A0A3B3TKR4_9TELE Loading...

SREBP regulating gene protein

AlphaFold DB , UniProt , Accession A0A3B3TKR4, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 201 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	52.4	Low	57.3	Low	225 Å²	225	150.5 Å²	150.5	100%	1.108	70%	0.697	S	S	*	*				0	-18.1	0	-150.7	141	69.6	0	0	115.1
2	M	53.1	Low	58.6	Low	169 Å²	169	154.6 Å²	154.6	83%	0.833	70%	0.701	S	S	*	*	H	α-helix	trans	-80.7	-27.3	-179.5	-98.7	178.6	169.7	0	0	116.1
3	L	55.8	Low	60.2	Low	142 Å²	142	156.8 Å²	156.8	74%	0.743	70%	0.701	S	S	*	*	H	α-helix	trans	-76	-28.6	-174.6	-87.2	149.5	0	0	0	114.2
4	V	56.5	Low	61.9	Low	99 Å²	99	152.1 Å²	152.1	60%	0.6	69%	0.69	S	S	*	*	H	α-helix	trans	-76	-37.4	-179.9	-180	0	0	0	0	111	R7 L8	V4-R7 PolarHBondContact O-N 2.96Å; V4-L8 HydrophobicContact CG1-CD1 4.21Å; V4-L8 WeakPolarHBondContact O-CG 3.31Å; V4-L8 PolarHBondContact O-N 3.29Å; V4-L8 VanDerWaalsContact O-N 3.13Å
5	L	55.3	Low	63.2	Low	109 Å²	109	149.9 Å²	149.9	57%	0.571	69%	0.686	S	S	*	*	H	α-helix	trans	-67.3	-41	179	-162.4	65.8	0	0	0	112	R7 L8 L9	L5-R7 VanDerWaalsContact C-N 3.33Å; L5-R7 PolarHBondContact O-N 3.4Å; L5-L8 PolarHBondContact O-N 3.31Å; L5-L9 HydrophobicContact CG-CD1 3.96Å; L5-L9 VanDerWaalsContact O-CD1 3.31Å; L5-L9 WeakPolarHBondContact O-CD1 3.47Å; L5-L9 PolarHBondContact O-N 3.47Å
6	R	56.7	Low	64.7	Low	190 Å²	190	143.4 Å²	143.4	72%	0.717	67%	0.673	S	S	*	*	H	α-helix	trans	-62.3	-34.5	173.7	-89.8	-173.4	173.2	-171.2	-1.2	113.4	R10	R6-R10 WeakPolarHBondContact O-CB 3.48Å; R6-R10 PolarHBondContact O-N 3.47Å
7	R	56.5	Low	66.2	Low	195 Å²	195	139.7 Å²	139.7	74%	0.736	66%	0.662	S	S	*	*	H	α-helix	trans	-71.4	-39.6	176.1	-77.6	-177.8	178.6	177.7	0.1	111.8	V4 L5 R10 K11	V4-R7 PolarHBondContact O-N 2.96Å; L5-R7 VanDerWaalsContact C-N 3.33Å; L5-R7 PolarHBondContact O-N 3.4Å; R7-R10 PolarHBondContact O-N 3.13Å; R7-K11 WeakPolarHBondContact O-CB 3.29Å; R7-K11 PolarHBondContact O-N 3.1Å
8	L	56.4	Low	67.5	Low	100 Å²	100	136.9 Å²	136.9	52%	0.524	66%	0.655	S	S	.	*	H	α-helix	trans	-68.6	-39.9	176.9	-71.1	168.7	0	0	0	112.5	V4 L5 K11 R12	V4-L8 HydrophobicContact CG1-CD1 4.21Å; V4-L8 WeakPolarHBondContact O-CG 3.31Å; V4-L8 PolarHBondContact O-N 3.29Å; V4-L8 VanDerWaalsContact O-N 3.13Å; L5-L8 PolarHBondContact O-N 3.31Å; L8-K11 PolarHBondContact O-N 3.17Å; L8-R12 PolarHBondContact O-N 2.95Å; L8-R12 VanDerWaalsContact O-N 3.1Å
9	L	58.8	Low	68.8	Low	91 Å²	91	136.9 Å²	136.9	48%	0.476	65%	0.652	S	S	.	*	H	α-helix	trans	-62.7	-48.6	171.9	-92	119.4	0	0	0	111	L5 K11 R12 W13	L5-L9 HydrophobicContact CG-CD1 3.96Å; L5-L9 VanDerWaalsContact O-CD1 3.31Å; L5-L9 WeakPolarHBondContact O-CD1 3.47Å; L5-L9 PolarHBondContact O-N 3.47Å; L9-K11 VanDerWaalsContact C-N 3.26Å; L9-K11 PolarHBondContact O-N 3.27Å; L9-R12 PolarHBondContact O-N 3.47Å; L9-W13 PolarHBondContact O-N 2.96Å
10	R	64.6	Low	70	Confident	180 Å²	180	131.5 Å²	131.5	68%	0.679	63%	0.634	S	S	*	*	H	α-helix	trans	-59	-37.3	179.3	-158.2	-177.8	-61.7	-165.2	-1.9	112.5	R6 R7 V14	R6-R10 WeakPolarHBondContact O-CB 3.48Å; R6-R10 PolarHBondContact O-N 3.47Å; R7-R10 PolarHBondContact O-N 3.13Å; R10-V14 VanDerWaalsContact O-CG2 3.29Å; R10-V14 WeakPolarHBondContact O-CG2 3.33Å; R10-V14 PolarHBondContact O-N 3.07Å
11	K	64.1	Low	71	Confident	156 Å²	156	130.6 Å²	130.6	68%	0.678	63%	0.632	S	S	*	*	H	α-helix	trans	-70.7	-37.9	178	-135.6	176	-174.8	-174.9	0	112.9	R7 L8 L9 L15	R7-K11 WeakPolarHBondContact O-CB 3.29Å; R7-K11 PolarHBondContact O-N 3.1Å; L8-K11 PolarHBondContact O-N 3.17Å; L9-K11 VanDerWaalsContact C-N 3.26Å; L9-K11 PolarHBondContact O-N 3.27Å; K11-L15 PolarHBondContact O-N 2.97Å
12	R	73.4	Confident	72.8	Confident	199 Å²	199	122.8 Å²	122.8	75%	0.751	60%	0.599	S	S	*	*	H	α-helix	trans	-70.5	-36.3	175.6	-80.1	-179.4	171	-179.3	-2.9	112.7	L8 L9 L15 G16	L8-R12 PolarHBondContact O-N 2.95Å; L8-R12 VanDerWaalsContact O-N 3.1Å; L9-R12 PolarHBondContact O-N 3.47Å; R12-L15 PolarHBondContact O-N 3.45Å; R12-G16 PolarHBondContact O-N 3.07Å
13	W	78.8	Confident	74.6	Confident	183 Å²	183	118.6 Å²	118.6	69%	0.693	58%	0.58	S	S	*	*	H	α-helix	trans	-65.2	-42.7	174.5	-86.3	89.6	0	0	0	112.2	L9 L15 G16 V17	L9-W13 PolarHBondContact O-N 2.96Å; W13-L15 PolarHBondContact O-N 3.25Å; W13-G16 PolarHBondContact O-N 3.23Å; W13-V17 WeakPolarHBondContact O-CG2 3.34Å; W13-V17 PolarHBondContact O-N 3.18Å
14	V	84.1	Confident	76.4	Confident	91 Å²	91	116.6 Å²	116.6	55%	0.552	57%	0.569	S	S	*	*	H	α-helix	trans	-62	-43.4	176.1	172.3	0	0	0	0	111.4	R10 V17 V18	R10-V14 VanDerWaalsContact O-CG2 3.29Å; R10-V14 WeakPolarHBondContact O-CG2 3.33Å; R10-V14 PolarHBondContact O-N 3.07Å; V14-V17 PolarHBondContact O-N 3.28Å; V14-V18 WeakPolarHBondContact O-CG2 3.36Å; V14-V18 PolarHBondContact O-N 2.9Å
15	L	81	Confident	78.1	Confident	120 Å²	120	119.9 Å²	119.9	63%	0.628	57%	0.572	S	S	*	*	H	α-helix	trans	-63.2	-41	175.7	-77.6	163	0	0	0	112.3	K11 R12 W13 V18 F19	K11-L15 PolarHBondContact O-N 2.97Å; R12-L15 PolarHBondContact O-N 3.45Å; W13-L15 PolarHBondContact O-N 3.25Å; L15-V18 PolarHBondContact O-N 2.71Å; L15-F19 WeakPolarHBondContact O-CB 3.36Å; L15-F19 PolarHBondContact O-N 3.33Å
16	G	87.6	Confident	79.8	Confident	46 Å²	46	121.3 Å²	121.3	47%	0.474	57%	0.574	S	S	.	*	H	α-helix	trans	-63	-39.9	175.4	0	0	0	0	0	113.1	R12 W13 G20	R12-G16 PolarHBondContact O-N 3.07Å; W13-G16 PolarHBondContact O-N 3.23Å; G16-G20 PolarHBondContact O-N 2.97Å
17	V	89.9	Confident	81.3	Confident	80 Å²	80	116.4 Å²	116.4	49%	0.485	56%	0.561	S	S	.	*	H	α-helix	trans	-67.6	-45.1	177.3	170.7	0	0	0	0	111.5	W13 V14 F19 G20 L21	W13-V17 WeakPolarHBondContact O-CG2 3.34Å; W13-V17 PolarHBondContact O-N 3.18Å; V14-V17 PolarHBondContact O-N 3.28Å; V17-F19 VanDerWaalsContact C-N 3.33Å; V17-F19 PolarHBondContact O-N 3.25Å; V17-G20 PolarHBondContact O-N 2.95Å; V17-L21 HydrophobicContact CG1-CD1 3.96Å; V17-L21 HydrophobicContact CG1-CG 4.43Å; V17-L21 WeakPolarHBondContact O-CB 3.48Å; V17-L21 WeakPolarHBondContact O-CG 3.34Å; V17-L21 PolarHBondContact O-N 3.48Å
18	V	90.9	Very high	82.7	Confident	90 Å²	90	110.9 Å²	110.9	55%	0.545	55%	0.55	S	S	.	.	H	α-helix	trans	-62.3	-43.9	177.5	172.9	0	0	0	0	110.7	V14 L15 L21 S22	V14-V18 WeakPolarHBondContact O-CG2 3.36Å; V14-V18 PolarHBondContact O-N 2.9Å; L15-V18 PolarHBondContact O-N 2.71Å; V18-L21 PolarHBondContact O-N 3.4Å; V18-S22 WeakPolarHBondContact O-CB 3.4Å; V18-S22 PolarHBondContact O-N 2.88Å; V18-S22 PolarHBondContact O-OG 2.9Å
19	F	90.5	Very high	84	Confident	136 Å²	136	108.5 Å²	108.5	60%	0.596	54%	0.541	S	S	*	.	H	α-helix	trans	-63.7	-44.8	177.2	-167.6	-100.3	0	0	0	111.5	L15 V17 L21 S22 L23	L15-F19 WeakPolarHBondContact O-CB 3.36Å; L15-F19 PolarHBondContact O-N 3.33Å; V17-F19 VanDerWaalsContact C-N 3.33Å; V17-F19 PolarHBondContact O-N 3.25Å; F19-L21 PolarHBondContact O-N 3.49Å; F19-S22 WeakPolarHBondContact CA-OG 3.29Å; F19-S22 PolarHBondContact O-N 3.48Å; F19-S22 PolarHBondContact O-OG 2.88Å; F19-L23 HydrophobicContact CE1-CD1 3.8Å; F19-L23 HydrophobicContact CZ-CD1 4.15Å; F19-L23 WeakPolarHBondContact O-CB 3.45Å; F19-L23 PolarHBondContact O-N 3.31Å
20	G	92.7	Very high	85.1	Confident	28 Å²	28	106.9 Å²	106.9	29%	0.289	54%	0.535	S	S	.	.	H	α-helix	trans	-59.6	-46.6	176.3	0	0	0	0	0	113.1	G16 V17 S22 L23 I24	G16-G20 PolarHBondContact O-N 2.97Å; V17-G20 PolarHBondContact O-N 2.95Å; G20-S22 VanDerWaalsContact C-N 3.34Å; G20-S22 PolarHBondContact O-N 3.47Å; G20-L23 PolarHBondContact O-N 3.47Å; G20-I24 WeakPolarHBondContact O-CB 3.38Å; G20-I24 VanDerWaalsContact O-CG1 3.25Å; G20-I24 WeakPolarHBondContact O-CG1 3.36Å; G20-I24 PolarHBondContact O-N 2.9Å
21	L	92.3	Very high	86	Confident	114 Å²	114	103.5 Å²	103.5	60%	0.597	53%	0.53	S	S	*	.	H	α-helix	trans	-64	-39	176.4	-70.7	172.5	0	0	0	112	V17 V18 F19 L23 Y25	V17-L21 HydrophobicContact CG1-CD1 3.96Å; V17-L21 HydrophobicContact CG1-CG 4.43Å; V17-L21 WeakPolarHBondContact O-CB 3.48Å; V17-L21 WeakPolarHBondContact O-CG 3.34Å; V17-L21 PolarHBondContact O-N 3.48Å; V18-L21 PolarHBondContact O-N 3.4Å; F19-L21 PolarHBondContact O-N 3.49Å; L21-L23 VanDerWaalsContact C-N 3.35Å; L21-Y25 VanDerWaalsContact O-CB 3.32Å; L21-Y25 WeakPolarHBondContact O-CB 3.34Å; L21-Y25 PolarHBondContact O-N 3Å
22	S	90.6	Very high	86.8	Confident	60 Å²	60	103.3 Å²	103.3	42%	0.42	53%	0.529	S	S	.	.	H	α-helix	trans	-65.6	-38.4	176.1	74.4	0	0	0	0	112.4	V18 F19 G20 Y25 F26	V18-S22 WeakPolarHBondContact O-CB 3.4Å; V18-S22 PolarHBondContact O-N 2.88Å; V18-S22 PolarHBondContact O-OG 2.9Å; F19-S22 WeakPolarHBondContact CA-OG 3.29Å; F19-S22 PolarHBondContact O-N 3.48Å; F19-S22 PolarHBondContact O-OG 2.88Å; G20-S22 VanDerWaalsContact C-N 3.34Å; G20-S22 PolarHBondContact O-N 3.47Å; S22-Y25 PolarHBondContact O-N 3.01Å; S22-F26 WeakPolarHBondContact O-CB 3.47Å; S22-F26 PolarHBondContact O-N 3.33Å
23	L	91	Very high	86.9	Confident	81 Å²	81	100.7 Å²	100.7	42%	0.424	53%	0.525	S	S	.	.	H	α-helix	trans	-73.4	-39.7	-179.6	-161.7	129	0	0	0	111.3	F19 G20 L21 F26 L27	F19-L23 HydrophobicContact CE1-CD1 3.8Å; F19-L23 HydrophobicContact CZ-CD1 4.15Å; F19-L23 WeakPolarHBondContact O-CB 3.45Å; F19-L23 PolarHBondContact O-N 3.31Å; G20-L23 PolarHBondContact O-N 3.47Å; L21-L23 VanDerWaalsContact C-N 3.35Å; L23-F26 PolarHBondContact O-N 2.91Å; L23-L27 HydrophobicContact CD2-CD1 3.69Å; L23-L27 HydrophobicContact CD2-CG 4.39Å; L23-L27 WeakPolarHBondContact O-CB 3.45Å; L23-L27 VanDerWaalsContact O-CG 3.29Å; L23-L27 WeakPolarHBondContact O-CG 3.32Å; L23-L27 PolarHBondContact O-N 3.46Å
24	I	92.5	Very high	86.7	Confident	101 Å²	101	97.4 Å²	97.4	52%	0.518	52%	0.518	S	S	.	.	H	α-helix	trans	-63.5	-43.4	172.4	-68.5	164.9	0	0	0	110.6	G20 F26 L27 T28	G20-I24 WeakPolarHBondContact O-CB 3.38Å; G20-I24 VanDerWaalsContact O-CG1 3.25Å; G20-I24 WeakPolarHBondContact O-CG1 3.36Å; G20-I24 PolarHBondContact O-N 2.9Å; I24-F26 VanDerWaalsContact C-N 3.33Å; I24-F26 PolarHBondContact O-N 2.98Å; I24-L27 PolarHBondContact O-N 2.87Å; I24-T28 HydrophobicContact CG2-CG2 4.39Å; I24-T28 WeakPolarHBondContact O-CB 3.25Å; I24-T28 WeakPolarHBondContact O-CG2 3.47Å; I24-T28 PolarHBondContact O-N 3.21Å; I24-T28 PolarHBondContact O-OG1 3.32Å
25	Y	92.8	Very high	86.2	Confident	167 Å²	167	99.4 Å²	99.4	66%	0.655	52%	0.521	S	S	*	.	H	α-helix	trans	-61.4	-42.8	175.2	178.7	-97.8	0	0	0	111.6	L21 S22 T28 S29	L21-Y25 VanDerWaalsContact O-CB 3.32Å; L21-Y25 WeakPolarHBondContact O-CB 3.34Å; L21-Y25 PolarHBondContact O-N 3Å; S22-Y25 PolarHBondContact O-N 3.01Å; Y25-T28 WeakPolarHBondContact CA-OG1 3.49Å; Y25-T28 PolarHBondContact O-OG1 3.05Å; Y25-S29 WeakPolarHBondContact O-CB 3.29Å; Y25-S29 PolarHBondContact O-N 3.46Å
26	F	90.1	Very high	85.6	Confident	139 Å²	139	102.3 Å²	102.3	61%	0.61	52%	0.524	S	S	*	.	H	α-helix	trans	-64.5	-45.8	177.6	-171.5	-96.5	0	0	0	112.5	S22 L23 I24 S29 T30	S22-F26 WeakPolarHBondContact O-CB 3.47Å; S22-F26 PolarHBondContact O-N 3.33Å; L23-F26 PolarHBondContact O-N 2.91Å; I24-F26 VanDerWaalsContact C-N 3.33Å; I24-F26 PolarHBondContact O-N 2.98Å; F26-S29 PolarHBondContact O-N 3.47Å; F26-T30 HydrophobicContact CD1-CG2 4.19Å; F26-T30 HydrophobicContact CE1-CG2 3.85Å; F26-T30 HydrophobicContact CE2-CG2 4.43Å; F26-T30 HydrophobicContact CZ-CG2 3.99Å; F26-T30 WeakPolarHBondContact O-CB 3.35Å; F26-T30 VanDerWaalsContact O-CG2 3.29Å; F26-T30 WeakPolarHBondContact O-CG2 3.38Å; F26-T30 PolarHBondContact O-N 2.9Å; F26-T30 PolarHBondContact O-OG1 3.04Å
27	L	88.3	Confident	84.7	Confident	87 Å²	87	102.8 Å²	102.8	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-65.1	-43	177.3	-70.1	173.6	0	0	0	112.1	L23 I24 S29 T30 L31	L23-L27 HydrophobicContact CD2-CD1 3.69Å; L23-L27 HydrophobicContact CD2-CG 4.39Å; L23-L27 WeakPolarHBondContact O-CB 3.45Å; L23-L27 VanDerWaalsContact O-CG 3.29Å; L23-L27 WeakPolarHBondContact O-CG 3.32Å; L23-L27 PolarHBondContact O-N 3.46Å; I24-L27 PolarHBondContact O-N 2.87Å; L27-S29 VanDerWaalsContact C-N 3.34Å; L27-S29 PolarHBondContact O-N 2.93Å; L27-T30 WeakPolarHBondContact CA-OG1 3.46Å; L27-T30 PolarHBondContact O-N 2.9Å; L27-T30 PolarHBondContact O-OG1 2.94Å; L27-L31 WeakPolarHBondContact O-CB 3.28Å; L27-L31 VanDerWaalsContact O-CG 3.28Å; L27-L31 WeakPolarHBondContact O-CG 3.17Å; L27-L31 PolarHBondContact O-N 2.75Å
28	T	86.8	Confident	83.7	Confident	80 Å²	80	103.4 Å²	103.4	49%	0.491	52%	0.519	S	S	.	.	H	α-helix	trans	-67.1	-36	176.8	50.3	0	0	0	0	112.3	I24 Y25 K32	I24-T28 HydrophobicContact CG2-CG2 4.39Å; I24-T28 WeakPolarHBondContact O-CB 3.25Å; I24-T28 WeakPolarHBondContact O-CG2 3.47Å; I24-T28 PolarHBondContact O-N 3.21Å; I24-T28 PolarHBondContact O-OG1 3.32Å; Y25-T28 WeakPolarHBondContact CA-OG1 3.49Å; Y25-T28 PolarHBondContact O-OG1 3.05Å; T28-K32 WeakPolarHBondContact O-CB 3.42Å; T28-K32 PolarHBondContact O-N 3.09Å; T28-K32 VanDerWaalsContact O-N 3.1Å
29	S	83.5	Confident	82.5	Confident	50 Å²	50	107.4 Å²	107.4	35%	0.35	53%	0.525	S	S	.	.	H	α-helix	trans	-67.5	-44.5	175.9	-174.6	0	0	0	0	112.2	Y25 F26 L27 K32 Q33	Y25-S29 WeakPolarHBondContact O-CB 3.29Å; Y25-S29 PolarHBondContact O-N 3.46Å; F26-S29 PolarHBondContact O-N 3.47Å; L27-S29 VanDerWaalsContact C-N 3.34Å; L27-S29 PolarHBondContact O-N 2.93Å; S29-K32 PolarHBondContact O-N 3.48Å; S29-Q33 WeakPolarHBondContact O-CB 3.44Å; S29-Q33 PolarHBondContact O-N 3.39Å
