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Phosphatidylinositol-4,5-bisphosphate 4-phosphatase

Catalyzes the hydrolysis of phosphatidylinositol-4,5-bisphosphate (PtdIns-4,5-P2) to phosphatidylinositol-4-phosphate (PtdIns-4-P).

AlphaFold DB , UniProt , Accession A0A077Z563, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 220 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	46	Very low	41.9	Very low	242 Å²	242	160.9 Å²	160.9	100%	1.192	87%	0.871	S	S	*	*				0	90.8	0	-72.2	170.5	157.3	0	0	106.8
2	S	44.1	Very low	41.5	Very low	126 Å²	126	161.7 Å²	161.7	88%	0.881	86%	0.864	S	S	*	*			trans	-127.1	108	-179.2	-64.7	0	0	0	0	108
3	S	42.7	Very low	41.1	Very low	131 Å²	131	157.2 Å²	157.2	92%	0.916	85%	0.85	S	S	*	*			trans	-74.7	130.8	169.9	-41.9	0	0	0	0	108.2
4	G	39.9	Very low	40.7	Very low	74 Å²	74	157.8 Å²	157.8	76%	0.763	85%	0.851	S	S	*	*			trans	-147.9	110.4	172.5	0	0	0	0	0	107.7
5	Y	40.8	Very low	40.1	Very low	227 Å²	227	158.3 Å²	158.3	89%	0.89	85%	0.846	S	S	*	*			trans	-52	140.4	-178.2	-116.9	-120.1	0	0	0	111.8	D7	Y5-D7 PolarHBondContact O-N 2.87Å
6	G	38.3	Very low	39.4	Very low	64 Å²	64	154.9 Å²	154.9	66%	0.66	84%	0.838	S	S	*	*			trans	-77.9	115.7	167.8	0	0	0	0	0	108.9	E8	G6-E8 PolarHBondContact O-N 3.29Å
7	D	44.9	Very low	39.2	Very low	154 Å²	154	153.6 Å²	153.6	82%	0.824	84%	0.837	S	S	*	*			trans	-74.5	106.8	166.3	-67.3	-60.6	0	0	0	107.8	Y5 E9	Y5-D7 PolarHBondContact O-N 2.87Å; D7-E9 VanDerWaalsContact C-N 3.33Å; D7-E9 PolarHBondContact O-N 3.04Å
8	E	44.8	Very low	38.8	Very low	187 Å²	187	149.9 Å²	149.9	87%	0.874	83%	0.83	S	S	*	*			trans	-66.8	96	165.6	-68.3	170.3	111.4	0	0	106.9	G6 E10	G6-E8 PolarHBondContact O-N 3.29Å; E8-E10 PolarHBondContact O-N 3.28Å
9	E	42.8	Very low	38.7	Very low	194 Å²	194	149.8 Å²	149.8	91%	0.907	83%	0.827	S	S	*	*			trans	-68.5	88.3	173.5	-160.5	168.1	144	0	0	108.1	D7 K11	D7-E9 VanDerWaalsContact C-N 3.33Å; D7-E9 PolarHBondContact O-N 3.04Å; E9-K11 PolarHBondContact O-N 2.89Å
10	E	39.1	Very low	38.5	Very low	184 Å²	184	150.5 Å²	150.5	86%	0.86	83%	0.829	S	S	*	*			trans	-62.2	105.7	178.6	-152.3	172.3	146.8	0	0	108.2	E8 E12	E8-E10 PolarHBondContact O-N 3.28Å; E10-E12 PolarHBondContact O-N 3.09Å
11	K	38	Very low	38.4	Very low	187 Å²	187	147 Å²	147	81%	0.813	82%	0.815	S	S	*	*			trans	-49.8	89.4	179.3	-171	174.8	-172.4	172.2	0	110.9	E9	E9-K11 PolarHBondContact O-N 2.89Å
12	E	36.4	Very low	38.1	Very low	170 Å²	170	142.1 Å²	142.1	79%	0.794	79%	0.794	S	S	*	*			trans	-57.8	129.3	173.1	-132.3	-163.8	133.2	0	0	108	E10 L14	E10-E12 PolarHBondContact O-N 3.09Å; E12-L14 PolarHBondContact O-N 2.91Å
13	P	36.3	Very low	38.2	Very low	104 Å²	104	140.7 Å²	140.7	68%	0.675	78%	0.78	S	S	*	*			trans	-56.2	138.7	-174	-20.9	31.3	0	0	0	109	E15	P13-E15 PolarHBondContact O-N 3.05Å
14	L	36.4	Very low	38.5	Very low	165 Å²	165	138.3 Å²	138.3	86%	0.864	76%	0.757	S	S	*	*			trans	-55.8	85.7	162.9	-81.9	106.8	0	0	0	107.8	E12 S16	E12-L14 PolarHBondContact O-N 2.91Å; L14-S16 PolarHBondContact O-N 3.47Å
15	E	31	Very low	38.8	Very low	165 Å²	165	140 Å²	140	77%	0.771	75%	0.748	S	S	*	*			trans	-61.6	97.2	155.3	-85.9	-156.4	102.2	0	0	103.8	P13 T17	P13-E15 PolarHBondContact O-N 3.05Å; E15-T17 PolarHBondContact O-N 2.75Å
16	S	29.3	Very low	39.2	Very low	104 Å²	104	129.6 Å²	129.6	73%	0.727	71%	0.709	S	S	*	*			trans	-38.1	91.5	164.6	44.6	0	0	0	0	108.4	L14 A18	L14-S16 PolarHBondContact O-N 3.47Å; S16-A18 PolarHBondContact O-N 2.83Å
17	T	35.3	Very low	39.9	Very low	134 Å²	134	129.4 Å²	129.4	82%	0.822	69%	0.689	S	S	*	*			trans	-66.7	56.5	155.2	47	0	0	0	0	106.7	E15 L19	E15-T17 PolarHBondContact O-N 2.75Å; T17-L19 PolarHBondContact O-N 3.09Å
18	A	32.5	Very low	40.2	Very low	86 Å²	86	123.8 Å²	123.8	71%	0.711	66%	0.661	S	S	*	*			trans	-66.3	83.8	157.8	0	0	0	0	0	104.6	S16 L20	S16-A18 PolarHBondContact O-N 2.83Å; A18-L20 PolarHBondContact O-N 3.03Å
19	L	36.9	Very low	40.4	Very low	148 Å²	148	118.2 Å²	118.2	78%	0.775	64%	0.637	S	S	*	*			trans	2.3	112.4	157	-62.7	172.1	0	0	0	111.2	T17 S21	T17-L19 PolarHBondContact O-N 3.09Å; L19-S21 PolarHBondContact O-N 3.46Å
20	L	34	Very low	41	Very low	164 Å²	164	115.4 Å²	115.4	86%	0.859	62%	0.619	S	S	*	*			trans	-45.5	69.1	144.8	-64.5	163.9	0	0	0	108.8	A18 N22	A18-L20 PolarHBondContact O-N 3.03Å; L20-N22 PolarHBondContact O-N 3.37Å
21	S	36.9	Very low	41.5	Very low	77 Å²	77	110.3 Å²	110.3	54%	0.538	59%	0.592	S	S	.	*			trans	-68.7	97.2	162.6	64.1	0	0	0	0	101.8	L19 T23	L19-S21 PolarHBondContact O-N 3.46Å; S21-T23 PolarHBondContact O-N 2.87Å; S21-T23 PolarHBondContact O-OG1 3.03Å; S21-T23 WeakPolarHBondContact OG-CG2 3.14Å
22	N	40.5	Very low	42	Very low	140 Å²	140	105.9 Å²	105.9	75%	0.749	58%	0.58	S	S	*	*			trans	-58.9	63.4	161.4	-72.2	-54.3	0	0	0	107.2	L20 N24	L20-N22 PolarHBondContact O-N 3.37Å; N22-N24 PolarHBondContact O-N 3.19Å
23	T	45.9	Very low	42.5	Very low	95 Å²	95	106 Å²	106	58%	0.583	57%	0.573	S	S	*	*			trans	-70.1	82.3	173.9	42.1	0	0	0	0	103.4	S21 D25	S21-T23 PolarHBondContact O-N 2.87Å; S21-T23 PolarHBondContact O-OG1 3.03Å; S21-T23 WeakPolarHBondContact OG-CG2 3.14Å; T23-D25 PolarHBondContact O-N 2.8Å
24	N	49.3	Very low	43.2	Very low	82 Å²	82	105 Å²	105	44%	0.439	56%	0.562	S	S	.	*			trans	-61.3	25.7	154.2	-70.4	-46.5	0	0	0	110.2	N22 S26 A145	N22-N24 PolarHBondContact O-N 3.19Å; N24-S26 VanDerWaalsContact C-N 3.29Å; N24-S26 PolarHBondContact O-N 3.13Å; N24-A145 HydrophobicContact CB-CB 4.37Å
25	D	44.6	Very low	43.8	Very low	109 Å²	109	100.7 Å²	100.7	58%	0.583	54%	0.537	S	S	*	.			trans	-53.8	108.1	162.5	-126.5	-16.8	0	0	0	103.7	T23 Y27	T23-D25 PolarHBondContact O-N 2.8Å; D25-Y27 PolarHBondContact O-N 2.83Å
26	S	50.2	Low	44.1	Very low	9 Å²	9	96.5 Å²	96.5	6%	0.063	54%	0.539	C	S	.	.			trans	-47	117.8	-162.1	-174.6	0	0	0	0	107.7	N24 C28 D29 W30 P147	N24-S26 VanDerWaalsContact C-N 3.29Å; N24-S26 PolarHBondContact O-N 3.13Å; S26-C28 CarbonylContact O-C 3.51Å; S26-C28 PolarHBondContact O-N 2.89Å; S26-C28 VanDerWaalsContact OG-CB 3.29Å; S26-C28 WeakPolarHBondContact OG-CB 3.35Å; S26-C28 PolarHBondContact OG-N 2.71Å; S26-D29 VanDerWaalsContact CB-OD2 3.27Å; S26-D29 WeakPolarHBondContact CB-OD2 3.14Å; S26-D29 CarbonylContact O-C 3.56Å; S26-D29 WeakPolarHBondContact O-CA 3.46Å; S26-D29 WeakPolarHBondContact O-CB 3.35Å; S26-D29 PolarHBondContact O-N 3.03Å; S26-W30 PolarHBondContact O-N 3.31Å; S26-P147 WeakPolarHBondContact OG-CB 2.91Å; S26-P147 VanDerWaalsContact OG-CG 3.25Å; S26-P147 WeakPolarHBondContact OG-CG 3.46Å
27	Y	52.9	Low	44.2	Very low	59 Å²	59	93.8 Å²	93.8	23%	0.231	53%	0.527	C	S	.	.	H	α-helix	trans	-55.2	-24.8	172.9	-179.7	-92.7	0	0	0	110	D25 W30 W31 I136	D25-Y27 PolarHBondContact O-N 2.83Å; Y27-W30 HydrophobicContact CD2-CD2 4.39Å; Y27-W30 AromaticContact CD2-CE3 3.78Å; Y27-W30 HydrophobicContact CD2-CE3 3.78Å; Y27-W30 HydrophobicContact CD2-CZ3 4.38Å; Y27-W30 HydrophobicContact CE2-CD2 4.25Å; Y27-W30 AromaticContact CE2-CE3 3.32Å; Y27-W30 HydrophobicContact CE2-CE3 3.32Å; Y27-W30 HydrophobicContact CE2-CH2 4.48Å; Y27-W30 AromaticContact CE2-CZ3 3.48Å; Y27-W30 HydrophobicContact CE2-CZ3 3.48Å; Y27-W30 VanDerWaalsContact CE2-CZ3 3.48Å; Y27-W30 AromaticContact CZ-CE3 3.91Å; Y27-W30 AromaticContact CZ-CZ3 3.86Å; Y27-W30 PolarHBondContact O-N 3.46Å; Y27-W31 HydrophobicContact CD1-CB 4.17Å; Y27-W31 HydrophobicContact CE1-CB 3.91Å; Y27-W31 AromaticContact CE1-CD1 3.85Å; Y27-W31 HydrophobicContact CE1-CG 4.06Å; Y27-W31 AromaticContact CZ-CD1 3.89Å; Y27-W31 WeakPolarHBondContact O-CA 3.47Å; Y27-W31 WeakPolarHBondContact O-CB 3.38Å; Y27-W31 PolarHBondContact O-N 3.48Å; Y27-I136 HydrophobicContact CD1-CB 3.65Å; Y27-I136 HydrophobicContact CD1-CD1 3.76Å; Y27-I136 HydrophobicContact CD1-CG1 4.19Å; Y27-I136 HydrophobicContact CD1-CG2 4Å; Y27-I136 HydrophobicContact CE1-CB 4.15Å; Y27-I136 HydrophobicContact CE1-CD1 3.64Å; Y27-I136 HydrophobicContact CE1-CG1 4.46Å; Y27-I136 HydrophobicContact CE1-CG2 4.09Å; Y27-I136 HydrophobicContact CG-CB 4.4Å
28	C	50.7	Low	43.9	Very low	37 Å²	37	92 Å²	92	25%	0.25	53%	0.526	C	S	.	.	H	α-helix	trans	-59.2	-44.9	168.1	-56.3	0	0	0	0	112.2	S26 W31 V32 L134	S26-C28 CarbonylContact O-C 3.51Å; S26-C28 PolarHBondContact O-N 2.89Å; S26-C28 VanDerWaalsContact OG-CB 3.29Å; S26-C28 WeakPolarHBondContact OG-CB 3.35Å; S26-C28 PolarHBondContact OG-N 2.71Å; C28-W31 PolarHBondContact O-N 3.23Å; C28-V32 VanDerWaalsContact O-CB 3.23Å; C28-V32 WeakPolarHBondContact O-CB 3.35Å; C28-V32 WeakPolarHBondContact O-CG2 3.1Å; C28-V32 PolarHBondContact O-N 3.03Å; C28-L134 PolarHBondContact SG-O 2.78Å
29	D	49.1	Very low	43.9	Very low	69 Å²	69	94 Å²	94	37%	0.369	53%	0.529	S	S	.	.	H	α-helix	trans	-71	-41.6	177.8	-64.1	-26.4	0	0	0	111.3	S26 W31 V32 R33	S26-D29 VanDerWaalsContact CB-OD2 3.27Å; S26-D29 WeakPolarHBondContact CB-OD2 3.14Å; S26-D29 CarbonylContact O-C 3.56Å; S26-D29 WeakPolarHBondContact O-CA 3.46Å; S26-D29 WeakPolarHBondContact O-CB 3.35Å; S26-D29 PolarHBondContact O-N 3.03Å; D29-W31 VanDerWaalsContact C-N 3.33Å; D29-W31 PolarHBondContact O-N 3.28Å; D29-V32 PolarHBondContact O-N 3.48Å; D29-R33 WeakPolarHBondContact O-CB 3.35Å; D29-R33 WeakPolarHBondContact O-CD 3.11Å; D29-R33 WeakPolarHBondContact O-CG 3.05Å; D29-R33 PolarHBondContact O-N 3.27Å
30	W	54.9	Low	43.7	Very low	136 Å²	136	94.5 Å²	94.5	52%	0.515	53%	0.531	S	S	.	.	H	α-helix	trans	-59.7	-44.7	172.8	-178.9	92.4	0	0	0	111.3	S26 Y27 R33 N34	S26-W30 PolarHBondContact O-N 3.31Å; Y27-W30 HydrophobicContact CD2-CD2 4.39Å; Y27-W30 AromaticContact CD2-CE3 3.78Å; Y27-W30 HydrophobicContact CD2-CE3 3.78Å; Y27-W30 HydrophobicContact CD2-CZ3 4.38Å; Y27-W30 HydrophobicContact CE2-CD2 4.25Å; Y27-W30 AromaticContact CE2-CE3 3.32Å; Y27-W30 HydrophobicContact CE2-CE3 3.32Å; Y27-W30 HydrophobicContact CE2-CH2 4.48Å; Y27-W30 AromaticContact CE2-CZ3 3.48Å; Y27-W30 HydrophobicContact CE2-CZ3 3.48Å; Y27-W30 VanDerWaalsContact CE2-CZ3 3.48Å; Y27-W30 AromaticContact CZ-CE3 3.91Å; Y27-W30 AromaticContact CZ-CZ3 3.86Å; Y27-W30 PolarHBondContact O-N 3.46Å; W30-R33 PolarHBondContact O-N 2.87Å; W30-N34 HydrophobicContact CD2-CB 4.46Å; W30-N34 HydrophobicContact CZ2-CB 4.44Å; W30-N34 WeakPolarHBondContact CZ2-ND2 3.44Å; W30-N34 PolarHBondContact NE1-ND2 3.2Å; W30-N34 VanDerWaalsContact O-CB 3.24Å; W30-N34 WeakPolarHBondContact O-CB 3.37Å; W30-N34 PolarHBondContact O-N 2.69Å
31	W	50.1	Low	43.4	Very low	77 Å²	77	95.6 Å²	95.6	29%	0.292	53%	0.53	S	S	.	.	H	α-helix	trans	-70.8	-37.5	-178.8	-169.5	83.3	0	0	0	111.7	Y27 C28 D29 Q35 V105	Y27-W31 HydrophobicContact CD1-CB 4.17Å; Y27-W31 HydrophobicContact CE1-CB 3.91Å; Y27-W31 AromaticContact CE1-CD1 3.85Å; Y27-W31 HydrophobicContact CE1-CG 4.06Å; Y27-W31 AromaticContact CZ-CD1 3.89Å; Y27-W31 WeakPolarHBondContact O-CA 3.47Å; Y27-W31 WeakPolarHBondContact O-CB 3.38Å; Y27-W31 PolarHBondContact O-N 3.48Å; C28-W31 PolarHBondContact O-N 3.23Å; D29-W31 VanDerWaalsContact C-N 3.33Å; D29-W31 PolarHBondContact O-N 3.28Å; W31-Q35 VanDerWaalsContact CE3-NE2 3.31Å; W31-Q35 WeakPolarHBondContact O-CG 3.13Å; W31-Q35 PolarHBondContact O-N 3.36Å; W31-V105 HydrophobicContact CH2-CG2 4.39Å; W31-V105 HydrophobicContact CZ3-CG2 4.48Å
