; Y238-G242 WeakPolarHBondContact O-CA 3.37Å; Y238-G242 PolarHBondContact O-N 3.49Å; Y238-E243 HydrophobicContact CE2-CB 4.09Å; Y238-E243 PolarHBondContact O-N 2.79Å; Y238-G244 VanDerWaalsContact CE1-CA 3.47Å; Y238-G244 PolarHBondContact O-N 3.12Å; Y238-H247 HydrophobicContact CE1-CB 4.23Å; Y238-H247 WeakPolarHBondContact OH-CB 3.37Å; Y238-H247 PolarHBondContact OH-ND1 2.88Å
239	Y	93	Very high	91.9	Very high	97 Å²	97	68.1 Å²	68.1	38%	0.38	32%	0.32	S	S	.	.	H	α-helix	trans	-74	-35.9	177.8	-86.4	-72.3	0	0	0	113.6	D235 F236 I237 D248	D235-Y239 HydrophobicContact CB-CD2 4.39Å; D235-Y239 VanDerWaalsContact O-CD2 3.24Å; D235-Y239 WeakPolarHBondContact O-CD2 3.34Å; D235-Y239 PolarHBondContact O-N 3.1Å; F236-Y239 PolarHBondContact O-N 3.49Å; I237-Y239 PolarHBondContact O-N 3.18Å; Y239-D248 WeakPolarHBondContact CE1-OD2 3.45Å; Y239-D248 PolarHBondContact OH-OD1 2.76Å; Y239-D248 VanDerWaalsContact OH-OD1 3.06Å
240	F	92.3	Very high	92.2	Very high	165 Å²	165	68.2 Å²	68.2	72%	0.724	32%	0.32	S	S	*	.	H	α-helix	trans	-85.8	-40	-178.5	-76.2	-71.7	0	0	0	113.6	F236 I237	F236-F240 WeakPolarHBondContact O-CD2 3.28Å; F236-F240 PolarHBondContact O-N 3.22Å; I237-F240 PolarHBondContact O-N 3.42Å
241	F	91.4	Very high	92.3	Very high	157 Å²	157	68.2 Å²	68.2	69%	0.689	32%	0.319	S	S	*	.	H	α-helix	trans	-119.1	-11.9	-170.7	-58.4	-77.1	0	0	0	114.1	F232 I237	F232-F241 HydrophobicContact CE1-CB 4.29Å; I237-F241 HydrophobicContact CG2-CB 4.38Å; I237-F241 HydrophobicContact CG2-CD2 4.03Å; I237-F241 WeakPolarHBondContact O-CA 3.49Å; I237-F241 WeakPolarHBondContact O-CB 3.19Å; I237-F241 PolarHBondContact O-N 3.48Å
242	G	89.6	Confident	92.6	Very high	27 Å²	27	70.4 Å²	70.4	28%	0.278	33%	0.331	S	S	.	.	S	Bend	trans	-106.1	-147.9	-179.5	0	0	0	0	0	112.8	I237 Y238	I237-G242 PolarHBondContact O-N 3.49Å; Y238-G242 CarbonylContact O-C 3.6Å; Y238-G242 VanDerWaalsContact O-C 3.22Å; Y238-G242 WeakPolarHBondContact O-CA 3.37Å; Y238-G242 PolarHBondContact O-N 3.49Å
243	E	90.8	Very high	92.7	Very high	57 Å²	57	70.6 Å²	70.6	27%	0.266	33%	0.333	S	S	.	.	S	Bend	trans	-98.6	17.4	-174.8	-63.6	-172.7	83.6	0	0	113.6	I222 H225 Y238 K245 N246 H247	I222-E243 HydrophobicContact CG2-CB 4.45Å; H225-E243 IonicContact CE1-OE2 2.66Å; H225-E243 IonicContact ND1-OE2 3.71Å; H225-E243 PolarHBondContact ND1-OE2 2.99Å; H225-E243 VanDerWaalsContact ND1-OE2 3.09Å; Y238-E243 HydrophobicContact CE2-CB 4.09Å; Y238-E243 PolarHBondContact O-N 2.79Å; E243-K245 VanDerWaalsContact C-N 3.33Å; E243-K245 PolarHBondContact O-N 3.48Å; E243-N246 PolarHBondContact O-N 3.39Å; E243-H247 WeakPolarHBondContact O-CB 3.17Å; E243-H247 PolarHBondContact O-N 2.93Å
244	G	92.2	Very high	92.7	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-52.9	-42.9	-174.2	0	0	0	0	0	114.8	Y238 H247 D248	Y238-G244 VanDerWaalsContact CE1-CA 3.47Å; Y238-G244 PolarHBondContact O-N 3.12Å; G244-H247 WeakPolarHBondContact O-CB 3.12Å; G244-H247 PolarHBondContact O-N 3.43Å; G244-D248 PolarHBondContact O-N 2.57Å
245	K	91.5	Very high	92.8	Very high	168 Å²	168	68.9 Å²	68.9	73%	0.73	32%	0.322	S	S	*	.	H	α-helix	trans	-66.5	-39.3	176.7	-66.4	-177.9	-178.4	176.2	0	113	E243 K249	E243-K245 VanDerWaalsContact C-N 3.33Å; E243-K245 PolarHBondContact O-N 3.48Å; K245-K249 PolarHBondContact O-N 3.49Å; K245-K249 VanDerWaalsContact O-N 3.1Å
246	N	92.2	Very high	92.8	Very high	66 Å²	66	68 Å²	68	35%	0.353	32%	0.323	S	S	.	.	H	α-helix	trans	-70.5	-37.2	178.1	-76	-23.6	0	0	0	111.1	R218 I222 E243 K249 T250	R218-N246 PolarHBondContact NH2-ND2 2.89Å; R218-N246 PolarHBondContact NH2-OD1 3.28Å; I222-N246 HydrophobicContact CD1-CB 4.33Å; E243-N246 PolarHBondContact O-N 3.39Å; N246-K249 PolarHBondContact O-N 2.72Å; N246-T250 WeakPolarHBondContact O-CB 3.27Å; N246-T250 PolarHBondContact O-N 3.5Å; N246-T250 PolarHBondContact O-OG1 3.33Å
247	H	93.6	Very high	92.7	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.009	31%	0.305	C	S	.	.	H	α-helix	trans	-56.4	-57.1	172.2	-171.5	124.1	0	0	0	109.7	M219 I222 Y238 E243 G244 K249 T250 L251	M219-H247 WeakPolarHBondContact CE-O 3.24Å; I222-H247 HydrophobicContact CG2-CB 4.03Å; I222-H247 WeakPolarHBondContact CG2-ND1 3.49Å; Y238-H247 HydrophobicContact CE1-CB 4.23Å; Y238-H247 WeakPolarHBondContact OH-CB 3.37Å; Y238-H247 PolarHBondContact OH-ND1 2.88Å; E243-H247 WeakPolarHBondContact O-CB 3.17Å; E243-H247 PolarHBondContact O-N 2.93Å; G244-H247 WeakPolarHBondContact O-CB 3.12Å; G244-H247 PolarHBondContact O-N 3.43Å; H247-K249 VanDerWaalsContact C-N 3.31Å; H247-K249 PolarHBondContact O-N 3.13Å; H247-T250 PolarHBondContact O-N 3.2Å; H247-L251 VanDerWaalsContact O-CB 3.23Å; H247-L251 WeakPolarHBondContact O-CB 3.39Å; H247-L251 PolarHBondContact O-N 2.76Å
248	D	94.6	Very high	92.5	Very high	53 Å²	53	61.8 Å²	61.8	28%	0.283	29%	0.294	S	S	.	.	H	α-helix	trans	-60.2	-38.7	-178.9	-70.2	-2.2	0	0	0	112.8	Y239 G244 K252	Y239-D248 WeakPolarHBondContact CE1-OD2 3.45Å; Y239-D248 PolarHBondContact OH-OD1 2.76Å; Y239-D248 VanDerWaalsContact OH-OD1 3.06Å; G244-D248 PolarHBondContact O-N 2.57Å; D248-K252 VanDerWaalsContact O-CG 3.25Å; D248-K252 WeakPolarHBondContact O-CG 3.19Å; D248-K252 PolarHBondContact O-N 3.4Å
249	K	94.4	Very high	92.3	Very high	131 Å²	131	67.7 Å²	67.7	57%	0.57	32%	0.318	S	S	*	.	H	α-helix	trans	-64.1	-47.5	177.2	-175.6	-178.1	177.6	-177.4	0	111.6	K245 N246 H247 L251 K252	K245-K249 PolarHBondContact O-N 3.49Å; K245-K249 VanDerWaalsContact O-N 3.1Å; N246-K249 PolarHBondContact O-N 2.72Å; H247-K249 VanDerWaalsContact C-N 3.31Å; H247-K249 PolarHBondContact O-N 3.13Å; K249-L251 VanDerWaalsContact C-N 3.33Å; K249-K252 PolarHBondContact O-N 3.45Å
250	T	94.4	Very high	92.1	Very high	3 Å²	3	68.5 Å²	68.5	2%	0.018	32%	0.323	C	S	.	.	H	α-helix	trans	-64.8	-42.4	180	-52.9	0	0	0	0	110.2	C215 R218 M219 N246 H247 K252 I253 L254	C215-T250 HydrophobicContact CB-CG2 3.69Å; C215-T250 WeakPolarHBondContact O-CG2 3.36Å; R218-T250 HydrophobicContact CB-CG2 4.24Å; R218-T250 HydrophobicContact CG-CG2 4.38Å; M219-T250 HydrophobicContact CB-CG2 4.1Å; M219-T250 HydrophobicContact CE-CG2 3.94Å; N246-T250 WeakPolarHBondContact O-CB 3.27Å; N246-T250 PolarHBondContact O-N 3.5Å; N246-T250 PolarHBondContact O-OG1 3.33Å; H247-T250 PolarHBondContact O-N 3.2Å; T250-K252 PolarHBondContact O-N 2.89Å; T250-I253 PolarHBondContact O-N 2.66Å; T250-L254 HydrophobicContact CG2-CD1 4.44Å; T250-L254 PolarHBondContact O-N 3.44Å
251	L	94.1	Very high	91.9	Very high	19 Å²	19	60.7 Å²	60.7	10%	0.099	29%	0.289	C	S	.	.	H	α-helix	trans	-60.2	-44.1	178.8	-174.9	62.3	0	0	0	112.3	P122 W123 M219 H247 K249 I253 L254 H255	P122-L251 HydrophobicContact CB-CD2 3.96Å; P122-L251 WeakPolarHBondContact O-CD1 3.37Å; P122-L251 WeakPolarHBondContact O-CD2 3.37Å; W123-L251 HydrophobicContact CB-CD1 3.98Å; W123-L251 HydrophobicContact CG-CD1 4.23Å; M219-L251 HydrophobicContact CE-CB 3.62Å; M219-L251 HydrophobicContact CE-CD1 4.09Å; M219-L251 HydrophobicContact CE-CG 4.46Å; M219-L251 VanDerWaalsContact CE-N 3.35Å; H247-L251 VanDerWaalsContact O-CB 3.23Å; H247-L251 WeakPolarHBondContact O-CB 3.39Å; H247-L251 PolarHBondContact O-N 2.76Å; K249-L251 VanDerWaalsContact C-N 3.33Å; L251-I253 VanDerWaalsContact C-N 3.26Å; L251-I253 PolarHBondContact O-N 3.38Å; L251-L254 PolarHBondContact O-N 3.47Å; L251-H255 VanDerWaalsContact CD1-CE1 3.44Å; L251-H255 WeakPolarHBondContact CD1-CE1 3.22Å; L251-H255 WeakPolarHBondContact O-CB 3.3Å; L251-H255 PolarHBondContact O-N 2.96Å
252	K	95.1	Very high	91.7	Very high	145 Å²	145	53.3 Å²	53.3	63%	0.63	26%	0.257	S	S	*	.	H	α-helix	trans	-56.7	-39.2	176.9	-77.6	170	-176.2	179.5	0	112.5	D248 K249 T250 S256	D248-K252 VanDerWaalsContact O-CG 3.25Å; D248-K252 WeakPolarHBondContact O-CG 3.19Å; D248-K252 PolarHBondContact O-N 3.4Å; K249-K252 PolarHBondContact O-N 3.45Å; T250-K252 PolarHBondContact O-N 2.89Å; K252-S256 WeakPolarHBondContact O-CB 3.41Å; K252-S256 PolarHBondContact O-N 3.47Å; K252-S256 PolarHBondContact O-OG 3.27Å
253	I	93.3	Very high	91.6	Very high	38 Å²	38	56.8 Å²	56.8	20%	0.195	26%	0.264	C	S	.	.	H	α-helix	trans	-68.2	-47.8	179	-64.7	162.5	0	0	0	110.1	E211 C215 T250 L251 S256 F257	E211-I253 HydrophobicContact CG-CD1 4.17Å; E211-I253 HydrophobicContact CG-CG2 4.19Å; E211-I253 WeakPolarHBondContact OE1-CD1 3.39Å; C215-I253 HydrophobicContact CB-CG2 4.33Å; C215-I253 VanDerWaalsContact SG-CD1 3.52Å; T250-I253 PolarHBondContact O-N 2.66Å; L251-I253 VanDerWaalsContact C-N 3.26Å; L251-I253 PolarHBondContact O-N 3.38Å; I253-S256 PolarHBondContact O-N 2.97Å; I253-F257 PolarHBondContact O-N 3.46Å
254	L	92	Very high	91.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.3	-51	179	-66.3	176.3	0	0	0	111.7	W123 Y212 C215 V216 M219 T250 L251 S256 F257 T258	W123-L254 HydrophobicContact CZ2-CD1 4.17Å; Y212-L254 HydrophobicContact CD2-CD2 3.98Å; Y212-L254 HydrophobicContact CE2-CD2 3.89Å; C215-L254 HydrophobicContact CB-CD2 3.77Å; C215-L254 HydrophobicContact CB-CG 4.01Å; V216-L254 HydrophobicContact CG2-CD2 3.6Å; M219-L254 HydrophobicContact CB-CD1 3.71Å; M219-L254 HydrophobicContact CE-CD1 4.25Å; M219-L254 HydrophobicContact CG-CD1 3.99Å; T250-L254 HydrophobicContact CG2-CD1 4.44Å; T250-L254 PolarHBondContact O-N 3.44Å; L251-L254 PolarHBondContact O-N 3.47Å; L254-S256 PolarHBondContact O-N 3.34Å; L254-F257 WeakPolarHBondContact O-CB 3.48Å; L254-F257 PolarHBondContact O-N 3.4Å; L254-T258 PolarHBondContact O-N 3.43Å; L254-T258 VanDerWaalsContact O-N 3.08Å; L254-T258 PolarHBondContact O-OG1 3.49Å
255	H	93.4	Very high	90.9	Very high	49 Å²	49	60.1 Å²	60.1	23%	0.227	28%	0.277	C	S	.	.	H	α-helix	trans	-66.2	-36.1	178.5	-73.1	171.5	0	0	0	113	P122 W123 L251 F257 T258 Y259 Q309 D313	P122-H255 PolarHBondContact O-CE1 3.3Å; W123-H255 PolarHBondContact O-NE2 3Å; L251-H255 VanDerWaalsContact CD1-CE1 3.44Å; L251-H255 WeakPolarHBondContact CD1-CE1 3.22Å; L251-H255 WeakPolarHBondContact O-CB 3.3Å; L251-H255 PolarHBondContact O-N 2.96Å; H255-F257 VanDerWaalsContact C-N 3.29Å; H255-F257 PolarHBondContact O-N 2.94Å; H255-T258 PolarHBondContact O-N 3.18Å; H255-T258 PolarHBondContact O-OG1 3.33Å; H255-Y259 WeakPolarHBondContact O-CB 3.2Å; H255-Y259 PolarHBondContact O-N 3.09Å; H255-Q309 PolarHBondContact O-NE2 3.04Å; H255-D313 IonicContact CD2-OD2 3.63Å; H255-D313 PolarHBondContact CD2-OD2 2.98Å; H255-D313 IonicContact NE2-OD2 3.45Å; H255-D313 PolarHBondContact NE2-OD2 2.98Å
256	S	92	Very high	90.5	Very high	78 Å²	78	54 Å²	54	55%	0.545	26%	0.255	S	S	.	.	H	α-helix	trans	-64.5	-38.4	176.1	-63.5	0	0	0	0	111.3	K252 I253 L254 K260	K252-S256 WeakPolarHBondContact O-CB 3.41Å; K252-S256 PolarHBondContact O-N 3.47Å; K252-S256 PolarHBondContact O-OG 3.27Å; I253-S256 PolarHBondContact O-N 2.97Å; L254-S256 PolarHBondContact O-N 3.34Å; S256-K260 VanDerWaalsContact O-CB 3.31Å; S256-K260 WeakPolarHBondContact O-CB 3.3Å; S256-K260 PolarHBondContact O-N 3.37Å
257	F	89.9	Confident	90	Very high	41 Å²	41	54.9 Å²	54.9	18%	0.18	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-52.1	176.3	-178.6	-92	0	0	0	111.4	M198 I202 Y212 I253 L254 H255 Y259 K260 V261	M198-F257 HydrophobicContact CE-CE1 3.84Å; M198-F257 HydrophobicContact SD-CE1 3.91Å; I202-F257 HydrophobicContact CG2-CE1 4.4Å; I202-F257 HydrophobicContact CG2-CE2 4.45Å; I202-F257 HydrophobicContact CG2-CZ 3.62Å; Y212-F257 HydrophobicContact CD2-CB 3.75Å; Y212-F257 AromaticContact CD2-CD1 3.57Å; Y212-F257 HydrophobicContact CD2-CD1 3.57Å; Y212-F257 HydrophobicContact CD2-CD2 4.07Å; Y212-F257 HydrophobicContact CD2-CE1 4.19Å; Y212-F257 AromaticContact CD2-CG 3.5Å; Y212-F257 HydrophobicContact CD2-CG 3.5Å; Y212-F257 HydrophobicContact CE1-CE1 4.38Å; Y212-F257 HydrophobicContact CE2-CB 4.05Å; Y212-F257 AromaticContact CE2-CD1 3.28Å; Y212-F257 HydrophobicContact CE2-CD1 3.28Å; Y212-F257 AromaticContact CE2-CE1 3.85Å; Y212-F257 HydrophobicContact CE2-CE1 3.85Å; Y212-F257 AromaticContact CE2-CG 3.73Å; Y212-F257 HydrophobicContact CE2-CG 3.73Å; Y212-F257 HydrophobicContact CG-CD1 4.33Å; Y212-F257 HydrophobicContact CG-CD2 4.36Å; Y212-F257 HydrophobicContact CG-CG 4.22Å; Y212-F257 AromaticContact CZ-CD1 3.86Å; Y212-F257 AromaticContact CZ-CE1 3.95Å; I253-F257 PolarHBondContact O-N 3.46Å; L254-F257 WeakPolarHBondContact O-CB 3.48Å; L254-F257 PolarHBondContact O-N 3.4Å; H255-F257 VanDerWaalsContact C-N 3.29Å; H255-F257 PolarHBondContact O-N 2.94Å; F257-Y259 PolarHBondContact O-N 2.99Å; F257-K260 PolarHBondContact O-N 3.07Å; F257-V261 HydrophobicContact CD1-CG2 4.26Å; F257-V261 HydrophobicContact CE1-CG2 3.86Å; F257-V261 HydrophobicContact CZ-CG2 4.02Å; F257-V261 WeakPolarHBondContact O-CG2 3.49Å; F257-V261 PolarHBondContact O-N 3.07Å
258	T	88.9	Confident	89.3	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66.2	-39.2	-178.7	55.6	0	0	0	0	112.4	M198 L254 H255 K260 V261 I262 Q309 V312 D313 M316	M198-T258 HydrophobicContact SD-CG2 4.48Å; L254-T258 PolarHBondContact O-N 3.43Å; L254-T258 VanDerWaalsContact O-N 3.08Å; L254-T258 PolarHBondContact O-OG1 3.49Å; H255-T258 PolarHBondContact O-N 3.18Å; H255-T258 PolarHBondContact O-OG1 3.33Å; T258-K260 PolarHBondContact O-N 2.89Å; T258-V261 PolarHBondContact O-N 3Å; T258-I262 WeakPolarHBondContact O-CB 3.22Å; T258-I262 WeakPolarHBondContact O-CD1 3.38Å; T258-I262 VanDerWaalsContact O-CG1 3.22Å; T258-I262 WeakPolarHBondContact O-CG1 3.23Å; T258-I262 PolarHBondContact O-N 3.36Å; T258-Q309 PolarHBondContact OG1-NE2 3.27Å; T258-V312 HydrophobicContact CG2-CG1 4.2Å; T258-D313 VanDerWaalsContact CB-OD1 3.23Å; T258-D313 WeakPolarHBondContact CB-OD1 2.98Å; T258-D313 WeakPolarHBondContact CG2-OD1 3.37Å; T258-D313 PolarHBondContact OG1-OD1 3.45Å; T258-M316 HydrophobicContact CG2-CE 3.28Å; T258-M316 HydrophobicContact CG2-SD 3.44Å; T258-M316 WeakPolarHBondContact CG2-SD 3.49Å
259	Y	89.8	Confident	88.3	Confident	126 Å²	126	58 Å²	58	49%	0.494	27%	0.274	S	S	.	.	H	α-helix	trans	-58.4	-46.5	173.1	-179.3	-98.9	0	0	0	112.3	H255 F257 V261 I262 K263	H255-Y259 WeakPolarHBondContact O-CB 3.2Å; H255-Y259 PolarHBondContact O-N 3.09Å; F257-Y259 PolarHBondContact O-N 2.99Å; Y259-V261 VanDerWaalsContact C-N 3.34Å; Y259-V261 PolarHBondContact O-N 3.39Å; Y259-I262 PolarHBondContact O-N 3.36Å; Y259-K263 HydrophobicContact CE1-CD 4.38Å; Y259-K263 WeakPolarHBondContact O-CB 3.32Å; Y259-K263 PolarHBondContact O-N 3.16Å
260	K	89.5	Confident	86.9	Confident	113 Å²	113	54.8 Å²	54.8	49%	0.491	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-44.6	178.2	-179.5	174.8	177.1	176.6	0	111.4	S256 F257 T258 K263 E264	S256-K260 VanDerWaalsContact O-CB 3.31Å; S256-K260 WeakPolarHBondContact O-CB 3.3Å; S256-K260 PolarHBondContact O-N 3.37Å; F257-K260 PolarHBondContact O-N 3.07Å; T258-K260 PolarHBondContact O-N 2.89Å; K260-K263 PolarHBondContact O-N 3.32Å; K260-E264 WeakPolarHBondContact CE-OE1 3.13Å; K260-E264 HydrophobicContact CG-CG 4.44Å; K260-E264 WeakPolarHBondContact CG-OE1 3.37Å; K260-E264 WeakPolarHBondContact O-CB 3.45Å; K260-E264 VanDerWaalsContact O-CG 3.28Å; K260-E264 WeakPolarHBondContact O-CG 3.39Å; K260-E264 PolarHBondContact O-N 2.66Å
261	V	87.2	Confident	85.3	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-61.9	-47.5	177.5	172.5	0	0	0	0	111.7	M198 F257 T258 Y259 K263 E264 R265 L289	M198-V261 HydrophobicContact CB-CG1 3.83Å; M198-V261 HydrophobicContact CG-CG1 4.02Å; M198-V261 HydrophobicContact SD-CB 4.31Å; M198-V261 HydrophobicContact SD-CG1 3.95Å; M198-V261 HydrophobicContact SD-CG2 4.18Å; F257-V261 HydrophobicContact CD1-CG2 4.26Å; F257-V261 HydrophobicContact CE1-CG2 3.86Å; F257-V261 HydrophobicContact CZ-CG2 4.02Å; F257-V261 WeakPolarHBondContact O-CG2 3.49Å; F257-V261 PolarHBondContact O-N 3.07Å; T258-V261 PolarHBondContact O-N 3Å; Y259-V261 VanDerWaalsContact C-N 3.34Å; Y259-V261 PolarHBondContact O-N 3.39Å; V261-K263 VanDerWaalsContact C-N 3.32Å; V261-K263 PolarHBondContact O-N 3.12Å; V261-E264 PolarHBondContact O-N 3.02Å; V261-R265 HydrophobicContact CG1-CG 4.48Å; V261-R265 VanDerWaalsContact O-CB 3.3Å; V261-R265 WeakPolarHBondContact O-CB 3.34Å; V261-R265 VanDerWaalsContact O-CG 3.25Å; V261-R265 WeakPolarHBondContact O-CG 3.37Å; V261-R265 PolarHBondContact O-N 3.29Å; V261-L289 HydrophobicContact CG1-CD2 3.96Å
262	I	87.4	Confident	83.7	Confident	2 Å²	2	66 Å²	66	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-60.7	-44.3	179.3	-68.2	163.6	0	0	0	110.4	T258 Y259 R265 S266 L289 I308 Q309 V312	T258-I262 WeakPolarHBondContact O-CB 3.22Å; T258-I262 WeakPolarHBondContact O-CD1 3.38Å; T258-I262 VanDerWaalsContact O-CG1 3.22Å; T258-I262 WeakPolarHBondContact O-CG1 3.23Å; T258-I262 PolarHBondContact O-N 3.36Å; Y259-I262 PolarHBondContact O-N 3.36Å; I262-R265 PolarHBondContact O-N 3.03Å; I262-S266 VanDerWaalsContact O-CB 3.31Å; I262-S266 WeakPolarHBondContact O-CB 3.39Å; I262-S266 PolarHBondContact O-N 2.81Å; I262-L289 HydrophobicContact CG1-CD1 3.97Å; I262-L289 HydrophobicContact CG1-CD2 4.19Å; I262-I308 HydrophobicContact CD1-CG2 4.15Å; I262-I308 HydrophobicContact CG1-CG2 4.27Å; I262-I308 HydrophobicContact CG2-CG2 4.2Å; I262-Q309 HydrophobicContact CD1-CB 3.76Å; I262-Q309 HydrophobicContact CD1-CG 4.19Å; I262-V312 HydrophobicContact CD1-CB 4.38Å; I262-V312 HydrophobicContact CD1-CG2 4.23Å; I262-V312 HydrophobicContact CG1-CG2 4.35Å
263	K	87.6	Confident	82	Confident	100 Å²	100	64.8 Å²	64.8	44%	0.435	31%	0.313	S	S	.	.	H	α-helix	trans	-63.1	-52.8	178.7	-176.2	176	174	-179.3	0	112	Y259 K260 V261 R265 S266 E267	Y259-K263 HydrophobicContact CE1-CD 4.38Å; Y259-K263 WeakPolarHBondContact O-CB 3.32Å; Y259-K263 PolarHBondContact O-N 3.16Å; K260-K263 PolarHBondContact O-N 3.32Å; V261-K263 VanDerWaalsContact C-N 3.32Å; V261-K263 PolarHBondContact O-N 3.12Å; K263-R265 PolarHBondContact O-N 3.22Å; K263-S266 PolarHBondContact O-N 3.18Å; K263-E267 WeakPolarHBondContact CE-OE1 3.36Å; K263-E267 IonicContact NZ-OE1 3.22Å; K263-E267 WeakPolarHBondContact O-CG 3.34Å; K263-E267 PolarHBondContact O-N 2.78Å
264	E	85.6	Confident	80.1	Confident	66 Å²	66	67.4 Å²	67.4	31%	0.308	34%	0.335	S	S	.	.	H	α-helix	trans	-55.6	-39.7	177.9	-74.6	170.8	177.8	0	0	111.3	R200 K260 V261 N268	R200-E264 IonicContact CZ-OE2 2.67Å; R200-E264 IonicContact NH1-OE1 2.74Å; R200-E264 IonicContact NH1-OE2 3.7Å; R200-E264 PolarHBondContact NH1-OE2 3.08Å; R200-E264 IonicContact NH2-OE2 3.89Å; K260-E264 WeakPolarHBondContact CE-OE1 3.13Å; K260-E264 HydrophobicContact CG-CG 4.44Å; K260-E264 WeakPolarHBondContact CG-OE1 3.37Å; K260-E264 WeakPolarHBondContact O-CB 3.45Å; K260-E264 VanDerWaalsContact O-CG 3.28Å; K260-E264 WeakPolarHBondContact O-CG 3.39Å; K260-E264 PolarHBondContact O-N 2.66Å; V261-E264 PolarHBondContact O-N 3.02Å; E264-N268 WeakPolarHBondContact O-CB 3.32Å; E264-N268 VanDerWaalsContact O-CG 3.25Å; E264-N268 PolarHBondContact O-N 3.11Å; E264-N268 PolarHBondContact O-ND2 2.8Å
265	R	83.3	Confident	78.1	Confident	61 Å²	61	72.8 Å²	72.8	23%	0.23	36%	0.363	C	S	.	.	H	α-helix	trans	-72.2	-43.6	179.5	-76	-80.1	175.5	172.4	-7.6	112.9	G199 V261 I262 K263 N268 L269 L289 D290 L293	G199-R265 PolarHBondContact O-NH2 3.14Å; V261-R265 HydrophobicContact CG1-CG 4.48Å; V261-R265 VanDerWaalsContact O-CB 3.3Å; V261-R265 WeakPolarHBondContact O-CB 3.34Å; V261-R265 VanDerWaalsContact O-CG 3.25Å; V261-R265 WeakPolarHBondContact O-CG 3.37Å; V261-R265 PolarHBondContact O-N 3.29Å; I262-R265 PolarHBondContact O-N 3.03Å; K263-R265 PolarHBondContact O-N 3.22Å; R265-N268 PolarHBondContact O-N 2.92Å; R265-L269 PolarHBondContact O-N 2.9Å; R265-L289 HydrophobicContact CB-CD2 3.87Å; R265-L289 HydrophobicContact CB-CG 4.43Å; R265-L289 HydrophobicContact CG-CD2 3.8Å; R265-D290 IonicContact NH1-OD1 3.5Å; R265-D290 IonicContact NH1-OD2 3.22Å; R265-L293 HydrophobicContact CB-CD1 4.12Å
266	S	82.3	Confident	75.8	Confident	38 Å²	38	75.1 Å²	75.1	27%	0.266	39%	0.385	S	S	.	.	H	α-helix	trans	-61.5	-43.4	177.2	-172.9	0	0	0	0	111.9	I262 K263 L269 S270	I262-S266 VanDerWaalsContact O-CB 3.31Å; I262-S266 WeakPolarHBondContact O-CB 3.39Å; I262-S266 PolarHBondContact O-N 2.81Å; K263-S266 PolarHBondContact O-N 3.18Å; S266-L269 PolarHBondContact O-N 3.18Å; S266-S270 PolarHBondContact O-N 2.93Å; S266-S270 VanDerWaalsContact O-N 3.15Å
267	E	82.6	Confident	73.3	Confident	86 Å²	86	79.8 Å²	79.8	40%	0.402	40%	0.404	S	S	.	.	H	α-helix	trans	-62	-50.2	177.1	-72.2	171.2	175.4	0	0	110.4	K263 L269 S270 Y271	K263-E267 WeakPolarHBondContact CE-OE1 3.36Å; K263-E267 IonicContact NZ-OE1 3.22Å; K263-E267 WeakPolarHBondContact O-CG 3.34Å; K263-E267 PolarHBondContact O-N 2.78Å; E267-L269 VanDerWaalsContact C-N 3.27Å; E267-L269 PolarHBondContact O-N 3.08Å; E267-S270 PolarHBondContact O-N 3.44Å; E267-S270 VanDerWaalsContact O-N 3.1Å; E267-S270 PolarHBondContact O-OG 3.01Å; E267-Y271 HydrophobicContact CB-CE2 4.4Å; E267-Y271 WeakPolarHBondContact O-CD2 3.49Å; E267-Y271 PolarHBondContact O-N 3.41Å; E267-Y271 VanDerWaalsContact O-N 3.11Å
268	N	78.4	Confident	71	Confident	90 Å²	90	82.4 Å²	82.4	48%	0.481	43%	0.427	S	S	.	.	H	α-helix	trans	-58.3	-36.1	177.5	-76.5	-43.3	0	0	0	113.5	E264 R265 I272	E264-N268 WeakPolarHBondContact O-CB 3.32Å; E264-N268 VanDerWaalsContact O-CG 3.25Å; E264-N268 PolarHBondContact O-N 3.11Å; E264-N268 PolarHBondContact O-ND2 2.8Å; R265-N268 PolarHBondContact O-N 2.92Å; N268-I272 WeakPolarHBondContact O-CD1 3.34Å; N268-I272 VanDerWaalsContact O-CG1 3.31Å; N268-I272 WeakPolarHBondContact O-CG1 3.14Å; N268-I272 PolarHBondContact O-N 3.24Å
269	L	73.4	Confident	68.7	Low	29 Å²	29	88.5 Å²	88.5	15%	0.152	46%	0.46	C	S	.	.	H	α-helix	trans	-66.4	-43	176.9	-138.5	88.6	0	0	0	111.3	R265 S266 E267 Y271 I272 E273 L293 K294	R265-L269 PolarHBondContact O-N 2.9Å; S266-L269 PolarHBondContact O-N 3.18Å; E267-L269 VanDerWaalsContact C-N 3.27Å; E267-L269 PolarHBondContact O-N 3.08Å; L269-Y271 VanDerWaalsContact C-N 3.34Å; L269-Y271 PolarHBondContact O-N 2.93Å; L269-I272 PolarHBondContact O-N 3.09Å; L269-E273 PolarHBondContact O-N 2.84Å; L269-L293 HydrophobicContact CD2-CB 4.27Å; L269-K294 HydrophobicContact CD2-CG 3.96Å
270	S	65.1	Low	66.5	Low	65 Å²	65	90.9 Å²	90.9	46%	0.455	48%	0.475	S	S	.	.	H	α-helix	trans	-64.1	-37.2	179	67.7	0	0	0	0	112.9	S266 E267 E273 S274	S266-S270 PolarHBondContact O-N 2.93Å; S266-S270 VanDerWaalsContact O-N 3.15Å; E267-S270 PolarHBondContact O-N 3.44Å; E267-S270 VanDerWaalsContact O-N 3.1Å; E267-S270 PolarHBondContact O-OG 3.01Å; S270-E273 PolarHBondContact O-N 3.16Å; S270-S274 PolarHBondContact O-N 2.95Å; S270-S274 VanDerWaalsContact O-N 3.12Å; S270-S274 PolarHBondContact O-OG 3.12Å
271	Y	61.2	Low	64	Low	156 Å²	156	88.9 Å²	88.9	61%	0.612	49%	0.487	S	S	*	.	H	α-helix	trans	-64.2	-40.2	174.8	-76	-68.6	0	0	0	112.4	E267 L269 S274 D275	E267-Y271 HydrophobicContact CB-CE2 4.4Å; E267-Y271 WeakPolarHBondContact O-CD2 3.49Å; E267-Y271 PolarHBondContact O-N 3.41Å; E267-Y271 VanDerWaalsContact O-N 3.11Å; L269-Y271 VanDerWaalsContact C-N 3.34Å; L269-Y271 PolarHBondContact O-N 2.93Å; Y271-S274 WeakPolarHBondContact CA-OG 3.45Å; Y271-S274 PolarHBondContact O-N 3.14Å; Y271-S274 PolarHBondContact O-OG 3.44Å; Y271-D275 WeakPolarHBondContact O-CB 3.46Å; Y271-D275 PolarHBondContact O-N 2.97Å
272	I	60.7	Low	61.8	Low	101 Å²	101	98.7 Å²	98.7	52%	0.518	53%	0.529	S	S	.	.	H	α-helix	trans	-70.9	-37.5	179.8	-65.6	165.3	0	0	0	111.5	N268 L269 S274 D275	N268-I272 WeakPolarHBondContact O-CD1 3.34Å; N268-I272 VanDerWaalsContact O-CG1 3.31Å; N268-I272 WeakPolarHBondContact O-CG1 3.14Å; N268-I272 PolarHBondContact O-N 3.24Å; L269-I272 PolarHBondContact O-N 3.09Å; I272-S274 VanDerWaalsContact C-N 3.27Å; I272-S274 PolarHBondContact O-N 2.96Å; I272-D275 PolarHBondContact O-N 2.91Å
273	E	58.7	Low	60	Low	119 Å²	119	110.2 Å²	110.2	56%	0.556	57%	0.573	S	S	*	*	H	α-helix	trans	-69.4	-25.5	175.3	-73.1	178.8	178.8	0	0	112.5	L269 S270	L269-E273 PolarHBondContact O-N 2.84Å; S270-E273 PolarHBondContact O-N 3.16Å
274	S	53.8	Low	58.6	Low	93 Å²	93	112.9 Å²	112.9	65%	0.65	58%	0.584	S	S	*	*	H	α-helix	trans	-83.1	-15.1	175.8	61.6	0	0	0	0	115.2	S270 Y271 I272	S270-S274 PolarHBondContact O-N 2.95Å; S270-S274 VanDerWaalsContact O-N 3.12Å; S270-S274 PolarHBondContact O-OG 3.12Å; Y271-S274 WeakPolarHBondContact CA-OG 3.45Å; Y271-S274 PolarHBondContact O-N 3.14Å; Y271-S274 PolarHBondContact O-OG 3.44Å; I272-S274 VanDerWaalsContact C-N 3.27Å; I272-S274 PolarHBondContact O-N 2.96Å
