A0A087YH25_POEFO Loading...

Cystatin-like

AlphaFold DB , UniProt , Accession A0A087YH25, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 138 aa.

						>A0A087YH25_POEFO|A0A087YH25
MWKVIVPFFAALLAFGFCQMMAGGLHKIEDADNDEGFQRALQFAVVQHNNGTNDTVLYQVLKVVSAERQVVAGTNYVITVILGRTNCEKEAPVDGCAIHKQPGFARPYQCKFNVWSRPWLNDTRLTKEECGNIEPESQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	52.3	Low	253 Å²	253	151.6 Å²	151.6	100%	1.246	78%	0.783	S	S	*	*				0	113	0	-56	-170.8	-73.7	0	0	105.4
2	W	52.5	Low	52.3	Low	228 Å²	228	154.2 Å²	154.2	86%	0.864	80%	0.797	S	S	*	*			cis	-140.6	130.7	25.2	159	-64.5	0	0	0	107.7	V4	W2-V4 HydrophobicContact CZ2-CG2 4.13Å
3	K	51.8	Low	52.5	Low	202 Å²	202	150.2 Å²	150.2	88%	0.878	78%	0.778	S	S	*	*			trans	-87.5	133.2	161.1	-75.3	-179.9	166.7	-175.8	0	106.6
4	V	61.3	Low	52.4	Low	100 Å²	100	147 Å²	147	61%	0.606	78%	0.784	S	S	*	*			trans	-154.1	115	131.2	-173.7	0	0	0	0	108.4	W2 V6	W2-V4 HydrophobicContact CZ2-CG2 4.13Å; V4-V6 HydrophobicContact CG1-CG2 3.79Å
5	I	62.2	Low	52.6	Low	153 Å²	153	146.9 Å²	146.9	79%	0.785	77%	0.774	S	S	*	*			trans	-72.9	129.8	157.8	-73.8	158.2	0	0	0	107.1	P7	I5-P7 HydrophobicContact CG2-CG 4.22Å
6	V	56.7	Low	52.6	Low	124 Å²	124	142.4 Å²	142.4	75%	0.752	77%	0.774	S	S	*	*			trans	-126.5	105.4	157	-175.1	0	0	0	0	107.8	V4	V4-V6 HydrophobicContact CG1-CG2 3.79Å
7	P	56.9	Low	52.6	Low	87 Å²	87	144.7 Å²	144.7	57%	0.565	78%	0.775	S	S	*	*			trans	-78.2	173.6	160.4	29	-13.1	0	0	0	108.2	I5	I5-P7 HydrophobicContact CG2-CG 4.22Å
8	F	44.7	Very low	52.6	Low	171 Å²	171	143.1 Å²	143.1	75%	0.75	78%	0.776	S	S	*	*			trans	96	135	162.7	-93.6	-95.3	0	0	0	120.4
9	F	43.6	Very low	52.5	Low	186 Å²	186	143.3 Å²	143.3	82%	0.816	77%	0.771	S	S	*	*			trans	78.5	118.9	168	-55.8	-76.1	0	0	0	115.5
10	A	53.4	Low	52.6	Low	94 Å²	94	141.7 Å²	141.7	78%	0.777	76%	0.76	S	S	*	*			cis	-142.4	121.7	37.8	0	0	0	0	0	113.3
11	A	54.2	Low	52.7	Low	70 Å²	70	141.7 Å²	141.7	58%	0.579	76%	0.757	S	S	*	*			trans	51.1	92.3	132.4	0	0	0	0	0	117.6	L13	A11-L13 HydrophobicContact CB-CB 4.13Å; A11-L13 HydrophobicContact CB-CD1 4.06Å; A11-L13 HydrophobicContact CB-CG 4.09Å; A11-L13 PolarHBondContact O-N 3.11Å
12	L	53.2	Low	54	Low	182 Å²	182	133.6 Å²	133.6	95%	0.953	73%	0.73	S	S	*	*				-54.1	81.6	129.3	-77.3	165	0	0	0	108.9
13	L	54.7	Low	55	Low	103 Å²	103	124.1 Å²	124.1	54%	0.539	70%	0.703	S	S	.	*			trans	-139.1	69.9	161.4	-70.1	171.3	0	0	0	105.8	A11 F15	A11-L13 HydrophobicContact CB-CB 4.13Å; A11-L13 HydrophobicContact CB-CD1 4.06Å; A11-L13 HydrophobicContact CB-CG 4.09Å; A11-L13 PolarHBondContact O-N 3.11Å; L13-F15 HydrophobicContact CB-CD2 3.54Å; L13-F15 HydrophobicContact CB-CE2 3.89Å; L13-F15 HydrophobicContact CB-CG 4.32Å; L13-F15 HydrophobicContact CD1-CD2 3.82Å; L13-F15 HydrophobicContact CD1-CE2 3.27Å; L13-F15 HydrophobicContact CD1-CZ 4.15Å; L13-F15 HydrophobicContact CD2-CD2 3.85Å; L13-F15 HydrophobicContact CD2-CE1 4.37Å; L13-F15 HydrophobicContact CD2-CE2 3.48Å; L13-F15 VanDerWaalsContact CD2-CE2 3.48Å; L13-F15 HydrophobicContact CD2-CG 4.44Å; L13-F15 HydrophobicContact CD2-CZ 3.75Å; L13-F15 HydrophobicContact CG-CD2 3.9Å; L13-F15 HydrophobicContact CG-CE2 3.69Å; L13-F15 HydrophobicContact CG-CZ 4.44Å; L13-F15 PolarHBondContact O-N 3.18Å
14	A	51.2	Low	56.7	Low	105 Å²	105	116.6 Å²	116.6	87%	0.868	68%	0.683	S	S	*	*			trans	-63.4	66.5	138	0	0	0	0	0	106.6	G16	A14-G16 VanDerWaalsContact C-N 3.31Å; A14-G16 PolarHBondContact O-N 3.46Å
15	F	54.7	Low	58.3	Low	146 Å²	146	115.6 Å²	115.6	64%	0.64	67%	0.674	S	S	*	*			trans	-52.8	112.7	153.1	-88.6	-65.7	0	0	0	102.9	L13 F17	L13-F15 HydrophobicContact CB-CD2 3.54Å; L13-F15 HydrophobicContact CB-CE2 3.89Å; L13-F15 HydrophobicContact CB-CG 4.32Å; L13-F15 HydrophobicContact CD1-CD2 3.82Å; L13-F15 HydrophobicContact CD1-CE2 3.27Å; L13-F15 HydrophobicContact CD1-CZ 4.15Å; L13-F15 HydrophobicContact CD2-CD2 3.85Å; L13-F15 HydrophobicContact CD2-CE1 4.37Å; L13-F15 HydrophobicContact CD2-CE2 3.48Å; L13-F15 VanDerWaalsContact CD2-CE2 3.48Å; L13-F15 HydrophobicContact CD2-CG 4.44Å; L13-F15 HydrophobicContact CD2-CZ 3.75Å; L13-F15 HydrophobicContact CG-CD2 3.9Å; L13-F15 HydrophobicContact CG-CE2 3.69Å; L13-F15 HydrophobicContact CG-CZ 4.44Å; L13-F15 PolarHBondContact O-N 3.18Å; F15-F17 PolarHBondContact O-N 3.02Å
16	G	53.5	Low	59.8	Low	74 Å²	74	113.6 Å²	113.6	76%	0.763	66%	0.661	S	S	*	*			trans	-55.1	89.7	170	0	0	0	0	0	107.2	A14 C18	A14-G16 VanDerWaalsContact C-N 3.31Å; A14-G16 PolarHBondContact O-N 3.46Å; G16-C18 PolarHBondContact O-N 3.33Å
17	F	51.3	Low	61.7	Low	182 Å²	182	115.3 Å²	115.3	80%	0.798	66%	0.658	S	S	*	*			trans	-62.4	93.2	149.2	-94.9	-93.2	0	0	0	102.8	F15 Q19	F15-F17 PolarHBondContact O-N 3.02Å; F17-Q19 HydrophobicContact CB-CG 4.11Å; F17-Q19 PolarHBondContact O-N 3.28Å
18	C	53.4	Low	63.6	Low	116 Å²	116	111.8 Å²	111.8	78%	0.784	63%	0.634	S	S	*	*			trans	-60.5	81	155.8	-155.4	0	0	0	0	104	G16 M20	G16-C18 PolarHBondContact O-N 3.33Å; C18-M20 PolarHBondContact O-N 3.33Å
19	Q	50.8	Low	65.9	Low	147 Å²	147	112.9 Å²	112.9	69%	0.687	64%	0.642	S	S	*	*			trans	-64.6	97.1	169	-71.4	-170.1	-72.3	0	0	103.2	F17 M21	F17-Q19 HydrophobicContact CB-CG 4.11Å; F17-Q19 PolarHBondContact O-N 3.28Å; Q19-M21 HydrophobicContact CB-SD 4.21Å; Q19-M21 PolarHBondContact O-N 3.32Å
20	M	54.7	Low	68.3	Low	110 Å²	110	108 Å²	108	54%	0.542	63%	0.625	S	S	.	*			trans	-59.1	93.1	163.8	-77.9	-169.3	144.8	0	0	105.5	C18 A22 V70	C18-M20 PolarHBondContact O-N 3.33Å; M20-A22 PolarHBondContact O-N 2.92Å; M20-V70 HydrophobicContact CB-CG1 4.2Å; M20-V70 HydrophobicContact CB-CG2 4.05Å
21	M	55	Low	70.3	Confident	143 Å²	143	104.2 Å²	104.2	70%	0.704	59%	0.593	S	S	*	*			trans	-60.1	125.3	-178.6	-62.3	-67.2	-89.9	0	0	106.9	Q19 G23	Q19-M21 HydrophobicContact CB-SD 4.21Å; Q19-M21 PolarHBondContact O-N 3.32Å; M21-G23 PolarHBondContact O-N 2.02Å
22	A	64.8	Low	72.1	Confident	82 Å²	82	106.8 Å²	106.8	68%	0.678	60%	0.597	S	S	*	*	S	Bend	trans	-56.6	123.5	164.5	0	0	0	0	0	107	M20 V70	M20-A22 PolarHBondContact O-N 2.92Å; A22-V70 VanDerWaalsContact CA-O 3.3Å; A22-V70 WeakPolarHBondContact CA-O 3.38Å
23	G	73.3	Confident	74.1	Confident	29 Å²	29	104 Å²	104	30%	0.299	58%	0.583	S	S	.	*			trans	-159.4	-169.6	-158.4	0	0	0	0	0	114	M21 Q69 V70	M21-G23 PolarHBondContact O-N 2.02Å; G23-Q69 WeakPolarHBondContact O-CG 2.99Å; G23-Q69 PolarHBondContact O-NE2 2.97Å; G23-V70 PolarHBondContact N-O 3.26Å
24	G	87.4	Confident	76.1	Confident	44 Å²	44	100.4 Å²	100.4	45%	0.454	56%	0.564	S	S	.	*	S	Bend	trans	-70	179.1	177.1	0	0	0	0	0	112.9	H26	G24-H26 PolarHBondContact O-CD2 3.08Å
25	L	93.6	Very high	78.3	Confident	79 Å²	79	102.2 Å²	102.2	41%	0.414	56%	0.555	S	S	.	*			trans	-71.5	128.4	173.5	-158.9	69.3	0	0	0	108.9	E67 Q69 V77	L25-E67 HydrophobicContact CD1-CB 4.18Å; L25-E67 HydrophobicContact CD2-CB 4.2Å; L25-E67 WeakPolarHBondContact CD2-OE2 3.34Å; L25-E67 HydrophobicContact CG-CB 3.92Å; L25-E67 WeakPolarHBondContact CG-OE2 3.25Å; L25-Q69 HydrophobicContact CD1-CB 4.04Å; L25-V77 HydrophobicContact CD1-CB 4.35Å; L25-V77 HydrophobicContact CD1-CG2 3.78Å
26	H	94.3	Very high	80.3	Confident	111 Å²	111	95.8 Å²	95.8	51%	0.514	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131.2	180	-69.5	-81.6	0	0	0	110.2	G24 E67 R68	G24-H26 PolarHBondContact O-CD2 3.08Å; H26-E67 CarbonylContact O-C 3.42Å; H26-E67 VanDerWaalsContact O-CA 3.26Å; H26-E67 WeakPolarHBondContact O-CA 3.28Å; H26-R68 PolarHBondContact N-O 3.02Å; H26-R68 PolarHBondContact O-N 2.91Å
27	K	96.8	Very high	82.4	Confident	161 Å²	161	92.3 Å²	92.3	70%	0.7	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	139.5	172.8	-169.2	176	179.9	-178.6	0	110.5
28	I	96.4	Very high	84.7	Confident	13 Å²	13	86.8 Å²	86.8	7%	0.067	47%	0.47	C	S	.	.			trans	-92.6	110	171.6	-51.8	178.2	0	0	0	106.6	A31 D34 F37 A66 R68 Y76	I28-A31 HydrophobicContact CG2-CB 4.3Å; I28-D34 HydrophobicContact CG2-CB 3.89Å; I28-F37 HydrophobicContact CD1-CB 3.77Å; I28-F37 HydrophobicContact CD1-CD2 3.74Å; I28-F37 HydrophobicContact CD1-CG 3.96Å; I28-A66 HydrophobicContact CB-CB 4.06Å; I28-A66 HydrophobicContact CD1-CB 4.41Å; I28-A66 PolarHBondContact N-O 3.32Å; I28-R68 HydrophobicContact CD1-CB 4.1Å; I28-R68 HydrophobicContact CD1-CG 4.22Å; I28-R68 HydrophobicContact CG1-CB 4.31Å; I28-R68 HydrophobicContact CG1-CG 3.99Å; I28-Y76 HydrophobicContact CD1-CD1 4.12Å; I28-Y76 HydrophobicContact CD1-CE1 4.15Å
29	E	93.3	Very high	86.8	Confident	193 Å²	193	87.3 Å²	87.3	90%	0.902	46%	0.456	S	S	*	.	S	Bend	trans	-71.4	-39.3	-176.8	-63.3	-173.6	162.1	0	0	112