30	T	82.7	Confident	81.1	Confident	56 Å²	56	105.6 Å²	105.6	34%	0.344	52%	0.521	S	S	.	.	H	α-helix	trans	-66.9	-44.9	-179.8	48.1	0	0	0	0	112.4	F26 L27 K32 Q33 E34	F26-T30 HydrophobicContact CD1-CG2 4.19Å; F26-T30 HydrophobicContact CE1-CG2 3.85Å; F26-T30 HydrophobicContact CE2-CG2 4.43Å; F26-T30 HydrophobicContact CZ-CG2 3.99Å; F26-T30 WeakPolarHBondContact O-CB 3.35Å; F26-T30 VanDerWaalsContact O-CG2 3.29Å; F26-T30 WeakPolarHBondContact O-CG2 3.38Å; F26-T30 PolarHBondContact O-N 2.9Å; F26-T30 PolarHBondContact O-OG1 3.04Å; L27-T30 WeakPolarHBondContact CA-OG1 3.46Å; L27-T30 PolarHBondContact O-N 2.9Å; L27-T30 PolarHBondContact O-OG1 2.94Å; T30-K32 VanDerWaalsContact C-N 3.34Å; T30-K32 PolarHBondContact O-N 3.45Å; T30-Q33 WeakPolarHBondContact O-CB 3.41Å; T30-Q33 PolarHBondContact O-N 3.48Å; T30-E34 PolarHBondContact O-N 3.1Å
31	L	81.6	Confident	79.6	Confident	110 Å²	110	113 Å²	113	58%	0.576	54%	0.541	S	S	*	.	H	α-helix	trans	-63.2	-40	175.2	-67.8	174.4	0	0	0	112	L27 Q33 E34 E35	L27-L31 WeakPolarHBondContact O-CB 3.28Å; L27-L31 VanDerWaalsContact O-CG 3.28Å; L27-L31 WeakPolarHBondContact O-CG 3.17Å; L27-L31 PolarHBondContact O-N 2.75Å; L31-Q33 VanDerWaalsContact C-N 3.3Å; L31-Q33 PolarHBondContact O-N 2.97Å; L31-E34 PolarHBondContact O-N 3.43Å; L31-E35 WeakPolarHBondContact O-CB 3.15Å; L31-E35 PolarHBondContact O-N 3.31Å
32	K	82	Confident	78.1	Confident	152 Å²	152	110.8 Å²	110.8	66%	0.661	53%	0.532	S	S	*	.	H	α-helix	trans	-67.3	-30.5	176.7	-167.7	175	-175.2	176.9	0	112.5	T28 S29 T30 R36	T28-K32 WeakPolarHBondContact O-CB 3.42Å; T28-K32 PolarHBondContact O-N 3.09Å; T28-K32 VanDerWaalsContact O-N 3.1Å; S29-K32 PolarHBondContact O-N 3.48Å; T30-K32 VanDerWaalsContact C-N 3.34Å; T30-K32 PolarHBondContact O-N 3.45Å; K32-R36 WeakPolarHBondContact O-CB 3.42Å; K32-R36 PolarHBondContact O-N 3.49Å; K32-R36 VanDerWaalsContact O-N 3.13Å
33	Q	74.4	Confident	76.6	Confident	143 Å²	143	112.6 Å²	112.6	67%	0.668	54%	0.536	S	S	*	.	H	α-helix	trans	-72.2	-41.3	174.3	-170.6	122.6	-26.1	0	0	111.5	S29 T30 L31 R36 S37	S29-Q33 WeakPolarHBondContact O-CB 3.44Å; S29-Q33 PolarHBondContact O-N 3.39Å; T30-Q33 WeakPolarHBondContact O-CB 3.41Å; T30-Q33 PolarHBondContact O-N 3.48Å; L31-Q33 VanDerWaalsContact C-N 3.3Å; L31-Q33 PolarHBondContact O-N 2.97Å; Q33-R36 PolarHBondContact O-N 3.37Å; Q33-S37 PolarHBondContact O-N 2.89Å
34	E	75	Confident	75	Confident	115 Å²	115	114.2 Å²	114.2	54%	0.537	55%	0.545	S	S	.	.	H	α-helix	trans	-62.4	-48	175.5	-172.3	173.5	-175	0	0	111.3	T30 L31 R36 S37 I38	T30-E34 PolarHBondContact O-N 3.1Å; L31-E34 PolarHBondContact O-N 3.43Å; E34-R36 VanDerWaalsContact C-N 3.31Å; E34-R36 PolarHBondContact O-N 3.37Å; E34-S37 PolarHBondContact O-N 3.25Å; E34-S37 VanDerWaalsContact O-N 3.09Å; E34-S37 PolarHBondContact O-OG 3Å; E34-I38 HydrophobicContact CG-CD1 4.07Å; E34-I38 WeakPolarHBondContact O-CG1 3.46Å; E34-I38 PolarHBondContact O-N 3.06Å
35	E	74.8	Confident	73.1	Confident	133 Å²	133	116 Å²	116	62%	0.621	55%	0.551	S	S	*	*	H	α-helix	trans	-60.5	-38.8	176.9	-164.5	-176.1	-175.3	0	0	112	L31 I38 R39	L31-E35 WeakPolarHBondContact O-CB 3.15Å; L31-E35 PolarHBondContact O-N 3.31Å; E35-I38 PolarHBondContact O-N 3Å; E35-R39 VanDerWaalsContact O-CB 3.27Å; E35-R39 WeakPolarHBondContact O-CB 3.21Å; E35-R39 PolarHBondContact O-N 2.93Å
36	R	68	Low	71.1	Confident	180 Å²	180	112.8 Å²	112.8	68%	0.679	55%	0.549	S	S	*	.	H	α-helix	trans	-66.4	-38.3	175.1	-161.1	175.1	-160.4	161.6	4	112	K32 Q33 E34 D40	K32-R36 WeakPolarHBondContact O-CB 3.42Å; K32-R36 PolarHBondContact O-N 3.49Å; K32-R36 VanDerWaalsContact O-N 3.13Å; Q33-R36 PolarHBondContact O-N 3.37Å; E34-R36 VanDerWaalsContact C-N 3.31Å; E34-R36 PolarHBondContact O-N 3.37Å; R36-D40 WeakPolarHBondContact O-CB 3.35Å; R36-D40 PolarHBondContact O-N 2.66Å
37	S	67.5	Low	69.2	Low	57 Å²	57	112.9 Å²	112.9	40%	0.399	55%	0.549	S	S	.	.	H	α-helix	trans	-70.8	-39.3	177.4	92.9	0	0	0	0	112.4	Q33 E34 D40 R41	Q33-S37 PolarHBondContact O-N 2.89Å; E34-S37 PolarHBondContact O-N 3.25Å; E34-S37 VanDerWaalsContact O-N 3.09Å; E34-S37 PolarHBondContact O-OG 3Å; S37-D40 PolarHBondContact O-N 3.33Å; S37-R41 WeakPolarHBondContact O-CG 3.27Å; S37-R41 PolarHBondContact O-N 3.39Å
38	I	69.4	Low	67.3	Low	92 Å²	92	113.4 Å²	113.4	47%	0.472	55%	0.552	S	S	.	*	H	α-helix	trans	-63.4	-48	175.6	-68.1	168.9	0	0	0	108.4	E34 E35 D40 R41 T42	E34-I38 HydrophobicContact CG-CD1 4.07Å; E34-I38 WeakPolarHBondContact O-CG1 3.46Å; E34-I38 PolarHBondContact O-N 3.06Å; E35-I38 PolarHBondContact O-N 3Å; I38-D40 VanDerWaalsContact C-N 3.33Å; I38-D40 PolarHBondContact O-N 2.92Å; I38-R41 WeakPolarHBondContact O-CB 3.35Å; I38-R41 PolarHBondContact O-N 3.41Å; I38-R41 VanDerWaalsContact O-N 3.1Å; I38-T42 PolarHBondContact O-N 3.39Å; I38-T42 PolarHBondContact O-OG1 2.95Å
39	R	65.8	Low	65.4	Low	174 Å²	174	114.4 Å²	114.4	66%	0.657	56%	0.562	S	S	*	*	H	α-helix	trans	-62.8	-36.3	179.1	-159.9	173.3	80.5	-175.2	9.3	113.1	E35 L43	E35-R39 VanDerWaalsContact O-CB 3.27Å; E35-R39 WeakPolarHBondContact O-CB 3.21Å; E35-R39 PolarHBondContact O-N 2.93Å; R39-L43 VanDerWaalsContact O-CB 3.22Å; R39-L43 WeakPolarHBondContact O-CB 3.49Å; R39-L43 PolarHBondContact O-N 3.41Å
40	D	61.5	Low	63.6	Low	98 Å²	98	118.6 Å²	118.6	52%	0.524	58%	0.581	S	S	.	*	H	α-helix	trans	-67	-40.2	173	-116.1	-8.7	0	0	0	111.6	R36 S37 I38 L43 L44	R36-D40 WeakPolarHBondContact O-CB 3.35Å; R36-D40 PolarHBondContact O-N 2.66Å; S37-D40 PolarHBondContact O-N 3.33Å; I38-D40 VanDerWaalsContact C-N 3.33Å; I38-D40 PolarHBondContact O-N 2.92Å; D40-L43 PolarHBondContact O-N 3.1Å; D40-L44 WeakPolarHBondContact O-CB 3.3Å; D40-L44 VanDerWaalsContact O-CG 3.25Å; D40-L44 WeakPolarHBondContact O-CG 3.17Å; D40-L44 PolarHBondContact O-N 2.98Å
41	R	61.2	Low	61.9	Low	184 Å²	184	121.6 Å²	121.6	69%	0.694	59%	0.59	S	S	*	*	H	α-helix	trans	-64.3	-43.6	174.1	-71.6	174.4	99.8	137.4	4.2	111.8	S37 I38 L43 L44 E45	S37-R41 WeakPolarHBondContact O-CG 3.27Å; S37-R41 PolarHBondContact O-N 3.39Å; I38-R41 WeakPolarHBondContact O-CB 3.35Å; I38-R41 PolarHBondContact O-N 3.41Å; I38-R41 VanDerWaalsContact O-N 3.1Å; R41-L43 VanDerWaalsContact C-N 3.34Å; R41-L44 PolarHBondContact O-N 2.97Å; R41-E45 PolarHBondContact O-N 2.73Å
42	T	61.1	Low	60.2	Low	67 Å²	67	127.5 Å²	127.5	41%	0.411	61%	0.605	S	S	.	*	H	α-helix	trans	-66.5	-37.6	177.2	-24.8	0	0	0	0	111.4	I38 E45 V46	I38-T42 PolarHBondContact O-N 3.39Å; I38-T42 PolarHBondContact O-OG1 2.95Å; T42-E45 PolarHBondContact O-N 2.83Å; T42-V46 WeakPolarHBondContact O-CB 3.33Å; T42-V46 WeakPolarHBondContact O-CG2 3.16Å; T42-V46 PolarHBondContact O-N 3.49Å
43	L	59.3	Low	58.5	Low	98 Å²	98	122.3 Å²	122.3	51%	0.513	58%	0.584	S	S	.	*	H	α-helix	trans	-67.9	-37.9	176.3	-168.6	152.5	0	0	0	111.6	R39 D40 R41 K47	R39-L43 VanDerWaalsContact O-CB 3.22Å; R39-L43 WeakPolarHBondContact O-CB 3.49Å; R39-L43 PolarHBondContact O-N 3.41Å; D40-L43 PolarHBondContact O-N 3.1Å; R41-L43 VanDerWaalsContact C-N 3.34Å; L43-K47 VanDerWaalsContact O-CB 3.25Å; L43-K47 WeakPolarHBondContact O-CB 3.22Å; L43-K47 PolarHBondContact O-N 2.94Å
44	L	56.7	Low	57.3	Low	115 Å²	115	121.2 Å²	121.2	60%	0.602	59%	0.589	S	S	*	*	H	α-helix	trans	-65.2	-44.4	172.5	-73.7	167.5	0	0	0	111.9	D40 R41 K47 D48	D40-L44 WeakPolarHBondContact O-CB 3.3Å; D40-L44 VanDerWaalsContact O-CG 3.25Å; D40-L44 WeakPolarHBondContact O-CG 3.17Å; D40-L44 PolarHBondContact O-N 2.98Å; R41-L44 PolarHBondContact O-N 2.97Å; L44-K47 PolarHBondContact O-N 2.9Å; L44-D48 WeakPolarHBondContact O-CB 3.36Å; L44-D48 PolarHBondContact O-N 2.9Å; L44-D48 VanDerWaalsContact O-N 3.12Å
45	E	52.8	Low	56.3	Low	138 Å²	138	119.1 Å²	119.1	65%	0.645	58%	0.577	S	S	*	*	H	α-helix	trans	-63.2	-41.1	175.7	-109.7	-178.1	130.3	0	0	112.8	R41 T42 D48 S49	R41-E45 PolarHBondContact O-N 2.73Å; T42-E45 PolarHBondContact O-N 2.83Å; E45-D48 PolarHBondContact O-N 2.98Å; E45-S49 PolarHBondContact O-N 3.33Å; E45-S49 PolarHBondContact O-OG 3.13Å
46	V	51.6	Low	55.3	Low	101 Å²	101	120.3 Å²	120.3	61%	0.612	58%	0.58	S	S	*	*	H	α-helix	trans	-70.9	-32.4	178.9	171.4	0	0	0	0	111.4	T42	T42-V46 WeakPolarHBondContact O-CB 3.33Å; T42-V46 WeakPolarHBondContact O-CG2 3.16Å; T42-V46 PolarHBondContact O-N 3.49Å
47	K	48.6	Very low	54.8	Low	140 Å²	140	112.7 Å²	112.7	61%	0.609	55%	0.553	S	S	*	*	H	α-helix	trans	-75.3	-27.9	177.6	-164.7	165.4	-177.4	178.7	0	113.3	L43 L44 H51	L43-K47 VanDerWaalsContact O-CB 3.25Å; L43-K47 WeakPolarHBondContact O-CB 3.22Å; L43-K47 PolarHBondContact O-N 2.94Å; L44-K47 PolarHBondContact O-N 2.9Å; K47-H51 PolarHBondContact O-ND1 3.43Å
48	D	48.6	Very low	54.4	Low	98 Å²	98	117.7 Å²	117.7	52%	0.524	56%	0.563	S	S	.	*	H	α-helix	trans	-77.4	-23.7	177.2	-161.6	24.3	0	0	0	112.9	L44 E45 Q152	L44-D48 WeakPolarHBondContact O-CB 3.36Å; L44-D48 PolarHBondContact O-N 2.9Å; L44-D48 VanDerWaalsContact O-N 3.12Å; E45-D48 PolarHBondContact O-N 2.98Å; D48-Q152 PolarHBondContact O-NE2 2.76Å; D48-Q152 PolarHBondContact OD1-OE1 3.28Å
49	S	47.8	Very low	53.8	Low	101 Å²	101	116 Å²	116	71%	0.706	55%	0.552	S	S	*	*	S	Bend	trans	-83.5	-17.1	-174.5	-62.5	0	0	0	0	115.3	E45	E45-S49 PolarHBondContact O-N 3.33Å; E45-S49 PolarHBondContact O-OG 3.13Å
50	D	44.8	Very low	53.4	Low	138 Å²	138	112.9 Å²	112.9	74%	0.738	55%	0.549	S	S	*	.	S	Bend	trans	-116.3	-7.2	-169.2	-154.2	24.9	0	0	0	115.4	R52	D50-R52 VanDerWaalsContact C-N 3.33Å; D50-R52 PolarHBondContact O-N 3.43Å; D50-R52 VanDerWaalsContact O-N 3.12Å
51	H	46.7	Very low	52.8	Low	119 Å²	119	114 Å²	114	55%	0.551	56%	0.555	S	S	*	*			trans	-90	74.1	171.3	-67.7	81.8	0	0	0	109.8	K47 I53	K47-H51 PolarHBondContact O-ND1 3.43Å; H51-I53 PolarHBondContact O-N 2.8Å
52	R	46.3	Very low	52.1	Low	235 Å²	235	109.2 Å²	109.2	89%	0.887	56%	0.562	S	S	*	*			trans	-61	91.7	154.5	-70.4	-174.9	-179.7	-176.2	2.1	106.5	D50 P54	D50-R52 VanDerWaalsContact C-N 3.33Å; D50-R52 PolarHBondContact O-N 3.43Å; D50-R52 VanDerWaalsContact O-N 3.12Å; R52-P54 VanDerWaalsContact O-CD 3.23Å; R52-P54 WeakPolarHBondContact O-CD 3.39Å
53	I	46.7	Very low	51.3	Low	42 Å²	42	113 Å²	113	22%	0.215	58%	0.58	C	S	.	*			trans	-50.1	117.7	174	-60.7	169.3	0	0	0	106.1	H51 W55 Q152 T156	H51-I53 PolarHBondContact O-N 2.8Å; I53-W55 VanDerWaalsContact C-N 3.28Å; I53-W55 HydrophobicContact CB-CZ2 4.3Å; I53-W55 HydrophobicContact CD1-CH2 4.17Å; I53-W55 HydrophobicContact CD1-CZ2 4.38Å; I53-W55 HydrophobicContact CG2-CD2 4.47Å; I53-W55 HydrophobicContact CG2-CE3 4.34Å; I53-W55 HydrophobicContact CG2-CZ3 4.39Å; I53-W55 PolarHBondContact O-N 3.14Å; I53-Q152 HydrophobicContact CD1-CB 4.02Å; I53-Q152 WeakPolarHBondContact CD1-O 3.44Å; I53-T156 HydrophobicContact CD1-CG2 4.13Å; I53-T156 HydrophobicContact CG2-CG2 4.3Å
54	P	48.5	Very low	50.8	Low	120 Å²	120	111.5 Å²	111.5	78%	0.779	58%	0.577	S	S	*	*			trans	-67.2	96.5	174.5	25.6	-30.3	0	0	0	106.8	R52 K56	R52-P54 VanDerWaalsContact O-CD 3.23Å; R52-P54 WeakPolarHBondContact O-CD 3.39Å; P54-K56 PolarHBondContact O-N 2.86Å; P54-K56 VanDerWaalsContact O-N 3.12Å
55	W	55.3	Low	50.3	Low	71 Å²	71	111.5 Å²	111.5	27%	0.269	59%	0.587	S	S	.	*			trans	-59.8	117.8	179.9	-61.6	106.9	0	0	0	108.9	I53 V57 A148 F155	I53-W55 VanDerWaalsContact C-N 3.28Å; I53-W55 HydrophobicContact CB-CZ2 4.3Å; I53-W55 HydrophobicContact CD1-CH2 4.17Å; I53-W55 HydrophobicContact CD1-CZ2 4.38Å; I53-W55 HydrophobicContact CG2-CD2 4.47Å; I53-W55 HydrophobicContact CG2-CE3 4.34Å; I53-W55 HydrophobicContact CG2-CZ3 4.39Å; I53-W55 PolarHBondContact O-N 3.14Å; W55-V57 VanDerWaalsContact C-N 3.32Å; W55-A148 HydrophobicContact CZ2-CB 3.49Å; W55-A148 VanDerWaalsContact CZ2-CB 3.49Å; W55-F155 HydrophobicContact CH2-CB 4.06Å; W55-F155 HydrophobicContact CZ3-CB 3.74Å
56	K	52.6	Low	50.2	Low	158 Å²	158	114.4 Å²	114.4	69%	0.687	59%	0.592	S	S	*	*			trans	-95	17.9	-172.9	-156.1	-174.6	177	-171.9	0	112.3	P54 R58	P54-K56 PolarHBondContact O-N 2.86Å; P54-K56 VanDerWaalsContact O-N 3.12Å; K56-R58 PolarHBondContact O-N 3.01Å
57	V	57.4	Low	50.4	Low	20 Å²	20	118 Å²	118	12%	0.121	60%	0.602	C	S	.	*			trans	-66.4	102.5	177	-176.8	0	0	0	0	107.6	W55 F59 L144 H161	W55-V57 VanDerWaalsContact C-N 3.32Å; V57-F59 HydrophobicContact CB-CE2 4.25Å; V57-F59 HydrophobicContact CB-CZ 4.4Å; V57-F59 HydrophobicContact CG1-CD1 4.4Å; V57-F59 HydrophobicContact CG1-CD2 4.33Å; V57-F59 HydrophobicContact CG1-CE1 3.97Å; V57-F59 HydrophobicContact CG1-CE2 3.89Å; V57-F59 HydrophobicContact CG1-CZ 3.7Å; V57-F59 PolarHBondContact O-N 3.36Å; V57-L144 HydrophobicContact CG2-CD1 4.43Å; V57-H161 HydrophobicContact CG1-CB 4.3Å
58	R	59.5	Low	51.1	Low	163 Å²	163	114.3 Å²	114.3	62%	0.615	59%	0.589	S	S	*	*	B	Isolated β-bridge	trans	-83.3	98.3	176.3	-68.6	-172.6	176.7	-165.5	-1.4	107.8	K56 N60	K56-R58 PolarHBondContact O-N 3.01Å; R58-N60 PolarHBondContact O-N 3.3Å; R58-N60 PolarHBondContact O-ND2 2.89Å