32	V	49.5	Very low	42.9	Very low	94 Å²	94	100.6 Å²	100.6	57%	0.57	54%	0.542	S	S	*	.	H	α-helix	trans	-66.5	-41.1	172.1	169.2	0	0	0	0	111	C28 D29	C28-V32 VanDerWaalsContact O-CB 3.23Å; C28-V32 WeakPolarHBondContact O-CB 3.35Å; C28-V32 WeakPolarHBondContact O-CG2 3.1Å; C28-V32 PolarHBondContact O-N 3.03Å; D29-V32 PolarHBondContact O-N 3.48Å
33	R	47.3	Very low	42.2	Very low	173 Å²	173	100.2 Å²	100.2	65%	0.653	54%	0.536	S	S	*	.	H	α-helix	trans	-72.4	-40.8	179.9	-73	171.7	-174.6	173.9	4.9	112.7	D29 W30 Q35	D29-R33 WeakPolarHBondContact O-CB 3.35Å; D29-R33 WeakPolarHBondContact O-CD 3.11Å; D29-R33 WeakPolarHBondContact O-CG 3.05Å; D29-R33 PolarHBondContact O-N 3.27Å; W30-R33 PolarHBondContact O-N 2.87Å; R33-Q35 VanDerWaalsContact C-N 3.29Å; R33-Q35 PolarHBondContact O-N 2.76Å
34	N	50.1	Low	41.4	Very low	81 Å²	81	99.2 Å²	99.2	43%	0.433	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-85.5	6.4	-176.3	-79.8	-3.3	0	0	0	114.7	W30 G36 G37	W30-N34 HydrophobicContact CD2-CB 4.46Å; W30-N34 HydrophobicContact CZ2-CB 4.44Å; W30-N34 WeakPolarHBondContact CZ2-ND2 3.44Å; W30-N34 PolarHBondContact NE1-ND2 3.2Å; W30-N34 VanDerWaalsContact O-CB 3.24Å; W30-N34 WeakPolarHBondContact O-CB 3.37Å; W30-N34 PolarHBondContact O-N 2.69Å; N34-G36 PolarHBondContact O-N 3.37Å; N34-G37 PolarHBondContact O-N 2.85Å
35	Q	49.4	Very low	40.3	Very low	76 Å²	76	103 Å²	103	36%	0.355	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-67.3	-15.5	165.8	-84.5	172	4.5	0	0	113.6	W31 R33 F46	W31-Q35 VanDerWaalsContact CE3-NE2 3.31Å; W31-Q35 WeakPolarHBondContact O-CG 3.13Å; W31-Q35 PolarHBondContact O-N 3.36Å; R33-Q35 VanDerWaalsContact C-N 3.29Å; R33-Q35 PolarHBondContact O-N 2.76Å; Q35-F46 HydrophobicContact CG-CE2 4.32Å
36	G	37.2	Very low	39.4	Very low	77 Å²	77	103.9 Å²	103.9	79%	0.794	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-92.1	-4	176.5	0	0	0	0	0	115.6	N34	N34-G36 PolarHBondContact O-N 3.37Å
37	G	30.8	Very low	38.1	Very low	47 Å²	47	110.7 Å²	110.7	49%	0.485	57%	0.569	S	S	.	*	S	Bend	trans	-105.3	119.5	-175.6	0	0	0	0	0	111.7	N34 V39	N34-G37 PolarHBondContact O-N 2.85Å; G37-V39 PolarHBondContact O-N 2.8Å
38	A	28.6	Very low	36.7	Very low	96 Å²	96	117.4 Å²	117.4	79%	0.793	60%	0.599	S	S	*	*			trans	-48.7	101	-179.6	0	0	0	0	0	113.5
39	V	34.2	Very low	35.4	Very low	128 Å²	128	123.7 Å²	123.7	78%	0.776	62%	0.622	S	S	*	*			trans	-100.8	105.2	148.3	-162.3	0	0	0	0	105	G37 F41	G37-V39 PolarHBondContact O-N 2.8Å; V39-F41 PolarHBondContact O-N 3.22Å
40	L	30.8	Very low	34.2	Very low	158 Å²	158	130.3 Å²	130.3	83%	0.827	65%	0.647	S	S	*	*			trans	-67.4	78.3	170.5	-63.8	-174.7	0	0	0	108.4
41	F	28.8	Very low	32.8	Very low	188 Å²	188	129.4 Å²	129.4	83%	0.825	65%	0.652	S	S	*	*	S	Bend	trans	-153.2	78.6	162.4	-128	-95.2	0	0	0	107.6	V39	V39-F41 PolarHBondContact O-N 3.22Å
42	F	26.1	Very low	31.5	Very low	182 Å²	182	131 Å²	131	80%	0.798	67%	0.671	S	S	*	*			trans	36.4	102.4	155	-70.5	-88.6	0	0	0	120.1
43	E	25.7	Very low	30.4	Very low	132 Å²	132	133 Å²	133	62%	0.617	68%	0.682	S	S	*	*			trans	64.5	95	141.9	-65.6	-162.7	118.5	0	0	119.7	Q102	E43-Q102 PolarHBondContact O-OE1 3.04Å
44	I	29.4	Very low	29.4	Very low	73 Å²	73	133.7 Å²	133.7	37%	0.374	69%	0.691	S	S	.	*			trans	-138.1	89.2	139	-50.4	177.3	0	0	0	108.5	Q102 Q103	I44-Q102 VanDerWaalsContact CD1-C 3.43Å; I44-Q102 HydrophobicContact CD1-CB 3.59Å; I44-Q102 WeakPolarHBondContact CD1-O 3.28Å; I44-Q102 HydrophobicContact CG1-CB 3.63Å; I44-Q102 HydrophobicContact CG2-CB 4.48Å; I44-Q103 HydrophobicContact CD1-CG 4.34Å; I44-Q103 HydrophobicContact CG2-CG 3.65Å
45	Q	26.1	Very low	28.2	Very low	161 Å²	161	134.3 Å²	134.3	75%	0.752	71%	0.707	S	S	*	*			trans	-61.5	133.2	179	-74.7	-75.4	-23.1	0	0	112.2
46	F	25.4	Very low	27.3	Very low	128 Å²	128	134.2 Å²	134.2	56%	0.561	73%	0.726	S	S	*	*			trans	-88.2	113.4	-170.1	-132.1	-104.7	0	0	0	111.8	Q35 K48	Q35-F46 HydrophobicContact CG-CE2 4.32Å; F46-K48 PolarHBondContact O-N 2.9Å
47	F	23.3	Very low	26.8	Very low	153 Å²	153	137.8 Å²	137.8	67%	0.671	73%	0.727	S	S	*	*			trans	-74	98	177.3	-109.1	-105.8	0	0	0	111.7	K49	F47-K49 HydrophobicContact CD1-CB 4.09Å; F47-K49 HydrophobicContact CE1-CB 4.32Å
48	K	23.5	Very low	27	Very low	200 Å²	200	145 Å²	145	87%	0.87	75%	0.748	S	S	*	*			trans	-97.9	72.9	149.2	-78.4	-176.3	177.4	177.6	0	108.4	F46	F46-K48 PolarHBondContact O-N 2.9Å
49	K	23.7	Very low	27	Very low	168 Å²	168	148.6 Å²	148.6	73%	0.73	75%	0.749	S	S	*	*			trans	-133.4	109.5	170	-102.7	177.9	179.1	177.1	0	111.1	F47 L51	F47-K49 HydrophobicContact CD1-CB 4.09Å; F47-K49 HydrophobicContact CE1-CB 4.32Å; K49-L51 PolarHBondContact O-N 3.05Å
50	K	23.5	Very low	26.9	Very low	208 Å²	208	150.1 Å²	150.1	90%	0.904	75%	0.747	S	S	*	*			trans	-9.6	100.5	158.7	-149.2	168.5	-175.5	180	0	112.7	T52	K50-T52 PolarHBondContact O-N 2.81Å
51	L	25.5	Very low	26.7	Very low	118 Å²	118	150.1 Å²	150.1	62%	0.618	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-75.2	117.1	172.9	-105.8	99.5	0	0	0	109.3	K49 L109	K49-L51 PolarHBondContact O-N 3.05Å; L51-L109 HydrophobicContact CD1-CD1 4.16Å; L51-L109 HydrophobicContact CD2-CD1 3.43Å; L51-L109 VanDerWaalsContact CD2-CD1 3.43Å; L51-L109 HydrophobicContact CG-CD1 4.32Å
52	T	23.6	Very low	26.7	Very low	111 Å²	111	148 Å²	148	68%	0.681	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-82.3	124.9	158.5	40.8	0	0	0	0	108.6	K50	K50-T52 PolarHBondContact O-N 2.81Å
53	V	24.6	Very low	27.1	Very low	134 Å²	134	146.8 Å²	146.8	81%	0.812	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-68.4	123.8	179.1	177	0	0	0	0	108.9
54	F	27	Very low	27.2	Very low	188 Å²	188	148.8 Å²	148.8	83%	0.825	74%	0.742	S	S	*	*			trans	-108.2	113.3	161.6	-79.4	-80.8	0	0	0	107.9	G56	F54-G56 PolarHBondContact O-N 3.15Å
55	A	25.6	Very low	27.2	Very low	94 Å²	94	153.1 Å²	153.1	78%	0.777	76%	0.761	S	S	*	*			trans	-72.2	115.2	164.2	0	0	0	0	0	107.2
56	G	29.1	Very low	27.9	Very low	74 Å²	74	151.6 Å²	151.6	76%	0.763	76%	0.762	S	S	*	*			trans	-121.6	97.1	173.6	0	0	0	0	0	108.1	F54 Q58	F54-G56 PolarHBondContact O-N 3.15Å; G56-Q58 PolarHBondContact O-N 2.94Å
57	D	27.6	Very low	28.1	Very low	153 Å²	153	151.6 Å²	151.6	82%	0.818	78%	0.775	S	S	*	*			trans	-63	120.2	164.8	-70.7	-56.3	0	0	0	109
58	Q	36	Very low	28.4	Very low	197 Å²	197	148.7 Å²	148.7	92%	0.921	78%	0.779	S	S	*	*			trans	-135.1	108.2	155.1	-73.5	-162.6	-17.2	0	0	109.3	G56	G56-Q58 PolarHBondContact O-N 2.94Å
59	Q	27.5	Very low	28.8	Very low	173 Å²	173	144.4 Å²	144.4	81%	0.808	77%	0.772	S	S	*	*			trans	-63.6	172.6	166.5	-66.9	163.2	-42.4	0	0	111.7
60	Q	31.7	Very low	29.2	Very low	159 Å²	159	142.2 Å²	142.2	74%	0.743	78%	0.775	S	S	*	*			trans	114.2	100.8	159	-65.8	171	-1	0	0	111.5
61	Q	27.7	Very low	29.6	Very low	158 Å²	158	141.4 Å²	141.4	74%	0.738	77%	0.774	S	S	*	*				66.6	124.4	91.5	-71.1	168.7	-14.5	0	0	107.7
62	Q	28.7	Very low	29.8	Very low	143 Å²	143	141.5 Å²	141.5	67%	0.668	78%	0.78	S	S	*	*				176.3	144.7	55.6	-148.9	153	-2.2	0	0	109
63	E	33.1	Very low	30.1	Very low	157 Å²	157	142.1 Å²	142.1	73%	0.734	79%	0.786	S	S	*	*			trans	46.1	109.5	147.1	-74.9	145	67.5	0	0	119.3
64	E	29.5	Very low	30.4	Very low	175 Å²	175	141 Å²	141	82%	0.818	78%	0.78	S	S	*	*				80.7	120.4	73.8	-165.8	143	135.2	0	0	113.4
65	E	29.6	Very low	31	Very low	163 Å²	163	137.8 Å²	137.8	76%	0.762	78%	0.777	S	S	*	*			trans	73.3	112.1	153.2	-152.8	130.5	129.9	0	0	120.6
66	V	38.8	Very low	31.5	Very low	130 Å²	130	142.3 Å²	142.3	79%	0.788	78%	0.783	S	S	*	*				174.4	126.7	115.7	173.4	0	0	0	0	108.6
67	P	30.3	Very low	32.3	Very low	127 Å²	127	143.1 Å²	143.1	83%	0.825	78%	0.782	S	S	*	*			trans	-94.2	130	175.6	34.4	-27.5	0	0	0	112
68	A	30.4	Very low	33	Very low	92 Å²	92	145.1 Å²	145.1	76%	0.76	79%	0.786	S	S	*	*			trans	-146.4	153.4	164.2	0	0	0	0	0	110.8
69	P	31.8	Very low	33.7	Very low	110 Å²	110	140.3 Å²	140.3	71%	0.714	76%	0.764	S	S	*	*			trans	-104.2	-170.3	-146.6	44.6	-38.4	0	0	0	113.4
70	P	31.9	Very low	34.7	Very low	123 Å²	123	135.6 Å²	135.6	80%	0.799	75%	0.75	S	S	*	*				-84.4	114.2	-117.4	29.8	-8.7	0	0	0	112.3
71	Q	32.3	Very low	35.8	Very low	190 Å²	190	137.9 Å²	137.9	89%	0.888	76%	0.761	S	S	*	*			trans	-87.7	125.4	173.6	-63	-173.3	14.6	0	0	110.3
72	T	29.1	Very low	37.1	Very low	120 Å²	120	134 Å²	134	74%	0.736	76%	0.763	S	S	*	*			trans	-33.6	139.7	169.8	-42.5	0	0	0	0	112.7	T74	T72-T74 PolarHBondContact O-N 3.48Å
73	P	30.9	Very low	38.7	Very low	125 Å²	125	129.6 Å²	129.6	81%	0.812	75%	0.748	S	S	*	*			trans	-70.8	92.9	-171.8	30.1	-34.7	0	0	0	109.9
74	T	31	Very low	40.9	Very low	110 Å²	110	128.7 Å²	128.7	68%	0.675	74%	0.742	S	S	*	*			trans	-70.5	134.1	161.7	47.5	0	0	0	0	107.3	T72 E76	T72-T74 PolarHBondContact O-N 3.48Å; T74-E76 VanDerWaalsContact C-N 3.35Å; T74-E76 PolarHBondContact O-N 2.9Å
75	P	39.4	Very low	43.8	Very low	120 Å²	120	125.5 Å²	125.5	78%	0.779	73%	0.726	S	S	*	*			trans	-67.2	99.9	175.5	26.8	-30.1	0	0	0	107.2	A77	P75-A77 PolarHBondContact O-N 2.86Å
76	E	35.7	Very low	46.7	Very low	190 Å²	190	118.4 Å²	118.4	89%	0.888	69%	0.693	S	S	*	*			trans	-60.8	78.3	173.8	-61	167.4	125.3	0	0	109.3	T74	T74-E76 VanDerWaalsContact C-N 3.35Å; T74-E76 PolarHBondContact O-N 2.9Å
77	A	45	Very low	49.2	Very low	91 Å²	91	119.4 Å²	119.4	75%	0.752	69%	0.686	S	S	*	*			trans	-100.4	9.4	174.1	0	0	0	0	0	111.6	P75 Q79	P75-A77 PolarHBondContact O-N 2.86Å; A77-Q79 PolarHBondContact O-N 2.67Å
78	E	43.1	Very low	52.3	Low	194 Å²	194	113.5 Å²	113.5	91%	0.907	65%	0.648	S	S	*	*			trans	-89.3	54.4	175.4	-68.2	-175.1	104.9	0	0	111	S80	E78-S80 VanDerWaalsContact C-N 3.29Å; E78-S80 PolarHBondContact O-N 3.47Å
79	Q	50.5	Low	55.1	Low	96 Å²	96	116.5 Å²	116.5	45%	0.449	64%	0.64	S	S	.	*			trans	-81.3	85.5	168.7	-154.7	163.2	23.6	0	0	108.5	A77 Q81	A77-Q79 PolarHBondContact O-N 2.67Å; Q79-Q81 PolarHBondContact O-N 3.28Å
80	S	49.4	Very low	57.9	Low	75 Å²	75	113.5 Å²	113.5	52%	0.524	62%	0.62	S	S	.	*			trans	3.1	86	160.8	56.6	0	0	0	0	115.8	E78 G82 S83	E78-S80 VanDerWaalsContact C-N 3.29Å; E78-S80 PolarHBondContact O-N 3.47Å; S80-G82 PolarHBondContact O-N 2.86Å; S80-S83 PolarHBondContact O-N 2.75Å; S80-S83 VanDerWaalsContact O-N 3.13Å; S80-S83 PolarHBondContact O-OG 2.76Å; S80-S83 PolarHBondContact OG-OG 2.68Å
81	Q	53.9	Low	60.8	Low	206 Å²	206	109.9 Å²	109.9	96%	0.963	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	-10.8	177	-73.1	177.9	-10	0	0	114.3	Q79	Q79-Q81 PolarHBondContact O-N 3.28Å
82	G	54.1	Low	63.7	Low	77 Å²	77	102.8 Å²	102.8	79%	0.794	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-13.5	178.4	0	0	0	0	0	115.5	S80	S80-G82 PolarHBondContact O-N 2.86Å
83	S	63.5	Low	66.7	Low	50 Å²	50	100.1 Å²	100.1	35%	0.35	56%	0.555	S	S	.	*			trans	-86.9	120	-175.1	62.5	0	0	0	0	111.7	S80 F85	S80-S83 PolarHBondContact O-N 2.75Å; S80-S83 VanDerWaalsContact O-N 3.13Å; S80-S83 PolarHBondContact O-OG 2.76Å; S80-S83 PolarHBondContact OG-OG 2.68Å; S83-F85 PolarHBondContact O-N 2.63Å; S83-F85 PolarHBondContact OG-O 2.83Å
84	K	79.8	Confident	69.6	Low	138 Å²	138	98.3 Å²	98.3	60%	0.6	54%	0.543	S	S	*	.	S	Bend	trans	-66.2	-2.1	174.4	-67.9	178.7	-179.1	173.3	0	113.4	I97 R98	K84-I97 WeakPolarHBondContact O-CG1 3.47Å; K84-I97 PolarHBondContact O-N 3.36Å; K84-R98 HydrophobicContact CB-CG 4.18Å; K84-R98 HydrophobicContact CD-CG 4.07Å; K84-R98 HydrophobicContact CG-CG 4.34Å