30	D	94.2	Very high	89.1	Confident	85 Å²	85	80.4 Å²	80.4	46%	0.455	42%	0.424	S	S	.	.			trans	-115.9	73	-180	-169.6	-5.7	0	0	0	110.1	D32 N33 D34	D30-D32 PolarHBondContact O-N 3.47Å; D30-N33 VanDerWaalsContact CG-ND2 3.26Å; D30-N33 PolarHBondContact O-N 3.2Å; D30-N33 PolarHBondContact OD1-N 3.44Å; D30-N33 PolarHBondContact OD1-ND2 3.22Å; D30-N33 VanDerWaalsContact OD1-ND2 3.09Å; D30-N33 PolarHBondContact OD2-ND2 3.34Å; D30-D34 PolarHBondContact O-N 3.2Å
31	A	94.6	Very high	91.2	Very high	14 Å²	14	75.7 Å²	75.7	12%	0.116	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-28.4	-176.7	0	0	0	0	0	112.6	I28 N33 D34 F37 Q38 A66	I28-A31 HydrophobicContact CG2-CB 4.3Å; A31-N33 VanDerWaalsContact C-N 3.28Å; A31-N33 PolarHBondContact O-N 3.02Å; A31-D34 PolarHBondContact O-N 3.23Å; A31-F37 HydrophobicContact CB-CD1 3.89Å; A31-F37 HydrophobicContact CB-CE1 3.74Å; A31-F37 HydrophobicContact CB-CZ 4.31Å; A31-F37 WeakPolarHBondContact O-CD1 3.48Å; A31-Q38 PolarHBondContact O-NE2 3.26Å; A31-A66 HydrophobicContact CB-CB 3.68Å
32	D	93.4	Very high	93.2	Very high	124 Å²	124	75.3 Å²	75.3	66%	0.663	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-30.2	-179.9	-67.1	-25.2	0	0	0	111.8	D30	D30-D32 PolarHBondContact O-N 3.47Å
33	N	95.4	Very high	94.8	Very high	123 Å²	123	73.9 Å²	73.9	66%	0.658	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-2	178.5	-65.1	-47.4	0	0	0	114.6	D30 A31 E35	D30-N33 VanDerWaalsContact CG-ND2 3.26Å; D30-N33 PolarHBondContact O-N 3.2Å; D30-N33 PolarHBondContact OD1-N 3.44Å; D30-N33 PolarHBondContact OD1-ND2 3.22Å; D30-N33 VanDerWaalsContact OD1-ND2 3.09Å; D30-N33 PolarHBondContact OD2-ND2 3.34Å; A31-N33 VanDerWaalsContact C-N 3.28Å; A31-N33 PolarHBondContact O-N 3.02Å; N33-E35 PolarHBondContact O-N 3.47Å
34	D	97	Very high	96	Very high	27 Å²	27	72.5 Å²	72.5	14%	0.144	36%	0.362	C	S	.	.			trans	-86	97.8	174.2	-171.7	-49.7	0	0	0	110.6	I28 D30 A31 G36 F37 Q38 R68	I28-D34 HydrophobicContact CG2-CB 3.89Å; D30-D34 PolarHBondContact O-N 3.2Å; A31-D34 PolarHBondContact O-N 3.23Å; D34-G36 PolarHBondContact O-N 3.49Å; D34-G36 WeakPolarHBondContact OD1-CA 3.2Å; D34-G36 PolarHBondContact OD1-N 2.71Å; D34-F37 HydrophobicContact CB-CB 3.91Å; D34-F37 WeakPolarHBondContact O-CB 3.25Å; D34-F37 PolarHBondContact O-N 2.88Å; D34-F37 PolarHBondContact OD1-N 2.88Å; D34-Q38 WeakPolarHBondContact O-CG 3.35Å; D34-Q38 PolarHBondContact O-N 3.36Å; D34-R68 IonicContact OD2-CZ 3.9Å; D34-R68 IonicContact OD2-NH1 2.84Å; D34-R68 PolarHBondContact OD2-NH1 3.36Å
35	E	96.8	Very high	96.5	Very high	144 Å²	144	71.3 Å²	71.3	67%	0.673	35%	0.346	S	S	*	.	H	α-helix	trans	-57.8	-31.6	-179.1	-64.9	-175.2	176.5	0	0	114.1	N33 R39	N33-E35 PolarHBondContact O-N 3.47Å; E35-R39 WeakPolarHBondContact O-CB 2.97Å; E35-R39 WeakPolarHBondContact O-CG 3.3Å; E35-R39 PolarHBondContact O-N 3.25Å; E35-R39 VanDerWaalsContact O-N 3.09Å; E35-R39 PolarHBondContact O-NE 3.44Å
36	G	96.6	Very high	96.6	Very high	11 Å²	11	71 Å²	71	11%	0.113	35%	0.346	C	S	.	.	H	α-helix	trans	-70.2	-43.8	179.6	0	0	0	0	0	110.9	D34 A40 Y76	D34-G36 PolarHBondContact O-N 3.49Å; D34-G36 WeakPolarHBondContact OD1-CA 3.2Å; D34-G36 PolarHBondContact OD1-N 2.71Å; G36-A40 WeakPolarHBondContact O-CB 3.28Å; G36-A40 PolarHBondContact O-N 3.36Å; G36-Y76 VanDerWaalsContact C-CZ 3.48Å; G36-Y76 VanDerWaalsContact C-OH 3.3Å; G36-Y76 WeakPolarHBondContact CA-OH 3.44Å
37	F	98.1	Very high	96.7	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-62.3	-47.5	172	173.1	-96.2	0	0	0	111.8	I28 A31 D34 R39 A40 L41 V63 A66 Y76 I78	I28-F37 HydrophobicContact CD1-CB 3.77Å; I28-F37 HydrophobicContact CD1-CD2 3.74Å; I28-F37 HydrophobicContact CD1-CG 3.96Å; A31-F37 HydrophobicContact CB-CD1 3.89Å; A31-F37 HydrophobicContact CB-CE1 3.74Å; A31-F37 HydrophobicContact CB-CZ 4.31Å; A31-F37 WeakPolarHBondContact O-CD1 3.48Å; D34-F37 HydrophobicContact CB-CB 3.91Å; D34-F37 WeakPolarHBondContact O-CB 3.25Å; D34-F37 PolarHBondContact O-N 2.88Å; D34-F37 PolarHBondContact OD1-N 2.88Å; F37-R39 VanDerWaalsContact C-N 3.32Å; F37-R39 PolarHBondContact O-N 3.04Å; F37-A40 WeakPolarHBondContact O-CB 3.39Å; F37-A40 PolarHBondContact O-N 3.28Å; F37-A40 VanDerWaalsContact O-N 3.09Å; F37-L41 HydrophobicContact CE1-CB 4.45Å; F37-L41 HydrophobicContact CE1-CD2 4.02Å; F37-L41 HydrophobicContact CZ-CD2 4.27Å; F37-L41 WeakPolarHBondContact O-CB 3.32Å; F37-L41 PolarHBondContact O-N 3.09Å; F37-V63 HydrophobicContact CZ-CG1 3.91Å; F37-A66 HydrophobicContact CD2-CB 3.91Å; F37-A66 HydrophobicContact CE1-CB 4.22Å; F37-A66 HydrophobicContact CE2-CB 3.33Å; F37-A66 HydrophobicContact CZ-CB 3.52Å; F37-Y76 HydrophobicContact CB-CD1 4.18Å; F37-Y76 HydrophobicContact CB-CE1 3.95Å; F37-Y76 HydrophobicContact CD2-CD1 4.12Å; F37-I78 HydrophobicContact CD2-CD1 4.44Å; F37-I78 HydrophobicContact CD2-CG1 4.32Å; F37-I78 HydrophobicContact CE2-CB 4.27Å; F37-I78 HydrophobicContact CE2-CD1 4.15Å; F37-I78 HydrophobicContact CE2-CG1 3.8Å; F37-I78 HydrophobicContact CE2-CG2 3.78Å; F37-I78 HydrophobicContact CZ-CG2 3.9Å
38	Q	98.3	Very high	96.8	Very high	67 Å²	67	61.8 Å²	61.8	31%	0.313	31%	0.306	S	S	.	.	H	α-helix	trans	-59.2	-42.5	179.9	-69.6	-61.3	-33.6	0	0	112	A31 D34 L41 Q42	A31-Q38 PolarHBondContact O-NE2 3.26Å; D34-Q38 WeakPolarHBondContact O-CG 3.35Å; D34-Q38 PolarHBondContact O-N 3.36Å; Q38-L41 PolarHBondContact O-N 2.92Å; Q38-Q42 WeakPolarHBondContact O-CB 3.42Å; Q38-Q42 PolarHBondContact O-N 3.39Å
39	R	98.1	Very high	96.7	Very high	127 Å²	127	61.6 Å²	61.6	48%	0.479	31%	0.305	S	S	.	.	H	α-helix	trans	-63.9	-42.4	173.7	-78.8	-178.9	-82.4	136.6	-12.2	112.5	E35 F37 F43	E35-R39 WeakPolarHBondContact O-CB 2.97Å; E35-R39 WeakPolarHBondContact O-CG 3.3Å; E35-R39 PolarHBondContact O-N 3.25Å; E35-R39 VanDerWaalsContact O-N 3.09Å; E35-R39 PolarHBondContact O-NE 3.44Å; F37-R39 VanDerWaalsContact C-N 3.32Å; F37-R39 PolarHBondContact O-N 3.04Å; R39-F43 VanDerWaalsContact O-CB 3.31Å; R39-F43 WeakPolarHBondContact O-CB 3.35Å; R39-F43 PolarHBondContact O-N 2.85Å
40	A	98.4	Very high	96.8	Very high	2 Å²	2	58 Å²	58	2%	0.017	29%	0.293	C	S	.	.	H	α-helix	trans	-64.6	-41.6	177.6	0	0	0	0	0	111.9	G36 F37 F43 A44 Y76 I78 V114	G36-A40 WeakPolarHBondContact O-CB 3.28Å; G36-A40 PolarHBondContact O-N 3.36Å; F37-A40 WeakPolarHBondContact O-CB 3.39Å; F37-A40 PolarHBondContact O-N 3.28Å; F37-A40 VanDerWaalsContact O-N 3.09Å; A40-F43 PolarHBondContact O-N 3.15Å; A40-A44 WeakPolarHBondContact O-CB 3.42Å; A40-A44 PolarHBondContact O-N 2.74Å; A40-Y76 HydrophobicContact CB-CD1 4.48Å; A40-Y76 HydrophobicContact CB-CD2 3.44Å; A40-Y76 VanDerWaalsContact CB-CD2 3.44Å; A40-Y76 HydrophobicContact CB-CE2 3.93Å; A40-Y76 HydrophobicContact CB-CG 3.75Å; A40-I78 HydrophobicContact CB-CD1 4.07Å; A40-V114 HydrophobicContact CB-CB 4.1Å; A40-V114 HydrophobicContact CB-CG1 3.88Å
41	L	98.6	Very high	96.8	Very high	11 Å²	11	56.9 Å²	56.9	6%	0.058	30%	0.301	C	S	.	.	H	α-helix	trans	-62.8	-50.1	176	174.6	58.2	0	0	0	111.2	F37 Q38 F43 A44 V45 V60 V63 I78 V80	F37-L41 HydrophobicContact CE1-CB 4.45Å; F37-L41 HydrophobicContact CE1-CD2 4.02Å; F37-L41 HydrophobicContact CZ-CD2 4.27Å; F37-L41 WeakPolarHBondContact O-CB 3.32Å; F37-L41 PolarHBondContact O-N 3.09Å; Q38-L41 PolarHBondContact O-N 2.92Å; L41-F43 VanDerWaalsContact C-N 3.3Å; L41-F43 PolarHBondContact O-N 2.99Å; L41-A44 PolarHBondContact O-N 2.93Å; L41-V45 HydrophobicContact CD1-CG2 4.1Å; L41-V45 WeakPolarHBondContact O-CG2 3.43Å; L41-V45 PolarHBondContact O-N 3.35Å; L41-V60 HydrophobicContact CD1-CG2 3.9Å; L41-V60 HydrophobicContact CD2-CG2 4.32Å; L41-V60 HydrophobicContact CG-CG2 4.27Å; L41-V63 HydrophobicContact CD2-CG2 4.02Å; L41-I78 HydrophobicContact CB-CD1 4.23Å; L41-I78 HydrophobicContact CD1-CG2 3.77Å; L41-V80 HydrophobicContact CD1-CG1 3.72Å
42	Q	97.8	Very high	96.7	Very high	134 Å²	134	57.9 Å²	57.9	63%	0.626	31%	0.306	S	S	*	.	H	α-helix	trans	-58.1	-45.5	177	-174.4	-176.8	17.4	0	0	111.2	Q38 A44 V45 V46	Q38-Q42 WeakPolarHBondContact O-CB 3.42Å; Q38-Q42 PolarHBondContact O-N 3.39Å; Q42-A44 PolarHBondContact O-N 2.82Å; Q42-V45 PolarHBondContact O-N 3.32Å; Q42-V46 WeakPolarHBondContact O-CG2 3.47Å; Q42-V46 PolarHBondContact O-N 2.81Å
43	F	98.4	Very high	96.6	Very high	53 Å²	53	60.2 Å²	60.2	23%	0.232	32%	0.318	C	S	.	.	H	α-helix	trans	-58	-47.5	176.3	-179.9	-86.3	0	0	0	111.5	R39 A40 L41 V45 V46 Q47 V114 T123 L125	R39-F43 VanDerWaalsContact O-CB 3.31Å; R39-F43 WeakPolarHBondContact O-CB 3.35Å; R39-F43 PolarHBondContact O-N 2.85Å; A40-F43 PolarHBondContact O-N 3.15Å; L41-F43 VanDerWaalsContact C-N 3.3Å; L41-F43 PolarHBondContact O-N 2.99Å; F43-V45 PolarHBondContact O-N 2.93Å; F43-V46 PolarHBondContact O-N 3.18Å; F43-Q47 HydrophobicContact CD1-CG 3.97Å; F43-Q47 HydrophobicContact CE1-CG 3.51Å; F43-Q47 HydrophobicContact CE2-CG 4.39Å; F43-Q47 HydrophobicContact CZ-CG 3.76Å; F43-Q47 VanDerWaalsContact CZ-NE2 3.32Å; F43-Q47 WeakPolarHBondContact O-CG 3.18Å; F43-Q47 PolarHBondContact O-N 3.09Å; F43-V114 HydrophobicContact CD1-CG1 4.14Å; F43-T123 HydrophobicContact CB-CG2 4.3Å; F43-T123 HydrophobicContact CD1-CG2 3.75Å; F43-T123 HydrophobicContact CD2-CG2 3.91Å; F43-T123 HydrophobicContact CE1-CG2 4.01Å; F43-T123 HydrophobicContact CE2-CG2 4.15Å; F43-T123 HydrophobicContact CG-CG2 3.7Å; F43-T123 HydrophobicContact CZ-CG2 4.2Å; F43-T123 WeakPolarHBondContact CZ-O 3.44Å; F43-L125 HydrophobicContact CE1-CB 4.17Å