59	F	57.3	Low	52.3	Low	55 Å²	55	115 Å²	115	24%	0.241	60%	0.597	C	S	.	*			trans	-68.4	82.4	165.3	-60.2	-78.9	0	0	0	108.2	V57 L61 Q137 L144 H161	V57-F59 HydrophobicContact CB-CE2 4.25Å; V57-F59 HydrophobicContact CB-CZ 4.4Å; V57-F59 HydrophobicContact CG1-CD1 4.4Å; V57-F59 HydrophobicContact CG1-CD2 4.33Å; V57-F59 HydrophobicContact CG1-CE1 3.97Å; V57-F59 HydrophobicContact CG1-CE2 3.89Å; V57-F59 HydrophobicContact CG1-CZ 3.7Å; V57-F59 PolarHBondContact O-N 3.36Å; F59-L61 VanDerWaalsContact C-N 3.34Å; F59-L61 PolarHBondContact O-N 2.9Å; F59-Q137 HydrophobicContact CD1-CG 3.85Å; F59-Q137 HydrophobicContact CE1-CG 4.35Å; F59-Q137 HydrophobicContact CG-CG 4.37Å; F59-L144 HydrophobicContact CZ-CD1 4.37Å; F59-H161 HydrophobicContact CD1-CB 3.93Å; F59-H161 AromaticContact CD1-CD2 3.97Å; F59-H161 AromaticContact CD1-CE1 3.94Å; F59-H161 AromaticContact CD1-CG 3.53Å; F59-H161 AromaticContact CD1-ND1 3.49Å; F59-H161 WeakPolarHBondContact CD1-ND1 3.43Å; F59-H161 HydrophobicContact CE1-CB 4.17Å; F59-H161 AromaticContact CE1-CD2 3.66Å; F59-H161 AromaticContact CE1-CG 3.68Å
60	N	56.6	Low	54.1	Low	109 Å²	109	117.2 Å²	117.2	58%	0.583	60%	0.596	S	S	*	*			trans	-70.5	94.4	178.7	-68.7	-61.1	0	0	0	108.2	R58 G62	R58-N60 PolarHBondContact O-N 3.3Å; R58-N60 PolarHBondContact O-ND2 2.89Å; N60-G62 PolarHBondContact O-N 3.49Å
61	L	48.4	Very low	56.3	Low	123 Å²	123	111 Å²	111	64%	0.644	56%	0.563	S	S	*	*			trans	-69.9	92.1	176.6	-163.4	77.9	0	0	0	109.1	F59 N63 P134	F59-L61 VanDerWaalsContact C-N 3.34Å; F59-L61 PolarHBondContact O-N 2.9Å; L61-N63 PolarHBondContact O-N 3.49Å; L61-P134 HydrophobicContact CD1-CB 4.23Å
62	G	48.5	Very low	58.4	Low	83 Å²	83	109.9 Å²	109.9	86%	0.856	55%	0.554	S	S	*	*	S	Bend	trans	54.6	6.1	147.1	0	0	0	0	0	120.2	N60	N60-G62 PolarHBondContact O-N 3.49Å
63	N	43.2	Very low	60.6	Low	147 Å²	147	100 Å²	100	79%	0.786	52%	0.519	S	S	*	.			trans	-108.7	31	178.2	-154.1	15.8	0	0	0	112.1	L61 S65	L61-N63 PolarHBondContact O-N 3.49Å; N63-S65 VanDerWaalsContact C-N 3.31Å; N63-S65 PolarHBondContact O-N 2.96Å
64	S	48.3	Very low	62.7	Low	65 Å²	65	98.2 Å²	98.2	46%	0.455	51%	0.51	S	S	.	.			trans	-79.2	87.8	169.1	-82.7	0	0	0	0	108.9	R66	S64-R66 PolarHBondContact O-N 3.31Å; S64-R66 VanDerWaalsContact O-N 3.08Å
65	S	45.9	Very low	64.3	Low	116 Å²	116	98.8 Å²	98.8	81%	0.811	51%	0.505	S	S	*	.			trans	-61.3	11.8	145.6	55.1	0	0	0	0	112.8	N63 Q67	N63-S65 VanDerWaalsContact C-N 3.31Å; N63-S65 PolarHBondContact O-N 2.96Å; S65-Q67 PolarHBondContact O-N 3.27Å
66	R	52.3	Low	65.1	Low	198 Å²	198	100.8 Å²	100.8	75%	0.747	52%	0.518	S	S	*	.	S	Bend	trans	-70.8	110.3	160	-69.8	-172.9	140.9	-168.4	-7.7	106.3	S64 I68	S64-R66 PolarHBondContact O-N 3.31Å; S64-R66 VanDerWaalsContact O-N 3.08Å; R66-I68 HydrophobicContact CB-CG1 4.28Å; R66-I68 PolarHBondContact O-N 3.15Å
67	Q	54.5	Low	66.2	Low	177 Å²	177	93.6 Å²	93.6	83%	0.827	49%	0.489	S	S	*	.			trans	-57.8	96.3	156.8	-70.3	-168.4	-17.6	0	0	106	S65 T69	S65-Q67 PolarHBondContact O-N 3.27Å; Q67-T69 PolarHBondContact O-N 3.2Å
68	I	63.2	Low	67.4	Low	63 Å²	63	101 Å²	101	32%	0.323	52%	0.519	S	S	.	.			trans	-70.3	92.7	175.5	-69.3	165.2	0	0	0	104.3	R66 Q70 L85	R66-I68 HydrophobicContact CB-CG1 4.28Å; R66-I68 PolarHBondContact O-N 3.15Å; I68-Q70 WeakPolarHBondContact CG2-O 3.45Å; I68-Q70 PolarHBondContact O-N 3.11Å; I68-L85 HydrophobicContact CD1-CD2 3.68Å
69	T	73.4	Confident	68.8	Low	112 Å²	112	98.8 Å²	98.8	69%	0.687	52%	0.518	S	S	*	.			trans	-72.3	-18.2	-178.2	47.5	0	0	0	0	111.3	Q67 N97	Q67-T69 PolarHBondContact O-N 3.2Å; T69-N97 WeakPolarHBondContact O-CB 3.34Å; T69-N97 PolarHBondContact O-ND2 3.46Å
70	Q	87.6	Confident	70.5	Confident	147 Å²	147	98.1 Å²	98.1	69%	0.687	52%	0.517	S	S	*	.	S	Bend	trans	-144.4	131.6	-178.7	-175	175.8	-0.6	0	0	110.1	I68 N97	I68-Q70 WeakPolarHBondContact CG2-O 3.45Å; I68-Q70 PolarHBondContact O-N 3.11Å; Q70-N97 WeakPolarHBondContact CA-O 3.32Å; Q70-N97 WeakPolarHBondContact CG-O 3.5Å
71	C	89.8	Confident	72.4	Confident	9 Å²	9	93.1 Å²	93.1	6%	0.061	49%	0.491	C	S	.	.			trans	-108.1	146.5	176.5	-58.6	0	0	0	0	111.4	D83 E84 N97 C99	C71-D83 HydrophobicContact CB-CB 4.31Å; C71-E84 WeakPolarHBondContact CA-OE1 3.34Å; C71-E84 HydrophobicContact CB-CG 4.19Å; C71-N97 PolarHBondContact N-O 2.92Å; C71-C99 HydrophobicContact CB-CB 3.79Å; C71-C99 WeakPolarHBondContact CB-SG 3.41Å; C71-C99 PolarHBondContact N-SG 3.24Å; C71-C99 VanDerWaalsContact N-SG 3.39Å; C71-C99 WeakPolarHBondContact SG-CB 3.15Å; C71-C99 CovalentContact SG-SG 2.02Å; C71-C99 PolarHBondContact SG-SG 2.75Å
72	R	91.6	Very high	74.6	Confident	95 Å²	95	87.3 Å²	87.3	36%	0.358	46%	0.46	S	S	.	.			trans	-77.6	151.3	157	-63.7	177.9	-66.5	-178.9	-3.3	109.6	D83 E84 D160 F162 E163	R72-D83 CarbonylContact O-C 3.54Å; R72-D83 WeakPolarHBondContact O-CA 3.13Å; R72-E84 HydrophobicContact CB-CB 4.4Å; R72-E84 IonicContact CZ-OE2 3.91Å; R72-E84 PolarHBondContact N-OE1 3.42Å; R72-E84 IonicContact NE-OE2 2.92Å; R72-E84 PolarHBondContact NE-OE2 3.33Å; R72-E84 IonicContact NH2-OE2 3.55Å; R72-E84 PolarHBondContact NH2-OE2 2.97Å; R72-E84 PolarHBondContact O-N 3.45Å; R72-D160 IonicContact NH2-OD2 3.1Å; R72-D160 PolarHBondContact NH2-OD2 2.91Å; R72-F162 HydrophobicContact CB-CD1 4.17Å; R72-F162 HydrophobicContact CB-CE1 3.76Å; R72-E163 IonicContact NH1-OE1 2.69Å; R72-E163 PolarHBondContact NH1-OE1 3.21Å; R72-E163 VanDerWaalsContact NH1-OE1 3.1Å
73	N	92.2	Very high	76.7	Confident	26 Å²	26	83.4 Å²	83.4	14%	0.139	42%	0.419	C	S	.	.	B	Isolated β-bridge	trans	-135.8	171.9	172.8	62.7	62	0	0	0	110.7	I75 T82 G98	N73-I75 PolarHBondContact O-N 3.28Å; N73-I75 WeakPolarHBondContact OD1-CA 3.5Å; N73-I75 WeakPolarHBondContact OD1-CG1 3.25Å; N73-I75 PolarHBondContact OD1-N 3.04Å; N73-T82 CarbonylContact C-O 3.42Å; N73-T82 WeakPolarHBondContact CA-O 3.5Å; N73-T82 WeakPolarHBondContact CB-O 3.47Å; N73-G98 PolarHBondContact ND2-O 3.25Å
74	S	91.1	Very high	79	Confident	6 Å²	6	78.4 Å²	78.4	4%	0.042	39%	0.392	C	S	.	.			trans	-66.1	-17.4	-177.5	57.9	0	0	0	0	113.8	Q76 T82 E125	S74-Q76 WeakPolarHBondContact O-CG 3.36Å; S74-Q76 PolarHBondContact O-N 3.47Å; S74-T82 PolarHBondContact N-O 3.42Å; S74-T82 PolarHBondContact OG-N 3.4Å; S74-E125 WeakPolarHBondContact CB-OE2 3.42Å; S74-E125 VanDerWaalsContact OG-CD 3.23Å; S74-E125 PolarHBondContact OG-OE1 3.15Å; S74-E125 PolarHBondContact OG-OE2 3.3Å
75	I	81	Confident	81	Confident	131 Å²	131	78.2 Å²	78.2	67%	0.672	39%	0.385	S	S	*	.			trans	57.7	-33.5	-179.6	-59.2	170.9	0	0	0	114.9	N73	N73-I75 PolarHBondContact O-N 3.28Å; N73-I75 WeakPolarHBondContact OD1-CA 3.5Å; N73-I75 WeakPolarHBondContact OD1-CG1 3.25Å; N73-I75 PolarHBondContact OD1-N 3.04Å
76	Q	72.4	Confident	83.2	Confident	113 Å²	113	72.7 Å²	72.7	53%	0.528	35%	0.346	S	S	.	.			trans	-78.9	-21.6	-167.9	-64	-173.8	-68.5	0	0	113.7	S74 K78 R170	S74-Q76 WeakPolarHBondContact O-CG 3.36Å; S74-Q76 PolarHBondContact O-N 3.47Å; Q76-K78 PolarHBondContact O-N 3.04Å; Q76-R170 VanDerWaalsContact OE1-NH2 3.09Å
77	G	76.6	Confident	85.2	Confident	8 Å²	8	65.9 Å²	65.9	8%	0.082	32%	0.321	C	S	.	.			trans	-76.1	123.7	-172.8	0	0	0	0	0	113.3	L80 R91 E125	G77-L80 CarbonylContact C-O 3.57Å; G77-L80 WeakPolarHBondContact CA-O 3.05Å; G77-R91 PolarHBondContact O-NH2 3.2Å; G77-E125 VanDerWaalsContact CA-OE1 3.26Å; G77-E125 WeakPolarHBondContact CA-OE1 3.25Å; G77-E125 PolarHBondContact N-OE1 3.16Å
78	K	82.4	Confident	87.2	Confident	174 Å²	174	57.6 Å²	57.6	76%	0.757	28%	0.283	S	S	*	.	S	Bend	trans	-68.4	-34.5	-178.4	-176.6	178.8	176.6	-177.4	0	113.6	Q76 R91	Q76-K78 PolarHBondContact O-N 3.04Å; K78-R91 VanDerWaalsContact O-CZ 3.25Å; K78-R91 PolarHBondContact O-NH1 3.36Å; K78-R91 PolarHBondContact O-NH2 3.46Å
79	I	89.1	Confident	88.7	Confident	117 Å²	117	54.6 Å²	54.6	60%	0.6	27%	0.267	S	S	*	.	S	Bend	trans	-120.5	-50.3	-173	-59.9	173.6	0	0	0	109.6	E90 R91	I79-E90 WeakPolarHBondContact O-CA 3.41Å; I79-R91 PolarHBondContact O-N 2.8Å
80	L	93.7	Very high	89.7	Confident	41 Å²	41	52.3 Å²	52.3	22%	0.215	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	150.3	177.5	-63.1	171.1	0	0	0	109.8	G77 V88 C89 E90 I123 E125 Y126	G77-L80 CarbonylContact C-O 3.57Å; G77-L80 WeakPolarHBondContact CA-O 3.05Å; L80-V88 HydrophobicContact CB-CG1 4.21Å; L80-V88 HydrophobicContact CD2-CG1 4.41Å; L80-C89 CarbonylContact C-O 3.53Å; L80-C89 WeakPolarHBondContact CA-O 3.38Å; L80-E90 HydrophobicContact CD2-CG 4.07Å; L80-I123 HydrophobicContact CD1-CG2 4.32Å; L80-E125 HydrophobicContact CB-CB 4.33Å; L80-E125 HydrophobicContact CB-CG 3.99Å; L80-Y126 HydrophobicContact CD1-CE1 3.94Å
81	L	94.6	Very high	89.8	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.026	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	152.9	170.6	-64.7	100.1	0	0	0	109.6	V88 C89 R91	L81-V88 VanDerWaalsContact O-CA 3.25Å; L81-V88 WeakPolarHBondContact O-CA 3.36Å; L81-C89 PolarHBondContact N-O 2.93Å; L81-C89 PolarHBondContact O-N 2.91Å; L81-R91 HydrophobicContact CD1-CB 3.65Å; L81-R91 HydrophobicContact CD1-CG 4.02Å
82	T	95.1	Very high	89.9	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	131	173.6	-44.6	0	0	0	0	109.8	N73 S74 Y87 V88 E125 V128 L132	N73-T82 CarbonylContact C-O 3.42Å; N73-T82 WeakPolarHBondContact CA-O 3.5Å; N73-T82 WeakPolarHBondContact CB-O 3.47Å; S74-T82 PolarHBondContact N-O 3.42Å; S74-T82 PolarHBondContact OG-N 3.4Å; T82-Y87 CarbonylContact C-O 3.42Å; T82-Y87 VanDerWaalsContact CA-O 3.29Å; T82-Y87 WeakPolarHBondContact CA-O 3.02Å; T82-V88 HydrophobicContact CG2-CG2 3.98Å; T82-E125 VanDerWaalsContact OG1-CA 3.22Å; T82-E125 WeakPolarHBondContact OG1-CA 3.14Å; T82-E125 WeakPolarHBondContact OG1-CB 3.33Å; T82-E125 PolarHBondContact OG1-O 3.43Å; T82-E125 PolarHBondContact OG1-OE2 3.04Å; T82-V128 HydrophobicContact CG2-CB 4.33Å; T82-V128 HydrophobicContact CG2-CG1 4.01Å; T82-L132 HydrophobicContact CG2-CD1 4.44Å
83	D	93.5	Very high	90	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-88.9	168.5	171.5	70.5	20	0	0	0	112.7	C71 R72 L85 G86 Y87 C100	C71-D83 HydrophobicContact CB-CB 4.31Å; R72-D83 CarbonylContact O-C 3.54Å; R72-D83 WeakPolarHBondContact O-CA 3.13Å; D83-L85 PolarHBondContact O-N 3.34Å; D83-L85 WeakPolarHBondContact OD1-CA 3.46Å; D83-L85 WeakPolarHBondContact OD1-CB 3.25Å; D83-L85 PolarHBondContact OD1-N 3.15Å; D83-L85 VanDerWaalsContact OD1-N 3.1Å; D83-G86 PolarHBondContact O-N 3.48Å; D83-G86 PolarHBondContact OD1-N 3.26Å; D83-Y87 PolarHBondContact N-O 3.37Å; D83-Y87 WeakPolarHBondContact OD1-CB 2.83Å; D83-Y87 PolarHBondContact OD1-N 3.12Å; D83-C100 PolarHBondContact OD2-N 3.41Å
84	E	91.3	Very high	90	Very high	43 Å²	43	56.1 Å²	56.1	20%	0.201	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-14.5	-179	70.1	-175.4	169.3	0	0	114.3	C71 R72 G86 F162	C71-E84 WeakPolarHBondContact CA-OE1 3.34Å; C71-E84 HydrophobicContact CB-CG 4.19Å; R72-E84 HydrophobicContact CB-CB 4.4Å; R72-E84 IonicContact CZ-OE2 3.91Å; R72-E84 PolarHBondContact N-OE1 3.42Å; R72-E84 IonicContact NE-OE2 2.92Å; R72-E84 PolarHBondContact NE-OE2 3.33Å; R72-E84 IonicContact NH2-OE2 3.55Å; R72-E84 PolarHBondContact NH2-OE2 2.97Å; R72-E84 PolarHBondContact O-N 3.45Å; E84-G86 VanDerWaalsContact C-N 3.29Å; E84-F162 HydrophobicContact CB-CB 4.16Å; E84-F162 HydrophobicContact CB-CD1 3.7Å; E84-F162 HydrophobicContact CB-CD2 4.07Å; E84-F162 HydrophobicContact CB-CE1 4.04Å; E84-F162 HydrophobicContact CB-CE2 4.37Å; E84-F162 HydrophobicContact CB-CG 3.71Å; E84-F162 HydrophobicContact CB-CZ 4.35Å
85	L	89.9	Confident	90.1	Very high	60 Å²	60	59.4 Å²	59.4	31%	0.314	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-6.2	174.1	-57.6	179.4	0	0	0	112.3	I68 D83 Y87 Q109 Y110	I68-L85 HydrophobicContact CD1-CD2 3.68Å; D83-L85 PolarHBondContact O-N 3.34Å; D83-L85 WeakPolarHBondContact OD1-CA 3.46Å; D83-L85 WeakPolarHBondContact OD1-CB 3.25Å; D83-L85 PolarHBondContact OD1-N 3.15Å; D83-L85 VanDerWaalsContact OD1-N 3.1Å; L85-Y87 HydrophobicContact CB-CD2 3.8Å; L85-Y87 HydrophobicContact CB-CE2 4.02Å; L85-Y87 HydrophobicContact CD1-CE2 4.38Å; L85-Q109 PolarHBondContact O-NE2 3.31Å; L85-Q109 VanDerWaalsContact O-NE2 3.12Å; L85-Y110 PolarHBondContact O-OH 3.23Å
86	G	92.7	Very high	90.5	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.295	C	S	.	.	S	Bend	trans	85.3	14.1	179.5	0	0	0	0	0	114.3	D83 E84 Q109 Y110 S129	D83-G86 PolarHBondContact O-N 3.48Å; D83-G86 PolarHBondContact OD1-N 3.26Å; E84-G86 VanDerWaalsContact C-N 3.29Å; G86-Q109 WeakPolarHBondContact O-CA 3.5Å; G86-Y110 PolarHBondContact O-N 3.43Å; G86-S129 PolarHBondContact O-OG 3.32Å
87	Y	94.7	Very high	91.4	Very high	55 Å²	55	58.1 Å²	58.1	22%	0.216	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	137.4	167.6	-65.8	-83.1	0	0	0	110.5	T82 D83 L85 V102 T107 R108 Q109	T82-Y87 CarbonylContact C-O 3.42Å; T82-Y87 VanDerWaalsContact CA-O 3.29Å; T82-Y87 WeakPolarHBondContact CA-O 3.02Å; D83-Y87 PolarHBondContact N-O 3.37Å; D83-Y87 WeakPolarHBondContact OD1-CB 2.83Å; D83-Y87 PolarHBondContact OD1-N 3.12Å; L85-Y87 HydrophobicContact CB-CD2 3.8Å; L85-Y87 HydrophobicContact CB-CE2 4.02Å; L85-Y87 HydrophobicContact CD1-CE2 4.38Å; Y87-V102 HydrophobicContact CD1-CG1 4.34Å; Y87-V102 HydrophobicContact CD2-CG1 4.37Å; Y87-V102 HydrophobicContact CE1-CG1 3.9Å; Y87-V102 HydrophobicContact CE2-CG1 3.97Å; Y87-T107 HydrophobicContact CD1-CG2 3.78Å; Y87-T107 HydrophobicContact CG-CG2 4.21Å; Y87-R108 CarbonylContact C-O 3.55Å; Y87-R108 WeakPolarHBondContact CA-O 3.49Å; Y87-Q109 HydrophobicContact CD1-CB 3.62Å; Y87-Q109 HydrophobicContact CD1-CG 3.79Å; Y87-Q109 HydrophobicContact CD2-CG 4.31Å; Y87-Q109 HydrophobicContact CE1-CB 3.61Å; Y87-Q109 HydrophobicContact CE1-CG 3.76Å; Y87-Q109 HydrophobicContact CE2-CG 4.25Å; Y87-Q109 HydrophobicContact CG-CB 4.34Å; Y87-Q109 HydrophobicContact CG-CG 4.07Å; Y87-Q109 PolarHBondContact OH-OE1 3.09Å