275	D	49	Very low	57.7	Low	113 Å²	113	113.8 Å²	113.8	60%	0.604	59%	0.585	S	S	*	*			trans	-111.3	22.8	-172.7	-153.8	19.8	0	0	0	112.5	Y271 I272 D277	Y271-D275 WeakPolarHBondContact O-CB 3.46Å; Y271-D275 PolarHBondContact O-N 2.97Å; I272-D275 PolarHBondContact O-N 2.91Å; D275-D277 PolarHBondContact O-N 3.11Å
276	S	44.7	Very low	57.1	Low	98 Å²	98	114.9 Å²	114.9	69%	0.685	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	49.7	-171.8	70.9	0	0	0	0	114.3
277	D	41.2	Very low	57	Low	176 Å²	176	113.2 Å²	113.2	94%	0.941	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.3	11.9	167.3	-121.3	-0.1	0	0	0	112.6	D275	D275-D277 PolarHBondContact O-N 3.11Å
278	S	39.8	Very low	57	Low	96 Å²	96	109.4 Å²	109.4	67%	0.671	56%	0.564	S	S	*	*	S	Bend	trans	-124.2	136.9	173.7	68.5	0	0	0	0	113.9
279	D	42.1	Very low	57.3	Low	129 Å²	129	105.1 Å²	105.1	69%	0.69	54%	0.541	S	S	*	.			trans	-84.9	161.2	-154.9	-169.8	24.3	0	0	0	114.7
280	H	42.9	Very low	57.7	Low	176 Å²	176	104.5 Å²	104.5	82%	0.815	54%	0.537	S	S	*	.			trans	35.7	88.1	158.8	-69	-34.2	0	0	0	119.9
281	G	36.7	Very low	58.4	Low	71 Å²	71	102.5 Å²	102.5	73%	0.732	52%	0.521	S	S	*	.			trans	-130.5	138.1	162.7	0	0	0	0	0	112.2	R283	G281-R283 PolarHBondContact O-N 3.38Å
282	K	41.4	Very low	59.5	Low	207 Å²	207	95.2 Å²	95.2	90%	0.9	49%	0.493	S	S	*	.			trans	-31.8	126.1	178.5	-73	174.9	177.4	175.7	0	112.3	K284	K282-K284 PolarHBondContact O-N 2.97Å
283	R	49.5	Very low	60.5	Low	244 Å²	244	91.3 Å²	91.3	92%	0.921	47%	0.473	S	S	*	.			trans	-44.1	103.6	176.5	-147.2	179.4	-167.8	175	2.8	109.3	G281 R285	G281-R283 PolarHBondContact O-N 3.38Å; R283-R285 PolarHBondContact O-N 3.31Å
284	K	59.4	Low	61.5	Low	157 Å²	157	91 Å²	91	68%	0.683	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-67	132	-175.9	-156.6	172.6	-174.6	177.2	0	107.6	K282 Q286	K282-K284 PolarHBondContact O-N 2.97Å; K284-Q286 PolarHBondContact O-N 3.34Å
285	R	65.5	Low	62.7	Low	84 Å²	84	88.1 Å²	88.1	32%	0.317	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-52	122.9	179.8	-66.1	-176.6	-173.2	160.6	9.9	109.1	E161 E195 R283	E161-R285 IonicContact OE1-CZ 3.87Å; E161-R285 IonicContact OE1-NH1 3.7Å; E161-R285 PolarHBondContact OE1-NH1 2.9Å; E161-R285 IonicContact OE1-NH2 3.46Å; E161-R285 PolarHBondContact OE1-NH2 2.95Å; E161-R285 IonicContact OE2-CZ 3.77Å; E161-R285 IonicContact OE2-NH1 3.51Å; E161-R285 PolarHBondContact OE2-NH1 3.45Å; E161-R285 IonicContact OE2-NH2 2.77Å; E161-R285 PolarHBondContact OE2-NH2 3.01Å; E195-R285 IonicContact OE1-NH1 3.23Å; E195-R285 PolarHBondContact OE1-NH1 3.04Å; E195-R285 VanDerWaalsContact OE1-NH1 3.13Å; R283-R285 PolarHBondContact O-N 3.31Å
286	Q	70.3	Confident	63.7	Low	84 Å²	84	86 Å²	86	39%	0.393	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-81.4	119.4	177.5	-67.8	-171.1	-30.1	0	0	109	F155 K284	F155-Q286 WeakPolarHBondContact CE1-O 3.31Å; K284-Q286 PolarHBondContact O-N 3.34Å
287	A	81.3	Confident	64.9	Low	4 Å²	4	82.9 Å²	82.9	3%	0.033	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-82.5	159.8	169.7	0	0	0	0	0	110.6	T196 L289 D290 M291	T196-A287 WeakPolarHBondContact O-CA 3.44Å; A287-L289 PolarHBondContact O-N 2.89Å; A287-D290 PolarHBondContact N-OD2 3.42Å; A287-D290 WeakPolarHBondContact O-CB 3.38Å; A287-D290 PolarHBondContact O-N 3.19Å; A287-M291 PolarHBondContact O-N 2.98Å
288	F	82.2	Confident	66	Low	6 Å²	6	80.2 Å²	80.2	3%	0.026	40%	0.397	C	S	.	.	H	α-helix	trans	-54.4	-41.8	172.9	177.4	-105.3	0	0	0	113	L143 T146 F147 T196 A197 D290 M291 L292 F315	L143-F288 HydrophobicContact CD2-CE1 4.45Å; L143-F288 HydrophobicContact CD2-CE2 3.66Å; L143-F288 HydrophobicContact CD2-CZ 3.33Å; L143-F288 HydrophobicContact CG-CZ 4.41Å; T146-F288 HydrophobicContact CG2-CD2 4.12Å; T146-F288 HydrophobicContact CG2-CE2 4.06Å; T146-F288 WeakPolarHBondContact OG1-CE2 3.47Å; F147-F288 HydrophobicContact CE2-CE2 4.02Å; F147-F288 HydrophobicContact CZ-CD2 4.48Å; F147-F288 HydrophobicContact CZ-CE2 4.27Å; T196-F288 PolarHBondContact O-N 3.43Å; A197-F288 HydrophobicContact CB-CB 4.29Å; A197-F288 WeakPolarHBondContact O-CB 3.47Å; A197-F288 PolarHBondContact O-N 3.47Å; F288-D290 VanDerWaalsContact C-N 3.29Å; F288-D290 PolarHBondContact O-N 3.47Å; F288-M291 HydrophobicContact CB-CE 4.36Å; F288-M291 HydrophobicContact CD2-CE 4.24Å; F288-M291 WeakPolarHBondContact O-CB 3.44Å; F288-M291 PolarHBondContact O-N 2.77Å; F288-M291 VanDerWaalsContact O-N 3.1Å; F288-L292 HydrophobicContact CD1-CD1 3.88Å; F288-L292 HydrophobicContact CD1-CG 4.28Å; F288-L292 HydrophobicContact CE1-CD1 3.38Å; F288-L292 HydrophobicContact CE1-CD2 4.48Å; F288-L292 HydrophobicContact CE1-CG 3.86Å; F288-L292 HydrophobicContact CZ-CD1 4.03Å; F288-L292 HydrophobicContact CZ-CD2 4.32Å; F288-L292 HydrophobicContact CZ-CG 4.1Å; F288-L292 PolarHBondContact O-N 3.01Å; F288-F315 HydrophobicContact CD1-CD2 4.19Å; F288-F315 HydrophobicContact CD1-CG 4.45Å; F288-F315 HydrophobicContact CE1-CB 4.49Å; F288-F315 AromaticContact CE1-CD2 3.25Å; F288-F315 HydrophobicContact CE1-CD2 3.25Å; F288-F315 AromaticContact CE1-CE2 3.61Å; F288-F315 HydrophobicContact CE1-CE2 3.61Å; F288-F315 AromaticContact CE1-CG 3.91Å; F288-F315 HydrophobicContact CE1-CG 3.91Å; F288-F315 HydrophobicContact CE1-CZ 4.45Å; F288-F315 HydrophobicContact CE2-CD2 4.38Å; F288-F315 HydrophobicContact CE2-CE2 4.08Å; F288-F315 HydrophobicContact CE2-CZ 4.21Å; F288-F315 AromaticContact CZ-CD2 3.38Å; F288-F315 HydrophobicContact CZ-CD2 3.38Å; F288-F315 HydrophobicContact CZ-CE1 4.43Å; F288-F315 AromaticContact CZ-CE2 3.19Å; F288-F315 HydrophobicContact CZ-CE2 3.19Å; F288-F315 HydrophobicContact CZ-CG 4.14Å; F288-F315 AromaticContact CZ-CZ 3.75Å; F288-F315 HydrophobicContact CZ-CZ 3.75Å
289	L	83.9	Confident	67.4	Low	0 Å²	0	82 Å²	82	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-59.2	-37.2	175.2	176.1	56.3	0	0	0	112.9	A197 V261 I262 R265 A287 M291 L292 L293 I308 V312	A197-L289 WeakPolarHBondContact O-CB 3.03Å; A197-L289 PolarHBondContact O-N 3.02Å; V261-L289 HydrophobicContact CG1-CD2 3.96Å; I262-L289 HydrophobicContact CG1-CD1 3.97Å; I262-L289 HydrophobicContact CG1-CD2 4.19Å; R265-L289 HydrophobicContact CB-CD2 3.87Å; R265-L289 HydrophobicContact CB-CG 4.43Å; R265-L289 HydrophobicContact CG-CD2 3.8Å; A287-L289 PolarHBondContact O-N 2.89Å; L289-M291 PolarHBondContact O-N 3.34Å; L289-L292 PolarHBondContact O-N 3.17Å; L289-L293 HydrophobicContact CD1-CD1 4.12Å; L289-L293 HydrophobicContact CD1-CG 4.06Å; L289-L293 HydrophobicContact CG-CD1 4.05Å; L289-L293 HydrophobicContact CG-CG 4.48Å; L289-L293 WeakPolarHBondContact O-CG 3.39Å; L289-L293 PolarHBondContact O-N 3.32Å; L289-I308 HydrophobicContact CD1-CG2 3.55Å; L289-V312 HydrophobicContact CD1-CG2 3.92Å
290	D	82.3	Confident	68.8	Low	16 Å²	16	78.2 Å²	78.2	9%	0.086	39%	0.39	C	S	.	.	H	α-helix	trans	-65	-32.2	178.1	-58.3	-36.1	0	0	0	111	R265 A287 F288 K294	R265-D290 IonicContact NH1-OD1 3.5Å; R265-D290 IonicContact NH1-OD2 3.22Å; A287-D290 PolarHBondContact N-OD2 3.42Å; A287-D290 WeakPolarHBondContact O-CB 3.38Å; A287-D290 PolarHBondContact O-N 3.19Å; F288-D290 VanDerWaalsContact C-N 3.29Å; F288-D290 PolarHBondContact O-N 3.47Å; D290-K294 WeakPolarHBondContact O-CG 3.37Å; D290-K294 PolarHBondContact O-N 2.84Å
291	M	80.1	Confident	70.4	Confident	23 Å²	23	74.2 Å²	74.2	11%	0.113	38%	0.375	C	S	.	.	H	α-helix	trans	-73.1	-42.7	174.5	-63.2	-177.3	-77.9	0	0	111.4	T146 I151 F155 A287 F288 L289 L293 K294 T295	T146-M291 HydrophobicContact CG2-CB 3.99Å; T146-M291 HydrophobicContact CG2-CE 3.72Å; T146-M291 HydrophobicContact CG2-CG 4.45Å; T146-M291 HydrophobicContact CG2-SD 3.63Å; I151-M291 HydrophobicContact CD1-SD 3.63Å; I151-M291 HydrophobicContact CG1-SD 4.37Å; I151-M291 HydrophobicContact CG2-CE 3.83Å; I151-M291 HydrophobicContact CG2-SD 4.14Å; F155-M291 HydrophobicContact CZ-CE 4.35Å; A287-M291 PolarHBondContact O-N 2.98Å; F288-M291 HydrophobicContact CB-CE 4.36Å; F288-M291 HydrophobicContact CD2-CE 4.24Å; F288-M291 WeakPolarHBondContact O-CB 3.44Å; F288-M291 PolarHBondContact O-N 2.77Å; F288-M291 VanDerWaalsContact O-N 3.1Å; L289-M291 PolarHBondContact O-N 3.34Å; M291-L293 VanDerWaalsContact C-N 3.33Å; M291-L293 PolarHBondContact O-N 3.38Å; M291-K294 PolarHBondContact O-N 3.1Å; M291-T295 PolarHBondContact O-N 3.47Å; M291-T295 PolarHBondContact O-OG1 3.1Å
292	L	83.3	Confident	72.4	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.01	37%	0.37	C	S	.	.	H	α-helix	trans	-58	-43.7	175	-79.3	-179	0	0	0	112.5	L143 F288 L289 K294 T295 L303 I308 E311 V312	L143-L292 HydrophobicContact CD2-CD2 3.48Å; L143-L292 VanDerWaalsContact CD2-CD2 3.48Å; L143-L292 HydrophobicContact CD2-CG 4.42Å; F288-L292 HydrophobicContact CD1-CD1 3.88Å; F288-L292 HydrophobicContact CD1-CG 4.28Å; F288-L292 HydrophobicContact CE1-CD1 3.38Å; F288-L292 HydrophobicContact CE1-CD2 4.48Å; F288-L292 HydrophobicContact CE1-CG 3.86Å; F288-L292 HydrophobicContact CZ-CD1 4.03Å; F288-L292 HydrophobicContact CZ-CD2 4.32Å; F288-L292 HydrophobicContact CZ-CG 4.1Å; F288-L292 PolarHBondContact O-N 3.01Å; L289-L292 PolarHBondContact O-N 3.17Å; L292-K294 VanDerWaalsContact C-N 3.26Å; L292-K294 PolarHBondContact O-N 3.36Å; L292-T295 PolarHBondContact O-N 3.31Å; L292-L303 HydrophobicContact CD2-CD1 4.06Å; L292-I308 HydrophobicContact CB-CG1 4.5Å; L292-I308 HydrophobicContact CB-CG2 4.31Å; L292-I308 HydrophobicContact CD1-CG2 4.2Å; L292-E311 HydrophobicContact CD1-CB 3.93Å; L292-V312 HydrophobicContact CD1-CG2 4.12Å
293	L	83.2	Confident	74.4	Confident	19 Å²	19	68.7 Å²	68.7	10%	0.099	33%	0.331	C	S	.	.	H	α-helix	trans	-65	-29	179.7	-73	166.9	0	0	0	113.2	R265 L269 L289 M291 I308	R265-L293 HydrophobicContact CB-CD1 4.12Å; L269-L293 HydrophobicContact CD2-CB 4.27Å; L289-L293 HydrophobicContact CD1-CD1 4.12Å; L289-L293 HydrophobicContact CD1-CG 4.06Å; L289-L293 HydrophobicContact CG-CD1 4.05Å; L289-L293 HydrophobicContact CG-CG 4.48Å; L289-L293 WeakPolarHBondContact O-CG 3.39Å; L289-L293 PolarHBondContact O-N 3.32Å; M291-L293 VanDerWaalsContact C-N 3.33Å; M291-L293 PolarHBondContact O-N 3.38Å; L293-I308 HydrophobicContact CD2-CD1 3.82Å
294	K	78.6	Confident	76.2	Confident	112 Å²	112	59.6 Å²	59.6	49%	0.487	31%	0.305	S	S	.	.	H	α-helix	trans	-90.1	-13	178.8	-68.7	177.8	-178	-174.1	0	113.6	L269 D290 M291 L292	L269-K294 HydrophobicContact CD2-CG 3.96Å; D290-K294 WeakPolarHBondContact O-CG 3.37Å; D290-K294 PolarHBondContact O-N 2.84Å; M291-K294 PolarHBondContact O-N 3.1Å; L292-K294 VanDerWaalsContact C-N 3.26Å; L292-K294 PolarHBondContact O-N 3.36Å
295	T	78.6	Confident	77.4	Confident	34 Å²	34	57 Å²	57	21%	0.209	30%	0.295	C	S	.	.			trans	-83	135.5	-173.2	-56.5	0	0	0	0	111.6	I142 M291 L292	I142-T295 HydrophobicContact CB-CG2 4.26Å; I142-T295 HydrophobicContact CD1-CG2 4.43Å; I142-T295 HydrophobicContact CG1-CG2 4.04Å; I142-T295 HydrophobicContact CG2-CG2 3.44Å; I142-T295 VanDerWaalsContact CG2-CG2 3.44Å; M291-T295 PolarHBondContact O-N 3.47Å; M291-T295 PolarHBondContact O-OG1 3.1Å; L292-T295 PolarHBondContact O-N 3.31Å
296	T	71.6	Confident	78.4	Confident	69 Å²	69	59.5 Å²	59.5	42%	0.423	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-104.9	154.3	168.8	57.6	0	0	0	0	110.8	N301 K302	T296-N301 CarbonylContact C-O 3.55Å; T296-N301 WeakPolarHBondContact CA-O 3.48Å; T296-K302 HydrophobicContact CG2-CG 4.3Å
297	D	69.6	Low	79.3	Confident	31 Å²	31	57.1 Å²	57.1	17%	0.166	30%	0.3	C	S	.	.			trans	-76.5	-175.8	171.2	66	21.3	0	0	0	113.3	D299 G300 N301	D297-D299 PolarHBondContact O-N 2.95Å; D297-D299 WeakPolarHBondContact OD1-CA 3.3Å; D297-D299 PolarHBondContact OD1-N 3.5Å; D297-G300 PolarHBondContact O-N 3.17Å; D297-G300 PolarHBondContact OD1-N 3.46Å; D297-N301 PolarHBondContact N-O 3.27Å; D297-N301 WeakPolarHBondContact OD1-CB 3.07Å; D297-N301 PolarHBondContact OD1-N 3.37Å
298	E	63.9	Low	79.7	Confident	120 Å²	120	57.2 Å²	57.2	56%	0.561	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-23	-178.9	-58.5	-168	147.4	0	0	112.9	K141 G300	K141-E298 IonicContact NZ-OE1 2.69Å; K141-E298 PolarHBondContact NZ-OE1 2.93Å; E298-G300 VanDerWaalsContact C-N 3.32Å
299	D	69.1	Low	80.1	Confident	135 Å²	135	58.5 Å²	58.5	72%	0.722	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	2.8	177	-59.8	-45.3	0	0	0	111.8	D297 N301	D297-D299 PolarHBondContact O-N 2.95Å; D297-D299 WeakPolarHBondContact OD1-CA 3.3Å; D297-D299 PolarHBondContact OD1-N 3.5Å; D299-N301 VanDerWaalsContact C-N 3.32Å; D299-N301 WeakPolarHBondContact CB-ND2 3.4Å
300	G	71.8	Confident	80.4	Confident	48 Å²	48	59.2 Å²	59.2	50%	0.495	31%	0.31	S	S	.	.	S	Bend	trans	80.3	6.6	-178.7	0	0	0	0	0	114.5	D297 E298	D297-G300 PolarHBondContact O-N 3.17Å; D297-G300 PolarHBondContact OD1-N 3.46Å; E298-G300 VanDerWaalsContact C-N 3.32Å
301	N	75.9	Confident	80.9	Confident	93 Å²	93	58.5 Å²	58.5	50%	0.497	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-82.8	142.7	179	-55.9	-59	0	0	0	111.2	T296 D297 D299	T296-N301 CarbonylContact C-O 3.55Å; T296-N301 WeakPolarHBondContact CA-O 3.48Å; D297-N301 PolarHBondContact N-O 3.27Å; D297-N301 WeakPolarHBondContact OD1-CB 3.07Å; D297-N301 PolarHBondContact OD1-N 3.37Å; D299-N301 VanDerWaalsContact C-N 3.32Å; D299-N301 WeakPolarHBondContact CB-ND2 3.4Å
302	K	78.8	Confident	81.3	Confident	147 Å²	147	57.5 Å²	57.5	64%	0.639	30%	0.301	S	S	*	.	B	Isolated β-bridge	trans	-68.6	148.2	171.3	-68	-171	178	-172.1	0	110.4	T296	T296-K302 HydrophobicContact CG2-CG 4.3Å
303	L	83.6	Confident	81.7	Confident	14 Å²	14	57.5 Å²	57.5	7%	0.073	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-61.7	139.9	171.1	-60.6	-176.6	0	0	0	110.6	I142 L292 D307 I308	I142-L303 HydrophobicContact CD1-CD2 4.39Å; L292-L303 HydrophobicContact CD2-CD1 4.06Å; L303-D307 HydrophobicContact CB-CB 4.37Å; L303-I308 HydrophobicContact CB-CD1 4.3Å; L303-I308 HydrophobicContact CB-CG1 3.87Å
304	S	86.9	Confident	82.1	Confident	54 Å²	54	56.6 Å²	56.6	38%	0.378	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-66.1	156	174.3	73.3	0	0	0	0	110.8	Q306 D307 I308	S304-Q306 PolarHBondContact O-N 2.95Å; S304-D307 PolarHBondContact N-OD2 3.08Å; S304-D307 WeakPolarHBondContact O-CB 3.31Å; S304-D307 PolarHBondContact O-N 3.25Å; S304-D307 VanDerWaalsContact O-N 3.09Å; S304-D307 WeakPolarHBondContact OG-CB 3.44Å; S304-D307 PolarHBondContact OG-N 3.26Å; S304-D307 VanDerWaalsContact OG-N 3.09Å; S304-D307 PolarHBondContact OG-OD2 3.06Å; S304-I308 WeakPolarHBondContact O-CG1 3.26Å; S304-I308 PolarHBondContact O-N 3.08Å
305	H	84.5	Confident	82.6	Confident	103 Å²	103	51.9 Å²	51.9	48%	0.477	28%	0.276	S	S	.	.	H	α-helix	trans	-56.2	-36.6	174.2	-82.1	-75.4	0	0	0	112.5	I308 Q309	H305-I308 PolarHBondContact O-N 2.62Å; H305-Q309 WeakPolarHBondContact O-CB 3.26Å; H305-Q309 PolarHBondContact O-N 2.97Å
306	Q	87.4	Confident	82.9	Confident	135 Å²	135	50.4 Å²	50.4	63%	0.631	27%	0.267	S	S	*	.	H	α-helix	trans	-64.8	-45.4	176.4	-176	176.8	-1.1	0	0	111.1	S304 I308 Q309 E310	S304-Q306 PolarHBondContact O-N 2.95Å; Q306-I308 VanDerWaalsContact C-N 3.3Å; Q306-I308 PolarHBondContact O-N 3.42Å; Q306-Q309 WeakPolarHBondContact O-CB 3.49Å; Q306-Q309 PolarHBondContact O-N 3.14Å; Q306-Q309 VanDerWaalsContact O-N 3.16Å; Q306-E310 WeakPolarHBondContact O-CG 3.46Å; Q306-E310 PolarHBondContact O-N 2.94Å
307	D	88.5	Confident	83.5	Confident	34 Å²	34	48.1 Å²	48.1	18%	0.182	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-37.8	177	-71.4	-55	0	0	0	112.7	K135 R139 L303 S304 E311	K135-D307 IonicContact NZ-OD1 3.29Å; R139-D307 IonicContact CZ-OD1 3.89Å; R139-D307 IonicContact NH2-OD1 3.72Å; R139-D307 PolarHBondContact NH2-OD1 2.9Å; R139-D307 IonicContact NH2-OD2 2.75Å; R139-D307 PolarHBondContact NH2-OD2 3.44Å; L303-D307 HydrophobicContact CB-CB 4.37Å; S304-D307 PolarHBondContact N-OD2 3.08Å; S304-D307 WeakPolarHBondContact O-CB 3.31Å; S304-D307 PolarHBondContact O-N 3.25Å; S304-D307 VanDerWaalsContact O-N 3.09Å; S304-D307 WeakPolarHBondContact OG-CB 3.44Å; S304-D307 PolarHBondContact OG-N 3.26Å; S304-D307 VanDerWaalsContact OG-N 3.09Å; S304-D307 PolarHBondContact OG-OD2 3.06Å; D307-E311 PolarHBondContact O-N 3.05Å
308	I	89.6	Confident	84.3	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-65.4	-43.3	174.8	-65.8	173.8	0	0	0	109.8	I262 L289 L292 L293 L303 S304 H305 Q306 E311 V312	I262-I308 HydrophobicContact CD1-CG2 4.15Å; I262-I308 HydrophobicContact CG1-CG2 4.27Å; I262-I308 HydrophobicContact CG2-CG2 4.2Å; L289-I308 HydrophobicContact CD1-CG2 3.55Å; L292-I308 HydrophobicContact CB-CG1 4.5Å; L292-I308 HydrophobicContact CB-CG2 4.31Å; L292-I308 HydrophobicContact CD1-CG2 4.2Å; L293-I308 HydrophobicContact CD2-CD1 3.82Å; L303-I308 HydrophobicContact CB-CD1 4.3Å; L303-I308 HydrophobicContact CB-CG1 3.87Å; S304-I308 WeakPolarHBondContact O-CG1 3.26Å; S304-I308 PolarHBondContact O-N 3.08Å; H305-I308 PolarHBondContact O-N 2.62Å; Q306-I308 VanDerWaalsContact C-N 3.3Å; Q306-I308 PolarHBondContact O-N 3.42Å; I308-E311 PolarHBondContact O-N 3.39Å; I308-V312 HydrophobicContact CG2-CG2 4.22Å; I308-V312 VanDerWaalsContact O-CG2 3.31Å; I308-V312 WeakPolarHBondContact O-CG2 3.43Å; I308-V312 PolarHBondContact O-N 3.21Å
309	Q	90.1	Very high	85.3	Confident	33 Å²	33	44 Å²	44	15%	0.154	23%	0.234	C	C	.	.	H	α-helix	trans	-62.2	-43.6	177.3	-174.9	170	30.7	0	0	112.3	H255 T258 I262 H305 Q306 E311 V312 D313	H255-Q309 PolarHBondContact O-NE2 3.04Å; T258-Q309 PolarHBondContact OG1-NE2 3.27Å; I262-Q309 HydrophobicContact CD1-CB 3.76Å; I262-Q309 HydrophobicContact CD1-CG 4.19Å; H305-Q309 WeakPolarHBondContact O-CB 3.26Å; H305-Q309 PolarHBondContact O-N 2.97Å; Q306-Q309 WeakPolarHBondContact O-CB 3.49Å; Q306-Q309 PolarHBondContact O-N 3.14Å; Q306-Q309 VanDerWaalsContact O-N 3.16Å; Q309-E311 VanDerWaalsContact C-N 3.27Å; Q309-E311 PolarHBondContact O-N 3.2Å; Q309-V312 PolarHBondContact O-N 2.85Å; Q309-D313 WeakPolarHBondContact CG-OD2 2.87Å; Q309-D313 WeakPolarHBondContact O-CB 3.48Å; Q309-D313 VanDerWaalsContact O-CG 3.3Å; Q309-D313 PolarHBondContact O-N 3.4Å
310	E	91.8	Very high	86.2	Confident	16 Å²	16	37.7 Å²	37.7	8%	0.075	20%	0.2	C	C	.	.	H	α-helix	trans	-53.5	-45.2	175.3	-70.9	-174	148.6	0	0	111.6	T126 K135 Q306 T314	T126-E310 VanDerWaalsContact N-CD 3.33Å; T126-E310 PolarHBondContact N-OE1 3.27Å; T126-E310 PolarHBondContact OG1-OE1 3.49Å; K135-E310 IonicContact NZ-OE1 3.57Å; K135-E310 IonicContact NZ-OE2 3.28Å; K135-E310 PolarHBondContact NZ-OE2 2.91Å; Q306-E310 WeakPolarHBondContact O-CG 3.46Å; Q306-E310 PolarHBondContact O-N 2.94Å; E310-T314 WeakPolarHBondContact O-CB 3.34Å; E310-T314 PolarHBondContact O-N 3.19Å; E310-T314 VanDerWaalsContact O-N 3.08Å; E310-T314 PolarHBondContact O-OG1 3.21Å
311	E	91.4	Very high	86.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-72.4	-45.7	179.2	-61.4	-56.7	161.5	0	0	111.6	G127 L128 R139 L143 L292 D307 I308 Q309 D313 T314 F315	G127-E311 WeakPolarHBondContact CA-OE1 3.45Å; L128-E311 VanDerWaalsContact CB-OE2 3.24Å; L128-E311 WeakPolarHBondContact CB-OE2 3.37Å; L128-E311 PolarHBondContact N-OE1 2.72Å; L128-E311 PolarHBondContact N-OE2 3.29Å; L128-E311 VanDerWaalsContact N-OE2 3.1Å; R139-E311 WeakPolarHBondContact CD-OE1 3.47Å; R139-E311 WeakPolarHBondContact CG-OE1 3.32Å; R139-E311 IonicContact NE-OE1 2.73Å; L143-E311 HydrophobicContact CD1-CG 4.25Å; L143-E311 WeakPolarHBondContact CD1-OE2 3.44Å; L292-E311 HydrophobicContact CD1-CB 3.93Å; D307-E311 PolarHBondContact O-N 3.05Å; I308-E311 PolarHBondContact O-N 3.39Å; Q309-E311 VanDerWaalsContact C-N 3.27Å; Q309-E311 PolarHBondContact O-N 3.2Å; E311-D313 PolarHBondContact O-N 3Å; E311-T314 WeakPolarHBondContact O-CB 3.15Å; E311-T314 PolarHBondContact O-N 2.81Å; E311-T314 VanDerWaalsContact O-N 3.11Å; E311-F315 HydrophobicContact CB-CD2 4.48Å; E311-F315 WeakPolarHBondContact O-CD2 3.46Å; E311-F315 PolarHBondContact O-N 3.34Å
312	V	90.2	Very high	87.2	Confident	2 Å²	2	33 Å²	33	1%	0.012	17%	0.165	C	C	.	.	H	α-helix	trans	-57.4	-48.1	177.6	172	0	0	0	0	111.2	M198 T258 I262 L289 L292 I308 Q309 T314 F315 M316	M198-V312 HydrophobicContact CG-CG1 3.79Å; M198-V312 HydrophobicContact SD-CG1 4.13Å; T258-V312 HydrophobicContact CG2-CG1 4.2Å; I262-V312 HydrophobicContact CD1-CB 4.38Å; I262-V312 HydrophobicContact CD1-CG2 4.23Å; I262-V312 HydrophobicContact CG1-CG2 4.35Å; L289-V312 HydrophobicContact CD1-CG2 3.92Å; L292-V312 HydrophobicContact CD1-CG2 4.12Å; I308-V312 HydrophobicContact CG2-CG2 4.22Å; I308-V312 VanDerWaalsContact O-CG2 3.31Å; I308-V312 WeakPolarHBondContact O-CG2 3.43Å; I308-V312 PolarHBondContact O-N 3.21Å; Q309-V312 PolarHBondContact O-N 2.85Å; V312-T314 VanDerWaalsContact C-N 3.29Å; V312-T314 PolarHBondContact O-N 3.28Å; V312-F315 PolarHBondContact O-N 3.01Å; V312-M316 HydrophobicContact CG1-CG 4.37Å; V312-M316 HydrophobicContact CG1-SD 4.15Å; V312-M316 WeakPolarHBondContact O-CB 3.36Å; V312-M316 VanDerWaalsContact O-CG 3.26Å; V312-M316 WeakPolarHBondContact O-CG 3.46Å; V312-M316 PolarHBondContact O-N 2.77Å
313	D	90.6	Very high	87.8	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.011	14%	0.136	C	C	.	.	H	α-helix	trans	-60.1	-41.3	177	-69.5	-24.2	0	0	0	111	L124 H255 T258 Q309 E311 F317	L124-D313 HydrophobicContact CD2-CB 4.17Å; H255-D313 IonicContact CD2-OD2 3.63Å; H255-D313 PolarHBondContact CD2-OD2 2.98Å; H255-D313 IonicContact NE2-OD2 3.45Å; H255-D313 PolarHBondContact NE2-OD2 2.98Å; T258-D313 VanDerWaalsContact CB-OD1 3.23Å; T258-D313 WeakPolarHBondContact CB-OD1 2.98Å; T258-D313 WeakPolarHBondContact CG2-OD1 3.37Å; T258-D313 PolarHBondContact OG1-OD1 3.45Å; Q309-D313 WeakPolarHBondContact CG-OD2 2.87Å; Q309-D313 WeakPolarHBondContact O-CB 3.48Å; Q309-D313 VanDerWaalsContact O-CG 3.3Å; Q309-D313 PolarHBondContact O-N 3.4Å; E311-D313 PolarHBondContact O-N 3Å; D313-F317 PolarHBondContact O-N 3.39Å; D313-F317 VanDerWaalsContact O-N 3.08Å
314	T	90.7	Very high	88.1	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.1	-51.7	176.2	-62.2	0	0	0	0	111.7	L129 E310 E311 V312 M316 F317 E318	L129-T314 HydrophobicContact CB-CG2 3.94Å; E310-T314 WeakPolarHBondContact O-CB 3.34Å; E310-T314 PolarHBondContact O-N 3.19Å; E310-T314 VanDerWaalsContact O-N 3.08Å; E310-T314 PolarHBondContact O-OG1 3.21Å; E311-T314 WeakPolarHBondContact O-CB 3.15Å; E311-T314 PolarHBondContact O-N 2.81Å; E311-T314 VanDerWaalsContact O-N 3.11Å; V312-T314 VanDerWaalsContact C-N 3.29Å; V312-T314 PolarHBondContact O-N 3.28Å; T314-M316 PolarHBondContact O-N 3.43Å; T314-F317 PolarHBondContact O-N 3.19Å; T314-E318 HydrophobicContact CG2-CG 4.32Å; T314-E318 WeakPolarHBondContact O-CB 2.9Å; T314-E318 WeakPolarHBondContact O-CG 3.25Å; T314-E318 PolarHBondContact O-N 3.42Å
315	F	89.6	Confident	88.1	Confident	13 Å²	13	23.4 Å²	23.4	6%	0.057	12%	0.119	C	C	.	.	H	α-helix	trans	-68.7	-35.1	-177.5	-79.9	-77.8	0	0	0	112.8	L128 L143 F147 I193 F288 E311 V312 G319 I457	L128-F315 HydrophobicContact CD2-CZ 4.05Å; L143-F315 HydrophobicContact CD1-CE2 3.87Å; L143-F315 HydrophobicContact CD1-CZ 4.14Å; F147-F315 HydrophobicContact CE1-CE1 4.2Å; F147-F315 AromaticContact CE2-CE1 3.59Å; F147-F315 HydrophobicContact CE2-CE1 3.59Å; F147-F315 AromaticContact CE2-CZ 3.79Å; F147-F315 HydrophobicContact CE2-CZ 3.79Å; F147-F315 AromaticContact CZ-CD1 3.78Å; F147-F315 HydrophobicContact CZ-CD1 3.78Å; F147-F315 AromaticContact CZ-CE1 3.16Å; F147-F315 HydrophobicContact CZ-CE1 3.16Å; F147-F315 AromaticContact CZ-CZ 3.84Å; F147-F315 HydrophobicContact CZ-CZ 3.84Å; I193-F315 WeakPolarHBondContact CG1-O 3.44Å; F288-F315 HydrophobicContact CD1-CD2 4.19Å; F288-F315 HydrophobicContact CD1-CG 4.45Å; F288-F315 HydrophobicContact CE1-CB 4.49Å; F288-F315 AromaticContact CE1-CD2 3.25Å; F288-F315 HydrophobicContact CE1-CD2 3.25Å; F288-F315 AromaticContact CE1-CE2 3.61Å; F288-F315 HydrophobicContact CE1-CE2 3.61Å; F288-F315 AromaticContact CE1-CG 3.91Å; F288-F315 HydrophobicContact CE1-CG 3.91Å; F288-F315 HydrophobicContact CE1-CZ 4.45Å; F288-F315 HydrophobicContact CE2-CD2 4.38Å; F288-F315 HydrophobicContact CE2-CE2 4.08Å; F288-F315 HydrophobicContact CE2-CZ 4.21Å; F288-F315 AromaticContact CZ-CD2 3.38Å; F288-F315 HydrophobicContact CZ-CD2 3.38Å; F288-F315 HydrophobicContact CZ-CE1 4.43Å; F288-F315 AromaticContact CZ-CE2 3.19Å; F288-F315 HydrophobicContact CZ-CE2 3.19Å; F288-F315 HydrophobicContact CZ-CG 4.14Å; F288-F315 AromaticContact CZ-CZ 3.75Å; F288-F315 HydrophobicContact CZ-CZ 3.75Å; E311-F315 HydrophobicContact CB-CD2 4.48Å; E311-F315 WeakPolarHBondContact O-CD2 3.46Å; E311-F315 PolarHBondContact O-N 3.34Å; V312-F315 PolarHBondContact O-N 3.01Å; F315-G319 WeakPolarHBondContact O-CA 3.47Å; F315-G319 PolarHBondContact O-N 3.25Å; F315-I457 HydrophobicContact CE1-CG2 3.68Å; F315-I457 HydrophobicContact CZ-CG2 3.9Å