44	A	98.5	Very high	96.4	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.6	-45	178.6	0	0	0	0	0	112.3	A40 L41 Q42 V46 Q47 H48 F112 V114 L125	A40-A44 WeakPolarHBondContact O-CB 3.42Å; A40-A44 PolarHBondContact O-N 2.74Å; L41-A44 PolarHBondContact O-N 2.93Å; Q42-A44 PolarHBondContact O-N 2.82Å; A44-V46 PolarHBondContact O-N 2.86Å; A44-Q47 PolarHBondContact O-N 3.36Å; A44-H48 WeakPolarHBondContact O-CB 3.42Å; A44-H48 PolarHBondContact O-N 3.34Å; A44-F112 HydrophobicContact CB-CB 3.97Å; A44-F112 HydrophobicContact CB-CD1 4.35Å; A44-F112 HydrophobicContact CB-CD2 3.74Å; A44-F112 HydrophobicContact CB-CE2 4.26Å; A44-F112 HydrophobicContact CB-CG 3.77Å; A44-V114 HydrophobicContact CB-CG2 3.77Å; A44-L125 HydrophobicContact CB-CD1 4.29Å
45	V	97.4	Very high	96.1	Very high	19 Å²	19	59.4 Å²	59.4	12%	0.115	32%	0.317	C	S	.	.	H	α-helix	trans	-65.4	-38.6	179.9	173.9	0	0	0	0	111.7	L41 Q42 F43 N49 V60 L82	L41-V45 HydrophobicContact CD1-CG2 4.1Å; L41-V45 WeakPolarHBondContact O-CG2 3.43Å; L41-V45 PolarHBondContact O-N 3.35Å; Q42-V45 PolarHBondContact O-N 3.32Å; F43-V45 PolarHBondContact O-N 2.93Å; V45-N49 WeakPolarHBondContact CG1-ND2 3.3Å; V45-N49 WeakPolarHBondContact O-CB 3.48Å; V45-N49 PolarHBondContact O-N 3.43Å; V45-N49 PolarHBondContact O-ND2 2.95Å; V45-V60 HydrophobicContact CG2-CG2 3.58Å; V45-L82 HydrophobicContact CG2-CD2 4.32Å
46	V	96.1	Very high	95.8	Very high	71 Å²	71	53.3 Å²	53.3	43%	0.43	29%	0.29	S	S	.	.	H	α-helix	trans	-64.5	-46.2	174.6	169.8	0	0	0	0	110.8	Q42 F43 A44 N49 N50	Q42-V46 WeakPolarHBondContact O-CG2 3.47Å; Q42-V46 PolarHBondContact O-N 2.81Å; F43-V46 PolarHBondContact O-N 3.18Å; A44-V46 PolarHBondContact O-N 2.86Å; V46-N49 PolarHBondContact O-N 2.94Å; V46-N50 PolarHBondContact O-N 2.76Å
47	Q	97.5	Very high	95.6	Very high	75 Å²	75	54.4 Å²	54.4	35%	0.35	29%	0.293	S	S	.	.	H	α-helix	trans	-63.6	-42.6	178.2	-67.3	-59.9	-13.2	0	0	112	F43 A44 N49 N50 G51 L125	F43-Q47 HydrophobicContact CD1-CG 3.97Å; F43-Q47 HydrophobicContact CE1-CG 3.51Å; F43-Q47 HydrophobicContact CE2-CG 4.39Å; F43-Q47 HydrophobicContact CZ-CG 3.76Å; F43-Q47 VanDerWaalsContact CZ-NE2 3.32Å; F43-Q47 WeakPolarHBondContact O-CG 3.18Å; F43-Q47 PolarHBondContact O-N 3.09Å; A44-Q47 PolarHBondContact O-N 3.36Å; Q47-N49 PolarHBondContact O-N 3.17Å; Q47-N50 PolarHBondContact O-N 2.88Å; Q47-G51 PolarHBondContact O-N 2.79Å; Q47-L125 HydrophobicContact CB-CB 4.39Å; Q47-L125 HydrophobicContact CB-CD2 3.73Å; Q47-L125 HydrophobicContact CG-CB 4.39Å
48	H	97.2	Very high	95.4	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.019	30%	0.297	C	S	.	.	H	α-helix	trans	-56.3	-51.4	173.5	176.7	75.3	0	0	0	111.3	A44 N50 G51 T52 L82 Y108 F112 E128	A44-H48 WeakPolarHBondContact O-CB 3.42Å; A44-H48 PolarHBondContact O-N 3.34Å; H48-N50 VanDerWaalsContact C-N 3.32Å; H48-N50 PolarHBondContact O-N 2.77Å; H48-G51 PolarHBondContact O-N 2.84Å; H48-G51 VanDerWaalsContact O-N 3.13Å; H48-T52 WeakPolarHBondContact O-CG2 3.17Å; H48-T52 PolarHBondContact O-N 2.91Å; H48-T52 PolarHBondContact O-OG1 3.28Å; H48-L82 VanDerWaalsContact CD2-CD1 3.41Å; H48-L82 WeakPolarHBondContact CD2-CD1 3.5Å; H48-L82 WeakPolarHBondContact NE2-CD1 3.03Å; H48-Y108 AromaticContact CE1-CE2 3.94Å; H48-Y108 PolarHBondContact CE1-OH 3.44Å; H48-Y108 AromaticContact NE2-CE2 3.89Å; H48-Y108 AromaticContact NE2-CZ 3.71Å; H48-Y108 PolarHBondContact NE2-OH 2.92Å; H48-F112 HydrophobicContact CB-CE1 4.13Å; H48-F112 HydrophobicContact CB-CZ 3.98Å; H48-E128 IonicContact CE1-OE1 3.48Å; H48-E128 PolarHBondContact CE1-OE1 2.82Å; H48-E128 IonicContact CG-OE1 3.68Å; H48-E128 IonicContact ND1-OE1 2.64Å; H48-E128 PolarHBondContact ND1-OE1 3.29Å
49	N	95.6	Very high	95.2	Very high	9 Å²	9	55.3 Å²	55.3	5%	0.048	30%	0.296	C	S	.	.	H	α-helix	trans	-59.6	-41.4	177.9	-82.1	-60	0	0	0	112.3	V45 V46 Q47 G51 T52 L57 Y58 K89	V45-N49 WeakPolarHBondContact CG1-ND2 3.3Å; V45-N49 WeakPolarHBondContact O-CB 3.48Å; V45-N49 PolarHBondContact O-N 3.43Å; V45-N49 PolarHBondContact O-ND2 2.95Å; V46-N49 PolarHBondContact O-N 2.94Å; Q47-N49 PolarHBondContact O-N 3.17Å; N49-G51 VanDerWaalsContact C-N 3.32Å; N49-G51 PolarHBondContact O-N 3.19Å; N49-T52 PolarHBondContact O-OG1 2.55Å; N49-L57 HydrophobicContact CB-CD2 3.99Å; N49-L57 WeakPolarHBondContact OD1-CA 3.5Å; N49-Y58 PolarHBondContact ND2-O 3.08Å; N49-Y58 PolarHBondContact OD1-N 2.98Å; N49-K89 WeakPolarHBondContact O-CE 3.41Å; N49-K89 PolarHBondContact O-NZ 2.86Å
50	N	94.7	Very high	95.1	Very high	119 Å²	119	51.4 Å²	51.4	64%	0.636	29%	0.287	S	S	*	.	H	α-helix	trans	-69	-30.3	176.9	-72.7	-8.3	0	0	0	113.1	V46 Q47 H48	V46-N50 PolarHBondContact O-N 2.76Å; Q47-N50 PolarHBondContact O-N 2.88Å; H48-N50 VanDerWaalsContact C-N 3.32Å; H48-N50 PolarHBondContact O-N 2.77Å
51	G	94.2	Very high	94.9	Very high	61 Å²	61	55.8 Å²	55.8	63%	0.629	31%	0.309	S	S	*	.	H	α-helix	trans	-82.9	-21.5	-179	0	0	0	0	0	114.7	Q47 H48 N49	Q47-G51 PolarHBondContact O-N 2.79Å; H48-G51 PolarHBondContact O-N 2.84Å; H48-G51 VanDerWaalsContact O-N 3.13Å; N49-G51 VanDerWaalsContact C-N 3.32Å; N49-G51 PolarHBondContact O-N 3.19Å
52	T	92.8	Very high	94.7	Very high	35 Å²	35	61.1 Å²	61.1	22%	0.215	33%	0.332	C	S	.	.	S	Bend	trans	-81.6	146.8	177.9	58.1	0	0	0	0	112.5	H48 N49 D54 K89	H48-T52 WeakPolarHBondContact O-CG2 3.17Å; H48-T52 PolarHBondContact O-N 2.91Å; H48-T52 PolarHBondContact O-OG1 3.28Å; N49-T52 PolarHBondContact O-OG1 2.55Å; T52-D54 VanDerWaalsContact C-N 3.26Å; T52-D54 PolarHBondContact O-N 3.04Å; T52-K89 PolarHBondContact O-NZ 2.8Å; T52-K89 PolarHBondContact OG1-NZ 2.05Å
53	N	92.3	Very high	94.6	Very high	172 Å²	172	56.9 Å²	56.9	92%	0.92	32%	0.315	S	S	*	.			trans	-85.3	8	172.8	-68.5	-26.6	0	0	0	113.6
54	D	90.3	Very high	94.6	Very high	40 Å²	40	57.6 Å²	57.6	21%	0.214	32%	0.324	C	S	.	.			trans	-71.2	150.2	176.3	-154.5	-27.2	0	0	0	110.4	T52 V56 Y58 R84 K89	T52-D54 VanDerWaalsContact C-N 3.26Å; T52-D54 PolarHBondContact O-N 3.04Å; D54-V56 VanDerWaalsContact C-N 3.32Å; D54-V56 PolarHBondContact OD1-N 2.96Å; D54-Y58 HydrophobicContact CB-CE2 3.91Å; D54-Y58 WeakPolarHBondContact OD2-CE2 3.47Å; D54-Y58 PolarHBondContact OD2-OH 3.32Å; D54-R84 IonicContact OD1-NH2 3.28Å; D54-R84 PolarHBondContact OD1-NH2 3.09Å; D54-R84 IonicContact OD2-CZ 3.66Å; D54-R84 IonicContact OD2-NE 3.92Å; D54-R84 IonicContact OD2-NH2 3.67Å; D54-K89 WeakPolarHBondContact O-CD 3.44Å; D54-K89 WeakPolarHBondContact O-CE 3.34Å; D54-K89 PolarHBondContact O-NZ 2.88Å
55	T	90	Very high	94.5	Very high	93 Å²	93	58.8 Å²	58.8	57%	0.571	33%	0.332	S	S	*	.	S	Bend	trans	-81	-17.7	177	59.3	0	0	0	0	112.1	E88 K89	T55-E88 CarbonylContact O-C 3.48Å; T55-E88 VanDerWaalsContact O-CA 3.3Å; T55-E88 WeakPolarHBondContact O-CA 3.38Å; T55-K89 PolarHBondContact O-N 2.86Å
56	V	91.4	Very high	94.6	Very high	17 Å²	17	58.1 Å²	58.1	10%	0.103	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	157.9	-178.3	-52.6	0	0	0	0	113.1	D54 Y58 R84 C87 K89	D54-V56 VanDerWaalsContact C-N 3.32Å; D54-V56 PolarHBondContact OD1-N 2.96Å; V56-Y58 HydrophobicContact CG2-CE2 4.18Å; V56-R84 HydrophobicContact CG2-CB 4.2Å; V56-R84 HydrophobicContact CG2-CG 4.03Å; V56-C87 CarbonylContact C-O 3.59Å; V56-C87 VanDerWaalsContact CA-O 3.28Å; V56-C87 WeakPolarHBondContact CA-O 3.41Å; V56-C87 WeakPolarHBondContact CB-O 3.49Å; V56-K89 VanDerWaalsContact O-CE 3.3Å; V56-K89 WeakPolarHBondContact O-CE 3.36Å
57	L	92.8	Very high	94.6	Very high	34 Å²	34	57.2 Å²	57.2	18%	0.178	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	146.3	169.1	-71.2	170.3	0	0	0	111.5	N49 T85 C87 K89	N49-L57 HydrophobicContact CB-CD2 3.99Å; N49-L57 WeakPolarHBondContact OD1-CA 3.5Å; L57-T85 WeakPolarHBondContact O-CB 3.45Å; L57-T85 WeakPolarHBondContact O-CG2 3.35Å; L57-T85 PolarHBondContact O-N 3.45Å; L57-T85 PolarHBondContact O-OG1 3.46Å; L57-C87 HydrophobicContact CB-CB 4.49Å; L57-C87 HydrophobicContact CD1-CB 4.12Å; L57-C87 PolarHBondContact N-O 3.41Å; L57-K89 HydrophobicContact CD2-CB 4.49Å; L57-K89 HydrophobicContact CD2-CG 3.72Å; L57-K89 HydrophobicContact CG-CG 4Å
