G4LZC5_SCHMA Loading...

Protein sleepless

AlphaFold DB , UniProt , Accession G4LZC5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 147 aa.

						>G4LZC5_SCHMA|G4LZC5
MIRYFVSYIPLGVTIAFLCVLQQESVYGIQCVVCNSYLDGQLCEPWDQFTFITNCSKYPGIDASKPISCRKIDQVVEHERRVVRQCSNVIDNLGCIDRVGTNDVRIRYCHCTEDLCNSITAVKPQSFYYLFSLSALTFSFIRLLIYT
					

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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	57.6	Low	66.6	Low	188 Å²	188	126.2 Å²	126.2	93%	0.926	60%	0.599	S	S	*	*				0	-53.7	0	-73.9	-171.8	-71.5	0	0	113.5	R3 Y4 F5	M1-R3 VanDerWaalsContact C-N 3.28Å; M1-R3 PolarHBondContact O-N 3.14Å; M1-Y4 PolarHBondContact O-N 3.21Å; M1-F5 PolarHBondContact O-N 3.1Å
2	I	62	Low	67.9	Low	143 Å²	143	118.8 Å²	118.8	73%	0.733	58%	0.582	S	S	*	*	H	α-helix	trans	-53.7	-39	-178.2	-64.3	166.8	0	0	0	113.5	Y4 F5 V6	I2-Y4 PolarHBondContact O-N 3.19Å; I2-F5 PolarHBondContact O-N 3.1Å; I2-V6 WeakPolarHBondContact O-CG2 3.46Å; I2-V6 PolarHBondContact O-N 3.48Å; I2-V6 VanDerWaalsContact O-N 3.16Å
3	R	60.3	Low	69	Low	209 Å²	209	116.8 Å²	116.8	79%	0.789	58%	0.581	S	S	*	*	H	α-helix	trans	-63.3	-35.6	177.8	-69.6	-174.3	173.4	-167.1	-2	114	M1 S7	M1-R3 VanDerWaalsContact C-N 3.28Å; M1-R3 PolarHBondContact O-N 3.14Å; R3-S7 PolarHBondContact O-N 3.07Å
4	Y	57.6	Low	69.7	Low	163 Å²	163	111.9 Å²	111.9	64%	0.639	56%	0.56	S	S	*	*	H	α-helix	trans	-66.9	-44.3	176.1	-74.3	-81.8	0	0	0	110.6	M1 I2 V6 S7 Y8	M1-Y4 PolarHBondContact O-N 3.21Å; I2-Y4 PolarHBondContact O-N 3.19Å; Y4-V6 PolarHBondContact O-N 3.3Å; Y4-S7 WeakPolarHBondContact O-CB 3.48Å; Y4-S7 PolarHBondContact O-N 3.42Å; Y4-S7 VanDerWaalsContact O-N 3.09Å; Y4-Y8 HydrophobicContact CD1-CE2 4.3Å; Y4-Y8 WeakPolarHBondContact O-CD2 3.26Å; Y4-Y8 PolarHBondContact O-N 3.29Å; Y4-Y8 VanDerWaalsContact O-N 3.14Å
5	F	59.6	Low	70.6	Confident	147 Å²	147	110.3 Å²	110.3	65%	0.645	55%	0.553	S	S	*	*	H	α-helix	trans	-57.6	-46.1	176.3	-82.9	-82.3	0	0	0	112.5	M1 I2 S7 Y8 I9	M1-F5 PolarHBondContact O-N 3.1Å; I2-F5 PolarHBondContact O-N 3.1Å; F5-S7 PolarHBondContact O-N 3.45Å; F5-Y8 PolarHBondContact O-N 3.17Å; F5-I9 VanDerWaalsContact O-CG1 3.28Å; F5-I9 WeakPolarHBondContact O-CG1 3.14Å; F5-I9 PolarHBondContact O-N 3.16Å
6	V	65.4	Low	71.5	Confident	79 Å²	79	106.8 Å²	106.8	48%	0.479	55%	0.546	S	S	.	.	H	α-helix	trans	-62.4	-29.5	178	178.6	0	0	0	0	112.3	I2 Y4 P10	I2-V6 WeakPolarHBondContact O-CG2 3.46Å; I2-V6 PolarHBondContact O-N 3.48Å; I2-V6 VanDerWaalsContact O-N 3.16Å; Y4-V6 PolarHBondContact O-N 3.3Å; V6-P10 WeakPolarHBondContact O-CD 3.45Å
7	S	66.8	Low	72.1	Confident	63 Å²	63	105.9 Å²	105.9	44%	0.441	54%	0.538	S	S	.	.	H	α-helix	trans	-78.1	-32.8	178.9	-164.8	0	0	0	0	113.8	R3 Y4 F5 P10	R3-S7 PolarHBondContact O-N 3.07Å; Y4-S7 WeakPolarHBondContact O-CB 3.48Å; Y4-S7 PolarHBondContact O-N 3.42Å; Y4-S7 VanDerWaalsContact O-N 3.09Å; F5-S7 PolarHBondContact O-N 3.45Å; S7-P10 WeakPolarHBondContact O-CD 3.49Å; S7-P10 WeakPolarHBondContact O-CG 3.26Å
8	Y	74.8	Confident	72.5	Confident	149 Å²	149	103.4 Å²	103.4	58%	0.584	53%	0.526	S	S	*	.	H	α-helix	trans	-82	-22.8	-180	-69.8	-67.7	0	0	0	113.5	Y4 F5 L11 G12	Y4-Y8 HydrophobicContact CD1-CE2 4.3Å; Y4-Y8 WeakPolarHBondContact O-CD2 3.26Å; Y4-Y8 PolarHBondContact O-N 3.29Å; Y4-Y8 VanDerWaalsContact O-N 3.14Å; F5-Y8 PolarHBondContact O-N 3.17Å; Y8-L11 PolarHBondContact O-N 3.04Å; Y8-G12 PolarHBondContact O-N 3.45Å
9	I	76.9	Confident	73	Confident	106 Å²	106	101.7 Å²	101.7	54%	0.544	52%	0.523	S	S	.	.	H	α-helix	trans	-56	-53.7	177	-70.6	165.7	0	0	0	112.8	F5 L11 G12 V13	F5-I9 VanDerWaalsContact O-CG1 3.28Å; F5-I9 WeakPolarHBondContact O-CG1 3.14Å; F5-I9 PolarHBondContact O-N 3.16Å; I9-L11 VanDerWaalsContact C-N 3.31Å; I9-L11 PolarHBondContact O-N 3.17Å; I9-G12 PolarHBondContact O-N 2.89Å; I9-V13 HydrophobicContact CG2-CG2 4.41Å; I9-V13 WeakPolarHBondContact O-CG2 3.4Å; I9-V13 PolarHBondContact O-N 3.43Å
10	P	73.8	Confident	73.3	Confident	60 Å²	60	101.2 Å²	101.2	39%	0.39	53%	0.525	S	S	.	.	H	α-helix	trans	-63.1	-38.2	-179.8	23.7	-33.8	0	0	0	112.1	V6 S7 V13 T14	V6-P10 WeakPolarHBondContact O-CD 3.45Å; S7-P10 WeakPolarHBondContact O-CD 3.49Å; S7-P10 WeakPolarHBondContact O-CG 3.26Å; P10-V13 PolarHBondContact O-N 3.37Å; P10-T14 WeakPolarHBondContact O-CG2 3.29Å; P10-T14 PolarHBondContact O-N 3.14Å; P10-T14 PolarHBondContact O-OG1 3.39Å
11	L	77.3	Confident	73.3	Confident	81 Å²	81	99.5 Å²	99.5	42%	0.424	52%	0.516	S	S	.	.	H	α-helix	trans	-61.1	-48.2	175	-174.5	69.7	0	0	0	110.7	Y8 I9 V13 T14 I15	Y8-L11 PolarHBondContact O-N 3.04Å; I9-L11 VanDerWaalsContact C-N 3.31Å; I9-L11 PolarHBondContact O-N 3.17Å; L11-V13 VanDerWaalsContact C-N 3.33Å; L11-V13 PolarHBondContact O-N 3.18Å; L11-T14 WeakPolarHBondContact CA-OG1 3.16Å; L11-T14 PolarHBondContact O-N 3.26Å; L11-T14 PolarHBondContact O-OG1 3.41Å; L11-I15 HydrophobicContact CD1-CD1 4.42Å; L11-I15 HydrophobicContact CG-CD1 3.97Å; L11-I15 WeakPolarHBondContact O-CG1 3.49Å; L11-I15 PolarHBondContact O-N 3.27Å
12	G	82.5	Confident	73.8	Confident	38 Å²	38	97.5 Å²	97.5	39%	0.392	50%	0.504	S	S	.	.	H	α-helix	trans	-59.2	-41	176.2	0	0	0	0	0	113	Y8 I9 I15 A16	Y8-G12 PolarHBondContact O-N 3.45Å; I9-G12 PolarHBondContact O-N 2.89Å; G12-I15 PolarHBondContact O-N 3.35Å; G12-A16 VanDerWaalsContact O-CB 3.32Å; G12-A16 WeakPolarHBondContact O-CB 3.39Å; G12-A16 PolarHBondContact O-N 3.01Å
13	V	82.9	Confident	74	Confident	93 Å²	93	98 Å²	98	56%	0.564	50%	0.504	S	S	*	.	H	α-helix	trans	-65.1	-43.5	175.7	172.8	0	0	0	0	111.3	I9 P10 L11 A16 F17	I9-V13 HydrophobicContact CG2-CG2 4.41Å; I9-V13 WeakPolarHBondContact O-CG2 3.4Å; I9-V13 PolarHBondContact O-N 3.43Å; P10-V13 PolarHBondContact O-N 3.37Å; L11-V13 VanDerWaalsContact C-N 3.33Å; L11-V13 PolarHBondContact O-N 3.18Å; V13-A16 PolarHBondContact O-N 3.01Å; V13-F17 WeakPolarHBondContact O-CB 3.47Å; V13-F17 PolarHBondContact O-N 3.29Å
14	T	78.4	Confident	74.3	Confident	47 Å²	47	96.6 Å²	96.6	29%	0.288	51%	0.506	S	S	.	.	H	α-helix	trans	-64.2	-41.9	177.2	57.2	0	0	0	0	112.1	P10 L11 F17 L18 A135	P10-T14 WeakPolarHBondContact O-CG2 3.29Å; P10-T14 PolarHBondContact O-N 3.14Å; P10-T14 PolarHBondContact O-OG1 3.39Å; L11-T14 WeakPolarHBondContact CA-OG1 3.16Å; L11-T14 PolarHBondContact O-N 3.26Å; L11-T14 PolarHBondContact O-OG1 3.41Å; T14-F17 PolarHBondContact O-N 3.32Å; T14-L18 WeakPolarHBondContact O-CB 3.01Å; T14-L18 VanDerWaalsContact O-CG 3.26Å; T14-L18 WeakPolarHBondContact O-CG 3.47Å; T14-L18 PolarHBondContact O-N 3.09Å; T14-A135 HydrophobicContact CG2-CB 4.06Å
15	I	83.1	Confident	74.6	Confident	88 Å²	88	91.7 Å²	91.7	45%	0.451	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-47.2	175.9	-67	167.5	0	0	0	110.1	L11 G12 F17 L18 C19	L11-I15 HydrophobicContact CD1-CD1 4.42Å; L11-I15 HydrophobicContact CG-CD1 3.97Å; L11-I15 WeakPolarHBondContact O-CG1 3.49Å; L11-I15 PolarHBondContact O-N 3.27Å; G12-I15 PolarHBondContact O-N 3.35Å; I15-F17 VanDerWaalsContact C-N 3.32Å; I15-F17 PolarHBondContact O-N 2.88Å; I15-L18 PolarHBondContact O-N 3.07Å; I15-C19 PolarHBondContact O-N 3.43Å; I15-C19 PolarHBondContact O-SG 3.39Å; I15-C19 VanDerWaalsContact O-SG 3.34Å
16	A	84.5	Confident	75.1	Confident	55 Å²	55	91.5 Å²	91.5	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-60.1	-42.4	178	0	0	0	0	0	111.9	G12 V13 C19 V20	G12-A16 VanDerWaalsContact O-CB 3.32Å; G12-A16 WeakPolarHBondContact O-CB 3.39Å; G12-A16 PolarHBondContact O-N 3.01Å; V13-A16 PolarHBondContact O-N 3.01Å; A16-C19 PolarHBondContact O-N 2.92Å; A16-V20 WeakPolarHBondContact O-CG2 3.44Å; A16-V20 PolarHBondContact O-N 3.23Å
17	F	82.6	Confident	75.5	Confident	92 Å²	92	96.7 Å²	96.7	40%	0.404	52%	0.518	S	S	.	.	H	α-helix	trans	-63	-46	176	-171.7	-103.5	0	0	0	111.6	V13 T14 I15 C19 V20 L21 F131	V13-F17 WeakPolarHBondContact O-CB 3.47Å; V13-F17 PolarHBondContact O-N 3.29Å; T14-F17 PolarHBondContact O-N 3.32Å; I15-F17 VanDerWaalsContact C-N 3.32Å; I15-F17 PolarHBondContact O-N 2.88Å; F17-C19 VanDerWaalsContact C-N 3.32Å; F17-C19 PolarHBondContact O-N 3.38Å; F17-V20 PolarHBondContact O-N 2.98Å; F17-L21 HydrophobicContact CD1-CD1 3.95Å; F17-L21 HydrophobicContact CD1-CG 4.45Å; F17-L21 HydrophobicContact CE1-CD1 3.61Å; F17-L21 HydrophobicContact CE1-CG 4.25Å; F17-L21 HydrophobicContact CZ-CD1 4.26Å; F17-L21 HydrophobicContact CZ-CD2 4.46Å; F17-L21 WeakPolarHBondContact O-CG 3.35Å; F17-L21 PolarHBondContact O-N 3.18Å; F17-L21 VanDerWaalsContact O-N 3.13Å; F17-F131 HydrophobicContact CD1-CD1 4.26Å; F17-F131 HydrophobicContact CD1-CE1 4.21Å; F17-F131 AromaticContact CE1-CD1 3.92Å; F17-F131 HydrophobicContact CE1-CD1 3.92Å; F17-F131 HydrophobicContact CE1-CD2 4.38Å; F17-F131 AromaticContact CE1-CE1 3.63Å; F17-F131 HydrophobicContact CE1-CE1 3.63Å; F17-F131 HydrophobicContact CE1-CE2 4.12Å; F17-F131 HydrophobicContact CE1-CG 4.28Å; F17-F131 AromaticContact CE1-CZ 3.73Å; F17-F131 HydrophobicContact CE1-CZ 3.73Å; F17-F131 HydrophobicContact CZ-CE1 4.29Å; F17-F131 HydrophobicContact CZ-CZ 4.07Å