316	M	85.8	Confident	88.4	Confident	4 Å²	4	18.5 Å²	18.5	2%	0.02	10%	0.096	C	C	.	.	H	α-helix	trans	-61.3	-48.3	173.2	-72.9	-175.4	-13.4	0	0	111.1	M198 Y212 T258 V312 T314 H320	M198-M316 HydrophobicContact CE-CG 3.91Å; M198-M316 HydrophobicContact CE-SD 3.31Å; M198-M316 WeakPolarHBondContact CE-SD 3.23Å; M198-M316 HydrophobicContact CG-SD 4.3Å; M198-M316 HydrophobicContact SD-CG 4.25Å; M198-M316 HydrophobicContact SD-SD 3.33Å; Y212-M316 HydrophobicContact CE2-CE 4.1Å; Y212-M316 WeakPolarHBondContact OH-CE 3.42Å; Y212-M316 PolarHBondContact OH-SD 3.1Å; T258-M316 HydrophobicContact CG2-CE 3.28Å; T258-M316 HydrophobicContact CG2-SD 3.44Å; T258-M316 WeakPolarHBondContact CG2-SD 3.49Å; V312-M316 HydrophobicContact CG1-CG 4.37Å; V312-M316 HydrophobicContact CG1-SD 4.15Å; V312-M316 WeakPolarHBondContact O-CB 3.36Å; V312-M316 VanDerWaalsContact O-CG 3.26Å; V312-M316 WeakPolarHBondContact O-CG 3.46Å; V312-M316 PolarHBondContact O-N 2.77Å; T314-M316 PolarHBondContact O-N 3.43Å; M316-H320 PolarHBondContact O-CE1 3.41Å; M316-H320 VanDerWaalsContact O-CE1 3.27Å; M316-H320 PolarHBondContact O-ND1 3.32Å
317	F	83.5	Confident	88.8	Confident	20 Å²	20	12.1 Å²	12.1	9%	0.088	7%	0.066	C	C	.	.	H	α-helix	trans	-64	-52.9	179.3	171.1	-123.6	0	0	0	112	L120 W123 L124 D313 T314 G319 H320 L494	L120-F317 HydrophobicContact CD2-CE1 4.18Å; W123-F317 HydrophobicContact CE3-CG 4.47Å; W123-F317 HydrophobicContact CH2-CB 3.76Å; W123-F317 HydrophobicContact CH2-CD1 4.47Å; W123-F317 AromaticContact CH2-CD2 3.11Å; W123-F317 HydrophobicContact CH2-CD2 3.11Å; W123-F317 AromaticContact CH2-CE2 3.75Å; W123-F317 HydrophobicContact CH2-CE2 3.75Å; W123-F317 AromaticContact CH2-CG 3.52Å; W123-F317 HydrophobicContact CH2-CG 3.52Å; W123-F317 HydrophobicContact CZ2-CB 3.89Å; W123-F317 HydrophobicContact CZ2-CD2 4.08Å; W123-F317 HydrophobicContact CZ2-CG 4.17Å; W123-F317 HydrophobicContact CZ3-CB 4.27Å; W123-F317 HydrophobicContact CZ3-CD1 4.2Å; W123-F317 AromaticContact CZ3-CD2 3.38Å; W123-F317 HydrophobicContact CZ3-CD2 3.38Å; W123-F317 HydrophobicContact CZ3-CE1 4.4Å; W123-F317 AromaticContact CZ3-CE2 3.61Å; W123-F317 HydrophobicContact CZ3-CE2 3.61Å; W123-F317 AromaticContact CZ3-CG 3.67Å; W123-F317 HydrophobicContact CZ3-CG 3.67Å; W123-F317 HydrophobicContact CZ3-CZ 4.12Å; L124-F317 HydrophobicContact CD1-CD1 3.79Å; L124-F317 HydrophobicContact CD1-CE1 4.39Å; L124-F317 HydrophobicContact CD2-CB 4.09Å; L124-F317 HydrophobicContact CD2-CD1 4.48Å; D313-F317 PolarHBondContact O-N 3.39Å; D313-F317 VanDerWaalsContact O-N 3.08Å; T314-F317 PolarHBondContact O-N 3.19Å; F317-G319 PolarHBondContact O-N 3.4Å; F317-H320 PolarHBondContact O-ND1 3.17Å; F317-L494 HydrophobicContact CZ-CD1 4.45Å
318	E	86	Confident	88.9	Confident	53 Å²	53	10.6 Å²	10.6	25%	0.248	6%	0.058	C	C	.	.	H	α-helix	trans	-71.6	-29.2	-172.3	-66.1	-171.8	151.7	0	0	113.6	L129 T314 T322	L129-E318 WeakPolarHBondContact CB-OE1 3.49Å; L129-E318 WeakPolarHBondContact CD1-OE1 3.34Å; L129-E318 VanDerWaalsContact CD2-OE1 3.22Å; L129-E318 WeakPolarHBondContact CD2-OE1 3.38Å; L129-E318 VanDerWaalsContact CG-OE1 3.27Å; L129-E318 WeakPolarHBondContact CG-OE1 3.26Å; T314-E318 HydrophobicContact CG2-CG 4.32Å; T314-E318 WeakPolarHBondContact O-CB 2.9Å; T314-E318 WeakPolarHBondContact O-CG 3.25Å; T314-E318 PolarHBondContact O-N 3.42Å; E318-T322 PolarHBondContact O-OG1 2.85Å
319	G	85.9	Confident	88.9	Confident	13 Å²	13	11.3 Å²	11.3	13%	0.134	6%	0.06	C	C	.	.	H	α-helix	trans	-86	-9.7	-166.3	0	0	0	0	0	116.7	F315 F317 T323	F315-G319 WeakPolarHBondContact O-CA 3.47Å; F315-G319 PolarHBondContact O-N 3.25Å; F317-G319 PolarHBondContact O-N 3.4Å; G319-T323 PolarHBondContact O-OG1 3.44Å; G319-T323 VanDerWaalsContact O-OG1 3.12Å
320	H	87.1	Confident	89.1	Confident	1 Å²	1	9.8 Å²	9.8	1%	0.005	5%	0.053	C	C	.	.	H	α-helix	trans	-115.2	-49	178.3	70.2	-66.9	0	0	0	113.5	A189 L190 I193 V216 M316 F317 T322 T323 A324	A189-H320 HydrophobicContact CB-CB 4.12Å; L190-H320 HydrophobicContact CB-CB 4.2Å; L190-H320 HydrophobicContact CD1-CB 4.33Å; I193-H320 HydrophobicContact CG2-CB 3.8Å; V216-H320 WeakPolarHBondContact CG1-NE2 3.45Å; M316-H320 PolarHBondContact O-CE1 3.41Å; M316-H320 VanDerWaalsContact O-CE1 3.27Å; M316-H320 PolarHBondContact O-ND1 3.32Å; F317-H320 PolarHBondContact O-ND1 3.17Å; H320-T322 VanDerWaalsContact C-N 3.29Å; H320-T322 PolarHBondContact O-N 3.37Å; H320-T323 PolarHBondContact O-N 3.1Å; H320-T323 PolarHBondContact O-OG1 2.87Å; H320-T323 VanDerWaalsContact O-OG1 3.1Å; H320-A324 WeakPolarHBondContact O-CB 3.36Å; H320-A324 PolarHBondContact O-N 3.48Å
321	D	81.6	Confident	89.2	Confident	5 Å²	5	9.1 Å²	9.1	3%	0.027	5%	0.05	C	C	.	.	H	α-helix	trans	-61	-41.1	-175.4	-88.9	-7.9	0	0	0	111	A325 S495	D321-A325 WeakPolarHBondContact O-CB 3.09Å; D321-A325 PolarHBondContact O-N 3.01Å; D321-S495 PolarHBondContact OD2-OG 2.87Å
322	T	87.2	Confident	89.1	Confident	38 Å²	38	9.4 Å²	9.4	23%	0.233	5%	0.051	C	C	.	.	H	α-helix	trans	-69.9	-42.6	-178.1	60.9	0	0	0	0	113.3	E318 H320 S326 S383 V384 L494	E318-T322 PolarHBondContact O-OG1 2.85Å; H320-T322 VanDerWaalsContact C-N 3.29Å; H320-T322 PolarHBondContact O-N 3.37Å; T322-S326 PolarHBondContact O-N 2.8Å; T322-S326 VanDerWaalsContact O-N 3.16Å; T322-S383 VanDerWaalsContact O-CB 3.31Å; T322-S383 WeakPolarHBondContact O-CB 3.38Å; T322-S383 PolarHBondContact O-OG 2.64Å; T322-V384 HydrophobicContact CG2-CG2 4.16Å; T322-L494 HydrophobicContact CG2-CD2 3.55Å
323	T	92.1	Very high	89.1	Confident	2 Å²	2	9.5 Å²	9.5	1%	0.012	5%	0.052	C	C	.	.	H	α-helix	trans	-73	-41.8	-179.9	50.2	0	0	0	0	110.6	G319 H320 A325 S326 M327 A462 E465	G319-T323 PolarHBondContact O-OG1 3.44Å; G319-T323 VanDerWaalsContact O-OG1 3.12Å; H320-T323 PolarHBondContact O-N 3.1Å; H320-T323 PolarHBondContact O-OG1 2.87Å; H320-T323 VanDerWaalsContact O-OG1 3.1Å; T323-A325 VanDerWaalsContact C-N 3.35Å; T323-A325 PolarHBondContact O-N 2.78Å; T323-S326 WeakPolarHBondContact O-CB 3.19Å; T323-S326 PolarHBondContact O-N 2.82Å; T323-M327 WeakPolarHBondContact O-CG 3.45Å; T323-M327 PolarHBondContact O-N 3.28Å; T323-A462 HydrophobicContact CG2-CB 3.59Å; T323-E465 PolarHBondContact OG1-OE1 3.12Å; T323-E465 PolarHBondContact OG1-OE2 3.23Å
324	A	89.9	Confident	89.3	Confident	1 Å²	1	9.4 Å²	9.4	1%	0.008	5%	0.051	C	C	.	.	H	α-helix	trans	-56.9	-46.2	172.9	0	0	0	0	0	112.2	T186 A189 H320 S326 M327 N328	T186-A324 HydrophobicContact CG2-CB 3.84Å; A189-A324 HydrophobicContact CB-CB 4.05Å; H320-A324 WeakPolarHBondContact O-CB 3.36Å; H320-A324 PolarHBondContact O-N 3.48Å; A324-S326 PolarHBondContact O-N 2.81Å; A324-M327 PolarHBondContact O-N 2.82Å; A324-N328 WeakPolarHBondContact O-CB 3.45Å; A324-N328 PolarHBondContact O-N 3.3Å; A324-N328 PolarHBondContact O-ND2 2.74Å
325	A	86.4	Confident	89.3	Confident	11 Å²	11	9.7 Å²	9.7	9%	0.091	5%	0.054	C	C	.	.	H	α-helix	trans	-60.1	-45.5	176	0	0	0	0	0	111.8	D321 T323 N328 W329	D321-A325 WeakPolarHBondContact O-CB 3.09Å; D321-A325 PolarHBondContact O-N 3.01Å; T323-A325 VanDerWaalsContact C-N 3.35Å; T323-A325 PolarHBondContact O-N 2.78Å; A325-N328 PolarHBondContact O-N 3.16Å; A325-W329 PolarHBondContact O-N 3.04Å
326	S	92.3	Very high	89.3	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58.7	-49.9	177.7	-173.8	0	0	0	0	111.6	T322 T323 A324 N328 W329 A330 S383 E466	T322-S326 PolarHBondContact O-N 2.8Å; T322-S326 VanDerWaalsContact O-N 3.16Å; T323-S326 WeakPolarHBondContact O-CB 3.19Å; T323-S326 PolarHBondContact O-N 2.82Å; A324-S326 PolarHBondContact O-N 2.81Å; S326-N328 PolarHBondContact O-N 2.94Å; S326-W329 PolarHBondContact O-N 2.81Å; S326-A330 WeakPolarHBondContact O-CB 3.4Å; S326-A330 PolarHBondContact O-N 3.02Å; S326-S383 PolarHBondContact N-OG 2.99Å; S326-E466 VanDerWaalsContact CB-CD 3.49Å; S326-E466 WeakPolarHBondContact CB-OE1 3.43Å; S326-E466 PolarHBondContact OG-OE1 2.87Å; S326-E466 PolarHBondContact OG-OE2 3.47Å
327	M	95	Very high	89.7	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-61.5	-44	179.8	-68.5	-172.8	-76.8	0	0	111.9	V185 A189 T323 A324 A330 L331 E466 V469 L470	V185-M327 HydrophobicContact CG1-CB 3.71Å; V185-M327 HydrophobicContact CG1-CE 3.83Å; V185-M327 HydrophobicContact CG1-SD 4.26Å; A189-M327 HydrophobicContact CB-CE 3.95Å; T323-M327 WeakPolarHBondContact O-CG 3.45Å; T323-M327 PolarHBondContact O-N 3.28Å; A324-M327 PolarHBondContact O-N 2.82Å; M327-A330 PolarHBondContact O-N 3.39Å; M327-L331 VanDerWaalsContact O-CG 3.3Å; M327-L331 WeakPolarHBondContact O-CG 3.46Å; M327-L331 PolarHBondContact O-N 3.07Å; M327-E466 HydrophobicContact CG-CB 4.17Å; M327-E466 HydrophobicContact CG-CG 3.75Å; M327-E466 HydrophobicContact SD-CG 4.5Å; M327-V469 HydrophobicContact SD-CB 3.45Å; M327-V469 WeakPolarHBondContact SD-CB 3.29Å; M327-V469 HydrophobicContact SD-CG1 3.51Å; M327-V469 VanDerWaalsContact SD-CG1 3.51Å; M327-V469 HydrophobicContact SD-CG2 3.87Å; M327-L470 HydrophobicContact CB-CD2 4.32Å; M327-L470 HydrophobicContact CG-CG 4.39Å
328	N	90.9	Very high	90.3	Very high	3 Å²	3	15.7 Å²	15.7	2%	0.016	9%	0.093	C	C	.	.	H	α-helix	trans	-65.3	-41.6	179.7	-78.6	-50	0	0	0	112.6	F182 A324 A325 S326 L331 H332 L497	F182-N328 WeakPolarHBondContact CA-OD1 3.26Å; F182-N328 HydrophobicContact CD2-CB 3.53Å; F182-N328 WeakPolarHBondContact CD2-ND2 3.43Å; F182-N328 HydrophobicContact CE2-CB 3.77Å; F182-N328 WeakPolarHBondContact CE2-ND2 3.43Å; F182-N328 PolarHBondContact O-ND2 3.19Å; A324-N328 WeakPolarHBondContact O-CB 3.45Å; A324-N328 PolarHBondContact O-N 3.3Å; A324-N328 PolarHBondContact O-ND2 2.74Å; A325-N328 PolarHBondContact O-N 3.16Å; S326-N328 PolarHBondContact O-N 2.94Å; N328-L331 PolarHBondContact O-N 2.79Å; N328-H332 WeakPolarHBondContact O-CB 3.17Å; N328-H332 PolarHBondContact O-N 2.77Å; N328-L497 HydrophobicContact CB-CD1 4.43Å
329	W	89.3	Confident	90.8	Very high	21 Å²	21	17.1 Å²	17.1	8%	0.08	10%	0.099	C	C	.	.	H	α-helix	trans	-65.5	-39.6	173.8	-77.7	120.4	0	0	0	112.4	A325 S326 H332 L333 F381 L488 P490 L497	A325-W329 PolarHBondContact O-N 3.04Å; S326-W329 PolarHBondContact O-N 2.81Å; W329-H332 PolarHBondContact O-N 3.24Å; W329-L333 WeakPolarHBondContact O-CB 3.11Å; W329-L333 VanDerWaalsContact O-CG 3.31Å; W329-L333 WeakPolarHBondContact O-CG 3.39Å; W329-L333 PolarHBondContact O-N 3.35Å; W329-F381 HydrophobicContact CB-CB 4.01Å; W329-F381 HydrophobicContact CB-CD2 4.41Å; W329-F381 HydrophobicContact CD2-CB 3.5Å; W329-F381 AromaticContact CD2-CD1 3.95Å; W329-F381 HydrophobicContact CD2-CD1 3.95Å; W329-F381 AromaticContact CD2-CD2 3.83Å; W329-F381 HydrophobicContact CD2-CD2 3.83Å; W329-F381 AromaticContact CD2-CG 3.48Å; W329-F381 HydrophobicContact CD2-CG 3.48Å; W329-F381 VanDerWaalsContact CD2-CG 3.48Å; W329-F381 AromaticContact CE2-CD1 3.81Å; W329-F381 AromaticContact CE2-CG 3.74Å; W329-F381 HydrophobicContact CE3-CB 4.11Å; W329-F381 AromaticContact CE3-CD1 3.88Å; W329-F381 HydrophobicContact CE3-CD1 3.88Å; W329-F381 AromaticContact CE3-CD2 3.52Å; W329-F381 HydrophobicContact CE3-CD2 3.52Å; W329-F381 HydrophobicContact CE3-CE1 4.15Å; W329-F381 AromaticContact CE3-CE2 3.82Å; W329-F381 HydrophobicContact CE3-CE2 3.82Å; W329-F381 AromaticContact CE3-CG 3.56Å; W329-F381 HydrophobicContact CE3-CG 3.56Å; W329-F381 HydrophobicContact CE3-CZ 4.12Å; W329-F381 HydrophobicContact CG-CB 3.44Å; W329-F381 VanDerWaalsContact CG-CB 3.44Å; W329-F381 HydrophobicContact CG-CD2 4.25Å; W329-F381 AromaticContact CG-CG 3.94Å; W329-F381 HydrophobicContact CG-CG 3.94Å; W329-F381 AromaticContact CH2-CD1 3.53Å; W329-F381 HydrophobicContact CH2-CD1 3.53Å; W329-F381 AromaticContact CH2-CE1 3.56Å; W329-F381 HydrophobicContact CH2-CE1 3.56Å; W329-F381 HydrophobicContact CH2-CG 4.09Å; W329-F381 HydrophobicContact CH2-CZ 4.14Å; W329-F381 HydrophobicContact CZ2-CB 4.3Å; W329-F381 AromaticContact CZ2-CD1 3.59Å; W329-F381 HydrophobicContact CZ2-CD1 3.59Å; W329-F381 HydrophobicContact CZ2-CE1 4.11Å; W329-F381 HydrophobicContact CZ2-CG 4.03Å; W329-F381 AromaticContact CZ3-CD1 3.69Å; W329-F381 HydrophobicContact CZ3-CD1 3.69Å; W329-F381 AromaticContact CZ3-CD2 3.96Å; W329-F381 HydrophobicContact CZ3-CD2 3.96Å; W329-F381 AromaticContact CZ3-CE1 3.6Å; W329-F381 HydrophobicContact CZ3-CE1 3.6Å; W329-F381 AromaticContact CZ3-CE2 3.87Å; W329-F381 HydrophobicContact CZ3-CE2 3.87Å; W329-F381 AromaticContact CZ3-CG 3.87Å; W329-F381 HydrophobicContact CZ3-CG 3.87Å; W329-F381 AromaticContact CZ3-CZ 3.69Å; W329-F381 HydrophobicContact CZ3-CZ 3.69Å; W329-L488 HydrophobicContact CH2-CD1 4.18Å; W329-L488 HydrophobicContact CZ3-CD1 3.65Å; W329-P490 HydrophobicContact CH2-CG 4.41Å; W329-P490 HydrophobicContact CZ2-CB 4.37Å; W329-L497 HydrophobicContact CD2-CD1 4.38Å; W329-L497 HydrophobicContact CH2-CD2 3.39Å; W329-L497 HydrophobicContact CZ2-CD1 4.41Å; W329-L497 HydrophobicContact CZ2-CD2 3.18Å; W329-L497 HydrophobicContact CZ2-CG 4.1Å; W329-L497 HydrophobicContact CZ3-CD2 4.13Å
330	A	94.8	Very high	91.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62	-45.4	174.6	0	0	0	0	0	111.7	S326 M327 L333 L334 A377 L470	S326-A330 WeakPolarHBondContact O-CB 3.4Å; S326-A330 PolarHBondContact O-N 3.02Å; M327-A330 PolarHBondContact O-N 3.39Å; A330-L333 PolarHBondContact O-N 2.59Å; A330-L334 WeakPolarHBondContact O-CB 3.48Å; A330-L334 WeakPolarHBondContact O-CD1 3.47Å; A330-L334 WeakPolarHBondContact O-CG 3.44Å; A330-L334 PolarHBondContact O-N 2.96Å; A330-A377 HydrophobicContact CB-CB 3.97Å; A330-L470 HydrophobicContact CB-CD1 3.81Å; A330-L470 HydrophobicContact CB-CD2 4.23Å
331	L	93.5	Very high	91.9	Very high	3 Å²	3	17 Å²	17	2%	0.016	10%	0.096	C	C	.	.	H	α-helix	trans	-61.5	-43.9	175.9	-71.8	170.8	0	0	0	111.9	V185 M327 N328 L334 G335 L470 I473 V479 L502	V185-L331 HydrophobicContact CG2-CD1 3.88Å; M327-L331 VanDerWaalsContact O-CG 3.3Å; M327-L331 WeakPolarHBondContact O-CG 3.46Å; M327-L331 PolarHBondContact O-N 3.07Å; N328-L331 PolarHBondContact O-N 2.79Å; L331-L334 PolarHBondContact O-N 2.72Å; L331-G335 PolarHBondContact O-N 3.09Å; L331-L470 HydrophobicContact CD1-CD2 4.37Å; L331-L470 HydrophobicContact CD2-CD2 3.68Å; L331-L470 HydrophobicContact CG-CD2 3.61Å; L331-I473 HydrophobicContact CD1-CD1 3.91Å; L331-I473 HydrophobicContact CD2-CD1 4.18Å; L331-I473 HydrophobicContact CD2-CG2 3.97Å; L331-V479 HydrophobicContact CD2-CG2 4.18Å; L331-L502 HydrophobicContact CB-CD1 4.22Å
332	H	88.8	Confident	92.6	Very high	5 Å²	5	24.4 Å²	24.4	2%	0.023	12%	0.123	C	C	.	.	H	α-helix	trans	-62.6	-45.4	176.8	-178.8	86.8	0	0	0	112	N328 W329 G335 T336 Q483 L488 L502	N328-H332 WeakPolarHBondContact O-CB 3.17Å; N328-H332 PolarHBondContact O-N 2.77Å; W329-H332 PolarHBondContact O-N 3.24Å; H332-G335 PolarHBondContact O-N 3.12Å; H332-T336 PolarHBondContact O-N 2.88Å; H332-T336 PolarHBondContact O-OG1 3.33Å; H332-Q483 PolarHBondContact CE1-O 3.04Å; H332-L488 VanDerWaalsContact NE2-CD1 3.34Å; H332-L488 WeakPolarHBondContact NE2-CD1 3.33Å; H332-L502 HydrophobicContact CB-CD2 4.36Å
333	L	90.9	Very high	93.2	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-64.5	-41.1	177.9	-76.5	167.6	0	0	0	111.9	W329 A330 G335 T336 H337 A377 L380 F381 F428	W329-L333 WeakPolarHBondContact O-CB 3.11Å; W329-L333 VanDerWaalsContact O-CG 3.31Å; W329-L333 WeakPolarHBondContact O-CG 3.39Å; W329-L333 PolarHBondContact O-N 3.35Å; A330-L333 PolarHBondContact O-N 2.59Å; L333-G335 VanDerWaalsContact C-N 3.32Å; L333-G335 PolarHBondContact O-N 3.29Å; L333-T336 WeakPolarHBondContact CA-OG1 3.49Å; L333-T336 PolarHBondContact O-N 2.8Å; L333-T336 PolarHBondContact O-OG1 2.99Å; L333-H337 WeakPolarHBondContact O-CB 3.34Å; L333-H337 PolarHBondContact O-N 3.49Å; L333-H337 VanDerWaalsContact O-N 3.09Å; L333-H337 PolarHBondContact O-ND1 3.36Å; L333-A377 HydrophobicContact CD1-CB 3.79Å; L333-L380 HydrophobicContact CD1-CD1 4.3Å; L333-L380 HydrophobicContact CD2-CD1 4.15Å; L333-F381 HydrophobicContact CD1-CD2 3.96Å; L333-F381 HydrophobicContact CD1-CE2 4.14Å; L333-F381 HydrophobicContact CD2-CE2 4.09Å; L333-F381 HydrophobicContact CG-CD2 4.5Å; L333-F381 HydrophobicContact CG-CE2 4.29Å; L333-F428 HydrophobicContact CB-CD1 4.28Å; L333-F428 HydrophobicContact CB-CD2 4.16Å; L333-F428 HydrophobicContact CB-CE1 3.99Å; L333-F428 HydrophobicContact CB-CE2 3.91Å; L333-F428 HydrophobicContact CB-CG 4.36Å; L333-F428 HydrophobicContact CB-CZ 3.81Å; L333-F428 HydrophobicContact CD1-CD2 3.72Å; L333-F428 HydrophobicContact CD1-CE2 3.69Å; L333-F428 HydrophobicContact CD1-CZ 4.42Å; L333-F428 HydrophobicContact CD2-CB 4.12Å; L333-F428 HydrophobicContact CD2-CD1 4.45Å; L333-F428 HydrophobicContact CD2-CD2 3.92Å; L333-F428 HydrophobicContact CD2-CE2 4.5Å; L333-F428 HydrophobicContact CD2-CG 3.91Å; L333-F428 HydrophobicContact CG-CD2 4.15Å; L333-F428 HydrophobicContact CG-CE2 4.25Å
334	L	94.4	Very high	93.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.7	-37.1	173.4	-72.1	165.7	0	0	0	112.3	A330 L331 T336 H337 V340 Q341 V344 V373 L474	A330-L334 WeakPolarHBondContact O-CB 3.48Å; A330-L334 WeakPolarHBondContact O-CD1 3.47Å; A330-L334 WeakPolarHBondContact O-CG 3.44Å; A330-L334 PolarHBondContact O-N 2.96Å; L331-L334 PolarHBondContact O-N 2.72Å; L334-T336 VanDerWaalsContact C-N 3.29Å; L334-T336 PolarHBondContact O-N 3.33Å; L334-H337 CarbonylContact O-C 3.32Å; L334-H337 PolarHBondContact O-N 3.11Å; L334-V340 HydrophobicContact CD2-CG1 3.87Å; L334-Q341 HydrophobicContact CB-CB 4.42Å; L334-Q341 HydrophobicContact CB-CG 4.39Å; L334-Q341 HydrophobicContact CD2-CB 4.19Å; L334-Q341 PolarHBondContact O-NE2 3.29Å; L334-V344 HydrophobicContact CD2-CG2 4.01Å; L334-V373 HydrophobicContact CD1-CG1 4.08Å; L334-V373 HydrophobicContact CD2-CG1 3.96Å; L334-V373 HydrophobicContact CD2-CG2 4.42Å; L334-V373 HydrophobicContact CG-CG1 4.03Å; L334-L474 HydrophobicContact CD1-CD1 3.72Å; L334-L474 HydrophobicContact CD1-CD2 4.32Å
335	G	90.8	Very high	93.8	Very high	6 Å²	6	28.6 Å²	28.6	6%	0.062	14%	0.138	C	C	.	.	H	α-helix	trans	-71.3	-21.1	177.5	0	0	0	0	0	114.4	L331 H332 L333 V479 A481	L331-G335 PolarHBondContact O-N 3.09Å; H332-G335 PolarHBondContact O-N 3.12Å; L333-G335 VanDerWaalsContact C-N 3.32Å; L333-G335 PolarHBondContact O-N 3.29Å; G335-V479 WeakPolarHBondContact CA-O 3.17Å; G335-A481 PolarHBondContact O-N 2.69Å; G335-A481 VanDerWaalsContact O-N 3.07Å
336	T	90.1	Very high	94.4	Very high	46 Å²	46	33.5 Å²	33.5	28%	0.282	16%	0.159	S	C	.	.	H	α-helix	trans	-94.2	-11.9	172.9	46.8	0	0	0	0	113.4	H332 L333 L334 A481	H332-T336 PolarHBondContact O-N 2.88Å; H332-T336 PolarHBondContact O-OG1 3.33Å; L333-T336 WeakPolarHBondContact CA-OG1 3.49Å; L333-T336 PolarHBondContact O-N 2.8Å; L333-T336 PolarHBondContact O-OG1 2.99Å; L334-T336 VanDerWaalsContact C-N 3.29Å; L334-T336 PolarHBondContact O-N 3.33Å; T336-A481 HydrophobicContact CG2-CB 3.48Å; T336-A481 VanDerWaalsContact CG2-CB 3.48Å
337	H	94.4	Very high	94.7	Very high	43 Å²	43	34.6 Å²	34.6	20%	0.199	16%	0.164	C	C	.	.			trans	-128.8	74.9	-176.1	-63.3	81.7	0	0	0	111.4	L333 L334 E339 V340 Q341 F428	L333-H337 WeakPolarHBondContact O-CB 3.34Å; L333-H337 PolarHBondContact O-N 3.49Å; L333-H337 VanDerWaalsContact O-N 3.09Å; L333-H337 PolarHBondContact O-ND1 3.36Å; L334-H337 CarbonylContact O-C 3.32Å; L334-H337 PolarHBondContact O-N 3.11Å; H337-E339 WeakPolarHBondContact CB-OE1 3.18Å; H337-E339 IonicContact CD2-OE1 2.95Å; H337-E339 IonicContact CG-OE1 3.06Å; H337-E339 PolarHBondContact O-N 3.3Å; H337-E339 VanDerWaalsContact O-N 3.14Å; H337-V340 HydrophobicContact CB-CB 4.06Å; H337-V340 HydrophobicContact CB-CG2 4.04Å; H337-V340 PolarHBondContact O-N 2.87Å; H337-Q341 PolarHBondContact O-N 3.4Å; H337-F428 HydrophobicContact CB-CD1 4.06Å; H337-F428 HydrophobicContact CB-CE1 4.29Å; H337-F428 AromaticContact CD2-CD1 3.91Å; H337-F428 AromaticContact CE1-CD1 3.92Å; H337-F428 AromaticContact CG-CD1 3.59Å; H337-F428 AromaticContact ND1-CD1 3.59Å
338	P	94.4	Very high	94.8	Very high	75 Å²	75	34.8 Å²	34.8	49%	0.487	17%	0.165	S	C	.	.	H	α-helix	trans	-58.4	-29.2	-175.1	-24.7	34.7	0	0	0	114.2	R342	P338-R342 WeakPolarHBondContact O-CB 3.39Å; P338-R342 WeakPolarHBondContact O-CG 3.08Å; P338-R342 PolarHBondContact O-N 3.02Å
339	E	97.1	Very high	95	Very high	82 Å²	82	38.6 Å²	38.6	38%	0.383	18%	0.183	S	C	.	.	H	α-helix	trans	-67.4	-38.1	174.4	71.8	-64.3	153.3	0	0	113.3	H337 K343	H337-E339 WeakPolarHBondContact CB-OE1 3.18Å; H337-E339 IonicContact CD2-OE1 2.95Å; H337-E339 IonicContact CG-OE1 3.06Å; H337-E339 PolarHBondContact O-N 3.3Å; H337-E339 VanDerWaalsContact O-N 3.14Å; E339-K343 WeakPolarHBondContact O-CG 3.46Å; E339-K343 PolarHBondContact O-N 3.34Å
340	V	98.1	Very high	95.4	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.024	21%	0.21	C	C	.	.	H	α-helix	trans	-70.3	-42.6	173.7	176.2	0	0	0	0	109.9	L334 H337 R342 K343 V344 Y369 V373 F428 P430	L334-V340 HydrophobicContact CD2-CG1 3.87Å; H337-V340 HydrophobicContact CB-CB 4.06Å; H337-V340 HydrophobicContact CB-CG2 4.04Å; H337-V340 PolarHBondContact O-N 2.87Å; V340-R342 VanDerWaalsContact C-N 3.35Å; V340-R342 PolarHBondContact O-N 3.04Å; V340-K343 WeakPolarHBondContact O-CB 3.46Å; V340-K343 PolarHBondContact O-N 3.39Å; V340-K343 VanDerWaalsContact O-N 3.16Å; V340-V344 PolarHBondContact O-N 3.1Å; V340-Y369 HydrophobicContact CG1-CE1 4.1Å; V340-V373 HydrophobicContact CG1-CG2 3.68Å; V340-F428 HydrophobicContact CB-CE1 4.14Å; V340-F428 HydrophobicContact CG1-CE1 3.79Å; V340-F428 HydrophobicContact CG1-CZ 4.31Å; V340-F428 HydrophobicContact CG2-CD1 4.33Å; V340-F428 HydrophobicContact CG2-CE1 4.1Å; V340-P430 HydrophobicContact CG1-CG 3.72Å; V340-P430 HydrophobicContact CG2-CG 4.39Å
341	Q	97.7	Very high	95.5	Very high	9 Å²	9	45.4 Å²	45.4	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-45.1	176.8	-165.9	179.4	161.4	0	0	112.1	L334 H337 K343 V344 Q345 L474 V479	L334-Q341 HydrophobicContact CB-CB 4.42Å; L334-Q341 HydrophobicContact CB-CG 4.39Å; L334-Q341 HydrophobicContact CD2-CB 4.19Å; L334-Q341 PolarHBondContact O-NE2 3.29Å; H337-Q341 PolarHBondContact O-N 3.4Å; Q341-K343 VanDerWaalsContact C-N 3.32Å; Q341-K343 PolarHBondContact O-N 3.33Å; Q341-V344 WeakPolarHBondContact O-CB 3.32Å; Q341-V344 PolarHBondContact O-N 2.82Å; Q341-V344 VanDerWaalsContact O-N 3.15Å; Q341-Q345 WeakPolarHBondContact O-CG 3.41Å; Q341-Q345 PolarHBondContact O-N 3.35Å; Q341-L474 HydrophobicContact CG-CD2 3.99Å; Q341-V479 PolarHBondContact NE2-O 3.49Å
342	R	97.8	Very high	95.5	Very high	160 Å²	160	45.8 Å²	45.8	60%	0.604	22%	0.219	S	C	*	.	H	α-helix	trans	-60.4	-38	175.5	-77.7	-176.2	-63.6	123.5	-4	113.1	P338 V340 Q345 Q346	P338-R342 WeakPolarHBondContact O-CB 3.39Å; P338-R342 WeakPolarHBondContact O-CG 3.08Å; P338-R342 PolarHBondContact O-N 3.02Å; V340-R342 VanDerWaalsContact C-N 3.35Å; V340-R342 PolarHBondContact O-N 3.04Å; R342-Q345 PolarHBondContact O-N 3.4Å; R342-Q346 WeakPolarHBondContact O-CB 3.22Å; R342-Q346 PolarHBondContact O-N 3.05Å
343	K	98.3	Very high	95.6	Very high	90 Å²	90	47.4 Å²	47.4	39%	0.391	24%	0.237	S	C	.	.	H	α-helix	trans	-65.2	-40.2	175.1	-73.5	171.8	176.2	172.4	0	111.9	E339 V340 Q341 Q346 E347 Y369 E431	E339-K343 WeakPolarHBondContact O-CG 3.46Å; E339-K343 PolarHBondContact O-N 3.34Å; V340-K343 WeakPolarHBondContact O-CB 3.46Å; V340-K343 PolarHBondContact O-N 3.39Å; V340-K343 VanDerWaalsContact O-N 3.16Å; Q341-K343 VanDerWaalsContact C-N 3.32Å; Q341-K343 PolarHBondContact O-N 3.33Å; K343-Q346 PolarHBondContact O-N 3.28Å; K343-E347 PolarHBondContact O-N 3.26Å; K343-Y369 HydrophobicContact CB-CD1 3.91Å; K343-Y369 HydrophobicContact CB-CE1 3.36Å; K343-Y369 HydrophobicContact CD-CE1 4.08Å; K343-Y369 HydrophobicContact CD-CE2 4.24Å; K343-Y369 WeakPolarHBondContact CD-OH 3.46Å; K343-Y369 HydrophobicContact CG-CE1 4.39Å; K343-E431 IonicContact NZ-OE1 2.65Å; K343-E431 PolarHBondContact NZ-OE1 3.03Å