58	Y	93.9	Very high	94.6	Very high	20 Å²	20	57.6 Å²	57.6	8%	0.078	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	138.8	172.1	-71.2	-89.2	0	0	0	110.5	N49 D54 V56 L82 G83 R84 Y108	N49-Y58 PolarHBondContact ND2-O 3.08Å; N49-Y58 PolarHBondContact OD1-N 2.98Å; D54-Y58 HydrophobicContact CB-CE2 3.91Å; D54-Y58 WeakPolarHBondContact OD2-CE2 3.47Å; D54-Y58 PolarHBondContact OD2-OH 3.32Å; V56-Y58 HydrophobicContact CG2-CE2 4.18Å; Y58-L82 HydrophobicContact CD1-CB 4.33Å; Y58-G83 WeakPolarHBondContact CA-O 3.42Å; Y58-R84 HydrophobicContact CD1-CG 4.13Å; Y58-R84 HydrophobicContact CE1-CB 4.28Å; Y58-R84 HydrophobicContact CE1-CG 3.29Å; Y58-Y108 AromaticContact CD1-CE1 3.79Å; Y58-Y108 HydrophobicContact CD1-CE1 3.79Å; Y58-Y108 AromaticContact CD1-CZ 3.86Å; Y58-Y108 WeakPolarHBondContact CD1-OH 3.39Å; Y58-Y108 HydrophobicContact CE1-CD1 4.32Å; Y58-Y108 AromaticContact CE1-CE1 3.24Å; Y58-Y108 HydrophobicContact CE1-CE1 3.24Å; Y58-Y108 AromaticContact CE1-CZ 3.68Å; Y58-Y108 VanDerWaalsContact CE1-OH 3.28Å; Y58-Y108 WeakPolarHBondContact CE1-OH 3.42Å; Y58-Y108 AromaticContact CZ-CE1 3.82Å
59	Q	94.1	Very high	94.6	Very high	65 Å²	65	60.2 Å²	60.2	30%	0.304	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	159	173	-82.3	176.6	2.4	0	0	110.6	L61 L82 G83 T85 C96 I98	Q59-L61 PolarHBondContact O-N 3.43Å; Q59-L82 WeakPolarHBondContact O-CA 3.39Å; Q59-G83 PolarHBondContact N-O 3.39Å; Q59-G83 PolarHBondContact O-N 3.33Å; Q59-T85 HydrophobicContact CB-CG2 3.72Å; Q59-T85 HydrophobicContact CG-CG2 3.52Å; Q59-C96 PolarHBondContact NE2-O 3.4Å; Q59-I98 HydrophobicContact CB-CD1 4.02Å; Q59-I98 HydrophobicContact CB-CG1 3.75Å
60	V	95.3	Very high	94.5	Very high	46 Å²	46	61.2 Å²	61.2	28%	0.279	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	115.4	175.6	-178.6	0	0	0	0	108.8	L41 V45 V63 V80 L82	L41-V60 HydrophobicContact CD1-CG2 3.9Å; L41-V60 HydrophobicContact CD2-CG2 4.32Å; L41-V60 HydrophobicContact CG-CG2 4.27Å; V45-V60 HydrophobicContact CG2-CG2 3.58Å; V60-V63 HydrophobicContact CG1-CG2 4.07Å; V60-V80 HydrophobicContact CG1-CB 4.28Å; V60-V80 HydrophobicContact CG1-CG1 4.2Å; V60-L82 HydrophobicContact CG2-CD2 4.07Å
61	L	93.4	Very high	94.4	Very high	93 Å²	93	58.4 Å²	58.4	49%	0.487	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-41.3	170.4	-177.8	63	0	0	0	110.8	Q59 I81 I98 P107	Q59-L61 PolarHBondContact O-N 3.43Å; L61-I81 HydrophobicContact CB-CG2 4.24Å; L61-I81 WeakPolarHBondContact CB-O 3.34Å; L61-I81 HydrophobicContact CD2-CG2 4.04Å; L61-I81 PolarHBondContact N-O 3.03Å; L61-I98 HydrophobicContact CB-CD1 3.84Å; L61-I98 HydrophobicContact CD1-CD1 3.85Å; L61-I98 HydrophobicContact CD1-CG2 4.36Å; L61-I98 HydrophobicContact CG-CD1 4.47Å; L61-P107 HydrophobicContact CD2-CB 4.1Å
62	K	94.5	Very high	94.3	Very high	123 Å²	123	59.2 Å²	59.2	54%	0.535	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	139.3	-177.9	-177	178.6	178	-173.3	0	110.7	V80 I81	K62-V80 CarbonylContact O-C 3.57Å; K62-V80 WeakPolarHBondContact O-CA 3.34Å; K62-I81 HydrophobicContact CB-CB 4.31Å; K62-I81 HydrophobicContact CB-CD1 4.38Å; K62-I81 HydrophobicContact CD-CD1 4.36Å; K62-I81 PolarHBondContact N-O 3.46Å; K62-I81 PolarHBondContact O-N 3Å
63	V	97.1	Very high	94.4	Very high	45 Å²	45	57.6 Å²	57.6	27%	0.273	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	121.3	163.6	-178.3	0	0	0	0	108.5	F37 L41 V60 A66 V80	F37-V63 HydrophobicContact CZ-CG1 3.91Å; L41-V63 HydrophobicContact CD2-CG2 4.02Å; V60-V63 HydrophobicContact CG1-CG2 4.07Å; V63-A66 HydrophobicContact CG1-CB 4.3Å; V63-V80 HydrophobicContact CG2-CG1 4.2Å
64	V	97.2	Very high	94.6	Very high	69 Å²	69	50.6 Å²	50.6	42%	0.418	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-46.6	179.4	-180	0	0	0	0	110.3	T79 I81	V64-T79 WeakPolarHBondContact CA-O 3.31Å; V64-T79 HydrophobicContact CB-CG2 3.94Å; V64-T79 WeakPolarHBondContact CB-O 3.37Å; V64-T79 HydrophobicContact CG1-CG2 4.22Å; V64-T79 HydrophobicContact CG2-CG2 4.49Å; V64-T79 PolarHBondContact N-O 3.44Å; V64-I81 HydrophobicContact CG2-CD1 4.1Å; V64-I81 HydrophobicContact CG2-CG1 3.76Å
65	S	97.3	Very high	95	Very high	25 Å²	25	50.1 Å²	50.1	18%	0.175	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	145	173.5	79.7	0	0	0	0	111.5	T79	S65-T79 PolarHBondContact N-O 2.84Å; S65-T79 VanDerWaalsContact N-O 3.08Å; S65-T79 PolarHBondContact O-N 3.3Å; S65-T79 VanDerWaalsContact OG-CB 3.31Å; S65-T79 WeakPolarHBondContact OG-CB 3.5Å; S65-T79 PolarHBondContact OG-OG1 2.95Å
66	A	98.1	Very high	95.4	Very high	5 Å²	5	46.4 Å²	46.4	4%	0.041	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	114.3	176.6	0	0	0	0	0	107.8	I28 A31 F37 V63	I28-A66 HydrophobicContact CB-CB 4.06Å; I28-A66 HydrophobicContact CD1-CB 4.41Å; I28-A66 PolarHBondContact N-O 3.32Å; A31-A66 HydrophobicContact CB-CB 3.68Å; F37-A66 HydrophobicContact CD2-CB 3.91Å; F37-A66 HydrophobicContact CE1-CB 4.22Å; F37-A66 HydrophobicContact CE2-CB 3.33Å; F37-A66 HydrophobicContact CZ-CB 3.52Å; V63-A66 HydrophobicContact CG1-CB 4.3Å
67	E	97.8	Very high	95.7	Very high	51 Å²	51	46.1 Å²	46.1	24%	0.238	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	148.8	-177.2	-58.3	173.5	-109	0	0	109.8	L25 H26 Y76 V77	L25-E67 HydrophobicContact CD1-CB 4.18Å; L25-E67 HydrophobicContact CD2-CB 4.2Å; L25-E67 WeakPolarHBondContact CD2-OE2 3.34Å; L25-E67 HydrophobicContact CG-CB 3.92Å; L25-E67 WeakPolarHBondContact CG-OE2 3.25Å; H26-E67 CarbonylContact O-C 3.42Å; H26-E67 VanDerWaalsContact O-CA 3.26Å; H26-E67 WeakPolarHBondContact O-CA 3.28Å; E67-Y76 CarbonylContact O-C 3.6Å; E67-Y76 WeakPolarHBondContact O-CA 3.33Å; E67-V77 HydrophobicContact CB-CB 4.3Å; E67-V77 PolarHBondContact N-O 3.48Å; E67-V77 PolarHBondContact O-N 2.96Å
68	R	96.8	Very high	96	Very high	83 Å²	83	44.5 Å²	44.5	31%	0.313	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	150.5	178.1	66.3	-176.4	-172.9	-172.4	4.3	111.9	H26 I28 D34 T74 N75 Y76	H26-R68 PolarHBondContact N-O 3.02Å; H26-R68 PolarHBondContact O-N 2.91Å; I28-R68 HydrophobicContact CD1-CB 4.1Å; I28-R68 HydrophobicContact CD1-CG 4.22Å; I28-R68 HydrophobicContact CG1-CB 4.31Å; I28-R68 HydrophobicContact CG1-CG 3.99Å; D34-R68 IonicContact OD2-CZ 3.9Å; D34-R68 IonicContact OD2-NH1 2.84Å; D34-R68 PolarHBondContact OD2-NH1 3.36Å; R68-T74 HydrophobicContact CB-CG2 4.15Å; R68-N75 CarbonylContact C-O 3.5Å; R68-N75 VanDerWaalsContact CA-O 3.31Å; R68-N75 WeakPolarHBondContact CA-O 3.4Å; R68-Y76 HydrophobicContact CB-CD1 3.95Å; R68-Y76 HydrophobicContact CB-CE1 4.03Å
69	Q	96.1	Very high	96.2	Very high	60 Å²	60	44.1 Å²	44.1	28%	0.28	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127.6	172.9	-170.2	-177.3	14.3	0	0	109.3	G23 L25 V71 N75	G23-Q69 WeakPolarHBondContact O-CG 2.99Å; G23-Q69 PolarHBondContact O-NE2 2.97Å; L25-Q69 HydrophobicContact CD1-CB 4.04Å; Q69-V71 HydrophobicContact CG-CG1 3.97Å; Q69-N75 HydrophobicContact CB-CB 4.35Å; Q69-N75 PolarHBondContact N-O 2.73Å; Q69-N75 PolarHBondContact O-N 3.5Å
70	V	94.4	Very high	96.4	Very high	30 Å²	30	41 Å²	41	18%	0.182	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	124.2	174	-178.7	0	0	0	0	108.3	M20 A22 G23	M20-V70 HydrophobicContact CB-CG1 4.2Å; M20-V70 HydrophobicContact CB-CG2 4.05Å; A22-V70 VanDerWaalsContact CA-O 3.3Å; A22-V70 WeakPolarHBondContact CA-O 3.38Å; G23-V70 PolarHBondContact N-O 3.26Å
71	V	91.6	Very high	96.5	Very high	60 Å²	60	39.9 Å²	39.9	36%	0.364	22%	0.218	S	C	.	.	S	Bend	trans	-137.8	-148.6	-179.4	-65	0	0	0	0	108.5	Q69 G73 N75	Q69-V71 HydrophobicContact CG-CG1 3.97Å; V71-G73 CarbonylContact C-O 3.58Å; V71-G73 PolarHBondContact N-O 3.23Å; V71-G73 PolarHBondContact O-N 3.47Å; V71-N75 HydrophobicContact CG2-CB 4.41Å
72	A	93.6	Very high	96.6	Very high	77 Å²	77	35.5 Å²	35.5	64%	0.636	20%	0.195	S	C	*	.	S	Bend	trans	-70.2	51.5	164	0	0	0	0	0	111.7	W115 R117	A72-W115 HydrophobicContact CB-CZ2 4.44Å; A72-W115 WeakPolarHBondContact O-CZ2 3.4Å; A72-R117 WeakPolarHBondContact O-CD 2.96Å; A72-R117 WeakPolarHBondContact O-CG 3.47Å
73	G	94.8	Very high	96.6	Very high	2 Å²	2	29.6 Å²	29.6	2%	0.021	17%	0.17	C	C	.	.	S	Bend	trans	142.8	-171.2	-157.7	0	0	0	0	0	110.8	V71 S116 W119	V71-G73 CarbonylContact C-O 3.58Å; V71-G73 PolarHBondContact N-O 3.23Å; V71-G73 PolarHBondContact O-N 3.47Å; G73-S116 CarbonylContact C-O 3.58Å; G73-S116 WeakPolarHBondContact CA-O 3.47Å; G73-W119 VanDerWaalsContact CA-CH2 3.49Å
74	T	97.1	Very high	96.4	Very high	25 Å²	25	30 Å²	30	15%	0.153	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.9	165.9	-50	0	0	0	0	108.4	R68 Y76 S116	R68-T74 HydrophobicContact CB-CG2 4.15Å; T74-Y76 HydrophobicContact CG2-CD1 4.5Å; T74-Y76 HydrophobicContact CG2-CD2 4.11Å; T74-Y76 HydrophobicContact CG2-CE1 3.99Å; T74-Y76 HydrophobicContact CG2-CE2 3.54Å; T74-Y76 VanDerWaalsContact CG2-CZ 3.47Å; T74-S116 PolarHBondContact N-O 2.96Å; T74-S116 PolarHBondContact O-N 2.71Å