18	L	79.6	Confident	76.3	Confident	61 Å²	61	94.8 Å²	94.8	32%	0.319	51%	0.509	S	S	.	.	H	α-helix	trans	-60.3	-40.8	174.8	-70.2	171.4	0	0	0	111.9	T14 I15 V20 L21 Q22	T14-L18 WeakPolarHBondContact O-CB 3.01Å; T14-L18 VanDerWaalsContact O-CG 3.26Å; T14-L18 WeakPolarHBondContact O-CG 3.47Å; T14-L18 PolarHBondContact O-N 3.09Å; I15-L18 PolarHBondContact O-N 3.07Å; L18-V20 PolarHBondContact O-N 3.22Å; L18-L21 PolarHBondContact O-N 3.5Å; L18-Q22 WeakPolarHBondContact O-CG 3.35Å; L18-Q22 PolarHBondContact O-N 2.99Å
19	C	80.8	Confident	77.1	Confident	71 Å²	71	88.7 Å²	88.7	48%	0.48	49%	0.486	S	S	.	.	H	α-helix	trans	-62.5	-39.9	175.6	-73.2	0	0	0	0	112.7	I15 A16 F17 L21 Q22	I15-C19 PolarHBondContact O-N 3.43Å; I15-C19 PolarHBondContact O-SG 3.39Å; I15-C19 VanDerWaalsContact O-SG 3.34Å; A16-C19 PolarHBondContact O-N 2.92Å; F17-C19 VanDerWaalsContact C-N 3.32Å; F17-C19 PolarHBondContact O-N 3.38Å; C19-L21 VanDerWaalsContact C-N 3.29Å; C19-L21 PolarHBondContact O-N 3.38Å; C19-Q22 PolarHBondContact O-N 3.3Å
20	V	79.2	Confident	77.8	Confident	90 Å²	90	86 Å²	86	55%	0.545	47%	0.472	S	S	.	.	H	α-helix	trans	-64.6	-36.3	176.6	172.4	0	0	0	0	111	A16 F17 L18 Q22 Q23	A16-V20 WeakPolarHBondContact O-CG2 3.44Å; A16-V20 PolarHBondContact O-N 3.23Å; F17-V20 PolarHBondContact O-N 2.98Å; L18-V20 PolarHBondContact O-N 3.22Å; V20-Q22 VanDerWaalsContact C-N 3.3Å; V20-Q22 PolarHBondContact O-N 2.85Å; V20-Q23 PolarHBondContact O-N 2.9Å
21	L	72.8	Confident	78.7	Confident	66 Å²	66	83.2 Å²	83.2	35%	0.346	45%	0.453	S	S	.	.	H	α-helix	trans	-72.8	-19.9	178.1	-61.7	178.9	0	0	0	113.8	F17 L18 C19 Q23 Y128	F17-L21 HydrophobicContact CD1-CD1 3.95Å; F17-L21 HydrophobicContact CD1-CG 4.45Å; F17-L21 HydrophobicContact CE1-CD1 3.61Å; F17-L21 HydrophobicContact CE1-CG 4.25Å; F17-L21 HydrophobicContact CZ-CD1 4.26Å; F17-L21 HydrophobicContact CZ-CD2 4.46Å; F17-L21 WeakPolarHBondContact O-CG 3.35Å; F17-L21 PolarHBondContact O-N 3.18Å; F17-L21 VanDerWaalsContact O-N 3.13Å; L18-L21 PolarHBondContact O-N 3.5Å; C19-L21 VanDerWaalsContact C-N 3.29Å; C19-L21 PolarHBondContact O-N 3.38Å; L21-Q23 VanDerWaalsContact C-N 3.3Å; L21-Y128 HydrophobicContact CB-CE1 3.86Å; L21-Y128 HydrophobicContact CD1-CE1 4.28Å; L21-Y128 PolarHBondContact O-OH 3.36Å
22	Q	68.8	Low	79.4	Confident	146 Å²	146	79.3 Å²	79.3	68%	0.682	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	9.4	177.5	-69.5	-174.5	-61.9	0	0	113.8	L18 C19 V20 E24	L18-Q22 WeakPolarHBondContact O-CG 3.35Å; L18-Q22 PolarHBondContact O-N 2.99Å; C19-Q22 PolarHBondContact O-N 3.3Å; V20-Q22 VanDerWaalsContact C-N 3.3Å; V20-Q22 PolarHBondContact O-N 2.85Å; Q22-E24 PolarHBondContact O-N 3.01Å
23	Q	66.5	Low	80	Confident	155 Å²	155	78.7 Å²	78.7	72%	0.724	42%	0.421	S	S	*	.			trans	-65.5	102.8	175.3	-75.7	-176	-2.4	0	0	110	V20 L21	V20-Q23 PolarHBondContact O-N 2.9Å; L21-Q23 VanDerWaalsContact C-N 3.3Å
24	E	66.2	Low	80.5	Confident	178 Å²	178	74.6 Å²	74.6	83%	0.832	40%	0.397	S	S	*	.			trans	-61.8	144.7	155.8	-65.9	-176.1	176.3	0	0	108.4	Q22 V26	Q22-E24 PolarHBondContact O-N 3.01Å; E24-V26 PolarHBondContact O-N 3.41Å; E24-V26 VanDerWaalsContact O-N 3.1Å
25	S	65	Low	81.2	Confident	60 Å²	60	74.3 Å²	74.3	42%	0.42	39%	0.393	S	S	.	.			trans	-59.8	117.1	177.7	57.8	0	0	0	0	109.7	Y27	S25-Y27 WeakPolarHBondContact CB-O 3.28Å; S25-Y27 PolarHBondContact O-N 3.44Å; S25-Y27 PolarHBondContact OG-O 2.78Å
26	V	68.6	Low	81.6	Confident	143 Å²	143	70.8 Å²	70.8	87%	0.867	38%	0.377	S	S	*	.	S	Bend	trans	-67.5	-22.4	171.2	-176.1	0	0	0	0	111	E24	E24-V26 PolarHBondContact O-N 3.41Å; E24-V26 VanDerWaalsContact O-N 3.1Å
27	Y	73.9	Confident	81.9	Confident	188 Å²	188	75.7 Å²	75.7	74%	0.737	39%	0.385	S	S	*	.	S	Bend	trans	-81	140.2	172.3	-55.9	-73.3	0	0	0	109.2	S25	S25-Y27 WeakPolarHBondContact CB-O 3.28Å; S25-Y27 PolarHBondContact O-N 3.44Å; S25-Y27 PolarHBondContact OG-O 2.78Å
28	G	83.2	Confident	82.4	Confident	24 Å²	24	77.5 Å²	77.5	25%	0.247	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-51.6	150	-178.6	0	0	0	0	0	113.5	Q30 N54 S56	G28-Q30 PolarHBondContact O-N 3.08Å; G28-N54 PolarHBondContact O-ND2 3.23Å; G28-N54 VanDerWaalsContact O-ND2 3.15Å; G28-S56 WeakPolarHBondContact CA-OG 3.32Å
29	I	91.7	Very high	82.9	Confident	20 Å²	20	77.7 Å²	77.7	10%	0.103	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-47.8	133.3	-172.5	-169.5	179.5	0	0	0	112.8	C55 I67 T112 D114	I29-C55 HydrophobicContact CG2-CB 3.85Å; I29-C55 WeakPolarHBondContact O-CB 3.34Å; I29-C55 PolarHBondContact O-N 3.28Å; I29-I67 HydrophobicContact CG2-CB 3.81Å; I29-I67 HydrophobicContact CG2-CG2 3.45Å; I29-I67 VanDerWaalsContact CG2-CG2 3.45Å; I29-T112 VanDerWaalsContact CD1-C 3.44Å; I29-T112 WeakPolarHBondContact CD1-O 3.18Å; I29-D114 WeakPolarHBondContact CA-OD1 3.42Å
30	Q	92.2	Very high	83.1	Confident	51 Å²	51	75.8 Å²	75.8	24%	0.238	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	126.5	176.4	-59.9	-70.1	-5	0	0	109.3	G28 I52 T53 N54 D114 L115	G28-Q30 PolarHBondContact O-N 3.08Å; Q30-I52 HydrophobicContact CB-CG2 4.23Å; Q30-T53 WeakPolarHBondContact CA-O 3.48Å; Q30-T53 PolarHBondContact OE1-O 3.07Å; Q30-N54 PolarHBondContact NE2-ND2 3.24Å; Q30-D114 HydrophobicContact CB-CB 4.47Å; Q30-D114 PolarHBondContact N-OD1 3.33Å; Q30-D114 WeakPolarHBondContact O-CA 3.36Å; Q30-L115 HydrophobicContact CB-CD2 4.12Å; Q30-L115 PolarHBondContact O-N 3.35Å
31	C	93.1	Very high	82.8	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	156.3	176	-57.4	0	0	0	0	110.8	T53 C55 C69	C31-T53 PolarHBondContact N-O 3.13Å; C31-T53 PolarHBondContact O-N 3.31Å; C31-C55 WeakPolarHBondContact CB-SG 3.49Å; C31-C55 PolarHBondContact SG-SG 3.39Å; C31-C69 VanDerWaalsContact CA-SG 3.58Å; C31-C69 HydrophobicContact CB-CB 3.75Å; C31-C69 WeakPolarHBondContact CB-SG 3.47Å; C31-C69 WeakPolarHBondContact SG-CA 3.4Å; C31-C69 WeakPolarHBondContact SG-CB 3.47Å; C31-C69 CovalentContact SG-SG 2.02Å; C31-C69 PolarHBondContact SG-SG 2.77Å
32	V	92.6	Very high	83.2	Confident	0 Å²	0	81 Å²	81	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	130.2	166.5	-175.5	0	0	0	0	108.4	W46 F51 R84 Q85 L115 N117	V32-W46 HydrophobicContact CG1-CG 4.41Å; V32-W46 HydrophobicContact CG2-CD2 4.4Å; V32-W46 HydrophobicContact CG2-CZ2 4.3Å; V32-F51 CarbonylContact C-O 3.53Å; V32-F51 WeakPolarHBondContact CA-O 3.39Å; V32-F51 HydrophobicContact CG1-CB 3.77Å; V32-R84 HydrophobicContact CB-CB 4.4Å; V32-R84 HydrophobicContact CG1-CB 4.38Å; V32-R84 CarbonylContact O-C 3.52Å; V32-R84 WeakPolarHBondContact O-CB 3.21Å; V32-Q85 PolarHBondContact O-N 3.31Å; V32-L115 HydrophobicContact CG2-CD2 4.33Å; V32-N117 PolarHBondContact N-OD1 3.4Å; V32-N117 PolarHBondContact O-ND2 3.49Å
33	V	93.8	Very high	83.8	Confident	24 Å²	24	74.1 Å²	74.1	15%	0.145	38%	0.379	C	S	.	.			trans	-122.8	108.4	176.1	-176.6	0	0	0	0	109.2	F51 T53 Y58 R84	V33-F51 PolarHBondContact N-O 3Å; V33-F51 WeakPolarHBondContact O-CB 3.35Å; V33-F51 WeakPolarHBondContact O-CD1 3.01Å; V33-T53 HydrophobicContact CG2-CG2 4.39Å; V33-Y58 HydrophobicContact CB-CE2 4.49Å; V33-Y58 HydrophobicContact CG1-CE2 3.79Å; V33-Y58 WeakPolarHBondContact CG1-OH 3.29Å; V33-Y58 HydrophobicContact CG2-CE2 4.2Å; V33-R84 VanDerWaalsContact CA-O 3.32Å; V33-R84 WeakPolarHBondContact CA-O 3.33Å
34	C	93.5	Very high	84.1	Confident	7 Å²	7	70.6 Å²	70.6	5%	0.047	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	162.3	178.7	69.8	0	0	0	0	111.9	D39 C43 F51 V83 R84	C34-D39 WeakPolarHBondContact CA-OD2 3.32Å; C34-C43 VanDerWaalsContact C-SG 3.5Å; C34-C43 HydrophobicContact CB-CB 3.65Å; C34-C43 WeakPolarHBondContact CB-SG 3.35Å; C34-C43 VanDerWaalsContact SG-CA 3.6Å; C34-C43 WeakPolarHBondContact SG-CB 3.4Å; C34-C43 CovalentContact SG-SG 2.05Å; C34-C43 PolarHBondContact SG-SG 3.24Å; C34-F51 HydrophobicContact CB-CB 4.23Å; C34-F51 HydrophobicContact CB-CD1 3.8Å; C34-F51 HydrophobicContact CB-CD2 3.93Å; C34-F51 HydrophobicContact CB-CE1 4.13Å; C34-F51 HydrophobicContact CB-CE2 4.28Å; C34-F51 HydrophobicContact CB-CG 3.72Å; C34-F51 HydrophobicContact CB-CZ 4.39Å; C34-V83 CarbonylContact O-C 3.52Å; C34-V83 WeakPolarHBondContact O-CA 3.32Å; C34-R84 PolarHBondContact N-O 2.82Å; C34-R84 PolarHBondContact O-N 3.06Å; C34-R84 PolarHBondContact SG-NH1 3.09Å
35	N	93.4	Very high	84.1	Confident	41 Å²	41	66.6 Å²	66.6	22%	0.219	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	113.3	174.9	-178.8	-14.1	0	0	0	109.6	Y37 L38 D39	N35-Y37 PolarHBondContact O-N 2.91Å; N35-Y37 WeakPolarHBondContact OD1-CB 3.26Å; N35-Y37 PolarHBondContact OD1-N 3.32Å; N35-L38 HydrophobicContact CB-CB 4.37Å; N35-L38 HydrophobicContact CB-CD1 4.4Å; N35-L38 HydrophobicContact CB-CG 4.45Å; N35-L38 PolarHBondContact O-N 3.22Å; N35-D39 PolarHBondContact N-OD2 3.46Å; N35-D39 WeakPolarHBondContact O-CB 3.47Å; N35-D39 PolarHBondContact O-N 2.89Å
36	S	92.1	Very high	84	Confident	15 Å²	15	66 Å²	66	11%	0.105	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-17.5	-176.7	74.3	0	0	0	0	114.5	G40 C43 R81 V82	S36-G40 VanDerWaalsContact O-CA 3.28Å; S36-G40 WeakPolarHBondContact O-CA 3.5Å; S36-G40 PolarHBondContact O-N 2.93Å; S36-C43 PolarHBondContact N-SG 2.88Å; S36-R81 WeakPolarHBondContact OG-CA 3.18Å; S36-V82 PolarHBondContact N-O 3.38Å; S36-V82 PolarHBondContact OG-N 3.4Å