88	V	95.5	Very high	92	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.024	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126	171.3	-174.8	0	0	0	0	108.5	L80 L81 T82 T107 R108 I111 E125 Y126	L80-V88 HydrophobicContact CB-CG1 4.21Å; L80-V88 HydrophobicContact CD2-CG1 4.41Å; L81-V88 VanDerWaalsContact O-CA 3.25Å; L81-V88 WeakPolarHBondContact O-CA 3.36Å; T82-V88 HydrophobicContact CG2-CG2 3.98Å; V88-T107 VanDerWaalsContact O-CA 3.29Å; V88-T107 WeakPolarHBondContact O-CA 3.25Å; V88-R108 PolarHBondContact N-O 2.99Å; V88-R108 PolarHBondContact O-N 2.79Å; V88-I111 HydrophobicContact CB-CG2 4.02Å; V88-I111 HydrophobicContact CG2-CG2 3.6Å; V88-E125 HydrophobicContact CG1-CB 4.18Å; V88-Y126 HydrophobicContact CB-CE1 4.46Å; V88-Y126 HydrophobicContact CG1-CD1 4.06Å; V88-Y126 HydrophobicContact CG1-CE1 3.81Å; V88-Y126 HydrophobicContact CG2-CD1 4.31Å
89	C	94.5	Very high	92.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	164	178.1	61	0	0	0	0	111.3	L80 L81 D93 C100 T107	L80-C89 CarbonylContact C-O 3.53Å; L80-C89 WeakPolarHBondContact CA-O 3.38Å; L81-C89 PolarHBondContact N-O 2.93Å; L81-C89 PolarHBondContact O-N 2.91Å; C89-D93 HydrophobicContact CB-CB 4.19Å; C89-C100 HydrophobicContact CB-CB 3.58Å; C89-C100 WeakPolarHBondContact CB-SG 3Å; C89-C100 PolarHBondContact N-SG 3.15Å; C89-C100 VanDerWaalsContact N-SG 3.41Å; C89-C100 WeakPolarHBondContact SG-CA 3.3Å; C89-C100 WeakPolarHBondContact SG-CB 3.42Å; C89-C100 CovalentContact SG-SG 2.04Å; C89-C100 PolarHBondContact SG-SG 3.23Å; C89-T107 HydrophobicContact CB-CG2 4.26Å; C89-T107 WeakPolarHBondContact CB-OG1 3.29Å
90	E	93.9	Very high	92.7	Very high	64 Å²	64	45.1 Å²	45.1	30%	0.299	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	155.1	166.2	-69.7	-179	-139.2	0	0	110.3	I79 L80 K92 D93 L94	I79-E90 WeakPolarHBondContact O-CA 3.41Å; L80-E90 HydrophobicContact CD2-CG 4.07Å; E90-K92 HydrophobicContact CB-CD 4.48Å; E90-K92 HydrophobicContact CB-CG 4.09Å; E90-K92 PolarHBondContact O-N 3.13Å; E90-K92 VanDerWaalsContact O-N 3.1Å; E90-K92 IonicContact OE1-NZ 2.89Å; E90-K92 PolarHBondContact OE1-NZ 2.03Å; E90-K92 WeakPolarHBondContact OE2-CD 3.49Å; E90-K92 WeakPolarHBondContact OE2-CE 3.34Å; E90-K92 IonicContact OE2-NZ 3.22Å; E90-K92 PolarHBondContact OE2-NZ 2.7Å; E90-D93 PolarHBondContact O-N 3.11Å; E90-L94 PolarHBondContact O-N 3.23Å
91	R	91.1	Very high	92.6	Very high	127 Å²	127	45.4 Å²	45.4	48%	0.479	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-56.5	-31.2	179.1	-171.2	176.6	-71	133.1	-6.6	113.7	G77 K78 I79 L81 D93 L94	G77-R91 PolarHBondContact O-NH2 3.2Å; K78-R91 VanDerWaalsContact O-CZ 3.25Å; K78-R91 PolarHBondContact O-NH1 3.36Å; K78-R91 PolarHBondContact O-NH2 3.46Å; I79-R91 PolarHBondContact O-N 2.8Å; L81-R91 HydrophobicContact CD1-CB 3.65Å; L81-R91 HydrophobicContact CD1-CG 4.02Å; R91-D93 PolarHBondContact O-N 3.37Å; R91-L94 WeakPolarHBondContact O-CB 3.04Å; R91-L94 PolarHBondContact O-N 3.01Å
92	K	91.8	Very high	92.5	Very high	148 Å²	148	49.1 Å²	49.1	64%	0.643	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-66.4	-23.9	178.1	74.2	-168	-175.3	-153.8	0	113.2	E90	E90-K92 HydrophobicContact CB-CD 4.48Å; E90-K92 HydrophobicContact CB-CG 4.09Å; E90-K92 PolarHBondContact O-N 3.13Å; E90-K92 VanDerWaalsContact O-N 3.1Å; E90-K92 IonicContact OE1-NZ 2.89Å; E90-K92 PolarHBondContact OE1-NZ 2.03Å; E90-K92 WeakPolarHBondContact OE2-CD 3.49Å; E90-K92 WeakPolarHBondContact OE2-CE 3.34Å; E90-K92 IonicContact OE2-NZ 3.22Å; E90-K92 PolarHBondContact OE2-NZ 2.7Å
93	D	93.4	Very high	92.3	Very high	29 Å²	29	55.9 Å²	55.9	16%	0.155	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-100.5	7.4	-177.4	-56.7	-52.6	0	0	0	111.6	C89 E90 R91 N101 A104 S106	C89-D93 HydrophobicContact CB-CB 4.19Å; E90-D93 PolarHBondContact O-N 3.11Å; R91-D93 PolarHBondContact O-N 3.37Å; D93-N101 WeakPolarHBondContact O-CB 3.41Å; D93-N101 PolarHBondContact O-N 2.89Å; D93-A104 HydrophobicContact CB-CB 3.92Å; D93-S106 VanDerWaalsContact CG-OG 3.3Å; D93-S106 PolarHBondContact OD2-OG 3.44Å
94	L	92.2	Very high	92.3	Very high	53 Å²	53	56.3 Å²	56.3	28%	0.277	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-77.8	126.2	173.9	-168.3	74.2	0	0	0	109.7	E90 R91 G98	E90-L94 PolarHBondContact O-N 3.23Å; R91-L94 WeakPolarHBondContact O-CB 3.04Å; R91-L94 PolarHBondContact O-N 3.01Å; L94-G98 WeakPolarHBondContact CD1-O 3.38Å
95	L	92.8	Very high	92.2	Very high	75 Å²	75	59.6 Å²	59.6	39%	0.393	32%	0.315	S	S	.	.			trans	-79.1	160.1	177.8	-62.9	175.7	0	0	0	110.9	N97 G98 C99 N101	L95-N97 WeakPolarHBondContact CB-OD1 3.33Å; L95-N97 PolarHBondContact O-N 2.77Å; L95-N97 VanDerWaalsContact O-N 3.13Å; L95-G98 PolarHBondContact O-N 2.97Å; L95-C99 WeakPolarHBondContact CB-O 3.48Å; L95-C99 PolarHBondContact N-O 3.07Å; L95-N101 HydrophobicContact CD1-CB 4.36Å; L95-N101 HydrophobicContact CD2-CB 3.96Å; L95-N101 HydrophobicContact CG-CB 4.01Å
96	V	90.3	Very high	92.2	Very high	161 Å²	161	58.5 Å²	58.5	98%	0.976	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.1	-179.8	-175.6	0	0	0	0	112.2	G98	V96-G98 PolarHBondContact O-N 3.46Å
97	N	89.8	Confident	92.2	Very high	55 Å²	55	59.1 Å²	59.1	29%	0.294	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	2.9	175.9	70.8	-15.1	0	0	0	114.3	T69 Q70 C71 L95 C99	T69-N97 WeakPolarHBondContact O-CB 3.34Å; T69-N97 PolarHBondContact O-ND2 3.46Å; Q70-N97 WeakPolarHBondContact CA-O 3.32Å; Q70-N97 WeakPolarHBondContact CG-O 3.5Å; C71-N97 PolarHBondContact N-O 2.92Å; L95-N97 WeakPolarHBondContact CB-OD1 3.33Å; L95-N97 PolarHBondContact O-N 2.77Å; L95-N97 VanDerWaalsContact O-N 3.13Å; N97-C99 VanDerWaalsContact C-N 3.29Å; N97-C99 PolarHBondContact ND2-SG 3.06Å; N97-C99 VanDerWaalsContact ND2-SG 3.36Å; N97-C99 PolarHBondContact O-N 3.11Å; N97-C99 WeakPolarHBondContact OD1-CB 3.08Å; N97-C99 PolarHBondContact OD1-N 2.84Å
98	G	90.1	Very high	92.2	Very high	12 Å²	12	63.2 Å²	63.2	12%	0.124	33%	0.331	C	S	.	.	S	Bend	trans	82.7	-1.8	178.9	0	0	0	0	0	115	N73 L94 L95 V96	N73-G98 PolarHBondContact ND2-O 3.25Å; L94-G98 WeakPolarHBondContact CD1-O 3.38Å; L95-G98 PolarHBondContact O-N 2.97Å; V96-G98 PolarHBondContact O-N 3.46Å
99	C	92.1	Very high	92.2	Very high	11 Å²	11	66.8 Å²	66.8	7%	0.074	35%	0.348	C	S	.	.	S	Bend	trans	-87.5	157	175	-51.3	0	0	0	0	111.3	C71 L95 N97	C71-C99 HydrophobicContact CB-CB 3.79Å; C71-C99 WeakPolarHBondContact CB-SG 3.41Å; C71-C99 PolarHBondContact N-SG 3.24Å; C71-C99 VanDerWaalsContact N-SG 3.39Å; C71-C99 WeakPolarHBondContact SG-CB 3.15Å; C71-C99 CovalentContact SG-SG 2.02Å; C71-C99 PolarHBondContact SG-SG 2.75Å; L95-C99 WeakPolarHBondContact CB-O 3.48Å; L95-C99 PolarHBondContact N-O 3.07Å; N97-C99 VanDerWaalsContact C-N 3.29Å; N97-C99 PolarHBondContact ND2-SG 3.06Å; N97-C99 VanDerWaalsContact ND2-SG 3.36Å; N97-C99 PolarHBondContact O-N 3.11Å; N97-C99 WeakPolarHBondContact OD1-CB 3.08Å; N97-C99 PolarHBondContact OD1-N 2.84Å
100	C	93.1	Very high	92.1	Very high	4 Å²	4	70.3 Å²	70.3	3%	0.027	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-75.6	142.6	170.1	-76.5	0	0	0	0	111.7	D83 C89 V102 T107	D83-C100 PolarHBondContact OD2-N 3.41Å; C89-C100 HydrophobicContact CB-CB 3.58Å; C89-C100 WeakPolarHBondContact CB-SG 3Å; C89-C100 PolarHBondContact N-SG 3.15Å; C89-C100 VanDerWaalsContact N-SG 3.41Å; C89-C100 WeakPolarHBondContact SG-CA 3.3Å; C89-C100 WeakPolarHBondContact SG-CB 3.42Å; C89-C100 CovalentContact SG-SG 2.04Å; C89-C100 PolarHBondContact SG-SG 3.23Å; C100-V102 PolarHBondContact O-N 3.13Å; C100-V102 VanDerWaalsContact O-N 3.14Å; C100-T107 HydrophobicContact CB-CG2 3.98Å
101	N	93.4	Very high	92.2	Very high	47 Å²	47	68 Å²	68	25%	0.251	35%	0.351	S	S	.	.			trans	-71.2	107.2	172.9	-175.9	-1.9	0	0	0	110.5	D93 L95 N103 A104 T107	D93-N101 WeakPolarHBondContact O-CB 3.41Å; D93-N101 PolarHBondContact O-N 2.89Å; L95-N101 HydrophobicContact CD1-CB 4.36Å; L95-N101 HydrophobicContact CD2-CB 3.96Å; L95-N101 HydrophobicContact CG-CB 4.01Å; N101-N103 PolarHBondContact O-N 2.85Å; N101-N103 WeakPolarHBondContact OD1-CB 3.49Å; N101-N103 PolarHBondContact OD1-N 2.9Å; N101-A104 HydrophobicContact CB-CB 4.2Å; N101-A104 WeakPolarHBondContact O-CB 3.29Å; N101-A104 PolarHBondContact O-N 3.33Å; N101-A104 VanDerWaalsContact O-N 3.15Å; N101-T107 VanDerWaalsContact O-CB 3.26Å; N101-T107 WeakPolarHBondContact O-CB 3.4Å; N101-T107 PolarHBondContact O-OG1 3.27Å
102	V	91.3	Very high	92.3	Very high	83 Å²	83	63.9 Å²	63.9	50%	0.503	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-21.4	179.9	-59.1	0	0	0	0	113.8	Y87 C100	Y87-V102 HydrophobicContact CD1-CG1 4.34Å; Y87-V102 HydrophobicContact CD2-CG1 4.37Å; Y87-V102 HydrophobicContact CE1-CG1 3.9Å; Y87-V102 HydrophobicContact CE2-CG1 3.97Å; C100-V102 PolarHBondContact O-N 3.13Å; C100-V102 VanDerWaalsContact O-N 3.14Å
103	N	91.3	Very high	92.3	Very high	142 Å²	142	65.2 Å²	65.2	76%	0.759	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-13.1	179.9	-58.2	-47.2	0	0	0	112.6	N101	N101-N103 PolarHBondContact O-N 2.85Å; N101-N103 WeakPolarHBondContact OD1-CB 3.49Å; N101-N103 PolarHBondContact OD1-N 2.9Å
104	A	92.5	Very high	92.2	Very high	10 Å²	10	65 Å²	65	8%	0.083	35%	0.348	C	S	.	.	S	Bend	trans	-74.3	135.5	178.5	0	0	0	0	0	110.3	D93 N101 S106 T107	D93-A104 HydrophobicContact CB-CB 3.92Å; N101-A104 HydrophobicContact CB-CB 4.2Å; N101-A104 WeakPolarHBondContact O-CB 3.29Å; N101-A104 PolarHBondContact O-N 3.33Å; N101-A104 VanDerWaalsContact O-N 3.15Å; A104-S106 PolarHBondContact O-N 2.82Å; A104-T107 WeakPolarHBondContact O-CB 3.45Å; A104-T107 PolarHBondContact O-N 3.16Å
105	P	90.3	Very high	92.3	Very high	111 Å²	111	63.7 Å²	63.7	72%	0.721	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-19.6	-175.8	28.2	-35.8	0	0	0	113.8	T107 R108	P105-T107 VanDerWaalsContact C-N 3.33Å; P105-R108 PolarHBondContact O-NH2 3.12Å; P105-R108 VanDerWaalsContact O-NH2 3.16Å
106	S	89.3	Confident	92.2	Very high	38 Å²	38	64.2 Å²	64.2	27%	0.266	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-24.6	173.4	47.6	0	0	0	0	112.5	D93 A104	D93-S106 VanDerWaalsContact CG-OG 3.3Å; D93-S106 PolarHBondContact OD2-OG 3.44Å; A104-S106 PolarHBondContact O-N 2.82Å
107	T	94	Very high	92	Very high	12 Å²	12	62.1 Å²	62.1	7%	0.074	35%	0.345	C	S	.	.			trans	-77.2	131	-175.3	-57.8	0	0	0	0	111.2	Y87 V88 C89 C100 N101 A104 P105	Y87-T107 HydrophobicContact CD1-CG2 3.78Å; Y87-T107 HydrophobicContact CG-CG2 4.21Å; V88-T107 VanDerWaalsContact O-CA 3.29Å; V88-T107 WeakPolarHBondContact O-CA 3.25Å; C89-T107 HydrophobicContact CB-CG2 4.26Å; C89-T107 WeakPolarHBondContact CB-OG1 3.29Å; C100-T107 HydrophobicContact CB-CG2 3.98Å; N101-T107 VanDerWaalsContact O-CB 3.26Å; N101-T107 WeakPolarHBondContact O-CB 3.4Å; N101-T107 PolarHBondContact O-OG1 3.27Å; A104-T107 WeakPolarHBondContact O-CB 3.45Å; A104-T107 PolarHBondContact O-N 3.16Å; P105-T107 VanDerWaalsContact C-N 3.33Å
108	R	94.6	Very high	91.8	Very high	142 Å²	142	60.8 Å²	60.8	54%	0.536	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	138.8	179	-59.4	-65.3	174.8	-168.3	-3	110.2	Y87 V88 P105 I111	Y87-R108 CarbonylContact C-O 3.55Å; Y87-R108 WeakPolarHBondContact CA-O 3.49Å; V88-R108 PolarHBondContact N-O 2.99Å; V88-R108 PolarHBondContact O-N 2.79Å; P105-R108 PolarHBondContact O-NH2 3.12Å; P105-R108 VanDerWaalsContact O-NH2 3.16Å; R108-I111 HydrophobicContact CB-CB 4.28Å; R108-I111 HydrophobicContact CB-CD1 4.11Å; R108-I111 HydrophobicContact CG-CD1 4.28Å
109	Q	94.4	Very high	91.8	Very high	79 Å²	79	60.3 Å²	60.3	37%	0.369	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	143.2	176.8	-153.6	-177.4	8.4	0	0	111.4	L85 G86 Y87 I111	L85-Q109 PolarHBondContact O-NE2 3.31Å; L85-Q109 VanDerWaalsContact O-NE2 3.12Å; G86-Q109 WeakPolarHBondContact O-CA 3.5Å; Y87-Q109 HydrophobicContact CD1-CB 3.62Å; Y87-Q109 HydrophobicContact CD1-CG 3.79Å; Y87-Q109 HydrophobicContact CD2-CG 4.31Å; Y87-Q109 HydrophobicContact CE1-CB 3.61Å; Y87-Q109 HydrophobicContact CE1-CG 3.76Å; Y87-Q109 HydrophobicContact CE2-CG 4.25Å; Y87-Q109 HydrophobicContact CG-CB 4.34Å; Y87-Q109 HydrophobicContact CG-CG 4.07Å; Y87-Q109 PolarHBondContact OH-OE1 3.09Å; Q109-I111 VanDerWaalsContact C-N 3.3Å; Q109-I111 PolarHBondContact O-N 3.39Å
110	Y	93.8	Very high	91.8	Very high	74 Å²	74	59.8 Å²	59.8	29%	0.29	33%	0.33	S	S	.	.	S	Bend	trans	49.1	47.4	174.8	-54	-51	0	0	0	113.5	L85 G86 C112 S129 L132 Q133	L85-Y110 PolarHBondContact O-OH 3.23Å; G86-Y110 PolarHBondContact O-N 3.43Å; Y110-C112 PolarHBondContact O-N 3.02Å; Y110-S129 WeakPolarHBondContact CA-OG 3.27Å; Y110-S129 WeakPolarHBondContact CD1-O 3.42Å; Y110-S129 PolarHBondContact N-OG 2.97Å; Y110-S129 VanDerWaalsContact N-OG 3.11Å; Y110-L132 HydrophobicContact CD1-CB 4.21Å; Y110-L132 HydrophobicContact CE1-CB 3.9Å; Y110-Q133 HydrophobicContact CD1-CB 4.09Å; Y110-Q133 HydrophobicContact CD1-CG 4.45Å; Y110-Q133 HydrophobicContact CD2-CG 4.44Å; Y110-Q133 HydrophobicContact CG-CB 4.15Å; Y110-Q133 HydrophobicContact CG-CG 4.03Å