75	N	97.8	Very high	96.1	Very high	29 Å²	29	26.8 Å²	26.8	16%	0.155	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	118.2	171.7	-172.8	32.2	0	0	0	108.6	R68 Q69 V71 V114	R68-N75 CarbonylContact C-O 3.5Å; R68-N75 VanDerWaalsContact CA-O 3.31Å; R68-N75 WeakPolarHBondContact CA-O 3.4Å; Q69-N75 HydrophobicContact CB-CB 4.35Å; Q69-N75 PolarHBondContact N-O 2.73Å; Q69-N75 PolarHBondContact O-N 3.5Å; V71-N75 HydrophobicContact CG2-CB 4.41Å; N75-V114 CarbonylContact C-O 3.5Å; N75-V114 WeakPolarHBondContact CA-O 3.47Å
76	Y	98.4	Very high	95.7	Very high	16 Å²	16	30 Å²	30	6%	0.063	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129.3	174.3	-63.9	-86.3	0	0	0	109.3	I28 G36 F37 A40 E67 R68 T74 N113 V114	I28-Y76 HydrophobicContact CD1-CD1 4.12Å; I28-Y76 HydrophobicContact CD1-CE1 4.15Å; G36-Y76 VanDerWaalsContact C-CZ 3.48Å; G36-Y76 VanDerWaalsContact C-OH 3.3Å; G36-Y76 WeakPolarHBondContact CA-OH 3.44Å; F37-Y76 HydrophobicContact CB-CD1 4.18Å; F37-Y76 HydrophobicContact CB-CE1 3.95Å; F37-Y76 HydrophobicContact CD2-CD1 4.12Å; A40-Y76 HydrophobicContact CB-CD1 4.48Å; A40-Y76 HydrophobicContact CB-CD2 3.44Å; A40-Y76 VanDerWaalsContact CB-CD2 3.44Å; A40-Y76 HydrophobicContact CB-CE2 3.93Å; A40-Y76 HydrophobicContact CB-CG 3.75Å; E67-Y76 CarbonylContact O-C 3.6Å; E67-Y76 WeakPolarHBondContact O-CA 3.33Å; R68-Y76 HydrophobicContact CB-CD1 3.95Å; R68-Y76 HydrophobicContact CB-CE1 4.03Å; T74-Y76 HydrophobicContact CG2-CD1 4.5Å; T74-Y76 HydrophobicContact CG2-CD2 4.11Å; T74-Y76 HydrophobicContact CG2-CE1 3.99Å; T74-Y76 HydrophobicContact CG2-CE2 3.54Å; T74-Y76 VanDerWaalsContact CG2-CZ 3.47Å; Y76-N113 CarbonylContact O-C 3.54Å; Y76-N113 VanDerWaalsContact O-CA 3.32Å; Y76-N113 WeakPolarHBondContact O-CA 3.39Å; Y76-V114 PolarHBondContact N-O 2.79Å; Y76-V114 PolarHBondContact O-N 2.78Å
77	V	98.4	Very high	95.3	Very high	10 Å²	10	30.2 Å²	30.2	6%	0.061	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	114.1	170.3	-179.2	0	0	0	0	106.6	L25 E67 K111 F112	L25-V77 HydrophobicContact CD1-CB 4.35Å; L25-V77 HydrophobicContact CD1-CG2 3.78Å; E67-V77 HydrophobicContact CB-CB 4.3Å; E67-V77 PolarHBondContact N-O 3.48Å; E67-V77 PolarHBondContact O-N 2.96Å; V77-K111 VanDerWaalsContact CG1-CE 3.41Å; V77-K111 HydrophobicContact CG1-CG 4.48Å; V77-F112 WeakPolarHBondContact CA-O 3.45Å
78	I	98.6	Very high	94.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	116.6	-166.8	-45.5	176.3	0	0	0	108.1	F37 A40 L41 V80 K111 F112 V114	F37-I78 HydrophobicContact CD2-CD1 4.44Å; F37-I78 HydrophobicContact CD2-CG1 4.32Å; F37-I78 HydrophobicContact CE2-CB 4.27Å; F37-I78 HydrophobicContact CE2-CD1 4.15Å; F37-I78 HydrophobicContact CE2-CG1 3.8Å; F37-I78 HydrophobicContact CE2-CG2 3.78Å; F37-I78 HydrophobicContact CZ-CG2 3.9Å; A40-I78 HydrophobicContact CB-CD1 4.07Å; L41-I78 HydrophobicContact CB-CD1 4.23Å; L41-I78 HydrophobicContact CD1-CG2 3.77Å; I78-V80 HydrophobicContact CG2-CG1 3.69Å; I78-K111 CarbonylContact O-C 3.57Å; I78-K111 WeakPolarHBondContact O-CA 3.36Å; I78-F112 HydrophobicContact CB-CB 4.43Å; I78-F112 PolarHBondContact N-O 2.89Å; I78-F112 PolarHBondContact O-N 2.85Å; I78-V114 HydrophobicContact CD1-CG2 4.08Å
79	T	98.4	Very high	94.2	Very high	13 Å²	13	32.6 Å²	32.6	8%	0.08	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.3	172.7	-48	0	0	0	0	108.6	V64 S65 Q109 C110	V64-T79 WeakPolarHBondContact CA-O 3.31Å; V64-T79 HydrophobicContact CB-CG2 3.94Å; V64-T79 WeakPolarHBondContact CB-O 3.37Å; V64-T79 HydrophobicContact CG1-CG2 4.22Å; V64-T79 HydrophobicContact CG2-CG2 4.49Å; V64-T79 PolarHBondContact N-O 3.44Å; S65-T79 PolarHBondContact N-O 2.84Å; S65-T79 VanDerWaalsContact N-O 3.08Å; S65-T79 PolarHBondContact O-N 3.3Å; S65-T79 VanDerWaalsContact OG-CB 3.31Å; S65-T79 WeakPolarHBondContact OG-CB 3.5Å; S65-T79 PolarHBondContact OG-OG1 2.95Å; T79-Q109 HydrophobicContact CG2-CG 3.8Å; T79-C110 CarbonylContact C-O 3.56Å; T79-C110 WeakPolarHBondContact CA-O 3.39Å
80	V	98.1	Very high	93.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	152.3	-176.5	-63.6	0	0	0	0	111.5	L41 V60 K62 V63 I78 L82 Q109 C110 F112	L41-V80 HydrophobicContact CD1-CG1 3.72Å; V60-V80 HydrophobicContact CG1-CB 4.28Å; V60-V80 HydrophobicContact CG1-CG1 4.2Å; K62-V80 CarbonylContact O-C 3.57Å; K62-V80 WeakPolarHBondContact O-CA 3.34Å; V63-V80 HydrophobicContact CG2-CG1 4.2Å; I78-V80 HydrophobicContact CG2-CG1 3.69Å; V80-L82 HydrophobicContact CG2-CD2 3.81Å; V80-L82 HydrophobicContact CG2-CG 4.11Å; V80-Q109 CarbonylContact O-C 3.59Å; V80-Q109 WeakPolarHBondContact O-CA 3.45Å; V80-C110 HydrophobicContact CG2-CB 4.44Å; V80-C110 PolarHBondContact N-O 2.84Å; V80-C110 PolarHBondContact O-N 3.03Å; V80-F112 HydrophobicContact CG2-CD2 4.04Å; V80-F112 HydrophobicContact CG2-CE2 3.57Å
81	I	96.9	Very high	92.3	Very high	22 Å²	22	39.5 Å²	39.5	11%	0.113	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	121.1	163.7	-59.9	173.8	0	0	0	107.1	L61 K62 V64 P107 Y108 I133	L61-I81 HydrophobicContact CB-CG2 4.24Å; L61-I81 WeakPolarHBondContact CB-O 3.34Å; L61-I81 HydrophobicContact CD2-CG2 4.04Å; L61-I81 PolarHBondContact N-O 3.03Å; K62-I81 HydrophobicContact CB-CB 4.31Å; K62-I81 HydrophobicContact CB-CD1 4.38Å; K62-I81 HydrophobicContact CD-CD1 4.36Å; K62-I81 PolarHBondContact N-O 3.46Å; K62-I81 PolarHBondContact O-N 3Å; V64-I81 HydrophobicContact CG2-CD1 4.1Å; V64-I81 HydrophobicContact CG2-CG1 3.76Å; I81-P107 HydrophobicContact CG2-CB 3.73Å; I81-Y108 CarbonylContact C-O 3.55Å; I81-Y108 WeakPolarHBondContact CA-O 3.38Å; I81-I133 HydrophobicContact CD1-CD1 4.48Å; I81-I133 HydrophobicContact CG2-CD1 4.02Å
82	L	95.8	Very high	91.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	147.6	173.7	-62.6	-175.8	0	0	0	110.2	V45 H48 Y58 Q59 V60 V80 P107 Y108 C110 F112	V45-L82 HydrophobicContact CG2-CD2 4.32Å; H48-L82 VanDerWaalsContact CD2-CD1 3.41Å; H48-L82 WeakPolarHBondContact CD2-CD1 3.5Å; H48-L82 WeakPolarHBondContact NE2-CD1 3.03Å; Y58-L82 HydrophobicContact CD1-CB 4.33Å; Q59-L82 WeakPolarHBondContact O-CA 3.39Å; V60-L82 HydrophobicContact CG2-CD2 4.07Å; V80-L82 HydrophobicContact CG2-CD2 3.81Å; V80-L82 HydrophobicContact CG2-CG 4.11Å; L82-P107 WeakPolarHBondContact O-CA 3.38Å; L82-Y108 HydrophobicContact CB-CE2 4.24Å; L82-Y108 HydrophobicContact CD1-CE2 4.11Å; L82-Y108 PolarHBondContact N-O 2.84Å; L82-Y108 PolarHBondContact O-N 2.79Å; L82-Y108 VanDerWaalsContact O-N 3.15Å; L82-C110 HydrophobicContact CD1-CB 4.41Å; L82-F112 HydrophobicContact CD1-CZ 4.12Å
83	G	93.8	Very high	89.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	144.7	173.8	0	0	0	0	0	111.6	Y58 Q59 A105	Y58-G83 WeakPolarHBondContact CA-O 3.42Å; Q59-G83 PolarHBondContact N-O 3.39Å; Q59-G83 PolarHBondContact O-N 3.33Å; G83-A105 WeakPolarHBondContact CA-O 3.31Å
84	R	93.2	Very high	88.8	Confident	53 Å²	53	51 Å²	51	20%	0.2	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	133.5	172.2	-66.9	-177.8	73.3	151.8	9.4	110.1	D54 V56 Y58 H99 A105	D54-R84 IonicContact OD1-NH2 3.28Å; D54-R84 PolarHBondContact OD1-NH2 3.09Å; D54-R84 IonicContact OD2-CZ 3.66Å; D54-R84 IonicContact OD2-NE 3.92Å; D54-R84 IonicContact OD2-NH2 3.67Å; V56-R84 HydrophobicContact CG2-CB 4.2Å; V56-R84 HydrophobicContact CG2-CG 4.03Å; Y58-R84 HydrophobicContact CD1-CG 4.13Å; Y58-R84 HydrophobicContact CE1-CB 4.28Å; Y58-R84 HydrophobicContact CE1-CG 3.29Å; R84-H99 PolarHBondContact O-N 3.13Å; R84-A105 PolarHBondContact N-O 2.93Å
85	T	91.9	Very high	87.5	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	171	172.8	68.9	0	0	0	0	111.6	L57 Q59 C87 A97 I98 H99	L57-T85 WeakPolarHBondContact O-CB 3.45Å; L57-T85 WeakPolarHBondContact O-CG2 3.35Å; L57-T85 PolarHBondContact O-N 3.45Å; L57-T85 PolarHBondContact O-OG1 3.46Å; Q59-T85 HydrophobicContact CB-CG2 3.72Å; Q59-T85 HydrophobicContact CG-CG2 3.52Å; T85-C87 PolarHBondContact O-N 2.72Å; T85-C87 PolarHBondContact OG1-N 3.48Å; T85-C87 PolarHBondContact OG1-O 2.64Å; T85-A97 VanDerWaalsContact CA-O 3.25Å; T85-A97 WeakPolarHBondContact CA-O 3.1Å; T85-A97 WeakPolarHBondContact CB-O 3.29Å; T85-I98 HydrophobicContact CG2-CG1 4.43Å; T85-H99 PolarHBondContact O-CD2 2.99Å; T85-H99 VanDerWaalsContact O-CD2 3.25Å; T85-H99 PolarHBondContact O-NE2 3.19Å
86	N	88.9	Confident	86.8	Confident	92 Å²	92	52.2 Å²	52.2	49%	0.492	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	5	168.7	67.2	-39.1	0	0	0	113.8	A97	N86-A97 PolarHBondContact N-O 3.18Å; N86-A97 VanDerWaalsContact N-O 3.08Å; N86-A97 PolarHBondContact OD1-N 3.02Å; N86-A97 PolarHBondContact OD1-O 3.38Å