37	Y	91.2	Very high	83.6	Confident	158 Å²	158	62.6 Å²	62.6	62%	0.62	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-36.3	173.3	179.9	-101.4	0	0	0	112.7	N35	N35-Y37 PolarHBondContact O-N 2.91Å; N35-Y37 WeakPolarHBondContact OD1-CB 3.26Å; N35-Y37 PolarHBondContact OD1-N 3.32Å
38	L	92	Very high	83	Confident	130 Å²	130	59.3 Å²	59.3	68%	0.681	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-43.5	-177.3	-62.2	176.7	0	0	0	112	N35 G40	N35-L38 HydrophobicContact CB-CB 4.37Å; N35-L38 HydrophobicContact CB-CD1 4.4Å; N35-L38 HydrophobicContact CB-CG 4.45Å; N35-L38 PolarHBondContact O-N 3.22Å; L38-G40 VanDerWaalsContact C-N 3.29Å
39	D	90.5	Very high	82.3	Confident	64 Å²	64	65.8 Å²	65.8	34%	0.342	33%	0.331	S	S	.	.	S	Bend	trans	-88.2	-3	-177.7	-54.3	-49.6	0	0	0	112.2	C34 N35 C43 F51	C34-D39 WeakPolarHBondContact CA-OD2 3.32Å; N35-D39 PolarHBondContact N-OD2 3.46Å; N35-D39 WeakPolarHBondContact O-CB 3.47Å; N35-D39 PolarHBondContact O-N 2.89Å; D39-C43 HydrophobicContact CB-CB 4.22Å; D39-F51 HydrophobicContact CB-CE1 4.21Å; D39-F51 HydrophobicContact CB-CZ 3.84Å
40	G	84.9	Confident	81.8	Confident	32 Å²	32	68.9 Å²	68.9	33%	0.33	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	59.4	-143	180	0	0	0	0	0	112.8	S36 L38 L42 C43	S36-G40 VanDerWaalsContact O-CA 3.28Å; S36-G40 WeakPolarHBondContact O-CA 3.5Å; S36-G40 PolarHBondContact O-N 2.93Å; L38-G40 VanDerWaalsContact C-N 3.29Å; G40-L42 PolarHBondContact O-N 2.73Å; G40-C43 PolarHBondContact O-N 2.92Å
41	Q	73.6	Confident	81.6	Confident	162 Å²	162	67.6 Å²	67.6	76%	0.757	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-61.9	-26.3	-175.7	-71.6	-174.8	-4.8	0	0	112.5	C43 E44 P45	Q41-C43 PolarHBondContact O-N 3.5Å; Q41-C43 VanDerWaalsContact O-N 3.09Å; Q41-E44 PolarHBondContact O-N 3.1Å; Q41-P45 WeakPolarHBondContact O-CD 3.16Å
42	L	79.4	Confident	81.5	Confident	104 Å²	104	70.5 Å²	70.5	55%	0.545	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-60.7	-26.5	-177.5	-65.4	176.1	0	0	0	113.5	G40 W46 F51	G40-L42 PolarHBondContact O-N 2.73Å; L42-W46 VanDerWaalsContact O-CA 3.32Å; L42-W46 WeakPolarHBondContact O-CA 3.13Å; L42-F51 HydrophobicContact CB-CE2 3.77Å; L42-F51 HydrophobicContact CB-CZ 4.01Å; L42-F51 WeakPolarHBondContact O-CE2 3.37Å
43	C	82.3	Confident	81.5	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-78	-24.6	175.7	-176.5	0	0	0	0	112.1	C34 S36 D39 G40 Q41 R84	C34-C43 VanDerWaalsContact C-SG 3.5Å; C34-C43 HydrophobicContact CB-CB 3.65Å; C34-C43 WeakPolarHBondContact CB-SG 3.35Å; C34-C43 VanDerWaalsContact SG-CA 3.6Å; C34-C43 WeakPolarHBondContact SG-CB 3.4Å; C34-C43 CovalentContact SG-SG 2.05Å; C34-C43 PolarHBondContact SG-SG 3.24Å; S36-C43 PolarHBondContact N-SG 2.88Å; D39-C43 HydrophobicContact CB-CB 4.22Å; G40-C43 PolarHBondContact O-N 2.92Å; Q41-C43 PolarHBondContact O-N 3.5Å; Q41-C43 VanDerWaalsContact O-N 3.09Å; C43-R84 PolarHBondContact O-NH1 3.19Å; C43-R84 PolarHBondContact O-NH2 3Å; C43-R84 PolarHBondContact SG-NH1 2.83Å
44	E	71.9	Confident	81.5	Confident	81 Å²	81	73.3 Å²	73.3	38%	0.379	38%	0.375	S	S	.	.	S	Bend	trans	-77.5	-59.5	-175	-78.3	-155.9	142.4	0	0	113.5	Q41 R80 I119	Q41-E44 PolarHBondContact O-N 3.1Å; E44-R80 IonicContact OE1-NH1 3.01Å; E44-R80 PolarHBondContact OE1-NH1 2.88Å; E44-I119 WeakPolarHBondContact O-CD1 3.44Å
45	P	67.7	Low	81.6	Confident	94 Å²	94	73 Å²	73	61%	0.61	37%	0.373	S	S	*	.	S	Bend	trans	-92.7	88.4	155.8	17	5.7	0	0	0	107.9	Q41 D47	Q41-P45 WeakPolarHBondContact O-CD 3.16Å; P45-D47 PolarHBondContact O-N 3.47Å
46	W	63.3	Low	81.6	Confident	48 Å²	48	73.6 Å²	73.6	18%	0.182	38%	0.38	C	S	.	.			trans	-54.6	127.6	175.6	158.2	68.4	0	0	0	111.5	V32 L42 Q48 F51 I52 L115 I119	V32-W46 HydrophobicContact CG1-CG 4.41Å; V32-W46 HydrophobicContact CG2-CD2 4.4Å; V32-W46 HydrophobicContact CG2-CZ2 4.3Å; L42-W46 VanDerWaalsContact O-CA 3.32Å; L42-W46 WeakPolarHBondContact O-CA 3.13Å; W46-Q48 HydrophobicContact CH2-CB 4.23Å; W46-Q48 HydrophobicContact CH2-CG 4.38Å; W46-Q48 VanDerWaalsContact CZ2-C 3.47Å; W46-Q48 HydrophobicContact CZ2-CB 4.24Å; W46-Q48 WeakPolarHBondContact CZ2-O 3.07Å; W46-Q48 HydrophobicContact CZ3-CG 4.41Å; W46-F51 AromaticContact CD1-CD2 3.93Å; W46-I52 HydrophobicContact CZ2-CD1 3.97Å; W46-I52 HydrophobicContact CZ2-CG1 3.87Å; W46-L115 HydrophobicContact CH2-CD1 4.4Å; W46-I119 HydrophobicContact CB-CD1 4.29Å
47	D	58.2	Low	81.5	Confident	72 Å²	72	81.6 Å²	81.6	39%	0.385	41%	0.413	S	S	.	.			trans	-75.1	128.3	158	136.5	36.9	0	0	0	108.5	P45 F49 T50	P45-D47 PolarHBondContact O-N 3.47Å; D47-F49 PolarHBondContact O-N 3.12Å; D47-F49 PolarHBondContact OD1-N 3.4Å; D47-T50 PolarHBondContact O-N 3.39Å; D47-T50 PolarHBondContact OD2-OG1 2.92Å
48	Q	62.1	Low	81.6	Confident	118 Å²	118	77.7 Å²	77.7	55%	0.551	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.5	-20.1	-172.8	-57	180	-27.6	0	0	116.5	W46 I52	W46-Q48 HydrophobicContact CH2-CB 4.23Å; W46-Q48 HydrophobicContact CH2-CG 4.38Å; W46-Q48 VanDerWaalsContact CZ2-C 3.47Å; W46-Q48 HydrophobicContact CZ2-CB 4.24Å; W46-Q48 WeakPolarHBondContact CZ2-O 3.07Å; W46-Q48 HydrophobicContact CZ3-CG 4.41Å; Q48-I52 WeakPolarHBondContact O-CD1 3.07Å; Q48-I52 WeakPolarHBondContact O-CG1 3.48Å
49	F	69.4	Low	81.7	Confident	160 Å²	160	76.5 Å²	76.5	70%	0.702	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.4	-18.4	-168.1	-56.1	-71.8	0	0	0	115.5	D47	D47-F49 PolarHBondContact O-N 3.12Å; D47-F49 PolarHBondContact OD1-N 3.4Å
50	T	79.9	Confident	81.8	Confident	85 Å²	85	77.4 Å²	77.4	52%	0.521	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-32.4	-169.2	-63.8	0	0	0	0	113.9	D47	D47-T50 PolarHBondContact O-N 3.39Å; D47-T50 PolarHBondContact OD2-OG1 2.92Å
51	F	89.6	Confident	82.3	Confident	24 Å²	24	77.2 Å²	77.2	11%	0.105	41%	0.414	C	S	.	.	S	Bend	trans	-113.9	10	-170.6	-63	-56.4	0	0	0	114.7	V32 V33 C34 D39 L42 W46	V32-F51 CarbonylContact C-O 3.53Å; V32-F51 WeakPolarHBondContact CA-O 3.39Å; V32-F51 HydrophobicContact CG1-CB 3.77Å; V33-F51 PolarHBondContact N-O 3Å; V33-F51 WeakPolarHBondContact O-CB 3.35Å; V33-F51 WeakPolarHBondContact O-CD1 3.01Å; C34-F51 HydrophobicContact CB-CB 4.23Å; C34-F51 HydrophobicContact CB-CD1 3.8Å; C34-F51 HydrophobicContact CB-CD2 3.93Å; C34-F51 HydrophobicContact CB-CE1 4.13Å; C34-F51 HydrophobicContact CB-CE2 4.28Å; C34-F51 HydrophobicContact CB-CG 3.72Å; C34-F51 HydrophobicContact CB-CZ 4.39Å; D39-F51 HydrophobicContact CB-CE1 4.21Å; D39-F51 HydrophobicContact CB-CZ 3.84Å; L42-F51 HydrophobicContact CB-CE2 3.77Å; L42-F51 HydrophobicContact CB-CZ 4.01Å; L42-F51 WeakPolarHBondContact O-CE2 3.37Å; W46-F51 AromaticContact CD1-CD2 3.93Å
52	I	90.8	Very high	83.2	Confident	62 Å²	62	72.2 Å²	72.2	32%	0.318	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128.2	176.7	-62	-177.5	0	0	0	109.5	Q30 W46 Q48 L115	Q30-I52 HydrophobicContact CB-CG2 4.23Å; W46-I52 HydrophobicContact CZ2-CD1 3.97Å; W46-I52 HydrophobicContact CZ2-CG1 3.87Å; Q48-I52 WeakPolarHBondContact O-CD1 3.07Å; Q48-I52 WeakPolarHBondContact O-CG1 3.48Å; I52-L115 HydrophobicContact CB-CD2 4.38Å; I52-L115 HydrophobicContact CD1-CD1 3.91Å; I52-L115 HydrophobicContact CD1-CD2 3.96Å; I52-L115 HydrophobicContact CG1-CD2 3.78Å; I52-L115 HydrophobicContact CG2-CD2 3.93Å
53	T	92.5	Very high	83.8	Confident	44 Å²	44	70.4 Å²	70.4	27%	0.27	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	138.4	177.7	-58.1	0	0	0	0	112	Q30 C31 V33 C55 Y58	Q30-T53 WeakPolarHBondContact CA-O 3.48Å; Q30-T53 PolarHBondContact OE1-O 3.07Å; C31-T53 PolarHBondContact N-O 3.13Å; C31-T53 PolarHBondContact O-N 3.31Å; V33-T53 HydrophobicContact CG2-CG2 4.39Å; T53-C55 PolarHBondContact O-N 3.42Å; T53-Y58 HydrophobicContact CG2-CD2 3.69Å; T53-Y58 HydrophobicContact CG2-CE2 4.44Å; T53-Y58 HydrophobicContact CG2-CG 4.5Å
54	N	93.7	Very high	84.3	Confident	39 Å²	39	75.3 Å²	75.3	21%	0.209	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	111.1	170.6	-174.4	-72.2	0	0	0	109.8	G28 Q30 S56 K57 Y58	G28-N54 PolarHBondContact O-ND2 3.23Å; G28-N54 VanDerWaalsContact O-ND2 3.15Å; Q30-N54 PolarHBondContact NE2-ND2 3.24Å; N54-S56 VanDerWaalsContact C-N 3.3Å; N54-S56 PolarHBondContact O-N 2.85Å; N54-S56 WeakPolarHBondContact OD1-CB 3.32Å; N54-S56 PolarHBondContact OD1-N 3.34Å; N54-S56 VanDerWaalsContact OD1-N 3.15Å; N54-K57 PolarHBondContact O-N 3.46Å; N54-Y58 PolarHBondContact O-N 3.2Å
55	C	95.1	Very high	85.2	Confident	0 Å²	0	77 Å²	77	0%	0	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-72.3	-21	-172.1	-69.5	0	0	0	0	114.4	I29 C31 T53 K57 Y58 I61 I67 C86	I29-C55 HydrophobicContact CG2-CB 3.85Å; I29-C55 WeakPolarHBondContact O-CB 3.34Å; I29-C55 PolarHBondContact O-N 3.28Å; C31-C55 WeakPolarHBondContact CB-SG 3.49Å; C31-C55 PolarHBondContact SG-SG 3.39Å; T53-C55 PolarHBondContact O-N 3.42Å; C55-K57 PolarHBondContact O-N 3.44Å; C55-Y58 PolarHBondContact O-N 3.48Å; C55-I61 WeakPolarHBondContact O-CG2 3.49Å; C55-I67 HydrophobicContact CB-CG2 3.54Å; C55-C86 WeakPolarHBondContact CA-SG 3.32Å; C55-C86 HydrophobicContact CB-CB 3.65Å; C55-C86 WeakPolarHBondContact CB-SG 3.11Å; C55-C86 WeakPolarHBondContact SG-CB 3.35Å; C55-C86 CovalentContact SG-SG 2.03Å; C55-C86 PolarHBondContact SG-SG 2.89Å