344	V	98.3	Very high	95.3	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-46.4	173.5	177.5	0	0	0	0	110.5	L334 V340 Q341 Q346 E347 L348 Y369 L370 V373 L474	L334-V344 HydrophobicContact CD2-CG2 4.01Å; V340-V344 PolarHBondContact O-N 3.1Å; Q341-V344 WeakPolarHBondContact O-CB 3.32Å; Q341-V344 PolarHBondContact O-N 2.82Å; Q341-V344 VanDerWaalsContact O-N 3.15Å; V344-Q346 VanDerWaalsContact C-N 3.29Å; V344-Q346 PolarHBondContact O-N 3.4Å; V344-E347 WeakPolarHBondContact O-CB 3.27Å; V344-E347 PolarHBondContact O-N 3.08Å; V344-L348 HydrophobicContact CG1-CD1 3.86Å; V344-L348 HydrophobicContact CG1-CG 4.26Å; V344-L348 VanDerWaalsContact O-CG 3.25Å; V344-L348 WeakPolarHBondContact O-CG 3.33Å; V344-L348 PolarHBondContact O-N 3.23Å; V344-Y369 HydrophobicContact CG2-CD1 3.69Å; V344-Y369 HydrophobicContact CG2-CE1 3.84Å; V344-L370 HydrophobicContact CG1-CB 4.33Å; V344-L370 HydrophobicContact CG1-CD1 3.96Å; V344-V373 HydrophobicContact CG2-CG2 3.71Å; V344-L474 HydrophobicContact CB-CD1 4.39Å; V344-L474 HydrophobicContact CG1-CD1 3.55Å
345	Q	97.3	Very high	94.9	Very high	39 Å²	39	56.5 Å²	56.5	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-36.6	177.7	-72.8	175.3	-33	0	0	112.4	Q341 R342 L348 H349 N478	Q341-Q345 WeakPolarHBondContact O-CG 3.41Å; Q341-Q345 PolarHBondContact O-N 3.35Å; R342-Q345 PolarHBondContact O-N 3.4Å; Q345-L348 PolarHBondContact O-N 2.97Å; Q345-H349 WeakPolarHBondContact O-CB 3.42Å; Q345-H349 PolarHBondContact O-N 3.26Å; Q345-N478 PolarHBondContact NE2-OD1 2.77Å
346	Q	97.9	Very high	94.6	Very high	113 Å²	113	59.9 Å²	59.9	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-48.4	172	-175.4	-175.5	-20.5	0	0	111.3	R342 K343 V344 L348 H349 E350	R342-Q346 WeakPolarHBondContact O-CB 3.22Å; R342-Q346 PolarHBondContact O-N 3.05Å; K343-Q346 PolarHBondContact O-N 3.28Å; V344-Q346 VanDerWaalsContact C-N 3.29Å; V344-Q346 PolarHBondContact O-N 3.4Å; Q346-L348 VanDerWaalsContact C-N 3.3Å; Q346-L348 PolarHBondContact O-N 3.08Å; Q346-H349 PolarHBondContact O-N 3.26Å; Q346-H349 VanDerWaalsContact O-N 3.15Å; Q346-E350 WeakPolarHBondContact CG-OE1 3.18Å; Q346-E350 PolarHBondContact NE2-OE1 2.91Å; Q346-E350 WeakPolarHBondContact O-CG 3.41Å; Q346-E350 PolarHBondContact O-N 2.85Å
347	E	98.3	Very high	94.8	Very high	23 Å²	23	61.6 Å²	61.6	11%	0.107	33%	0.331	C	S	.	.	H	α-helix	trans	-57.1	-44	174.5	175.1	177.6	-112.1	0	0	111.5	K343 V344 H349 E350 V351 L367 R368 Y369 L370	K343-E347 PolarHBondContact O-N 3.26Å; V344-E347 WeakPolarHBondContact O-CB 3.27Å; V344-E347 PolarHBondContact O-N 3.08Å; E347-H349 VanDerWaalsContact C-N 3.34Å; E347-H349 PolarHBondContact O-N 2.87Å; E347-E350 PolarHBondContact O-N 3.06Å; E347-V351 WeakPolarHBondContact O-CG2 3.21Å; E347-V351 PolarHBondContact O-N 3.37Å; E347-V351 VanDerWaalsContact O-N 3.07Å; E347-L367 HydrophobicContact CG-CD2 4.16Å; E347-R368 PolarHBondContact OE1-N 2.89Å; E347-Y369 WeakPolarHBondContact OE1-CB 2.98Å; E347-Y369 PolarHBondContact OE1-N 2.89Å; E347-Y369 PolarHBondContact OE2-N 3.46Å; E347-L370 WeakPolarHBondContact OE2-CB 3.17Å; E347-L370 PolarHBondContact OE2-N 2.63Å
348	L	97.5	Very high	94.7	Very high	4 Å²	4	63.8 Å²	63.8	2%	0.021	35%	0.349	C	S	.	.	H	α-helix	trans	-63	-41.2	177	-66.9	169.7	0	0	0	111.3	V344 Q345 Q346 V351 F352 L367 A471 L474 R475	V344-L348 HydrophobicContact CG1-CD1 3.86Å; V344-L348 HydrophobicContact CG1-CG 4.26Å; V344-L348 VanDerWaalsContact O-CG 3.25Å; V344-L348 WeakPolarHBondContact O-CG 3.33Å; V344-L348 PolarHBondContact O-N 3.23Å; Q345-L348 PolarHBondContact O-N 2.97Å; Q346-L348 VanDerWaalsContact C-N 3.3Å; Q346-L348 PolarHBondContact O-N 3.08Å; L348-V351 PolarHBondContact O-N 3.4Å; L348-F352 HydrophobicContact CB-CD2 4.43Å; L348-F352 HydrophobicContact CD2-CD2 4.17Å; L348-F352 HydrophobicContact CD2-CE2 3.82Å; L348-F352 WeakPolarHBondContact O-CB 3.38Å; L348-F352 VanDerWaalsContact O-CD2 3.23Å; L348-F352 WeakPolarHBondContact O-CD2 3.32Å; L348-F352 PolarHBondContact O-N 3.44Å; L348-L367 HydrophobicContact CD2-CD1 4.36Å; L348-L367 HydrophobicContact CD2-CD2 3.71Å; L348-A471 HydrophobicContact CD2-CB 3.55Å; L348-L474 HydrophobicContact CD1-CB 3.66Å; L348-R475 HydrophobicContact CB-CG 4.24Å; L348-R475 HydrophobicContact CD1-CG 4.23Å
349	H	96.3	Very high	94.8	Very high	84 Å²	84	60.4 Å²	60.4	39%	0.389	33%	0.327	S	S	.	.	H	α-helix	trans	-65.9	-39.2	176.2	-172.3	65.9	0	0	0	112.3	Q345 Q346 E347 V351 G353 Y511	Q345-H349 WeakPolarHBondContact O-CB 3.42Å; Q345-H349 PolarHBondContact O-N 3.26Å; Q346-H349 PolarHBondContact O-N 3.26Å; Q346-H349 VanDerWaalsContact O-N 3.15Å; E347-H349 VanDerWaalsContact C-N 3.34Å; E347-H349 PolarHBondContact O-N 2.87Å; H349-V351 VanDerWaalsContact C-N 3.29Å; H349-V351 PolarHBondContact O-N 3.3Å; H349-G353 PolarHBondContact ND1-O 2.77Å; H349-G353 WeakPolarHBondContact O-CA 3.44Å; H349-G353 PolarHBondContact O-N 3.14Å; H349-Y511 PolarHBondContact CD2-OH 3.44Å; H349-Y511 VanDerWaalsContact CG-OH 3.25Å
350	E	96.4	Very high	94.6	Very high	138 Å²	138	59.6 Å²	59.6	65%	0.645	33%	0.325	S	S	*	.	H	α-helix	trans	-64.2	-33.6	175.9	-72.2	171.7	-167.6	0	0	112.3	Q346 E347	Q346-E350 WeakPolarHBondContact CG-OE1 3.18Å; Q346-E350 PolarHBondContact NE2-OE1 2.91Å; Q346-E350 WeakPolarHBondContact O-CG 3.41Å; Q346-E350 PolarHBondContact O-N 2.85Å; E347-E350 PolarHBondContact O-N 3.06Å
351	V	96.7	Very high	94.3	Very high	25 Å²	25	60.3 Å²	60.3	15%	0.152	33%	0.329	C	S	.	.	H	α-helix	trans	-84.3	-41.2	-179.4	174.9	0	0	0	0	112.8	E347 L348 H349 D363 K366 L367	E347-V351 WeakPolarHBondContact O-CG2 3.21Å; E347-V351 PolarHBondContact O-N 3.37Å; E347-V351 VanDerWaalsContact O-N 3.07Å; L348-V351 PolarHBondContact O-N 3.4Å; H349-V351 VanDerWaalsContact C-N 3.29Å; H349-V351 PolarHBondContact O-N 3.3Å; V351-D363 HydrophobicContact CG1-CB 3.88Å; V351-K366 HydrophobicContact CG1-CD 4.37Å; V351-K366 HydrophobicContact CG2-CB 3.66Å; V351-K366 HydrophobicContact CG2-CD 4.23Å; V351-L367 HydrophobicContact CB-CD2 4.42Å; V351-L367 HydrophobicContact CG2-CD2 4.13Å
352	F	94.2	Very high	94.1	Very high	11 Å²	11	64.7 Å²	64.7	5%	0.048	35%	0.35	C	S	.	.	H	α-helix	trans	-108.9	-19.1	-170.7	-60.5	-75.1	0	0	0	114.3	L348 T354 S355 I359 D363 L367	L348-F352 HydrophobicContact CB-CD2 4.43Å; L348-F352 HydrophobicContact CD2-CD2 4.17Å; L348-F352 HydrophobicContact CD2-CE2 3.82Å; L348-F352 WeakPolarHBondContact O-CB 3.38Å; L348-F352 VanDerWaalsContact O-CD2 3.23Å; L348-F352 WeakPolarHBondContact O-CD2 3.32Å; L348-F352 PolarHBondContact O-N 3.44Å; F352-T354 PolarHBondContact O-N 3.44Å; F352-S355 WeakPolarHBondContact O-CB 3.48Å; F352-S355 PolarHBondContact O-N 3.29Å; F352-I359 HydrophobicContact CE1-CB 4.48Å; F352-I359 HydrophobicContact CE1-CG1 3.97Å; F352-I359 HydrophobicContact CZ-CB 4.39Å; F352-I359 HydrophobicContact CZ-CD1 4.33Å; F352-I359 HydrophobicContact CZ-CG1 3.76Å; F352-I359 HydrophobicContact CZ-CG2 4.15Å; F352-D363 HydrophobicContact CE1-CB 3.87Å; F352-D363 WeakPolarHBondContact CE1-OD2 3.33Å; F352-D363 HydrophobicContact CZ-CB 3.74Å; F352-L367 HydrophobicContact CE2-CD1 4.49Å; F352-L367 HydrophobicContact CE2-CD2 4.15Å
353	G	90.4	Very high	94	Very high	39 Å²	39	57.3 Å²	57.3	40%	0.402	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	-124.6	-173.1	0	0	0	0	0	111.5	H349	H349-G353 PolarHBondContact ND1-O 2.77Å; H349-G353 WeakPolarHBondContact O-CA 3.44Å; H349-G353 PolarHBondContact O-N 3.14Å
354	T	85.8	Confident	93.8	Very high	144 Å²	144	53.6 Å²	53.6	88%	0.883	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	3.8	173.1	55.7	0	0	0	0	113	F352 G356	F352-T354 PolarHBondContact O-N 3.44Å; T354-G356 PolarHBondContact O-N 3.49Å
355	S	85.7	Confident	93.6	Very high	52 Å²	52	58.7 Å²	58.7	36%	0.364	33%	0.329	S	S	.	.			trans	-70.1	130.7	-177.6	-170.8	0	0	0	0	110.4	F352 R357 R475	F352-S355 WeakPolarHBondContact O-CB 3.48Å; F352-S355 PolarHBondContact O-N 3.29Å; S355-R357 VanDerWaalsContact C-N 3.27Å; S355-R357 WeakPolarHBondContact OG-CB 3.2Å; S355-R357 VanDerWaalsContact OG-CG 3.28Å; S355-R357 WeakPolarHBondContact OG-CG 3.41Å; S355-R357 PolarHBondContact OG-N 2.92Å; S355-R475 PolarHBondContact O-NH2 3.46Å
356	G	84.3	Confident	93.6	Very high	76 Å²	76	62.4 Å²	62.4	78%	0.784	34%	0.344	S	S	*	.			trans	-85.4	10.1	169.5	0	0	0	0	0	114	T354	T354-G356 PolarHBondContact O-N 3.49Å
357	R	93.2	Very high	93.6	Very high	83 Å²	83	57 Å²	57	31%	0.313	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-63.7	155.8	-174.4	71.3	177.5	178.5	74.1	-0.7	112.9	S355 N360 D363 R475	S355-R357 VanDerWaalsContact C-N 3.27Å; S355-R357 WeakPolarHBondContact OG-CB 3.2Å; S355-R357 VanDerWaalsContact OG-CG 3.28Å; S355-R357 WeakPolarHBondContact OG-CG 3.41Å; S355-R357 PolarHBondContact OG-N 2.92Å; R357-N360 PolarHBondContact NH1-ND2 3.08Å; R357-N360 VanDerWaalsContact NH1-ND2 3.13Å; R357-D363 IonicContact CZ-OD1 3.25Å; R357-D363 IonicContact CZ-OD2 3.09Å; R357-D363 VanDerWaalsContact CZ-OD2 3.3Å; R357-D363 IonicContact NH1-OD1 3.32Å; R357-D363 IonicContact NH1-OD2 3.45Å; R357-D363 PolarHBondContact NH1-OD2 3.44Å; R357-D363 IonicContact NH2-OD1 3.16Å; R357-D363 PolarHBondContact NH2-OD1 3.42Å; R357-D363 IonicContact NH2-OD2 3.96Å; R357-D363 PolarHBondContact NH2-OD2 2.89Å; R357-D363 VanDerWaalsContact NH2-OD2 3.07Å; R357-R475 PolarHBondContact O-NH1 3.5Å; R357-R475 PolarHBondContact O-NH2 2.96Å
358	P	93.6	Very high	93.6	Very high	89 Å²	89	64.8 Å²	64.8	58%	0.578	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-57.9	151.5	168.6	-24.5	34.6	0	0	0	112.8	N160	N160-P358 HydrophobicContact CB-CB 4.26Å
359	I	95.7	Very high	93.6	Very high	4 Å²	4	65.7 Å²	65.7	2%	0.021	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-75.5	128	178.8	-58.6	174.9	0	0	0	108.9	N160 F352 D363 L364 V468 A471	N160-I359 PolarHBondContact ND2-O 3.45Å; N160-I359 PolarHBondContact OD1-N 3.34Å; F352-I359 HydrophobicContact CE1-CB 4.48Å; F352-I359 HydrophobicContact CE1-CG1 3.97Å; F352-I359 HydrophobicContact CZ-CB 4.39Å; F352-I359 HydrophobicContact CZ-CD1 4.33Å; F352-I359 HydrophobicContact CZ-CG1 3.76Å; F352-I359 HydrophobicContact CZ-CG2 4.15Å; I359-D363 HydrophobicContact CG2-CB 4.08Å; I359-L364 HydrophobicContact CG2-CD2 3.72Å; I359-L364 HydrophobicContact CG2-CG 3.93Å; I359-V468 HydrophobicContact CD1-CB 4.47Å; I359-V468 HydrophobicContact CD1-CG1 4.36Å; I359-V468 HydrophobicContact CG2-CG2 4.43Å; I359-A471 HydrophobicContact CD1-CB 3.69Å
360	N	93.8	Very high	93.7	Very high	64 Å²	64	61.7 Å²	61.7	34%	0.342	33%	0.332	S	S	.	.			trans	-106.5	173.2	175	73.1	50.5	0	0	0	111.6	R357 E362 D363 L364	R357-N360 PolarHBondContact NH1-ND2 3.08Å; R357-N360 VanDerWaalsContact NH1-ND2 3.13Å; N360-E362 VanDerWaalsContact C-N 3.31Å; N360-E362 PolarHBondContact O-N 3.48Å; N360-E362 WeakPolarHBondContact OD1-CA 3.37Å; N360-E362 WeakPolarHBondContact OD1-CB 3.31Å; N360-E362 PolarHBondContact OD1-N 3Å; N360-D363 PolarHBondContact N-OD2 3.31Å; N360-D363 PolarHBondContact ND2-OD2 3.2Å; N360-D363 VanDerWaalsContact ND2-OD2 3.15Å; N360-D363 WeakPolarHBondContact O-CB 3.43Å; N360-D363 PolarHBondContact O-N 3.42Å; N360-D363 PolarHBondContact OD1-N 3.19Å; N360-D363 PolarHBondContact OD1-OD2 3.19Å; N360-L364 PolarHBondContact O-N 3.1Å
361	T	91.1	Very high	93.8	Very high	20 Å²	20	57.7 Å²	57.7	12%	0.123	31%	0.314	C	S	.	.	H	α-helix	trans	-69.5	-25	-173.4	-27.9	0	0	0	0	114.5	F149	F149-T361 HydrophobicContact CD2-CG2 4.3Å; F149-T361 HydrophobicContact CE1-CG2 4.14Å; F149-T361 HydrophobicContact CE2-CG2 3.2Å; F149-T361 HydrophobicContact CZ-CG2 3.1Å
362	E	93.1	Very high	93.9	Very high	101 Å²	101	57 Å²	57	47%	0.472	31%	0.309	S	S	.	.	H	α-helix	trans	-74.5	-31.7	173.9	-63.5	-52.3	133.6	0	0	111.8	N360 K365	N360-E362 VanDerWaalsContact C-N 3.31Å; N360-E362 PolarHBondContact O-N 3.48Å; N360-E362 WeakPolarHBondContact OD1-CA 3.37Å; N360-E362 WeakPolarHBondContact OD1-CB 3.31Å; N360-E362 PolarHBondContact OD1-N 3Å; E362-K365 PolarHBondContact O-N 3.06Å; E362-K365 IonicContact OE1-NZ 3.63Å; E362-K365 PolarHBondContact OE1-NZ 3.04Å; E362-K365 WeakPolarHBondContact OE2-CD 3.36Å; E362-K365 IonicContact OE2-NZ 2.8Å; E362-K365 PolarHBondContact OE2-NZ 3.24Å
363	D	95.5	Very high	94.1	Very high	4 Å²	4	56.4 Å²	56.4	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-45.5	174.2	-54.5	-40.3	0	0	0	110.8	V351 F352 R357 I359 N360 K365 K366 L367	V351-D363 HydrophobicContact CG1-CB 3.88Å; F352-D363 HydrophobicContact CE1-CB 3.87Å; F352-D363 WeakPolarHBondContact CE1-OD2 3.33Å; F352-D363 HydrophobicContact CZ-CB 3.74Å; R357-D363 IonicContact CZ-OD1 3.25Å; R357-D363 IonicContact CZ-OD2 3.09Å; R357-D363 VanDerWaalsContact CZ-OD2 3.3Å; R357-D363 IonicContact NH1-OD1 3.32Å; R357-D363 IonicContact NH1-OD2 3.45Å; R357-D363 PolarHBondContact NH1-OD2 3.44Å; R357-D363 IonicContact NH2-OD1 3.16Å; R357-D363 PolarHBondContact NH2-OD1 3.42Å; R357-D363 IonicContact NH2-OD2 3.96Å; R357-D363 PolarHBondContact NH2-OD2 2.89Å; R357-D363 VanDerWaalsContact NH2-OD2 3.07Å; I359-D363 HydrophobicContact CG2-CB 4.08Å; N360-D363 PolarHBondContact N-OD2 3.31Å; N360-D363 PolarHBondContact ND2-OD2 3.2Å; N360-D363 VanDerWaalsContact ND2-OD2 3.15Å; N360-D363 WeakPolarHBondContact O-CB 3.43Å; N360-D363 PolarHBondContact O-N 3.42Å; N360-D363 PolarHBondContact OD1-N 3.19Å; N360-D363 PolarHBondContact OD1-OD2 3.19Å; D363-K365 PolarHBondContact O-N 2.8Å; D363-K365 VanDerWaalsContact O-N 3.12Å; D363-K366 WeakPolarHBondContact O-CA 3.44Å; D363-K366 WeakPolarHBondContact O-CB 3.47Å; D363-K366 PolarHBondContact O-N 2.83Å; D363-L367 WeakPolarHBondContact O-CG 3.31Å; D363-L367 PolarHBondContact O-N 3.05Å; D363-L367 VanDerWaalsContact O-N 3.15Å
364	L	95	Very high	94.5	Very high	13 Å²	13	54.6 Å²	54.6	7%	0.068	29%	0.288	C	S	.	.	H	α-helix	trans	-57.8	-29.4	-179.4	-67.3	176.5	0	0	0	113.8	L156 I359 N360 K366 L367 M464 K467 V468	L156-L364 HydrophobicContact CD1-CD1 3.95Å; L156-L364 HydrophobicContact CD2-CD1 4.27Å; I359-L364 HydrophobicContact CG2-CD2 3.72Å; I359-L364 HydrophobicContact CG2-CG 3.93Å; N360-L364 PolarHBondContact O-N 3.1Å; L364-K366 VanDerWaalsContact C-N 3.31Å; L364-L367 HydrophobicContact CD2-CD1 4.32Å; L364-M464 HydrophobicContact CD1-CE 4.19Å; L364-M464 HydrophobicContact CD1-CG 3.67Å; L364-M464 HydrophobicContact CD1-SD 4.34Å; L364-K467 HydrophobicContact CD2-CB 3.72Å; L364-K467 HydrophobicContact CD2-CD 4.17Å; L364-K467 PolarHBondContact O-NZ 3.4Å; L364-V468 HydrophobicContact CD2-CG2 4.03Å
365	K	94.7	Very high	95.1	Very high	106 Å²	106	50.2 Å²	50.2	46%	0.461	26%	0.257	S	S	.	.	H	α-helix	trans	-72.6	-24.8	174.9	-64.6	174.5	-169.1	167.3	0	112.7	E362 D363	E362-K365 PolarHBondContact O-N 3.06Å; E362-K365 IonicContact OE1-NZ 3.63Å; E362-K365 PolarHBondContact OE1-NZ 3.04Å; E362-K365 WeakPolarHBondContact OE2-CD 3.36Å; E362-K365 IonicContact OE2-NZ 2.8Å; E362-K365 PolarHBondContact OE2-NZ 3.24Å; D363-K365 PolarHBondContact O-N 2.8Å; D363-K365 VanDerWaalsContact O-N 3.12Å
366	K	97.3	Very high	95.7	Very high	117 Å²	117	47.7 Å²	47.7	51%	0.509	24%	0.239	S	C	.	.	H	α-helix	trans	-86.8	-24.8	178.7	-61.9	174.7	-176.1	176.1	0	112.5	V351 D363 L364 R368	V351-K366 HydrophobicContact CG1-CD 4.37Å; V351-K366 HydrophobicContact CG2-CB 3.66Å; V351-K366 HydrophobicContact CG2-CD 4.23Å; D363-K366 WeakPolarHBondContact O-CA 3.44Å; D363-K366 WeakPolarHBondContact O-CB 3.47Å; D363-K366 PolarHBondContact O-N 2.83Å; L364-K366 VanDerWaalsContact C-N 3.31Å; K366-R368 PolarHBondContact O-N 3.48Å
367	L	97.6	Very high	96.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.202	C	C	.	.			trans	-73.3	69.4	175.2	-57.3	-176.2	0	0	0	111.6	E347 L348 V351 F352 D363 L364 L370 K467 A471	E347-L367 HydrophobicContact CG-CD2 4.16Å; L348-L367 HydrophobicContact CD2-CD1 4.36Å; L348-L367 HydrophobicContact CD2-CD2 3.71Å; V351-L367 HydrophobicContact CB-CD2 4.42Å; V351-L367 HydrophobicContact CG2-CD2 4.13Å; F352-L367 HydrophobicContact CE2-CD1 4.49Å; F352-L367 HydrophobicContact CE2-CD2 4.15Å; D363-L367 WeakPolarHBondContact O-CG 3.31Å; D363-L367 PolarHBondContact O-N 3.05Å; D363-L367 VanDerWaalsContact O-N 3.15Å; L364-L367 HydrophobicContact CD2-CD1 4.32Å; L367-L370 HydrophobicContact CB-CB 4.3Å; L367-L370 HydrophobicContact CD1-CD2 4.09Å; L367-K467 HydrophobicContact CB-CD 4.38Å; L367-K467 PolarHBondContact O-NZ 3.46Å; L367-A471 HydrophobicContact CD1-CB 4.15Å
368	R	97.5	Very high	96.4	Very high	187 Å²	187	40.3 Å²	40.3	71%	0.706	19%	0.188	S	C	*	.	H	α-helix	trans	-87	-41	-175	-66.1	-178.3	-179.8	-175.2	1	111.5	E347 K366 E371 C372	E347-R368 PolarHBondContact OE1-N 2.89Å; K366-R368 PolarHBondContact O-N 3.48Å; R368-E371 WeakPolarHBondContact O-CB 3.42Å; R368-E371 PolarHBondContact O-N 2.94Å; R368-C372 PolarHBondContact O-N 3.04Å; R368-C372 VanDerWaalsContact O-N 3.07Å; R368-C372 PolarHBondContact O-SG 3.05Å
369	Y	98.6	Very high	96.6	Very high	22 Å²	22	36.1 Å²	36.1	9%	0.086	16%	0.161	C	C	.	.	H	α-helix	trans	-70.4	-41.7	177.6	-168.8	-101.7	0	0	0	111	V340 K343 V344 E347 E371 C372 V373 P430 E431 F434	V340-Y369 HydrophobicContact CG1-CE1 4.1Å; K343-Y369 HydrophobicContact CB-CD1 3.91Å; K343-Y369 HydrophobicContact CB-CE1 3.36Å; K343-Y369 HydrophobicContact CD-CE1 4.08Å; K343-Y369 HydrophobicContact CD-CE2 4.24Å; K343-Y369 WeakPolarHBondContact CD-OH 3.46Å; K343-Y369 HydrophobicContact CG-CE1 4.39Å; V344-Y369 HydrophobicContact CG2-CD1 3.69Å; V344-Y369 HydrophobicContact CG2-CE1 3.84Å; E347-Y369 WeakPolarHBondContact OE1-CB 2.98Å; E347-Y369 PolarHBondContact OE1-N 2.89Å; E347-Y369 PolarHBondContact OE2-N 3.46Å; Y369-E371 PolarHBondContact O-N 3.27Å; Y369-C372 WeakPolarHBondContact O-CA 3.45Å; Y369-C372 WeakPolarHBondContact O-CB 3.49Å; Y369-C372 PolarHBondContact O-N 3.46Å; Y369-V373 HydrophobicContact CD1-CG2 4.31Å; Y369-V373 HydrophobicContact CE1-CG2 4.01Å; Y369-V373 PolarHBondContact O-N 3.44Å; Y369-P430 HydrophobicContact CE2-CB 4.18Å; Y369-E431 PolarHBondContact OH-OE1 3.33Å; Y369-F434 AromaticContact CD2-CE1 3.88Å; Y369-F434 HydrophobicContact CD2-CE1 3.88Å; Y369-F434 AromaticContact CD2-CZ 3.96Å; Y369-F434 HydrophobicContact CD2-CZ 3.96Å; Y369-F434 HydrophobicContact CE2-CE1 4.29Å; Y369-F434 HydrophobicContact CE2-CZ 4.04Å
370	L	98.6	Very high	96.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57.8	-38	170.4	179.2	59.6	0	0	0	111.9	V344 E347 L367 C372 V373 I374 K467 L470 A471	V344-L370 HydrophobicContact CG1-CB 4.33Å; V344-L370 HydrophobicContact CG1-CD1 3.96Å; E347-L370 WeakPolarHBondContact OE2-CB 3.17Å; E347-L370 PolarHBondContact OE2-N 2.63Å; L367-L370 HydrophobicContact CB-CB 4.3Å; L367-L370 HydrophobicContact CD1-CD2 4.09Å; L370-C372 VanDerWaalsContact C-N 3.33Å; L370-C372 PolarHBondContact O-N 3.06Å; L370-V373 WeakPolarHBondContact O-CB 3.25Å; L370-V373 PolarHBondContact O-N 2.89Å; L370-I374 HydrophobicContact CG-CD1 4.23Å; L370-I374 WeakPolarHBondContact O-CG1 3.23Å; L370-I374 PolarHBondContact O-N 3.45Å; L370-K467 HydrophobicContact CD2-CB 4.33Å; L370-K467 HydrophobicContact CD2-CG 4.28Å; L370-K467 HydrophobicContact CG-CG 4.5Å; L370-L470 HydrophobicContact CD1-CB 4.11Å; L370-L470 HydrophobicContact CD1-CD1 4.27Å; L370-A471 HydrophobicContact CD2-CB 4.06Å
371	E	98.4	Very high	96.4	Very high	55 Å²	55	33.2 Å²	33.2	26%	0.257	15%	0.145	S	C	.	.	H	α-helix	trans	-64.7	-37.8	173.6	-162.9	-179.7	120.9	0	0	112.5	R368 Y369 V373 I374 K375 K467	R368-E371 WeakPolarHBondContact O-CB 3.42Å; R368-E371 PolarHBondContact O-N 2.94Å; Y369-E371 PolarHBondContact O-N 3.27Å; E371-V373 VanDerWaalsContact C-N 3.32Å; E371-I374 PolarHBondContact O-N 3.14Å; E371-K375 HydrophobicContact CG-CD 4.38Å; E371-K375 WeakPolarHBondContact O-CB 3.4Å; E371-K375 VanDerWaalsContact O-CG 3.31Å; E371-K375 WeakPolarHBondContact O-CG 3.11Å; E371-K375 PolarHBondContact O-N 3.03Å; E371-K375 WeakPolarHBondContact OE1-CE 3.16Å; E371-K375 IonicContact OE1-NZ 2.62Å; E371-K375 PolarHBondContact OE1-NZ 3.42Å; E371-K467 VanDerWaalsContact OE2-CE 3.31Å; E371-K467 WeakPolarHBondContact OE2-CE 3.22Å; E371-K467 IonicContact OE2-NZ 3.75Å; E371-K467 PolarHBondContact OE2-NZ 3.25Å
372	C	98.6	Very high	96.4	Very high	9 Å²	9	32.7 Å²	32.7	6%	0.061	14%	0.142	C	C	.	.	H	α-helix	trans	-64.9	-38.6	174.8	-65.4	0	0	0	0	111.5	R368 Y369 L370 K375 E376 P430 F433	R368-C372 PolarHBondContact O-N 3.04Å; R368-C372 VanDerWaalsContact O-N 3.07Å; R368-C372 PolarHBondContact O-SG 3.05Å; Y369-C372 WeakPolarHBondContact O-CA 3.45Å; Y369-C372 WeakPolarHBondContact O-CB 3.49Å; Y369-C372 PolarHBondContact O-N 3.46Å; L370-C372 VanDerWaalsContact C-N 3.33Å; L370-C372 PolarHBondContact O-N 3.06Å; C372-K375 PolarHBondContact O-N 2.96Å; C372-E376 WeakPolarHBondContact O-CB 3.31Å; C372-E376 PolarHBondContact O-N 3.44Å; C372-P430 HydrophobicContact CB-CB 4.02Å; C372-P430 WeakPolarHBondContact CB-O 3.24Å; C372-F433 HydrophobicContact CB-CB 4.14Å
373	V	98.7	Very high	96.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.1	-49.1	173.3	162.5	0	0	0	0	111	L334 V340 V344 Y369 L370 E371 K375 E376 A377 F428 P430	L334-V373 HydrophobicContact CD1-CG1 4.08Å; L334-V373 HydrophobicContact CD2-CG1 3.96Å; L334-V373 HydrophobicContact CD2-CG2 4.42Å; L334-V373 HydrophobicContact CG-CG1 4.03Å; V340-V373 HydrophobicContact CG1-CG2 3.68Å; V344-V373 HydrophobicContact CG2-CG2 3.71Å; Y369-V373 HydrophobicContact CD1-CG2 4.31Å; Y369-V373 HydrophobicContact CE1-CG2 4.01Å; Y369-V373 PolarHBondContact O-N 3.44Å; L370-V373 WeakPolarHBondContact O-CB 3.25Å; L370-V373 PolarHBondContact O-N 2.89Å; E371-V373 VanDerWaalsContact C-N 3.32Å; V373-K375 VanDerWaalsContact C-N 3.31Å; V373-K375 PolarHBondContact O-N 3.44Å; V373-E376 PolarHBondContact O-N 2.91Å; V373-A377 WeakPolarHBondContact O-CB 3.3Å; V373-A377 PolarHBondContact O-N 3.16Å; V373-F428 HydrophobicContact CG1-CZ 4.25Å; V373-P430 HydrophobicContact CB-CG 4.48Å; V373-P430 HydrophobicContact CG2-CB 3.94Å; V373-P430 HydrophobicContact CG2-CG 3.63Å
374	I	98.5	Very high	95.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-58.1	-45.5	176.2	-71.9	164	0	0	0	110.7	L370 E371 E376 A377 L378 L463 E466 K467 L470	L370-I374 HydrophobicContact CG-CD1 4.23Å; L370-I374 WeakPolarHBondContact O-CG1 3.23Å; L370-I374 PolarHBondContact O-N 3.45Å; E371-I374 PolarHBondContact O-N 3.14Å; I374-E376 PolarHBondContact O-N 3.23Å; I374-A377 WeakPolarHBondContact O-CB 3.45Å; I374-A377 PolarHBondContact O-N 3.14Å; I374-L378 HydrophobicContact CG2-CD1 4.12Å; I374-L378 PolarHBondContact O-N 3.16Å; I374-L463 HydrophobicContact CG2-CD2 3.77Å; I374-E466 HydrophobicContact CD1-CB 3.89Å; I374-E466 HydrophobicContact CG1-CB 4.47Å; I374-E466 WeakPolarHBondContact CG2-OE2 3.46Å; I374-K467 HydrophobicContact CD1-CG 3.77Å; I374-L470 HydrophobicContact CD1-CD1 4.02Å; I374-L470 HydrophobicContact CG1-CD1 3.69Å
375	K	98.4	Very high	95.5	Very high	52 Å²	52	30.6 Å²	30.6	23%	0.226	14%	0.138	C	C	.	.	H	α-helix	trans	-63.4	-42.3	178.6	-76.4	168.1	168.5	164.9	0	112.4	E371 C372 V373 L378 R379 F433 Y446	E371-K375 HydrophobicContact CG-CD 4.38Å; E371-K375 WeakPolarHBondContact O-CB 3.4Å; E371-K375 VanDerWaalsContact O-CG 3.31Å; E371-K375 WeakPolarHBondContact O-CG 3.11Å; E371-K375 PolarHBondContact O-N 3.03Å; E371-K375 WeakPolarHBondContact OE1-CE 3.16Å; E371-K375 IonicContact OE1-NZ 2.62Å; E371-K375 PolarHBondContact OE1-NZ 3.42Å; C372-K375 PolarHBondContact O-N 2.96Å; V373-K375 VanDerWaalsContact C-N 3.31Å; V373-K375 PolarHBondContact O-N 3.44Å; K375-L378 PolarHBondContact O-N 2.72Å; K375-R379 WeakPolarHBondContact O-CB 3.23Å; K375-R379 PolarHBondContact O-N 3.15Å; K375-F433 HydrophobicContact CB-CB 4.28Å; K375-F433 HydrophobicContact CB-CD1 3.85Å; K375-F433 HydrophobicContact CB-CD2 3.63Å; K375-F433 HydrophobicContact CB-CE1 4.03Å; K375-F433 HydrophobicContact CB-CE2 3.82Å; K375-F433 HydrophobicContact CB-CG 3.63Å; K375-F433 HydrophobicContact CB-CZ 4.02Å; K375-F433 HydrophobicContact CD-CB 4.06Å; K375-F433 HydrophobicContact CD-CD1 3.9Å; K375-F433 HydrophobicContact CD-CG 4.02Å; K375-F433 HydrophobicContact CG-CD1 4.36Å; K375-F433 HydrophobicContact CG-CG 4.44Å; K375-Y446 WeakPolarHBondContact CA-OH 3.49Å; K375-Y446 WeakPolarHBondContact CB-OH 3.48Å; K375-Y446 HydrophobicContact CG-CE1 4.4Å; K375-Y446 PolarHBondContact O-OH 3.49Å