85	F	89.4	Confident	72.5	Confident	108 Å²	108	93.8 Å²	93.8	47%	0.474	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	133.1	-177.7	-63.9	-86.5	0	0	0	109.8	S83 I95 D96	S83-F85 PolarHBondContact O-N 2.63Å; S83-F85 PolarHBondContact OG-O 2.83Å; F85-I95 WeakPolarHBondContact CA-O 3.35Å; F85-D96 HydrophobicContact CD1-CB 4Å; F85-D96 HydrophobicContact CE1-CB 3.76Å
86	I	90	Very high	74.9	Confident	14 Å²	14	90.4 Å²	90.4	7%	0.072	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	143.8	172.3	-174.4	172.6	0	0	0	109.4	P94 I95 I97 T115 P116 I117	I86-P94 CarbonylContact O-C 3.6Å; I86-P94 WeakPolarHBondContact O-CA 3.35Å; I86-I95 HydrophobicContact CG2-CB 3.95Å; I86-I95 PolarHBondContact N-O 2.98Å; I86-I95 PolarHBondContact O-N 3.39Å; I86-I97 HydrophobicContact CB-CG2 4.48Å; I86-I97 HydrophobicContact CG2-CG2 3.6Å; I86-T115 HydrophobicContact CD1-CG2 4.03Å; I86-P116 VanDerWaalsContact CD1-O 3.3Å; I86-P116 WeakPolarHBondContact CD1-O 3.21Å; I86-I117 HydrophobicContact CB-CG2 4.47Å; I86-I117 HydrophobicContact CD1-CB 4.44Å; I86-I117 HydrophobicContact CD1-CG2 3.69Å; I86-I117 HydrophobicContact CG2-CG2 3.84Å
87	K	92.6	Very high	77.4	Confident	151 Å²	151	82.8 Å²	82.8	66%	0.657	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	133.6	172.3	-64.2	-177.2	-178.7	178.9	0	111	R89	K87-R89 PolarHBondContact O-N 2.76Å
88	C	93.9	Very high	79.4	Confident	3 Å²	3	86 Å²	86	2%	0.02	45%	0.448	C	S	.	.			trans	-60.6	128.6	170.8	-177	0	0	0	0	110	V90 C91 G92 I93 I95 C108	C88-V90 PolarHBondContact O-N 2.81Å; C88-V90 VanDerWaalsContact O-N 3.14Å; C88-V90 PolarHBondContact SG-N 2.99Å; C88-V90 VanDerWaalsContact SG-N 3.43Å; C88-C91 VanDerWaalsContact CB-SG 3.6Å; C88-C91 VanDerWaalsContact SG-SG 3.65Å; C88-G92 WeakPolarHBondContact O-CA 3.41Å; C88-G92 PolarHBondContact O-N 3.18Å; C88-I93 WeakPolarHBondContact CB-O 3.32Å; C88-I93 PolarHBondContact N-O 3.45Å; C88-I95 HydrophobicContact CB-CD1 3.81Å; C88-I95 HydrophobicContact CB-CG1 4.19Å; C88-C108 HydrophobicContact CB-CB 4.22Å; C88-C108 VanDerWaalsContact SG-CB 3.57Å
89	R	89.7	Confident	81.3	Confident	155 Å²	155	79.8 Å²	79.8	59%	0.585	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-10.8	178.6	-70.9	-174.7	-170.7	-165.1	0.5	114.5	K87 T115	K87-R89 PolarHBondContact O-N 2.76Å; R89-T115 HydrophobicContact CG-CG2 4.04Å
90	V	90.3	Very high	82.9	Confident	48 Å²	48	77.9 Å²	77.9	29%	0.291	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-47.3	-176.6	-178.5	0	0	0	0	111.6	C88 C111 E113 N132	C88-V90 PolarHBondContact O-N 2.81Å; C88-V90 VanDerWaalsContact O-N 3.14Å; C88-V90 PolarHBondContact SG-N 2.99Å; C88-V90 VanDerWaalsContact SG-N 3.43Å; V90-C111 HydrophobicContact CG1-CB 4.38Å; V90-E113 HydrophobicContact CB-CB 4.2Å; V90-E113 HydrophobicContact CB-CG 4.35Å; V90-E113 HydrophobicContact CG1-CG 4.14Å; V90-E113 HydrophobicContact CG2-CB 3.66Å; V90-E113 HydrophobicContact CG2-CG 3.96Å; V90-N132 HydrophobicContact CG1-CB 4.37Å; V90-N132 HydrophobicContact CG2-CB 4.06Å
91	C	93.6	Very high	84.4	Confident	46 Å²	46	77.1 Å²	77.1	31%	0.311	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-2	-178.5	59.8	0	0	0	0	114.4	C88 I93 C111	C88-C91 VanDerWaalsContact CB-SG 3.6Å; C88-C91 VanDerWaalsContact SG-SG 3.65Å; C91-I93 HydrophobicContact CB-CD1 4.38Å; C91-I93 HydrophobicContact CB-CG1 4.46Å; C91-I93 PolarHBondContact O-N 3.42Å; C91-C111 HydrophobicContact CB-CB 4.23Å; C91-C111 VanDerWaalsContact SG-SG 3.66Å
92	G	92.5	Very high	85.9	Confident	42 Å²	42	72.4 Å²	72.4	43%	0.433	40%	0.403	S	S	.	.			trans	74.6	-13.7	-179.2	0	0	0	0	0	115.4	C88	C88-G92 WeakPolarHBondContact O-CA 3.41Å; C88-G92 PolarHBondContact O-N 3.18Å
93	I	92.8	Very high	87.6	Confident	63 Å²	63	70.1 Å²	70.1	32%	0.323	37%	0.372	S	S	.	.			trans	-62.3	134.7	-177.1	-66.2	170.8	0	0	0	110.6	C88 C91 I95 H110	C88-I93 WeakPolarHBondContact CB-O 3.32Å; C88-I93 PolarHBondContact N-O 3.45Å; C91-I93 HydrophobicContact CB-CD1 4.38Å; C91-I93 HydrophobicContact CB-CG1 4.46Å; C91-I93 PolarHBondContact O-N 3.42Å; I93-I95 PolarHBondContact O-N 3.15Å; I93-H110 HydrophobicContact CD1-CB 3.55Å; I93-H110 WeakPolarHBondContact CD1-CD2 3.2Å
94	P	92.4	Very high	88.9	Confident	87 Å²	87	71.2 Å²	71.2	57%	0.565	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	131.7	175.9	26.7	-34.3	0	0	0	111.2	I86	I86-P94 CarbonylContact O-C 3.6Å; I86-P94 WeakPolarHBondContact O-CA 3.35Å
95	I	90.7	Very high	89.6	Confident	15 Å²	15	65.4 Å²	65.4	8%	0.077	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.7	175.2	-54	172.7	0	0	0	107	F85 I86 C88 I93 V106 C108	F85-I95 WeakPolarHBondContact CA-O 3.35Å; I86-I95 HydrophobicContact CG2-CB 3.95Å; I86-I95 PolarHBondContact N-O 2.98Å; I86-I95 PolarHBondContact O-N 3.39Å; C88-I95 HydrophobicContact CB-CD1 3.81Å; C88-I95 HydrophobicContact CB-CG1 4.19Å; I93-I95 PolarHBondContact O-N 3.15Å; I95-V106 HydrophobicContact CD1-CG2 4.31Å; I95-V106 HydrophobicContact CG2-CG2 4.02Å; I95-C108 HydrophobicContact CD1-CB 3.76Å; I95-C108 HydrophobicContact CG1-CB 4.42Å
96	D	90.4	Very high	89.7	Confident	50 Å²	50	60.4 Å²	60.4	27%	0.267	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	124.9	171.4	-175.7	2.6	0	0	0	111	F85 R98	F85-D96 HydrophobicContact CD1-CB 4Å; F85-D96 HydrophobicContact CE1-CB 3.76Å; D96-R98 VanDerWaalsContact CG-NE 3.27Å; D96-R98 WeakPolarHBondContact OD1-CB 2.98Å; D96-R98 WeakPolarHBondContact OD1-CG 3.25Å; D96-R98 PolarHBondContact OD1-N 3.48Å; D96-R98 IonicContact OD1-NE 3.07Å; D96-R98 PolarHBondContact OD1-NE 2.99Å; D96-R98 VanDerWaalsContact OD1-NE 3.07Å; D96-R98 IonicContact OD2-CZ 3.09Å; D96-R98 IonicContact OD2-NE 2.75Å; D96-R98 PolarHBondContact OD2-NE 2.82Å; D96-R98 IonicContact OD2-NH2 2.64Å; D96-R98 PolarHBondContact OD2-NH2 2.87Å
97	I	87.7	Confident	89.8	Confident	30 Å²	30	65 Å²	65	15%	0.154	34%	0.343	C	S	.	.			trans	-106.4	9.7	180	60.1	163.2	0	0	0	112.9	K84 I86 G99 K100 A101 V106 I117	K84-I97 WeakPolarHBondContact O-CG1 3.47Å; K84-I97 PolarHBondContact O-N 3.36Å; I86-I97 HydrophobicContact CB-CG2 4.48Å; I86-I97 HydrophobicContact CG2-CG2 3.6Å; I97-G99 PolarHBondContact O-N 2.85Å; I97-K100 CarbonylContact O-C 3.58Å; I97-K100 PolarHBondContact O-N 2.74Å; I97-A101 PolarHBondContact O-N 3.29Å; I97-V106 HydrophobicContact CG2-CG1 4.43Å; I97-V106 HydrophobicContact CG2-CG2 4.39Å; I97-I117 HydrophobicContact CG2-CG2 3.83Å
98	R	86.4	Confident	89.8	Confident	158 Å²	158	58 Å²	58	60%	0.596	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	125.5	171.2	-71.7	179	-66.2	-179	0.3	110.2	K84 D96 K100	K84-R98 HydrophobicContact CB-CG 4.18Å; K84-R98 HydrophobicContact CD-CG 4.07Å; K84-R98 HydrophobicContact CG-CG 4.34Å; D96-R98 VanDerWaalsContact CG-NE 3.27Å; D96-R98 WeakPolarHBondContact OD1-CB 2.98Å; D96-R98 WeakPolarHBondContact OD1-CG 3.25Å; D96-R98 PolarHBondContact OD1-N 3.48Å; D96-R98 IonicContact OD1-NE 3.07Å; D96-R98 PolarHBondContact OD1-NE 2.99Å; D96-R98 VanDerWaalsContact OD1-NE 3.07Å; D96-R98 IonicContact OD2-CZ 3.09Å; D96-R98 IonicContact OD2-NE 2.75Å; D96-R98 PolarHBondContact OD2-NE 2.82Å; D96-R98 IonicContact OD2-NH2 2.64Å; D96-R98 PolarHBondContact OD2-NH2 2.87Å; R98-K100 PolarHBondContact O-N 2.75Å
99	G	84.5	Confident	89.7	Confident	64 Å²	64	63.1 Å²	63.1	66%	0.66	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	-5.7	-176.7	0	0	0	0	0	115.6	I97	I97-G99 PolarHBondContact O-N 2.85Å
100	K	84.6	Confident	89.8	Confident	55 Å²	55	62.3 Å²	62.3	24%	0.239	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	3.9	176.5	-61.1	178.3	-173.5	169.6	0	112.8	I97 R98 Q102 Q103 V106 I117	I97-K100 CarbonylContact O-C 3.58Å; I97-K100 PolarHBondContact O-N 2.74Å; R98-K100 PolarHBondContact O-N 2.75Å; K100-Q102 PolarHBondContact O-N 2.97Å; K100-Q102 VanDerWaalsContact O-N 3.14Å; K100-Q103 VanDerWaalsContact O-CB 3.29Å; K100-Q103 WeakPolarHBondContact O-CB 3.36Å; K100-Q103 PolarHBondContact O-N 2.72Å; K100-V106 HydrophobicContact CB-CG1 3.95Å; K100-V106 HydrophobicContact CD-CG1 3.98Å; K100-I117 WeakPolarHBondContact O-CD1 3.19Å
101	A	80	Confident	89.9	Confident	60 Å²	60	61.7 Å²	61.7	50%	0.496	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-28.7	-178.8	0	0	0	0	0	113.4	I97 Q103 R118	I97-A101 PolarHBondContact O-N 3.29Å; A101-Q103 VanDerWaalsContact C-N 3.29Å; A101-Q103 PolarHBondContact O-N 2.61Å; A101-R118 WeakPolarHBondContact O-CD 3.36Å; A101-R118 PolarHBondContact O-NE 3.17Å
102	Q	84.4	Confident	89.8	Confident	106 Å²	106	63.7 Å²	63.7	50%	0.495	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-18.9	174.7	-66.8	172.4	-33.5	0	0	112.8	E43 I44 K100 R118	E43-Q102 PolarHBondContact O-OE1 3.04Å; I44-Q102 VanDerWaalsContact CD1-C 3.43Å; I44-Q102 HydrophobicContact CD1-CB 3.59Å; I44-Q102 WeakPolarHBondContact CD1-O 3.28Å; I44-Q102 HydrophobicContact CG1-CB 3.63Å; I44-Q102 HydrophobicContact CG2-CB 4.48Å; K100-Q102 PolarHBondContact O-N 2.97Å; K100-Q102 VanDerWaalsContact O-N 3.14Å; Q102-R118 PolarHBondContact O-NE 2.65Å; Q102-R118 PolarHBondContact O-NH2 3.36Å
103	Q	90.4	Very high	89.9	Confident	30 Å²	30	62.7 Å²	62.7	14%	0.14	33%	0.331	C	S	.	.	S	Bend	trans	-74.3	154.1	177.2	-62.9	-178.3	-16.9	0	0	110.8	I44 K100 A101 I117 R118	I44-Q103 HydrophobicContact CD1-CG 4.34Å; I44-Q103 HydrophobicContact CG2-CG 3.65Å; K100-Q103 VanDerWaalsContact O-CB 3.29Å; K100-Q103 WeakPolarHBondContact O-CB 3.36Å; K100-Q103 PolarHBondContact O-N 2.72Å; A101-Q103 VanDerWaalsContact C-N 3.29Å; A101-Q103 PolarHBondContact O-N 2.61Å; Q103-I117 HydrophobicContact CB-CD1 4.4Å; Q103-I117 WeakPolarHBondContact O-CD1 3.38Å; Q103-I117 WeakPolarHBondContact O-CG1 3.4Å; Q103-R118 PolarHBondContact O-NE 3.25Å
104	Y	91.6	Very high	89.9	Confident	72 Å²	72	61.8 Å²	61.8	28%	0.282	33%	0.328	S	S	.	.	S	Bend	trans	-81	-31.2	173.7	-78	-85.3	0	0	0	112.1	I117 R118 P119 P121	Y104-I117 WeakPolarHBondContact O-CG1 3.25Å; Y104-I117 PolarHBondContact O-N 2.8Å; Y104-R118 HydrophobicContact CD1-CB 4.29Å; Y104-R118 VanDerWaalsContact CG-NH2 3.28Å; Y104-R118 VanDerWaalsContact CZ-NH1 3.34Å; Y104-R118 VanDerWaalsContact CZ-NH2 3.28Å; Y104-R118 PolarHBondContact O-N 3.32Å; Y104-P119 WeakPolarHBondContact CD1-O 3.45Å; Y104-P119 WeakPolarHBondContact CE1-O 3.43Å; Y104-P121 HydrophobicContact CD1-CG 3.92Å; Y104-P121 HydrophobicContact CD2-CG 4.17Å; Y104-P121 HydrophobicContact CE1-CB 4.21Å; Y104-P121 HydrophobicContact CE1-CG 3.67Å; Y104-P121 HydrophobicContact CE2-CG 3.95Å; Y104-P121 HydrophobicContact CG-CG 4.17Å
105	V	93.1	Very high	89.9	Confident	16 Å²	16	57.6 Å²	57.6	10%	0.097	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	150.6	-171.9	-59.3	0	0	0	0	110.3	W31 T114 T115 F126 L134	W31-V105 HydrophobicContact CH2-CG2 4.39Å; W31-V105 HydrophobicContact CZ3-CG2 4.48Å; V105-T114 HydrophobicContact CB-CG2 3.57Å; V105-T114 HydrophobicContact CG1-CG2 4.29Å; V105-T114 HydrophobicContact CG2-CG2 3.8Å; V105-T115 WeakPolarHBondContact CA-O 3.27Å; V105-F126 HydrophobicContact CG1-CE1 3.57Å; V105-F126 HydrophobicContact CG1-CZ 3.69Å; V105-L134 HydrophobicContact CG1-CD2 3.89Å