111	I	94	Very high	91.9	Very high	15 Å²	15	59.6 Å²	59.6	8%	0.077	33%	0.329	C	S	.	.			trans	-82.8	115.4	-173.4	-176	165.3	0	0	0	111.6	V88 R108 Q109 K113 Y126 S129	V88-I111 HydrophobicContact CB-CG2 4.02Å; V88-I111 HydrophobicContact CG2-CG2 3.6Å; R108-I111 HydrophobicContact CB-CB 4.28Å; R108-I111 HydrophobicContact CB-CD1 4.11Å; R108-I111 HydrophobicContact CG-CD1 4.28Å; Q109-I111 VanDerWaalsContact C-N 3.3Å; Q109-I111 PolarHBondContact O-N 3.39Å; I111-K113 HydrophobicContact CD1-CB 4.46Å; I111-K113 HydrophobicContact CD1-CD 4.04Å; I111-K113 HydrophobicContact CD1-CG 4.16Å; I111-K113 HydrophobicContact CG1-CB 4.17Å; I111-K113 HydrophobicContact CG1-CD 4.37Å; I111-K113 HydrophobicContact CG1-CG 3.94Å; I111-Y126 HydrophobicContact CD1-CE1 4.17Å; I111-Y126 HydrophobicContact CD1-CE2 4.12Å; I111-Y126 HydrophobicContact CG1-CD2 4.48Å; I111-Y126 HydrophobicContact CG1-CE2 4.44Å; I111-Y126 HydrophobicContact CG2-CD1 3.53Å; I111-Y126 HydrophobicContact CG2-CE1 3.8Å; I111-Y126 HydrophobicContact CG2-CG 4.04Å; I111-S129 PolarHBondContact N-OG 3.14Å
112	C	94.2	Very high	91.8	Very high	40 Å²	40	60 Å²	60	27%	0.27	34%	0.335	S	S	.	.			trans	-106.2	14.2	178.4	-56.9	0	0	0	0	114.1	Y110 S114 C115 C130	Y110-C112 PolarHBondContact O-N 3.02Å; C112-S114 VanDerWaalsContact C-N 3.26Å; C112-S114 PolarHBondContact O-N 2.89Å; C112-S114 VanDerWaalsContact O-N 3.14Å; C112-C115 HydrophobicContact CB-CB 4.47Å; C112-C115 WeakPolarHBondContact O-CB 3.37Å; C112-C115 PolarHBondContact O-N 2.05Å; C112-C130 HydrophobicContact CB-CB 3.89Å; C112-C130 WeakPolarHBondContact CB-SG 3.23Å; C112-C130 VanDerWaalsContact SG-CA 3.56Å; C112-C130 WeakPolarHBondContact SG-CB 2.96Å; C112-C130 CovalentContact SG-SG 2.03Å; C112-C130 PolarHBondContact SG-SG 2.92Å
113	K	91.8	Very high	91.9	Very high	177 Å²	177	58.8 Å²	58.8	77%	0.77	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-28.7	-168.4	-72.9	-171.8	-175.1	-179.2	0	115.1	I111	I111-K113 HydrophobicContact CD1-CB 4.46Å; I111-K113 HydrophobicContact CD1-CD 4.04Å; I111-K113 HydrophobicContact CD1-CG 4.16Å; I111-K113 HydrophobicContact CG1-CB 4.17Å; I111-K113 HydrophobicContact CG1-CD 4.37Å; I111-K113 HydrophobicContact CG1-CG 3.94Å
114	S	91.6	Very high	92	Very high	24 Å²	24	52.9 Å²	52.9	17%	0.168	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	8.1	179.4	71.2	0	0	0	0	113.6	C112 C121 S122 Y126	C112-S114 VanDerWaalsContact C-N 3.26Å; C112-S114 PolarHBondContact O-N 2.89Å; C112-S114 VanDerWaalsContact O-N 3.14Å; S114-C121 VanDerWaalsContact O-CA 3.25Å; S114-C121 WeakPolarHBondContact O-CA 3.41Å; S114-S122 VanDerWaalsContact CB-OG 3.31Å; S114-S122 WeakPolarHBondContact CB-OG 3.45Å; S114-S122 PolarHBondContact O-N 2.03Å; S114-S122 VanDerWaalsContact O-N 3.13Å; S114-Y126 WeakPolarHBondContact OG-CB 3.33Å; S114-Y126 VanDerWaalsContact OG-CD2 3.3Å; S114-Y126 WeakPolarHBondContact OG-CD2 3.31Å
115	C	93.2	Very high	92.1	Very high	26 Å²	26	52.9 Å²	52.9	18%	0.176	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-100.3	136.6	-173.3	-57.2	0	0	0	0	110.7	C112 C120 C121	C112-C115 HydrophobicContact CB-CB 4.47Å; C112-C115 WeakPolarHBondContact O-CB 3.37Å; C112-C115 PolarHBondContact O-N 2.05Å; C115-C120 CarbonylContact C-O 3.44Å; C115-C120 WeakPolarHBondContact CA-O 3.13Å; C115-C121 HydrophobicContact CB-CB 4.03Å; C115-C121 WeakPolarHBondContact CB-SG 3.3Å; C115-C121 WeakPolarHBondContact SG-CB 3.01Å; C115-C121 CovalentContact SG-SG 2.03Å; C115-C121 PolarHBondContact SG-SG 3.44Å
116	L	91.5	Very high	92.4	Very high	86 Å²	86	49.8 Å²	49.8	45%	0.45	27%	0.265	S	S	.	.			trans	-83.5	168.6	172.7	-62.4	177.2	0	0	0	110.4	N118 G119 C120 A187	L116-N118 VanDerWaalsContact CB-OD1 3.25Å; L116-N118 WeakPolarHBondContact CB-OD1 3.25Å; L116-N118 PolarHBondContact O-N 3.36Å; L116-G119 PolarHBondContact O-N 2.9Å; L116-C120 PolarHBondContact N-O 2.84Å; L116-A187 HydrophobicContact CD1-CB 3.54Å; L116-A187 HydrophobicContact CG-CB 4.22Å
117	A	87	Confident	92.6	Very high	117 Å²	117	48 Å²	48	97%	0.967	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.5	-178.1	0	0	0	0	0	113.7	G119	A117-G119 PolarHBondContact O-N 3.42Å
118	N	85.4	Confident	92.7	Very high	26 Å²	26	47.4 Å²	47.4	14%	0.139	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-0.1	174.5	67.2	-14	0	0	0	113.7	L116 C120	L116-N118 VanDerWaalsContact CB-OD1 3.25Å; L116-N118 WeakPolarHBondContact CB-OD1 3.25Å; L116-N118 PolarHBondContact O-N 3.36Å; N118-C120 WeakPolarHBondContact OD1-CB 3.34Å; N118-C120 PolarHBondContact OD1-N 3.47Å; N118-C120 VanDerWaalsContact OD1-N 3.15Å
119	G	89.7	Confident	92.7	Very high	3 Å²	3	40.7 Å²	40.7	3%	0.031	22%	0.223	C	C	.	.	S	Bend	trans	76.1	23.4	-178.5	0	0	0	0	0	113.6	L116 A117 C190 Y191 G192	L116-G119 PolarHBondContact O-N 2.9Å; A117-G119 PolarHBondContact O-N 3.42Å; G119-C190 WeakPolarHBondContact O-CA 3.49Å; G119-Y191 VanDerWaalsContact O-CD1 3.32Å; G119-Y191 WeakPolarHBondContact O-CD1 3.36Å; G119-Y191 WeakPolarHBondContact O-CE1 3.11Å; G119-Y191 PolarHBondContact O-N 3.28Å; G119-G192 PolarHBondContact O-N 2.96Å
120	C	92.6	Very high	92.7	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	139.3	170.9	-68	0	0	0	0	111.1	C115 L116 N118 A187 Y189 C190	C115-C120 CarbonylContact C-O 3.44Å; C115-C120 WeakPolarHBondContact CA-O 3.13Å; L116-C120 PolarHBondContact N-O 2.84Å; N118-C120 WeakPolarHBondContact OD1-CB 3.34Å; N118-C120 PolarHBondContact OD1-N 3.47Å; N118-C120 VanDerWaalsContact OD1-N 3.15Å; C120-A187 HydrophobicContact CB-CB 3.98Å; C120-Y189 CarbonylContact C-O 3.57Å; C120-Y189 WeakPolarHBondContact CA-O 3.42Å; C120-C190 HydrophobicContact CB-CB 4.03Å; C120-C190 WeakPolarHBondContact CB-SG 3.38Å; C120-C190 WeakPolarHBondContact SG-CB 3.09Å; C120-C190 CovalentContact SG-SG 2.03Å; C120-C190 PolarHBondContact SG-SG 3.39Å
121	C	93.6	Very high	92.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	153.8	-172	-42.6	0	0	0	0	111.6	S114 C115 C127 A187 K188 Y189	S114-C121 VanDerWaalsContact O-CA 3.25Å; S114-C121 WeakPolarHBondContact O-CA 3.41Å; C115-C121 HydrophobicContact CB-CB 4.03Å; C115-C121 WeakPolarHBondContact CB-SG 3.3Å; C115-C121 WeakPolarHBondContact SG-CB 3.01Å; C115-C121 CovalentContact SG-SG 2.03Å; C115-C121 PolarHBondContact SG-SG 3.44Å; C121-C127 HydrophobicContact CB-CB 3.96Å; C121-C127 VanDerWaalsContact SG-CA 3.58Å; C121-A187 CarbonylContact O-C 3.59Å; C121-K188 PolarHBondContact O-N 3.43Å; C121-Y189 PolarHBondContact N-O 3.46Å; C121-Y189 PolarHBondContact O-N 2.03Å; C121-Y189 VanDerWaalsContact O-N 3.11Å
122	S	92.3	Very high	92.7	Very high	54 Å²	54	33.3 Å²	33.3	38%	0.378	19%	0.191	S	C	.	.	S	Bend	trans	-78.7	-32.1	175.7	72.5	0	0	0	0	113.6	S114 Q186 Y189	S114-S122 VanDerWaalsContact CB-OG 3.31Å; S114-S122 WeakPolarHBondContact CB-OG 3.45Å; S114-S122 PolarHBondContact O-N 2.03Å; S114-S122 VanDerWaalsContact O-N 3.13Å; S122-Q186 WeakPolarHBondContact CA-O 3.48Å; S122-Q186 WeakPolarHBondContact CB-O 3.18Å; S122-Y189 WeakPolarHBondContact O-CD2 3.2Å; S122-Y189 WeakPolarHBondContact O-CE2 3.25Å
123	I	93	Very high	92.7	Very high	58 Å²	58	33.9 Å²	33.9	30%	0.297	19%	0.19	S	C	.	.	S	Bend	trans	-108.1	127.5	-178.7	-61.1	166.5	0	0	0	109.1	L80 E125 Y126 C127	L80-I123 HydrophobicContact CD1-CG2 4.32Å; I123-E125 VanDerWaalsContact C-N 3.35Å; I123-E125 HydrophobicContact CG2-CB 4.21Å; I123-E125 PolarHBondContact O-N 3.25Å; I123-Y126 HydrophobicContact CB-CD2 4.18Å; I123-Y126 HydrophobicContact CB-CG 4.09Å; I123-Y126 HydrophobicContact CD1-CD2 3.8Å; I123-Y126 HydrophobicContact CD1-CE2 3.63Å; I123-Y126 HydrophobicContact CD1-CG 4.43Å; I123-Y126 HydrophobicContact CG2-CD1 4.21Å; I123-Y126 HydrophobicContact CG2-CG 4.13Å; I123-Y126 PolarHBondContact O-N 2.05Å; I123-C127 PolarHBondContact O-N 3.27Å; I123-C127 VanDerWaalsContact O-N 3.09Å
124	Y	93.5	Very high	92.5	Very high	19 Å²	19	28.3 Å²	28.3	8%	0.075	17%	0.172	C	C	.	.	H	α-helix	trans	-58.4	-46.6	-179.6	175.8	-115	0	0	0	111.9	Y126 C127 V128 L166 C169 R170 Y189	Y124-Y126 VanDerWaalsContact C-N 3.29Å; Y124-Y126 PolarHBondContact O-N 3.3Å; Y124-C127 WeakPolarHBondContact O-CA 3Å; Y124-C127 VanDerWaalsContact O-CB 3.25Å; Y124-C127 WeakPolarHBondContact O-CB 3.03Å; Y124-C127 PolarHBondContact O-N 3.36Å; Y124-V128 HydrophobicContact CD1-CG2 4.45Å; Y124-V128 HydrophobicContact CD2-CG2 4.29Å; Y124-V128 HydrophobicContact CE1-CG2 4.03Å; Y124-V128 HydrophobicContact CE2-CG2 3.84Å; Y124-V128 WeakPolarHBondContact O-CG2 3.04Å; Y124-V128 PolarHBondContact O-N 3.12Å; Y124-L166 WeakPolarHBondContact OH-CD2 3.22Å; Y124-L166 PolarHBondContact OH-O 3.48Å; Y124-C169 HydrophobicContact CD2-CB 3.98Å; Y124-C169 HydrophobicContact CE2-CB 3.67Å; Y124-R170 HydrophobicContact CE2-CG 4.04Å; Y124-Y189 AromaticContact CD2-CD1 3.74Å; Y124-Y189 HydrophobicContact CD2-CD1 3.74Å; Y124-Y189 HydrophobicContact CD2-CE1 4.05Å; Y124-Y189 HydrophobicContact CD2-CG 4.21Å; Y124-Y189 HydrophobicContact CG-CD1 4.29Å; Y124-Y189 HydrophobicContact CG-CE1 4.27Å
125	E	95.2	Very high	92.4	Very high	9 Å²	9	31 Å²	31	4%	0.042	18%	0.184	C	C	.	.	H	α-helix	trans	-62.6	-36.7	-178.3	-51.3	-47.1	162.9	0	0	112.8	S74 G77 L80 T82 V88 I123 V128 S129	S74-E125 WeakPolarHBondContact CB-OE2 3.42Å; S74-E125 VanDerWaalsContact OG-CD 3.23Å; S74-E125 PolarHBondContact OG-OE1 3.15Å; S74-E125 PolarHBondContact OG-OE2 3.3Å; G77-E125 VanDerWaalsContact CA-OE1 3.26Å; G77-E125 WeakPolarHBondContact CA-OE1 3.25Å; G77-E125 PolarHBondContact N-OE1 3.16Å; L80-E125 HydrophobicContact CB-CB 4.33Å; L80-E125 HydrophobicContact CB-CG 3.99Å; T82-E125 VanDerWaalsContact OG1-CA 3.22Å; T82-E125 WeakPolarHBondContact OG1-CA 3.14Å; T82-E125 WeakPolarHBondContact OG1-CB 3.33Å; T82-E125 PolarHBondContact OG1-O 3.43Å; T82-E125 PolarHBondContact OG1-OE2 3.04Å; V88-E125 HydrophobicContact CG1-CB 4.18Å; I123-E125 VanDerWaalsContact C-N 3.35Å; I123-E125 HydrophobicContact CG2-CB 4.21Å; I123-E125 PolarHBondContact O-N 3.25Å; E125-V128 PolarHBondContact O-N 3.14Å; E125-S129 WeakPolarHBondContact O-CB 3.03Å; E125-S129 PolarHBondContact O-N 3.27Å
126	Y	95	Very high	92.2	Very high	47 Å²	47	31.9 Å²	31.9	18%	0.184	19%	0.185	C	C	.	.	H	α-helix	trans	-71.6	-33.4	175.1	-68	3.4	0	0	0	111.4	L80 V88 I111 S114 I123 Y124 C130	L80-Y126 HydrophobicContact CD1-CE1 3.94Å; V88-Y126 HydrophobicContact CB-CE1 4.46Å; V88-Y126 HydrophobicContact CG1-CD1 4.06Å; V88-Y126 HydrophobicContact CG1-CE1 3.81Å; V88-Y126 HydrophobicContact CG2-CD1 4.31Å; I111-Y126 HydrophobicContact CD1-CE1 4.17Å; I111-Y126 HydrophobicContact CD1-CE2 4.12Å; I111-Y126 HydrophobicContact CG1-CD2 4.48Å; I111-Y126 HydrophobicContact CG1-CE2 4.44Å; I111-Y126 HydrophobicContact CG2-CD1 3.53Å; I111-Y126 HydrophobicContact CG2-CE1 3.8Å; I111-Y126 HydrophobicContact CG2-CG 4.04Å; S114-Y126 WeakPolarHBondContact OG-CB 3.33Å; S114-Y126 VanDerWaalsContact OG-CD2 3.3Å; S114-Y126 WeakPolarHBondContact OG-CD2 3.31Å; I123-Y126 HydrophobicContact CB-CD2 4.18Å; I123-Y126 HydrophobicContact CB-CG 4.09Å; I123-Y126 HydrophobicContact CD1-CD2 3.8Å; I123-Y126 HydrophobicContact CD1-CE2 3.63Å; I123-Y126 HydrophobicContact CD1-CG 4.43Å; I123-Y126 HydrophobicContact CG2-CD1 4.21Å; I123-Y126 HydrophobicContact CG2-CG 4.13Å; I123-Y126 PolarHBondContact O-N 2.05Å; Y124-Y126 VanDerWaalsContact C-N 3.29Å; Y124-Y126 PolarHBondContact O-N 3.3Å; Y126-C130 WeakPolarHBondContact O-CB 3.22Å; Y126-C130 PolarHBondContact O-N 3.19Å
127	C	94.8	Very high	91.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.6	-49.5	170.7	-177.1	0	0	0	0	111.2	C121 I123 Y124 C130 C131 C169	C121-C127 HydrophobicContact CB-CB 3.96Å; C121-C127 VanDerWaalsContact SG-CA 3.58Å; I123-C127 PolarHBondContact O-N 3.27Å; I123-C127 VanDerWaalsContact O-N 3.09Å; Y124-C127 WeakPolarHBondContact O-CA 3Å; Y124-C127 VanDerWaalsContact O-CB 3.25Å; Y124-C127 WeakPolarHBondContact O-CB 3.03Å; Y124-C127 PolarHBondContact O-N 3.36Å; C127-C130 PolarHBondContact O-N 3.21Å; C127-C131 WeakPolarHBondContact O-CB 3.43Å; C127-C131 PolarHBondContact O-N 2.83Å; C127-C169 HydrophobicContact CB-CB 3.77Å; C127-C169 WeakPolarHBondContact CB-SG 3.42Å; C127-C169 PolarHBondContact O-SG 2.94Å; C127-C169 VanDerWaalsContact O-SG 3.36Å; C127-C169 WeakPolarHBondContact SG-CB 3.49Å; C127-C169 CovalentContact SG-SG 2.05Å; C127-C169 PolarHBondContact SG-SG 3.24Å
128	V	94.9	Very high	91.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.3	-48.2	-178.4	177.8	0	0	0	0	110.3	T82 Y124 E125 C130 C131 L132 F162 C165 L166 C169	T82-V128 HydrophobicContact CG2-CB 4.33Å; T82-V128 HydrophobicContact CG2-CG1 4.01Å; Y124-V128 HydrophobicContact CD1-CG2 4.45Å; Y124-V128 HydrophobicContact CD2-CG2 4.29Å; Y124-V128 HydrophobicContact CE1-CG2 4.03Å; Y124-V128 HydrophobicContact CE2-CG2 3.84Å; Y124-V128 WeakPolarHBondContact O-CG2 3.04Å; Y124-V128 PolarHBondContact O-N 3.12Å; E125-V128 PolarHBondContact O-N 3.14Å; V128-C130 PolarHBondContact O-N 2.92Å; V128-C131 WeakPolarHBondContact O-CB 3.31Å; V128-C131 PolarHBondContact O-N 3.36Å; V128-L132 HydrophobicContact CG1-CD1 4.24Å; V128-L132 WeakPolarHBondContact O-CG 3.39Å; V128-L132 PolarHBondContact O-N 3.47Å; V128-L132 VanDerWaalsContact O-N 3.11Å; V128-F162 HydrophobicContact CG1-CD2 4.37Å; V128-F162 HydrophobicContact CG1-CE2 3.92Å; V128-C165 HydrophobicContact CG1-CB 4.3Å; V128-L166 HydrophobicContact CG1-CD2 3.98Å; V128-L166 HydrophobicContact CG2-CD2 4.08Å; V128-C169 HydrophobicContact CG2-CB 3.91Å; V128-C169 PolarHBondContact N-SG 3.07Å