376	E	98.3	Very high	95.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-69.6	-34.5	177.1	-175.2	70.1	172.6	0	0	112.2	C372 V373 I374 R379 L380 F428 R429 R432 F433	C372-E376 WeakPolarHBondContact O-CB 3.31Å; C372-E376 PolarHBondContact O-N 3.44Å; V373-E376 PolarHBondContact O-N 2.91Å; I374-E376 PolarHBondContact O-N 3.23Å; E376-R379 VanDerWaalsContact CD-NE 3.27Å; E376-R379 WeakPolarHBondContact O-CB 3.28Å; E376-R379 PolarHBondContact O-N 2.79Å; E376-R379 IonicContact OE1-CZ 2.75Å; E376-R379 IonicContact OE1-NE 2.67Å; E376-R379 PolarHBondContact OE1-NE 3.14Å; E376-R379 IonicContact OE1-NH2 2.7Å; E376-R379 PolarHBondContact OE1-NH2 2.77Å; E376-R379 WeakPolarHBondContact OE2-CD 3.43Å; E376-R379 IonicContact OE2-CZ 2.91Å; E376-R379 IonicContact OE2-NE 2.69Å; E376-R379 PolarHBondContact OE2-NE 3.25Å; E376-R379 IonicContact OE2-NH2 3.57Å; E376-L380 PolarHBondContact O-N 3.45Å; E376-F428 HydrophobicContact CB-CD2 4.13Å; E376-F428 HydrophobicContact CB-CE2 3.8Å; E376-F428 HydrophobicContact CG-CD2 3.35Å; E376-F428 HydrophobicContact CG-CE2 3.56Å; E376-F428 HydrophobicContact CG-CG 4.3Å; E376-R429 PolarHBondContact OE1-N 2.91Å; E376-R432 WeakPolarHBondContact OE1-CD 3.15Å; E376-R432 IonicContact OE1-NE 3.73Å; E376-R432 PolarHBondContact OE1-NE 3.49Å; E376-R432 VanDerWaalsContact OE1-NE 3.12Å; E376-R432 WeakPolarHBondContact OE2-CD 3.45Å; E376-R432 IonicContact OE2-NE 2.74Å; E376-F433 HydrophobicContact CB-CD2 4.13Å; E376-F433 HydrophobicContact CB-CE2 4.02Å; E376-F433 WeakPolarHBondContact OE2-CE2 3.38Å
377	A	96.2	Very high	95.1	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.9	-47.9	170.8	0	0	0	0	0	111.3	A330 L333 V373 I374 R379 L380 F381	A330-A377 HydrophobicContact CB-CB 3.97Å; L333-A377 HydrophobicContact CD1-CB 3.79Å; V373-A377 WeakPolarHBondContact O-CB 3.3Å; V373-A377 PolarHBondContact O-N 3.16Å; I374-A377 WeakPolarHBondContact O-CB 3.45Å; I374-A377 PolarHBondContact O-N 3.14Å; A377-R379 VanDerWaalsContact C-N 3.29Å; A377-R379 PolarHBondContact O-N 3.43Å; A377-L380 PolarHBondContact O-N 2.83Å; A377-F381 CarbonylContact O-C 3.56Å; A377-F381 WeakPolarHBondContact O-CA 3.33Å; A377-F381 PolarHBondContact O-N 3.28Å
378	L	96.2	Very high	94.9	Very high	4 Å²	4	24 Å²	24	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-68.1	-23.8	176.5	-75.1	171.3	0	0	0	113.9	I374 K375 P382 P448 F449	I374-L378 HydrophobicContact CG2-CD1 4.12Å; I374-L378 PolarHBondContact O-N 3.16Å; K375-L378 PolarHBondContact O-N 2.72Å; L378-P382 WeakPolarHBondContact O-CA 3.39Å; L378-P382 WeakPolarHBondContact O-CB 3.25Å; L378-P382 WeakPolarHBondContact O-CD 3.36Å; L378-P382 VanDerWaalsContact O-N 3.14Å; L378-P448 HydrophobicContact CB-CB 3.95Å; L378-P448 HydrophobicContact CB-CG 4.42Å; L378-P448 HydrophobicContact CD1-CB 4.39Å; L378-F449 HydrophobicContact CD1-CE2 3.76Å; L378-F449 HydrophobicContact CD1-CZ 3.78Å
379	R	97.6	Very high	94.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-69.4	-48.9	172.2	-170.4	-166.8	65.4	76.1	-2.8	110.9	K375 E376 A377 H416 F422 P425 E427 F433 Y446	K375-R379 WeakPolarHBondContact O-CB 3.23Å; K375-R379 PolarHBondContact O-N 3.15Å; E376-R379 VanDerWaalsContact CD-NE 3.27Å; E376-R379 WeakPolarHBondContact O-CB 3.28Å; E376-R379 PolarHBondContact O-N 2.79Å; E376-R379 IonicContact OE1-CZ 2.75Å; E376-R379 IonicContact OE1-NE 2.67Å; E376-R379 PolarHBondContact OE1-NE 3.14Å; E376-R379 IonicContact OE1-NH2 2.7Å; E376-R379 PolarHBondContact OE1-NH2 2.77Å; E376-R379 WeakPolarHBondContact OE2-CD 3.43Å; E376-R379 IonicContact OE2-CZ 2.91Å; E376-R379 IonicContact OE2-NE 2.69Å; E376-R379 PolarHBondContact OE2-NE 3.25Å; E376-R379 IonicContact OE2-NH2 3.57Å; A377-R379 VanDerWaalsContact C-N 3.29Å; A377-R379 PolarHBondContact O-N 3.43Å; R379-H416 HydrophobicContact CG-CB 3.72Å; R379-H416 WeakPolarHBondContact CG-O 3.44Å; R379-H416 PolarHBondContact NH1-O 3.26Å; R379-H416 WeakPolarHBondContact O-CB 3.36Å; R379-F422 HydrophobicContact CG-CD1 4.48Å; R379-F422 HydrophobicContact CG-CE1 4.21Å; R379-F422 HydrophobicContact CG-CZ 4.28Å; R379-P425 PolarHBondContact NH1-O 3.28Å; R379-P425 PolarHBondContact NH2-O 3.39Å; R379-E427 PolarHBondContact NH2-O 3.26Å; R379-F433 HydrophobicContact CB-CE2 4.3Å; R379-F433 HydrophobicContact CB-CZ 4.16Å; R379-F433 HydrophobicContact CG-CZ 4.5Å; R379-Y446 HydrophobicContact CB-CD2 4.35Å; R379-Y446 HydrophobicContact CB-CE2 3.82Å; R379-Y446 HydrophobicContact CG-CD2 4.35Å; R379-Y446 HydrophobicContact CG-CE2 4.32Å
380	L	93.6	Very high	94.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-74.1	-42.6	179.9	-73.4	176.2	0	0	0	111.5	L333 E376 A377 Y413 R417 P425 F428	L333-L380 HydrophobicContact CD1-CD1 4.3Å; L333-L380 HydrophobicContact CD2-CD1 4.15Å; E376-L380 PolarHBondContact O-N 3.45Å; A377-L380 PolarHBondContact O-N 2.83Å; L380-Y413 VanDerWaalsContact O-CE2 3.28Å; L380-Y413 WeakPolarHBondContact O-CE2 3.31Å; L380-R417 PolarHBondContact O-NH1 3.43Å; L380-R417 PolarHBondContact O-NH2 2.67Å; L380-P425 WeakPolarHBondContact CD2-O 3.31Å; L380-F428 HydrophobicContact CD1-CB 3.87Å; L380-F428 HydrophobicContact CD1-CD2 3.87Å; L380-F428 HydrophobicContact CD1-CG 4.35Å
381	F	91.1	Very high	94.5	Very high	8 Å²	8	15.5 Å²	15.5	4%	0.035	8%	0.083	C	C	.	.	S	Bend	trans	-131.8	72.4	-174.6	-56.4	-75.2	0	0	0	110	W329 L333 A377 S383 Y413 R485 P490	W329-F381 HydrophobicContact CB-CB 4.01Å; W329-F381 HydrophobicContact CB-CD2 4.41Å; W329-F381 HydrophobicContact CD2-CB 3.5Å; W329-F381 AromaticContact CD2-CD1 3.95Å; W329-F381 HydrophobicContact CD2-CD1 3.95Å; W329-F381 AromaticContact CD2-CD2 3.83Å; W329-F381 HydrophobicContact CD2-CD2 3.83Å; W329-F381 AromaticContact CD2-CG 3.48Å; W329-F381 HydrophobicContact CD2-CG 3.48Å; W329-F381 VanDerWaalsContact CD2-CG 3.48Å; W329-F381 AromaticContact CE2-CD1 3.81Å; W329-F381 AromaticContact CE2-CG 3.74Å; W329-F381 HydrophobicContact CE3-CB 4.11Å; W329-F381 AromaticContact CE3-CD1 3.88Å; W329-F381 HydrophobicContact CE3-CD1 3.88Å; W329-F381 AromaticContact CE3-CD2 3.52Å; W329-F381 HydrophobicContact CE3-CD2 3.52Å; W329-F381 HydrophobicContact CE3-CE1 4.15Å; W329-F381 AromaticContact CE3-CE2 3.82Å; W329-F381 HydrophobicContact CE3-CE2 3.82Å; W329-F381 AromaticContact CE3-CG 3.56Å; W329-F381 HydrophobicContact CE3-CG 3.56Å; W329-F381 HydrophobicContact CE3-CZ 4.12Å; W329-F381 HydrophobicContact CG-CB 3.44Å; W329-F381 VanDerWaalsContact CG-CB 3.44Å; W329-F381 HydrophobicContact CG-CD2 4.25Å; W329-F381 AromaticContact CG-CG 3.94Å; W329-F381 HydrophobicContact CG-CG 3.94Å; W329-F381 AromaticContact CH2-CD1 3.53Å; W329-F381 HydrophobicContact CH2-CD1 3.53Å; W329-F381 AromaticContact CH2-CE1 3.56Å; W329-F381 HydrophobicContact CH2-CE1 3.56Å; W329-F381 HydrophobicContact CH2-CG 4.09Å; W329-F381 HydrophobicContact CH2-CZ 4.14Å; W329-F381 HydrophobicContact CZ2-CB 4.3Å; W329-F381 AromaticContact CZ2-CD1 3.59Å; W329-F381 HydrophobicContact CZ2-CD1 3.59Å; W329-F381 HydrophobicContact CZ2-CE1 4.11Å; W329-F381 HydrophobicContact CZ2-CG 4.03Å; W329-F381 AromaticContact CZ3-CD1 3.69Å; W329-F381 HydrophobicContact CZ3-CD1 3.69Å; W329-F381 AromaticContact CZ3-CD2 3.96Å; W329-F381 HydrophobicContact CZ3-CD2 3.96Å; W329-F381 AromaticContact CZ3-CE1 3.6Å; W329-F381 HydrophobicContact CZ3-CE1 3.6Å; W329-F381 AromaticContact CZ3-CE2 3.87Å; W329-F381 HydrophobicContact CZ3-CE2 3.87Å; W329-F381 AromaticContact CZ3-CG 3.87Å; W329-F381 HydrophobicContact CZ3-CG 3.87Å; W329-F381 AromaticContact CZ3-CZ 3.69Å; W329-F381 HydrophobicContact CZ3-CZ 3.69Å; L333-F381 HydrophobicContact CD1-CD2 3.96Å; L333-F381 HydrophobicContact CD1-CE2 4.14Å; L333-F381 HydrophobicContact CD2-CE2 4.09Å; L333-F381 HydrophobicContact CG-CD2 4.5Å; L333-F381 HydrophobicContact CG-CE2 4.29Å; A377-F381 CarbonylContact O-C 3.56Å; A377-F381 WeakPolarHBondContact O-CA 3.33Å; A377-F381 PolarHBondContact O-N 3.28Å; F381-S383 PolarHBondContact O-N 2.78Å; F381-Y413 HydrophobicContact CD1-CE2 4.44Å; F381-R485 HydrophobicContact CZ-CG 4.28Å; F381-P490 HydrophobicContact CD1-CG 4.47Å; F381-P490 HydrophobicContact CE1-CG 4.06Å
382	P	90.4	Very high	94.2	Very high	8 Å²	8	14.3 Å²	14.3	5%	0.052	8%	0.08	C	C	.	.			trans	-60.6	127.4	174.9	24	-33.6	0	0	0	110.1	L378 V384 P385 Y413	L378-P382 WeakPolarHBondContact O-CA 3.39Å; L378-P382 WeakPolarHBondContact O-CB 3.25Å; L378-P382 WeakPolarHBondContact O-CD 3.36Å; L378-P382 VanDerWaalsContact O-N 3.14Å; P382-V384 PolarHBondContact O-N 3.4Å; P382-V384 VanDerWaalsContact O-N 3.08Å; P382-P385 HydrophobicContact CG-CB 4.37Å; P382-Y413 HydrophobicContact CG-CD2 4.36Å
383	S	87.6	Confident	94	Very high	18 Å²	18	17.4 Å²	17.4	13%	0.126	10%	0.097	C	C	.	.	S	Bend	trans	-55.7	-29.1	177.8	-48.5	0	0	0	0	112.9	T322 S326 F381 L494	T322-S383 VanDerWaalsContact O-CB 3.31Å; T322-S383 WeakPolarHBondContact O-CB 3.38Å; T322-S383 PolarHBondContact O-OG 2.64Å; S326-S383 PolarHBondContact N-OG 2.99Å; F381-S383 PolarHBondContact O-N 2.78Å; S383-L494 WeakPolarHBondContact O-CD2 3.38Å
384	V	90.1	Very high	93.8	Very high	43 Å²	43	21.1 Å²	21.1	26%	0.261	12%	0.116	S	C	.	.	S	Bend	trans	-116.4	94.4	170.9	-177.7	0	0	0	0	108.2	T322 P382 F386 F387 T412 L494	T322-V384 HydrophobicContact CG2-CG2 4.16Å; P382-V384 PolarHBondContact O-N 3.4Å; P382-V384 VanDerWaalsContact O-N 3.08Å; V384-F386 VanDerWaalsContact C-N 3.3Å; V384-F386 WeakPolarHBondContact CG1-O 3.45Å; V384-F386 PolarHBondContact O-N 3.48Å; V384-F387 HydrophobicContact CG1-CB 4.31Å; V384-F387 HydrophobicContact CG1-CD1 4.41Å; V384-T412 PolarHBondContact O-OG1 2.82Å; V384-L494 HydrophobicContact CG2-CD2 4.08Å
385	P	87	Confident	93.5	Very high	14 Å²	14	22.2 Å²	22.2	9%	0.091	12%	0.123	C	C	.	.			trans	-78.3	-14.1	-171.2	30.6	-36.1	0	0	0	114	F67 P382 T412 Y413	F67-P385 HydrophobicContact CD2-CG 4.49Å; F67-P385 HydrophobicContact CE2-CB 3.63Å; F67-P385 HydrophobicContact CE2-CG 3.95Å; F67-P385 HydrophobicContact CZ-CB 3.9Å; F67-P385 HydrophobicContact CZ-CG 4.46Å; P382-P385 HydrophobicContact CG-CB 4.37Å; P385-T412 VanDerWaalsContact CA-OG1 3.26Å; P385-T412 WeakPolarHBondContact CA-OG1 3.15Å; P385-T412 PolarHBondContact O-N 3.08Å; P385-T412 PolarHBondContact O-OG1 2.91Å; P385-Y413 PolarHBondContact O-N 3.3Å
386	F	90.6	Very high	93.2	Very high	60 Å²	60	24.3 Å²	24.3	26%	0.263	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	151.3	167.4	53	-92.4	0	0	0	111.6	F66 F67 V384 I409 I410 I411	F66-F386 HydrophobicContact CE1-CZ 4.32Å; F67-F386 HydrophobicContact CD2-CD1 4.35Å; F67-F386 HydrophobicContact CD2-CE1 4.03Å; F67-F386 HydrophobicContact CE2-CD1 4.32Å; F67-F386 HydrophobicContact CE2-CE1 4.42Å; V384-F386 VanDerWaalsContact C-N 3.3Å; V384-F386 WeakPolarHBondContact CG1-O 3.45Å; V384-F386 PolarHBondContact O-N 3.48Å; F386-I409 HydrophobicContact CB-CG2 4.19Å; F386-I410 WeakPolarHBondContact CA-O 3.39Å; F386-I410 WeakPolarHBondContact CB-O 3.46Å; F386-I411 HydrophobicContact CB-CD1 3.61Å; F386-I411 HydrophobicContact CG-CD1 4.33Å
387	F	93.3	Very high	93	Very high	12 Å²	12	24.3 Å²	24.3	5%	0.053	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	163.4	173.3	58.7	-97	0	0	0	110.2	L105 V384 I410 T412	L105-F387 HydrophobicContact CD1-CE2 4.16Å; L105-F387 HydrophobicContact CD1-CZ 4Å; L105-F387 HydrophobicContact CD2-CE2 3.97Å; V384-F387 HydrophobicContact CG1-CB 4.31Å; V384-F387 HydrophobicContact CG1-CD1 4.41Å; F387-I410 HydrophobicContact CD2-CB 4.38Å; F387-I410 HydrophobicContact CD2-CD1 4.13Å; F387-I410 HydrophobicContact CE1-CG2 4.33Å; F387-I410 HydrophobicContact CE2-CB 4.05Å; F387-I410 HydrophobicContact CE2-CD1 3.45Å; F387-I410 VanDerWaalsContact CE2-CD1 3.45Å; F387-I410 HydrophobicContact CE2-CG1 4.35Å; F387-I410 HydrophobicContact CE2-CG2 4.35Å; F387-I410 HydrophobicContact CZ-CB 4.17Å; F387-I410 HydrophobicContact CZ-CD1 4.07Å; F387-I410 HydrophobicContact CZ-CG2 3.97Å; F387-I410 PolarHBondContact N-O 3.41Å; F387-I410 VanDerWaalsContact N-O 3.09Å; F387-I410 PolarHBondContact O-N 3.34Å; F387-T412 HydrophobicContact CD1-CG2 4.01Å; F387-T412 HydrophobicContact CE1-CG2 3.39Å; F387-T412 HydrophobicContact CZ-CG2 4.31Å
388	A	93.9	Very high	92.7	Very high	11 Å²	11	27.5 Å²	27.5	9%	0.091	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	149.8	-169.6	0	0	0	0	0	115.4	A114 A408 I409	A114-A388 HydrophobicContact CB-CB 3.39Å; A114-A388 PolarHBondContact N-O 3.25Å; A388-A408 CarbonylContact C-O 3.55Å; A388-A408 WeakPolarHBondContact CA-O 3.23Å; A388-A408 WeakPolarHBondContact CB-O 3.17Å; A388-I409 HydrophobicContact CB-CB 4.45Å; A388-I409 HydrophobicContact CB-CG1 4.12Å
389	R	95.1	Very high	92.4	Very high	3 Å²	3	30.4 Å²	30.4	1%	0.011	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.1	175.8	-59.7	-63	173.5	-176.7	-7.5	110.5	I104 L105 L111 T112 N407 A408 R454	I104-R389 HydrophobicContact CG2-CB 4.22Å; I104-R389 HydrophobicContact CG2-CG 4.1Å; L105-R389 HydrophobicContact CD2-CG 4.48Å; L111-R389 PolarHBondContact O-NH1 2.92Å; T112-R389 WeakPolarHBondContact O-CA 3.47Å; R389-N407 CarbonylContact O-C 3.52Å; R389-N407 VanDerWaalsContact O-CA 3.23Å; R389-N407 WeakPolarHBondContact O-CA 3.5Å; R389-A408 PolarHBondContact N-O 3.22Å; R389-A408 PolarHBondContact O-N 3.42Å; R389-R454 VanDerWaalsContact NH1-CB 3.28Å; R389-R454 VanDerWaalsContact NH1-CG 3.31Å; R389-R454 PolarHBondContact NH2-O 3.24Å
390	S	95.4	Very high	92.2	Very high	27 Å²	27	32.4 Å²	32.4	19%	0.189	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	130.4	163.4	-173.1	0	0	0	0	108.7	T112 C392	T112-S390 PolarHBondContact O-N 2.86Å; S390-C392 PolarHBondContact O-N 2.92Å
391	L	94.9	Very high	92.2	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	22%	0.217	C	C	.	.			trans	-77.7	108.4	178.4	-61.7	-177.8	0	0	0	109.5	I104 D393 V402 G405 A406 A408	I104-L391 HydrophobicContact CD1-CD2 3.59Å; I104-L391 HydrophobicContact CG1-CD2 4.49Å; I104-L391 HydrophobicContact CG2-CD2 4.47Å; L391-D393 VanDerWaalsContact C-N 3.31Å; L391-D393 PolarHBondContact O-N 2.77Å; L391-V402 HydrophobicContact CD1-CB 4.01Å; L391-V402 HydrophobicContact CD1-CG1 3.42Å; L391-V402 VanDerWaalsContact CD1-CG1 3.42Å; L391-G405 PolarHBondContact O-N 3.23Å; L391-A406 WeakPolarHBondContact CB-O 3.23Å; L391-A406 HydrophobicContact CD1-CB 4.34Å; L391-A406 WeakPolarHBondContact CG-O 3.45Å; L391-A406 PolarHBondContact N-O 2.65Å; L391-A408 HydrophobicContact CD2-CB 4Å; L391-A408 HydrophobicContact CG-CB 4.37Å
392	C	93.3	Very high	92.4	Very high	30 Å²	30	37.4 Å²	37.4	20%	0.203	22%	0.215	C	C	.	.	S	Bend	trans	-77.5	-13.2	-178.4	-59.4	0	0	0	0	114.5	V109 H110 T112 S390 K404	V109-C392 HydrophobicContact CG1-CB 3.68Å; V109-C392 WeakPolarHBondContact O-CB 3.41Å; V109-C392 PolarHBondContact O-SG 3.41Å; V109-C392 VanDerWaalsContact O-SG 3.34Å; H110-C392 PolarHBondContact ND1-N 3.36Å; T112-C392 PolarHBondContact OG1-SG 2.89Å; T112-C392 VanDerWaalsContact OG1-SG 3.4Å; S390-C392 PolarHBondContact O-N 2.92Å; C392-K404 WeakPolarHBondContact O-CD 3.09Å; C392-K404 WeakPolarHBondContact O-CE 3.3Å; C392-K404 WeakPolarHBondContact O-CG 3.08Å; C392-K404 PolarHBondContact O-NZ 3.02Å
393	D	94.3	Very high	92.7	Very high	75 Å²	75	37.1 Å²	37.1	40%	0.401	21%	0.214	S	C	.	.	S	Bend	trans	-144.5	162.1	176.8	-78.2	-21.3	0	0	0	110.1	V109 L391 K404	V109-D393 HydrophobicContact CG1-CB 4.25Å; V109-D393 WeakPolarHBondContact CG1-OD2 3.27Å; L391-D393 VanDerWaalsContact C-N 3.31Å; L391-D393 PolarHBondContact O-N 2.77Å; D393-K404 IonicContact OD1-NZ 3.11Å
394	D	93.6	Very high	93	Very high	78 Å²	78	41.9 Å²	41.9	42%	0.417	23%	0.232	S	C	.	.			trans	-60.9	136.3	171.8	-78.7	14	0	0	0	110.1	K401 V402 P403 K404	D394-K401 WeakPolarHBondContact OD2-CE 3.23Å; D394-K401 IonicContact OD2-NZ 3.9Å; D394-K401 PolarHBondContact OD2-NZ 3.18Å; D394-V402 WeakPolarHBondContact CA-O 3.4Å; D394-P403 WeakPolarHBondContact OD1-CA 3.41Å; D394-K404 PolarHBondContact OD1-N 2.93Å
395	C	92.8	Very high	93.1	Very high	22 Å²	22	41.2 Å²	41.2	15%	0.149	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	158.6	178	72.7	0	0	0	0	112.9	V402	C395-V402 PolarHBondContact N-O 3.39Å; C395-V402 PolarHBondContact O-N 2.7Å
396	N	93	Very high	93.5	Very high	97 Å²	97	40.5 Å²	40.5	52%	0.519	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	112.5	175.8	-172.4	-20.1	0	0	0	110.2	K103 G399 F400	K103-N396 PolarHBondContact NZ-O 3.07Å; N396-G399 VanDerWaalsContact OD1-CA 3.23Å; N396-G399 WeakPolarHBondContact OD1-CA 3.41Å; N396-G399 PolarHBondContact OD1-N 3.1Å; N396-F400 WeakPolarHBondContact CA-O 3.19Å; N396-F400 PolarHBondContact OD1-N 2.98Å; N396-F400 PolarHBondContact OD1-O 2.79Å
397	L	92.9	Very high	93.7	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	109.8	-179	-58.8	-177.1	0	0	0	108.6	L82 L95 K103 I104 G399 F400 V402	L82-L397 HydrophobicContact CD2-CB 3.42Å; L82-L397 VanDerWaalsContact CD2-CB 3.42Å; L82-L397 HydrophobicContact CD2-CD1 4.32Å; L95-L397 HydrophobicContact CD1-CD1 4.26Å; L95-L397 HydrophobicContact CD2-CD1 3.83Å; K103-L397 HydrophobicContact CB-CD2 3.97Å; K103-L397 HydrophobicContact CD-CD2 3.97Å; I104-L397 HydrophobicContact CD1-CD1 4.29Å; I104-L397 HydrophobicContact CD1-CD2 3.95Å; I104-L397 HydrophobicContact CG1-CD2 4.36Å; L397-G399 VanDerWaalsContact C-N 3.26Å; L397-G399 PolarHBondContact O-N 3.14Å; L397-G399 VanDerWaalsContact O-N 3.14Å; L397-F400 PolarHBondContact N-O 3.33Å; L397-F400 WeakPolarHBondContact O-CB 3.48Å; L397-F400 WeakPolarHBondContact O-CD2 3.44Å; L397-F400 PolarHBondContact O-N 2.94Å; L397-V402 HydrophobicContact CB-CG2 4.49Å; L397-V402 HydrophobicContact CD1-CG2 3.91Å; L397-V402 HydrophobicContact CG-CG2 4.17Å
398	N	89.9	Confident	93.9	Very high	67 Å²	67	37.4 Å²	37.4	36%	0.358	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	42	46.9	-176.8	-69.5	-10.7	0	0	0	115.1	P81 N100 F400	P81-N398 HydrophobicContact CB-CB 3.65Å; P81-N398 VanDerWaalsContact CB-ND2 3.26Å; P81-N398 WeakPolarHBondContact CB-ND2 3.37Å; P81-N398 HydrophobicContact CG-CB 3.81Å; N100-N398 PolarHBondContact ND2-ND2 2.67Å; N100-N398 VanDerWaalsContact ND2-ND2 3.17Å; N100-N398 VanDerWaalsContact OD1-CG 3.28Å; N100-N398 PolarHBondContact OD1-N 3.12Å; N100-N398 PolarHBondContact OD1-ND2 3.25Å; N100-N398 PolarHBondContact OD1-OD1 3.34Å; N398-F400 VanDerWaalsContact C-N 3.32Å
399	G	89.9	Confident	94	Very high	64 Å²	64	38.4 Å²	38.4	66%	0.66	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.5	-9.7	178.2	0	0	0	0	0	114.2	N396 L397	N396-G399 VanDerWaalsContact OD1-CA 3.23Å; N396-G399 WeakPolarHBondContact OD1-CA 3.41Å; N396-G399 PolarHBondContact OD1-N 3.1Å; L397-G399 VanDerWaalsContact C-N 3.26Å; L397-G399 PolarHBondContact O-N 3.14Å; L397-G399 VanDerWaalsContact O-N 3.14Å
400	F	94.2	Very high	94	Very high	42 Å²	42	38.3 Å²	38.3	18%	0.184	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.2	176.2	-62.1	-76.5	0	0	0	111.6	S42 I43 P44 P81 L82 N396 L397 N398	S42-F400 VanDerWaalsContact O-CE1 3.25Å; S42-F400 WeakPolarHBondContact O-CE1 3.38Å; I43-F400 HydrophobicContact CB-CD1 4.45Å; I43-F400 HydrophobicContact CD1-CB 4.42Å; I43-F400 HydrophobicContact CG1-CB 3.81Å; I43-F400 HydrophobicContact CG1-CD1 3.87Å; I43-F400 HydrophobicContact CG1-CG 4.02Å; P44-F400 HydrophobicContact CG-CZ 4.36Å; P81-F400 HydrophobicContact CG-CD2 4.14Å; P81-F400 HydrophobicContact CG-CE2 3.62Å; L82-F400 HydrophobicContact CD1-CB 4.48Å; L82-F400 HydrophobicContact CD1-CD2 4.27Å; L82-F400 HydrophobicContact CD1-CG 4.42Å; L82-F400 HydrophobicContact CD2-CB 4.46Å; L82-F400 HydrophobicContact CD2-CD2 4.06Å; L82-F400 HydrophobicContact CG-CD2 4.14Å; N396-F400 WeakPolarHBondContact CA-O 3.19Å; N396-F400 PolarHBondContact OD1-N 2.98Å; N396-F400 PolarHBondContact OD1-O 2.79Å; L397-F400 PolarHBondContact N-O 3.33Å; L397-F400 WeakPolarHBondContact O-CB 3.48Å; L397-F400 WeakPolarHBondContact O-CD2 3.44Å; L397-F400 PolarHBondContact O-N 2.94Å; N398-F400 VanDerWaalsContact C-N 3.32Å
401	K	93.7	Very high	94	Very high	113 Å²	113	37.1 Å²	37.1	49%	0.491	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	123.2	171.2	-171.1	175.8	-179.4	-177.6	0	109.7	D394	D394-K401 WeakPolarHBondContact OD2-CE 3.23Å; D394-K401 IonicContact OD2-NZ 3.9Å; D394-K401 PolarHBondContact OD2-NZ 3.18Å
402	V	95.5	Very high	94	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	119.4	172.7	-167	0	0	0	0	108.7	M40 I43 V93 L391 D394 C395 L397 A406	M40-V402 HydrophobicContact CE-CG1 4.49Å; I43-V402 HydrophobicContact CD1-CG2 3.97Å; V93-V402 HydrophobicContact CG1-CG1 4.24Å; L391-V402 HydrophobicContact CD1-CB 4.01Å; L391-V402 HydrophobicContact CD1-CG1 3.42Å; L391-V402 VanDerWaalsContact CD1-CG1 3.42Å; D394-V402 WeakPolarHBondContact CA-O 3.4Å; C395-V402 PolarHBondContact N-O 3.39Å; C395-V402 PolarHBondContact O-N 2.7Å; L397-V402 HydrophobicContact CB-CG2 4.49Å; L397-V402 HydrophobicContact CD1-CG2 3.91Å; L397-V402 HydrophobicContact CG-CG2 4.17Å; V402-A406 HydrophobicContact CG1-CB 3.82Å
403	P	94.9	Very high	93.9	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.013	21%	0.206	C	C	.	.			trans	-75.6	153.3	-177.1	28.2	-31	0	0	0	112.2	K36 M40 D394 A406	K36-P403 HydrophobicContact CB-CG 4.16Å; K36-P403 HydrophobicContact CG-CB 4.34Å; K36-P403 HydrophobicContact CG-CG 3.97Å; M40-P403 VanDerWaalsContact CG-CD 3.43Å; M40-P403 HydrophobicContact CG-CG 3.86Å; M40-P403 HydrophobicContact SD-CG 4.36Å; D394-P403 WeakPolarHBondContact OD1-CA 3.41Å; P403-A406 WeakPolarHBondContact O-CB 3.35Å; P403-A406 PolarHBondContact O-N 3.1Å
404	K	94.9	Very high	93.9	Very high	118 Å²	118	34 Å²	34	51%	0.513	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	139.1	169.6	176.9	173.4	-176.7	141.6	0	111.8	C392 D393 D394	C392-K404 WeakPolarHBondContact O-CD 3.09Å; C392-K404 WeakPolarHBondContact O-CE 3.3Å; C392-K404 WeakPolarHBondContact O-CG 3.08Å; C392-K404 PolarHBondContact O-NZ 3.02Å; D393-K404 IonicContact OD1-NZ 3.11Å; D394-K404 PolarHBondContact OD1-N 2.93Å
405	G	92.3	Very high	94	Very high	29 Å²	29	30.3 Å²	30.3	30%	0.299	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	2.6	179.3	0	0	0	0	0	114.9	L391	L391-G405 PolarHBondContact O-N 3.23Å
406	A	95	Very high	94.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.164	C	C	.	.			trans	-77.3	157	162.4	0	0	0	0	0	111.4	M40 P91 L391 V402 P403	M40-A406 HydrophobicContact SD-CB 4.06Å; P91-A406 HydrophobicContact CB-CB 4.35Å; P91-A406 HydrophobicContact CG-CB 4.14Å; L391-A406 WeakPolarHBondContact CB-O 3.23Å; L391-A406 HydrophobicContact CD1-CB 4.34Å; L391-A406 WeakPolarHBondContact CG-O 3.45Å; L391-A406 PolarHBondContact N-O 2.65Å; V402-A406 HydrophobicContact CG1-CB 3.82Å; P403-A406 WeakPolarHBondContact O-CB 3.35Å; P403-A406 PolarHBondContact O-N 3.1Å
407	N	95.8	Very high	94.3	Very high	7 Å²	7	25.3 Å²	25.3	4%	0.037	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	121.4	179.7	-62.2	-94.3	0	0	0	110.1	I90 P91 F92 V93 A114 F115 R389	I90-N407 WeakPolarHBondContact CG2-ND2 3.39Å; P91-N407 PolarHBondContact O-N 3.09Å; P91-N407 PolarHBondContact O-ND2 2.89Å; F92-N407 CarbonylContact C-O 3.4Å; F92-N407 WeakPolarHBondContact CA-O 3.17Å; F92-N407 HydrophobicContact CD1-CB 3.4Å; F92-N407 HydrophobicContact CE1-CB 3.59Å; F92-N407 HydrophobicContact CG-CB 4.22Å; V93-N407 PolarHBondContact N-O 3.15Å; A114-N407 VanDerWaalsContact CA-OD1 3.25Å; A114-N407 WeakPolarHBondContact CA-OD1 3.25Å; A114-N407 HydrophobicContact CB-CB 4.15Å; A114-N407 VanDerWaalsContact CB-OD1 3.25Å; A114-N407 WeakPolarHBondContact CB-OD1 3.25Å; F115-N407 PolarHBondContact N-OD1 3.06Å; R389-N407 CarbonylContact O-C 3.52Å; R389-N407 VanDerWaalsContact O-CA 3.23Å; R389-N407 WeakPolarHBondContact O-CA 3.5Å
408	A	96.3	Very high	94.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	113.6	172.5	0	0	0	0	0	110	V93 L95 I104 A388 R389 L391	V93-A408 HydrophobicContact CG1-CB 3.87Å; V93-A408 CarbonylContact O-C 3.46Å; V93-A408 WeakPolarHBondContact O-CA 3.22Å; L95-A408 HydrophobicContact CD1-CB 3.95Å; I104-A408 HydrophobicContact CG1-CB 4.34Å; I104-A408 HydrophobicContact CG2-CB 4.27Å; A388-A408 CarbonylContact C-O 3.55Å; A388-A408 WeakPolarHBondContact CA-O 3.23Å; A388-A408 WeakPolarHBondContact CB-O 3.17Å; R389-A408 PolarHBondContact N-O 3.22Å; R389-A408 PolarHBondContact O-N 3.42Å; L391-A408 HydrophobicContact CD2-CB 4Å; L391-A408 HydrophobicContact CG-CB 4.37Å