106	V	92.5	Very high	90	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.024	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	151	175.5	-63.5	0	0	0	0	110.4	I95 I97 K100 T114 T115 I117	I95-V106 HydrophobicContact CD1-CG2 4.31Å; I95-V106 HydrophobicContact CG2-CG2 4.02Å; I97-V106 HydrophobicContact CG2-CG1 4.43Å; I97-V106 HydrophobicContact CG2-CG2 4.39Å; K100-V106 HydrophobicContact CB-CG1 3.95Å; K100-V106 HydrophobicContact CD-CG1 3.98Å; V106-T114 CarbonylContact O-C 3.55Å; V106-T114 WeakPolarHBondContact O-CA 3.08Å; V106-T115 PolarHBondContact N-O 3.08Å; V106-T115 PolarHBondContact O-N 2.83Å; V106-I117 HydrophobicContact CG1-CD1 3.75Å; V106-I117 HydrophobicContact CG1-CG1 4.26Å; V106-I117 HydrophobicContact CG1-CG2 4.24Å; V106-I117 HydrophobicContact CG2-CG2 3.62Å
107	K	91.7	Very high	90.1	Very high	111 Å²	111	56.4 Å²	56.4	48%	0.483	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	131.7	175.9	-165.4	-176.6	-177.2	-165.5	0	110.1	N112	K107-N112 WeakPolarHBondContact CE-O 3.37Å; K107-N112 WeakPolarHBondContact CE-OD1 3.33Å; K107-N112 WeakPolarHBondContact CG-O 3.36Å; K107-N112 PolarHBondContact NZ-OD1 3.31Å
108	C	92.7	Very high	90.2	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.014	30%	0.301	C	S	.	.			trans	-70.3	134.5	168.6	-175.2	0	0	0	0	109.7	C88 I95 H110 C111 N112 E113	C88-C108 HydrophobicContact CB-CB 4.22Å; C88-C108 VanDerWaalsContact SG-CB 3.57Å; I95-C108 HydrophobicContact CD1-CB 3.76Å; I95-C108 HydrophobicContact CG1-CB 4.42Å; C108-H110 VanDerWaalsContact C-N 3.33Å; C108-H110 PolarHBondContact SG-N 2.8Å; C108-H110 VanDerWaalsContact SG-N 3.44Å; C108-C111 VanDerWaalsContact CB-SG 3.55Å; C108-C111 VanDerWaalsContact SG-SG 3.7Å; C108-N112 WeakPolarHBondContact O-CA 3.32Å; C108-N112 PolarHBondContact O-N 2.67Å; C108-N112 VanDerWaalsContact O-N 3.08Å; C108-E113 WeakPolarHBondContact CB-O 3.42Å; C108-E113 PolarHBondContact N-O 2.81Å
109	L	91.3	Very high	90.4	Very high	112 Å²	112	55.8 Å²	55.8	59%	0.586	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-20.5	178.5	-62.7	175.4	0	0	0	113.1	L51	L51-L109 HydrophobicContact CD1-CD1 4.16Å; L51-L109 HydrophobicContact CD2-CD1 3.43Å; L51-L109 VanDerWaalsContact CD2-CD1 3.43Å; L51-L109 HydrophobicContact CG-CD1 4.32Å
110	H	92.6	Very high	90.7	Very high	137 Å²	137	54.9 Å²	54.9	63%	0.634	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-60.3	-178.5	-174	81.7	0	0	0	111.9	I93 C108	I93-H110 HydrophobicContact CD1-CB 3.55Å; I93-H110 WeakPolarHBondContact CD1-CD2 3.2Å; C108-H110 VanDerWaalsContact C-N 3.33Å; C108-H110 PolarHBondContact SG-N 2.8Å; C108-H110 VanDerWaalsContact SG-N 3.44Å
111	C	92.8	Very high	91.1	Very high	36 Å²	36	53.5 Å²	53.5	24%	0.243	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.2	-179.3	64.7	0	0	0	0	113.8	V90 C91 C108 E113	V90-C111 HydrophobicContact CG1-CB 4.38Å; C91-C111 HydrophobicContact CB-CB 4.23Å; C91-C111 VanDerWaalsContact SG-SG 3.66Å; C108-C111 VanDerWaalsContact CB-SG 3.55Å; C108-C111 VanDerWaalsContact SG-SG 3.7Å; C111-E113 PolarHBondContact O-N 2.9Å
112	N	91.5	Very high	91.6	Very high	87 Å²	87	56.7 Å²	56.7	47%	0.465	30%	0.298	S	S	.	.			trans	60.3	9.6	-175.5	-74.1	-63.7	0	0	0	115.7	K107 C108	K107-N112 WeakPolarHBondContact CE-O 3.37Å; K107-N112 WeakPolarHBondContact CE-OD1 3.33Å; K107-N112 WeakPolarHBondContact CG-O 3.36Å; K107-N112 PolarHBondContact NZ-OD1 3.31Å; C108-N112 WeakPolarHBondContact O-CA 3.32Å; C108-N112 PolarHBondContact O-N 2.67Å; C108-N112 VanDerWaalsContact O-N 3.08Å
113	E	93.2	Very high	91.9	Very high	22 Å²	22	54.2 Å²	54.2	10%	0.103	30%	0.301	C	S	.	.			trans	-88.7	149.2	178.2	-65.9	-62	163	0	0	112.8	V90 C108 C111 N132 R148	V90-E113 HydrophobicContact CB-CB 4.2Å; V90-E113 HydrophobicContact CB-CG 4.35Å; V90-E113 HydrophobicContact CG1-CG 4.14Å; V90-E113 HydrophobicContact CG2-CB 3.66Å; V90-E113 HydrophobicContact CG2-CG 3.96Å; C108-E113 WeakPolarHBondContact CB-O 3.42Å; C108-E113 PolarHBondContact N-O 2.81Å; C111-E113 PolarHBondContact O-N 2.9Å; E113-N132 HydrophobicContact CG-CB 4.06Å; E113-R148 IonicContact OE1-CZ 3.39Å; E113-R148 IonicContact OE1-NH1 3.31Å; E113-R148 PolarHBondContact OE1-NH1 3.33Å; E113-R148 IonicContact OE1-NH2 2.67Å; E113-R148 PolarHBondContact OE1-NH2 3.38Å; E113-R148 IonicContact OE2-NH2 2.9Å; E113-R148 PolarHBondContact OE2-NH2 3.45Å
114	T	93.4	Very high	91.9	Very high	43 Å²	43	55.3 Å²	55.3	26%	0.264	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.8	-178.2	-53.1	0	0	0	0	111.2	V105 V106 R128 L134	V105-T114 HydrophobicContact CB-CG2 3.57Å; V105-T114 HydrophobicContact CG1-CG2 4.29Å; V105-T114 HydrophobicContact CG2-CG2 3.8Å; V106-T114 CarbonylContact O-C 3.55Å; V106-T114 WeakPolarHBondContact O-CA 3.08Å; T114-R128 PolarHBondContact O-NH1 3.27Å; T114-R128 PolarHBondContact O-NH2 3.17Å; T114-L134 HydrophobicContact CG2-CD2 3.78Å
115	T	92.6	Very high	92	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	130.7	178.7	-57.3	0	0	0	0	109.8	I86 R89 V105 V106	I86-T115 HydrophobicContact CD1-CG2 4.03Å; R89-T115 HydrophobicContact CG-CG2 4.04Å; V105-T115 WeakPolarHBondContact CA-O 3.27Å; V106-T115 PolarHBondContact N-O 3.08Å; V106-T115 PolarHBondContact O-N 2.83Å
116	P	93.4	Very high	92	Very high	7 Å²	7	55 Å²	55	5%	0.045	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	136.8	174.8	31.7	-33.9	0	0	0	110.2	I86 F126 L134	I86-P116 VanDerWaalsContact CD1-O 3.3Å; I86-P116 WeakPolarHBondContact CD1-O 3.21Å; P116-F126 HydrophobicContact CB-CD2 3.8Å; P116-F126 HydrophobicContact CB-CE2 3.76Å; P116-F126 HydrophobicContact CB-CG 4.35Å; P116-F126 HydrophobicContact CB-CZ 4.27Å; P116-L134 HydrophobicContact CB-CD2 4.42Å
117	I	91	Very high	92.1	Very high	32 Å²	32	55.8 Å²	55.8	16%	0.164	31%	0.309	C	S	.	.			trans	-115.3	-15.1	177.7	53.1	160.6	0	0	0	112.6	I86 I97 K100 Q103 Y104 V106	I86-I117 HydrophobicContact CB-CG2 4.47Å; I86-I117 HydrophobicContact CD1-CB 4.44Å; I86-I117 HydrophobicContact CD1-CG2 3.69Å; I86-I117 HydrophobicContact CG2-CG2 3.84Å; I97-I117 HydrophobicContact CG2-CG2 3.83Å; K100-I117 WeakPolarHBondContact O-CD1 3.19Å; Q103-I117 HydrophobicContact CB-CD1 4.4Å; Q103-I117 WeakPolarHBondContact O-CD1 3.38Å; Q103-I117 WeakPolarHBondContact O-CG1 3.4Å; Y104-I117 WeakPolarHBondContact O-CG1 3.25Å; Y104-I117 PolarHBondContact O-N 2.8Å; V106-I117 HydrophobicContact CG1-CD1 3.75Å; V106-I117 HydrophobicContact CG1-CG1 4.26Å; V106-I117 HydrophobicContact CG1-CG2 4.24Å; V106-I117 HydrophobicContact CG2-CG2 3.62Å
118	R	90.5	Very high	92.1	Very high	76 Å²	76	53.7 Å²	53.7	29%	0.287	30%	0.298	S	S	.	.	S	Bend	trans	-133.5	161.8	175.7	-66.3	-164.7	-62	107.4	-3.8	110.2	A101 Q102 Q103 Y104 F126	A101-R118 WeakPolarHBondContact O-CD 3.36Å; A101-R118 PolarHBondContact O-NE 3.17Å; Q102-R118 PolarHBondContact O-NE 2.65Å; Q102-R118 PolarHBondContact O-NH2 3.36Å; Q103-R118 PolarHBondContact O-NE 3.25Å; Y104-R118 HydrophobicContact CD1-CB 4.29Å; Y104-R118 VanDerWaalsContact CG-NH2 3.28Å; Y104-R118 VanDerWaalsContact CZ-NH1 3.34Å; Y104-R118 VanDerWaalsContact CZ-NH2 3.28Å; Y104-R118 PolarHBondContact O-N 3.32Å; R118-F126 WeakPolarHBondContact O-CE2 3.23Å
119	P	91.4	Very high	92	Very high	99 Å²	99	53.7 Å²	53.7	64%	0.643	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-54	146.9	168.6	-24.8	34.7	0	0	0	110.9	Y104	Y104-P119 WeakPolarHBondContact CD1-O 3.45Å; Y104-P119 WeakPolarHBondContact CE1-O 3.43Å
120	P	90.3	Very high	91.8	Very high	45 Å²	45	51.5 Å²	51.5	29%	0.292	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-58.4	154.2	178.5	26.5	-34.4	0	0	0	111.1	K124 F126	P120-K124 WeakPolarHBondContact CB-O 3.35Å; P120-K124 VanDerWaalsContact CG-O 3.27Å; P120-K124 WeakPolarHBondContact CG-O 3.3Å; P120-F126 VanDerWaalsContact CA-CE2 3.47Å; P120-F126 HydrophobicContact CB-CD2 3.81Å; P120-F126 HydrophobicContact CB-CE2 3.67Å; P120-F126 HydrophobicContact CB-CG 4.34Å; P120-F126 HydrophobicContact CB-CZ 4.09Å; P120-F126 HydrophobicContact CG-CD2 4.18Å; P120-F126 HydrophobicContact CG-CE2 4.32Å
121	P	91.6	Very high	91.6	Very high	27 Å²	27	46.7 Å²	46.7	18%	0.175	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-55.6	153.5	172.8	-20.7	29.9	0	0	0	111.8	Y104 G123 K124	Y104-P121 HydrophobicContact CD1-CG 3.92Å; Y104-P121 HydrophobicContact CD2-CG 4.17Å; Y104-P121 HydrophobicContact CE1-CB 4.21Å; Y104-P121 HydrophobicContact CE1-CG 3.67Å; Y104-P121 HydrophobicContact CE2-CG 3.95Å; Y104-P121 HydrophobicContact CG-CG 4.17Å; P121-G123 PolarHBondContact O-N 3.49Å; P121-K124 WeakPolarHBondContact O-CB 3.44Å; P121-K124 PolarHBondContact O-N 2.91Å
122	P	92.1	Very high	91.5	Very high	126 Å²	126	48.2 Å²	48.2	82%	0.818	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	136.3	179.9	-26.9	34.6	0	0	0	113	K124	P122-K124 VanDerWaalsContact C-N 3.25Å; P122-K124 PolarHBondContact O-N 3.43Å
123	G	90.4	Very high	91.5	Very high	55 Å²	55	44.7 Å²	44.7	57%	0.567	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	3.6	-178.3	0	0	0	0	0	115.3	P121 Q139	P121-G123 PolarHBondContact O-N 3.49Å; G123-Q139 PolarHBondContact O-N 3.01Å
124	K	90.8	Very high	91.6	Very high	52 Å²	52	44.2 Å²	44.2	23%	0.226	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	157.8	177.7	-55.7	-63.4	-178.2	70.6	0	111.7	P120 P121 P122 I136 C137 R138	P120-K124 WeakPolarHBondContact CB-O 3.35Å; P120-K124 VanDerWaalsContact CG-O 3.27Å; P120-K124 WeakPolarHBondContact CG-O 3.3Å; P121-K124 WeakPolarHBondContact O-CB 3.44Å; P121-K124 PolarHBondContact O-N 2.91Å; P122-K124 VanDerWaalsContact C-N 3.25Å; P122-K124 PolarHBondContact O-N 3.43Å; K124-I136 HydrophobicContact CB-CG2 3.92Å; K124-I136 HydrophobicContact CD-CG2 4.48Å; K124-I136 HydrophobicContact CG-CG2 4.24Å; K124-C137 CarbonylContact C-O 3.45Å; K124-C137 WeakPolarHBondContact CA-O 3.38Å; K124-C137 WeakPolarHBondContact CB-O 3.27Å; K124-R138 HydrophobicContact CD-CG 4.3Å
125	K	92.8	Very high	91.6	Very high	41 Å²	41	42.4 Å²	42.4	18%	0.178	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	150.6	167.9	59.7	-167.8	-177.3	-163.7	0	111.8	V127 I136 C137 Q139 S141	K125-V127 HydrophobicContact CG-CG2 4.3Å; K125-I136 WeakPolarHBondContact O-CA 3.36Å; K125-C137 WeakPolarHBondContact CE-SG 3.32Å; K125-C137 WeakPolarHBondContact CG-SG 3.35Å; K125-C137 PolarHBondContact N-O 3.47Å; K125-C137 PolarHBondContact O-N 2.66Å; K125-Q139 PolarHBondContact NZ-O 3.33Å; K125-S141 PolarHBondContact NZ-O 3.08Å
126	F	94.1	Very high	91.6	Very high	42 Å²	42	43.5 Å²	43.5	18%	0.184	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	137.6	166.7	-66.5	-57.5	0	0	0	110.4	V105 P116 R118 P120 L134 L135 I136	V105-F126 HydrophobicContact CG1-CE1 3.57Å; V105-F126 HydrophobicContact CG1-CZ 3.69Å; P116-F126 HydrophobicContact CB-CD2 3.8Å; P116-F126 HydrophobicContact CB-CE2 3.76Å; P116-F126 HydrophobicContact CB-CG 4.35Å; P116-F126 HydrophobicContact CB-CZ 4.27Å; R118-F126 WeakPolarHBondContact O-CE2 3.23Å; P120-F126 VanDerWaalsContact CA-CE2 3.47Å; P120-F126 HydrophobicContact CB-CD2 3.81Å; P120-F126 HydrophobicContact CB-CE2 3.67Å; P120-F126 HydrophobicContact CB-CG 4.34Å; P120-F126 HydrophobicContact CB-CZ 4.09Å; P120-F126 HydrophobicContact CG-CD2 4.18Å; P120-F126 HydrophobicContact CG-CE2 4.32Å; F126-L134 HydrophobicContact CB-CD1 4.08Å; F126-L134 HydrophobicContact CD1-CD1 4.35Å; F126-L134 HydrophobicContact CD1-CD2 4.26Å; F126-L134 HydrophobicContact CD1-CG 4.32Å; F126-L134 HydrophobicContact CG-CD1 4.46Å; F126-L135 WeakPolarHBondContact CA-O 3.47Å; F126-I136 HydrophobicContact CD1-CD1 4.27Å; F126-I136 HydrophobicContact CD1-CG1 3.62Å; F126-I136 HydrophobicContact CE1-CD1 3.66Å; F126-I136 HydrophobicContact CE1-CG1 3.54Å