87	C	87.9	Confident	86.2	Confident	11 Å²	11	53.5 Å²	53.5	7%	0.074	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137.5	-177.5	-74.3	0	0	0	0	112.1	V56 L57 T85 C96	V56-C87 CarbonylContact C-O 3.59Å; V56-C87 VanDerWaalsContact CA-O 3.28Å; V56-C87 WeakPolarHBondContact CA-O 3.41Å; V56-C87 WeakPolarHBondContact CB-O 3.49Å; L57-C87 HydrophobicContact CB-CB 4.49Å; L57-C87 HydrophobicContact CD1-CB 4.12Å; L57-C87 PolarHBondContact N-O 3.41Å; T85-C87 PolarHBondContact O-N 2.72Å; T85-C87 PolarHBondContact OG1-N 3.48Å; T85-C87 PolarHBondContact OG1-O 2.64Å; C87-C96 HydrophobicContact CB-CB 3.93Å; C87-C96 WeakPolarHBondContact CB-SG 3.08Å; C87-C96 WeakPolarHBondContact SG-CA 3.49Å; C87-C96 WeakPolarHBondContact SG-CB 3.32Å; C87-C96 CovalentContact SG-SG 2.02Å; C87-C96 PolarHBondContact SG-SG 2.84Å
88	E	87.3	Confident	85.5	Confident	121 Å²	121	54.5 Å²	54.5	57%	0.565	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	150.8	165.3	-62.6	-174.9	173.2	0	0	110	T55 E90 A91	T55-E88 CarbonylContact O-C 3.48Å; T55-E88 VanDerWaalsContact O-CA 3.3Å; T55-E88 WeakPolarHBondContact O-CA 3.38Å; E88-E90 PolarHBondContact O-N 2.86Å; E88-A91 HydrophobicContact CB-CB 4.21Å; E88-A91 PolarHBondContact O-N 2.99Å
89	K	84.6	Confident	84.8	Confident	63 Å²	63	57.5 Å²	57.5	27%	0.274	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-29	-178.7	-73.6	-180	-179.4	167.6	0	113.8	N49 T52 D54 T55 V56 L57	N49-K89 WeakPolarHBondContact O-CE 3.41Å; N49-K89 PolarHBondContact O-NZ 2.86Å; T52-K89 PolarHBondContact O-NZ 2.8Å; T52-K89 PolarHBondContact OG1-NZ 2.05Å; D54-K89 WeakPolarHBondContact O-CD 3.44Å; D54-K89 WeakPolarHBondContact O-CE 3.34Å; D54-K89 PolarHBondContact O-NZ 2.88Å; T55-K89 PolarHBondContact O-N 2.86Å; V56-K89 VanDerWaalsContact O-CE 3.3Å; V56-K89 WeakPolarHBondContact O-CE 3.36Å; L57-K89 HydrophobicContact CD2-CB 4.49Å; L57-K89 HydrophobicContact CD2-CG 3.72Å; L57-K89 HydrophobicContact CG-CG 4Å
90	E	76.5	Confident	83.9	Confident	197 Å²	197	66.2 Å²	66.2	92%	0.921	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-1.8	-177	-59.1	-174.5	174.8	0	0	113.1	E88	E88-E90 PolarHBondContact O-N 2.86Å
91	A	74.4	Confident	82.8	Confident	38 Å²	38	71.8 Å²	71.8	31%	0.314	39%	0.388	S	S	.	.	S	Bend	trans	-90.1	156.7	-179.4	0	0	0	0	0	112	E88 V93	E88-A91 HydrophobicContact CB-CB 4.21Å; E88-A91 PolarHBondContact O-N 2.99Å; A91-V93 PolarHBondContact O-N 2.83Å
92	P	68.8	Low	81.6	Confident	115 Å²	115	76.9 Å²	76.9	75%	0.747	42%	0.423	S	S	*	.			trans	-55.1	131.5	170.6	-22.4	32.8	0	0	0	110.9	D94	P92-D94 PolarHBondContact O-N 2.89Å
93	V	66.5	Low	80.7	Confident	106 Å²	106	79.7 Å²	79.7	64%	0.642	45%	0.451	S	S	*	.			trans	-74	5.9	-173	-168.8	0	0	0	0	112.9	A91 G95 C96	A91-V93 PolarHBondContact O-N 2.83Å; V93-G95 PolarHBondContact O-N 2.77Å; V93-C96 VanDerWaalsContact C-SG 3.59Å; V93-C96 VanDerWaalsContact CA-SG 3.59Å; V93-C96 HydrophobicContact CG1-CB 4.49Å; V93-C96 PolarHBondContact O-SG 2.8Å; V93-C96 VanDerWaalsContact O-SG 3.32Å
94	D	70.6	Confident	80	Confident	158 Å²	158	84.9 Å²	84.9	85%	0.845	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	122.6	-174.4	-149.6	7.7	0	0	0	110.6	P92	P92-D94 PolarHBondContact O-N 2.89Å
95	G	71.2	Confident	79.5	Confident	59 Å²	59	83 Å²	83	61%	0.608	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	19.6	-179.4	0	0	0	0	0	116.4	V93 A97	V93-G95 PolarHBondContact O-N 2.77Å; G95-A97 PolarHBondContact O-N 2.88Å
96	C	83.6	Confident	79.3	Confident	22 Å²	22	90.7 Å²	90.7	15%	0.149	50%	0.499	C	S	.	.			trans	-65.1	119.9	175.4	-64.2	0	0	0	0	112.6	Q59 C87 V93	Q59-C96 PolarHBondContact NE2-O 3.4Å; C87-C96 HydrophobicContact CB-CB 3.93Å; C87-C96 WeakPolarHBondContact CB-SG 3.08Å; C87-C96 WeakPolarHBondContact SG-CA 3.49Å; C87-C96 WeakPolarHBondContact SG-CB 3.32Å; C87-C96 CovalentContact SG-SG 2.02Å; C87-C96 PolarHBondContact SG-SG 2.84Å; V93-C96 VanDerWaalsContact C-SG 3.59Å; V93-C96 VanDerWaalsContact CA-SG 3.59Å; V93-C96 HydrophobicContact CG1-CB 4.49Å; V93-C96 PolarHBondContact O-SG 2.8Å; V93-C96 VanDerWaalsContact O-SG 3.32Å
97	A	84.4	Confident	79.5	Confident	43 Å²	43	88.9 Å²	88.9	36%	0.355	49%	0.493	S	S	.	.			trans	-135.7	151.6	177.3	0	0	0	0	0	111	T85 N86 G95 H99	T85-A97 VanDerWaalsContact CA-O 3.25Å; T85-A97 WeakPolarHBondContact CA-O 3.1Å; T85-A97 WeakPolarHBondContact CB-O 3.29Å; N86-A97 PolarHBondContact N-O 3.18Å; N86-A97 VanDerWaalsContact N-O 3.08Å; N86-A97 PolarHBondContact OD1-N 3.02Å; N86-A97 PolarHBondContact OD1-O 3.38Å; G95-A97 PolarHBondContact O-N 2.88Å; A97-H99 PolarHBondContact O-N 2.88Å
98	I	84.8	Confident	79.8	Confident	31 Å²	31	90.3 Å²	90.3	16%	0.159	50%	0.497	C	S	.	.	B	Isolated β-bridge	trans	-58.9	138.7	172.1	-61.1	174.2	0	0	0	109.6	Q59 L61 T85 K100 A105	Q59-I98 HydrophobicContact CB-CD1 4.02Å; Q59-I98 HydrophobicContact CB-CG1 3.75Å; L61-I98 HydrophobicContact CB-CD1 3.84Å; L61-I98 HydrophobicContact CD1-CD1 3.85Å; L61-I98 HydrophobicContact CD1-CG2 4.36Å; L61-I98 HydrophobicContact CG-CD1 4.47Å; T85-I98 HydrophobicContact CG2-CG1 4.43Å; I98-K100 PolarHBondContact O-N 2.84Å; I98-K100 VanDerWaalsContact O-N 3.11Å; I98-A105 HydrophobicContact CG2-CB 4Å
99	H	83.9	Confident	80.3	Confident	63 Å²	63	87.3 Å²	87.3	29%	0.292	48%	0.483	S	S	.	.			trans	-55.9	118.2	175.7	-94.2	-72.7	0	0	0	111	R84 T85 A97 Q101 F104 A105	R84-H99 PolarHBondContact O-N 3.13Å; T85-H99 PolarHBondContact O-CD2 2.99Å; T85-H99 VanDerWaalsContact O-CD2 3.25Å; T85-H99 PolarHBondContact O-NE2 3.19Å; A97-H99 PolarHBondContact O-N 2.88Å; H99-Q101 VanDerWaalsContact C-N 3.28Å; H99-Q101 PolarHBondContact O-N 2.79Å; H99-F104 HydrophobicContact CB-CB 3.84Å; H99-A105 HydrophobicContact CB-CB 4.41Å
100	K	78.3	Confident	81	Confident	196 Å²	196	84.3 Å²	84.3	85%	0.852	47%	0.469	S	S	*	.			trans	-76.7	-15.2	177.6	-62.5	-176.4	-178.9	179.3	0	113.5	I98	I98-K100 PolarHBondContact O-N 2.84Å; I98-K100 VanDerWaalsContact O-N 3.11Å
101	Q	76.4	Confident	82	Confident	116 Å²	116	79 Å²	79	54%	0.542	44%	0.444	S	S	.	.	S	Bend	trans	-76.8	125.7	180	-71.8	179.3	-6.5	0	0	110.5	H99 G103 F104	H99-Q101 VanDerWaalsContact C-N 3.28Å; H99-Q101 PolarHBondContact O-N 2.79Å; Q101-G103 PolarHBondContact O-N 2.99Å; Q101-F104 HydrophobicContact CB-CB 4.38Å; Q101-F104 HydrophobicContact CB-CD2 3.59Å; Q101-F104 HydrophobicContact CB-CE2 4.3Å; Q101-F104 HydrophobicContact CB-CG 4.32Å; Q101-F104 PolarHBondContact O-N 2.65Å
102	P	71.6	Confident	83.2	Confident	130 Å²	130	77.2 Å²	77.2	84%	0.844	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	130.5	174.5	-23.9	33	0	0	0	110.9
103	G	75.5	Confident	84.6	Confident	58 Å²	58	73.3 Å²	73.3	60%	0.598	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.8	-16.5	179.9	0	0	0	0	0	116.1	Q101 R106	Q101-G103 PolarHBondContact O-N 2.99Å; G103-R106 WeakPolarHBondContact O-CG 3.26Å
104	F	79.8	Confident	86.1	Confident	110 Å²	110	68.2 Å²	68.2	48%	0.482	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-34	176.9	-72.9	-89.8	0	0	0	113.2	H99 Q101 R106	H99-F104 HydrophobicContact CB-CB 3.84Å; Q101-F104 HydrophobicContact CB-CB 4.38Å; Q101-F104 HydrophobicContact CB-CD2 3.59Å; Q101-F104 HydrophobicContact CB-CE2 4.3Å; Q101-F104 HydrophobicContact CB-CG 4.32Å; Q101-F104 PolarHBondContact O-N 2.65Å; F104-R106 PolarHBondContact O-N 2.86Å
105	A	82.5	Confident	87.5	Confident	14 Å²	14	63.6 Å²	63.6	12%	0.116	34%	0.341	C	S	.	.	S	Bend	trans	-61.6	-26.1	175.2	0	0	0	0	0	113	G83 R84 I98 H99	G83-A105 WeakPolarHBondContact CA-O 3.31Å; R84-A105 PolarHBondContact N-O 2.93Å; I98-A105 HydrophobicContact CG2-CB 4Å; H99-A105 HydrophobicContact CB-CB 4.41Å
106	R	88.1	Confident	88.7	Confident	161 Å²	161	61.3 Å²	61.3	61%	0.608	32%	0.316	S	S	*	.			trans	35.6	61.5	-179.8	-62.5	-172.6	-177.3	-172.9	2.3	112.5	G103 F104	G103-R106 WeakPolarHBondContact O-CG 3.26Å; F104-R106 PolarHBondContact O-N 2.86Å
107	P	92.8	Very high	89.4	Confident	55 Å²	55	61.9 Å²	61.9	36%	0.357	32%	0.315	S	S	.	.			trans	-71.6	141.9	-167.4	32.6	-37.1	0	0	0	111	L61 I81 L82 I133	L61-P107 HydrophobicContact CD2-CB 4.1Å; I81-P107 HydrophobicContact CG2-CB 3.73Å; L82-P107 WeakPolarHBondContact O-CA 3.38Å; P107-I133 HydrophobicContact CB-CD1 3.84Å; P107-I133 HydrophobicContact CG-CD1 3.78Å; P107-I133 WeakPolarHBondContact O-CD1 3.2Å