129	S	95.3	Very high	91.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.4	-45.2	177.9	-178.8	0	0	0	0	112.4	G86 Y110 I111 E125 C131 L132	G86-S129 PolarHBondContact O-OG 3.32Å; Y110-S129 WeakPolarHBondContact CA-OG 3.27Å; Y110-S129 WeakPolarHBondContact CD1-O 3.42Å; Y110-S129 PolarHBondContact N-OG 2.97Å; Y110-S129 VanDerWaalsContact N-OG 3.11Å; I111-S129 PolarHBondContact N-OG 3.14Å; E125-S129 WeakPolarHBondContact O-CB 3.03Å; E125-S129 PolarHBondContact O-N 3.27Å; S129-C131 PolarHBondContact O-N 2.9Å; S129-L132 PolarHBondContact O-N 2.96Å
130	C	95.3	Very high	91.6	Very high	1 Å²	1	28 Å²	28	1%	0.007	15%	0.15	C	C	.	.	H	α-helix	trans	-66	-36.6	177.7	-169.1	0	0	0	0	112.6	C112 Y126 C127 V128 L132 Q133 K136 Y191	C112-C130 HydrophobicContact CB-CB 3.89Å; C112-C130 WeakPolarHBondContact CB-SG 3.23Å; C112-C130 VanDerWaalsContact SG-CA 3.56Å; C112-C130 WeakPolarHBondContact SG-CB 2.96Å; C112-C130 CovalentContact SG-SG 2.03Å; C112-C130 PolarHBondContact SG-SG 2.92Å; Y126-C130 WeakPolarHBondContact O-CB 3.22Å; Y126-C130 PolarHBondContact O-N 3.19Å; C127-C130 PolarHBondContact O-N 3.21Å; V128-C130 PolarHBondContact O-N 2.92Å; C130-L132 VanDerWaalsContact C-N 3.3Å; C130-L132 PolarHBondContact O-N 3.38Å; C130-Q133 WeakPolarHBondContact O-CB 3.16Å; C130-Q133 PolarHBondContact O-N 2.99Å; C130-K136 WeakPolarHBondContact O-CG 3.39Å; C130-Y191 HydrophobicContact CB-CE1 4.01Å; C130-Y191 PolarHBondContact SG-OH 2.97Å
131	C	94.4	Very high	91.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-32.2	177	174.3	0	0	0	0	113.1	C127 V128 S129 Q133 H161 C165 Y191	C127-C131 WeakPolarHBondContact O-CB 3.43Å; C127-C131 PolarHBondContact O-N 2.83Å; V128-C131 WeakPolarHBondContact O-CB 3.31Å; V128-C131 PolarHBondContact O-N 3.36Å; S129-C131 PolarHBondContact O-N 2.9Å; C131-Q133 PolarHBondContact O-N 3.39Å; C131-H161 PolarHBondContact O-NE2 3.26Å; C131-C165 HydrophobicContact CB-CB 3.69Å; C131-C165 WeakPolarHBondContact CB-SG 3.38Å; C131-C165 PolarHBondContact O-SG 2.69Å; C131-C165 WeakPolarHBondContact SG-CA 3.22Å; C131-C165 WeakPolarHBondContact SG-CB 3.22Å; C131-C165 CovalentContact SG-SG 2.05Å; C131-C165 PolarHBondContact SG-SG 3.02Å; C131-Y191 HydrophobicContact CB-CD1 4.25Å; C131-Y191 HydrophobicContact CB-CG 4Å
132	L	93.2	Very high	90.6	Very high	12 Å²	12	40 Å²	40	6%	0.063	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-12.6	177.7	-74.6	168.5	0	0	0	113.4	T82 Y110 V128 S129 C130 F162 C165	T82-L132 HydrophobicContact CG2-CD1 4.44Å; Y110-L132 HydrophobicContact CD1-CB 4.21Å; Y110-L132 HydrophobicContact CE1-CB 3.9Å; V128-L132 HydrophobicContact CG1-CD1 4.24Å; V128-L132 WeakPolarHBondContact O-CG 3.39Å; V128-L132 PolarHBondContact O-N 3.47Å; V128-L132 VanDerWaalsContact O-N 3.11Å; S129-L132 PolarHBondContact O-N 2.96Å; C130-L132 VanDerWaalsContact C-N 3.3Å; C130-L132 PolarHBondContact O-N 3.38Å; L132-F162 HydrophobicContact CD1-CD2 3.84Å; L132-F162 HydrophobicContact CD1-CE2 4.22Å; L132-F162 HydrophobicContact CD2-CB 4.25Å; L132-F162 HydrophobicContact CD2-CD2 4.14Å; L132-F162 HydrophobicContact CG-CD2 4.45Å; L132-C165 HydrophobicContact CD2-CB 4.45Å; L132-C165 HydrophobicContact CG-CB 4.38Å
133	Q	92.8	Very high	90	Very high	52 Å²	52	39 Å²	39	24%	0.243	19%	0.189	C	C	.	.	S	Bend	trans	-63.7	136	-179.1	-160.7	-178.6	12.5	0	0	110.4	Y110 C130 C131 D135 K136	Y110-Q133 HydrophobicContact CD1-CB 4.09Å; Y110-Q133 HydrophobicContact CD1-CG 4.45Å; Y110-Q133 HydrophobicContact CD2-CG 4.44Å; Y110-Q133 HydrophobicContact CG-CB 4.15Å; Y110-Q133 HydrophobicContact CG-CG 4.03Å; C130-Q133 WeakPolarHBondContact O-CB 3.16Å; C130-Q133 PolarHBondContact O-N 2.99Å; C131-Q133 PolarHBondContact O-N 3.39Å; Q133-D135 WeakPolarHBondContact CB-OD1 3.5Å; Q133-D135 WeakPolarHBondContact CG-OD1 3.42Å; Q133-D135 PolarHBondContact O-N 3.11Å; Q133-D135 PolarHBondContact OE1-OD1 2.76Å; Q133-K136 HydrophobicContact CB-CG 4.31Å; Q133-K136 PolarHBondContact O-N 3.34Å
134	P	88.3	Confident	89.2	Confident	60 Å²	60	36.9 Å²	36.9	39%	0.39	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-63.9	-25.9	-173.1	22.4	-34.4	0	0	0	113.7	L61 K136 Q137	L61-P134 HydrophobicContact CD1-CB 4.23Å; P134-K136 PolarHBondContact O-N 2.99Å; P134-Q137 WeakPolarHBondContact O-CB 3.44Å; P134-Q137 VanDerWaalsContact O-CG 3.31Å; P134-Q137 WeakPolarHBondContact O-CG 3.34Å; P134-Q137 PolarHBondContact O-N 3.2Å
135	D	89.4	Confident	88.3	Confident	81 Å²	81	40 Å²	40	43%	0.433	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-68	-17.9	176.3	69.3	-28.7	0	0	0	113.2	Q133 P138	Q133-D135 WeakPolarHBondContact CB-OD1 3.5Å; Q133-D135 WeakPolarHBondContact CG-OD1 3.42Å; Q133-D135 PolarHBondContact O-N 3.11Å; Q133-D135 PolarHBondContact OE1-OD1 2.76Å; D135-P138 WeakPolarHBondContact O-CD 3.34Å
136	K	89.4	Confident	87.5	Confident	45 Å²	45	47.1 Å²	47.1	20%	0.196	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-89.5	-10.2	177.3	-51.7	-45.9	178.3	-147.7	0	113.6	C130 Q133 P134 L139 L140 Y191	C130-K136 WeakPolarHBondContact O-CG 3.39Å; Q133-K136 HydrophobicContact CB-CG 4.31Å; Q133-K136 PolarHBondContact O-N 3.34Å; P134-K136 PolarHBondContact O-N 2.99Å; K136-L139 WeakPolarHBondContact O-CB 3.49Å; K136-L139 PolarHBondContact O-N 3.1Å; K136-L139 VanDerWaalsContact O-N 3.07Å; K136-L140 WeakPolarHBondContact O-CG 3.21Å; K136-L140 PolarHBondContact O-N 3.11Å; K136-Y191 HydrophobicContact CD-CE2 4.29Å; K136-Y191 HydrophobicContact CG-CE2 4.3Å
137	Q	84	Confident	86.3	Confident	43 Å²	43	45.3 Å²	45.3	20%	0.201	22%	0.217	C	C	.	.	H	α-helix	trans	-49.6	-49.4	176.8	-69	179.4	4.3	0	0	114.3	F59 P134 L139 L140 E141	F59-Q137 HydrophobicContact CD1-CG 3.85Å; F59-Q137 HydrophobicContact CE1-CG 4.35Å; F59-Q137 HydrophobicContact CG-CG 4.37Å; P134-Q137 WeakPolarHBondContact O-CB 3.44Å; P134-Q137 VanDerWaalsContact O-CG 3.31Å; P134-Q137 WeakPolarHBondContact O-CG 3.34Å; P134-Q137 PolarHBondContact O-N 3.2Å; Q137-L139 PolarHBondContact O-N 3.49Å; Q137-L140 PolarHBondContact O-N 3.13Å; Q137-L140 VanDerWaalsContact O-N 3.13Å; Q137-E141 WeakPolarHBondContact O-CB 3.22Å; Q137-E141 PolarHBondContact O-N 3.27Å
138	P	85.7	Confident	84.9	Confident	64 Å²	64	46.1 Å²	46.1	42%	0.416	22%	0.224	S	C	.	.	H	α-helix	trans	-64.9	-28.4	-179.2	25.1	-35.8	0	0	0	113	D135 R142	D135-P138 WeakPolarHBondContact O-CD 3.34Å; P138-R142 WeakPolarHBondContact O-CG 3.29Å; P138-R142 PolarHBondContact O-N 2.99Å
139	L	87.3	Confident	83.5	Confident	42 Å²	42	55.2 Å²	55.2	22%	0.22	26%	0.264	C	S	.	.	H	α-helix	trans	-70.1	-45.3	174.3	179	154.3	0	0	0	110.6	K136 Q137 R142 F143 Y191	K136-L139 WeakPolarHBondContact O-CB 3.49Å; K136-L139 PolarHBondContact O-N 3.1Å; K136-L139 VanDerWaalsContact O-N 3.07Å; Q137-L139 PolarHBondContact O-N 3.49Å; L139-R142 PolarHBondContact O-N 3.07Å; L139-F143 PolarHBondContact O-N 2.81Å; L139-Y191 HydrophobicContact CD2-CD2 4.44Å
140	L	84.8	Confident	82	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-65.3	-39.8	179.3	-65.5	172.2	0	0	0	111.6	K136 Q137 F143 L144 H161 L164	K136-L140 WeakPolarHBondContact O-CG 3.21Å; K136-L140 PolarHBondContact O-N 3.11Å; Q137-L140 PolarHBondContact O-N 3.13Å; Q137-L140 VanDerWaalsContact O-N 3.13Å; L140-F143 WeakPolarHBondContact O-CB 3.25Å; L140-F143 PolarHBondContact O-N 3.25Å; L140-L144 WeakPolarHBondContact O-CB 3.26Å; L140-L144 VanDerWaalsContact O-CG 3.29Å; L140-L144 WeakPolarHBondContact O-CG 3.19Å; L140-L144 PolarHBondContact O-N 3.4Å; L140-H161 WeakPolarHBondContact CD1-NE2 3.33Å; L140-L164 HydrophobicContact CB-CD2 4.29Å; L140-L164 HydrophobicContact CD1-CD2 4.45Å
141	E	81.7	Confident	80.4	Confident	110 Å²	110	64 Å²	64	51%	0.514	32%	0.317	S	S	.	.	H	α-helix	trans	-63.2	-43.8	176.8	-172	-179.3	-173.5	0	0	112	Q137 F143 L144 N145	Q137-E141 WeakPolarHBondContact O-CB 3.22Å; Q137-E141 PolarHBondContact O-N 3.27Å; E141-F143 VanDerWaalsContact C-N 3.34Å; E141-F143 PolarHBondContact O-N 3.38Å; E141-L144 PolarHBondContact O-N 2.67Å; E141-N145 WeakPolarHBondContact O-CB 3.36Å; E141-N145 PolarHBondContact O-N 2.88Å; E141-N145 PolarHBondContact O-ND2 3.37Å; E141-N145 VanDerWaalsContact O-ND2 3.16Å
142	R	82.3	Confident	78.7	Confident	143 Å²	143	66.7 Å²	66.7	54%	0.54	33%	0.33	S	S	.	.	H	α-helix	trans	-60.3	-44.1	173.5	-75.4	-171.6	-59.6	-105.4	4	112	P138 L139 N145 R146 E193	P138-R142 WeakPolarHBondContact O-CG 3.29Å; P138-R142 PolarHBondContact O-N 2.99Å; L139-R142 PolarHBondContact O-N 3.07Å; R142-N145 PolarHBondContact O-N 2.9Å; R142-R146 PolarHBondContact O-N 2.63Å; R142-E193 WeakPolarHBondContact CB-OE1 3.13Å; R142-E193 IonicContact NE-OE1 3.21Å
143	F	79.6	Confident	77.2	Confident	33 Å²	33	72.8 Å²	72.8	15%	0.145	36%	0.363	C	S	.	.	H	α-helix	trans	-59.9	-48.6	175.9	174.6	-100.1	0	0	0	111.5	L139 L140 E141 N145 R146 A147 F155 K168 E193	L139-F143 PolarHBondContact O-N 2.81Å; L140-F143 WeakPolarHBondContact O-CB 3.25Å; L140-F143 PolarHBondContact O-N 3.25Å; E141-F143 VanDerWaalsContact C-N 3.34Å; E141-F143 PolarHBondContact O-N 3.38Å; F143-N145 PolarHBondContact O-N 2.88Å; F143-R146 PolarHBondContact O-N 3.01Å; F143-A147 HydrophobicContact CE1-CB 4.3Å; F143-A147 HydrophobicContact CZ-CB 4.28Å; F143-A147 VanDerWaalsContact O-CB 3.3Å; F143-A147 WeakPolarHBondContact O-CB 3.29Å; F143-A147 PolarHBondContact O-N 3.45Å; F143-F155 HydrophobicContact CE1-CE1 4.14Å; F143-F155 HydrophobicContact CE1-CE2 4.1Å; F143-F155 AromaticContact CE1-CZ 3.61Å; F143-F155 HydrophobicContact CE1-CZ 3.61Å; F143-F155 HydrophobicContact CZ-CE2 4.27Å; F143-F155 AromaticContact CZ-CZ 3.88Å; F143-F155 HydrophobicContact CZ-CZ 3.88Å; F143-K168 HydrophobicContact CD1-CD 4.42Å; F143-K168 HydrophobicContact CE1-CD 3.87Å; F143-K168 HydrophobicContact CZ-CD 4.03Å; F143-E193 HydrophobicContact CB-CG 4.11Å; F143-E193 HydrophobicContact CD2-CG 4.28Å
144	L	76.4	Confident	75.7	Confident	12 Å²	12	76 Å²	76	6%	0.063	38%	0.381	C	S	.	.	H	α-helix	trans	-59.7	-45.1	178.2	-74.3	172.8	0	0	0	111.7	V57 F59 L140 E141 R146 A147 A148 F155 L164	V57-L144 HydrophobicContact CG2-CD1 4.43Å; F59-L144 HydrophobicContact CZ-CD1 4.37Å; L140-L144 WeakPolarHBondContact O-CB 3.26Å; L140-L144 VanDerWaalsContact O-CG 3.29Å; L140-L144 WeakPolarHBondContact O-CG 3.19Å; L140-L144 PolarHBondContact O-N 3.4Å; E141-L144 PolarHBondContact O-N 2.67Å; L144-R146 VanDerWaalsContact C-N 3.29Å; L144-R146 PolarHBondContact O-N 3.43Å; L144-A147 PolarHBondContact O-N 2.68Å; L144-A148 VanDerWaalsContact O-CB 3.29Å; L144-A148 WeakPolarHBondContact O-CB 3.34Å; L144-A148 PolarHBondContact O-N 2.95Å; L144-F155 HydrophobicContact CD2-CD1 4.44Å; L144-F155 HydrophobicContact CD2-CG 4.4Å; L144-L164 HydrophobicContact CD1-CD2 3.82Å; L144-L164 HydrophobicContact CD2-CD1 3.84Å; L144-L164 HydrophobicContact CD2-CD2 4.37Å; L144-L164 HydrophobicContact CG-CD2 4.28Å
145	N	75.6	Confident	74.4	Confident	85 Å²	85	74.2 Å²	74.2	46%	0.455	37%	0.367	S	S	.	.	H	α-helix	trans	-62.9	-34.1	177.7	-77.8	-37.5	0	0	0	113	E141 R142 F143	E141-N145 WeakPolarHBondContact O-CB 3.36Å; E141-N145 PolarHBondContact O-N 2.88Å; E141-N145 PolarHBondContact O-ND2 3.37Å; E141-N145 VanDerWaalsContact O-ND2 3.16Å; R142-N145 PolarHBondContact O-N 2.9Å; F143-N145 PolarHBondContact O-N 2.88Å
146	R	76.4	Confident	73	Confident	158 Å²	158	74 Å²	74	60%	0.596	37%	0.368	S	S	*	.	H	α-helix	trans	-75.4	-43.7	173.9	-172.4	-179.5	-71.5	140.7	1.7	111.5	R142 F143 L144 A148 K149 E193	R142-R146 PolarHBondContact O-N 2.63Å; F143-R146 PolarHBondContact O-N 3.01Å; L144-R146 VanDerWaalsContact C-N 3.29Å; L144-R146 PolarHBondContact O-N 3.43Å; R146-A148 VanDerWaalsContact C-N 3.31Å; R146-A148 PolarHBondContact O-N 3.32Å; R146-K149 WeakPolarHBondContact O-CB 3.49Å; R146-K149 PolarHBondContact O-N 3.02Å; R146-K149 VanDerWaalsContact O-N 3.15Å; R146-E193 IonicContact CZ-OE2 3.62Å; R146-E193 IonicContact NH1-OE2 2.66Å; R146-E193 PolarHBondContact NH1-OE2 3.21Å; R146-E193 IonicContact NH2-OE2 3.78Å
147	A	71.1	Confident	71.7	Confident	9 Å²	9	75.7 Å²	75.7	7%	0.074	39%	0.391	C	S	.	.	H	α-helix	trans	-63.8	-37.1	179.5	0	0	0	0	0	111.8	F143 L144 K149 G150 F151 F155	F143-A147 HydrophobicContact CE1-CB 4.3Å; F143-A147 HydrophobicContact CZ-CB 4.28Å; F143-A147 VanDerWaalsContact O-CB 3.3Å; F143-A147 WeakPolarHBondContact O-CB 3.29Å; F143-A147 PolarHBondContact O-N 3.45Å; L144-A147 PolarHBondContact O-N 2.68Å; A147-K149 PolarHBondContact O-N 3.22Å; A147-K149 VanDerWaalsContact O-N 3.11Å; A147-G150 PolarHBondContact O-N 2.95Å; A147-F151 CarbonylContact O-C 3.5Å; A147-F151 PolarHBondContact O-N 3.16Å; A147-F155 HydrophobicContact CB-CD2 3.98Å; A147-F155 HydrophobicContact CB-CE2 3.76Å
148	A	64.7	Low	71	Confident	18 Å²	18	74.5 Å²	74.5	15%	0.149	39%	0.387	C	S	.	.	H	α-helix	trans	-56.3	-27.2	174.7	0	0	0	0	0	113.3	W55 L144 R146 Q152	W55-A148 HydrophobicContact CZ2-CB 3.49Å; W55-A148 VanDerWaalsContact CZ2-CB 3.49Å; L144-A148 VanDerWaalsContact O-CB 3.29Å; L144-A148 WeakPolarHBondContact O-CB 3.34Å; L144-A148 PolarHBondContact O-N 2.95Å; R146-A148 VanDerWaalsContact C-N 3.31Å; R146-A148 PolarHBondContact O-N 3.32Å; A148-Q152 WeakPolarHBondContact O-CG 3.15Å