127	V	92.8	Very high	91.5	Very high	19 Å²	19	43.6 Å²	43.6	12%	0.115	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	129.8	173.4	174.9	0	0	0	0	107.1	K125 L135 C137 I155 L157	K125-V127 HydrophobicContact CG-CG2 4.3Å; V127-L135 HydrophobicContact CB-CB 4.48Å; V127-L135 PolarHBondContact N-O 3.41Å; V127-L135 WeakPolarHBondContact O-CA 3.17Å; V127-L135 WeakPolarHBondContact O-CB 3.5Å; V127-L135 PolarHBondContact O-N 3.11Å; V127-C137 VanDerWaalsContact CG2-SG 3.57Å; V127-I155 HydrophobicContact CG1-CD1 4.26Å; V127-I155 HydrophobicContact CG1-CG2 4.42Å; V127-L157 HydrophobicContact CB-CD2 4.27Å; V127-L157 HydrophobicContact CG1-CD2 3.69Å; V127-L157 HydrophobicContact CG2-CD1 4.27Å; V127-L157 HydrophobicContact CG2-CD2 3.58Å
128	R	92.3	Very high	91.4	Very high	68 Å²	68	51 Å²	51	26%	0.257	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.6	174	-168	167.7	-65.5	-86.8	2.3	109.6	T114 N132	T114-R128 PolarHBondContact O-NH1 3.27Å; T114-R128 PolarHBondContact O-NH2 3.17Å; R128-N132 PolarHBondContact NH1-O 2.99Å
129	C	90.9	Very high	91.2	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.007	29%	0.29	C	S	.	.			trans	-69.2	148.6	170.9	-172.7	0	0	0	0	110	C131 N132 C133 L135 C146 C151 I155	C129-C131 PolarHBondContact O-N 3.47Å; C129-C131 VanDerWaalsContact O-N 3.08Å; C129-C131 PolarHBondContact SG-SG 2.83Å; C129-N132 VanDerWaalsContact O-CA 3.3Å; C129-N132 WeakPolarHBondContact O-CA 3.39Å; C129-N132 PolarHBondContact O-N 3.48Å; C129-C133 HydrophobicContact CB-CB 4.06Å; C129-C133 WeakPolarHBondContact CB-O 3.11Å; C129-C133 PolarHBondContact N-O 2.97Å; C129-L135 HydrophobicContact CB-CD1 4.33Å; C129-C146 HydrophobicContact CB-CB 4.38Å; C129-C146 VanDerWaalsContact SG-CB 3.56Å; C129-C146 VanDerWaalsContact SG-SG 3.65Å; C129-C151 VanDerWaalsContact SG-SG 3.69Å; C129-I155 HydrophobicContact CB-CD1 3.9Å
130	P	88.2	Confident	91	Very high	67 Å²	67	52.2 Å²	52.2	44%	0.435	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-20.1	173	-30.3	38.2	0	0	0	115.1	N132 R153	P130-N132 PolarHBondContact O-N 3.41Å; P130-R153 VanDerWaalsContact CB-NH1 3.33Å
131	C	87.6	Confident	90.9	Very high	35 Å²	35	51.3 Å²	51.3	24%	0.236	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	14.8	169.3	71.1	0	0	0	0	113.7	C129 C133 C146 C151	C129-C131 PolarHBondContact O-N 3.47Å; C129-C131 VanDerWaalsContact O-N 3.08Å; C129-C131 PolarHBondContact SG-SG 2.83Å; C131-C133 PolarHBondContact O-N 2.72Å; C131-C133 VanDerWaalsContact O-N 3.17Å; C131-C133 VanDerWaalsContact SG-CB 3.54Å; C131-C146 PolarHBondContact SG-SG 3.06Å; C131-C151 HydrophobicContact CB-CB 4.1Å
132	N	91.1	Very high	90.8	Very high	69 Å²	69	55.2 Å²	55.2	37%	0.369	31%	0.308	S	S	.	.	S	Bend	trans	67.6	-4.3	-174.3	-62.1	-43.8	0	0	0	117.1	V90 E113 R128 C129 P130 L134	V90-N132 HydrophobicContact CG1-CB 4.37Å; V90-N132 HydrophobicContact CG2-CB 4.06Å; E113-N132 HydrophobicContact CG-CB 4.06Å; R128-N132 PolarHBondContact NH1-O 2.99Å; C129-N132 VanDerWaalsContact O-CA 3.3Å; C129-N132 WeakPolarHBondContact O-CA 3.39Å; C129-N132 PolarHBondContact O-N 3.48Å; P130-N132 PolarHBondContact O-N 3.41Å; N132-L134 PolarHBondContact O-N 2.99Å
133	C	90.8	Very high	90.7	Very high	12 Å²	12	57.8 Å²	57.8	8%	0.081	30%	0.301	C	S	.	.			trans	-60.7	120.8	175.2	-172	0	0	0	0	111.6	C129 C131 L135 R148	C129-C133 HydrophobicContact CB-CB 4.06Å; C129-C133 WeakPolarHBondContact CB-O 3.11Å; C129-C133 PolarHBondContact N-O 2.97Å; C131-C133 PolarHBondContact O-N 2.72Å; C131-C133 VanDerWaalsContact O-N 3.17Å; C131-C133 VanDerWaalsContact SG-CB 3.54Å; C133-L135 HydrophobicContact CB-CD2 4.48Å; C133-R148 HydrophobicContact CB-CG 4.35Å
134	L	94.8	Very high	90.8	Very high	12 Å²	12	55.9 Å²	55.9	6%	0.063	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	122	173.5	-174.8	67.3	0	0	0	110	C28 V105 T114 P116 F126 N132	C28-L134 PolarHBondContact SG-O 2.78Å; V105-L134 HydrophobicContact CG1-CD2 3.89Å; T114-L134 HydrophobicContact CG2-CD2 3.78Å; P116-L134 HydrophobicContact CB-CD2 4.42Å; F126-L134 HydrophobicContact CB-CD1 4.08Å; F126-L134 HydrophobicContact CD1-CD1 4.35Å; F126-L134 HydrophobicContact CD1-CD2 4.26Å; F126-L134 HydrophobicContact CD1-CG 4.32Å; F126-L134 HydrophobicContact CG-CD1 4.46Å; N132-L134 PolarHBondContact O-N 2.99Å
135	L	94.3	Very high	90.8	Very high	5 Å²	5	54.6 Å²	54.6	3%	0.026	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	152.7	179.8	-49.5	179.4	0	0	0	110.3	F126 V127 C129 C133 I144 P147 I155	F126-L135 WeakPolarHBondContact CA-O 3.47Å; V127-L135 HydrophobicContact CB-CB 4.48Å; V127-L135 PolarHBondContact N-O 3.41Å; V127-L135 WeakPolarHBondContact O-CA 3.17Å; V127-L135 WeakPolarHBondContact O-CB 3.5Å; V127-L135 PolarHBondContact O-N 3.11Å; C129-L135 HydrophobicContact CB-CD1 4.33Å; C133-L135 HydrophobicContact CB-CD2 4.48Å; L135-I144 HydrophobicContact CB-CD1 3.96Å; L135-I144 HydrophobicContact CD1-CD1 4.01Å; L135-I144 HydrophobicContact CD1-CG1 4.13Å; L135-I144 HydrophobicContact CD1-CG2 4.38Å; L135-P147 HydrophobicContact CD2-CG 4.07Å; L135-I155 HydrophobicContact CD1-CD1 4.06Å
136	I	92.2	Very high	90.7	Very high	23 Å²	23	52.9 Å²	52.9	12%	0.118	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	127	171.2	-56.8	173.9	0	0	0	106.9	Y27 K124 K125 F126	Y27-I136 HydrophobicContact CD1-CB 3.65Å; Y27-I136 HydrophobicContact CD1-CD1 3.76Å; Y27-I136 HydrophobicContact CD1-CG1 4.19Å; Y27-I136 HydrophobicContact CD1-CG2 4Å; Y27-I136 HydrophobicContact CE1-CB 4.15Å; Y27-I136 HydrophobicContact CE1-CD1 3.64Å; Y27-I136 HydrophobicContact CE1-CG1 4.46Å; Y27-I136 HydrophobicContact CE1-CG2 4.09Å; Y27-I136 HydrophobicContact CG-CB 4.4Å; K124-I136 HydrophobicContact CB-CG2 3.92Å; K124-I136 HydrophobicContact CD-CG2 4.48Å; K124-I136 HydrophobicContact CG-CG2 4.24Å; K125-I136 WeakPolarHBondContact O-CA 3.36Å; F126-I136 HydrophobicContact CD1-CD1 4.27Å; F126-I136 HydrophobicContact CD1-CG1 3.62Å; F126-I136 HydrophobicContact CE1-CD1 3.66Å; F126-I136 HydrophobicContact CE1-CG1 3.54Å
137	C	90.9	Very high	90.6	Very high	9 Å²	9	53 Å²	53	6%	0.061	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	164.1	-179.1	67.6	0	0	0	0	110.8	K124 K125 V127 S141 I144	K124-C137 CarbonylContact C-O 3.45Å; K124-C137 WeakPolarHBondContact CA-O 3.38Å; K124-C137 WeakPolarHBondContact CB-O 3.27Å; K125-C137 WeakPolarHBondContact CE-SG 3.32Å; K125-C137 WeakPolarHBondContact CG-SG 3.35Å; K125-C137 PolarHBondContact N-O 3.47Å; K125-C137 PolarHBondContact O-N 2.66Å; V127-C137 VanDerWaalsContact CG2-SG 3.57Å; C137-S141 VanDerWaalsContact CB-OG 3.32Å; C137-S141 WeakPolarHBondContact CB-OG 3.29Å; C137-S141 PolarHBondContact SG-OG 3Å; C137-S141 VanDerWaalsContact SG-OG 3.35Å; C137-I144 HydrophobicContact CB-CD1 3.58Å
138	R	89.1	Confident	90.5	Very high	187 Å²	187	55.8 Å²	55.8	71%	0.706	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	144.7	173.2	-66.5	-178.1	-178	179.7	0.1	109.4	K124 A140 S141	K124-R138 HydrophobicContact CD-CG 4.3Å; R138-A140 PolarHBondContact O-N 3Å; R138-S141 WeakPolarHBondContact O-CB 3.2Å; R138-S141 PolarHBondContact O-N 3.44Å; R138-S141 PolarHBondContact O-OG 3.05Å
139	Q	87.4	Confident	90.3	Very high	113 Å²	113	57.8 Å²	57.8	53%	0.528	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-44.5	178.2	-167.7	68.8	13.9	0	0	111.3	G123 K125 S141	G123-Q139 PolarHBondContact O-N 3.01Å; K125-Q139 PolarHBondContact NZ-O 3.33Å; Q139-S141 PolarHBondContact O-N 3.01Å
140	A	87.4	Confident	90	Very high	89 Å²	89	62 Å²	62	74%	0.736	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-3.6	178.4	0	0	0	0	0	115	R138 N142	R138-A140 PolarHBondContact O-N 3Å; A140-N142 PolarHBondContact O-N 2.87Å
141	S	87.4	Confident	89.9	Confident	26 Å²	26	60.4 Å²	60.4	18%	0.182	32%	0.318	C	S	.	.			trans	-73.4	130.7	177.3	66.6	0	0	0	0	110.7	K125 C137 R138 Q139 L157	K125-S141 PolarHBondContact NZ-O 3.08Å; C137-S141 VanDerWaalsContact CB-OG 3.32Å; C137-S141 WeakPolarHBondContact CB-OG 3.29Å; C137-S141 PolarHBondContact SG-OG 3Å; C137-S141 VanDerWaalsContact SG-OG 3.35Å; R138-S141 WeakPolarHBondContact O-CB 3.2Å; R138-S141 PolarHBondContact O-N 3.44Å; R138-S141 PolarHBondContact O-OG 3.05Å; Q139-S141 PolarHBondContact O-N 3.01Å; S141-L157 VanDerWaalsContact O-CD1 3.27Å; S141-L157 WeakPolarHBondContact O-CD1 3.37Å
142	N	89.1	Confident	89.9	Confident	108 Å²	108	65.7 Å²	65.7	58%	0.578	34%	0.337	S	S	*	.	S	Bend	trans	-102.6	-14	179.3	-69.7	-29.2	0	0	0	112.8	A140 T156 L157	A140-N142 PolarHBondContact O-N 2.87Å; N142-T156 CarbonylContact O-C 3.55Å; N142-T156 WeakPolarHBondContact O-CA 3.44Å; N142-L157 PolarHBondContact O-N 2.92Å
143	R	90.7	Very high	89.7	Confident	180 Å²	180	65 Å²	65	68%	0.679	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.7	137.4	179	-65	-174.6	-179.6	-156.1	0.2	109.5	I155 T156	R143-I155 WeakPolarHBondContact CA-O 3.01Å; R143-T156 HydrophobicContact CG-CG2 4.31Å
144	I	91.8	Very high	89.7	Confident	16 Å²	16	68.9 Å²	68.9	8%	0.082	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	146	175.8	-178.7	162.4	0	0	0	110	L135 C137 V154 I155 L157	L135-I144 HydrophobicContact CB-CD1 3.96Å; L135-I144 HydrophobicContact CD1-CD1 4.01Å; L135-I144 HydrophobicContact CD1-CG1 4.13Å; L135-I144 HydrophobicContact CD1-CG2 4.38Å; C137-I144 HydrophobicContact CB-CD1 3.58Å; I144-V154 CarbonylContact O-C 3.53Å; I144-V154 WeakPolarHBondContact O-CA 3.09Å; I144-I155 HydrophobicContact CG2-CB 4.04Å; I144-I155 PolarHBondContact N-O 3.44Å; I144-I155 PolarHBondContact O-N 2.79Å; I144-L157 HydrophobicContact CB-CD1 4.47Å; I144-L157 HydrophobicContact CG2-CD1 3.89Å; I144-L157 HydrophobicContact CG2-CD2 4.22Å; I144-L157 HydrophobicContact CG2-CG 4.21Å
145	A	91.5	Very high	89.4	Confident	25 Å²	25	69.7 Å²	69.7	21%	0.207	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	144.3	172.4	0	0	0	0	0	111.8	N24 R153 V154	N24-A145 HydrophobicContact CB-CB 4.37Å; A145-R153 CarbonylContact C-O 3.39Å; A145-R153 WeakPolarHBondContact CA-O 3.24Å; A145-V154 HydrophobicContact CB-CG2 4.46Å
146	C	90.4	Very high	89.1	Confident	4 Å²	4	72.4 Å²	72.4	3%	0.027	37%	0.373	C	S	.	.			trans	-70.2	132.8	168.8	-174.5	0	0	0	0	110	C129 C131 R148 C151 K152 R153	C129-C146 HydrophobicContact CB-CB 4.38Å; C129-C146 VanDerWaalsContact SG-CB 3.56Å; C129-C146 VanDerWaalsContact SG-SG 3.65Å; C131-C146 PolarHBondContact SG-SG 3.06Å; C146-R148 VanDerWaalsContact C-N 3.29Å; C146-R148 PolarHBondContact O-N 3.22Å; C146-C151 HydrophobicContact CB-CB 4.27Å; C146-K152 WeakPolarHBondContact O-CA 3.47Å; C146-R153 PolarHBondContact N-O 2.75Å
147	P	92.5	Very high	88.8	Confident	45 Å²	45	72.9 Å²	72.9	29%	0.292	38%	0.376	S	S	.	.			trans	-76.8	-15.9	-177.9	35	-41.2	0	0	0	113.5	S26 L135	S26-P147 WeakPolarHBondContact OG-CB 2.91Å; S26-P147 VanDerWaalsContact OG-CG 3.25Å; S26-P147 WeakPolarHBondContact OG-CG 3.46Å; L135-P147 HydrophobicContact CD2-CG 4.07Å