56	S	92.7	Very high	86.4	Confident	53 Å²	53	76 Å²	76	37%	0.371	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-66.9	-16.9	175.1	-58.5	0	0	0	0	113.1	G28 N54	G28-S56 WeakPolarHBondContact CA-OG 3.32Å; N54-S56 VanDerWaalsContact C-N 3.3Å; N54-S56 PolarHBondContact O-N 2.85Å; N54-S56 WeakPolarHBondContact OD1-CB 3.32Å; N54-S56 PolarHBondContact OD1-N 3.34Å; N54-S56 VanDerWaalsContact OD1-N 3.15Å
57	K	91.6	Very high	87.9	Confident	183 Å²	183	75.1 Å²	75.1	80%	0.796	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-111.3	3.9	176.2	-60.7	-177	-178.5	179.2	0	112.8	N54 C55	N54-K57 PolarHBondContact O-N 3.46Å; C55-K57 PolarHBondContact O-N 3.44Å
58	Y	93.5	Very high	89.6	Confident	76 Å²	76	71.7 Å²	71.7	30%	0.298	41%	0.406	S	S	.	.	S	Bend	trans	-76.7	132.7	-174	-171.4	-102.8	0	0	0	111.3	V33 T53 N54 C55 G60 I61 C86	V33-Y58 HydrophobicContact CB-CE2 4.49Å; V33-Y58 HydrophobicContact CG1-CE2 3.79Å; V33-Y58 WeakPolarHBondContact CG1-OH 3.29Å; V33-Y58 HydrophobicContact CG2-CE2 4.2Å; T53-Y58 HydrophobicContact CG2-CD2 3.69Å; T53-Y58 HydrophobicContact CG2-CE2 4.44Å; T53-Y58 HydrophobicContact CG2-CG 4.5Å; N54-Y58 PolarHBondContact O-N 3.2Å; C55-Y58 PolarHBondContact O-N 3.48Å; Y58-G60 PolarHBondContact O-N 3.22Å; Y58-I61 HydrophobicContact CD1-CG1 3.8Å; Y58-I61 HydrophobicContact CG-CG1 4.44Å; Y58-I61 PolarHBondContact O-N 3.28Å; Y58-C86 HydrophobicContact CD1-CB 3.97Å; Y58-C86 HydrophobicContact CG-CB 4.28Å
59	P	93.5	Very high	91.2	Very high	105 Å²	105	66 Å²	66	68%	0.682	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	135.2	177.8	-25.6	34.5	0	0	0	112.7	I61	P59-I61 VanDerWaalsContact C-N 3.27Å; P59-I61 PolarHBondContact O-N 3.3Å
60	G	92.2	Very high	92.4	Very high	84 Å²	84	61.1 Å²	61.1	87%	0.866	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	0.6	179.5	0	0	0	0	0	115.1	Y58	Y58-G60 PolarHBondContact O-N 3.22Å
61	I	94.6	Very high	93.1	Very high	27 Å²	27	59.4 Å²	59.4	14%	0.138	34%	0.342	C	S	.	.			trans	-94.8	128.4	169.7	-64.5	-69.4	0	0	0	109.6	C55 Y58 P59 A63 I67 C86	C55-I61 WeakPolarHBondContact O-CG2 3.49Å; Y58-I61 HydrophobicContact CD1-CG1 3.8Å; Y58-I61 HydrophobicContact CG-CG1 4.44Å; Y58-I61 PolarHBondContact O-N 3.28Å; P59-I61 VanDerWaalsContact C-N 3.27Å; P59-I61 PolarHBondContact O-N 3.3Å; I61-A63 PolarHBondContact O-N 3.46Å; I61-I67 HydrophobicContact CG2-CD1 3.75Å; I61-I67 HydrophobicContact CG2-CG1 3.87Å; I61-I67 HydrophobicContact CG2-CG2 4.21Å; I61-C86 VanDerWaalsContact CD1-C 3.5Å; I61-C86 HydrophobicContact CD1-CB 3.62Å; I61-C86 HydrophobicContact CG1-CB 3.6Å
62	D	94.2	Very high	93.3	Very high	58 Å²	58	59.2 Å²	59.2	31%	0.31	34%	0.342	S	S	.	.			trans	-81.6	104.4	171.4	-176.2	-5.9	0	0	0	108.9	S64 K65 N88	D62-S64 PolarHBondContact O-N 3.03Å; D62-S64 VanDerWaalsContact OD1-CB 3.29Å; D62-S64 WeakPolarHBondContact OD1-CB 2.78Å; D62-S64 PolarHBondContact OD1-N 2.78Å; D62-S64 PolarHBondContact OD1-OG 3.1Å; D62-S64 PolarHBondContact OD2-OG 2.95Å; D62-K65 HydrophobicContact CB-CB 4.41Å; D62-K65 HydrophobicContact CB-CD 4.14Å; D62-K65 HydrophobicContact CB-CG 4.35Å; D62-K65 PolarHBondContact O-N 2.79Å; D62-K65 VanDerWaalsContact O-N 3.11Å; D62-K65 WeakPolarHBondContact OD2-CD 2.94Å; D62-K65 WeakPolarHBondContact OD2-CE 3.5Å; D62-K65 IonicContact OD2-NZ 3.61Å; D62-K65 PolarHBondContact OD2-NZ 2.8Å; D62-N88 PolarHBondContact N-OD1 3.14Å; D62-N88 PolarHBondContact O-ND2 2.9Å
63	A	91.3	Very high	93.4	Very high	66 Å²	66	58.1 Å²	58.1	55%	0.545	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-11.3	179.1	0	0	0	0	0	113.6	I61 K65	I61-A63 PolarHBondContact O-N 3.46Å; A63-K65 VanDerWaalsContact C-N 3.29Å
64	S	91.8	Very high	93.5	Very high	103 Å²	103	58.2 Å²	58.2	72%	0.72	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-11.6	173.2	76.2	0	0	0	0	113.2	D62	D62-S64 PolarHBondContact O-N 3.03Å; D62-S64 VanDerWaalsContact OD1-CB 3.29Å; D62-S64 WeakPolarHBondContact OD1-CB 2.78Å; D62-S64 PolarHBondContact OD1-N 2.78Å; D62-S64 PolarHBondContact OD1-OG 3.1Å; D62-S64 PolarHBondContact OD2-OG 2.95Å
65	K	92.4	Very high	93.5	Very high	116 Å²	116	56.7 Å²	56.7	50%	0.504	33%	0.326	S	S	.	.	S	Bend	trans	-106.7	157.4	179.2	-70.1	176.9	-173.9	165	0	111	D62 A63 I67 N88	D62-K65 HydrophobicContact CB-CB 4.41Å; D62-K65 HydrophobicContact CB-CD 4.14Å; D62-K65 HydrophobicContact CB-CG 4.35Å; D62-K65 PolarHBondContact O-N 2.79Å; D62-K65 VanDerWaalsContact O-N 3.11Å; D62-K65 WeakPolarHBondContact OD2-CD 2.94Å; D62-K65 WeakPolarHBondContact OD2-CE 3.5Å; D62-K65 IonicContact OD2-NZ 3.61Å; D62-K65 PolarHBondContact OD2-NZ 2.8Å; A63-K65 VanDerWaalsContact C-N 3.29Å; K65-I67 WeakPolarHBondContact O-CG1 3.01Å; K65-I67 PolarHBondContact O-N 3.35Å; K65-N88 HydrophobicContact CB-CB 4.44Å
66	P	92.5	Very high	93.4	Very high	74 Å²	74	58.7 Å²	58.7	48%	0.481	34%	0.338	S	S	.	.			trans	-51.8	136.8	168.8	-28	37.8	0	0	0	111.4	N88 I90	P66-N88 WeakPolarHBondContact O-CA 3.1Å; P66-N88 PolarHBondContact O-ND2 2.66Å; P66-I90 HydrophobicContact CB-CB 4.47Å; P66-I90 HydrophobicContact CB-CD1 3.69Å; P66-I90 HydrophobicContact CB-CG1 4.15Å; P66-I90 HydrophobicContact CB-CG2 3.63Å; P66-I90 HydrophobicContact CG-CD1 3.71Å
67	I	94.5	Very high	93.3	Very high	28 Å²	28	62.7 Å²	62.7	14%	0.144	35%	0.351	C	S	.	.			trans	-113.5	136.7	-177.9	-53.8	176	0	0	0	108.3	I29 C55 I61 K65 S87	I29-I67 HydrophobicContact CG2-CB 3.81Å; I29-I67 HydrophobicContact CG2-CG2 3.45Å; I29-I67 VanDerWaalsContact CG2-CG2 3.45Å; C55-I67 HydrophobicContact CB-CG2 3.54Å; I61-I67 HydrophobicContact CG2-CD1 3.75Å; I61-I67 HydrophobicContact CG2-CG1 3.87Å; I61-I67 HydrophobicContact CG2-CG2 4.21Å; K65-I67 WeakPolarHBondContact O-CG1 3.01Å; K65-I67 PolarHBondContact O-N 3.35Å; I67-S87 CarbonylContact C-O 3.59Å; I67-S87 WeakPolarHBondContact CA-O 3.17Å
68	S	94.8	Very high	93	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	157.9	174.8	67.9	0	0	0	0	110.7	S87 V89 C111	S68-S87 PolarHBondContact N-O 2.7Å; S68-S87 PolarHBondContact O-N 3.49Å; S68-S87 PolarHBondContact OG-O 3.33Å; S68-V89 PolarHBondContact OG-O 3Å; S68-C111 CarbonylContact C-O 3.56Å; S68-C111 WeakPolarHBondContact CA-O 3.26Å; S68-C111 VanDerWaalsContact CB-O 3.32Å; S68-C111 WeakPolarHBondContact CB-O 3.44Å
69	C	94.8	Very high	92.9	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	139	164.4	-53.1	0	0	0	0	109.8	C31 H110 C111 N117	C31-C69 VanDerWaalsContact CA-SG 3.58Å; C31-C69 HydrophobicContact CB-CB 3.75Å; C31-C69 WeakPolarHBondContact CB-SG 3.47Å; C31-C69 WeakPolarHBondContact SG-CA 3.4Å; C31-C69 WeakPolarHBondContact SG-CB 3.47Å; C31-C69 CovalentContact SG-SG 2.02Å; C31-C69 PolarHBondContact SG-SG 2.77Å; C69-H110 WeakPolarHBondContact O-CA 3.28Å; C69-C111 PolarHBondContact N-O 3.1Å; C69-C111 PolarHBondContact O-N 3.31Å; C69-N117 HydrophobicContact CB-CB 3.61Å
70	R	95.2	Very high	92.8	Very high	56 Å²	56	63.4 Å²	63.4	21%	0.211	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.6	173.9	177.4	168.5	58.8	-158.7	1.5	110.7	I72 R84 Q85 C109 H110 N117	R70-I72 HydrophobicContact CG-CD1 4.4Å; R70-I72 HydrophobicContact CG-CG1 3.88Å; R70-R84 WeakPolarHBondContact O-CA 3.29Å; R70-Q85 HydrophobicContact CB-CG 4.11Å; R70-Q85 HydrophobicContact CG-CG 4.4Å; R70-Q85 PolarHBondContact N-O 2.93Å; R70-Q85 VanDerWaalsContact NE-CD 3.35Å; R70-Q85 VanDerWaalsContact NE-NE2 3.11Å; R70-Q85 VanDerWaalsContact NH2-NE2 3.17Å; R70-Q85 PolarHBondContact O-N 2.95Å; R70-C109 CarbonylContact C-O 3.56Å; R70-C109 VanDerWaalsContact CA-O 3.3Å; R70-C109 WeakPolarHBondContact CA-O 3.47Å; R70-H110 VanDerWaalsContact CD-CE1 3.48Å; R70-H110 WeakPolarHBondContact CD-CE1 3.11Å; R70-N117 PolarHBondContact O-ND2 2.97Å
71	K	94.2	Very high	92.8	Very high	49 Å²	49	62.1 Å²	62.1	21%	0.213	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.6	165	-179.2	179.1	-179.2	-178.8	0	108.8	V82 V83 R84 C109 N117	K71-V82 HydrophobicContact CG-CG1 4.38Å; K71-V83 CarbonylContact C-O 3.41Å; K71-R84 HydrophobicContact CB-CG 4.49Å; K71-R84 HydrophobicContact CG-CG 4.25Å; K71-C109 HydrophobicContact CB-CB 4.39Å; K71-C109 PolarHBondContact N-O 3.42Å; K71-C109 PolarHBondContact O-N 3.32Å; K71-N117 HydrophobicContact CB-CB 4.17Å
72	I	94.3	Very high	92.6	Very high	20 Å²	20	60.9 Å²	60.9	10%	0.103	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	117.6	176.3	-52.6	178.6	0	0	0	106.8	R70 V82 V83 I106 R107 Y108	R70-I72 HydrophobicContact CG-CD1 4.4Å; R70-I72 HydrophobicContact CG-CG1 3.88Å; I72-V82 CarbonylContact O-C 3.57Å; I72-V82 VanDerWaalsContact O-CA 3.32Å; I72-V82 WeakPolarHBondContact O-CA 3Å; I72-V83 HydrophobicContact CB-CB 4.26Å; I72-V83 PolarHBondContact N-O 3.35Å; I72-V83 PolarHBondContact O-N 3.19Å; I72-I106 HydrophobicContact CG2-CG2 3.51Å; I72-R107 WeakPolarHBondContact CA-O 3.45Å; I72-Y108 HydrophobicContact CD1-CD1 4.09Å; I72-Y108 HydrophobicContact CD1-CE1 3.97Å; I72-Y108 HydrophobicContact CG1-CD1 3.92Å; I72-Y108 HydrophobicContact CG1-CE1 4.22Å; I72-Y108 HydrophobicContact CG2-CD1 4.3Å; I72-Y108 HydrophobicContact CG2-CE1 4.13Å