149	K	65.8	Low	70.2	Confident	190 Å²	190	78.5 Å²	78.5	83%	0.826	40%	0.4	S	S	*	.	H	α-helix	trans	-81	-22	177.2	-63.4	-178.3	179.6	-175.8	0	113.6	R146 A147	R146-K149 WeakPolarHBondContact O-CB 3.49Å; R146-K149 PolarHBondContact O-N 3.02Å; R146-K149 VanDerWaalsContact O-N 3.15Å; A147-K149 PolarHBondContact O-N 3.22Å; A147-K149 VanDerWaalsContact O-N 3.11Å
150	G	63.6	Low	69.9	Low	54 Å²	54	78.5 Å²	78.5	56%	0.557	40%	0.4	S	S	*	.	H	α-helix	trans	-116.2	-22.3	-174.9	0	0	0	0	0	115.2	A147	A147-G150 PolarHBondContact O-N 2.95Å
151	F	62.6	Low	69.9	Low	133 Å²	133	79.3 Å²	79.3	58%	0.583	40%	0.404	S	S	*	.			trans	-149.1	59.4	-170.4	-64.6	-76.6	0	0	0	111	A147 N153 L154	A147-F151 CarbonylContact O-C 3.5Å; A147-F151 PolarHBondContact O-N 3.16Å; F151-N153 PolarHBondContact O-N 2.9Å; F151-N153 VanDerWaalsContact O-N 3.11Å; F151-L154 HydrophobicContact CB-CB 4.19Å; F151-L154 PolarHBondContact O-N 2.85Å
152	Q	58.8	Low	70.3	Confident	56 Å²	56	74.3 Å²	74.3	26%	0.262	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-33	-180	-74.6	-178.1	1.4	0	0	113.5	D48 I53 A148 T156	D48-Q152 PolarHBondContact O-NE2 2.76Å; D48-Q152 PolarHBondContact OD1-OE1 3.28Å; I53-Q152 HydrophobicContact CD1-CB 4.02Å; I53-Q152 WeakPolarHBondContact CD1-O 3.44Å; A148-Q152 WeakPolarHBondContact O-CG 3.15Å; Q152-T156 PolarHBondContact O-OG1 3.41Å
153	N	60.2	Low	70.6	Confident	140 Å²	140	70.4 Å²	70.4	75%	0.749	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-19.2	-174.2	-64.3	-22.2	0	0	0	115	F151 T156	F151-N153 PolarHBondContact O-N 2.9Å; F151-N153 VanDerWaalsContact O-N 3.11Å; N153-T156 VanDerWaalsContact C-OG1 3.29Å; N153-T156 VanDerWaalsContact CA-OG1 3.27Å; N153-T156 WeakPolarHBondContact CA-OG1 3.5Å; N153-T156 PolarHBondContact O-OG1 3.1Å
154	L	62.8	Low	71	Confident	120 Å²	120	68.9 Å²	68.9	63%	0.628	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-31	-170	-152.7	87	0	0	0	112.4	F151	F151-L154 HydrophobicContact CB-CB 4.19Å; F151-L154 PolarHBondContact O-N 2.85Å
155	F	61.2	Low	71.7	Confident	22 Å²	22	68.3 Å²	68.3	10%	0.096	36%	0.358	C	S	.	.	S	Bend	trans	-105.4	0.5	-176	-64.9	-75.1	0	0	0	113.2	W55 F143 L144 A147 A157 V158 L164	W55-F155 HydrophobicContact CH2-CB 4.06Å; W55-F155 HydrophobicContact CZ3-CB 3.74Å; F143-F155 HydrophobicContact CE1-CE1 4.14Å; F143-F155 HydrophobicContact CE1-CE2 4.1Å; F143-F155 AromaticContact CE1-CZ 3.61Å; F143-F155 HydrophobicContact CE1-CZ 3.61Å; F143-F155 HydrophobicContact CZ-CE2 4.27Å; F143-F155 AromaticContact CZ-CZ 3.88Å; F143-F155 HydrophobicContact CZ-CZ 3.88Å; L144-F155 HydrophobicContact CD2-CD1 4.44Å; L144-F155 HydrophobicContact CD2-CG 4.4Å; A147-F155 HydrophobicContact CB-CD2 3.98Å; A147-F155 HydrophobicContact CB-CE2 3.76Å; F155-A157 PolarHBondContact O-N 2.84Å; F155-V158 HydrophobicContact CD1-CG2 4.19Å; F155-V158 PolarHBondContact O-N 3.05Å; F155-V158 VanDerWaalsContact O-N 3.14Å; F155-L164 HydrophobicContact CD1-CD1 4.14Å; F155-L164 HydrophobicContact CE1-CD1 4.3Å
156	T	59	Low	72.4	Confident	75 Å²	75	65.6 Å²	65.6	46%	0.46	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-23	176.9	-16.3	0	0	0	0	112.1	I53 Q152 N153	I53-T156 HydrophobicContact CD1-CG2 4.13Å; I53-T156 HydrophobicContact CG2-CG2 4.3Å; Q152-T156 PolarHBondContact O-OG1 3.41Å; N153-T156 VanDerWaalsContact C-OG1 3.29Å; N153-T156 VanDerWaalsContact CA-OG1 3.27Å; N153-T156 WeakPolarHBondContact CA-OG1 3.5Å; N153-T156 PolarHBondContact O-OG1 3.1Å
157	A	62.4	Low	73	Confident	81 Å²	81	60.3 Å²	60.3	67%	0.669	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-6	177.2	0	0	0	0	0	114	F155	F155-A157 PolarHBondContact O-N 2.84Å
158	V	69	Low	73.8	Confident	19 Å²	19	61.6 Å²	61.6	12%	0.115	34%	0.338	C	S	.	.			trans	-92.8	109.2	-178.4	178.1	0	0	0	0	108.9	F155 E163 L164 A167	F155-V158 HydrophobicContact CD1-CG2 4.19Å; F155-V158 PolarHBondContact O-N 3.05Å; F155-V158 VanDerWaalsContact O-N 3.14Å; V158-E163 HydrophobicContact CG1-CB 4.07Å; V158-L164 VanDerWaalsContact CG1-CA 3.43Å; V158-L164 HydrophobicContact CG1-CB 3.61Å; V158-L164 HydrophobicContact CG1-CD1 4.2Å; V158-L164 VanDerWaalsContact CG1-N 3.28Å; V158-A167 HydrophobicContact CG2-CB 4.46Å
159	E	69.7	Low	75.1	Confident	148 Å²	148	60.8 Å²	60.8	69%	0.692	33%	0.331	S	S	*	.			trans	-88.5	-29	-174.5	-60.1	-169.4	167	0	0	112.7	E163	E159-E163 PolarHBondContact N-OE2 2.99Å
160	D	79.9	Confident	76.3	Confident	42 Å²	42	57.9 Å²	57.9	23%	0.225	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-141.1	160.7	-167	-158.2	5.4	0	0	0	113.2	R72 F162 E163 L164	R72-D160 IonicContact NH2-OD2 3.1Å; R72-D160 PolarHBondContact NH2-OD2 2.91Å; D160-F162 PolarHBondContact O-N 2.88Å; D160-E163 PolarHBondContact O-N 2.89Å; D160-E163 VanDerWaalsContact O-N 3.13Å; D160-L164 PolarHBondContact O-N 3.47Å
161	H	85.7	Confident	77.3	Confident	17 Å²	17	58 Å²	58	8%	0.079	31%	0.305	C	S	.	.	H	α-helix	trans	-59.4	-36.9	-178.5	-176.7	-167.5	0	0	0	111.4	V57 F59 C131 L140 L164 C165	V57-H161 HydrophobicContact CG1-CB 4.3Å; F59-H161 HydrophobicContact CD1-CB 3.93Å; F59-H161 AromaticContact CD1-CD2 3.97Å; F59-H161 AromaticContact CD1-CE1 3.94Å; F59-H161 AromaticContact CD1-CG 3.53Å; F59-H161 AromaticContact CD1-ND1 3.49Å; F59-H161 WeakPolarHBondContact CD1-ND1 3.43Å; F59-H161 HydrophobicContact CE1-CB 4.17Å; F59-H161 AromaticContact CE1-CD2 3.66Å; F59-H161 AromaticContact CE1-CG 3.68Å; C131-H161 PolarHBondContact O-NE2 3.26Å; L140-H161 WeakPolarHBondContact CD1-NE2 3.33Å; H161-L164 WeakPolarHBondContact O-CB 3.47Å; H161-L164 PolarHBondContact O-N 3.18Å; H161-C165 PolarHBondContact O-N 3.26Å; H161-C165 VanDerWaalsContact O-N 3.1Å
162	F	89.8	Confident	78.3	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-62.6	-46.5	175.1	-178.4	-124.5	0	0	0	113	R72 E84 V128 L132 D160 L164 C165 L166	R72-F162 HydrophobicContact CB-CD1 4.17Å; R72-F162 HydrophobicContact CB-CE1 3.76Å; E84-F162 HydrophobicContact CB-CB 4.16Å; E84-F162 HydrophobicContact CB-CD1 3.7Å; E84-F162 HydrophobicContact CB-CD2 4.07Å; E84-F162 HydrophobicContact CB-CE1 4.04Å; E84-F162 HydrophobicContact CB-CE2 4.37Å; E84-F162 HydrophobicContact CB-CG 3.71Å; E84-F162 HydrophobicContact CB-CZ 4.35Å; V128-F162 HydrophobicContact CG1-CD2 4.37Å; V128-F162 HydrophobicContact CG1-CE2 3.92Å; L132-F162 HydrophobicContact CD1-CD2 3.84Å; L132-F162 HydrophobicContact CD1-CE2 4.22Å; L132-F162 HydrophobicContact CD2-CB 4.25Å; L132-F162 HydrophobicContact CD2-CD2 4.14Å; L132-F162 HydrophobicContact CG-CD2 4.45Å; D160-F162 PolarHBondContact O-N 2.88Å; F162-L164 VanDerWaalsContact C-N 3.28Å; F162-L164 PolarHBondContact O-N 3.1Å; F162-C165 PolarHBondContact O-N 3.12Å; F162-L166 HydrophobicContact CD1-CD1 3.94Å; F162-L166 HydrophobicContact CD2-CG 4.4Å; F162-L166 HydrophobicContact CE1-CD1 3.53Å; F162-L166 HydrophobicContact CE1-CG 4.2Å; F162-L166 HydrophobicContact CE2-CD1 4.33Å; F162-L166 HydrophobicContact CE2-CD2 4.16Å; F162-L166 HydrophobicContact CE2-CG 4.11Å; F162-L166 HydrophobicContact CG-CD1 4.49Å; F162-L166 HydrophobicContact CZ-CD1 3.77Å; F162-L166 HydrophobicContact CZ-CD2 4.02Å; F162-L166 HydrophobicContact CZ-CG 4Å; F162-L166 WeakPolarHBondContact O-CG 3.39Å; F162-L166 PolarHBondContact O-N 3.01Å
163	E	88.4	Confident	79.2	Confident	60 Å²	60	56.5 Å²	56.5	28%	0.28	32%	0.317	S	S	.	.	H	α-helix	trans	-65.7	-34.5	178.5	-66.9	-174.3	166	0	0	112	R72 V158 E159 D160 C165 L166 A167	R72-E163 IonicContact NH1-OE1 2.69Å; R72-E163 PolarHBondContact NH1-OE1 3.21Å; R72-E163 VanDerWaalsContact NH1-OE1 3.1Å; V158-E163 HydrophobicContact CG1-CB 4.07Å; E159-E163 PolarHBondContact N-OE2 2.99Å; D160-E163 PolarHBondContact O-N 2.89Å; D160-E163 VanDerWaalsContact O-N 3.13Å; E163-C165 VanDerWaalsContact C-N 3.34Å; E163-C165 PolarHBondContact O-N 2.93Å; E163-L166 PolarHBondContact O-N 3.44Å; E163-A167 WeakPolarHBondContact O-CB 3.4Å; E163-A167 PolarHBondContact O-N 2.69Å
164	L	87.4	Confident	80.1	Confident	1 Å²	1	55 Å²	55	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-59.2	-48.4	173.7	-178.9	61.4	0	0	0	110.7	L140 L144 F155 V158 D160 H161 F162 A167 K168	L140-L164 HydrophobicContact CB-CD2 4.29Å; L140-L164 HydrophobicContact CD1-CD2 4.45Å; L144-L164 HydrophobicContact CD1-CD2 3.82Å; L144-L164 HydrophobicContact CD2-CD1 3.84Å; L144-L164 HydrophobicContact CD2-CD2 4.37Å; L144-L164 HydrophobicContact CG-CD2 4.28Å; F155-L164 HydrophobicContact CD1-CD1 4.14Å; F155-L164 HydrophobicContact CE1-CD1 4.3Å; V158-L164 VanDerWaalsContact CG1-CA 3.43Å; V158-L164 HydrophobicContact CG1-CB 3.61Å; V158-L164 HydrophobicContact CG1-CD1 4.2Å; V158-L164 VanDerWaalsContact CG1-N 3.28Å; D160-L164 PolarHBondContact O-N 3.47Å; H161-L164 WeakPolarHBondContact O-CB 3.47Å; H161-L164 PolarHBondContact O-N 3.18Å; F162-L164 VanDerWaalsContact C-N 3.28Å; F162-L164 PolarHBondContact O-N 3.1Å; L164-A167 PolarHBondContact O-N 3.22Å; L164-K168 WeakPolarHBondContact O-CB 3.12Å; L164-K168 PolarHBondContact O-N 2.56Å
165	C	91.5	Very high	80.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66	-41.1	179	-71.5	0	0	0	0	112	V128 C131 L132 H161 F162 E163 A167 C169	V128-C165 HydrophobicContact CG1-CB 4.3Å; C131-C165 HydrophobicContact CB-CB 3.69Å; C131-C165 WeakPolarHBondContact CB-SG 3.38Å; C131-C165 PolarHBondContact O-SG 2.69Å; C131-C165 WeakPolarHBondContact SG-CA 3.22Å; C131-C165 WeakPolarHBondContact SG-CB 3.22Å; C131-C165 CovalentContact SG-SG 2.05Å; C131-C165 PolarHBondContact SG-SG 3.02Å; L132-C165 HydrophobicContact CD2-CB 4.45Å; L132-C165 HydrophobicContact CG-CB 4.38Å; H161-C165 PolarHBondContact O-N 3.26Å; H161-C165 VanDerWaalsContact O-N 3.1Å; F162-C165 PolarHBondContact O-N 3.12Å; E163-C165 VanDerWaalsContact C-N 3.34Å; E163-C165 PolarHBondContact O-N 2.93Å; C165-A167 PolarHBondContact O-N 2.68Å; C165-C169 WeakPolarHBondContact O-CB 3.32Å; C165-C169 PolarHBondContact O-N 3.1Å
166	L	91.6	Very high	82	Confident	29 Å²	29	50.2 Å²	50.2	15%	0.152	28%	0.283	C	S	.	.	H	α-helix	trans	-59.2	-45.4	174.7	-72.6	177.6	0	0	0	112.1	Y124 V128 F162 E163 R170	Y124-L166 WeakPolarHBondContact OH-CD2 3.22Å; Y124-L166 PolarHBondContact OH-O 3.48Å; V128-L166 HydrophobicContact CG1-CD2 3.98Å; V128-L166 HydrophobicContact CG2-CD2 4.08Å; F162-L166 HydrophobicContact CD1-CD1 3.94Å; F162-L166 HydrophobicContact CD2-CG 4.4Å; F162-L166 HydrophobicContact CE1-CD1 3.53Å; F162-L166 HydrophobicContact CE1-CG 4.2Å; F162-L166 HydrophobicContact CE2-CD1 4.33Å; F162-L166 HydrophobicContact CE2-CD2 4.16Å; F162-L166 HydrophobicContact CE2-CG 4.11Å; F162-L166 HydrophobicContact CG-CD1 4.49Å; F162-L166 HydrophobicContact CZ-CD1 3.77Å; F162-L166 HydrophobicContact CZ-CD2 4.02Å; F162-L166 HydrophobicContact CZ-CG 4Å; F162-L166 WeakPolarHBondContact O-CG 3.39Å; F162-L166 PolarHBondContact O-N 3.01Å; E163-L166 PolarHBondContact O-N 3.44Å; L166-R170 WeakPolarHBondContact O-CG 3.42Å
167	A	88.6	Confident	82.9	Confident	46 Å²	46	51.8 Å²	51.8	38%	0.38	29%	0.285	S	S	.	.	H	α-helix	trans	-69.9	-46.1	-179.6	0	0	0	0	0	111.7	V158 E163 L164 C165 R170	V158-A167 HydrophobicContact CG2-CB 4.46Å; E163-A167 WeakPolarHBondContact O-CB 3.4Å; E163-A167 PolarHBondContact O-N 2.69Å; L164-A167 PolarHBondContact O-N 3.22Å; C165-A167 PolarHBondContact O-N 2.68Å; A167-R170 PolarHBondContact O-N 2.73Å
168	K	88.2	Confident	83.7	Confident	37 Å²	37	54.2 Å²	54.2	16%	0.161	28%	0.282	C	S	.	.	H	α-helix	trans	-67.6	-42.9	-176.2	-177.1	67.9	-178.4	178.9	0	112	F143 L164 R170 C190 Y191 G192	F143-K168 HydrophobicContact CD1-CD 4.42Å; F143-K168 HydrophobicContact CE1-CD 3.87Å; F143-K168 HydrophobicContact CZ-CD 4.03Å; L164-K168 WeakPolarHBondContact O-CB 3.12Å; L164-K168 PolarHBondContact O-N 2.56Å; K168-R170 PolarHBondContact O-N 2.04Å; K168-C190 CarbonylContact C-O 3.49Å; K168-Y191 WeakPolarHBondContact CE-O 3.34Å; K168-G192 WeakPolarHBondContact CE-O 3.13Å; K168-G192 PolarHBondContact NZ-O 3.49Å
169	C	91.7	Very high	84.3	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-10.4	-179.5	-78.5	0	0	0	0	114.2	Y124 C127 V128 C165 Y189	Y124-C169 HydrophobicContact CD2-CB 3.98Å; Y124-C169 HydrophobicContact CE2-CB 3.67Å; C127-C169 HydrophobicContact CB-CB 3.77Å; C127-C169 WeakPolarHBondContact CB-SG 3.42Å; C127-C169 PolarHBondContact O-SG 2.94Å; C127-C169 VanDerWaalsContact O-SG 3.36Å; C127-C169 WeakPolarHBondContact SG-CB 3.49Å; C127-C169 CovalentContact SG-SG 2.05Å; C127-C169 PolarHBondContact SG-SG 3.24Å; V128-C169 HydrophobicContact CG2-CB 3.91Å; V128-C169 PolarHBondContact N-SG 3.07Å; C165-C169 WeakPolarHBondContact O-CB 3.32Å; C165-C169 PolarHBondContact O-N 3.1Å; C169-Y189 WeakPolarHBondContact O-CA 3.39Å; C169-Y189 WeakPolarHBondContact O-CB 3.09Å; C169-Y189 VanDerWaalsContact O-CD1 3.25Å; C169-Y189 WeakPolarHBondContact O-CD1 3.44Å
170	R	89.7	Confident	84.6	Confident	130 Å²	130	60.5 Å²	60.5	49%	0.491	32%	0.315	S	S	.	.	S	Bend	trans	-68.1	146.7	175	-78.8	170.9	176	-176.7	1.9	110.6	Q76 Y124 L166 A167 K168 S172	Q76-R170 VanDerWaalsContact OE1-NH2 3.09Å; Y124-R170 HydrophobicContact CE2-CG 4.04Å; L166-R170 WeakPolarHBondContact O-CG 3.42Å; A167-R170 PolarHBondContact O-N 2.73Å; K168-R170 PolarHBondContact O-N 2.04Å; R170-S172 PolarHBondContact O-N 3.05Å