148	R	89.6	Confident	87.8	Confident	77 Å²	77	76.6 Å²	76.6	29%	0.291	40%	0.395	S	S	.	.			trans	-64.3	130.3	-175.4	-68	-167.5	178.9	-156.3	2	110.7	E113 C133 C146 D150 C151 K152	E113-R148 IonicContact OE1-CZ 3.39Å; E113-R148 IonicContact OE1-NH1 3.31Å; E113-R148 PolarHBondContact OE1-NH1 3.33Å; E113-R148 IonicContact OE1-NH2 2.67Å; E113-R148 PolarHBondContact OE1-NH2 3.38Å; E113-R148 IonicContact OE2-NH2 2.9Å; E113-R148 PolarHBondContact OE2-NH2 3.45Å; C133-R148 HydrophobicContact CB-CG 4.35Å; C146-R148 VanDerWaalsContact C-N 3.29Å; C146-R148 PolarHBondContact O-N 3.22Å; R148-D150 WeakPolarHBondContact CB-OD1 3.35Å; R148-D150 PolarHBondContact O-N 2.78Å; R148-C151 HydrophobicContact CB-CB 3.88Å; R148-C151 PolarHBondContact O-N 2.79Å; R148-K152 WeakPolarHBondContact O-CG 3.37Å; R148-K152 PolarHBondContact O-N 3.42Å
149	P	88.2	Confident	86.4	Confident	110 Å²	110	72.2 Å²	72.2	71%	0.714	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-29.1	-175.4	25.8	-34.6	0	0	0	112.8	K152	P149-K152 WeakPolarHBondContact O-CE 3.06Å
150	D	85.4	Confident	84.7	Confident	90 Å²	90	75.1 Å²	75.1	48%	0.481	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-12.4	178.5	65.1	-54.2	0	0	0	113.8	R148 R200	R148-D150 WeakPolarHBondContact CB-OD1 3.35Å; R148-D150 PolarHBondContact O-N 2.78Å; D150-R200 PolarHBondContact O-NH2 3.22Å
151	C	85.9	Confident	83.2	Confident	34 Å²	34	75 Å²	75	23%	0.23	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-60.6	178	-172.2	0	0	0	0	112.5	C129 C131 C146 R148 R153	C129-C151 VanDerWaalsContact SG-SG 3.69Å; C131-C151 HydrophobicContact CB-CB 4.1Å; C146-C151 HydrophobicContact CB-CB 4.27Å; R148-C151 HydrophobicContact CB-CB 3.88Å; R148-C151 PolarHBondContact O-N 2.79Å; C151-R153 PolarHBondContact O-N 2.75Å
152	K	88.1	Confident	81.5	Confident	145 Å²	145	81.7 Å²	81.7	63%	0.63	44%	0.439	S	S	*	.			trans	44.6	19.8	-176.8	-60.4	-174.5	-178.2	-178.9	0	116	C146 R148 P149 V154	C146-K152 WeakPolarHBondContact O-CA 3.47Å; R148-K152 WeakPolarHBondContact O-CG 3.37Å; R148-K152 PolarHBondContact O-N 3.42Å; P149-K152 WeakPolarHBondContact O-CE 3.06Å; K152-V154 PolarHBondContact O-N 2.9Å
153	R	87	Confident	79.9	Confident	55 Å²	55	79.2 Å²	79.2	21%	0.208	44%	0.439	C	S	.	.			trans	-69	132.2	-173	177.9	170.4	-68.1	178.5	-1.5	110.9	P130 A145 C146 C151 I155 E182 H198	P130-R153 VanDerWaalsContact CB-NH1 3.33Å; A145-R153 CarbonylContact C-O 3.39Å; A145-R153 WeakPolarHBondContact CA-O 3.24Å; C146-R153 PolarHBondContact N-O 2.75Å; C151-R153 PolarHBondContact O-N 2.75Å; R153-I155 HydrophobicContact CG-CG1 4.45Å; R153-E182 IonicContact NH1-OE1 3.77Å; R153-H198 VanDerWaalsContact CZ-CE1 3.47Å; R153-H198 PolarHBondContact NH1-CE1 2.98Å; R153-H198 PolarHBondContact NH1-ND1 2.86Å; R153-H198 PolarHBondContact NH2-CE1 3.31Å; R153-H198 PolarHBondContact NH2-ND1 3.35Å; R153-H198 PolarHBondContact NH2-NE2 2.94Å
154	V	90.5	Very high	78.1	Confident	94 Å²	94	76.4 Å²	76.4	57%	0.57	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	125.4	168	-176.7	0	0	0	0	109.1	I144 A145 K152	I144-V154 CarbonylContact O-C 3.53Å; I144-V154 WeakPolarHBondContact O-CA 3.09Å; A145-V154 HydrophobicContact CB-CG2 4.46Å; K152-V154 PolarHBondContact O-N 2.9Å
155	I	87.4	Confident	76.4	Confident	28 Å²	28	80.4 Å²	80.4	14%	0.144	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	118.7	178.3	-54.5	168.2	0	0	0	107	V127 C129 L135 R143 I144 R153 L157	V127-I155 HydrophobicContact CG1-CD1 4.26Å; V127-I155 HydrophobicContact CG1-CG2 4.42Å; C129-I155 HydrophobicContact CB-CD1 3.9Å; L135-I155 HydrophobicContact CD1-CD1 4.06Å; R143-I155 WeakPolarHBondContact CA-O 3.01Å; I144-I155 HydrophobicContact CG2-CB 4.04Å; I144-I155 PolarHBondContact N-O 3.44Å; I144-I155 PolarHBondContact O-N 2.79Å; R153-I155 HydrophobicContact CG-CG1 4.45Å; I155-L157 HydrophobicContact CG2-CD2 3.93Å
156	T	89.5	Confident	74.9	Confident	62 Å²	62	84.9 Å²	84.9	38%	0.38	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	126	168.5	-50.8	0	0	0	0	107.8	N142 R143 N158	N142-T156 CarbonylContact O-C 3.55Å; N142-T156 WeakPolarHBondContact O-CA 3.44Å; R143-T156 HydrophobicContact CG-CG2 4.31Å; T156-N158 HydrophobicContact CG2-CB 3.74Å; T156-N158 PolarHBondContact O-N 2.97Å; T156-N158 PolarHBondContact O-OD1 3.12Å; T156-N158 VanDerWaalsContact O-OD1 3.11Å
157	L	84.6	Confident	73.4	Confident	33 Å²	33	96.3 Å²	96.3	17%	0.173	55%	0.545	C	S	.	.			trans	-94.7	27.3	-177.7	-55.7	169.9	0	0	0	110.8	V127 S141 N142 I144 I155 A159	V127-L157 HydrophobicContact CB-CD2 4.27Å; V127-L157 HydrophobicContact CG1-CD2 3.69Å; V127-L157 HydrophobicContact CG2-CD1 4.27Å; V127-L157 HydrophobicContact CG2-CD2 3.58Å; S141-L157 VanDerWaalsContact O-CD1 3.27Å; S141-L157 WeakPolarHBondContact O-CD1 3.37Å; N142-L157 PolarHBondContact O-N 2.92Å; I144-L157 HydrophobicContact CB-CD1 4.47Å; I144-L157 HydrophobicContact CG2-CD1 3.89Å; I144-L157 HydrophobicContact CG2-CD2 4.22Å; I144-L157 HydrophobicContact CG2-CG 4.21Å; I155-L157 HydrophobicContact CG2-CD2 3.93Å; L157-A159 PolarHBondContact O-N 3.21Å; L157-A159 VanDerWaalsContact O-N 3.12Å
158	N	70.6	Confident	72	Confident	87 Å²	87	96.2 Å²	96.2	47%	0.465	55%	0.548	S	S	.	.			trans	-55.5	113.8	-170.9	44.2	-21.8	0	0	0	110.7	T156 Q160	T156-N158 HydrophobicContact CG2-CB 3.74Å; T156-N158 PolarHBondContact O-N 2.97Å; T156-N158 PolarHBondContact O-OD1 3.12Å; T156-N158 VanDerWaalsContact O-OD1 3.11Å; N158-Q160 PolarHBondContact O-N 3.25Å
159	A	58.9	Low	70.7	Confident	96 Å²	96	96.8 Å²	96.8	79%	0.793	56%	0.561	S	S	*	*	S	Bend	trans	-68.9	92.5	152	0	0	0	0	0	106.1	L157 S161	L157-A159 PolarHBondContact O-N 3.21Å; L157-A159 VanDerWaalsContact O-N 3.12Å; A159-S161 PolarHBondContact O-N 3.04Å
160	Q	53	Low	70	Confident	174 Å²	174	99.7 Å²	99.7	81%	0.813	57%	0.57	S	S	*	*			trans	43.4	70.5	164.2	-58.9	177.2	-18.7	0	0	114.8	N158 I162	N158-Q160 PolarHBondContact O-N 3.25Å; Q160-I162 PolarHBondContact O-N 3.43Å
161	S	54.5	Low	69.5	Low	86 Å²	86	96.6 Å²	96.6	60%	0.601	56%	0.56	S	S	*	*			trans	-66.9	106.7	154.1	55.9	0	0	0	0	106.1	A159 G163	A159-S161 PolarHBondContact O-N 3.04Å; S161-G163 PolarHBondContact O-N 3.14Å
162	I	52.6	Low	69.1	Low	166 Å²	166	96.5 Å²	96.5	85%	0.851	56%	0.558	S	S	*	*			trans	-60.6	80.5	164.5	-58.7	168.4	0	0	0	105.6	Q160 T164	Q160-I162 PolarHBondContact O-N 3.43Å; I162-T164 PolarHBondContact O-N 3.2Å
163	G	55.9	Low	68.6	Low	56 Å²	56	90.8 Å²	90.8	58%	0.577	54%	0.535	S	S	*	.			trans	-70.6	116.4	172.8	0	0	0	0	0	105.9	S161 A165	S161-G163 PolarHBondContact O-N 3.14Å; G163-A165 PolarHBondContact O-N 2.86Å
164	T	52.6	Low	68.4	Low	121 Å²	121	95.4 Å²	95.4	74%	0.742	55%	0.553	S	S	*	*			trans	-46.7	119.9	156.6	44.2	0	0	0	0	106.1	I162 T166	I162-T164 PolarHBondContact O-N 3.2Å; T164-T166 PolarHBondContact O-N 2.79Å
165	A	55.1	Low	67.9	Low	101 Å²	101	91 Å²	91	84%	0.835	53%	0.526	S	S	*	.			trans	-64.7	86	-178	0	0	0	0	0	107.9	G163 R167	G163-A165 PolarHBondContact O-N 2.86Å; A165-R167 PolarHBondContact O-N 3.34Å
166	T	59.7	Low	67.7	Low	119 Å²	119	90.5 Å²	90.5	73%	0.73	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-61.8	127.2	171.3	40.4	0	0	0	0	106.1	T164 A168	T164-T166 PolarHBondContact O-N 2.79Å; T166-A168 PolarHBondContact O-N 2.93Å
167	R	60.6	Low	67.2	Low	243 Å²	243	87.6 Å²	87.6	92%	0.917	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-54.7	130.5	175	-77.6	-174.9	173.8	-171.5	-1.8	107.4	A165	A165-R167 PolarHBondContact O-N 3.34Å
168	A	62	Low	67.1	Low	43 Å²	43	89.3 Å²	89.3	36%	0.355	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-54.8	137.2	172.7	0	0	0	0	0	108.2	T166 L170 T172 M185	T166-A168 PolarHBondContact O-N 2.93Å; A168-L170 PolarHBondContact O-N 2.95Å; A168-T172 WeakPolarHBondContact CB-OG1 3.17Å; A168-M185 HydrophobicContact CB-CE 4.15Å
169	P	63.4	Low	67.5	Low	89 Å²	89	90.4 Å²	90.4	58%	0.578	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-50.4	141.7	176	-26.1	33.4	0	0	0	110.9	G171 T172	P169-G171 PolarHBondContact O-N 3.36Å; P169-T172 HydrophobicContact CB-CG2 4.36Å; P169-T172 PolarHBondContact O-N 3.05Å; P169-T172 PolarHBondContact O-OG1 3.42Å
170	L	72.8	Confident	68.5	Low	171 Å²	171	88 Å²	88	90%	0.895	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	135.2	176.2	-66.7	168.6	0	0	0	109.9	A168	A168-L170 PolarHBondContact O-N 2.95Å
171	G	73.7	Confident	69.7	Low	26 Å²	26	85.6 Å²	85.6	27%	0.268	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	4.4	-176.7	0	0	0	0	0	114.9	P169 N187 T188	P169-G171 PolarHBondContact O-N 3.36Å; G171-N187 CarbonylContact O-C 3.54Å; G171-N187 WeakPolarHBondContact O-CA 3.34Å; G171-N187 PolarHBondContact O-OD1 2.98Å; G171-N187 VanDerWaalsContact O-OD1 3.09Å; G171-T188 PolarHBondContact O-N 3.33Å; G171-T188 PolarHBondContact O-OG1 3.48Å
172	T	78.1	Confident	71	Confident	31 Å²	31	84.7 Å²	84.7	19%	0.19	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	135.2	167.2	62.1	0	0	0	0	111	A168 P169 M185 F186 N187	A168-T172 WeakPolarHBondContact CB-OG1 3.17Å; P169-T172 HydrophobicContact CB-CG2 4.36Å; P169-T172 PolarHBondContact O-N 3.05Å; P169-T172 PolarHBondContact O-OG1 3.42Å; T172-M185 HydrophobicContact CG2-CE 4.01Å; T172-M185 VanDerWaalsContact OG1-CE 3.28Å; T172-M185 WeakPolarHBondContact OG1-CE 3.36Å; T172-F186 CarbonylContact C-O 3.49Å; T172-F186 WeakPolarHBondContact CA-O 3.42Å; T172-N187 HydrophobicContact CG2-CB 4.17Å
173	V	78.4	Confident	72.4	Confident	25 Å²	25	81.4 Å²	81.4	15%	0.152	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	149.5	179.2	-62.4	0	0	0	0	110	I175 M185 F186 T188 I206 T208	V173-I175 HydrophobicContact CG2-CD1 3.73Å; V173-I175 HydrophobicContact CG2-CG1 3.68Å; V173-M185 WeakPolarHBondContact O-CA 3.49Å; V173-F186 HydrophobicContact CG2-CB 4.43Å; V173-F186 HydrophobicContact CG2-CD1 4.44Å; V173-F186 PolarHBondContact N-O 3.14Å; V173-F186 PolarHBondContact O-N 3.48Å; V173-T188 HydrophobicContact CB-CG2 4.09Å; V173-T188 HydrophobicContact CG1-CG2 3.54Å; V173-T188 HydrophobicContact CG2-CG2 3.39Å; V173-I206 HydrophobicContact CB-CG2 4.14Å; V173-I206 HydrophobicContact CG2-CD1 4.31Å; V173-I206 HydrophobicContact CG2-CG2 4.24Å; V173-T208 HydrophobicContact CB-CG2 3.89Å; V173-T208 HydrophobicContact CG1-CG2 3.89Å
174	R	82.8	Confident	73.7	Confident	152 Å²	152	80 Å²	80	57%	0.574	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	132.1	170.6	-69.7	-176.2	173.9	117.4	-0.4	108.9	I183 M185 L207	R174-I183 HydrophobicContact CB-CG2 4.39Å; R174-M185 HydrophobicContact CG-CG 4.39Å; R174-L207 HydrophobicContact CB-CB 4.36Å; R174-L207 PolarHBondContact O-N 3.22Å