409	I	95.8	Very high	94.6	Very high	32 Å²	32	26.7 Å²	26.7	16%	0.164	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	128	171	-49.4	-178.4	0	0	0	107.9	F92 V93 L95 F386 A388 I411	F92-I409 HydrophobicContact CB-CD1 3.95Å; F92-I409 HydrophobicContact CB-CG1 4.23Å; F92-I409 HydrophobicContact CD1-CD1 3.45Å; F92-I409 VanDerWaalsContact CD1-CD1 3.45Å; F92-I409 HydrophobicContact CD1-CG1 3.56Å; F92-I409 HydrophobicContact CE1-CD1 4.19Å; F92-I409 HydrophobicContact CE1-CG1 4.38Å; F92-I409 HydrophobicContact CG-CD1 3.9Å; F92-I409 HydrophobicContact CG-CG1 4.29Å; V93-I409 PolarHBondContact O-N 3.13Å; L95-I409 PolarHBondContact N-O 3.12Å; F386-I409 HydrophobicContact CB-CG2 4.19Å; A388-I409 HydrophobicContact CB-CB 4.45Å; A388-I409 HydrophobicContact CB-CG1 4.12Å; I409-I411 HydrophobicContact CG2-CD1 3.62Å
410	I	96.1	Very high	94.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	118.3	176.6	-64.5	155.3	0	0	0	107.4	L95 V101 L105 F386 F387 T412	L95-I410 HydrophobicContact CB-CG1 4.34Å; L95-I410 HydrophobicContact CD1-CG1 4.37Å; L95-I410 WeakPolarHBondContact O-CA 3.43Å; V101-I410 HydrophobicContact CG1-CD1 4.49Å; V101-I410 HydrophobicContact CG1-CG2 4.18Å; V101-I410 HydrophobicContact CG2-CG1 4.35Å; V101-I410 HydrophobicContact CG2-CG2 3.85Å; L105-I410 HydrophobicContact CD1-CD1 4.09Å; L105-I410 HydrophobicContact CD2-CD1 3.61Å; L105-I410 HydrophobicContact CG-CD1 3.84Å; F386-I410 WeakPolarHBondContact CA-O 3.39Å; F386-I410 WeakPolarHBondContact CB-O 3.46Å; F387-I410 HydrophobicContact CD2-CB 4.38Å; F387-I410 HydrophobicContact CD2-CD1 4.13Å; F387-I410 HydrophobicContact CE1-CG2 4.33Å; F387-I410 HydrophobicContact CE2-CB 4.05Å; F387-I410 HydrophobicContact CE2-CD1 3.45Å; F387-I410 VanDerWaalsContact CE2-CD1 3.45Å; F387-I410 HydrophobicContact CE2-CG1 4.35Å; F387-I410 HydrophobicContact CE2-CG2 4.35Å; F387-I410 HydrophobicContact CZ-CB 4.17Å; F387-I410 HydrophobicContact CZ-CD1 4.07Å; F387-I410 HydrophobicContact CZ-CG2 3.97Å; F387-I410 PolarHBondContact N-O 3.41Å; F387-I410 VanDerWaalsContact N-O 3.09Å; F387-I410 PolarHBondContact O-N 3.34Å; I410-T412 HydrophobicContact CG2-CG2 4.35Å; I410-T412 PolarHBondContact O-N 3.45Å
411	I	95.2	Very high	94.8	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.01	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	91.4	178.7	-47.2	-58.1	0	0	0	108	I70 T74 V94 L95 F96 F386 I409 Y413 T414 L415	I70-I411 HydrophobicContact CG2-CD1 3.76Å; I70-I411 HydrophobicContact CG2-CG1 4.41Å; T74-I411 HydrophobicContact CG2-CB 4.39Å; T74-I411 HydrophobicContact CG2-CG1 4.12Å; T74-I411 HydrophobicContact CG2-CG2 4.33Å; V94-I411 HydrophobicContact CG1-CD1 4.04Å; V94-I411 HydrophobicContact CG1-CG1 3.5Å; V94-I411 VanDerWaalsContact CG1-CG1 3.5Å; L95-I411 PolarHBondContact O-N 3.05Å; F96-I411 HydrophobicContact CB-CB 4.5Å; F386-I411 HydrophobicContact CB-CD1 3.61Å; F386-I411 HydrophobicContact CG-CD1 4.33Å; I409-I411 HydrophobicContact CG2-CD1 3.62Å; I411-Y413 PolarHBondContact O-N 3.24Å; I411-T414 PolarHBondContact O-N 3.31Å; I411-L415 VanDerWaalsContact O-CB 3.32Å; I411-L415 WeakPolarHBondContact O-CB 3.24Å; I411-L415 PolarHBondContact O-N 2.94Å
412	T	94.3	Very high	94.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.7	-35.3	-179.1	48.9	0	0	0	0	111.6	V384 P385 F387 I410 T414 L415 H416 V447	V384-T412 PolarHBondContact O-OG1 2.82Å; P385-T412 VanDerWaalsContact CA-OG1 3.26Å; P385-T412 WeakPolarHBondContact CA-OG1 3.15Å; P385-T412 PolarHBondContact O-N 3.08Å; P385-T412 PolarHBondContact O-OG1 2.91Å; F387-T412 HydrophobicContact CD1-CG2 4.01Å; F387-T412 HydrophobicContact CE1-CG2 3.39Å; F387-T412 HydrophobicContact CZ-CG2 4.31Å; I410-T412 HydrophobicContact CG2-CG2 4.35Å; I410-T412 PolarHBondContact O-N 3.45Å; T412-T414 VanDerWaalsContact C-N 3.32Å; T412-T414 PolarHBondContact O-N 3.3Å; T412-L415 PolarHBondContact O-N 3.16Å; T412-H416 WeakPolarHBondContact O-CB 3.31Å; T412-H416 PolarHBondContact O-CD2 3.06Å; T412-H416 PolarHBondContact O-N 3.46Å; T412-V447 HydrophobicContact CG2-CG2 4.19Å
413	Y	92.1	Very high	94.9	Very high	27 Å²	27	28.5 Å²	28.5	11%	0.106	15%	0.147	C	C	.	.	H	α-helix	trans	-55.7	-44.6	178.9	-172.8	-92.3	0	0	0	113	F67 V71 L380 F381 P382 P385 I411 R417	F67-Y413 HydrophobicContact CE1-CD2 4.29Å; F67-Y413 HydrophobicContact CE1-CE2 4.28Å; F67-Y413 HydrophobicContact CE1-CG 4.43Å; F67-Y413 HydrophobicContact CZ-CD1 4.02Å; F67-Y413 AromaticContact CZ-CD2 3.73Å; F67-Y413 HydrophobicContact CZ-CD2 3.73Å; F67-Y413 HydrophobicContact CZ-CE1 4.45Å; F67-Y413 HydrophobicContact CZ-CE2 4.18Å; F67-Y413 AromaticContact CZ-CG 3.64Å; F67-Y413 HydrophobicContact CZ-CG 3.64Å; V71-Y413 HydrophobicContact CG1-CD1 4.31Å; V71-Y413 HydrophobicContact CG1-CE1 4.14Å; V71-Y413 HydrophobicContact CG2-CD1 3.72Å; V71-Y413 HydrophobicContact CG2-CE1 4.03Å; L380-Y413 VanDerWaalsContact O-CE2 3.28Å; L380-Y413 WeakPolarHBondContact O-CE2 3.31Å; F381-Y413 HydrophobicContact CD1-CE2 4.44Å; P382-Y413 HydrophobicContact CG-CD2 4.36Å; P385-Y413 PolarHBondContact O-N 3.3Å; I411-Y413 PolarHBondContact O-N 3.24Å; Y413-R417 WeakPolarHBondContact O-CD 3.42Å; Y413-R417 WeakPolarHBondContact O-CG 3.19Å; Y413-R417 PolarHBondContact O-NH1 2.84Å; Y413-R417 PolarHBondContact OH-NH2 3.25Å
414	T	94.4	Very high	95	Very high	15 Å²	15	34 Å²	34	9%	0.092	17%	0.172	C	C	.	.	H	α-helix	trans	-79.5	-40.9	177.2	-51.9	0	0	0	0	111.3	T74 F96 I411 T412 H416 R417 D418	T74-T414 HydrophobicContact CG2-CG2 4.41Å; T74-T414 WeakPolarHBondContact OG1-CG2 3.42Å; T74-T414 PolarHBondContact OG1-OG1 2.65Å; F96-T414 HydrophobicContact CB-CG2 3.96Å; F96-T414 HydrophobicContact CD2-CG2 4.29Å; F96-T414 HydrophobicContact CG-CG2 4.33Å; I411-T414 PolarHBondContact O-N 3.31Å; T412-T414 VanDerWaalsContact C-N 3.32Å; T412-T414 PolarHBondContact O-N 3.3Å; T414-H416 PolarHBondContact O-N 2.89Å; T414-R417 CarbonylContact O-C 3.43Å; T414-R417 WeakPolarHBondContact O-CA 3.15Å; T414-R417 WeakPolarHBondContact O-CB 3.33Å; T414-R417 PolarHBondContact O-N 3.47Å; T414-D418 PolarHBondContact O-N 3.34Å
415	L	96	Very high	95	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-54.7	-41.2	177.3	175.8	68.6	0	0	0	112.4	F96 A98 V101 I411 T412 R417 D418 V447	F96-L415 WeakPolarHBondContact O-CA 3.47Å; F96-L415 WeakPolarHBondContact O-CD1 3.38Å; A98-L415 HydrophobicContact CB-CD1 4.17Å; V101-L415 HydrophobicContact CG1-CD2 4.3Å; V101-L415 HydrophobicContact CG2-CD1 4.24Å; V101-L415 HydrophobicContact CG2-CD2 4.12Å; I411-L415 VanDerWaalsContact O-CB 3.32Å; I411-L415 WeakPolarHBondContact O-CB 3.24Å; I411-L415 PolarHBondContact O-N 2.94Å; T412-L415 PolarHBondContact O-N 3.16Å; L415-R417 PolarHBondContact O-N 2.95Å; L415-D418 PolarHBondContact O-N 3.19Å; L415-V447 HydrophobicContact CD2-CG2 3.5Å; L415-V447 VanDerWaalsContact CD2-CG2 3.5Å
416	H	96.9	Very high	95	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-1.1	-179.9	-66.8	-178.6	0	0	0	113.6	R379 T412 T414 F422 A445 V447	R379-H416 HydrophobicContact CG-CB 3.72Å; R379-H416 WeakPolarHBondContact CG-O 3.44Å; R379-H416 PolarHBondContact NH1-O 3.26Å; R379-H416 WeakPolarHBondContact O-CB 3.36Å; T412-H416 WeakPolarHBondContact O-CB 3.31Å; T412-H416 PolarHBondContact O-CD2 3.06Å; T412-H416 PolarHBondContact O-N 3.46Å; T414-H416 PolarHBondContact O-N 2.89Å; H416-F422 VanDerWaalsContact O-CD2 3.28Å; H416-F422 WeakPolarHBondContact O-CD2 3.34Å; H416-A445 PolarHBondContact CD2-O 3.3Å; H416-V447 PolarHBondContact NE2-N 3.48Å
417	R	95.1	Very high	95.1	Very high	13 Å²	13	37 Å²	37	5%	0.049	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	11.3	176	-72.8	174.9	167.6	72	3.7	113.1	L380 Y413 T414 L415 P419 P425 E426	L380-R417 PolarHBondContact O-NH1 3.43Å; L380-R417 PolarHBondContact O-NH2 2.67Å; Y413-R417 WeakPolarHBondContact O-CD 3.42Å; Y413-R417 WeakPolarHBondContact O-CG 3.19Å; Y413-R417 PolarHBondContact O-NH1 2.84Å; Y413-R417 PolarHBondContact OH-NH2 3.25Å; T414-R417 CarbonylContact O-C 3.43Å; T414-R417 WeakPolarHBondContact O-CA 3.15Å; T414-R417 WeakPolarHBondContact O-CB 3.33Å; T414-R417 PolarHBondContact O-N 3.47Å; L415-R417 PolarHBondContact O-N 2.95Å; R417-P419 VanDerWaalsContact O-CD 3.24Å; R417-P419 WeakPolarHBondContact O-CD 3.32Å; R417-P425 HydrophobicContact CB-CB 4.03Å; R417-P425 HydrophobicContact CG-CB 4.37Å; R417-P425 VanDerWaalsContact O-CB 3.23Å; R417-P425 WeakPolarHBondContact O-CB 3.43Å; R417-P425 WeakPolarHBondContact O-CG 3.06Å; R417-E426 VanDerWaalsContact CD-OE1 3.25Å; R417-E426 WeakPolarHBondContact CD-OE1 3.46Å; R417-E426 IonicContact CZ-OE2 3.45Å; R417-E426 IonicContact NE-OE1 3.88Å; R417-E426 PolarHBondContact NE-OE1 3.24Å; R417-E426 IonicContact NE-OE2 3.13Å; R417-E426 PolarHBondContact NE-OE2 2.94Å; R417-E426 IonicContact NH2-OE2 3.98Å
418	D	94.8	Very high	95.1	Very high	10 Å²	10	37.4 Å²	37.4	5%	0.053	19%	0.185	C	C	.	.			trans	-66.1	113.1	176.3	-167	-35.5	0	0	0	110.1	H97 T414 L415 R420 Y421 F422	H97-D418 IonicContact CE1-OD2 3.5Å; H97-D418 IonicContact ND1-OD2 3.3Å; H97-D418 PolarHBondContact ND1-OD2 3.04Å; H97-D418 VanDerWaalsContact ND1-OD2 3.15Å; T414-D418 PolarHBondContact O-N 3.34Å; L415-D418 PolarHBondContact O-N 3.19Å; D418-R420 PolarHBondContact O-N 2.93Å; D418-R420 VanDerWaalsContact O-N 3.11Å; D418-R420 VanDerWaalsContact OD1-CB 3.22Å; D418-R420 WeakPolarHBondContact OD1-CB 3.23Å; D418-R420 WeakPolarHBondContact OD1-CG 3.35Å; D418-R420 IonicContact OD1-CZ 3.69Å; D418-R420 PolarHBondContact OD1-N 2.89Å; D418-R420 IonicContact OD1-NE 2.97Å; D418-R420 PolarHBondContact OD1-NE 2.98Å; D418-R420 IonicContact OD2-CZ 2.64Å; D418-R420 VanDerWaalsContact OD2-CZ 3.25Å; D418-R420 IonicContact OD2-NE 3.74Å; D418-R420 PolarHBondContact OD2-NE 3.15Å; D418-R420 IonicContact OD2-NH2 2.84Å; D418-R420 PolarHBondContact OD2-NH2 3.11Å; D418-Y421 HydrophobicContact CB-CD2 4.12Å; D418-Y421 PolarHBondContact O-N 3.1Å; D418-F422 PolarHBondContact O-N 3.3Å
419	P	94.6	Very high	95.1	Very high	86 Å²	86	41.4 Å²	41.4	56%	0.558	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-16	-174.6	27.9	-35.3	0	0	0	113	R417 Y421 P425	R417-P419 VanDerWaalsContact O-CD 3.24Å; R417-P419 WeakPolarHBondContact O-CD 3.32Å; P419-Y421 PolarHBondContact O-N 3.42Å; P419-P425 HydrophobicContact CB-CG 4.46Å
420	R	93	Very high	95.3	Very high	127 Å²	127	39.9 Å²	39.9	48%	0.479	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-28.7	173.3	-58.3	177.6	-64.4	154.6	6.3	111.9	H97 E99 D418	H97-R420 PolarHBondContact ND1-NH2 3.22Å; H97-R420 VanDerWaalsContact ND1-NH2 3.11Å; E99-R420 IonicContact OE1-CZ 3.81Å; E99-R420 IonicContact OE1-NH1 3.64Å; E99-R420 PolarHBondContact OE1-NH1 3.37Å; E99-R420 IonicContact OE1-NH2 2.95Å; E99-R420 PolarHBondContact OE1-NH2 3.01Å; E99-R420 IonicContact OE2-CZ 2.73Å; E99-R420 IonicContact OE2-NH1 3.63Å; E99-R420 IonicContact OE2-NH2 2.71Å; E99-R420 PolarHBondContact OE2-NH2 3.4Å; E99-R420 VanDerWaalsContact OE2-NH2 3.16Å; D418-R420 PolarHBondContact O-N 2.93Å; D418-R420 VanDerWaalsContact O-N 3.11Å; D418-R420 VanDerWaalsContact OD1-CB 3.22Å; D418-R420 WeakPolarHBondContact OD1-CB 3.23Å; D418-R420 WeakPolarHBondContact OD1-CG 3.35Å; D418-R420 IonicContact OD1-CZ 3.69Å; D418-R420 PolarHBondContact OD1-N 2.89Å; D418-R420 IonicContact OD1-NE 2.97Å; D418-R420 PolarHBondContact OD1-NE 2.98Å; D418-R420 IonicContact OD2-CZ 2.64Å; D418-R420 VanDerWaalsContact OD2-CZ 3.25Å; D418-R420 IonicContact OD2-NE 3.74Å; D418-R420 PolarHBondContact OD2-NE 3.15Å; D418-R420 IonicContact OD2-NH2 2.84Å; D418-R420 PolarHBondContact OD2-NH2 3.11Å
421	Y	94.7	Very high	95.3	Very high	52 Å²	52	41.7 Å²	41.7	20%	0.204	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-21.2	-176.8	-53.5	-53.2	0	0	0	113.2	A98 E99 D418 P419 P442 A445	A98-Y421 HydrophobicContact CB-CD2 4.47Å; A98-Y421 HydrophobicContact CB-CE2 3.82Å; E99-Y421 PolarHBondContact OE1-OH 3.25Å; D418-Y421 HydrophobicContact CB-CD2 4.12Å; D418-Y421 PolarHBondContact O-N 3.1Å; P419-Y421 PolarHBondContact O-N 3.42Å; Y421-P442 VanDerWaalsContact CD1-CD 3.49Å; Y421-P442 HydrophobicContact CD1-CG 3.91Å; Y421-P442 HydrophobicContact CE1-CG 3.38Å; Y421-A445 HydrophobicContact CD2-CB 3.78Å; Y421-A445 HydrophobicContact CE2-CB 4.38Å; Y421-A445 HydrophobicContact CG-CB 3.95Å
422	F	96.3	Very high	95.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	-132.2	85.3	178.8	-58.6	-75.4	0	0	0	110.7	R379 H416 D418 E424 P425 F433 Y446	R379-F422 HydrophobicContact CG-CD1 4.48Å; R379-F422 HydrophobicContact CG-CE1 4.21Å; R379-F422 HydrophobicContact CG-CZ 4.28Å; H416-F422 VanDerWaalsContact O-CD2 3.28Å; H416-F422 WeakPolarHBondContact O-CD2 3.34Å; D418-F422 PolarHBondContact O-N 3.3Å; F422-E424 PolarHBondContact O-N 2.77Å; F422-P425 HydrophobicContact CB-CB 4.49Å; F422-P425 WeakPolarHBondContact O-CA 3.09Å; F422-P425 WeakPolarHBondContact O-CB 3.39Å; F422-P425 WeakPolarHBondContact O-CD 3.33Å; F422-F433 HydrophobicContact CE1-CZ 4.39Å; F422-Y446 HydrophobicContact CZ-CD2 4.32Å
423	P	94.9	Very high	95.5	Very high	79 Å²	79	43 Å²	43	51%	0.513	21%	0.206	S	C	.	.	S	Bend	trans	-56.3	138.9	176.8	-25	34.1	0	0	0	111.4	R429 R432	P423-R429 PolarHBondContact O-NH2 3.41Å; P423-R429 VanDerWaalsContact O-NH2 3.09Å; P423-R432 PolarHBondContact O-NH1 3.34Å; P423-R432 PolarHBondContact O-NH2 2.66Å
424	E	96.1	Very high	95.7	Very high	116 Å²	116	45 Å²	45	54%	0.542	22%	0.215	S	C	.	.	S	Bend	trans	51.9	62.5	-172.5	-53	164.2	112.1	0	0	110.4	F422 E426 E427 R429 R432	F422-E424 PolarHBondContact O-N 2.77Å; E424-E426 PolarHBondContact O-N 3.13Å; E424-E427 HydrophobicContact CB-CB 4.27Å; E424-E427 HydrophobicContact CB-CG 3.87Å; E424-E427 PolarHBondContact O-N 3.33Å; E424-R429 IonicContact OE2-CZ 3.56Å; E424-R429 VanDerWaalsContact OE2-CZ 3.3Å; E424-R429 IonicContact OE2-NH1 3.83Å; E424-R429 PolarHBondContact OE2-NH1 2.91Å; E424-R429 IonicContact OE2-NH2 3.91Å; E424-R429 PolarHBondContact OE2-NH2 3.35Å; E424-R432 PolarHBondContact O-NH2 3.4Å
425	P	95.4	Very high	95.7	Very high	28 Å²	28	49 Å²	49	18%	0.182	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.1	-163.5	23.9	-34.4	0	0	0	113.8	R379 L380 R417 P419 F422	R379-P425 PolarHBondContact NH1-O 3.28Å; R379-P425 PolarHBondContact NH2-O 3.39Å; L380-P425 WeakPolarHBondContact CD2-O 3.31Å; R417-P425 HydrophobicContact CB-CB 4.03Å; R417-P425 HydrophobicContact CG-CB 4.37Å; R417-P425 VanDerWaalsContact O-CB 3.23Å; R417-P425 WeakPolarHBondContact O-CB 3.43Å; R417-P425 WeakPolarHBondContact O-CG 3.06Å; P419-P425 HydrophobicContact CB-CG 4.46Å; F422-P425 HydrophobicContact CB-CB 4.49Å; F422-P425 WeakPolarHBondContact O-CA 3.09Å; F422-P425 WeakPolarHBondContact O-CB 3.39Å; F422-P425 WeakPolarHBondContact O-CD 3.33Å
426	E	93.4	Very high	95.6	Very high	76 Å²	76	55.5 Å²	55.5	36%	0.355	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-16.5	178.2	-56.4	-56.4	166.4	0	0	113	R417 E424 R485	R417-E426 VanDerWaalsContact CD-OE1 3.25Å; R417-E426 WeakPolarHBondContact CD-OE1 3.46Å; R417-E426 IonicContact CZ-OE2 3.45Å; R417-E426 IonicContact NE-OE1 3.88Å; R417-E426 PolarHBondContact NE-OE1 3.24Å; R417-E426 IonicContact NE-OE2 3.13Å; R417-E426 PolarHBondContact NE-OE2 2.94Å; R417-E426 IonicContact NH2-OE2 3.98Å; E424-E426 PolarHBondContact O-N 3.13Å; E426-R485 PolarHBondContact O-NH1 2.97Å; E426-R485 IonicContact OE2-CZ 3.2Å; E426-R485 IonicContact OE2-NH1 3.3Å; E426-R485 IonicContact OE2-NH2 2.76Å; E426-R485 PolarHBondContact OE2-NH2 2.84Å
427	E	95.4	Very high	95.4	Very high	108 Å²	108	60 Å²	60	51%	0.505	30%	0.296	S	S	.	.	S	Bend	trans	-74.3	130.8	-179.6	-67.4	-59.7	145.9	0	0	111.9	R379 E424 R429 R432	R379-E427 PolarHBondContact NH2-O 3.26Å; E424-E427 HydrophobicContact CB-CB 4.27Å; E424-E427 HydrophobicContact CB-CG 3.87Å; E424-E427 PolarHBondContact O-N 3.33Å; E427-R429 PolarHBondContact O-N 3.12Å; E427-R432 PolarHBondContact O-NH2 2.99Å
428	F	96.2	Very high	95.2	Very high	15 Å²	15	61.1 Å²	61.1	7%	0.066	31%	0.305	C	S	.	.			trans	-77.9	101.2	174.4	178.5	-115.7	0	0	0	110.2	L333 H337 V340 V373 E376 L380 P430	L333-F428 HydrophobicContact CB-CD1 4.28Å; L333-F428 HydrophobicContact CB-CD2 4.16Å; L333-F428 HydrophobicContact CB-CE1 3.99Å; L333-F428 HydrophobicContact CB-CE2 3.91Å; L333-F428 HydrophobicContact CB-CG 4.36Å; L333-F428 HydrophobicContact CB-CZ 3.81Å; L333-F428 HydrophobicContact CD1-CD2 3.72Å; L333-F428 HydrophobicContact CD1-CE2 3.69Å; L333-F428 HydrophobicContact CD1-CZ 4.42Å; L333-F428 HydrophobicContact CD2-CB 4.12Å; L333-F428 HydrophobicContact CD2-CD1 4.45Å; L333-F428 HydrophobicContact CD2-CD2 3.92Å; L333-F428 HydrophobicContact CD2-CE2 4.5Å; L333-F428 HydrophobicContact CD2-CG 3.91Å; L333-F428 HydrophobicContact CG-CD2 4.15Å; L333-F428 HydrophobicContact CG-CE2 4.25Å; H337-F428 HydrophobicContact CB-CD1 4.06Å; H337-F428 HydrophobicContact CB-CE1 4.29Å; H337-F428 AromaticContact CD2-CD1 3.91Å; H337-F428 AromaticContact CE1-CD1 3.92Å; H337-F428 AromaticContact CG-CD1 3.59Å; H337-F428 AromaticContact ND1-CD1 3.59Å; V340-F428 HydrophobicContact CB-CE1 4.14Å; V340-F428 HydrophobicContact CG1-CE1 3.79Å; V340-F428 HydrophobicContact CG1-CZ 4.31Å; V340-F428 HydrophobicContact CG2-CD1 4.33Å; V340-F428 HydrophobicContact CG2-CE1 4.1Å; V373-F428 HydrophobicContact CG1-CZ 4.25Å; E376-F428 HydrophobicContact CB-CD2 4.13Å; E376-F428 HydrophobicContact CB-CE2 3.8Å; E376-F428 HydrophobicContact CG-CD2 3.35Å; E376-F428 HydrophobicContact CG-CE2 3.56Å; E376-F428 HydrophobicContact CG-CG 4.3Å; L380-F428 HydrophobicContact CD1-CB 3.87Å; L380-F428 HydrophobicContact CD1-CD2 3.87Å; L380-F428 HydrophobicContact CD1-CG 4.35Å; F428-P430 HydrophobicContact CE1-CG 4.16Å; F428-P430 HydrophobicContact CE2-CG 4.35Å; F428-P430 HydrophobicContact CZ-CG 3.91Å
429	R	97.3	Very high	95	Very high	83 Å²	83	64.3 Å²	64.3	31%	0.313	33%	0.333	S	S	.	.			trans	-136.3	90.4	-175.9	-178.6	166.9	44.2	-164.5	-10.2	111.2	E376 P423 E424 E427 E431 R432	E376-R429 PolarHBondContact OE1-N 2.91Å; P423-R429 PolarHBondContact O-NH2 3.41Å; P423-R429 VanDerWaalsContact O-NH2 3.09Å; E424-R429 IonicContact OE2-CZ 3.56Å; E424-R429 VanDerWaalsContact OE2-CZ 3.3Å; E424-R429 IonicContact OE2-NH1 3.83Å; E424-R429 PolarHBondContact OE2-NH1 2.91Å; E424-R429 IonicContact OE2-NH2 3.91Å; E424-R429 PolarHBondContact OE2-NH2 3.35Å; E427-R429 PolarHBondContact O-N 3.12Å; R429-E431 HydrophobicContact CG-CB 4.27Å; R429-E431 WeakPolarHBondContact CG-OE2 3.42Å; R429-E431 PolarHBondContact O-N 3.35Å; R429-E431 VanDerWaalsContact O-N 3.12Å; R429-R432 HydrophobicContact CB-CG 4.28Å; R429-R432 HydrophobicContact CG-CG 4.28Å; R429-R432 VanDerWaalsContact NH2-CZ 3.27Å; R429-R432 VanDerWaalsContact NH2-NH1 3.15Å; R429-R432 WeakPolarHBondContact O-CB 2.86Å; R429-R432 WeakPolarHBondContact O-CG 3.41Å; R429-R432 PolarHBondContact O-N 2.81Å; R429-R432 VanDerWaalsContact O-N 3.15Å
430	P	98.2	Very high	94.7	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-52.3	-32.7	178.8	-29.2	36.8	0	0	0	114.2	V340 Y369 C372 V373 F428 R432 F433	V340-P430 HydrophobicContact CG1-CG 3.72Å; V340-P430 HydrophobicContact CG2-CG 4.39Å; Y369-P430 HydrophobicContact CE2-CB 4.18Å; C372-P430 HydrophobicContact CB-CB 4.02Å; C372-P430 WeakPolarHBondContact CB-O 3.24Å; V373-P430 HydrophobicContact CB-CG 4.48Å; V373-P430 HydrophobicContact CG2-CB 3.94Å; V373-P430 HydrophobicContact CG2-CG 3.63Å; F428-P430 HydrophobicContact CE1-CG 4.16Å; F428-P430 HydrophobicContact CE2-CG 4.35Å; F428-P430 HydrophobicContact CZ-CG 3.91Å; P430-R432 PolarHBondContact O-N 3.26Å; P430-F433 PolarHBondContact O-N 2.95Å
431	E	97.3	Very high	94.8	Very high	39 Å²	39	60.6 Å²	60.6	18%	0.182	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-58.1	-18.1	-178.9	-65.1	84.1	172.3	0	0	113.4	K343 Y369 R429 F433 F434 N437	K343-E431 IonicContact NZ-OE1 2.65Å; K343-E431 PolarHBondContact NZ-OE1 3.03Å; Y369-E431 PolarHBondContact OH-OE1 3.33Å; R429-E431 HydrophobicContact CG-CB 4.27Å; R429-E431 WeakPolarHBondContact CG-OE2 3.42Å; R429-E431 PolarHBondContact O-N 3.35Å; R429-E431 VanDerWaalsContact O-N 3.12Å; E431-F433 PolarHBondContact O-N 2.9Å; E431-F433 VanDerWaalsContact O-N 3.15Å; E431-F434 HydrophobicContact CB-CD2 3.86Å; E431-F434 HydrophobicContact CB-CE2 3.66Å; E431-F434 HydrophobicContact CB-CZ 4.21Å; E431-F434 HydrophobicContact CG-CD2 4.12Å; E431-F434 HydrophobicContact CG-CE2 3.38Å; E431-F434 HydrophobicContact CG-CZ 3.69Å; E431-F434 WeakPolarHBondContact O-CB 3.39Å; E431-F434 WeakPolarHBondContact O-CG 3.29Å; E431-F434 PolarHBondContact O-N 2.98Å; E431-F434 VanDerWaalsContact O-N 3.13Å; E431-N437 WeakPolarHBondContact O-CB 3.36Å; E431-N437 PolarHBondContact O-ND2 2.84Å
432	R	96.6	Very high	94.8	Very high	15 Å²	15	59.7 Å²	59.7	6%	0.057	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-56.6	-26.3	170.9	-67.4	173.9	-164.5	-74.7	8.1	113.2	E376 P423 E424 E427 R429 P430 S438 R441	E376-R432 WeakPolarHBondContact OE1-CD 3.15Å; E376-R432 IonicContact OE1-NE 3.73Å; E376-R432 PolarHBondContact OE1-NE 3.49Å; E376-R432 VanDerWaalsContact OE1-NE 3.12Å; E376-R432 WeakPolarHBondContact OE2-CD 3.45Å; E376-R432 IonicContact OE2-NE 2.74Å; P423-R432 PolarHBondContact O-NH1 3.34Å; P423-R432 PolarHBondContact O-NH2 2.66Å; E424-R432 PolarHBondContact O-NH2 3.4Å; E427-R432 PolarHBondContact O-NH2 2.99Å; R429-R432 HydrophobicContact CB-CG 4.28Å; R429-R432 HydrophobicContact CG-CG 4.28Å; R429-R432 VanDerWaalsContact NH2-CZ 3.27Å; R429-R432 VanDerWaalsContact NH2-NH1 3.15Å; R429-R432 WeakPolarHBondContact O-CB 2.86Å; R429-R432 WeakPolarHBondContact O-CG 3.41Å; R429-R432 PolarHBondContact O-N 2.81Å; R429-R432 VanDerWaalsContact O-N 3.15Å; P430-R432 PolarHBondContact O-N 3.26Å; R432-S438 PolarHBondContact O-OG 3.28Å; R432-R441 PolarHBondContact O-NH2 3.46Å
433	F	97.4	Very high	94.6	Very high	15 Å²	15	64.5 Å²	64.5	7%	0.066	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-97.9	7.3	-177.5	-69.4	-76.6	0	0	0	113.8	C372 K375 E376 R379 F422 P430 E431 S438 Y446	C372-F433 HydrophobicContact CB-CB 4.14Å; K375-F433 HydrophobicContact CB-CB 4.28Å; K375-F433 HydrophobicContact CB-CD1 3.85Å; K375-F433 HydrophobicContact CB-CD2 3.63Å; K375-F433 HydrophobicContact CB-CE1 4.03Å; K375-F433 HydrophobicContact CB-CE2 3.82Å; K375-F433 HydrophobicContact CB-CG 3.63Å; K375-F433 HydrophobicContact CB-CZ 4.02Å; K375-F433 HydrophobicContact CD-CB 4.06Å; K375-F433 HydrophobicContact CD-CD1 3.9Å; K375-F433 HydrophobicContact CD-CG 4.02Å; K375-F433 HydrophobicContact CG-CD1 4.36Å; K375-F433 HydrophobicContact CG-CG 4.44Å; E376-F433 HydrophobicContact CB-CD2 4.13Å; E376-F433 HydrophobicContact CB-CE2 4.02Å; E376-F433 WeakPolarHBondContact OE2-CE2 3.38Å; R379-F433 HydrophobicContact CB-CE2 4.3Å; R379-F433 HydrophobicContact CB-CZ 4.16Å; R379-F433 HydrophobicContact CG-CZ 4.5Å; F422-F433 HydrophobicContact CE1-CZ 4.39Å; P430-F433 PolarHBondContact O-N 2.95Å; E431-F433 PolarHBondContact O-N 2.9Å; E431-F433 VanDerWaalsContact O-N 3.15Å; F433-S438 WeakPolarHBondContact CA-OG 3.41Å; F433-Y446 AromaticContact CE1-CD1 3.83Å; F433-Y446 HydrophobicContact CE1-CD1 3.83Å; F433-Y446 AromaticContact CE1-CD2 3.98Å; F433-Y446 HydrophobicContact CE1-CD2 3.98Å; F433-Y446 AromaticContact CE1-CE1 3.74Å; F433-Y446 HydrophobicContact CE1-CE1 3.74Å; F433-Y446 AromaticContact CE1-CE2 3.9Å; F433-Y446 HydrophobicContact CE1-CE2 3.9Å; F433-Y446 AromaticContact CE1-CG 3.93Å; F433-Y446 HydrophobicContact CE1-CG 3.93Å; F433-Y446 AromaticContact CE1-CZ 3.76Å; F433-Y446 HydrophobicContact CZ-CD1 4.43Å; F433-Y446 AromaticContact CZ-CD2 3.79Å; F433-Y446 HydrophobicContact CZ-CD2 3.79Å; F433-Y446 HydrophobicContact CZ-CE1 4.19Å; F433-Y446 AromaticContact CZ-CE2 3.52Å; F433-Y446 HydrophobicContact CZ-CE2 3.52Å; F433-Y446 HydrophobicContact CZ-CG 4.24Å; F433-Y446 AromaticContact CZ-CZ 3.72Å