73	D	93.1	Very high	92.6	Very high	40 Å²	40	59.3 Å²	59.3	21%	0.214	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110.3	169.4	-166.8	-29	0	0	0	107.1	R80 I106 R107	D73-R80 IonicContact OD1-CZ 3.62Å; D73-R80 IonicContact OD1-NE 2.89Å; D73-R80 PolarHBondContact OD1-NE 3.01Å; D73-R80 IonicContact OD1-NH2 3.7Å; D73-R80 IonicContact OD2-CZ 3.32Å; D73-R80 VanDerWaalsContact OD2-CZ 3.32Å; D73-R80 IonicContact OD2-NE 3.13Å; D73-R80 PolarHBondContact OD2-NE 3.37Å; D73-R80 VanDerWaalsContact OD2-NE 3.13Å; D73-R80 IonicContact OD2-NH2 2.67Å; D73-R80 PolarHBondContact OD2-NH2 3.19Å; D73-I106 CarbonylContact O-C 3.56Å; D73-I106 WeakPolarHBondContact O-CA 3.34Å; D73-R107 HydrophobicContact CB-CB 4.24Å; D73-R107 PolarHBondContact N-O 3.13Å; D73-R107 PolarHBondContact O-N 2.8Å
74	Q	93.5	Very high	92.8	Very high	46 Å²	46	56.5 Å²	56.5	22%	0.215	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.7	-178.2	59.8	-178.9	-25.3	0	0	109.3	R80 R81 R105 I106	Q74-R80 CarbonylContact O-C 3.49Å; Q74-R80 WeakPolarHBondContact O-CA 3.43Å; Q74-R81 HydrophobicContact CG-CB 3.64Å; Q74-R81 VanDerWaalsContact CG-O 3.26Å; Q74-R81 WeakPolarHBondContact CG-O 2.94Å; Q74-R81 PolarHBondContact N-O 3.15Å; Q74-R81 PolarHBondContact O-N 3.3Å; Q74-R105 CarbonylContact C-O 3.59Å; Q74-R105 WeakPolarHBondContact CA-O 3.48Å; Q74-I106 HydrophobicContact CB-CG1 4.13Å; Q74-I106 HydrophobicContact CB-CG2 4.24Å
75	V	93.5	Very high	92.9	Very high	6 Å²	6	53.8 Å²	53.8	4%	0.036	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	126.6	168.4	-172	0	0	0	0	108.2	E79 R80 V104 R105	V75-E79 VanDerWaalsContact CA-O 3.31Å; V75-E79 WeakPolarHBondContact CA-O 3.06Å; V75-R80 HydrophobicContact CG2-CB 3.96Å; V75-R80 HydrophobicContact CG2-CG 3.95Å; V75-V104 WeakPolarHBondContact O-CA 3.4Å; V75-R105 HydrophobicContact CB-CG 3.64Å; V75-R105 HydrophobicContact CG2-CG 4.17Å; V75-R105 VanDerWaalsContact CG2-NH1 3.3Å; V75-R105 PolarHBondContact N-O 2.73Å; V75-R105 PolarHBondContact O-N 3.43Å
76	V	92.6	Very high	93.1	Very high	42 Å²	42	48.4 Å²	48.4	26%	0.255	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	119.8	-178.8	176.8	0	0	0	0	106.6	H78 E79 V104	V76-H78 VanDerWaalsContact C-N 3.28Å; V76-H78 PolarHBondContact O-N 3.02Å; V76-E79 PolarHBondContact N-O 3.2Å; V76-E79 WeakPolarHBondContact O-CB 3.45Å; V76-E79 PolarHBondContact O-N 2.95Å; V76-V104 HydrophobicContact CG1-CG2 4.18Å; V76-V104 HydrophobicContact CG2-CG1 4.37Å; V76-V104 HydrophobicContact CG2-CG2 4.33Å
77	E	90.6	Very high	93.3	Very high	137 Å²	137	45 Å²	45	64%	0.64	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	48.5	178.9	-60.8	-176.9	174	0	0	112.5	E79	E77-E79 PolarHBondContact O-N 3.28Å; E77-E79 VanDerWaalsContact O-N 3.14Å
78	H	86.6	Confident	93.3	Very high	159 Å²	159	45.8 Å²	45.8	74%	0.736	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.2	-6.5	-174.6	-47.3	83.2	0	0	0	116.9	V76 D103	V76-H78 VanDerWaalsContact C-N 3.28Å; V76-H78 PolarHBondContact O-N 3.02Å; H78-D103 IonicContact CD2-OD2 2.64Å; H78-D103 IonicContact CG-OD2 3.38Å; H78-D103 PolarHBondContact N-OD2 2.01Å
79	E	90.8	Very high	93.1	Very high	110 Å²	110	48.4 Å²	48.4	51%	0.514	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	118.1	173.4	-67.4	-169.5	179	0	0	111.2	V75 V76 E77 R81	V75-E79 VanDerWaalsContact CA-O 3.31Å; V75-E79 WeakPolarHBondContact CA-O 3.06Å; V76-E79 PolarHBondContact N-O 3.2Å; V76-E79 WeakPolarHBondContact O-CB 3.45Å; V76-E79 PolarHBondContact O-N 2.95Å; E77-E79 PolarHBondContact O-N 3.28Å; E77-E79 VanDerWaalsContact O-N 3.14Å; E79-R81 IonicContact OE2-CZ 3.63Å; E79-R81 IonicContact OE2-NH1 3.47Å; E79-R81 IonicContact OE2-NH2 3.86Å; E79-R81 PolarHBondContact OE2-NH2 3.47Å
80	R	90.3	Very high	92.8	Very high	110 Å²	110	51.2 Å²	51.2	42%	0.415	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	136.1	175.1	-177.7	171.4	178.7	-90.9	6.3	111.3	E44 D73 Q74 V75 V82	E44-R80 IonicContact OE1-NH1 3.01Å; E44-R80 PolarHBondContact OE1-NH1 2.88Å; D73-R80 IonicContact OD1-CZ 3.62Å; D73-R80 IonicContact OD1-NE 2.89Å; D73-R80 PolarHBondContact OD1-NE 3.01Å; D73-R80 IonicContact OD1-NH2 3.7Å; D73-R80 IonicContact OD2-CZ 3.32Å; D73-R80 VanDerWaalsContact OD2-CZ 3.32Å; D73-R80 IonicContact OD2-NE 3.13Å; D73-R80 PolarHBondContact OD2-NE 3.37Å; D73-R80 VanDerWaalsContact OD2-NE 3.13Å; D73-R80 IonicContact OD2-NH2 2.67Å; D73-R80 PolarHBondContact OD2-NH2 3.19Å; Q74-R80 CarbonylContact O-C 3.49Å; Q74-R80 WeakPolarHBondContact O-CA 3.43Å; V75-R80 HydrophobicContact CG2-CB 3.96Å; V75-R80 HydrophobicContact CG2-CG 3.95Å; R80-V82 VanDerWaalsContact NH1-CG2 3.27Å; R80-V82 VanDerWaalsContact NH2-CG2 3.3Å
81	R	92.3	Very high	92.2	Very high	57 Å²	57	55.6 Å²	55.6	22%	0.215	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.3	170.1	-53.4	175.3	176.8	98.6	0.1	110.1	S36 Q74 E79	S36-R81 WeakPolarHBondContact OG-CA 3.18Å; Q74-R81 HydrophobicContact CG-CB 3.64Å; Q74-R81 VanDerWaalsContact CG-O 3.26Å; Q74-R81 WeakPolarHBondContact CG-O 2.94Å; Q74-R81 PolarHBondContact N-O 3.15Å; Q74-R81 PolarHBondContact O-N 3.3Å; E79-R81 IonicContact OE2-CZ 3.63Å; E79-R81 IonicContact OE2-NH1 3.47Å; E79-R81 IonicContact OE2-NH2 3.86Å; E79-R81 PolarHBondContact OE2-NH2 3.47Å
82	V	92.2	Very high	91.6	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.8	177.5	-178.6	0	0	0	0	109.4	S36 K71 I72 R80 R84	S36-V82 PolarHBondContact N-O 3.38Å; S36-V82 PolarHBondContact OG-N 3.4Å; K71-V82 HydrophobicContact CG-CG1 4.38Å; I72-V82 CarbonylContact O-C 3.57Å; I72-V82 VanDerWaalsContact O-CA 3.32Å; I72-V82 WeakPolarHBondContact O-CA 3Å; R80-V82 VanDerWaalsContact NH1-CG2 3.27Å; R80-V82 VanDerWaalsContact NH2-CG2 3.3Å; V82-R84 HydrophobicContact CG1-CG 4.26Å
83	V	94.2	Very high	91.3	Very high	26 Å²	26	60.9 Å²	60.9	16%	0.158	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125	174.4	-176	0	0	0	0	109	C34 K71 I72	C34-V83 CarbonylContact O-C 3.52Å; C34-V83 WeakPolarHBondContact O-CA 3.32Å; K71-V83 CarbonylContact C-O 3.41Å; I72-V83 HydrophobicContact CB-CB 4.26Å; I72-V83 PolarHBondContact N-O 3.35Å; I72-V83 PolarHBondContact O-N 3.19Å
84	R	94	Very high	91.2	Very high	6 Å²	6	60.7 Å²	60.7	2%	0.023	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	137.5	174.5	-61.3	-175.9	-176.1	83.4	-10.8	109.1	V32 V33 C34 C43 R70 K71 V82 N117	V32-R84 HydrophobicContact CB-CB 4.4Å; V32-R84 HydrophobicContact CG1-CB 4.38Å; V32-R84 CarbonylContact O-C 3.52Å; V32-R84 WeakPolarHBondContact O-CB 3.21Å; V33-R84 VanDerWaalsContact CA-O 3.32Å; V33-R84 WeakPolarHBondContact CA-O 3.33Å; C34-R84 PolarHBondContact N-O 2.82Å; C34-R84 PolarHBondContact O-N 3.06Å; C34-R84 PolarHBondContact SG-NH1 3.09Å; C43-R84 PolarHBondContact O-NH1 3.19Å; C43-R84 PolarHBondContact O-NH2 3Å; C43-R84 PolarHBondContact SG-NH1 2.83Å; R70-R84 WeakPolarHBondContact O-CA 3.29Å; K71-R84 HydrophobicContact CB-CG 4.49Å; K71-R84 HydrophobicContact CG-CG 4.25Å; V82-R84 HydrophobicContact CG1-CG 4.26Å; R84-N117 WeakPolarHBondContact CD-O 3.32Å; R84-N117 PolarHBondContact NE-O 2.88Å
85	Q	95.1	Very high	91.3	Very high	46 Å²	46	62.3 Å²	62.3	22%	0.215	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	161.4	-174.7	56.4	-172.4	-54	0	0	111.4	V32 R70	V32-Q85 PolarHBondContact O-N 3.31Å; R70-Q85 HydrophobicContact CB-CG 4.11Å; R70-Q85 HydrophobicContact CG-CG 4.4Å; R70-Q85 PolarHBondContact N-O 2.93Å; R70-Q85 VanDerWaalsContact NE-CD 3.35Å; R70-Q85 VanDerWaalsContact NE-NE2 3.11Å; R70-Q85 VanDerWaalsContact NH2-NE2 3.17Å; R70-Q85 PolarHBondContact O-N 2.95Å
86	C	96.2	Very high	91.3	Very high	3 Å²	3	64.8 Å²	64.8	2%	0.02	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	157.3	164.7	-54	0	0	0	0	110.8	C55 Y58 I61	C55-C86 WeakPolarHBondContact CA-SG 3.32Å; C55-C86 HydrophobicContact CB-CB 3.65Å; C55-C86 WeakPolarHBondContact CB-SG 3.11Å; C55-C86 WeakPolarHBondContact SG-CB 3.35Å; C55-C86 CovalentContact SG-SG 2.03Å; C55-C86 PolarHBondContact SG-SG 2.89Å; Y58-C86 HydrophobicContact CD1-CB 3.97Å; Y58-C86 HydrophobicContact CG-CB 4.28Å; I61-C86 VanDerWaalsContact CD1-C 3.5Å; I61-C86 HydrophobicContact CD1-CB 3.62Å; I61-C86 HydrophobicContact CG1-CB 3.6Å
87	S	96	Very high	91.3	Very high	4 Å²	4	67 Å²	67	3%	0.028	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	147.2	-178.4	167.6	0	0	0	0	111.2	I67 S68 V89 H110	I67-S87 CarbonylContact C-O 3.59Å; I67-S87 WeakPolarHBondContact CA-O 3.17Å; S68-S87 PolarHBondContact N-O 2.7Å; S68-S87 PolarHBondContact O-N 3.49Å; S68-S87 PolarHBondContact OG-O 3.33Å; S87-V89 WeakPolarHBondContact OG-CB 3.1Å; S87-V89 PolarHBondContact OG-N 3.34Å; S87-H110 PolarHBondContact OG-CE1 3.15Å