175	I	80.2	Confident	75.1	Confident	2 Å²	2	79 Å²	79	1%	0.01	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136.3	-178.3	-46.2	-172.1	0	0	0	108.7	V173 I183 F184 F186 A194 V204 H205 I206	V173-I175 HydrophobicContact CG2-CD1 3.73Å; V173-I175 HydrophobicContact CG2-CG1 3.68Å; I175-I183 CarbonylContact O-C 3.54Å; I175-I183 WeakPolarHBondContact O-CA 3.2Å; I175-F184 HydrophobicContact CB-CE1 4.38Å; I175-F184 HydrophobicContact CB-CZ 4.31Å; I175-F184 PolarHBondContact N-O 2.85Å; I175-F184 WeakPolarHBondContact O-CD1 3.42Å; I175-F184 PolarHBondContact O-N 2.85Å; I175-F186 HydrophobicContact CD1-CB 3.46Å; I175-F186 VanDerWaalsContact CD1-CB 3.46Å; I175-F186 HydrophobicContact CD1-CD1 3.79Å; I175-F186 HydrophobicContact CD1-CG 3.89Å; I175-F186 HydrophobicContact CG1-CB 4.04Å; I175-A194 HydrophobicContact CD1-CB 4.19Å; I175-V204 HydrophobicContact CD1-CG2 4.37Å; I175-V204 HydrophobicContact CG2-CB 3.36Å; I175-V204 HydrophobicContact CG2-CG2 3.46Å; I175-V204 VanDerWaalsContact CG2-CG2 3.46Å; I175-H205 CarbonylContact C-O 3.38Å; I175-H205 VanDerWaalsContact CA-O 3.25Å; I175-H205 WeakPolarHBondContact CA-O 3.12Å; I175-H205 WeakPolarHBondContact CG2-O 3.48Å; I175-I206 HydrophobicContact CD1-CD1 4.17Å; I175-I206 HydrophobicContact CD1-CG1 3.98Å; I175-I206 HydrophobicContact CG1-CG1 4.05Å; I175-I206 HydrophobicContact CG1-CG2 4.43Å; I175-I206 HydrophobicContact CG2-CG1 4.19Å
176	S	81.7	Confident	76.3	Confident	18 Å²	18	75.5 Å²	75.5	13%	0.126	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	139.8	169.9	61	0	0	0	0	110.6	E182 V204 H205	S176-E182 CarbonylContact C-O 3.57Å; S176-E182 WeakPolarHBondContact CA-O 3.41Å; S176-V204 CarbonylContact O-C 3.58Å; S176-V204 WeakPolarHBondContact O-CA 3.18Å; S176-H205 PolarHBondContact N-O 3.17Å; S176-H205 PolarHBondContact O-N 3.43Å; S176-H205 VanDerWaalsContact OG-CB 3.32Å; S176-H205 WeakPolarHBondContact OG-CB 3.22Å; S176-H205 PolarHBondContact OG-O 3.03Å
177	C	79.8	Confident	77.2	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	130.1	171.9	173.4	0	0	0	0	110.9	Y179 C180 N181 E182 F184 C196 C199 V204	C177-Y179 PolarHBondContact O-N 2.94Å; C177-Y179 PolarHBondContact SG-N 3.48Å; C177-C180 VanDerWaalsContact CB-SG 3.5Å; C177-C180 VanDerWaalsContact SG-SG 3.62Å; C177-N181 WeakPolarHBondContact O-CA 3.32Å; C177-N181 PolarHBondContact O-N 2.71Å; C177-E182 PolarHBondContact N-O 2.87Å; C177-F184 HydrophobicContact CB-CE1 4.49Å; C177-C196 HydrophobicContact CB-CB 3.77Å; C177-C196 WeakPolarHBondContact CB-SG 3.39Å; C177-C196 VanDerWaalsContact SG-CB 3.57Å; C177-C199 PolarHBondContact SG-SG 3.21Å; C177-V204 HydrophobicContact CB-CG1 4.4Å
178	V	82.1	Confident	78	Confident	69 Å²	69	62.4 Å²	62.4	42%	0.418	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-25.5	-177.6	-174.3	0	0	0	0	112.8	Y203 H205	V178-Y203 PolarHBondContact N-O 3.03Å; V178-H205 HydrophobicContact CG2-CB 4.42Å
179	Y	79.3	Confident	78.6	Confident	110 Å²	110	66.1 Å²	66.1	43%	0.431	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-34.3	-177.7	-61	-77.6	0	0	0	115.6	C177 K201 Y203	C177-Y179 PolarHBondContact O-N 2.94Å; C177-Y179 PolarHBondContact SG-N 3.48Å; Y179-K201 HydrophobicContact CD1-CD 3.78Å; Y179-K201 HydrophobicContact CD2-CB 3.55Å; Y179-K201 HydrophobicContact CD2-CD 3.18Å; Y179-K201 HydrophobicContact CD2-CG 3.99Å; Y179-K201 HydrophobicContact CE1-CD 4.01Å; Y179-K201 HydrophobicContact CE2-CB 3.63Å; Y179-K201 HydrophobicContact CE2-CD 3.38Å; Y179-K201 HydrophobicContact CE2-CG 4.11Å; Y179-K201 HydrophobicContact CG-CB 4.5Å; Y179-K201 HydrophobicContact CG-CD 3.36Å; Y179-Y203 AromaticContact CE2-CD2 3.49Å; Y179-Y203 HydrophobicContact CE2-CD2 3.49Å; Y179-Y203 VanDerWaalsContact CE2-CD2 3.49Å; Y179-Y203 HydrophobicContact CE2-CE2 4.45Å; Y179-Y203 AromaticContact CE2-CG 3.82Å; Y179-Y203 HydrophobicContact CE2-CG 3.82Å; Y179-Y203 AromaticContact CZ-CD2 3.78Å; Y179-Y203 WeakPolarHBondContact OH-CD2 3.14Å; Y179-Y203 WeakPolarHBondContact OH-CE2 3.08Å
180	C	79.5	Confident	79.1	Confident	45 Å²	45	66.1 Å²	66.1	30%	0.304	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	0	-178.2	66.9	0	0	0	0	112.6	C177 E182 H198	C177-C180 VanDerWaalsContact CB-SG 3.5Å; C177-C180 VanDerWaalsContact SG-SG 3.62Å; C180-E182 HydrophobicContact CB-CG 4.39Å; C180-E182 WeakPolarHBondContact O-CG 3.19Å; C180-E182 PolarHBondContact O-N 3.45Å; C180-H198 HydrophobicContact CB-CB 4.44Å; C180-H198 VanDerWaalsContact SG-CB 3.53Å
181	N	78.8	Confident	78.9	Confident	124 Å²	124	67.5 Å²	67.5	66%	0.663	34%	0.341	S	S	*	.			trans	55.2	15.6	-179.1	-62.6	-38.1	0	0	0	115.5	C177	C177-N181 WeakPolarHBondContact O-CA 3.32Å; C177-N181 PolarHBondContact O-N 2.71Å
182	E	81.4	Confident	79.1	Confident	67 Å²	67	69.6 Å²	69.6	31%	0.313	35%	0.351	S	S	.	.			trans	-85.7	138.7	-177.4	-72.6	-98	-132.5	0	0	111.4	R153 S176 C177 C180 H198	R153-E182 IonicContact NH1-OE1 3.77Å; S176-E182 CarbonylContact C-O 3.57Å; S176-E182 WeakPolarHBondContact CA-O 3.41Å; C177-E182 PolarHBondContact N-O 2.87Å; C180-E182 HydrophobicContact CB-CG 4.39Å; C180-E182 WeakPolarHBondContact O-CG 3.19Å; C180-E182 PolarHBondContact O-N 3.45Å; E182-H198 HydrophobicContact CB-CB 4.47Å; E182-H198 WeakPolarHBondContact CB-CE1 3.32Å; E182-H198 VanDerWaalsContact CB-ND1 3.33Å; E182-H198 WeakPolarHBondContact CB-ND1 3.35Å; E182-H198 WeakPolarHBondContact CG-ND1 3.38Å; E182-H198 IonicContact OE1-CE1 3.29Å; E182-H198 PolarHBondContact OE1-CE1 3.21Å; E182-H198 VanDerWaalsContact OE1-CE1 3.29Å; E182-H198 IonicContact OE1-ND1 2.99Å; E182-H198 PolarHBondContact OE1-ND1 2.99Å; E182-H198 IonicContact OE2-CE1 3.48Å; E182-H198 PolarHBondContact OE2-CE1 2.94Å; E182-H198 IonicContact OE2-ND1 3.89Å
183	I	83.1	Confident	79	Confident	98 Å²	98	72 Å²	72	50%	0.503	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	130.3	-175.8	-54.3	175.6	0	0	0	109.4	R174 I175 L207	R174-I183 HydrophobicContact CB-CG2 4.39Å; I175-I183 CarbonylContact O-C 3.54Å; I175-I183 WeakPolarHBondContact O-CA 3.2Å; I183-L207 HydrophobicContact CB-CD1 4.34Å; I183-L207 HydrophobicContact CD1-CD1 3.52Å; I183-L207 HydrophobicContact CG1-CD1 3.71Å; I183-L207 HydrophobicContact CG2-CD1 3.72Å
184	F	81.8	Confident	79	Confident	26 Å²	26	71.4 Å²	71.4	11%	0.114	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	161.1	176.3	66.7	-79.9	0	0	0	111.4	I175 C177 F186 A194 C196 P197 V204	I175-F184 HydrophobicContact CB-CE1 4.38Å; I175-F184 HydrophobicContact CB-CZ 4.31Å; I175-F184 PolarHBondContact N-O 2.85Å; I175-F184 WeakPolarHBondContact O-CD1 3.42Å; I175-F184 PolarHBondContact O-N 2.85Å; C177-F184 HydrophobicContact CB-CE1 4.49Å; F184-F186 HydrophobicContact CE2-CB 4.09Å; F184-A194 HydrophobicContact CE2-CB 4.49Å; F184-A194 HydrophobicContact CZ-CB 4.36Å; F184-C196 HydrophobicContact CE1-CB 4.44Å; F184-P197 HydrophobicContact CB-CG 4.14Å; F184-P197 HydrophobicContact CD2-CG 4.33Å; F184-P197 HydrophobicContact CG-CG 4.1Å; F184-V204 HydrophobicContact CE1-CB 4.48Å; F184-V204 HydrophobicContact CE1-CG1 3.96Å; F184-V204 HydrophobicContact CZ-CB 4.39Å; F184-V204 HydrophobicContact CZ-CG1 3.87Å
185	M	82.5	Confident	78.9	Confident	101 Å²	101	72.8 Å²	72.8	50%	0.498	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	133.5	172.1	-83.5	176.2	63.8	0	0	110.3	A168 T172 V173 R174	A168-M185 HydrophobicContact CB-CE 4.15Å; T172-M185 HydrophobicContact CG2-CE 4.01Å; T172-M185 VanDerWaalsContact OG1-CE 3.28Å; T172-M185 WeakPolarHBondContact OG1-CE 3.36Å; V173-M185 WeakPolarHBondContact O-CA 3.49Å; R174-M185 HydrophobicContact CG-CG 4.39Å
186	F	80.1	Confident	78.8	Confident	27 Å²	27	72.7 Å²	72.7	12%	0.118	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.1	173	178.3	-106.4	0	0	0	109.4	T172 V173 I175 F184 T188 S192 A194	T172-F186 CarbonylContact C-O 3.49Å; T172-F186 WeakPolarHBondContact CA-O 3.42Å; V173-F186 HydrophobicContact CG2-CB 4.43Å; V173-F186 HydrophobicContact CG2-CD1 4.44Å; V173-F186 PolarHBondContact N-O 3.14Å; V173-F186 PolarHBondContact O-N 3.48Å; I175-F186 HydrophobicContact CD1-CB 3.46Å; I175-F186 VanDerWaalsContact CD1-CB 3.46Å; I175-F186 HydrophobicContact CD1-CD1 3.79Å; I175-F186 HydrophobicContact CD1-CG 3.89Å; I175-F186 HydrophobicContact CG1-CB 4.04Å; F184-F186 HydrophobicContact CE2-CB 4.09Å; F186-T188 HydrophobicContact CD1-CG2 4.39Å; F186-T188 PolarHBondContact O-N 2.72Å; F186-S192 WeakPolarHBondContact CZ-O 3.19Å; F186-A194 HydrophobicContact CB-CB 4.46Å; F186-A194 HydrophobicContact CD1-CB 4.04Å; F186-A194 HydrophobicContact CD2-CB 3.67Å; F186-A194 HydrophobicContact CE1-CB 4.24Å; F186-A194 HydrophobicContact CE2-CB 3.9Å; F186-A194 HydrophobicContact CG-CB 3.76Å; F186-A194 HydrophobicContact CZ-CB 4.2Å
187	N	79.5	Confident	78.7	Confident	49 Å²	49	75.6 Å²	75.6	26%	0.262	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	110.1	174.4	-173.8	-14	0	0	0	108.9	G171 T172 L189 N190	G171-N187 CarbonylContact O-C 3.54Å; G171-N187 WeakPolarHBondContact O-CA 3.34Å; G171-N187 PolarHBondContact O-OD1 2.98Å; G171-N187 VanDerWaalsContact O-OD1 3.09Å; T172-N187 HydrophobicContact CG2-CB 4.17Å; N187-L189 PolarHBondContact O-N 2.87Å; N187-L189 WeakPolarHBondContact OD1-CA 3.27Å; N187-L189 WeakPolarHBondContact OD1-CB 3.37Å; N187-L189 WeakPolarHBondContact OD1-CG 3.47Å; N187-L189 PolarHBondContact OD1-N 2.82Å; N187-N190 HydrophobicContact CB-CB 4.44Å; N187-N190 WeakPolarHBondContact O-CB 3.3Å; N187-N190 PolarHBondContact O-N 2.81Å
188	T	75.9	Confident	78.6	Confident	37 Å²	37	78.1 Å²	78.1	23%	0.227	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-16.4	177.8	60.1	0	0	0	0	113	G171 V173 F186 N190 Y214	G171-T188 PolarHBondContact O-N 3.33Å; G171-T188 PolarHBondContact O-OG1 3.48Å; V173-T188 HydrophobicContact CB-CG2 4.09Å; V173-T188 HydrophobicContact CG1-CG2 3.54Å; V173-T188 HydrophobicContact CG2-CG2 3.39Å; F186-T188 HydrophobicContact CD1-CG2 4.39Å; F186-T188 PolarHBondContact O-N 2.72Å; T188-N190 VanDerWaalsContact C-N 3.26Å; T188-Y214 HydrophobicContact CG2-CE2 4.41Å
189	L	76	Confident	78.4	Confident	122 Å²	122	76.9 Å²	76.9	64%	0.639	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-22.6	171.9	-50.1	176.2	0	0	0	111.5	N187 K191	N187-L189 PolarHBondContact O-N 2.87Å; N187-L189 WeakPolarHBondContact OD1-CA 3.27Å; N187-L189 WeakPolarHBondContact OD1-CB 3.37Å; N187-L189 WeakPolarHBondContact OD1-CG 3.47Å; N187-L189 PolarHBondContact OD1-N 2.82Å; L189-K191 PolarHBondContact O-N 3.46Å
190	N	74.5	Confident	78.2	Confident	89 Å²	89	79.6 Å²	79.6	48%	0.476	40%	0.399	S	S	.	.	S	Bend	trans	-76.2	112.5	171.8	-67.2	-10.9	0	0	0	108.7	N187 T188 S192	N187-N190 HydrophobicContact CB-CB 4.44Å; N187-N190 WeakPolarHBondContact O-CB 3.3Å; N187-N190 PolarHBondContact O-N 2.81Å; T188-N190 VanDerWaalsContact C-N 3.26Å; N190-S192 PolarHBondContact O-N 2.64Å
191	K	67.7	Low	78.1	Confident	199 Å²	199	82.2 Å²	82.2	87%	0.865	41%	0.405	S	S	*	.			trans	-64.9	7.1	179.6	-61.8	-178.5	-179.2	-180	0	114.8	L189	L189-K191 PolarHBondContact O-N 3.46Å
192	S	77.1	Confident	77.9	Confident	70 Å²	70	79.2 Å²	79.2	49%	0.49	39%	0.388	S	S	.	.	S	Bend	trans	-79.3	150.8	174.6	57.6	0	0	0	0	111.5	F186 N190	F186-S192 WeakPolarHBondContact CZ-O 3.19Å; N190-S192 PolarHBondContact O-N 2.64Å
193	L	77.5	Confident	77.4	Confident	83 Å²	83	82.2 Å²	82.2	44%	0.435	40%	0.398	S	S	.	.			trans	-68.6	139.6	167.1	-63	171.6	0	0	0	110.4	R195 L202 R217	L193-R195 PolarHBondContact O-N 2.75Å; L193-L202 HydrophobicContact CB-CD2 3.69Å; L193-L202 HydrophobicContact CD1-CD1 4.33Å; L193-R217 HydrophobicContact CD2-CB 4.27Å
194	A	77	Confident	77.1	Confident	12 Å²	12	78.5 Å²	78.5	10%	0.099	38%	0.379	C	S	.	.			trans	-67.8	104.3	179.3	0	0	0	0	0	110.7	I175 F184 F186 V204	I175-A194 HydrophobicContact CD1-CB 4.19Å; F184-A194 HydrophobicContact CE2-CB 4.49Å; F184-A194 HydrophobicContact CZ-CB 4.36Å; F186-A194 HydrophobicContact CB-CB 4.46Å; F186-A194 HydrophobicContact CD1-CB 4.04Å; F186-A194 HydrophobicContact CD2-CB 3.67Å; F186-A194 HydrophobicContact CE1-CB 4.24Å; F186-A194 HydrophobicContact CE2-CB 3.9Å; F186-A194 HydrophobicContact CG-CB 3.76Å; F186-A194 HydrophobicContact CZ-CB 4.2Å; A194-V204 HydrophobicContact CB-CG2 3.77Å