108	Y	94.9	Very high	89.9	Confident	40 Å²	40	62.6 Å²	62.6	16%	0.157	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	159.4	174.8	60.3	-95.9	0	0	0	110.1	H48 Y58 I81 L82 C110 C130 G131	H48-Y108 AromaticContact CE1-CE2 3.94Å; H48-Y108 PolarHBondContact CE1-OH 3.44Å; H48-Y108 AromaticContact NE2-CE2 3.89Å; H48-Y108 AromaticContact NE2-CZ 3.71Å; H48-Y108 PolarHBondContact NE2-OH 2.92Å; Y58-Y108 AromaticContact CD1-CE1 3.79Å; Y58-Y108 HydrophobicContact CD1-CE1 3.79Å; Y58-Y108 AromaticContact CD1-CZ 3.86Å; Y58-Y108 WeakPolarHBondContact CD1-OH 3.39Å; Y58-Y108 HydrophobicContact CE1-CD1 4.32Å; Y58-Y108 AromaticContact CE1-CE1 3.24Å; Y58-Y108 HydrophobicContact CE1-CE1 3.24Å; Y58-Y108 AromaticContact CE1-CZ 3.68Å; Y58-Y108 VanDerWaalsContact CE1-OH 3.28Å; Y58-Y108 WeakPolarHBondContact CE1-OH 3.42Å; Y58-Y108 AromaticContact CZ-CE1 3.82Å; I81-Y108 CarbonylContact C-O 3.55Å; I81-Y108 WeakPolarHBondContact CA-O 3.38Å; L82-Y108 HydrophobicContact CB-CE2 4.24Å; L82-Y108 HydrophobicContact CD1-CE2 4.11Å; L82-Y108 PolarHBondContact N-O 2.84Å; L82-Y108 PolarHBondContact O-N 2.79Å; L82-Y108 VanDerWaalsContact O-N 3.15Å; Y108-C110 WeakPolarHBondContact CE2-SG 3.1Å; Y108-C130 HydrophobicContact CD2-CB 4.21Å; Y108-C130 HydrophobicContact CE2-CB 4.25Å; Y108-G131 WeakPolarHBondContact CB-O 3.26Å
109	Q	97.7	Very high	90.5	Very high	58 Å²	58	69.3 Å²	69.3	27%	0.271	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	138.8	-178	-173.8	170.8	-80.7	0	0	110.2	T79 V80 C130 G131	T79-Q109 HydrophobicContact CG2-CG 3.8Å; V80-Q109 CarbonylContact O-C 3.59Å; V80-Q109 WeakPolarHBondContact O-CA 3.45Å; Q109-C130 CarbonylContact O-C 3.56Å; Q109-C130 VanDerWaalsContact O-CA 3.26Å; Q109-C130 WeakPolarHBondContact O-CA 3.36Å; Q109-G131 PolarHBondContact N-O 2.82Å; Q109-G131 PolarHBondContact O-N 2.8Å
110	C	98.3	Very high	91.1	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.6	168.7	-67.3	0	0	0	0	110.8	T79 V80 L82 Y108 F112 E129 C130	T79-C110 CarbonylContact C-O 3.56Å; T79-C110 WeakPolarHBondContact CA-O 3.39Å; V80-C110 HydrophobicContact CG2-CB 4.44Å; V80-C110 PolarHBondContact N-O 2.84Å; V80-C110 PolarHBondContact O-N 3.03Å; L82-C110 HydrophobicContact CD1-CB 4.41Å; Y108-C110 WeakPolarHBondContact CE2-SG 3.1Å; C110-F112 HydrophobicContact CB-CD2 4.48Å; C110-F112 HydrophobicContact CB-CE1 3.89Å; C110-F112 HydrophobicContact CB-CE2 3.81Å; C110-F112 HydrophobicContact CB-CZ 3.47Å; C110-F112 VanDerWaalsContact CB-CZ 3.47Å; C110-E129 CarbonylContact C-O 3.57Å; C110-E129 VanDerWaalsContact CA-O 3.29Å; C110-E129 WeakPolarHBondContact CA-O 3.39Å; C110-C130 HydrophobicContact CB-CB 4.19Å; C110-C130 WeakPolarHBondContact CB-SG 3.45Å; C110-C130 WeakPolarHBondContact SG-CB 3.31Å; C110-C130 CovalentContact SG-SG 2.05Å; C110-C130 PolarHBondContact SG-SG 2.85Å
111	K	98.6	Very high	92	Very high	87 Å²	87	69.3 Å²	69.3	38%	0.378	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	120.6	168	-174	175.1	-175.9	171.1	0	109	V77 I78 E128 E129	V77-K111 VanDerWaalsContact CG1-CE 3.41Å; V77-K111 HydrophobicContact CG1-CG 4.48Å; I78-K111 CarbonylContact O-C 3.57Å; I78-K111 WeakPolarHBondContact O-CA 3.36Å; K111-E128 WeakPolarHBondContact O-CA 3.14Å; K111-E129 PolarHBondContact N-O 3.33Å; K111-E129 PolarHBondContact O-N 3.17Å
112	F	98.7	Very high	93	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	138.6	179.2	-56.3	-60	0	0	0	110.5	A44 H48 V77 I78 V80 L82 C110 V114 L125 K127 E128	A44-F112 HydrophobicContact CB-CB 3.97Å; A44-F112 HydrophobicContact CB-CD1 4.35Å; A44-F112 HydrophobicContact CB-CD2 3.74Å; A44-F112 HydrophobicContact CB-CE2 4.26Å; A44-F112 HydrophobicContact CB-CG 3.77Å; H48-F112 HydrophobicContact CB-CE1 4.13Å; H48-F112 HydrophobicContact CB-CZ 3.98Å; V77-F112 WeakPolarHBondContact CA-O 3.45Å; I78-F112 HydrophobicContact CB-CB 4.43Å; I78-F112 PolarHBondContact N-O 2.89Å; I78-F112 PolarHBondContact O-N 2.85Å; V80-F112 HydrophobicContact CG2-CD2 4.04Å; V80-F112 HydrophobicContact CG2-CE2 3.57Å; L82-F112 HydrophobicContact CD1-CZ 4.12Å; C110-F112 HydrophobicContact CB-CD2 4.48Å; C110-F112 HydrophobicContact CB-CE1 3.89Å; C110-F112 HydrophobicContact CB-CE2 3.81Å; C110-F112 HydrophobicContact CB-CZ 3.47Å; C110-F112 VanDerWaalsContact CB-CZ 3.47Å; F112-V114 HydrophobicContact CB-CG2 4.38Å; F112-L125 HydrophobicContact CB-CD1 3.92Å; F112-L125 HydrophobicContact CD1-CD1 3.93Å; F112-L125 HydrophobicContact CG-CD1 4.27Å; F112-K127 WeakPolarHBondContact CA-O 3.3Å; F112-E128 HydrophobicContact CD1-CB 4.11Å; F112-E128 HydrophobicContact CD1-CG 3.89Å; F112-E128 HydrophobicContact CE1-CB 4.36Å; F112-E128 HydrophobicContact CE1-CG 3.66Å
113	N	98.6	Very high	94.3	Very high	32 Å²	32	61.2 Å²	61.2	17%	0.171	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	118.4	163	-66.5	4.1	0	0	0	108.8	Y76 T126 K127	Y76-N113 CarbonylContact O-C 3.54Å; Y76-N113 VanDerWaalsContact O-CA 3.32Å; Y76-N113 WeakPolarHBondContact O-CA 3.39Å; N113-T126 WeakPolarHBondContact CB-OG1 3.47Å; N113-T126 PolarHBondContact O-N 3.47Å; N113-T126 PolarHBondContact O-OG1 3.1Å; N113-T126 VanDerWaalsContact O-OG1 3.1Å; N113-K127 HydrophobicContact CB-CB 3.76Å; N113-K127 PolarHBondContact N-O 3.23Å; N113-K127 PolarHBondContact O-N 2.71Å
114	V	98.8	Very high	95.4	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	116.6	-178	-176	0	0	0	0	109.4	A40 F43 A44 N75 Y76 I78 F112 T123 R124 L125	A40-V114 HydrophobicContact CB-CB 4.1Å; A40-V114 HydrophobicContact CB-CG1 3.88Å; F43-V114 HydrophobicContact CD1-CG1 4.14Å; A44-V114 HydrophobicContact CB-CG2 3.77Å; N75-V114 CarbonylContact C-O 3.5Å; N75-V114 WeakPolarHBondContact CA-O 3.47Å; Y76-V114 PolarHBondContact N-O 2.79Å; Y76-V114 PolarHBondContact O-N 2.78Å; I78-V114 HydrophobicContact CD1-CG2 4.08Å; F112-V114 HydrophobicContact CB-CG2 4.38Å; V114-T123 HydrophobicContact CG1-CG2 3.67Å; V114-R124 CarbonylContact C-O 3.58Å; V114-R124 WeakPolarHBondContact CA-O 3.32Å; V114-L125 HydrophobicContact CG2-CD1 4.12Å
115	W	98.4	Very high	96.3	Very high	60 Å²	60	61.3 Å²	61.3	23%	0.227	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	115.1	175.3	-174.4	48.6	0	0	0	110.3	A72 R117 T123 R124 T126	A72-W115 HydrophobicContact CB-CZ2 4.44Å; A72-W115 WeakPolarHBondContact O-CZ2 3.4Å; W115-R117 VanDerWaalsContact CH2-NE 3.26Å; W115-R117 VanDerWaalsContact CZ2-CD 3.43Å; W115-R117 HydrophobicContact CZ2-CG 4.19Å; W115-T123 WeakPolarHBondContact O-CA 3.24Å; W115-R124 PolarHBondContact N-O 2.9Å; W115-R124 PolarHBondContact O-N 2.8Å; W115-T126 HydrophobicContact CB-CG2 3.83Å
116	S	98.2	Very high	97	Very high	11 Å²	11	64.5 Å²	64.5	8%	0.077	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131.8	-177.5	-170.1	0	0	0	0	111.5	G73 T74 T123	G73-S116 CarbonylContact C-O 3.58Å; G73-S116 WeakPolarHBondContact CA-O 3.47Å; T74-S116 PolarHBondContact N-O 2.96Å; T74-S116 PolarHBondContact O-N 2.71Å; S116-T123 PolarHBondContact OG-OG1 3.03Å
117	R	97.8	Very high	97.5	Very high	35 Å²	35	61.1 Å²	61.1	13%	0.132	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	78.8	170.6	-68.3	174.8	-69.7	167	-3.8	108.6	A72 W115 W119 L120 N121 D122	A72-R117 WeakPolarHBondContact O-CD 2.96Å; A72-R117 WeakPolarHBondContact O-CG 3.47Å; W115-R117 VanDerWaalsContact CH2-NE 3.26Å; W115-R117 VanDerWaalsContact CZ2-CD 3.43Å; W115-R117 HydrophobicContact CZ2-CG 4.19Å; R117-W119 HydrophobicContact CB-CD2 4.5Å; R117-W119 HydrophobicContact CB-CZ2 4.11Å; R117-W119 HydrophobicContact CG-CH2 4.37Å; R117-W119 HydrophobicContact CG-CZ2 3.92Å; R117-W119 PolarHBondContact O-N 3.38Å; R117-W119 VanDerWaalsContact O-N 3.16Å; R117-L120 HydrophobicContact CB-CB 4.4Å; R117-L120 PolarHBondContact O-N 3.22Å; R117-N121 PolarHBondContact O-N 3.27Å; R117-D122 IonicContact CZ-OD2 2.84Å; R117-D122 PolarHBondContact N-O 2.84Å; R117-D122 IonicContact NH2-OD1 2.71Å; R117-D122 IonicContact NH2-OD2 2.58Å; R117-D122 PolarHBondContact NH2-OD2 2.86Å; R117-D122 PolarHBondContact O-N 2.92Å
118	P	95.6	Very high	97.8	Very high	58 Å²	58	62.2 Å²	62.2	38%	0.377	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-57	-34.4	-174	-27.3	36	0	0	0	113.6	L120 N121	P118-L120 PolarHBondContact O-N 2.84Å; P118-N121 PolarHBondContact O-N 3.16Å; P118-N121 PolarHBondContact O-OD1 2.79Å
119	W	95.6	Very high	97.9	Very high	171 Å²	171	64.9 Å²	64.9	65%	0.648	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-67.5	-12.4	178.2	59.2	93.3	0	0	0	114.6	G73 R117	G73-W119 VanDerWaalsContact CA-CH2 3.49Å; R117-W119 HydrophobicContact CB-CD2 4.5Å; R117-W119 HydrophobicContact CB-CZ2 4.11Å; R117-W119 HydrophobicContact CG-CH2 4.37Å; R117-W119 HydrophobicContact CG-CZ2 3.92Å; R117-W119 PolarHBondContact O-N 3.38Å; R117-W119 VanDerWaalsContact O-N 3.16Å
120	L	97.9	Very high	97.9	Very high	101 Å²	101	65 Å²	65	53%	0.529	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-110.6	5.4	172.6	-63.4	177.8	0	0	0	112.4	R117 P118 D122	R117-L120 HydrophobicContact CB-CB 4.4Å; R117-L120 PolarHBondContact O-N 3.22Å; P118-L120 PolarHBondContact O-N 2.84Å; L120-D122 HydrophobicContact CB-CB 4.13Å; L120-D122 PolarHBondContact O-N 2.97Å