88	N	95.2	Very high	91.5	Very high	43 Å²	43	66.9 Å²	66.9	23%	0.23	34%	0.34	C	S	.	.	S	Bend	trans	-93.8	3.8	167.3	-70	115.7	0	0	0	113.5	D62 K65 P66	D62-N88 PolarHBondContact N-OD1 3.14Å; D62-N88 PolarHBondContact O-ND2 2.9Å; K65-N88 HydrophobicContact CB-CB 4.44Å; P66-N88 WeakPolarHBondContact O-CA 3.1Å; P66-N88 PolarHBondContact O-ND2 2.66Å
89	V	91.2	Very high	91.8	Very high	55 Å²	55	65.4 Å²	65.4	33%	0.333	34%	0.341	S	S	.	.			trans	-80.4	119.5	176.9	179.9	0	0	0	0	109.9	S68 S87	S68-V89 PolarHBondContact OG-O 3Å; S87-V89 WeakPolarHBondContact OG-CB 3.1Å; S87-V89 PolarHBondContact OG-N 3.34Å
90	I	87.4	Confident	91.8	Very high	60 Å²	60	62.2 Å²	62.2	31%	0.308	34%	0.338	S	S	.	.			trans	-121	-17.1	175.8	54.2	155.2	0	0	0	113.9	P66 N92 L93	P66-I90 HydrophobicContact CB-CB 4.47Å; P66-I90 HydrophobicContact CB-CD1 3.69Å; P66-I90 HydrophobicContact CB-CG1 4.15Å; P66-I90 HydrophobicContact CB-CG2 3.63Å; P66-I90 HydrophobicContact CG-CD1 3.71Å; I90-N92 PolarHBondContact O-N 3.05Å; I90-L93 WeakPolarHBondContact O-CG 3.23Å
91	D	83.5	Confident	91.8	Very high	148 Å²	148	62.4 Å²	62.4	79%	0.791	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-12	-172.7	-54.9	-32	0	0	0	114
92	N	81.8	Confident	91.5	Very high	76 Å²	76	65.8 Å²	65.8	41%	0.406	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	52.2	-176.5	-68.4	-56.3	0	0	0	111.4	I90 I96	I90-N92 PolarHBondContact O-N 3.05Å; N92-I96 HydrophobicContact CB-CD1 3.61Å; N92-I96 WeakPolarHBondContact OD1-CD1 3.38Å
93	L	87.8	Confident	91.2	Very high	103 Å²	103	68.9 Å²	68.9	54%	0.539	39%	0.391	S	S	.	.			trans	-59.4	140.3	172.1	-60.8	-176.5	0	0	0	110.5	I90 H110 T112	I90-L93 WeakPolarHBondContact O-CG 3.23Å; L93-H110 HydrophobicContact CD2-CB 4.42Å; L93-T112 HydrophobicContact CD1-CG2 4.39Å; L93-T112 HydrophobicContact CD2-CG2 3.8Å
94	G	91.3	Very high	91.2	Very high	37 Å²	37	69.6 Å²	69.6	38%	0.381	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	98.4	-158.9	-169.2	0	0	0	0	0	111.9	C109 H110	G94-C109 CarbonylContact O-C 3.56Å; G94-C109 VanDerWaalsContact O-CA 3.23Å; G94-C109 WeakPolarHBondContact O-CA 3.43Å; G94-H110 PolarHBondContact N-O 3.22Å; G94-H110 PolarHBondContact O-N 3.23Å
95	C	94	Very high	91.2	Very high	79 Å²	79	74.9 Å²	74.9	53%	0.534	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.3	-175.6	-61.3	0	0	0	0	111.8	R107 Y108 C109	C95-R107 HydrophobicContact CB-CG 4.22Å; C95-Y108 CarbonylContact C-O 3.58Å; C95-Y108 VanDerWaalsContact CA-O 3.23Å; C95-Y108 WeakPolarHBondContact CA-O 3.23Å; C95-C109 HydrophobicContact CB-CB 4.18Å; C95-C109 WeakPolarHBondContact CB-SG 3.43Å; C95-C109 WeakPolarHBondContact SG-CB 3.05Å; C95-C109 CovalentContact SG-SG 2.05Å; C95-C109 PolarHBondContact SG-SG 2.7Å
96	I	94.1	Very high	91.3	Very high	59 Å²	59	74.3 Å²	74.3	30%	0.303	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.6	174.5	-60.4	178.1	0	0	0	109	N92 R107 Y108	N92-I96 HydrophobicContact CB-CD1 3.61Å; N92-I96 WeakPolarHBondContact OD1-CD1 3.38Å; I96-R107 WeakPolarHBondContact O-CA 3.07Å; I96-Y108 PolarHBondContact N-O 2.74Å; I96-Y108 PolarHBondContact O-N 2.86Å
97	D	93.8	Very high	91.2	Very high	87 Å²	87	80 Å²	80	47%	0.465	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	135.5	174.7	-67.1	-36.5	0	0	0	111.1	I106 R107	D97-I106 CarbonylContact C-O 3.57Å; D97-R107 WeakPolarHBondContact OD1-CA 3.48Å; D97-R107 WeakPolarHBondContact OD1-CB 3.32Å; D97-R107 WeakPolarHBondContact OD1-CG 3.02Å; D97-R107 IonicContact OD1-CZ 3.53Å; D97-R107 IonicContact OD1-NE 2.7Å; D97-R107 PolarHBondContact OD1-NE 2.89Å; D97-R107 IonicContact OD1-NH2 3.51Å; D97-R107 IonicContact OD2-CZ 3.5Å; D97-R107 IonicContact OD2-NE 3.42Å; D97-R107 PolarHBondContact OD2-NE 2.67Å; D97-R107 IonicContact OD2-NH2 2.74Å; D97-R107 PolarHBondContact OD2-NH2 2.05Å
98	R	94.2	Very high	91.1	Very high	136 Å²	136	82.6 Å²	82.6	51%	0.513	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	124.3	169.9	-65.3	-164.6	169.7	88.4	3.3	108.9	R105 I106 Y108	R98-R105 WeakPolarHBondContact O-CA 3.38Å; R98-I106 PolarHBondContact N-O 2.96Å; R98-I106 PolarHBondContact O-N 3.06Å; R98-Y108 HydrophobicContact CB-CE2 4.32Å; R98-Y108 HydrophobicContact CG-CD2 4.37Å; R98-Y108 HydrophobicContact CG-CE2 4.08Å; R98-Y108 VanDerWaalsContact NH1-CD2 3.34Å
99	V	93.5	Very high	91.1	Very high	127 Å²	127	81.8 Å²	81.8	77%	0.77	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.9	177.9	-176.2	0	0	0	0	108
100	G	90.5	Very high	91.3	Very high	44 Å²	44	79.9 Å²	79.9	45%	0.454	43%	0.429	S	S	.	.			trans	-102.9	-166.4	175.5	0	0	0	0	0	112.2	V104	G100-V104 PolarHBondContact N-O 3.01Å
101	T	89.5	Confident	91.6	Very high	113 Å²	113	78.6 Å²	78.6	69%	0.693	42%	0.424	S	S	*	.	S	Bend	trans	-78.8	163.9	170.1	50.3	0	0	0	0	110.9	D103 V104	T101-D103 PolarHBondContact O-N 2.87Å; T101-V104 WeakPolarHBondContact O-CB 3.43Å; T101-V104 VanDerWaalsContact O-CG2 3.28Å; T101-V104 WeakPolarHBondContact O-CG2 3.39Å; T101-V104 PolarHBondContact O-N 2.02Å
102	N	86.1	Confident	92	Very high	128 Å²	128	75.2 Å²	75.2	68%	0.684	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	49.2	171.6	-57.8	-14.4	0	0	0	115.2	V104	N102-V104 PolarHBondContact O-N 2.79Å
103	D	86	Confident	92.3	Very high	66 Å²	66	77.8 Å²	77.8	35%	0.353	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	34.8	179.7	-170.9	40.5	0	0	0	113.8	H78 T101 R105	H78-D103 IonicContact CD2-OD2 2.64Å; H78-D103 IonicContact CG-OD2 3.38Å; H78-D103 PolarHBondContact N-OD2 2.01Å; T101-D103 PolarHBondContact O-N 2.87Å; D103-R105 IonicContact OD1-NE 3.94Å; D103-R105 IonicContact OD1-NH2 3.94Å; D103-R105 IonicContact OD2-NH2 3.82Å
104	V	93.7	Very high	92.4	Very high	41 Å²	41	76.2 Å²	76.2	25%	0.248	41%	0.411	C	S	.	.			trans	-89.5	117.5	168.8	178	0	0	0	0	109.1	V75 V76 G100 T101 N102 I106	V75-V104 WeakPolarHBondContact O-CA 3.4Å; V76-V104 HydrophobicContact CG1-CG2 4.18Å; V76-V104 HydrophobicContact CG2-CG1 4.37Å; V76-V104 HydrophobicContact CG2-CG2 4.33Å; G100-V104 PolarHBondContact N-O 3.01Å; T101-V104 WeakPolarHBondContact O-CB 3.43Å; T101-V104 VanDerWaalsContact O-CG2 3.28Å; T101-V104 WeakPolarHBondContact O-CG2 3.39Å; T101-V104 PolarHBondContact O-N 2.02Å; N102-V104 PolarHBondContact O-N 2.79Å; V104-I106 HydrophobicContact CG1-CD1 4.38Å; V104-I106 HydrophobicContact CG1-CG1 4.28Å
105	R	95.2	Very high	92.4	Very high	118 Å²	118	76.8 Å²	76.8	45%	0.445	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	133	172.6	56	-175.5	133.9	111	1.2	110.1	Q74 V75 R98 D103	Q74-R105 CarbonylContact C-O 3.59Å; Q74-R105 WeakPolarHBondContact CA-O 3.48Å; V75-R105 HydrophobicContact CB-CG 3.64Å; V75-R105 HydrophobicContact CG2-CG 4.17Å; V75-R105 VanDerWaalsContact CG2-NH1 3.3Å; V75-R105 PolarHBondContact N-O 2.73Å; V75-R105 PolarHBondContact O-N 3.43Å; R98-R105 WeakPolarHBondContact O-CA 3.38Å; D103-R105 IonicContact OD1-NE 3.94Å; D103-R105 IonicContact OD1-NH2 3.94Å; D103-R105 IonicContact OD2-NH2 3.82Å
106	I	95.7	Very high	92.2	Very high	33 Å²	33	74.2 Å²	74.2	17%	0.169	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	120.1	-179.3	-48.7	176.5	0	0	0	109.4	I72 D73 Q74 D97 R98 V104 Y108	I72-I106 HydrophobicContact CG2-CG2 3.51Å; D73-I106 CarbonylContact O-C 3.56Å; D73-I106 WeakPolarHBondContact O-CA 3.34Å; Q74-I106 HydrophobicContact CB-CG1 4.13Å; Q74-I106 HydrophobicContact CB-CG2 4.24Å; D97-I106 CarbonylContact C-O 3.57Å; R98-I106 PolarHBondContact N-O 2.96Å; R98-I106 PolarHBondContact O-N 3.06Å; V104-I106 HydrophobicContact CG1-CD1 4.38Å; V104-I106 HydrophobicContact CG1-CG1 4.28Å; I106-Y108 HydrophobicContact CB-CE2 3.82Å; I106-Y108 HydrophobicContact CG2-CD2 3.99Å; I106-Y108 HydrophobicContact CG2-CE1 3.99Å; I106-Y108 HydrophobicContact CG2-CE2 3.38Å
107	R	94.7	Very high	92.1	Very high	124 Å²	124	71.6 Å²	71.6	47%	0.468	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117	173	178.4	168.6	-76.2	-179.4	-4	109.7	I72 D73 C95 I96 D97	I72-R107 WeakPolarHBondContact CA-O 3.45Å; D73-R107 HydrophobicContact CB-CB 4.24Å; D73-R107 PolarHBondContact N-O 3.13Å; D73-R107 PolarHBondContact O-N 2.8Å; C95-R107 HydrophobicContact CB-CG 4.22Å; I96-R107 WeakPolarHBondContact O-CA 3.07Å; D97-R107 WeakPolarHBondContact OD1-CA 3.48Å; D97-R107 WeakPolarHBondContact OD1-CB 3.32Å; D97-R107 WeakPolarHBondContact OD1-CG 3.02Å; D97-R107 IonicContact OD1-CZ 3.53Å; D97-R107 IonicContact OD1-NE 2.7Å; D97-R107 PolarHBondContact OD1-NE 2.89Å; D97-R107 IonicContact OD1-NH2 3.51Å; D97-R107 IonicContact OD2-CZ 3.5Å; D97-R107 IonicContact OD2-NE 3.42Å; D97-R107 PolarHBondContact OD2-NE 2.67Å; D97-R107 IonicContact OD2-NH2 2.74Å; D97-R107 PolarHBondContact OD2-NH2 2.05Å