171	T	86	Confident	84.7	Confident	56 Å²	56	62 Å²	62	34%	0.344	33%	0.325	S	S	.	.			trans	-62.3	134.4	173.5	51.2	0	0	0	0	109.9	Y182 K188 Y189	T171-Y182 HydrophobicContact CG2-CE1 3.75Å; T171-K188 HydrophobicContact CG2-CB 4.13Å; T171-K188 HydrophobicContact CG2-CD 4.41Å; T171-K188 HydrophobicContact CG2-CG 4.06Å; T171-Y189 HydrophobicContact CG2-CD1 3.9Å; T171-Y189 HydrophobicContact CG2-CE1 3.81Å
172	S	81.8	Confident	84.6	Confident	55 Å²	55	65 Å²	65	39%	0.385	34%	0.337	S	S	.	.			trans	-121.1	173.6	-179.8	70	0	0	0	0	111.5	R170 Q174 S175	R170-S172 PolarHBondContact O-N 3.05Å; S172-Q174 PolarHBondContact O-N 3.18Å; S172-Q174 VanDerWaalsContact O-N 3.15Å; S172-Q174 PolarHBondContact OG-N 2.92Å; S172-S175 PolarHBondContact N-OG 3.48Å; S172-S175 WeakPolarHBondContact O-CB 3.26Å; S172-S175 PolarHBondContact O-N 3.21Å
173	S	79.8	Confident	84.2	Confident	102 Å²	102	68.1 Å²	68.1	71%	0.713	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-58.1	-23.6	172.1	55.7	0	0	0	0	112.9	S175 V176	S173-S175 VanDerWaalsContact C-N 3.28Å; S173-S175 PolarHBondContact O-N 2.02Å; S173-V176 WeakPolarHBondContact O-CG2 3.04Å; S173-V176 PolarHBondContact O-N 3.08Å
174	Q	78.6	Confident	84.1	Confident	109 Å²	109	65.6 Å²	65.6	51%	0.509	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-74.6	-20.4	175.2	-59.3	-175.2	13.7	0	0	112.7	S172 V176 R183 P195	S172-Q174 PolarHBondContact O-N 3.18Å; S172-Q174 VanDerWaalsContact O-N 3.15Å; S172-Q174 PolarHBondContact OG-N 2.92Å; Q174-V176 VanDerWaalsContact C-N 3.31Å; Q174-R183 WeakPolarHBondContact O-CD 3.06Å; Q174-R183 PolarHBondContact O-NE 2.91Å; Q174-P195 HydrophobicContact CB-CB 4.4Å
175	S	80.1	Confident	83.9	Confident	6 Å²	6	69.9 Å²	69.9	4%	0.042	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-83.9	-8	178.9	-46.7	0	0	0	0	112.8	S172 S173 Y182 R183	S172-S175 PolarHBondContact N-OG 3.48Å; S172-S175 WeakPolarHBondContact O-CB 3.26Å; S172-S175 PolarHBondContact O-N 3.21Å; S173-S175 VanDerWaalsContact C-N 3.28Å; S173-S175 PolarHBondContact O-N 2.02Å; S175-Y182 WeakPolarHBondContact O-CA 3.5Å; S175-R183 PolarHBondContact O-N 3.43Å
176	V	83.4	Confident	83.7	Confident	36 Å²	36	76.9 Å²	76.9	22%	0.218	40%	0.398	C	S	.	.	B	Isolated β-bridge	trans	-108.3	158.9	179.1	-59.9	0	0	0	0	111.6	S173 Q174 T181 Y182 R183	S173-V176 WeakPolarHBondContact O-CG2 3.04Å; S173-V176 PolarHBondContact O-N 3.08Å; Q174-V176 VanDerWaalsContact C-N 3.31Å; V176-T181 CarbonylContact C-O 3.51Å; V176-T181 VanDerWaalsContact CA-O 3.3Å; V176-T181 WeakPolarHBondContact CA-O 3.48Å; V176-Y182 HydrophobicContact CG1-CD1 3.95Å; V176-Y182 HydrophobicContact CG1-CE1 4.03Å; V176-R183 PolarHBondContact O-NE 3.33Å
177	Q	77.8	Confident	83.5	Confident	107 Å²	107	75.7 Å²	75.7	50%	0.5	39%	0.392	S	S	.	.			trans	-114.4	-74.8	-179.5	-174.8	179.1	8.1	0	0	111.4	T181 R183 L198	Q177-T181 PolarHBondContact N-O 3.15Å; Q177-R183 HydrophobicContact CB-CG 4.35Å; Q177-L198 HydrophobicContact CG-CD2 4.41Å
178	H	79.2	Confident	83.5	Confident	132 Å²	132	76.3 Å²	76.3	61%	0.611	39%	0.386	S	S	*	.	S	Bend	trans	-137.1	140.2	-179.1	-168.1	66.8	0	0	0	109.7	N180 T181	H178-N180 PolarHBondContact O-N 3.06Å; H178-N180 VanDerWaalsContact O-N 3.14Å; H178-T181 WeakPolarHBondContact O-CB 3.01Å; H178-T181 PolarHBondContact O-N 3.3Å; H178-T181 PolarHBondContact O-OG1 2.92Å
179	E	80.8	Confident	83.7	Confident	162 Å²	162	76.9 Å²	76.9	76%	0.757	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	37	178	-65.6	176.8	174.5	0	0	114.6	T181	E179-T181 PolarHBondContact O-N 3.35Å
180	N	77.1	Confident	83.7	Confident	138 Å²	138	77.5 Å²	77.5	74%	0.738	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	13.1	-174.8	-52.5	-50.1	0	0	0	115.6	H178 Y182	H178-N180 PolarHBondContact O-N 3.06Å; H178-N180 VanDerWaalsContact O-N 3.14Å; N180-Y182 PolarHBondContact O-N 2.88Å
181	T	82.4	Confident	83.8	Confident	72 Å²	72	72.1 Å²	72.1	44%	0.442	37%	0.371	S	S	.	.			trans	-68.4	127.3	170.4	-53.7	0	0	0	0	109.6	V176 Q177 H178 E179	V176-T181 CarbonylContact C-O 3.51Å; V176-T181 VanDerWaalsContact CA-O 3.3Å; V176-T181 WeakPolarHBondContact CA-O 3.48Å; Q177-T181 PolarHBondContact N-O 3.15Å; H178-T181 WeakPolarHBondContact O-CB 3.01Å; H178-T181 PolarHBondContact O-N 3.3Å; H178-T181 PolarHBondContact O-OG1 2.92Å; E179-T181 PolarHBondContact O-N 3.35Å
182	Y	83.1	Confident	83.7	Confident	81 Å²	81	69.6 Å²	69.6	32%	0.318	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-70.9	140.5	177.4	-69.3	-71.6	0	0	0	111.2	T171 S175 V176 N180 N184 K188	T171-Y182 HydrophobicContact CG2-CE1 3.75Å; S175-Y182 WeakPolarHBondContact O-CA 3.5Å; V176-Y182 HydrophobicContact CG1-CD1 3.95Å; V176-Y182 HydrophobicContact CG1-CE1 4.03Å; N180-Y182 PolarHBondContact O-N 2.88Å; Y182-N184 PolarHBondContact O-N 3.17Å; Y182-K188 HydrophobicContact CD1-CB 4.17Å; Y182-K188 HydrophobicContact CE1-CB 4.43Å; Y182-K188 HydrophobicContact CE2-CD 4.4Å; Y182-K188 HydrophobicContact CG-CB 4.45Å
183	R	81.9	Confident	83.6	Confident	71 Å²	71	69.9 Å²	69.9	27%	0.268	35%	0.352	S	S	.	.	S	Bend	trans	-56.8	-40.1	174.9	-65.9	-173	172.7	-118.1	-4.6	112.5	Q174 S175 V176 Q177 P196 E197 L198 L199	Q174-R183 WeakPolarHBondContact O-CD 3.06Å; Q174-R183 PolarHBondContact O-NE 2.91Å; S175-R183 PolarHBondContact O-N 3.43Å; V176-R183 PolarHBondContact O-NE 3.33Å; Q177-R183 HydrophobicContact CB-CG 4.35Å; R183-P196 HydrophobicContact CB-CB 4.26Å; R183-E197 CarbonylContact C-O 3.55Å; R183-L198 HydrophobicContact CB-CD2 3.77Å; R183-L198 HydrophobicContact CG-CD2 3.5Å; R183-L198 VanDerWaalsContact CG-CD2 3.5Å; R183-L198 HydrophobicContact CG-CG 4.47Å; R183-L199 PolarHBondContact O-N 2.84Å
184	N	84.7	Confident	83.3	Confident	7 Å²	7	68 Å²	68	4%	0.037	34%	0.338	C	S	.	.			trans	-134.6	106.8	170.9	-170.6	-35.3	0	0	0	108.3	Y182 Q186 A187 P196 E197 L199	Y182-N184 PolarHBondContact O-N 3.17Å; N184-Q186 PolarHBondContact O-N 3.13Å; N184-Q186 WeakPolarHBondContact OD1-CA 3.42Å; N184-Q186 WeakPolarHBondContact OD1-CB 3.33Å; N184-Q186 PolarHBondContact OD1-N 3.14Å; N184-A187 CarbonylContact O-C 3.58Å; N184-A187 PolarHBondContact O-N 3.02Å; N184-A187 PolarHBondContact OD1-N 3.36Å; N184-P196 HydrophobicContact CB-CB 3.92Å; N184-E197 WeakPolarHBondContact CB-O 2.98Å; N184-L199 HydrophobicContact CB-CD1 4.4Å
185	P	84.4	Confident	83.2	Confident	91 Å²	91	65.4 Å²	65.4	59%	0.591	33%	0.331	S	S	*	.	S	Bend	trans	-66.7	-23.3	179.6	26	-33.3	0	0	0	112.6
186	Q	86.3	Confident	83.1	Confident	148 Å²	148	65.3 Å²	65.3	69%	0.692	33%	0.33	S	S	*	.	S	Bend	trans	-83	-29.3	178.2	-62.6	-169.8	-24.8	0	0	113	S122 N184	S122-Q186 WeakPolarHBondContact CA-O 3.48Å; S122-Q186 WeakPolarHBondContact CB-O 3.18Å; N184-Q186 PolarHBondContact O-N 3.13Å; N184-Q186 WeakPolarHBondContact OD1-CA 3.42Å; N184-Q186 WeakPolarHBondContact OD1-CB 3.33Å; N184-Q186 PolarHBondContact OD1-N 3.14Å
187	A	87.9	Confident	82.8	Confident	4 Å²	4	69.4 Å²	69.4	3%	0.033	35%	0.347	C	S	.	.			trans	-131.3	75.8	-176.4	0	0	0	0	0	111.7	L116 C120 C121 N184 P196	L116-A187 HydrophobicContact CD1-CB 3.54Å; L116-A187 HydrophobicContact CG-CB 4.22Å; C120-A187 HydrophobicContact CB-CB 3.98Å; C121-A187 CarbonylContact O-C 3.59Å; N184-A187 CarbonylContact O-C 3.58Å; N184-A187 PolarHBondContact O-N 3.02Å; N184-A187 PolarHBondContact OD1-N 3.36Å; A187-P196 WeakPolarHBondContact O-CB 3.15Å
188	K	89.3	Confident	82.8	Confident	58 Å²	58	68.8 Å²	68.8	25%	0.252	35%	0.347	S	S	.	.			trans	-95.9	-19.7	-171.4	67.1	-167.7	179.3	-174.2	0	115.3	C121 T171 Y182	C121-K188 PolarHBondContact O-N 3.43Å; T171-K188 HydrophobicContact CG2-CB 4.13Å; T171-K188 HydrophobicContact CG2-CD 4.41Å; T171-K188 HydrophobicContact CG2-CG 4.06Å; Y182-K188 HydrophobicContact CD1-CB 4.17Å; Y182-K188 HydrophobicContact CE1-CB 4.43Å; Y182-K188 HydrophobicContact CE2-CD 4.4Å; Y182-K188 HydrophobicContact CG-CB 4.45Å
189	Y	92	Very high	82.4	Confident	50 Å²	50	65.9 Å²	65.9	20%	0.196	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	116.4	-176.2	-56.5	-68.4	0	0	0	109.9	C120 C121 S122 Y124 C169 T171	C120-Y189 CarbonylContact C-O 3.57Å; C120-Y189 WeakPolarHBondContact CA-O 3.42Å; C121-Y189 PolarHBondContact N-O 3.46Å; C121-Y189 PolarHBondContact O-N 2.03Å; C121-Y189 VanDerWaalsContact O-N 3.11Å; S122-Y189 WeakPolarHBondContact O-CD2 3.2Å; S122-Y189 WeakPolarHBondContact O-CE2 3.25Å; Y124-Y189 AromaticContact CD2-CD1 3.74Å; Y124-Y189 HydrophobicContact CD2-CD1 3.74Å; Y124-Y189 HydrophobicContact CD2-CE1 4.05Å; Y124-Y189 HydrophobicContact CD2-CG 4.21Å; Y124-Y189 HydrophobicContact CG-CD1 4.29Å; Y124-Y189 HydrophobicContact CG-CE1 4.27Å; C169-Y189 WeakPolarHBondContact O-CA 3.39Å; C169-Y189 WeakPolarHBondContact O-CB 3.09Å; C169-Y189 VanDerWaalsContact O-CD1 3.25Å; C169-Y189 WeakPolarHBondContact O-CD1 3.44Å; T171-Y189 HydrophobicContact CG2-CD1 3.9Å; T171-Y189 HydrophobicContact CG2-CE1 3.81Å
190	C	91.8	Very high	81.6	Confident	12 Å²	12	64 Å²	64	8%	0.081	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.6	-170.1	-51.7	0	0	0	0	113	G119 C120 K168 P196	G119-C190 WeakPolarHBondContact O-CA 3.49Å; C120-C190 HydrophobicContact CB-CB 4.03Å; C120-C190 WeakPolarHBondContact CB-SG 3.38Å; C120-C190 WeakPolarHBondContact SG-CB 3.09Å; C120-C190 CovalentContact SG-SG 2.03Å; C120-C190 PolarHBondContact SG-SG 3.39Å; K168-C190 CarbonylContact C-O 3.49Å; C190-P196 VanDerWaalsContact SG-CG 3.59Å
191	Y	90.6	Very high	80.7	Confident	17 Å²	17	66.3 Å²	66.3	7%	0.067	36%	0.356	C	S	.	.			trans	-99.7	-13.7	166.7	65	-97.1	0	0	0	112.8	G119 C130 C131 K136 L139 K168	G119-Y191 VanDerWaalsContact O-CD1 3.32Å; G119-Y191 WeakPolarHBondContact O-CD1 3.36Å; G119-Y191 WeakPolarHBondContact O-CE1 3.11Å; G119-Y191 PolarHBondContact O-N 3.28Å; C130-Y191 HydrophobicContact CB-CE1 4.01Å; C130-Y191 PolarHBondContact SG-OH 2.97Å; C131-Y191 HydrophobicContact CB-CD1 4.25Å; C131-Y191 HydrophobicContact CB-CG 4Å; K136-Y191 HydrophobicContact CD-CE2 4.29Å; K136-Y191 HydrophobicContact CG-CE2 4.3Å; L139-Y191 HydrophobicContact CD2-CD2 4.44Å; K168-Y191 WeakPolarHBondContact CE-O 3.34Å
192	G	85.7	Confident	80.6	Confident	3 Å²	3	66 Å²	66	3%	0.031	35%	0.351	C	S	.	.	S	Bend	trans	-63.8	168.8	178.9	0	0	0	0	0	115.3	G119 K168	G119-G192 PolarHBondContact O-N 2.96Å; K168-G192 WeakPolarHBondContact CE-O 3.13Å; K168-G192 PolarHBondContact NZ-O 3.49Å
193	E	78.3	Confident	80.4	Confident	62 Å²	62	65.2 Å²	65.2	29%	0.29	35%	0.353	S	S	.	.	S	Bend	trans	-73.7	-37.3	175.2	-69.8	-177.2	-167.6	0	0	112.3	R142 F143 R146	R142-E193 WeakPolarHBondContact CB-OE1 3.13Å; R142-E193 IonicContact NE-OE1 3.21Å; F143-E193 HydrophobicContact CB-CG 4.11Å; F143-E193 HydrophobicContact CD2-CG 4.28Å; R146-E193 IonicContact CZ-OE2 3.62Å; R146-E193 IonicContact NH1-OE2 2.66Å; R146-E193 PolarHBondContact NH1-OE2 3.21Å; R146-E193 IonicContact NH2-OE2 3.78Å
194	S	73.9	Confident	80.4	Confident	62 Å²	62	64.9 Å²	64.9	43%	0.434	36%	0.358	S	S	.	.	S	Bend	trans	-85.8	147.2	-178.1	47.1	0	0	0	0	112.1
195	P	76.1	Confident	80.1	Confident	55 Å²	55	68.3 Å²	68.3	36%	0.357	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-64.9	162.9	169.9	29.2	-34.6	0	0	0	111	Q174 E197	Q174-P195 HydrophobicContact CB-CB 4.4Å; P195-E197 PolarHBondContact O-N 3.43Å
196	P	77.9	Confident	79.8	Confident	4 Å²	4	66.9 Å²	66.9	3%	0.026	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-52.4	142.1	172.4	-15.6	21.2	0	0	0	111.6	R183 N184 A187 C190	R183-P196 HydrophobicContact CB-CB 4.26Å; N184-P196 HydrophobicContact CB-CB 3.92Å; A187-P196 WeakPolarHBondContact O-CB 3.15Å; C190-P196 VanDerWaalsContact SG-CG 3.59Å
197	E	78.6	Confident	79.4	Confident	122 Å²	122	61.5 Å²	61.5	57%	0.57	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-57.6	139.1	174.6	-71.5	176.8	-173.2	0	0	110.3	R183 N184 P195 L199	R183-E197 CarbonylContact C-O 3.55Å; N184-E197 WeakPolarHBondContact CB-O 2.98Å; P195-E197 PolarHBondContact O-N 3.43Å; E197-L199 PolarHBondContact O-N 2.78Å
198	L	76.6	Confident	78.8	Confident	94 Å²	94	65.6 Å²	65.6	49%	0.492	36%	0.363	S	S	.	.			trans	-75.5	109	174.3	-72.6	166.8	0	0	0	108.2	Q177 R183	Q177-L198 HydrophobicContact CG-CD2 4.41Å; R183-L198 HydrophobicContact CB-CD2 3.77Å; R183-L198 HydrophobicContact CG-CD2 3.5Å; R183-L198 VanDerWaalsContact CG-CD2 3.5Å; R183-L198 HydrophobicContact CG-CG 4.47Å
199	L	70.8	Confident	78	Confident	71 Å²	71	66.2 Å²	66.2	37%	0.372	37%	0.372	S	S	.	.			trans	-80.1	137.5	167.7	-67.4	178.5	0	0	0	108.9	R183 N184 E197 V201	R183-L199 PolarHBondContact O-N 2.84Å; N184-L199 HydrophobicContact CB-CD1 4.4Å; E197-L199 PolarHBondContact O-N 2.78Å; L199-V201 PolarHBondContact O-N 3.24Å
200	P	63.5	Low	76.8	Confident	123 Å²	123	67.5 Å²	67.5	80%	0.799	39%	0.387	S	S	*	.			trans	-61.6	131.5	170.9	25.6	-30.6	0	0	0	108.7
201	V	58.1	Low	75.5	Confident	185 Å²	185	72.5 Å²	72.5	100%	1.121	41%	0.414	S	S	*	.			trans	-73.1	0	176.1	-176.1	0	0	0	0	109.8	L199	L199-V201 PolarHBondContact O-N 3.24Å

Retrieved 201 of 201 residues in 37.3 ms (Link to these results)

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