121	N	96.9	Very high	97.8	Very high	159 Å²	159	66.9 Å²	66.9	85%	0.85	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	35.3	-169.7	-63.4	-34.3	0	0	0	113	R117 P118	R117-N121 PolarHBondContact O-N 3.27Å; P118-N121 PolarHBondContact O-N 3.16Å; P118-N121 PolarHBondContact O-OD1 2.79Å
122	D	97.8	Very high	97.4	Very high	32 Å²	32	69.9 Å²	69.9	17%	0.171	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	112.3	-173.1	-165.3	-21.7	0	0	0	109.9	R117 L120 R124	R117-D122 IonicContact CZ-OD2 2.84Å; R117-D122 PolarHBondContact N-O 2.84Å; R117-D122 IonicContact NH2-OD1 2.71Å; R117-D122 IonicContact NH2-OD2 2.58Å; R117-D122 PolarHBondContact NH2-OD2 2.86Å; R117-D122 PolarHBondContact O-N 2.92Å; L120-D122 HydrophobicContact CB-CB 4.13Å; L120-D122 PolarHBondContact O-N 2.97Å; D122-R124 VanDerWaalsContact OD1-CG 3.24Å; D122-R124 WeakPolarHBondContact OD1-CG 3.35Å; D122-R124 IonicContact OD1-CZ 2.61Å; D122-R124 IonicContact OD1-NE 3.36Å; D122-R124 PolarHBondContact OD1-NE 2.78Å; D122-R124 IonicContact OD1-NH2 3.46Å; D122-R124 IonicContact OD2-CZ 3.65Å; D122-R124 IonicContact OD2-NE 2.78Å; D122-R124 PolarHBondContact OD2-NE 2.85Å; D122-R124 IonicContact OD2-NH2 3.66Å; D122-R124 PolarHBondContact OD2-NH2 2.88Å
123	T	98.4	Very high	96.8	Very high	43 Å²	43	73.3 Å²	73.3	26%	0.264	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	132.2	173.6	-58.9	0	0	0	0	108.4	F43 V114 W115 S116	F43-T123 HydrophobicContact CB-CG2 4.3Å; F43-T123 HydrophobicContact CD1-CG2 3.75Å; F43-T123 HydrophobicContact CD2-CG2 3.91Å; F43-T123 HydrophobicContact CE1-CG2 4.01Å; F43-T123 HydrophobicContact CE2-CG2 4.15Å; F43-T123 HydrophobicContact CG-CG2 3.7Å; F43-T123 HydrophobicContact CZ-CG2 4.2Å; F43-T123 WeakPolarHBondContact CZ-O 3.44Å; V114-T123 HydrophobicContact CG1-CG2 3.67Å; W115-T123 WeakPolarHBondContact O-CA 3.24Å; S116-T123 PolarHBondContact OG-OG1 3.03Å
124	R	98.5	Very high	95.5	Very high	125 Å²	125	79.3 Å²	79.3	47%	0.472	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	137.3	-173.6	-55	-175.6	-171.5	-171.5	-2.9	111.1	V114 W115 D122 T126	V114-R124 CarbonylContact C-O 3.58Å; V114-R124 WeakPolarHBondContact CA-O 3.32Å; W115-R124 PolarHBondContact N-O 2.9Å; W115-R124 PolarHBondContact O-N 2.8Å; D122-R124 VanDerWaalsContact OD1-CG 3.24Å; D122-R124 WeakPolarHBondContact OD1-CG 3.35Å; D122-R124 IonicContact OD1-CZ 2.61Å; D122-R124 IonicContact OD1-NE 3.36Å; D122-R124 PolarHBondContact OD1-NE 2.78Å; D122-R124 IonicContact OD1-NH2 3.46Å; D122-R124 IonicContact OD2-CZ 3.65Å; D122-R124 IonicContact OD2-NE 2.78Å; D122-R124 PolarHBondContact OD2-NE 2.85Å; D122-R124 IonicContact OD2-NH2 3.66Å; D122-R124 PolarHBondContact OD2-NH2 2.88Å; R124-T126 HydrophobicContact CB-CG2 4.18Å; R124-T126 PolarHBondContact O-N 3.39Å
125	L	98.5	Very high	93.6	Very high	46 Å²	46	84.5 Å²	84.5	24%	0.241	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	104.7	164.5	-177.4	63.9	0	0	0	106.3	F43 A44 Q47 F112 V114 K127 E128	F43-L125 HydrophobicContact CE1-CB 4.17Å; A44-L125 HydrophobicContact CB-CD1 4.29Å; Q47-L125 HydrophobicContact CB-CB 4.39Å; Q47-L125 HydrophobicContact CB-CD2 3.73Å; Q47-L125 HydrophobicContact CG-CB 4.39Å; F112-L125 HydrophobicContact CB-CD1 3.92Å; F112-L125 HydrophobicContact CD1-CD1 3.93Å; F112-L125 HydrophobicContact CG-CD1 4.27Å; V114-L125 HydrophobicContact CG2-CD1 4.12Å; L125-K127 WeakPolarHBondContact CD1-O 3.39Å; L125-E128 HydrophobicContact CD2-CB 4.22Å; L125-E128 WeakPolarHBondContact CD2-OE2 2.97Å
126	T	98.3	Very high	91.6	Very high	80 Å²	80	90.6 Å²	90.6	49%	0.491	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-23.7	-174.1	58.5	0	0	0	0	112.3	N113 W115 R124	N113-T126 WeakPolarHBondContact CB-OG1 3.47Å; N113-T126 PolarHBondContact O-N 3.47Å; N113-T126 PolarHBondContact O-OG1 3.1Å; N113-T126 VanDerWaalsContact O-OG1 3.1Å; W115-T126 HydrophobicContact CB-CG2 3.83Å; R124-T126 HydrophobicContact CB-CG2 4.18Å; R124-T126 PolarHBondContact O-N 3.39Å
127	K	98.4	Very high	89.2	Confident	91 Å²	91	95.7 Å²	95.7	40%	0.396	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	143.7	175.8	-158.1	-176.5	-173.1	-152.8	0	110.1	F112 N113 L125 E129	F112-K127 WeakPolarHBondContact CA-O 3.3Å; N113-K127 HydrophobicContact CB-CB 3.76Å; N113-K127 PolarHBondContact N-O 3.23Å; N113-K127 PolarHBondContact O-N 2.71Å; L125-K127 WeakPolarHBondContact CD1-O 3.39Å; K127-E129 WeakPolarHBondContact CE-OE1 3.15Å; K127-E129 HydrophobicContact CG-CG 4.48Å; K127-E129 IonicContact NZ-OE1 3.29Å; K127-E129 PolarHBondContact NZ-OE1 2.85Å; K127-E129 IonicContact NZ-OE2 3.64Å; K127-E129 PolarHBondContact NZ-OE2 2.91Å
128	E	98.3	Very high	86.2	Confident	78 Å²	78	106.4 Å²	106.4	36%	0.364	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-142.6	127	173.5	171.8	174.5	179.1	0	0	108.7	H48 K111 F112 L125	H48-E128 IonicContact CE1-OE1 3.48Å; H48-E128 PolarHBondContact CE1-OE1 2.82Å; H48-E128 IonicContact CG-OE1 3.68Å; H48-E128 IonicContact ND1-OE1 2.64Å; H48-E128 PolarHBondContact ND1-OE1 3.29Å; K111-E128 WeakPolarHBondContact O-CA 3.14Å; F112-E128 HydrophobicContact CD1-CB 4.11Å; F112-E128 HydrophobicContact CD1-CG 3.89Å; F112-E128 HydrophobicContact CE1-CB 4.36Å; F112-E128 HydrophobicContact CE1-CG 3.66Å; L125-E128 HydrophobicContact CD2-CB 4.22Å; L125-E128 WeakPolarHBondContact CD2-OE2 2.97Å
129	E	97.9	Very high	85.7	Confident	96 Å²	96	108.9 Å²	108.9	45%	0.449	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-135.9	118.3	176.2	-66.1	176.6	146.8	0	0	108.4	C110 K111 K127	C110-E129 CarbonylContact C-O 3.57Å; C110-E129 VanDerWaalsContact CA-O 3.29Å; C110-E129 WeakPolarHBondContact CA-O 3.39Å; K111-E129 PolarHBondContact N-O 3.33Å; K111-E129 PolarHBondContact O-N 3.17Å; K127-E129 WeakPolarHBondContact CE-OE1 3.15Å; K127-E129 HydrophobicContact CG-CG 4.48Å; K127-E129 IonicContact NZ-OE1 3.29Å; K127-E129 PolarHBondContact NZ-OE1 2.85Å; K127-E129 IonicContact NZ-OE2 3.64Å; K127-E129 PolarHBondContact NZ-OE2 2.91Å
130	C	97.1	Very high	85.2	Confident	60 Å²	60	105.6 Å²	105.6	41%	0.405	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.2	144.9	179.6	-61.1	0	0	0	0	111	Y108 Q109 C110	Y108-C130 HydrophobicContact CD2-CB 4.21Å; Y108-C130 HydrophobicContact CE2-CB 4.25Å; Q109-C130 CarbonylContact O-C 3.56Å; Q109-C130 VanDerWaalsContact O-CA 3.26Å; Q109-C130 WeakPolarHBondContact O-CA 3.36Å; C110-C130 HydrophobicContact CB-CB 4.19Å; C110-C130 WeakPolarHBondContact CB-SG 3.45Å; C110-C130 WeakPolarHBondContact SG-CB 3.31Å; C110-C130 CovalentContact SG-SG 2.05Å; C110-C130 PolarHBondContact SG-SG 2.85Å
131	G	94.8	Very high	84.5	Confident	39 Å²	39	105.8 Å²	105.8	40%	0.402	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-161.7	173.4	-179.1	0	0	0	0	0	112.3	Y108 Q109	Y108-G131 WeakPolarHBondContact CB-O 3.26Å; Q109-G131 PolarHBondContact N-O 2.82Å; Q109-G131 PolarHBondContact O-N 2.8Å
132	N	90.9	Very high	83.7	Confident	151 Å²	151	102.7 Å²	102.7	81%	0.807	54%	0.541	S	S	*	.			trans	-57.7	152.5	174.6	-63.5	-52.4	0	0	0	110.4	E134	N132-E134 PolarHBondContact O-N 2.61Å
133	I	86.4	Confident	82.9	Confident	72 Å²	72	107.1 Å²	107.1	37%	0.369	56%	0.564	S	S	.	*			trans	-64.1	112.4	174.2	-54.1	175.4	0	0	0	107.4	I81 P107	I81-I133 HydrophobicContact CD1-CD1 4.48Å; I81-I133 HydrophobicContact CG2-CD1 4.02Å; P107-I133 HydrophobicContact CB-CD1 3.84Å; P107-I133 HydrophobicContact CG-CD1 3.78Å; P107-I133 WeakPolarHBondContact O-CD1 3.2Å
134	E	70.4	Confident	81.8	Confident	157 Å²	157	111.4 Å²	111.4	73%	0.734	58%	0.584	S	S	*	*			trans	-69.9	127.2	172.2	-162.4	164.1	-160.1	0	0	107.7	N132 E136	N132-E134 PolarHBondContact O-N 2.61Å; E134-E136 PolarHBondContact O-N 2.71Å
135	P	59.9	Low	80.6	Confident	110 Å²	110	110.4 Å²	110.4	71%	0.714	59%	0.592	S	S	*	*			trans	-61.1	129.6	176.1	24	-30.2	0	0	0	108.3	S137	P135-S137 PolarHBondContact O-N 2.58Å
136	E	56.8	Low	79.3	Confident	187 Å²	187	115.4 Å²	115.4	87%	0.874	62%	0.619	S	S	*	*			trans	-56.5	103.7	176.5	-161.9	167.7	-166.9	0	0	108	E134 Q138	E134-E136 PolarHBondContact O-N 2.71Å; E136-Q138 PolarHBondContact O-N 3.29Å
137	S	46	Very low	77.7	Confident	119 Å²	119	118.3 Å²	118.3	83%	0.832	63%	0.63	S	S	*	*			trans	-70.4	98.6	174.7	60.8	0	0	0	0	107.3	P135	P135-S137 PolarHBondContact O-N 2.58Å
138	Q	35.2	Very low	75.8	Confident	260 Å²	260	120.8 Å²	120.8	100%	1.215	65%	0.651	S	S	*	*			trans	-75.4	0	175.8	-156	-179.6	-58	0	0	111.3	E136	E136-Q138 PolarHBondContact O-N 3.29Å

Retrieved 138 of 138 residues in 35.7 ms (Link to these results)

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