434	F	96.2	Very high	94.6	Very high	67 Å²	67	62.5 Å²	62.5	29%	0.294	35%	0.349	S	S	.	.	S	Bend	trans	-60.4	147.1	163.9	-66	-22.6	0	0	0	110.9	Y369 E431 E436 N437 S438	Y369-F434 AromaticContact CD2-CE1 3.88Å; Y369-F434 HydrophobicContact CD2-CE1 3.88Å; Y369-F434 AromaticContact CD2-CZ 3.96Å; Y369-F434 HydrophobicContact CD2-CZ 3.96Å; Y369-F434 HydrophobicContact CE2-CE1 4.29Å; Y369-F434 HydrophobicContact CE2-CZ 4.04Å; E431-F434 HydrophobicContact CB-CD2 3.86Å; E431-F434 HydrophobicContact CB-CE2 3.66Å; E431-F434 HydrophobicContact CB-CZ 4.21Å; E431-F434 HydrophobicContact CG-CD2 4.12Å; E431-F434 HydrophobicContact CG-CE2 3.38Å; E431-F434 HydrophobicContact CG-CZ 3.69Å; E431-F434 WeakPolarHBondContact O-CB 3.39Å; E431-F434 WeakPolarHBondContact O-CG 3.29Å; E431-F434 PolarHBondContact O-N 2.98Å; E431-F434 VanDerWaalsContact O-N 3.13Å; F434-E436 WeakPolarHBondContact CB-OE2 3.45Å; F434-E436 PolarHBondContact O-N 3.35Å; F434-N437 HydrophobicContact CB-CB 4.49Å; F434-N437 PolarHBondContact O-N 3.44Å; F434-N437 VanDerWaalsContact O-N 3.12Å; F434-S438 WeakPolarHBondContact O-CB 3.24Å; F434-S438 PolarHBondContact O-N 3.26Å; F434-S438 PolarHBondContact O-OG 3.41Å
435	P	93.6	Very high	94.6	Very high	100 Å²	100	57 Å²	57	65%	0.649	32%	0.323	S	S	*	.	H	α-helix	trans	-53.3	-39.4	-177.6	-27.2	35.7	0	0	0	113	S438 A439	P435-S438 PolarHBondContact O-N 3.16Å; P435-A439 PolarHBondContact O-N 3.42Å
436	E	94.1	Very high	94.7	Very high	137 Å²	137	57.6 Å²	57.6	64%	0.64	32%	0.322	S	S	*	.	H	α-helix	trans	-70	-39.6	-177.8	-47.5	73.9	-152.8	0	0	111.1	F434 S438 A439	F434-E436 WeakPolarHBondContact CB-OE2 3.45Å; F434-E436 PolarHBondContact O-N 3.35Å; E436-S438 VanDerWaalsContact C-N 3.34Å; E436-A439 WeakPolarHBondContact O-CB 3.2Å; E436-A439 PolarHBondContact O-N 3.24Å
437	N	92.4	Very high	94.9	Very high	95 Å²	95	54.1 Å²	54.1	51%	0.508	31%	0.306	S	S	.	.	H	α-helix	trans	-81.3	-14.2	-179.5	-67.1	-22.7	0	0	0	113.6	E431 F434 R441	E431-N437 WeakPolarHBondContact O-CB 3.36Å; E431-N437 PolarHBondContact O-ND2 2.84Å; F434-N437 HydrophobicContact CB-CB 4.49Å; F434-N437 PolarHBondContact O-N 3.44Å; F434-N437 VanDerWaalsContact O-N 3.12Å; N437-R441 PolarHBondContact O-NH2 3.49Å
438	S	90.7	Very high	94.9	Very high	35 Å²	35	50 Å²	50	25%	0.245	29%	0.288	C	S	.	.	H	α-helix	trans	-93.7	-12.8	174.5	-59	0	0	0	0	112.6	R432 F433 F434 P435 E436 G440 R441	R432-S438 PolarHBondContact O-OG 3.28Å; F433-S438 WeakPolarHBondContact CA-OG 3.41Å; F434-S438 WeakPolarHBondContact O-CB 3.24Å; F434-S438 PolarHBondContact O-N 3.26Å; F434-S438 PolarHBondContact O-OG 3.41Å; P435-S438 PolarHBondContact O-N 3.16Å; E436-S438 VanDerWaalsContact C-N 3.34Å; S438-G440 PolarHBondContact O-N 2.79Å; S438-R441 WeakPolarHBondContact O-CB 3.4Å; S438-R441 PolarHBondContact O-N 3.23Å
439	A	91.1	Very high	94.9	Very high	78 Å²	78	50.7 Å²	50.7	65%	0.645	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	131.3	178.9	0	0	0	0	0	110.8	P435 E436 R441	P435-A439 PolarHBondContact O-N 3.42Å; E436-A439 WeakPolarHBondContact O-CB 3.2Å; E436-A439 PolarHBondContact O-N 3.24Å; A439-R441 VanDerWaalsContact C-N 3.26Å; A439-R441 PolarHBondContact O-N 3.07Å
440	G	88.6	Confident	94.8	Very high	85 Å²	85	47.9 Å²	47.9	88%	0.876	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	-3.9	179.9	0	0	0	0	0	115.7	S438	S438-G440 PolarHBondContact O-N 2.79Å
441	R	94.2	Very high	94.6	Very high	49 Å²	49	48.7 Å²	48.7	19%	0.185	29%	0.292	C	S	.	.			trans	-66.4	131.4	172.2	-171.5	-178.4	-60	138.3	11	109.8	R432 N437 S438 A439 A445	R432-R441 PolarHBondContact O-NH2 3.46Å; N437-R441 PolarHBondContact O-NH2 3.49Å; S438-R441 WeakPolarHBondContact O-CB 3.4Å; S438-R441 PolarHBondContact O-N 3.23Å; A439-R441 VanDerWaalsContact C-N 3.26Å; A439-R441 PolarHBondContact O-N 3.07Å; R441-A445 HydrophobicContact CG-CB 4.07Å
442	P	94.7	Very high	94.4	Very high	33 Å²	33	48.3 Å²	48.3	21%	0.214	30%	0.298	C	S	.	.			trans	-58.1	139.1	176.6	-27.1	36.3	0	0	0	111.8	Y421 Y444 A445	Y421-P442 VanDerWaalsContact CD1-CD 3.49Å; Y421-P442 HydrophobicContact CD1-CG 3.91Å; Y421-P442 HydrophobicContact CE1-CG 3.38Å; P442-Y444 PolarHBondContact O-N 3.48Å; P442-Y444 VanDerWaalsContact O-N 3.08Å; P442-A445 HydrophobicContact CB-CB 4.27Å; P442-A445 WeakPolarHBondContact O-CB 3.25Å; P442-A445 PolarHBondContact O-N 3.33Å
443	P	92.2	Very high	94.2	Very high	102 Å²	102	51.8 Å²	51.8	66%	0.662	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.7	-175.8	-26.4	34.2	0	0	0	114.2
444	Y	96	Very high	94	Very high	36 Å²	36	52 Å²	52	14%	0.141	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	4.6	-177.5	-65.9	-92.3	0	0	0	114	V101 E102 L105 G106 P442 Y446 V447 A451	V101-Y444 HydrophobicContact CG1-CD1 4.39Å; E102-Y444 HydrophobicContact CB-CD1 4.37Å; E102-Y444 HydrophobicContact CB-CD2 3.5Å; E102-Y444 HydrophobicContact CB-CE2 4.06Å; E102-Y444 HydrophobicContact CB-CG 3.69Å; E102-Y444 HydrophobicContact CG-CD2 3.47Å; E102-Y444 VanDerWaalsContact CG-CD2 3.47Å; E102-Y444 HydrophobicContact CG-CE2 3.59Å; E102-Y444 HydrophobicContact CG-CG 4.17Å; L105-Y444 HydrophobicContact CB-CD1 3.95Å; L105-Y444 HydrophobicContact CB-CE1 3.54Å; L105-Y444 HydrophobicContact CD1-CD1 4.27Å; G106-Y444 WeakPolarHBondContact CA-OH 3.44Å; P442-Y444 PolarHBondContact O-N 3.48Å; P442-Y444 VanDerWaalsContact O-N 3.08Å; Y444-Y446 VanDerWaalsContact C-N 3.34Å; Y444-V447 HydrophobicContact CD1-CG1 4.39Å; Y444-A451 HydrophobicContact CD1-CB 3.65Å; Y444-A451 HydrophobicContact CE1-CB 3.38Å
445	A	96.4	Very high	93.9	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	32%	0.317	C	S	.	.	S	Bend	trans	-76.7	-22.1	173.7	0	0	0	0	0	112.7	A98 H416 Y421 R441 P442	A98-A445 HydrophobicContact CB-CB 4.09Å; H416-A445 PolarHBondContact CD2-O 3.3Å; Y421-A445 HydrophobicContact CD2-CB 3.78Å; Y421-A445 HydrophobicContact CE2-CB 4.38Å; Y421-A445 HydrophobicContact CG-CB 3.95Å; R441-A445 HydrophobicContact CG-CB 4.07Å; P442-A445 HydrophobicContact CB-CB 4.27Å; P442-A445 WeakPolarHBondContact O-CB 3.25Å; P442-A445 PolarHBondContact O-N 3.33Å
446	Y	97.4	Very high	94	Very high	41 Å²	41	48.8 Å²	48.8	16%	0.161	30%	0.301	C	S	.	.			trans	-130.9	99.3	177.8	-176.9	-108.9	0	0	0	110.8	K375 R379 F422 F433 Y444 P448	K375-Y446 WeakPolarHBondContact CA-OH 3.49Å; K375-Y446 WeakPolarHBondContact CB-OH 3.48Å; K375-Y446 HydrophobicContact CG-CE1 4.4Å; K375-Y446 PolarHBondContact O-OH 3.49Å; R379-Y446 HydrophobicContact CB-CD2 4.35Å; R379-Y446 HydrophobicContact CB-CE2 3.82Å; R379-Y446 HydrophobicContact CG-CD2 4.35Å; R379-Y446 HydrophobicContact CG-CE2 4.32Å; F422-Y446 HydrophobicContact CZ-CD2 4.32Å; F433-Y446 AromaticContact CE1-CD1 3.83Å; F433-Y446 HydrophobicContact CE1-CD1 3.83Å; F433-Y446 AromaticContact CE1-CD2 3.98Å; F433-Y446 HydrophobicContact CE1-CD2 3.98Å; F433-Y446 AromaticContact CE1-CE1 3.74Å; F433-Y446 HydrophobicContact CE1-CE1 3.74Å; F433-Y446 AromaticContact CE1-CE2 3.9Å; F433-Y446 HydrophobicContact CE1-CE2 3.9Å; F433-Y446 AromaticContact CE1-CG 3.93Å; F433-Y446 HydrophobicContact CE1-CG 3.93Å; F433-Y446 AromaticContact CE1-CZ 3.76Å; F433-Y446 HydrophobicContact CZ-CD1 4.43Å; F433-Y446 AromaticContact CZ-CD2 3.79Å; F433-Y446 HydrophobicContact CZ-CD2 3.79Å; F433-Y446 HydrophobicContact CZ-CE1 4.19Å; F433-Y446 AromaticContact CZ-CE2 3.52Å; F433-Y446 HydrophobicContact CZ-CE2 3.52Å; F433-Y446 HydrophobicContact CZ-CG 4.24Å; F433-Y446 AromaticContact CZ-CZ 3.72Å; Y444-Y446 VanDerWaalsContact C-N 3.34Å; Y446-P448 VanDerWaalsContact C-CD 3.5Å; Y446-P448 HydrophobicContact CD1-CG 4.31Å; Y446-P448 HydrophobicContact CE1-CG 3.67Å; Y446-P448 HydrophobicContact CE2-CG 3.95Å; Y446-P448 VanDerWaalsContact CZ-CG 3.46Å
447	V	97	Very high	94	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.024	28%	0.276	C	S	.	.			trans	-133	51.3	-173.4	-64.3	0	0	0	0	113.8	T412 L415 H416 Y444 F449 S450 A451	T412-V447 HydrophobicContact CG2-CG2 4.19Å; L415-V447 HydrophobicContact CD2-CG2 3.5Å; L415-V447 VanDerWaalsContact CD2-CG2 3.5Å; H416-V447 PolarHBondContact NE2-N 3.48Å; Y444-V447 HydrophobicContact CD1-CG1 4.39Å; V447-F449 PolarHBondContact O-N 2.83Å; V447-S450 PolarHBondContact O-N 3.41Å; V447-A451 HydrophobicContact CG1-CB 3.75Å
448	P	95.3	Very high	94.1	Very high	20 Å²	20	39.3 Å²	39.3	13%	0.13	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-28.3	178.1	30.8	-39.8	0	0	0	112.5	L378 Y446	L378-P448 HydrophobicContact CB-CB 3.95Å; L378-P448 HydrophobicContact CB-CG 4.42Å; L378-P448 HydrophobicContact CD1-CB 4.39Å; Y446-P448 VanDerWaalsContact C-CD 3.5Å; Y446-P448 HydrophobicContact CD1-CG 4.31Å; Y446-P448 HydrophobicContact CE1-CG 3.67Å; Y446-P448 HydrophobicContact CE2-CG 3.95Å; Y446-P448 VanDerWaalsContact CZ-CG 3.46Å
449	F	96.4	Very high	94.3	Very high	31 Å²	31	41.1 Å²	41.1	14%	0.136	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	20.4	175.9	-65.3	-74.3	0	0	0	112.6	L378 V447 C456 Q459 A462 L463	L378-F449 HydrophobicContact CD1-CE2 3.76Å; L378-F449 HydrophobicContact CD1-CZ 3.78Å; V447-F449 PolarHBondContact O-N 2.83Å; F449-C456 HydrophobicContact CB-CB 3.82Å; F449-C456 HydrophobicContact CD1-CB 3.89Å; F449-C456 HydrophobicContact CG-CB 4.33Å; F449-C456 WeakPolarHBondContact O-CB 3.45Å; F449-C456 PolarHBondContact O-N 3.41Å; F449-Q459 HydrophobicContact CB-CB 4.34Å; F449-Q459 HydrophobicContact CB-CG 4.19Å; F449-Q459 HydrophobicContact CD1-CB 3.96Å; F449-Q459 HydrophobicContact CD1-CG 3.96Å; F449-Q459 HydrophobicContact CD2-CB 4.48Å; F449-Q459 HydrophobicContact CD2-CG 3.63Å; F449-Q459 HydrophobicContact CE1-CB 4.41Å; F449-Q459 HydrophobicContact CE1-CG 4.25Å; F449-Q459 HydrophobicContact CE2-CG 3.95Å; F449-Q459 HydrophobicContact CG-CB 4Å; F449-Q459 HydrophobicContact CG-CG 3.64Å; F449-Q459 HydrophobicContact CZ-CG 4.25Å; F449-A462 HydrophobicContact CE1-CB 4.06Å; F449-A462 HydrophobicContact CZ-CB 4.42Å; F449-L463 HydrophobicContact CE2-CD2 4.36Å; F449-L463 HydrophobicContact CE2-CG 4.46Å; F449-L463 HydrophobicContact CZ-CD2 4.36Å; F449-L463 HydrophobicContact CZ-CG 4.37Å
450	S	95.6	Very high	94.4	Very high	23 Å²	23	45 Å²	45	16%	0.161	26%	0.261	C	S	.	.			trans	56	-174.8	-164.8	179.1	0	0	0	0	111.2	V447 R454	V447-S450 PolarHBondContact O-N 3.41Å; S450-R454 PolarHBondContact OG-O 2.94Å
451	A	94.1	Very high	94.7	Very high	18 Å²	18	41.4 Å²	41.4	15%	0.149	22%	0.221	C	C	.	.			trans	-142.1	175.7	175.9	0	0	0	0	0	111.4	L105 Y444 V447	L105-A451 HydrophobicContact CD1-CB 4.18Å; Y444-A451 HydrophobicContact CD1-CB 3.65Å; Y444-A451 HydrophobicContact CE1-CB 3.38Å; V447-A451 HydrophobicContact CG1-CB 3.75Å
452	G	92.9	Very high	94.7	Very high	31 Å²	31	39.3 Å²	39.3	32%	0.32	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	69	-158	-179.6	0	0	0	0	0	113.8	L105 R454 N455	L105-G452 WeakPolarHBondContact O-CA 3.48Å; G452-R454 PolarHBondContact O-N 3.46Å; G452-R454 VanDerWaalsContact O-N 3.14Å; G452-N455 WeakPolarHBondContact O-CB 3.26Å; G452-N455 PolarHBondContact O-N 3.39Å; G452-N455 VanDerWaalsContact O-N 3.16Å; G452-N455 PolarHBondContact O-OD1 3.36Å
453	L	91.4	Very high	94.8	Very high	88 Å²	88	38.9 Å²	38.9	46%	0.461	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-59.8	-27.5	-175.8	-70.2	-179	0	0	0	113.5	P108 L111 W136	P108-L453 HydrophobicContact CB-CD1 3.59Å; L111-L453 HydrophobicContact CD2-CB 3.77Å; L111-L453 HydrophobicContact CD2-CD1 3.97Å; W136-L453 HydrophobicContact CH2-CB 3.89Å; W136-L453 WeakPolarHBondContact CH2-O 3.46Å; W136-L453 WeakPolarHBondContact CZ2-O 3.5Å; W136-L453 HydrophobicContact CZ3-CB 4.38Å
454	R	93.3	Very high	95	Very high	20 Å²	20	34.8 Å²	34.8	8%	0.075	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-106	32.1	-178.1	-62.3	-72.5	-68.9	-117.3	22.1	112	L111 L128 L129 S131 W136 R389 S450 G452	L111-R454 HydrophobicContact CD2-CG 3.6Å; L111-R454 PolarHBondContact O-NH1 2.73Å; L128-R454 PolarHBondContact O-NH2 3.29Å; L129-R454 PolarHBondContact O-NH2 2.98Å; S131-R454 PolarHBondContact O-NH1 2.93Å; S131-R454 PolarHBondContact O-NH2 3.38Å; W136-R454 VanDerWaalsContact CD1-CZ 3.43Å; W136-R454 HydrophobicContact CZ2-CG 4.22Å; W136-R454 VanDerWaalsContact NE1-CD 3.33Å; R389-R454 VanDerWaalsContact NH1-CB 3.28Å; R389-R454 VanDerWaalsContact NH1-CG 3.31Å; R389-R454 PolarHBondContact NH2-O 3.24Å; S450-R454 PolarHBondContact OG-O 2.94Å; G452-R454 PolarHBondContact O-N 3.46Å; G452-R454 VanDerWaalsContact O-N 3.14Å
455	N	95.1	Very high	95	Very high	51 Å²	51	33.1 Å²	33.1	27%	0.273	18%	0.176	S	C	.	.	S	Bend	trans	-68.7	163.3	168.6	72.1	-17.2	0	0	0	111.5	R140 G452 I457	R140-N455 PolarHBondContact NH1-O 2.74Å; R140-N455 PolarHBondContact NH2-OD1 3.26Å; G452-N455 WeakPolarHBondContact O-CB 3.26Å; G452-N455 PolarHBondContact O-N 3.39Å; G452-N455 VanDerWaalsContact O-N 3.16Å; G452-N455 PolarHBondContact O-OD1 3.36Å; N455-I457 PolarHBondContact O-N 3.22Å
456	C	95.9	Very high	95.1	Very high	48 Å²	48	33.2 Å²	33.2	32%	0.324	18%	0.176	S	C	.	.			trans	-59.9	125	177	-175.7	0	0	0	0	110.4	F449 G458 Q459	F449-C456 HydrophobicContact CB-CB 3.82Å; F449-C456 HydrophobicContact CD1-CB 3.89Å; F449-C456 HydrophobicContact CG-CB 4.33Å; F449-C456 WeakPolarHBondContact O-CB 3.45Å; F449-C456 PolarHBondContact O-N 3.41Å; C456-G458 VanDerWaalsContact C-N 3.34Å; C456-G458 PolarHBondContact SG-N 3Å; C456-G458 VanDerWaalsContact SG-N 3.41Å; C456-Q459 HydrophobicContact CB-CB 4.37Å
457	I	94.4	Very high	95.1	Very high	19 Å²	19	31.8 Å²	31.8	10%	0.097	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-32.8	175.1	-161.5	175.7	0	0	0	111.3	L128 L143 F147 F315 N455 Q459	L128-I457 HydrophobicContact CD2-CB 4.19Å; L128-I457 HydrophobicContact CD2-CD1 3.81Å; L128-I457 HydrophobicContact CD2-CG2 3.79Å; L143-I457 HydrophobicContact CB-CD1 3.73Å; F147-I457 HydrophobicContact CD2-CD1 3.71Å; F147-I457 HydrophobicContact CD2-CG1 3.6Å; F147-I457 HydrophobicContact CD2-CG2 4.42Å; F147-I457 HydrophobicContact CE2-CD1 3.84Å; F147-I457 HydrophobicContact CE2-CG1 3.99Å; F147-I457 HydrophobicContact CE2-CG2 4.05Å; F147-I457 HydrophobicContact CG-CG1 4.24Å; F147-I457 HydrophobicContact CZ-CG2 4.34Å; F315-I457 HydrophobicContact CE1-CG2 3.68Å; F315-I457 HydrophobicContact CZ-CG2 3.9Å; N455-I457 PolarHBondContact O-N 3.22Å; I457-Q459 VanDerWaalsContact C-N 3.34Å; I457-Q459 PolarHBondContact O-N 3.09Å
458	G	93.7	Very high	95.2	Very high	14 Å²	14	31.6 Å²	31.6	14%	0.144	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	5.8	-177.8	0	0	0	0	0	115	C456 R460 F461 A462	C456-G458 VanDerWaalsContact C-N 3.34Å; C456-G458 PolarHBondContact SG-N 3Å; C456-G458 VanDerWaalsContact SG-N 3.41Å; G458-R460 PolarHBondContact O-N 2.79Å; G458-R460 VanDerWaalsContact O-N 3.12Å; G458-F461 WeakPolarHBondContact O-CA 3.27Å; G458-F461 WeakPolarHBondContact O-CB 3.5Å; G458-F461 PolarHBondContact O-N 2.73Å; G458-A462 PolarHBondContact O-N 3.09Å
459	Q	94.6	Very high	95.3	Very high	72 Å²	72	30.7 Å²	30.7	34%	0.336	16%	0.164	S	C	.	.	H	α-helix	trans	-52.2	-41.6	-175.1	176.5	178.2	7.9	0	0	113.2	F449 C456 I457 L463	F449-Q459 HydrophobicContact CB-CB 4.34Å; F449-Q459 HydrophobicContact CB-CG 4.19Å; F449-Q459 HydrophobicContact CD1-CB 3.96Å; F449-Q459 HydrophobicContact CD1-CG 3.96Å; F449-Q459 HydrophobicContact CD2-CB 4.48Å; F449-Q459 HydrophobicContact CD2-CG 3.63Å; F449-Q459 HydrophobicContact CE1-CB 4.41Å; F449-Q459 HydrophobicContact CE1-CG 4.25Å; F449-Q459 HydrophobicContact CE2-CG 3.95Å; F449-Q459 HydrophobicContact CG-CB 4Å; F449-Q459 HydrophobicContact CG-CG 3.64Å; F449-Q459 HydrophobicContact CZ-CG 4.25Å; C456-Q459 HydrophobicContact CB-CB 4.37Å; I457-Q459 VanDerWaalsContact C-N 3.34Å; I457-Q459 PolarHBondContact O-N 3.09Å; Q459-L463 HydrophobicContact CG-CD1 4.23Å; Q459-L463 WeakPolarHBondContact O-CG 3.49Å; Q459-L463 PolarHBondContact O-N 2.98Å; Q459-L463 VanDerWaalsContact O-N 3.09Å
460	R	93.2	Very high	95.4	Very high	159 Å²	159	29.2 Å²	29.2	60%	0.6	16%	0.157	S	C	*	.	H	α-helix	trans	-72	-34.6	179.2	-68.9	-177.7	175.5	-179.1	-2.3	112.7	L152 G458 M464	L152-R460 HydrophobicContact CD1-CB 3.75Å; G458-R460 PolarHBondContact O-N 2.79Å; G458-R460 VanDerWaalsContact O-N 3.12Å; R460-M464 VanDerWaalsContact O-CB 3.32Å; R460-M464 WeakPolarHBondContact O-CB 3.43Å; R460-M464 PolarHBondContact O-N 2.67Å; R460-M464 VanDerWaalsContact O-N 3.16Å
461	F	94.1	Very high	95.5	Very high	10 Å²	10	28.1 Å²	28.1	4%	0.044	15%	0.15	C	C	.	.	H	α-helix	trans	-65.3	-50.9	174.4	178.7	-83.3	0	0	0	110	F147 L152 F155 M159 I192 I193 T196 G458 L463 M464 E465	F147-F461 HydrophobicContact CD1-CB 4.29Å; F147-F461 HydrophobicContact CE1-CB 4.45Å; L152-F461 HydrophobicContact CD2-CB 4.09Å; L152-F461 HydrophobicContact CD2-CD2 4.02Å; F155-F461 HydrophobicContact CB-CE2 4.17Å; F155-F461 AromaticContact CD2-CD2 3.75Å; F155-F461 HydrophobicContact CD2-CD2 3.75Å; F155-F461 AromaticContact CD2-CE2 3.72Å; F155-F461 HydrophobicContact CD2-CE2 3.72Å; F155-F461 HydrophobicContact CE2-CD2 4.36Å; F155-F461 HydrophobicContact CE2-CE2 4.4Å; F155-F461 HydrophobicContact CG-CE2 4.14Å; M159-F461 HydrophobicContact CE-CD1 4.2Å; M159-F461 HydrophobicContact CE-CD2 3.61Å; M159-F461 HydrophobicContact CE-CE1 3.97Å; M159-F461 HydrophobicContact CE-CE2 3.35Å; M159-F461 HydrophobicContact CE-CG 4.03Å; M159-F461 HydrophobicContact CE-CZ 3.54Å; I192-F461 HydrophobicContact CG2-CE1 4.45Å; I192-F461 HydrophobicContact CG2-CZ 3.94Å; I193-F461 HydrophobicContact CD1-CE1 4.17Å; I193-F461 HydrophobicContact CD1-CZ 4.15Å; T196-F461 HydrophobicContact CG2-CE2 4.11Å; T196-F461 HydrophobicContact CG2-CZ 4.28Å; T196-F461 WeakPolarHBondContact OG1-CZ 3.15Å; G458-F461 WeakPolarHBondContact O-CA 3.27Å; G458-F461 WeakPolarHBondContact O-CB 3.5Å; G458-F461 PolarHBondContact O-N 2.73Å; F461-L463 PolarHBondContact O-N 3.41Å; F461-M464 WeakPolarHBondContact O-CB 3.44Å; F461-M464 PolarHBondContact O-N 3.23Å; F461-M464 VanDerWaalsContact O-N 3.1Å; F461-E465 VanDerWaalsContact CE1-OE2 3.26Å; F461-E465 WeakPolarHBondContact CE1-OE2 3.4Å; F461-E465 WeakPolarHBondContact O-CB 3.33Å; F461-E465 PolarHBondContact O-N 3.47Å
462	A	95.6	Very high	95.6	Very high	6 Å²	6	27.9 Å²	27.9	5%	0.05	15%	0.147	C	C	.	.	H	α-helix	trans	-55.8	-52	178.3	0	0	0	0	0	112.1	T323 F449 G458 M464 E465 E466	T323-A462 HydrophobicContact CG2-CB 3.59Å; F449-A462 HydrophobicContact CE1-CB 4.06Å; F449-A462 HydrophobicContact CZ-CB 4.42Å; G458-A462 PolarHBondContact O-N 3.09Å; A462-M464 VanDerWaalsContact C-N 3.25Å; A462-M464 PolarHBondContact O-N 3.41Å; A462-E465 PolarHBondContact O-N 3.22Å; A462-E466 WeakPolarHBondContact O-CB 2.96Å; A462-E466 WeakPolarHBondContact O-CG 3.18Å; A462-E466 PolarHBondContact O-N 3.22Å
463	L	96.1	Very high	95.8	Very high	24 Å²	24	26.6 Å²	26.6	13%	0.126	13%	0.133	C	C	.	.	H	α-helix	trans	-63.4	-30.8	178.4	-70.1	174.4	0	0	0	113.2	I374 F449 Q459 F461 K467	I374-L463 HydrophobicContact CG2-CD2 3.77Å; F449-L463 HydrophobicContact CE2-CD2 4.36Å; F449-L463 HydrophobicContact CE2-CG 4.46Å; F449-L463 HydrophobicContact CZ-CD2 4.36Å; F449-L463 HydrophobicContact CZ-CG 4.37Å; Q459-L463 HydrophobicContact CG-CD1 4.23Å; Q459-L463 WeakPolarHBondContact O-CG 3.49Å; Q459-L463 PolarHBondContact O-N 2.98Å; Q459-L463 VanDerWaalsContact O-N 3.09Å; F461-L463 PolarHBondContact O-N 3.41Å; L463-K467 WeakPolarHBondContact O-CB 3.41Å; L463-K467 WeakPolarHBondContact O-CG 3.49Å; L463-K467 PolarHBondContact O-N 2.82Å
464	M	95.9	Very high	96	Very high	16 Å²	16	22.4 Å²	22.4	8%	0.079	11%	0.111	C	C	.	.	H	α-helix	trans	-69.8	-49.4	174.8	179.7	176.4	-65.8	0	0	110.7	L152 L156 M159 L364 R460 F461 A462 K467 V468	L152-M464 HydrophobicContact CB-CE 3.75Å; L152-M464 HydrophobicContact CB-SD 4.09Å; L152-M464 HydrophobicContact CD1-CE 4.33Å; L156-M464 HydrophobicContact CB-SD 4.22Å; L156-M464 HydrophobicContact CD1-CG 4.32Å; L156-M464 HydrophobicContact CD1-SD 4.37Å; M159-M464 HydrophobicContact CE-CB 4.5Å; M159-M464 HydrophobicContact CE-CG 4.34Å; M159-M464 HydrophobicContact CE-SD 4.46Å; M159-M464 HydrophobicContact SD-CB 4.31Å; M159-M464 HydrophobicContact SD-CG 3.69Å; M159-M464 HydrophobicContact SD-SD 4.1Å; L364-M464 HydrophobicContact CD1-CE 4.19Å; L364-M464 HydrophobicContact CD1-CG 3.67Å; L364-M464 HydrophobicContact CD1-SD 4.34Å; R460-M464 VanDerWaalsContact O-CB 3.32Å; R460-M464 WeakPolarHBondContact O-CB 3.43Å; R460-M464 PolarHBondContact O-N 2.67Å; R460-M464 VanDerWaalsContact O-N 3.16Å; F461-M464 WeakPolarHBondContact O-CB 3.44Å; F461-M464 PolarHBondContact O-N 3.23Å; F461-M464 VanDerWaalsContact O-N 3.1Å; A462-M464 VanDerWaalsContact C-N 3.25Å; A462-M464 PolarHBondContact O-N 3.41Å; M464-K467 PolarHBondContact O-N 2.83Å; M464-V468 VanDerWaalsContact O-CG2 3.25Å; M464-V468 WeakPolarHBondContact O-CG2 3.46Å; M464-V468 PolarHBondContact O-N 2.88Å
465	E	97.1	Very high	96.1	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-58.1	-53.1	177.3	-175.3	-174.8	169.2	0	0	111.5	M159 A189 I192 T323 F461 A462 K467 V468 V469	M159-E465 HydrophobicContact CE-CB 3.88Å; M159-E465 HydrophobicContact SD-CB 4.06Å; A189-E465 WeakPolarHBondContact CA-OE1 3.15Å; A189-E465 WeakPolarHBondContact CB-OE1 3.42Å; I192-E465 HydrophobicContact CD1-CG 3.91Å; I192-E465 HydrophobicContact CG2-CG 4.26Å; T323-E465 PolarHBondContact OG1-OE1 3.12Å; T323-E465 PolarHBondContact OG1-OE2 3.23Å; F461-E465 VanDerWaalsContact CE1-OE2 3.26Å; F461-E465 WeakPolarHBondContact CE1-OE2 3.4Å; F461-E465 WeakPolarHBondContact O-CB 3.33Å; F461-E465 PolarHBondContact O-N 3.47Å; A462-E465 PolarHBondContact O-N 3.22Å; E465-K467 VanDerWaalsContact C-N 3.3Å; E465-K467 PolarHBondContact O-N 2.69Å; E465-V468 PolarHBondContact O-N 2.81Å; E465-V469 HydrophobicContact CG-CG2 4.39Å; E465-V469 WeakPolarHBondContact O-CG2 3.4Å; E465-V469 PolarHBondContact O-N 2.98Å
466	E	97.9	Very high	96	Very high	3 Å²	3	25.3 Å²	25.3	1%	0.014	12%	0.124	C	C	.	.	H	α-helix	trans	-57.6	-43.3	-179.5	-70.2	172.9	-148.5	0	0	111	S326 M327 I374 A462 L470	S326-E466 VanDerWaalsContact CB-CD 3.49Å; S326-E466 WeakPolarHBondContact CB-OE1 3.43Å; S326-E466 PolarHBondContact OG-OE1 2.87Å; S326-E466 PolarHBondContact OG-OE2 3.47Å; M327-E466 HydrophobicContact CG-CB 4.17Å; M327-E466 HydrophobicContact CG-CG 3.75Å; M327-E466 HydrophobicContact SD-CG 4.5Å; I374-E466 HydrophobicContact CD1-CB 3.89Å; I374-E466 HydrophobicContact CG1-CB 4.47Å; I374-E466 WeakPolarHBondContact CG2-OE2 3.46Å; A462-E466 WeakPolarHBondContact O-CB 2.96Å; A462-E466 WeakPolarHBondContact O-CG 3.18Å; A462-E466 PolarHBondContact O-N 3.22Å; E466-L470 WeakPolarHBondContact O-CB 3.32Å; E466-L470 WeakPolarHBondContact O-CD1 3.22Å; E466-L470 WeakPolarHBondContact O-CG 3.46Å; E466-L470 PolarHBondContact O-N 3.43Å
467	K	98.1	Very high	95.9	Very high	11 Å²	11	23.2 Å²	23.2	5%	0.048	11%	0.109	C	C	.	.	H	α-helix	trans	-63.5	-44.7	174.9	-77.6	-177.4	-172.6	-155.1	0	112.4	L364 L367 L370 E371 I374 L463 M464 E465 A471	L364-K467 HydrophobicContact CD2-CB 3.72Å; L364-K467 HydrophobicContact CD2-CD 4.17Å; L364-K467 PolarHBondContact O-NZ 3.4Å; L367-K467 HydrophobicContact CB-CD 4.38Å; L367-K467 PolarHBondContact O-NZ 3.46Å; L370-K467 HydrophobicContact CD2-CB 4.33Å; L370-K467 HydrophobicContact CD2-CG 4.28Å; L370-K467 HydrophobicContact CG-CG 4.5Å; E371-K467 VanDerWaalsContact OE2-CE 3.31Å; E371-K467 WeakPolarHBondContact OE2-CE 3.22Å; E371-K467 IonicContact OE2-NZ 3.75Å; E371-K467 PolarHBondContact OE2-NZ 3.25Å; I374-K467 HydrophobicContact CD1-CG 3.77Å; L463-K467 WeakPolarHBondContact O-CB 3.41Å; L463-K467 WeakPolarHBondContact O-CG 3.49Å; L463-K467 PolarHBondContact O-N 2.82Å; M464-K467 PolarHBondContact O-N 2.83Å; E465-K467 VanDerWaalsContact C-N 3.3Å; E465-K467 PolarHBondContact O-N 2.69Å; K467-A471 WeakPolarHBondContact O-CB 3.22Å; K467-A471 PolarHBondContact O-N 3.31Å
468	V	98.1	Very high	95.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.3	-51.1	-178.2	170.1	0	0	0	0	110.5	L156 M159 A163 I359 L364 M464 E465 S472	L156-V468 HydrophobicContact CD1-CG2 3.41Å; L156-V468 VanDerWaalsContact CD1-CG2 3.41Å; M159-V468 HydrophobicContact CB-CB 4.27Å; M159-V468 HydrophobicContact CB-CG1 3.92Å; M159-V468 HydrophobicContact CB-CG2 4.4Å; A163-V468 HydrophobicContact CB-CG1 4.24Å; I359-V468 HydrophobicContact CD1-CB 4.47Å; I359-V468 HydrophobicContact CD1-CG1 4.36Å; I359-V468 HydrophobicContact CG2-CG2 4.43Å; L364-V468 HydrophobicContact CD2-CG2 4.03Å; M464-V468 VanDerWaalsContact O-CG2 3.25Å; M464-V468 WeakPolarHBondContact O-CG2 3.46Å; M464-V468 PolarHBondContact O-N 2.88Å; E465-V468 PolarHBondContact O-N 2.81Å; V468-S472 VanDerWaalsContact O-CB 3.29Å; V468-S472 WeakPolarHBondContact O-CB 3.12Å; V468-S472 PolarHBondContact O-N 2.92Å; V468-S472 PolarHBondContact O-OG 3.36Å