108	Y	94.6	Very high	91.6	Very high	58 Å²	58	68 Å²	68	23%	0.227	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	117.1	174.8	-60.7	-90.5	0	0	0	109.2	I72 C95 I96 R98 I106	I72-Y108 HydrophobicContact CD1-CD1 4.09Å; I72-Y108 HydrophobicContact CD1-CE1 3.97Å; I72-Y108 HydrophobicContact CG1-CD1 3.92Å; I72-Y108 HydrophobicContact CG1-CE1 4.22Å; I72-Y108 HydrophobicContact CG2-CD1 4.3Å; I72-Y108 HydrophobicContact CG2-CE1 4.13Å; C95-Y108 CarbonylContact C-O 3.58Å; C95-Y108 VanDerWaalsContact CA-O 3.23Å; C95-Y108 WeakPolarHBondContact CA-O 3.23Å; I96-Y108 PolarHBondContact N-O 2.74Å; I96-Y108 PolarHBondContact O-N 2.86Å; R98-Y108 HydrophobicContact CB-CE2 4.32Å; R98-Y108 HydrophobicContact CG-CD2 4.37Å; R98-Y108 HydrophobicContact CG-CE2 4.08Å; R98-Y108 VanDerWaalsContact NH1-CD2 3.34Å; I106-Y108 HydrophobicContact CB-CE2 3.82Å; I106-Y108 HydrophobicContact CG2-CD2 3.99Å; I106-Y108 HydrophobicContact CG2-CE1 3.99Å; I106-Y108 HydrophobicContact CG2-CE2 3.38Å
109	C	94.6	Very high	90.7	Very high	26 Å²	26	65.5 Å²	65.5	18%	0.176	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.2	174.4	-60.2	0	0	0	0	110.8	R70 K71 G94 C95	R70-C109 CarbonylContact C-O 3.56Å; R70-C109 VanDerWaalsContact CA-O 3.3Å; R70-C109 WeakPolarHBondContact CA-O 3.47Å; K71-C109 HydrophobicContact CB-CB 4.39Å; K71-C109 PolarHBondContact N-O 3.42Å; K71-C109 PolarHBondContact O-N 3.32Å; G94-C109 CarbonylContact O-C 3.56Å; G94-C109 VanDerWaalsContact O-CA 3.23Å; G94-C109 WeakPolarHBondContact O-CA 3.43Å; C95-C109 HydrophobicContact CB-CB 4.18Å; C95-C109 WeakPolarHBondContact CB-SG 3.43Å; C95-C109 WeakPolarHBondContact SG-CB 3.05Å; C95-C109 CovalentContact SG-SG 2.05Å; C95-C109 PolarHBondContact SG-SG 2.7Å
110	H	95.3	Very high	89.3	Confident	15 Å²	15	64 Å²	64	7%	0.069	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	139.4	176.3	-69.4	-93.4	0	0	0	111.1	C69 R70 S87 L93 G94	C69-H110 WeakPolarHBondContact O-CA 3.28Å; R70-H110 VanDerWaalsContact CD-CE1 3.48Å; R70-H110 WeakPolarHBondContact CD-CE1 3.11Å; S87-H110 PolarHBondContact OG-CE1 3.15Å; L93-H110 HydrophobicContact CD2-CB 4.42Å; G94-H110 PolarHBondContact N-O 3.22Å; G94-H110 PolarHBondContact O-N 3.23Å
111	C	93.4	Very high	87.7	Confident	33 Å²	33	65 Å²	65	22%	0.223	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	161	179.2	55.6	0	0	0	0	110.5	S68 C69 C116	S68-C111 CarbonylContact C-O 3.56Å; S68-C111 WeakPolarHBondContact CA-O 3.26Å; S68-C111 VanDerWaalsContact CB-O 3.32Å; S68-C111 WeakPolarHBondContact CB-O 3.44Å; C69-C111 PolarHBondContact N-O 3.1Å; C69-C111 PolarHBondContact O-N 3.31Å; C111-C116 HydrophobicContact CB-CB 3.74Å; C111-C116 WeakPolarHBondContact CB-SG 3.39Å; C111-C116 WeakPolarHBondContact SG-CB 3.4Å; C111-C116 CovalentContact SG-SG 2.01Å; C111-C116 PolarHBondContact SG-SG 3.22Å
112	T	92.1	Very high	86.1	Confident	77 Å²	77	65.2 Å²	65.2	47%	0.472	35%	0.348	S	S	.	.			trans	-119.3	2.4	-168.8	51.7	0	0	0	0	114.2	I29 L93	I29-T112 VanDerWaalsContact CD1-C 3.44Å; I29-T112 WeakPolarHBondContact CD1-O 3.18Å; L93-T112 HydrophobicContact CD1-CG2 4.39Å; L93-T112 HydrophobicContact CD2-CG2 3.8Å
113	E	89.2	Confident	84.6	Confident	130 Å²	130	66 Å²	66	61%	0.607	35%	0.345	S	S	*	.	S	Bend	trans	-89.9	156.5	176.3	-66.8	172.2	-166	0	0	110.7	L115 C116	E113-L115 PolarHBondContact O-N 2.81Å; E113-C116 HydrophobicContact CB-CB 3.91Å; E113-C116 VanDerWaalsContact O-CB 3.26Å; E113-C116 WeakPolarHBondContact O-CB 3.39Å; E113-C116 PolarHBondContact O-N 3Å; E113-C116 PolarHBondContact O-SG 3.49Å
114	D	90	Very high	83.2	Confident	70 Å²	70	65.8 Å²	65.8	37%	0.374	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	131.8	173.9	-85.2	-11.6	0	0	0	111.1	I29 Q30 C116	I29-D114 WeakPolarHBondContact CA-OD1 3.42Å; Q30-D114 HydrophobicContact CB-CB 4.47Å; Q30-D114 PolarHBondContact N-OD1 3.33Å; Q30-D114 WeakPolarHBondContact O-CA 3.36Å; D114-C116 PolarHBondContact O-N 2.03Å
115	L	89.3	Confident	81.7	Confident	48 Å²	48	69.3 Å²	69.3	25%	0.251	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	19.3	175.5	-50.4	177.7	0	0	0	113.6	Q30 V32 W46 I52 E113 N117 S118	Q30-L115 HydrophobicContact CB-CD2 4.12Å; Q30-L115 PolarHBondContact O-N 3.35Å; V32-L115 HydrophobicContact CG2-CD2 4.33Å; W46-L115 HydrophobicContact CH2-CD1 4.4Å; I52-L115 HydrophobicContact CB-CD2 4.38Å; I52-L115 HydrophobicContact CD1-CD1 3.91Å; I52-L115 HydrophobicContact CD1-CD2 3.96Å; I52-L115 HydrophobicContact CG1-CD2 3.78Å; I52-L115 HydrophobicContact CG2-CD2 3.93Å; E113-L115 PolarHBondContact O-N 2.81Å; L115-N117 PolarHBondContact O-N 2.73Å; L115-S118 WeakPolarHBondContact O-CB 3.26Å; L115-S118 PolarHBondContact O-N 3.02Å; L115-S118 PolarHBondContact O-OG 2.81Å
116	C	90.5	Very high	80.2	Confident	26 Å²	26	67.1 Å²	67.1	18%	0.176	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-21.3	-176.1	67.3	0	0	0	0	113.3	C111 E113 D114 S118	C111-C116 HydrophobicContact CB-CB 3.74Å; C111-C116 WeakPolarHBondContact CB-SG 3.39Å; C111-C116 WeakPolarHBondContact SG-CB 3.4Å; C111-C116 CovalentContact SG-SG 2.01Å; C111-C116 PolarHBondContact SG-SG 3.22Å; E113-C116 HydrophobicContact CB-CB 3.91Å; E113-C116 VanDerWaalsContact O-CB 3.26Å; E113-C116 WeakPolarHBondContact O-CB 3.39Å; E113-C116 PolarHBondContact O-N 3Å; E113-C116 PolarHBondContact O-SG 3.49Å; D114-C116 PolarHBondContact O-N 2.03Å; C116-S118 PolarHBondContact O-N 2.05Å
117	N	91.9	Very high	78.8	Confident	4 Å²	4	72.5 Å²	72.5	2%	0.021	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	7.4	174.8	72.6	-22.8	0	0	0	113.6	V32 C69 R70 K71 R84 L115	V32-N117 PolarHBondContact N-OD1 3.4Å; V32-N117 PolarHBondContact O-ND2 3.49Å; C69-N117 HydrophobicContact CB-CB 3.61Å; R70-N117 PolarHBondContact O-ND2 2.97Å; K71-N117 HydrophobicContact CB-CB 4.17Å; R84-N117 WeakPolarHBondContact CD-O 3.32Å; R84-N117 PolarHBondContact NE-O 2.88Å; L115-N117 PolarHBondContact O-N 2.73Å
118	S	84.2	Confident	77.6	Confident	10 Å²	10	70.9 Å²	70.9	7%	0.07	38%	0.381	C	S	.	.	S	Bend	trans	-70.9	-173.1	174.2	69.6	0	0	0	0	112.4	L115 C116 T120	L115-S118 WeakPolarHBondContact O-CB 3.26Å; L115-S118 PolarHBondContact O-N 3.02Å; L115-S118 PolarHBondContact O-OG 2.81Å; C116-S118 PolarHBondContact O-N 2.05Å; S118-T120 PolarHBondContact OG-O 3.45Å; S118-T120 VanDerWaalsContact OG-O 3.1Å
119	I	74.6	Confident	76.6	Confident	84 Å²	84	76.2 Å²	76.2	43%	0.431	40%	0.402	S	S	.	.	S	Bend	trans	-78.6	-46.5	178.1	-60.1	159.3	0	0	0	110	E44 W46	E44-I119 WeakPolarHBondContact O-CD1 3.44Å; W46-I119 HydrophobicContact CB-CD1 4.29Å
120	T	65	Low	75.6	Confident	95 Å²	95	80.6 Å²	80.6	58%	0.583	42%	0.423	S	S	*	.	S	Bend	trans	-98.1	95.3	-179.8	-48.2	0	0	0	0	106.8	S118 V122	S118-T120 PolarHBondContact OG-O 3.45Å; S118-T120 VanDerWaalsContact OG-O 3.1Å; T120-V122 HydrophobicContact CG2-CG2 4.24Å; T120-V122 WeakPolarHBondContact O-CG2 3.37Å; T120-V122 PolarHBondContact O-N 3.03Å
121	A	55.6	Low	74.5	Confident	65 Å²	65	84.6 Å²	84.6	54%	0.537	44%	0.44	S	S	.	.			trans	-62.2	94.3	160.9	0	0	0	0	0	106.2	K123	A121-K123 PolarHBondContact O-N 2.8Å
122	V	55.5	Low	73.5	Confident	119 Å²	119	85.2 Å²	85.2	72%	0.721	45%	0.445	S	S	*	.			trans	-69.5	84.8	176.2	-157.7	0	0	0	0	104.8	T120 P124	T120-V122 HydrophobicContact CG2-CG2 4.24Å; T120-V122 WeakPolarHBondContact O-CG2 3.37Å; T120-V122 PolarHBondContact O-N 3.03Å; V122-P124 WeakPolarHBondContact O-CD 3.3Å; V122-P124 VanDerWaalsContact O-N 3.16Å
123	K	55.9	Low	72.9	Confident	145 Å²	145	86.8 Å²	86.8	63%	0.63	45%	0.45	S	S	*	.			trans	-67.7	111.8	173.5	-70.9	-162.9	178.2	-168.7	0	106.4	A121 Q125	A121-K123 PolarHBondContact O-N 2.8Å; K123-Q125 PolarHBondContact O-N 2.78Å
124	P	57.2	Low	72.3	Confident	60 Å²	60	82.8 Å²	82.8	39%	0.39	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	8.6	179.7	30.4	-28.9	0	0	0	112.5	V122 S126 F127 Y128	V122-P124 WeakPolarHBondContact O-CD 3.3Å; V122-P124 VanDerWaalsContact O-N 3.16Å; P124-S126 VanDerWaalsContact C-N 3.29Å; P124-S126 PolarHBondContact O-N 3.49Å; P124-S126 VanDerWaalsContact O-N 3.14Å; P124-F127 PolarHBondContact O-N 2.82Å; P124-Y128 HydrophobicContact CB-CE2 3.87Å; P124-Y128 HydrophobicContact CG-CE2 4.08Å; P124-Y128 WeakPolarHBondContact O-CD2 3.33Å; P124-Y128 WeakPolarHBondContact O-CE2 3.48Å
125	Q	61.6	Low	71.6	Confident	115 Å²	115	80.7 Å²	80.7	54%	0.537	43%	0.428	S	S	.	.	H	α-helix	trans	-57.1	-33.2	-170.6	-78.3	179.6	-22.2	0	0	114.4	K123 Y129	K123-Q125 PolarHBondContact O-N 2.78Å; Q125-Y129 WeakPolarHBondContact O-CD2 3.31Å
126	S	63.4	Low	71.1	Confident	72 Å²	72	83.2 Å²	83.2	50%	0.503	44%	0.442	S	S	.	.	H	α-helix	trans	-71.7	-32.7	-174	40.5	0	0	0	0	114.2	P124	P124-S126 VanDerWaalsContact C-N 3.29Å; P124-S126 PolarHBondContact O-N 3.49Å; P124-S126 VanDerWaalsContact O-N 3.14Å
127	F	66.6	Low	70.6	Confident	147 Å²	147	85.1 Å²	85.1	65%	0.645	45%	0.452	S	S	*	.	H	α-helix	trans	-72.7	-31.9	-176.3	-69.4	-76.5	0	0	0	112.9	P124 L130 F131	P124-F127 PolarHBondContact O-N 2.82Å; F127-L130 PolarHBondContact O-N 3.4Å; F127-F131 PolarHBondContact O-N 3.24Å
128	Y	69	Low	69.9	Low	90 Å²	90	92.1 Å²	92.1	35%	0.353	48%	0.483	S	S	.	.	H	α-helix	trans	-67.3	-39.8	179.8	-62.3	-71.3	0	0	0	113.3	L21 P124 S132	L21-Y128 HydrophobicContact CB-CE1 3.86Å; L21-Y128 HydrophobicContact CD1-CE1 4.28Å; L21-Y128 PolarHBondContact O-OH 3.36Å; P124-Y128 HydrophobicContact CB-CE2 3.87Å; P124-Y128 HydrophobicContact CG-CE2 4.08Å; P124-Y128 WeakPolarHBondContact O-CD2 3.33Å; P124-Y128 WeakPolarHBondContact O-CE2 3.48Å; Y128-S132 WeakPolarHBondContact O-CB 3.4Å; Y128-S132 PolarHBondContact O-N 2.89Å; Y128-S132 VanDerWaalsContact O-N 3.1Å; Y128-S132 PolarHBondContact O-OG 2.79Å