195	R	80.9	Confident	76.7	Confident	180 Å²	180	81.2 Å²	81.2	68%	0.679	39%	0.392	S	S	*	.			trans	-85.4	126.2	170.2	-72	177.7	-174.9	-165.5	0.8	109.2	L193 P197 L202	L193-R195 PolarHBondContact O-N 2.75Å; R195-P197 WeakPolarHBondContact O-CD 3.22Å; R195-L202 HydrophobicContact CB-CD2 4.28Å; R195-L202 HydrophobicContact CG-CD2 3.23Å; R195-L202 HydrophobicContact CG-CG 4.16Å
196	C	79.2	Confident	76	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	37%	0.374	C	S	.	.			trans	-60.3	122.7	172.4	176.7	0	0	0	0	109.7	C177 F184 H198 C199 R200 K201 V204	C177-C196 HydrophobicContact CB-CB 3.77Å; C177-C196 WeakPolarHBondContact CB-SG 3.39Å; C177-C196 VanDerWaalsContact SG-CB 3.57Å; F184-C196 HydrophobicContact CE1-CB 4.44Å; C196-H198 PolarHBondContact O-N 3.07Å; C196-H198 VanDerWaalsContact O-N 3.13Å; C196-H198 VanDerWaalsContact SG-CB 3.54Å; C196-H198 PolarHBondContact SG-N 3.05Å; C196-C199 PolarHBondContact SG-N 3.25Å; C196-C199 VanDerWaalsContact SG-SG 3.67Å; C196-R200 WeakPolarHBondContact O-CA 3.29Å; C196-R200 PolarHBondContact O-N 2.9Å; C196-K201 WeakPolarHBondContact CB-O 3.4Å; C196-K201 PolarHBondContact N-O 3.38Å; C196-V204 HydrophobicContact CB-CG1 4.45Å
197	P	79.5	Confident	75.4	Confident	80 Å²	80	80.2 Å²	80.2	52%	0.519	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-6.5	177.4	26.4	-31.1	0	0	0	113.2	F184 R195	F184-P197 HydrophobicContact CB-CG 4.14Å; F184-P197 HydrophobicContact CD2-CG 4.33Å; F184-P197 HydrophobicContact CG-CG 4.1Å; R195-P197 WeakPolarHBondContact O-CD 3.22Å
198	H	77.2	Confident	74.6	Confident	52 Å²	52	80.3 Å²	80.3	24%	0.241	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-51.2	-178.7	-53.3	-116.4	0	0	0	111.1	R153 C180 E182 C196	R153-H198 VanDerWaalsContact CZ-CE1 3.47Å; R153-H198 PolarHBondContact NH1-CE1 2.98Å; R153-H198 PolarHBondContact NH1-ND1 2.86Å; R153-H198 PolarHBondContact NH2-CE1 3.31Å; R153-H198 PolarHBondContact NH2-ND1 3.35Å; R153-H198 PolarHBondContact NH2-NE2 2.94Å; C180-H198 HydrophobicContact CB-CB 4.44Å; C180-H198 VanDerWaalsContact SG-CB 3.53Å; E182-H198 HydrophobicContact CB-CB 4.47Å; E182-H198 WeakPolarHBondContact CB-CE1 3.32Å; E182-H198 VanDerWaalsContact CB-ND1 3.33Å; E182-H198 WeakPolarHBondContact CB-ND1 3.35Å; E182-H198 WeakPolarHBondContact CG-ND1 3.38Å; E182-H198 IonicContact OE1-CE1 3.29Å; E182-H198 PolarHBondContact OE1-CE1 3.21Å; E182-H198 VanDerWaalsContact OE1-CE1 3.29Å; E182-H198 IonicContact OE1-ND1 2.99Å; E182-H198 PolarHBondContact OE1-ND1 2.99Å; E182-H198 IonicContact OE2-CE1 3.48Å; E182-H198 PolarHBondContact OE2-CE1 2.94Å; E182-H198 IonicContact OE2-ND1 3.89Å; C196-H198 PolarHBondContact O-N 3.07Å; C196-H198 VanDerWaalsContact O-N 3.13Å; C196-H198 VanDerWaalsContact SG-CB 3.54Å; C196-H198 PolarHBondContact SG-N 3.05Å
199	C	77.4	Confident	73.6	Confident	43 Å²	43	87.7 Å²	87.7	29%	0.291	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-0.9	-176.9	67.4	0	0	0	0	114.1	C177 C196 K201	C177-C199 PolarHBondContact SG-SG 3.21Å; C196-C199 PolarHBondContact SG-N 3.25Å; C196-C199 VanDerWaalsContact SG-SG 3.67Å; C199-K201 HydrophobicContact CB-CG 4.38Å; C199-K201 PolarHBondContact O-N 2.97Å
200	R	76.3	Confident	72.4	Confident	168 Å²	168	88.8 Å²	88.8	63%	0.634	43%	0.425	S	S	*	.			trans	59.8	4.6	-174.8	-58.8	-177.7	178.7	91.9	4.2	115.4	D150 C196	D150-R200 PolarHBondContact O-NH2 3.22Å; C196-R200 WeakPolarHBondContact O-CA 3.29Å; C196-R200 PolarHBondContact O-N 2.9Å
201	K	76.3	Confident	71	Confident	99 Å²	99	88.5 Å²	88.5	43%	0.43	43%	0.428	S	S	.	.			trans	-78.1	153.4	175.9	-59.1	-179	176.2	-175.1	0	110.9	Y179 C196 C199	Y179-K201 HydrophobicContact CD1-CD 3.78Å; Y179-K201 HydrophobicContact CD2-CB 3.55Å; Y179-K201 HydrophobicContact CD2-CD 3.18Å; Y179-K201 HydrophobicContact CD2-CG 3.99Å; Y179-K201 HydrophobicContact CE1-CD 4.01Å; Y179-K201 HydrophobicContact CE2-CB 3.63Å; Y179-K201 HydrophobicContact CE2-CD 3.38Å; Y179-K201 HydrophobicContact CE2-CG 4.11Å; Y179-K201 HydrophobicContact CG-CB 4.5Å; Y179-K201 HydrophobicContact CG-CD 3.36Å; C196-K201 WeakPolarHBondContact CB-O 3.4Å; C196-K201 PolarHBondContact N-O 3.38Å; C199-K201 HydrophobicContact CB-CG 4.38Å; C199-K201 PolarHBondContact O-N 2.97Å
202	L	74.9	Confident	69.9	Low	61 Å²	61	86.1 Å²	86.1	32%	0.319	43%	0.425	S	S	.	.	S	Bend	trans	-91	-8.4	-173.8	-72.3	168.6	0	0	0	114.3	L193 R195	L193-L202 HydrophobicContact CB-CD2 3.69Å; L193-L202 HydrophobicContact CD1-CD1 4.33Å; R195-L202 HydrophobicContact CB-CD2 4.28Å; R195-L202 HydrophobicContact CG-CD2 3.23Å; R195-L202 HydrophobicContact CG-CG 4.16Å
203	Y	72.1	Confident	68.4	Low	130 Å²	130	89.1 Å²	89.1	51%	0.51	43%	0.434	S	S	.	.			trans	-89.5	116.4	-175.6	-56	-102.6	0	0	0	110.8	V178 Y179	V178-Y203 PolarHBondContact N-O 3.03Å; Y179-Y203 AromaticContact CE2-CD2 3.49Å; Y179-Y203 HydrophobicContact CE2-CD2 3.49Å; Y179-Y203 VanDerWaalsContact CE2-CD2 3.49Å; Y179-Y203 HydrophobicContact CE2-CE2 4.45Å; Y179-Y203 AromaticContact CE2-CG 3.82Å; Y179-Y203 HydrophobicContact CE2-CG 3.82Å; Y179-Y203 AromaticContact CZ-CD2 3.78Å; Y179-Y203 WeakPolarHBondContact OH-CD2 3.14Å; Y179-Y203 WeakPolarHBondContact OH-CE2 3.08Å
204	V	76	Confident	67	Low	20 Å²	20	89.7 Å²	89.7	12%	0.121	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	141.5	-169.7	-57.1	0	0	0	0	109.5	I175 S176 C177 F184 A194 C196	I175-V204 HydrophobicContact CD1-CG2 4.37Å; I175-V204 HydrophobicContact CG2-CB 3.36Å; I175-V204 HydrophobicContact CG2-CG2 3.46Å; I175-V204 VanDerWaalsContact CG2-CG2 3.46Å; S176-V204 CarbonylContact O-C 3.58Å; S176-V204 WeakPolarHBondContact O-CA 3.18Å; C177-V204 HydrophobicContact CB-CG1 4.4Å; F184-V204 HydrophobicContact CE1-CB 4.48Å; F184-V204 HydrophobicContact CE1-CG1 3.96Å; F184-V204 HydrophobicContact CZ-CB 4.39Å; F184-V204 HydrophobicContact CZ-CG1 3.87Å; A194-V204 HydrophobicContact CB-CG2 3.77Å; C196-V204 HydrophobicContact CB-CG1 4.45Å
205	H	72.6	Confident	65.4	Low	84 Å²	84	94.3 Å²	94.3	39%	0.389	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	120	-178.7	-121.2	-87.1	0	0	0	109.8	I175 S176 V178 L207	I175-H205 CarbonylContact C-O 3.38Å; I175-H205 VanDerWaalsContact CA-O 3.25Å; I175-H205 WeakPolarHBondContact CA-O 3.12Å; I175-H205 WeakPolarHBondContact CG2-O 3.48Å; S176-H205 PolarHBondContact N-O 3.17Å; S176-H205 PolarHBondContact O-N 3.43Å; S176-H205 VanDerWaalsContact OG-CB 3.32Å; S176-H205 WeakPolarHBondContact OG-CB 3.22Å; S176-H205 PolarHBondContact OG-O 3.03Å; V178-H205 HydrophobicContact CG2-CB 4.42Å; H205-L207 PolarHBondContact O-N 2.7Å
206	I	69.3	Low	63.3	Low	21 Å²	21	91.7 Å²	91.7	11%	0.108	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	125.8	177.4	-53.1	-161.6	0	0	0	108.7	V173 I175 T208 Y214	V173-I206 HydrophobicContact CB-CG2 4.14Å; V173-I206 HydrophobicContact CG2-CD1 4.31Å; V173-I206 HydrophobicContact CG2-CG2 4.24Å; I175-I206 HydrophobicContact CD1-CD1 4.17Å; I175-I206 HydrophobicContact CD1-CG1 3.98Å; I175-I206 HydrophobicContact CG1-CG1 4.05Å; I175-I206 HydrophobicContact CG1-CG2 4.43Å; I175-I206 HydrophobicContact CG2-CG1 4.19Å; I206-T208 VanDerWaalsContact C-N 3.28Å; I206-T208 HydrophobicContact CG2-CG2 3.78Å; I206-T208 WeakPolarHBondContact CG2-OG1 3.19Å; I206-Y214 HydrophobicContact CD1-CD2 3.35Å; I206-Y214 HydrophobicContact CD1-CE2 4.3Å; I206-Y214 HydrophobicContact CD1-CG 3.49Å; I206-Y214 VanDerWaalsContact CD1-CG 3.49Å
207	L	66.9	Low	61.6	Low	86 Å²	86	99.2 Å²	99.2	45%	0.45	48%	0.48	S	S	.	.			trans	-88.8	7.7	-179.8	-63.1	-177.9	0	0	0	113.1	R174 I183 H205	R174-L207 HydrophobicContact CB-CB 4.36Å; R174-L207 PolarHBondContact O-N 3.22Å; I183-L207 HydrophobicContact CB-CD1 4.34Å; I183-L207 HydrophobicContact CD1-CD1 3.52Å; I183-L207 HydrophobicContact CG1-CD1 3.71Å; I183-L207 HydrophobicContact CG2-CD1 3.72Å; H205-L207 PolarHBondContact O-N 2.7Å
208	T	63	Low	59.6	Low	51 Å²	51	99.8 Å²	99.8	31%	0.313	48%	0.478	S	S	.	.	S	Bend	trans	-71.8	146.6	170.8	59.2	0	0	0	0	108.7	V173 I206 H210	V173-T208 HydrophobicContact CB-CG2 3.89Å; V173-T208 HydrophobicContact CG1-CG2 3.89Å; I206-T208 VanDerWaalsContact C-N 3.28Å; I206-T208 HydrophobicContact CG2-CG2 3.78Å; I206-T208 WeakPolarHBondContact CG2-OG1 3.19Å; T208-H210 CarbonylContact O-C 3.57Å; T208-H210 PolarHBondContact O-N 3.18Å
209	E	54.6	Low	57.7	Low	192 Å²	192	102.1 Å²	102.1	90%	0.897	50%	0.496	S	S	*	.	S	Bend	trans	-57	-4.4	177.3	-61.8	-179.9	160.6	0	0	114.4	P211	E209-P211 WeakPolarHBondContact O-CD 3.33Å
210	H	50.7	Low	55.6	Low	144 Å²	144	111.8 Å²	111.8	67%	0.667	54%	0.544	S	S	*	.			trans	-99.6	83.4	163.7	-69.5	-69.2	0	0	0	111.7	T208 L212	T208-H210 CarbonylContact O-C 3.57Å; T208-H210 PolarHBondContact O-N 3.18Å; H210-L212 PolarHBondContact O-N 3.13Å
211	P	44.3	Very low	54.6	Low	83 Å²	83	109 Å²	109	54%	0.539	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-11	-178.5	23.8	-33.1	0	0	0	115	E209	E209-P211 WeakPolarHBondContact O-CD 3.33Å
212	L	44.1	Very low	53.5	Low	150 Å²	150	109.5 Å²	109.5	79%	0.785	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-11	-166.3	-72.1	174.3	0	0	0	116.5	H210	H210-L212 PolarHBondContact O-N 3.13Å
213	L	45.6	Very low	52.3	Low	132 Å²	132	112.2 Å²	112.2	69%	0.691	56%	0.557	S	S	*	*	S	Bend	trans	-89	-10.3	-162.2	-95.4	170.8	0	0	0	117.8
214	Y	48.7	Very low	51.1	Low	95 Å²	95	111.2 Å²	111.2	37%	0.373	56%	0.56	S	S	.	*	S	Bend	trans	-137.9	-3.8	-171.6	-82.2	-90.8	0	0	0	117.8	T188 I206 L216	T188-Y214 HydrophobicContact CG2-CE2 4.41Å; I206-Y214 HydrophobicContact CD1-CD2 3.35Å; I206-Y214 HydrophobicContact CD1-CE2 4.3Å; I206-Y214 HydrophobicContact CD1-CG 3.49Å; I206-Y214 VanDerWaalsContact CD1-CG 3.49Å; Y214-L216 PolarHBondContact O-N 2.92Å; Y214-L216 VanDerWaalsContact O-N 3.09Å
215	M	44.2	Very low	49.6	Very low	110 Å²	110	116.9 Å²	116.9	54%	0.542	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-62.7	-13.4	165.6	-65.5	-65.7	-91.1	0	0	111.7
216	L	37.4	Very low	48	Very low	125 Å²	125	119.1 Å²	119.1	65%	0.654	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-93.2	5.4	-170.3	-79.7	162.1	0	0	0	116.5	Y214	Y214-L216 PolarHBondContact O-N 2.92Å; Y214-L216 VanDerWaalsContact O-N 3.09Å
217	R	42.2	Very low	46.5	Very low	158 Å²	158	126.1 Å²	126.1	60%	0.596	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-90.6	-0.6	177.2	-114.2	-178.2	-176	164.8	5.1	115.7	L193	L193-R217 HydrophobicContact CD2-CB 4.27Å
218	N	36.9	Very low	44.9	Very low	92 Å²	92	129.2 Å²	129.2	49%	0.492	65%	0.651	S	S	.	*	G	3₁₀ helix	trans	-109.7	10.1	173.7	-96.6	11.9	0	0	0	113.4
219	T	37.5	Very low	43.4	Very low	101 Å²	101	135.7 Å²	135.7	62%	0.62	68%	0.679	S	S	*	*			trans	-108.3	73.4	170.8	-32.1	0	0	0	0	107.9
220	L	35.1	Very low	42.4	Very low	246 Å²	246	130.5 Å²	130.5	100%	1.288	66%	0.659	S	S	*	*			trans	-179.7	0	156	-94.5	162.2	0	0	0	109.4

Retrieved 220 of 220 residues in 118.8 ms (Link to these results)

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