469	V	98.3	Very high	95.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-67.3	-49	-176.7	176.1	0	0	0	0	110.9	A163 L166 I192 M327 E465 A471 S472 I473	A163-V469 HydrophobicContact CB-CG2 4.27Å; L166-V469 HydrophobicContact CD2-CG1 3.81Å; I192-V469 HydrophobicContact CD1-CG2 4.01Å; M327-V469 HydrophobicContact SD-CB 3.45Å; M327-V469 WeakPolarHBondContact SD-CB 3.29Å; M327-V469 HydrophobicContact SD-CG1 3.51Å; M327-V469 VanDerWaalsContact SD-CG1 3.51Å; M327-V469 HydrophobicContact SD-CG2 3.87Å; E465-V469 HydrophobicContact CG-CG2 4.39Å; E465-V469 WeakPolarHBondContact O-CG2 3.4Å; E465-V469 PolarHBondContact O-N 2.98Å; V469-A471 PolarHBondContact O-N 3.28Å; V469-S472 PolarHBondContact O-N 2.8Å; V469-I473 HydrophobicContact CG1-CD1 3.98Å; V469-I473 WeakPolarHBondContact O-CG1 3.31Å; V469-I473 PolarHBondContact O-N 2.88Å
470	L	98.2	Very high	95.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.5	-42.9	179.5	-67.1	172	0	0	0	112	M327 A330 L331 L370 I374 E466 S472 I473 L474	M327-L470 HydrophobicContact CB-CD2 4.32Å; M327-L470 HydrophobicContact CG-CG 4.39Å; A330-L470 HydrophobicContact CB-CD1 3.81Å; A330-L470 HydrophobicContact CB-CD2 4.23Å; L331-L470 HydrophobicContact CD1-CD2 4.37Å; L331-L470 HydrophobicContact CD2-CD2 3.68Å; L331-L470 HydrophobicContact CG-CD2 3.61Å; L370-L470 HydrophobicContact CD1-CB 4.11Å; L370-L470 HydrophobicContact CD1-CD1 4.27Å; I374-L470 HydrophobicContact CD1-CD1 4.02Å; I374-L470 HydrophobicContact CG1-CD1 3.69Å; E466-L470 WeakPolarHBondContact O-CB 3.32Å; E466-L470 WeakPolarHBondContact O-CD1 3.22Å; E466-L470 WeakPolarHBondContact O-CG 3.46Å; E466-L470 PolarHBondContact O-N 3.43Å; L470-S472 VanDerWaalsContact C-N 3.29Å; L470-S472 PolarHBondContact O-N 3.41Å; L470-I473 PolarHBondContact O-N 3.06Å; L470-L474 WeakPolarHBondContact O-CB 3.42Å; L470-L474 VanDerWaalsContact O-CG 3.25Å; L470-L474 WeakPolarHBondContact O-CG 3.11Å; L470-L474 PolarHBondContact O-N 2.77Å
471	A	97.9	Very high	94.9	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-62.4	-38.5	175.3	0	0	0	0	0	111.8	L348 I359 L367 L370 K467 V469 R475	L348-A471 HydrophobicContact CD2-CB 3.55Å; I359-A471 HydrophobicContact CD1-CB 3.69Å; L367-A471 HydrophobicContact CD1-CB 4.15Å; L370-A471 HydrophobicContact CD2-CB 4.06Å; K467-A471 WeakPolarHBondContact O-CB 3.22Å; K467-A471 PolarHBondContact O-N 3.31Å; V469-A471 PolarHBondContact O-N 3.28Å; A471-R475 VanDerWaalsContact O-CB 3.31Å; A471-R475 WeakPolarHBondContact O-CB 3.27Å; A471-R475 WeakPolarHBondContact O-CD 3.45Å; A471-R475 WeakPolarHBondContact O-CG 3.49Å; A471-R475 PolarHBondContact O-N 3Å
472	S	97	Very high	94	Very high	14 Å²	14	22.4 Å²	22.4	10%	0.098	12%	0.119	C	C	.	.	H	α-helix	trans	-66.3	-40.9	178.4	-59.1	0	0	0	0	111.5	V468 V469 L470 N476	V468-S472 VanDerWaalsContact O-CB 3.29Å; V468-S472 WeakPolarHBondContact O-CB 3.12Å; V468-S472 PolarHBondContact O-N 2.92Å; V468-S472 PolarHBondContact O-OG 3.36Å; V469-S472 PolarHBondContact O-N 2.8Å; L470-S472 VanDerWaalsContact C-N 3.29Å; L470-S472 PolarHBondContact O-N 3.41Å; S472-N476 PolarHBondContact O-ND2 2.94Å
473	I	96	Very high	92.8	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.015	13%	0.129	C	C	.	.	H	α-helix	trans	-65.1	-52.2	174.9	-65.5	168.6	0	0	0	110.5	L166 L170 L331 V469 L470 R475 N476 F477 V479	L166-I473 HydrophobicContact CD2-CD1 4.02Å; L166-I473 HydrophobicContact CD2-CG1 4.44Å; L170-I473 HydrophobicContact CD1-CD1 4.25Å; L170-I473 HydrophobicContact CD1-CG1 4.03Å; L331-I473 HydrophobicContact CD1-CD1 3.91Å; L331-I473 HydrophobicContact CD2-CD1 4.18Å; L331-I473 HydrophobicContact CD2-CG2 3.97Å; V469-I473 HydrophobicContact CG1-CD1 3.98Å; V469-I473 WeakPolarHBondContact O-CG1 3.31Å; V469-I473 PolarHBondContact O-N 2.88Å; L470-I473 PolarHBondContact O-N 3.06Å; I473-R475 VanDerWaalsContact C-N 3.28Å; I473-R475 PolarHBondContact O-N 3.06Å; I473-N476 PolarHBondContact O-N 3.3Å; I473-F477 HydrophobicContact CG2-CD2 4.17Å; I473-F477 WeakPolarHBondContact O-CD2 3.49Å; I473-F477 PolarHBondContact O-N 2.77Å; I473-V479 HydrophobicContact CG2-CG2 4.15Å
474	L	96.2	Very high	91.5	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-72.2	-18.3	-172.4	-65.4	169.2	0	0	0	114.3	L334 Q341 V344 L348 L470 N476 V479	L334-L474 HydrophobicContact CD1-CD1 3.72Å; L334-L474 HydrophobicContact CD1-CD2 4.32Å; Q341-L474 HydrophobicContact CG-CD2 3.99Å; V344-L474 HydrophobicContact CB-CD1 4.39Å; V344-L474 HydrophobicContact CG1-CD1 3.55Å; L348-L474 HydrophobicContact CD1-CB 3.66Å; L470-L474 WeakPolarHBondContact O-CB 3.42Å; L470-L474 VanDerWaalsContact O-CG 3.25Å; L470-L474 WeakPolarHBondContact O-CG 3.11Å; L470-L474 PolarHBondContact O-N 2.77Å; L474-N476 VanDerWaalsContact C-N 3.32Å; L474-V479 HydrophobicContact CD2-CG2 4.33Å
475	R	94.6	Very high	90.1	Very high	54 Å²	54	32.8 Å²	32.8	20%	0.204	16%	0.161	C	C	.	.	H	α-helix	trans	-73.6	-23.4	169.3	-77.8	168.7	69.8	-163.6	2.8	112.9	L348 S355 R357 A471 I473 A508	L348-R475 HydrophobicContact CB-CG 4.24Å; L348-R475 HydrophobicContact CD1-CG 4.23Å; S355-R475 PolarHBondContact O-NH2 3.46Å; R357-R475 PolarHBondContact O-NH1 3.5Å; R357-R475 PolarHBondContact O-NH2 2.96Å; A471-R475 VanDerWaalsContact O-CB 3.31Å; A471-R475 WeakPolarHBondContact O-CB 3.27Å; A471-R475 WeakPolarHBondContact O-CD 3.45Å; A471-R475 WeakPolarHBondContact O-CG 3.49Å; A471-R475 PolarHBondContact O-N 3Å; I473-R475 VanDerWaalsContact C-N 3.28Å; I473-R475 PolarHBondContact O-N 3.06Å; R475-A508 VanDerWaalsContact O-CB 3.27Å; R475-A508 WeakPolarHBondContact O-CB 3.02Å
476	N	93.3	Very high	88.6	Confident	77 Å²	77	40 Å²	40	41%	0.412	20%	0.199	S	C	.	.	H	α-helix	trans	-110.3	-23	-173.8	-70.1	-76.6	0	0	0	113	V167 S472 I473 L474	V167-N476 HydrophobicContact CG1-CB 4.06Å; S472-N476 PolarHBondContact O-ND2 2.94Å; I473-N476 PolarHBondContact O-N 3.3Å; L474-N476 VanDerWaalsContact C-N 3.32Å
477	F	92.8	Very high	86.8	Confident	4 Å²	4	45.5 Å²	45.5	2%	0.018	23%	0.225	C	C	.	.			trans	-139	153	-171.4	-51.6	-72.7	0	0	0	113.2	V167 L170 E171 A174 I473 V504 P506	V167-F477 HydrophobicContact CB-CE2 4.39Å; V167-F477 HydrophobicContact CG1-CE2 3.92Å; V167-F477 HydrophobicContact CG1-CZ 4.13Å; V167-F477 HydrophobicContact CG2-CE2 4.36Å; L170-F477 HydrophobicContact CB-CE2 3.84Å; L170-F477 HydrophobicContact CB-CZ 3.91Å; L170-F477 HydrophobicContact CD1-CE2 4.37Å; E171-F477 HydrophobicContact CB-CE1 4.22Å; E171-F477 HydrophobicContact CB-CZ 3.97Å; A174-F477 HydrophobicContact CB-CD1 4.26Å; A174-F477 HydrophobicContact CB-CE1 4.02Å; I473-F477 HydrophobicContact CG2-CD2 4.17Å; I473-F477 WeakPolarHBondContact O-CD2 3.49Å; I473-F477 PolarHBondContact O-N 2.77Å; F477-V504 HydrophobicContact CB-CG1 3.41Å; F477-V504 VanDerWaalsContact CB-CG1 3.41Å; F477-V504 HydrophobicContact CD1-CG1 3.54Å; F477-V504 HydrophobicContact CD2-CG1 4.02Å; F477-V504 HydrophobicContact CE1-CG1 4.33Å; F477-V504 HydrophobicContact CG-CG1 3.36Å; F477-P506 HydrophobicContact CD1-CB 4.38Å; F477-P506 HydrophobicContact CE1-CB 4.5Å
478	N	91.6	Very high	85.2	Confident	54 Å²	54	45.8 Å²	45.8	29%	0.289	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	132.1	157.2	-65.2	-35.8	0	0	0	108.7	Q345 T505 D507	Q345-N478 PolarHBondContact NE2-OD1 2.77Å; N478-T505 PolarHBondContact N-O 3.01Å; N478-T505 PolarHBondContact O-N 2.94Å; N478-T505 PolarHBondContact O-OG1 2.87Å; N478-D507 PolarHBondContact ND2-O 2.91Å
479	V	89.4	Confident	83.5	Confident	6 Å²	6	54.3 Å²	54.3	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	131.1	178.7	-176.8	0	0	0	0	108.5	L331 G335 Q341 I473 L474	L331-V479 HydrophobicContact CD2-CG2 4.18Å; G335-V479 WeakPolarHBondContact CA-O 3.17Å; Q341-V479 PolarHBondContact NE2-O 3.49Å; I473-V479 HydrophobicContact CG2-CG2 4.15Å; L474-V479 HydrophobicContact CD2-CG2 4.33Å
480	E	88.9	Confident	81.6	Confident	121 Å²	121	55.9 Å²	55.9	57%	0.565	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.5	173.1	-174.1	176.6	-175.4	0	0	109	T503	E480-T503 PolarHBondContact N-O 3.28Å; E480-T503 PolarHBondContact O-N 3.43Å
481	A	85	Confident	79.7	Confident	16 Å²	16	58 Å²	58	13%	0.132	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	131	176.7	0	0	0	0	0	110.6	G335 T336 Q483 L502	G335-A481 PolarHBondContact O-N 2.69Å; G335-A481 VanDerWaalsContact O-N 3.07Å; T336-A481 HydrophobicContact CG2-CB 3.48Å; T336-A481 VanDerWaalsContact CG2-CB 3.48Å; A481-Q483 VanDerWaalsContact C-N 3.28Å; A481-Q483 PolarHBondContact O-N 2.86Å; A481-L502 HydrophobicContact CB-CD2 3.86Å
482	C	76.3	Confident	77.3	Confident	60 Å²	60	58.5 Å²	58.5	41%	0.405	29%	0.286	S	S	.	.	S	Bend	trans	-81.3	-11.9	179.5	-57.1	0	0	0	0	113.3	S178 S501 T503	S178-C482 WeakPolarHBondContact CB-SG 3.39Å; C482-S501 PolarHBondContact N-O 2.9Å; C482-S501 WeakPolarHBondContact CB-O 3.3Å; C482-S501 PolarHBondContact SG-O 2.9Å; C482-T503 PolarHBondContact SG-OG1 3.44Å
483	Q	70.1	Confident	75	Confident	56 Å²	56	58.9 Å²	58.9	26%	0.262	29%	0.286	S	S	.	.	S	Bend	trans	-125.7	142.2	-174.6	-71	171.9	-53.4	0	0	109.2	H332 A481 E487 L488 T500	H332-Q483 PolarHBondContact CE1-O 3.04Å; A481-Q483 VanDerWaalsContact C-N 3.28Å; A481-Q483 PolarHBondContact O-N 2.86Å; Q483-E487 WeakPolarHBondContact CA-OE2 3.23Å; Q483-L488 HydrophobicContact CB-CD2 4.28Å; Q483-T500 VanDerWaalsContact OE1-CB 3.28Å
484	K	69.6	Low	72.7	Confident	143 Å²	143	61 Å²	61	62%	0.622	30%	0.298	S	S	*	.			trans	-78	155.3	171.4	-69	-177.5	-179.6	179.4	0	109.5	D486 E487	K484-D486 PolarHBondContact O-N 2.78Å; K484-E487 HydrophobicContact CB-CG 4.4Å; K484-E487 PolarHBondContact N-OE2 2.8Å; K484-E487 WeakPolarHBondContact O-CB 3.32Å; K484-E487 PolarHBondContact O-N 3.39Å
485	R	66.3	Low	69.9	Low	66 Å²	66	61.4 Å²	61.4	25%	0.249	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-51.3	-43	177.7	-174.7	-166.4	163	178.4	-1.9	113.3	F381 E426 E487 L488	F381-R485 HydrophobicContact CZ-CG 4.28Å; E426-R485 PolarHBondContact O-NH1 2.97Å; E426-R485 IonicContact OE2-CZ 3.2Å; E426-R485 IonicContact OE2-NH1 3.3Å; E426-R485 IonicContact OE2-NH2 2.76Å; E426-R485 PolarHBondContact OE2-NH2 2.84Å; R485-E487 PolarHBondContact O-N 3.33Å; R485-L488 VanDerWaalsContact O-CB 3.28Å; R485-L488 WeakPolarHBondContact O-CB 3.45Å; R485-L488 WeakPolarHBondContact O-CG 3.28Å; R485-L488 PolarHBondContact O-N 2.87Å
486	D	64.6	Low	67.3	Low	152 Å²	152	65.2 Å²	65.2	81%	0.813	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-67.9	-15.9	-176.2	-58.2	-29	0	0	0	113.2	K484	K484-D486 PolarHBondContact O-N 2.78Å
487	E	60.7	Low	64.7	Low	117 Å²	117	62.6 Å²	62.6	55%	0.547	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-86.9	-12.2	175.6	-59.2	167.4	174.4	0	0	111.6	Q483 K484 R485	Q483-E487 WeakPolarHBondContact CA-OE2 3.23Å; K484-E487 HydrophobicContact CB-CG 4.4Å; K484-E487 PolarHBondContact N-OE2 2.8Å; K484-E487 WeakPolarHBondContact O-CB 3.32Å; K484-E487 PolarHBondContact O-N 3.39Å; R485-E487 PolarHBondContact O-N 3.33Å
488	L	64.9	Low	62	Low	17 Å²	17	67 Å²	67	9%	0.089	32%	0.324	C	S	.	.			trans	-82.9	137.1	178.7	-53	174.8	0	0	0	110.5	W329 H332 Q483 R485 P490 T500	W329-L488 HydrophobicContact CH2-CD1 4.18Å; W329-L488 HydrophobicContact CZ3-CD1 3.65Å; H332-L488 VanDerWaalsContact NE2-CD1 3.34Å; H332-L488 WeakPolarHBondContact NE2-CD1 3.33Å; Q483-L488 HydrophobicContact CB-CD2 4.28Å; R485-L488 VanDerWaalsContact O-CB 3.28Å; R485-L488 WeakPolarHBondContact O-CB 3.45Å; R485-L488 WeakPolarHBondContact O-CG 3.28Å; R485-L488 PolarHBondContact O-N 2.87Å; L488-P490 WeakPolarHBondContact O-CD 3.37Å; L488-T500 HydrophobicContact CD2-CG2 3.41Å; L488-T500 VanDerWaalsContact CD2-CG2 3.41Å
489	R	60.9	Low	59.2	Low	180 Å²	180	69 Å²	69	68%	0.679	34%	0.34	S	S	*	.			trans	-106.9	100.8	166.9	-66.6	-175.1	-179.8	-169.3	1.1	108.5	I491	R489-I491 PolarHBondContact O-N 3.11Å
490	P	60.1	Low	56.8	Low	33 Å²	33	69.3 Å²	69.3	21%	0.214	34%	0.342	C	S	.	.			trans	-59.9	125.5	172.7	-19.5	31.6	0	0	0	108.9	F67 W329 F381 L488	F67-P490 HydrophobicContact CD1-CB 4.29Å; F67-P490 WeakPolarHBondContact CD1-O 3.27Å; F67-P490 HydrophobicContact CE1-CB 4Å; W329-P490 HydrophobicContact CH2-CG 4.41Å; W329-P490 HydrophobicContact CZ2-CB 4.37Å; F381-P490 HydrophobicContact CD1-CG 4.47Å; F381-P490 HydrophobicContact CE1-CG 4.06Å; L488-P490 WeakPolarHBondContact O-CD 3.37Å
491	I	56.7	Low	54.2	Low	43 Å²	43	65.4 Å²	65.4	22%	0.221	33%	0.328	C	S	.	.			trans	-94.5	124.6	172.8	-52.4	-173.3	0	0	0	105.6	A63 R489 D493 R496 D498	A63-I491 HydrophobicContact CB-CG2 3.36Å; R489-I491 PolarHBondContact O-N 3.11Å; I491-D493 PolarHBondContact O-N 2.87Å; I491-D493 HydrophobicContact CG2-CB 3.8Å; I491-R496 VanDerWaalsContact CB-O 3.28Å; I491-R496 WeakPolarHBondContact CB-O 3.25Å; I491-R496 HydrophobicContact CD1-CB 4.43Å; I491-R496 WeakPolarHBondContact CD1-O 3.28Å; I491-R496 WeakPolarHBondContact CG1-O 3.36Å; I491-D498 HydrophobicContact CD1-CB 4.5Å
492	G	49	Very low	51.7	Low	12 Å²	12	64.9 Å²	64.9	12%	0.124	32%	0.323	C	S	.	.	S	Bend	trans	-72.9	24	179.3	0	0	0	0	0	114.1	F67	F67-G492 VanDerWaalsContact CG-CA 3.48Å
493	D	47.9	Very low	49.3	Very low	21 Å²	21	63.2 Å²	63.2	11%	0.112	31%	0.311	C	S	.	.	S	Bend	trans	-110.1	141.2	-179.3	-151.8	-14.7	0	0	0	108.6	A63 S224 R228 I491 S495	A63-D493 HydrophobicContact CB-CB 4.34Å; S224-D493 WeakPolarHBondContact CB-OD1 3.21Å; S224-D493 WeakPolarHBondContact CB-OD2 3.44Å; S224-D493 PolarHBondContact OG-OD1 3.37Å; S224-D493 PolarHBondContact OG-OD2 2.87Å; R228-D493 IonicContact CZ-OD2 3.3Å; R228-D493 IonicContact NH1-OD1 3.76Å; R228-D493 IonicContact NH1-OD2 3.14Å; R228-D493 PolarHBondContact NH1-OD2 3.42Å; R228-D493 IonicContact NH2-OD2 3.07Å; R228-D493 PolarHBondContact NH2-OD2 3.21Å; I491-D493 PolarHBondContact O-N 2.87Å; I491-D493 HydrophobicContact CG2-CB 3.8Å; D493-S495 PolarHBondContact O-N 3.42Å
494	L	48.8	Very low	47.4	Very low	49 Å²	49	60.7 Å²	60.7	26%	0.257	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-4.8	-172.2	-95.7	151.9	0	0	0	114.2	F317 T322 S383 V384	F317-L494 HydrophobicContact CZ-CD1 4.45Å; T322-L494 HydrophobicContact CG2-CD2 3.55Å; S383-L494 WeakPolarHBondContact O-CD2 3.38Å; V384-L494 HydrophobicContact CG2-CD2 4.08Å
495	S	36.8	Very low	45.4	Very low	8 Å²	8	56.2 Å²	56.2	6%	0.056	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.7	-3	-160.7	-42.3	0	0	0	0	116.8	S220 D321 D493	S220-S495 WeakPolarHBondContact CB-OG 3.33Å; D321-S495 PolarHBondContact OD2-OG 2.87Å; D493-S495 PolarHBondContact O-N 3.42Å
496	R	39.9	Very low	43.5	Very low	135 Å²	135	56.3 Å²	56.3	51%	0.509	29%	0.293	S	S	.	.			trans	-148.7	113.6	177.7	-70.1	-166.3	174.6	118.7	8	113.3	D221 I491	D221-R496 IonicContact OD1-CZ 2.75Å; D221-R496 IonicContact OD1-NH1 3.95Å; D221-R496 PolarHBondContact OD1-NH1 3.46Å; D221-R496 IonicContact OD2-CZ 3.12Å; D221-R496 VanDerWaalsContact OD2-CZ 3.29Å; D221-R496 IonicContact OD2-NH1 2.82Å; D221-R496 PolarHBondContact OD2-NH1 2.85Å; D221-R496 IonicContact OD2-NH2 3.22Å; D221-R496 PolarHBondContact OD2-NH2 2.76Å; D221-R496 VanDerWaalsContact OD2-NH2 3.11Å; I491-R496 VanDerWaalsContact CB-O 3.28Å; I491-R496 WeakPolarHBondContact CB-O 3.25Å; I491-R496 HydrophobicContact CD1-CB 4.43Å; I491-R496 WeakPolarHBondContact CD1-O 3.28Å; I491-R496 WeakPolarHBondContact CG1-O 3.36Å
497	L	39	Very low	42	Very low	21 Å²	21	53.1 Å²	53.1	11%	0.11	28%	0.276	C	S	.	.			trans	-66.3	134.8	140.3	-84	172.3	0	0	0	107	F182 N328 W329	F182-L497 HydrophobicContact CD2-CB 4.02Å; F182-L497 HydrophobicContact CD2-CD1 3.67Å; F182-L497 HydrophobicContact CD2-CG 4.21Å; F182-L497 HydrophobicContact CE2-CB 3.93Å; F182-L497 HydrophobicContact CE2-CD1 3.68Å; F182-L497 HydrophobicContact CE2-CG 3.9Å; N328-L497 HydrophobicContact CB-CD1 4.43Å; W329-L497 HydrophobicContact CD2-CD1 4.38Å; W329-L497 HydrophobicContact CH2-CD2 3.39Å; W329-L497 HydrophobicContact CZ2-CD1 4.41Å; W329-L497 HydrophobicContact CZ2-CD2 3.18Å; W329-L497 HydrophobicContact CZ2-CG 4.1Å; W329-L497 HydrophobicContact CZ3-CD2 4.13Å
498	D	35.4	Very low	40.5	Very low	97 Å²	97	49.8 Å²	49.8	52%	0.519	27%	0.269	S	S	.	.			trans	-51.2	138.5	160.6	-142.3	3.6	0	0	0	106.8	I491 T500	I491-D498 HydrophobicContact CD1-CB 4.5Å; D498-T500 WeakPolarHBondContact O-CG2 3.37Å; D498-T500 PolarHBondContact O-N 3.37Å
499	P	32.4	Very low	38.7	Very low	96 Å²	96	51.4 Å²	51.4	62%	0.623	29%	0.29	S	S	*	.			trans	-59.3	108	-162.1	15.2	-19.1	0	0	0	110.2
500	T	39.4	Very low	36.9	Very low	13 Å²	13	50.3 Å²	50.3	8%	0.08	29%	0.292	C	S	.	.			trans	-105.8	130.7	-175.3	44.1	0	0	0	0	109.3	N180 Q483 L488 D498	N180-T500 VanDerWaalsContact CG-O 3.26Å; N180-T500 PolarHBondContact OD1-O 2.91Å; Q483-T500 VanDerWaalsContact OE1-CB 3.28Å; L488-T500 HydrophobicContact CD2-CG2 3.41Å; L488-T500 VanDerWaalsContact CD2-CG2 3.41Å; D498-T500 WeakPolarHBondContact O-CG2 3.37Å; D498-T500 PolarHBondContact O-N 3.37Å
501	S	34.3	Very low	35.3	Very low	38 Å²	38	55.9 Å²	55.9	27%	0.266	31%	0.31	S	S	.	.			trans	-84.5	117.3	-178	24.9	0	0	0	0	109.9	C482	C482-S501 PolarHBondContact N-O 2.9Å; C482-S501 WeakPolarHBondContact CB-O 3.3Å; C482-S501 PolarHBondContact SG-O 2.9Å
502	L	31.7	Very low	33.6	Very low	5 Å²	5	59.5 Å²	59.5	3%	0.026	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.6	168.5	-69	173.7	0	0	0	107.7	F179 C181 L331 H332 A481	F179-L502 CarbonylContact C-O 3.43Å; F179-L502 PolarHBondContact N-O 3.43Å; F179-L502 VanDerWaalsContact N-O 3.16Å; F179-L502 CarbonylContact O-C 3.22Å; F179-L502 PolarHBondContact O-N 2.92Å; C181-L502 WeakPolarHBondContact SG-CD1 3.5Å; L331-L502 HydrophobicContact CB-CD1 4.22Å; H332-L502 HydrophobicContact CB-CD2 4.36Å; A481-L502 HydrophobicContact CB-CD2 3.86Å
503	T	27.9	Very low	32.4	Very low	26 Å²	26	65.6 Å²	65.6	16%	0.16	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	119	170.3	-58.1	0	0	0	0	107.9	S178 E480 C482 T505	S178-T503 VanDerWaalsContact CA-OG1 3.29Å; S178-T503 WeakPolarHBondContact CA-OG1 3.04Å; S178-T503 WeakPolarHBondContact CB-OG1 3.33Å; E480-T503 PolarHBondContact N-O 3.28Å; E480-T503 PolarHBondContact O-N 3.43Å; C482-T503 PolarHBondContact SG-OG1 3.44Å; T503-T505 HydrophobicContact CG2-CG2 3.99Å
504	V	29.5	Very low	31.1	Very low	2 Å²	2	76 Å²	76	1%	0.012	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	117.8	171.3	-175.1	0	0	0	0	107.3	A174 G175 F179 F477	A174-V504 WeakPolarHBondContact CA-O 3.14Å; G175-V504 PolarHBondContact N-O 3.48Å; F179-V504 HydrophobicContact CE1-CB 3.78Å; F179-V504 HydrophobicContact CE1-CG2 3.98Å; F179-V504 HydrophobicContact CE2-CG2 4.32Å; F179-V504 HydrophobicContact CZ-CB 3.71Å; F179-V504 HydrophobicContact CZ-CG2 3.55Å; F477-V504 HydrophobicContact CB-CG1 3.41Å; F477-V504 VanDerWaalsContact CB-CG1 3.41Å; F477-V504 HydrophobicContact CD1-CG1 3.54Å; F477-V504 HydrophobicContact CD2-CG1 4.02Å; F477-V504 HydrophobicContact CE1-CG1 4.33Å; F477-V504 HydrophobicContact CG-CG1 3.36Å
505	T	26.7	Very low	29.9	Very low	50 Å²	50	78.4 Å²	78.4	31%	0.307	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.1	176.3	57	0	0	0	0	109.7	N478 T503 D507	N478-T505 PolarHBondContact N-O 3.01Å; N478-T505 PolarHBondContact O-N 2.94Å; N478-T505 PolarHBondContact O-OG1 2.87Å; T503-T505 HydrophobicContact CG2-CG2 3.99Å; T505-D507 PolarHBondContact O-N 3.4Å
506	P	26.1	Very low	29.5	Very low	67 Å²	67	83.3 Å²	83.3	44%	0.435	45%	0.453	S	S	.	.	S	Bend	trans	-81.1	100.5	176	29	-22.2	0	0	0	108.6	A174 F477	A174-P506 HydrophobicContact CB-CB 4.15Å; A174-P506 HydrophobicContact CB-CG 3.88Å; F477-P506 HydrophobicContact CD1-CB 4.38Å; F477-P506 HydrophobicContact CE1-CB 4.5Å
507	D	33.3	Very low	28.9	Very low	85 Å²	85	84.1 Å²	84.1	46%	0.455	47%	0.468	S	S	.	.			trans	-176.6	105.6	145.8	-132.1	-33.2	0	0	0	111.1	N478 T505 G509	N478-D507 PolarHBondContact ND2-O 2.91Å; T505-D507 PolarHBondContact O-N 3.4Å; D507-G509 WeakPolarHBondContact OD1-CA 3.25Å; D507-G509 PolarHBondContact OD1-N 3.35Å; D507-G509 VanDerWaalsContact OD1-N 3.12Å
508	A	30.4	Very low	28.5	Very low	48 Å²	48	92.8 Å²	92.8	40%	0.397	50%	0.504	S	S	.	.	S	Bend	trans	-88.6	11.2	162.7	0	0	0	0	0	111.7	R475	R475-A508 VanDerWaalsContact O-CB 3.27Å; R475-A508 WeakPolarHBondContact O-CB 3.02Å
509	G	25.7	Very low	28.1	Very low	51 Å²	51	97.5 Å²	97.5	53%	0.526	52%	0.52	S	S	.	.			trans	-110.2	-9.1	-164.4	0	0	0	0	0	117.9	D507 Y511	D507-G509 WeakPolarHBondContact OD1-CA 3.25Å; D507-G509 PolarHBondContact OD1-N 3.35Å; D507-G509 VanDerWaalsContact OD1-N 3.12Å; G509-Y511 PolarHBondContact O-N 3.04Å
510	E	23.1	Very low	27.9	Very low	156 Å²	156	99 Å²	99	73%	0.729	53%	0.528	S	S	*	.			trans	-102.4	85.4	177.4	-75.1	-159.6	161.4	0	0	112.5	T512	E510-T512 VanDerWaalsContact C-N 3.27Å; E510-T512 PolarHBondContact O-N 3.46Å
511	Y	27.3	Very low	27.6	Very low	150 Å²	150	103.4 Å²	103.4	59%	0.588	56%	0.556	S	S	*	*			trans	-60	91.2	154.5	-68.5	-89.2	0	0	0	109.2	H349 G509 I513	H349-Y511 PolarHBondContact CD2-OH 3.44Å; H349-Y511 VanDerWaalsContact CG-OH 3.25Å; G509-Y511 PolarHBondContact O-N 3.04Å; Y511-I513 PolarHBondContact O-N 3.43Å
512	T	21.5	Very low	27.4	Very low	120 Å²	120	113 Å²	113	74%	0.736	59%	0.587	S	S	*	*			trans	-78.4	71.1	161	-5.2	0	0	0	0	109	E510 R514	E510-T512 VanDerWaalsContact C-N 3.27Å; E510-T512 PolarHBondContact O-N 3.46Å; T512-R514 PolarHBondContact O-N 2.82Å; T512-R514 VanDerWaalsContact O-N 3.11Å
513	I	23	Very low	27.3	Very low	140 Å²	140	122.2 Å²	122.2	72%	0.718	63%	0.627	S	S	*	*			trans	-65.5	107.1	150	-62.1	176.7	0	0	0	104.5	Y511 S515	Y511-I513 PolarHBondContact O-N 3.43Å; I513-S515 VanDerWaalsContact C-N 3.3Å; I513-S515 PolarHBondContact O-N 3.35Å
514	R	21.8	Very low	27.4	Very low	239 Å²	239	126.1 Å²	126.1	90%	0.902	66%	0.655	S	S	*	*			trans	-59.2	98.9	165.5	-76.6	-174.7	179.2	-173.2	0.9	107.6	T512	T512-R514 PolarHBondContact O-N 2.82Å; T512-R514 VanDerWaalsContact O-N 3.11Å
515	S	23.3	Very low	27.5	Very low	100 Å²	100	135.9 Å²	135.9	70%	0.699	70%	0.697	S	S	*	*			trans	-98.4	128.1	158.7	-173.7	0	0	0	0	108.3	I513	I513-S515 VanDerWaalsContact C-N 3.3Å; I513-S515 PolarHBondContact O-N 3.35Å
516	P	28.5	Very low	27.6	Very low	110 Å²	110	137 Å²	137	71%	0.714	72%	0.719	S	S	*	*			trans	-75.3	132.6	-178.8	30.3	-30.3	0	0	0	110.4
517	N	27.3	Very low	28	Very low	153 Å²	153	142.1 Å²	142.1	82%	0.818	74%	0.741	S	S	*	*			trans	67.9	107.3	162.4	-73	-30.1	0	0	0	119
518	K	30.1	Very low	28.1	Very low	202 Å²	202	142.2 Å²	142.2	88%	0.878	75%	0.753	S	S	*	*				163.6	106.2	106.7	-90.9	177.6	-179.9	177.5	0	113.1
519	K	26.5	Very low	28.3	Very low	197 Å²	197	151.3 Å²	151.3	86%	0.857	80%	0.795	S	S	*	*				26.5	125.1	124.2	-98.8	-173.5	-176.1	-176.9	0	121.7
520	V	29.3	Very low	28.4	Very low	128 Å²	128	156.3 Å²	156.3	78%	0.776	81%	0.809	S	S	*	*			trans	94.7	147.3	137.3	-162	0	0	0	0	117.7
521	P	32.5	Very low	28.7	Very low	104 Å²	104	156.3 Å²	156.3	68%	0.675	81%	0.813	S	S	*	*			cis	-131.6	175	-42.8	40.3	-23.3	0	0	0	114.7
522	R	30.3	Very low	28.8	Very low	241 Å²	241	156.7 Å²	156.7	91%	0.909	83%	0.825	S	S	*	*			trans	-63.8	143.6	169.6	-69.8	175	174.4	177.2	-3	113.4
523	F	29.2	Very low	29.2	Very low	198 Å²	198	158.8 Å²	158.8	87%	0.868	83%	0.831	S	S	*	*			trans	-117.6	110.7	154.7	-97.6	-81.8	0	0	0	110.5
524	S	29.8	Very low	29.6	Very low	108 Å²	108	160 Å²	160	76%	0.755	84%	0.838	S	S	*	*			trans	-77.2	128.8	160.7	50	0	0	0	0	109.3
525	K	32.8	Very low	30.1	Very low	206 Å²	206	154.7 Å²	154.7	90%	0.896	83%	0.833	S	S	*	*			trans	-109.5	107.1	156.5	-87.8	-172.1	175.2	-177.7	0	108.6
526	G	28.6	Very low	30.6	Very low	74 Å²	74	158.6 Å²	158.6	76%	0.763	84%	0.843	S	S	*	*			trans	-74.9	154.2	166	0	0	0	0	0	111.4
527	I	33.9	Very low	30.8	Very low	174 Å²	174	162.4 Å²	162.4	89%	0.892	85%	0.853	S	S	*	*			trans	-73.5	137.5	168.3	-64.8	161.8	0	0	0	108.7
528	A	35.3	Very low	31.1	Very low	87 Å²	87	163.2 Å²	163.2	72%	0.719	86%	0.856	S	S	*	*			trans	-168.4	128.6	142.9	0	0	0	0	0	111.6
529	N	34.9	Very low	31.2	Very low	239 Å²	239	159.6 Å²	159.6	100%	1.278	85%	0.854	S	S	*	*			trans	68	0	160.7	-64.1	-9.5	0	0	0	120.2

Retrieved 529 of 529 residues in 805.4 ms (Link to these results)

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