129	Y	74.2	Confident	69.6	Low	170 Å²	170	94.7 Å²	94.7	67%	0.667	50%	0.501	S	S	*	.	H	α-helix	trans	-67.6	-38.1	179	-70.6	-68.2	0	0	0	112	Q125 S132 L133	Q125-Y129 WeakPolarHBondContact O-CD2 3.31Å; Y129-S132 PolarHBondContact O-OG 2.92Å; Y129-S132 VanDerWaalsContact O-OG 3.12Å; Y129-L133 VanDerWaalsContact O-CB 3.29Å; Y129-L133 WeakPolarHBondContact O-CB 3.1Å; Y129-L133 PolarHBondContact O-N 2.75Å
130	L	73.9	Confident	69.8	Low	117 Å²	117	97.1 Å²	97.1	61%	0.613	51%	0.509	S	S	*	.	H	α-helix	trans	-68.2	-42.8	179.7	-67.6	174.1	0	0	0	112	F127 S134	F127-L130 PolarHBondContact O-N 3.4Å; L130-S134 WeakPolarHBondContact O-CB 3.48Å; L130-S134 PolarHBondContact O-N 2.81Å; L130-S134 VanDerWaalsContact O-N 3.08Å; L130-S134 PolarHBondContact O-OG 2.88Å
131	F	71	Confident	70.5	Confident	100 Å²	100	97.1 Å²	97.1	44%	0.439	50%	0.504	S	S	.	.	H	α-helix	trans	-66.6	-46	177.7	-98.7	-82.1	0	0	0	112.3	F17 F127 L133 S134 A135	F17-F131 HydrophobicContact CD1-CD1 4.26Å; F17-F131 HydrophobicContact CD1-CE1 4.21Å; F17-F131 AromaticContact CE1-CD1 3.92Å; F17-F131 HydrophobicContact CE1-CD1 3.92Å; F17-F131 HydrophobicContact CE1-CD2 4.38Å; F17-F131 AromaticContact CE1-CE1 3.63Å; F17-F131 HydrophobicContact CE1-CE1 3.63Å; F17-F131 HydrophobicContact CE1-CE2 4.12Å; F17-F131 HydrophobicContact CE1-CG 4.28Å; F17-F131 AromaticContact CE1-CZ 3.73Å; F17-F131 HydrophobicContact CE1-CZ 3.73Å; F17-F131 HydrophobicContact CZ-CE1 4.29Å; F17-F131 HydrophobicContact CZ-CZ 4.07Å; F127-F131 PolarHBondContact O-N 3.24Å; F131-L133 PolarHBondContact O-N 2.86Å; F131-S134 PolarHBondContact O-N 3.38Å; F131-S134 PolarHBondContact O-OG 2.62Å; F131-A135 PolarHBondContact O-N 2.88Å
132	S	73.7	Confident	71.3	Confident	46 Å²	46	99.5 Å²	99.5	32%	0.322	50%	0.499	S	S	.	.	H	α-helix	trans	-63.5	-40.7	179.2	56.2	0	0	0	0	112.5	Y128 Y129 A135 L136	Y128-S132 WeakPolarHBondContact O-CB 3.4Å; Y128-S132 PolarHBondContact O-N 2.89Å; Y128-S132 VanDerWaalsContact O-N 3.1Å; Y128-S132 PolarHBondContact O-OG 2.79Å; Y129-S132 PolarHBondContact O-OG 2.92Å; Y129-S132 VanDerWaalsContact O-OG 3.12Å; S132-A135 PolarHBondContact O-N 3.14Å; S132-L136 WeakPolarHBondContact O-CG 3.39Å; S132-L136 PolarHBondContact O-N 2.8Å; S132-L136 VanDerWaalsContact O-N 3.07Å
133	L	78	Confident	72.2	Confident	109 Å²	109	99 Å²	99	57%	0.571	49%	0.492	S	S	*	.	H	α-helix	trans	-62.8	-43.6	175.3	-170.2	69.7	0	0	0	111.7	Y129 F131 L136 T137	Y129-L133 VanDerWaalsContact O-CB 3.29Å; Y129-L133 WeakPolarHBondContact O-CB 3.1Å; Y129-L133 PolarHBondContact O-N 2.75Å; F131-L133 PolarHBondContact O-N 2.86Å; L133-L136 PolarHBondContact O-N 2.8Å; L133-T137 WeakPolarHBondContact O-CG2 3.47Å; L133-T137 PolarHBondContact O-N 2.83Å; L133-T137 PolarHBondContact O-OG1 2.81Å
134	S	77.9	Confident	73.1	Confident	47 Å²	47	97.9 Å²	97.9	33%	0.329	49%	0.492	S	S	.	.	H	α-helix	trans	-64.2	-40.4	178.1	73.9	0	0	0	0	112.7	L130 F131 T137 F138	L130-S134 WeakPolarHBondContact O-CB 3.48Å; L130-S134 PolarHBondContact O-N 2.81Å; L130-S134 VanDerWaalsContact O-N 3.08Å; L130-S134 PolarHBondContact O-OG 2.88Å; F131-S134 PolarHBondContact O-N 3.38Å; F131-S134 PolarHBondContact O-OG 2.62Å; S134-T137 WeakPolarHBondContact CA-OG1 3.46Å; S134-T137 PolarHBondContact O-N 2.95Å; S134-T137 PolarHBondContact O-OG1 3.04Å; S134-F138 WeakPolarHBondContact O-CB 3.29Å; S134-F138 VanDerWaalsContact O-CD2 3.29Å; S134-F138 WeakPolarHBondContact O-CD2 3.37Å; S134-F138 PolarHBondContact O-N 3.28Å
135	A	75.4	Confident	74.1	Confident	25 Å²	25	101 Å²	101	21%	0.207	50%	0.504	C	S	.	.	H	α-helix	trans	-66.7	-39	178.3	0	0	0	0	0	112	T14 F131 S132 S139	T14-A135 HydrophobicContact CG2-CB 4.06Å; F131-A135 PolarHBondContact O-N 2.88Å; S132-A135 PolarHBondContact O-N 3.14Å; A135-S139 WeakPolarHBondContact O-CB 3.33Å; A135-S139 PolarHBondContact O-N 2.78Å; A135-S139 VanDerWaalsContact O-N 3.07Å; A135-S139 PolarHBondContact O-OG 2.98Å
136	L	77.6	Confident	74.4	Confident	101 Å²	101	102.7 Å²	102.7	53%	0.529	51%	0.507	S	S	.	.	H	α-helix	trans	-65.8	-45.6	175.2	-72.3	170.3	0	0	0	111.4	S132 L133 F138 S139 F140	S132-L136 WeakPolarHBondContact O-CG 3.39Å; S132-L136 PolarHBondContact O-N 2.8Å; S132-L136 VanDerWaalsContact O-N 3.07Å; L133-L136 PolarHBondContact O-N 2.8Å; L136-F138 PolarHBondContact O-N 2.83Å; L136-S139 PolarHBondContact O-N 3.19Å; L136-F140 WeakPolarHBondContact O-CD2 3.47Å; L136-F140 PolarHBondContact O-N 3.19Å
137	T	79.8	Confident	74.1	Confident	66 Å²	66	106.6 Å²	106.6	41%	0.405	53%	0.528	S	S	.	.	H	α-helix	trans	-64	-41.8	178.4	56.1	0	0	0	0	112	L133 S134 S139 F140 I141	L133-T137 WeakPolarHBondContact O-CG2 3.47Å; L133-T137 PolarHBondContact O-N 2.83Å; L133-T137 PolarHBondContact O-OG1 2.81Å; S134-T137 WeakPolarHBondContact CA-OG1 3.46Å; S134-T137 PolarHBondContact O-N 2.95Å; S134-T137 PolarHBondContact O-OG1 3.04Å; T137-S139 VanDerWaalsContact C-N 3.29Å; T137-S139 PolarHBondContact O-N 3.35Å; T137-F140 PolarHBondContact O-N 3.44Å; T137-I141 WeakPolarHBondContact O-CB 3.44Å; T137-I141 VanDerWaalsContact O-CG1 3.26Å; T137-I141 WeakPolarHBondContact O-CG1 3.37Å; T137-I141 PolarHBondContact O-N 3.42Å
138	F	78.1	Confident	74.5	Confident	151 Å²	151	104.6 Å²	104.6	66%	0.662	52%	0.522	S	S	*	.	H	α-helix	trans	-59.9	-38.8	173.3	-93.8	-74.3	0	0	0	112.5	S134 L136 R142	S134-F138 WeakPolarHBondContact O-CB 3.29Å; S134-F138 VanDerWaalsContact O-CD2 3.29Å; S134-F138 WeakPolarHBondContact O-CD2 3.37Å; S134-F138 PolarHBondContact O-N 3.28Å; L136-F138 PolarHBondContact O-N 2.83Å; F138-R142 PolarHBondContact O-N 3.11Å
139	S	77.4	Confident	74.8	Confident	64 Å²	64	105.3 Å²	105.3	45%	0.448	53%	0.531	S	S	.	.	H	α-helix	trans	-69.3	-42.4	177.5	-58.6	0	0	0	0	112.1	A135 L136 T137 R142 L143	A135-S139 WeakPolarHBondContact O-CB 3.33Å; A135-S139 PolarHBondContact O-N 2.78Å; A135-S139 VanDerWaalsContact O-N 3.07Å; A135-S139 PolarHBondContact O-OG 2.98Å; L136-S139 PolarHBondContact O-N 3.19Å; T137-S139 VanDerWaalsContact C-N 3.29Å; T137-S139 PolarHBondContact O-N 3.35Å; S139-R142 PolarHBondContact O-N 3.2Å; S139-L143 PolarHBondContact O-N 3.03Å
140	F	78.7	Confident	74.8	Confident	136 Å²	136	101.7 Å²	101.7	60%	0.596	52%	0.523	S	S	*	.	H	α-helix	trans	-65.2	-45.3	176.2	-93.4	-77	0	0	0	112.7	L136 T137 R142 L143 L144	L136-F140 WeakPolarHBondContact O-CD2 3.47Å; L136-F140 PolarHBondContact O-N 3.19Å; T137-F140 PolarHBondContact O-N 3.44Å; F140-R142 VanDerWaalsContact C-N 3.28Å; F140-R142 PolarHBondContact O-N 2.9Å; F140-L143 PolarHBondContact O-N 2.64Å; F140-L144 WeakPolarHBondContact O-CG 3.37Å; F140-L144 PolarHBondContact O-N 3.24Å
141	I	79.7	Confident	74.8	Confident	95 Å²	95	100.8 Å²	100.8	49%	0.487	52%	0.518	S	S	.	.	H	α-helix	trans	-59.9	-41.8	177.1	-69.9	166.2	0	0	0	110.2	T137 L144 I145	T137-I141 WeakPolarHBondContact O-CB 3.44Å; T137-I141 VanDerWaalsContact O-CG1 3.26Å; T137-I141 WeakPolarHBondContact O-CG1 3.37Å; T137-I141 PolarHBondContact O-N 3.42Å; I141-L144 PolarHBondContact O-N 2.88Å; I141-I145 HydrophobicContact CG2-CD1 3.72Å; I141-I145 WeakPolarHBondContact O-CD1 3.11Å; I141-I145 VanDerWaalsContact O-CG1 3.26Å; I141-I145 WeakPolarHBondContact O-CG1 3.41Å; I141-I145 PolarHBondContact O-N 3.27Å
142	R	72.9	Confident	75.1	Confident	114 Å²	114	100.9 Å²	100.9	43%	0.43	52%	0.523	S	S	.	.	H	α-helix	trans	-63.5	-45.9	174.6	-85.4	-154.6	-177.5	-114.7	5.5	112.2	F138 S139 F140 L144 I145 Y146	F138-R142 PolarHBondContact O-N 3.11Å; S139-R142 PolarHBondContact O-N 3.2Å; F140-R142 VanDerWaalsContact C-N 3.28Å; F140-R142 PolarHBondContact O-N 2.9Å; R142-L144 VanDerWaalsContact C-N 3.27Å; R142-L144 PolarHBondContact O-N 2.89Å; R142-I145 PolarHBondContact O-N 3.43Å; R142-I145 VanDerWaalsContact O-N 3.14Å; R142-Y146 HydrophobicContact CB-CD2 4.47Å; R142-Y146 PolarHBondContact NH1-OH 2.94Å; R142-Y146 WeakPolarHBondContact O-CD2 3.28Å; R142-Y146 PolarHBondContact O-N 2.58Å; R142-Y146 VanDerWaalsContact O-N 3.1Å
143	L	74.2	Confident	75.2	Confident	109 Å²	109	104.5 Å²	104.5	57%	0.571	54%	0.536	S	S	*	.	H	α-helix	trans	-56.5	-44	178.7	-172.4	69.6	0	0	0	111.3	S139 F140 I145 Y146 T147	S139-L143 PolarHBondContact O-N 3.03Å; F140-L143 PolarHBondContact O-N 2.64Å; L143-I145 PolarHBondContact O-N 2.79Å; L143-Y146 PolarHBondContact O-N 3.26Å; L143-T147 PolarHBondContact O-N 3.47Å; L143-T147 VanDerWaalsContact O-N 3.1Å; L143-T147 PolarHBondContact O-OG1 2.98Å
144	L	75.6	Confident	75	Confident	121 Å²	121	104.2 Å²	104.2	63%	0.634	53%	0.534	S	S	*	.	H	α-helix	trans	-66.4	-32	177.5	-70.8	171.8	0	0	0	114	F140 I141 R142 Y146 T147	F140-L144 WeakPolarHBondContact O-CG 3.37Å; F140-L144 PolarHBondContact O-N 3.24Å; I141-L144 PolarHBondContact O-N 2.88Å; R142-L144 VanDerWaalsContact C-N 3.27Å; R142-L144 PolarHBondContact O-N 2.89Å; L144-Y146 VanDerWaalsContact C-N 3.3Å; L144-T147 PolarHBondContact O-OG1 3.22Å
145	I	77.7	Confident	74.7	Confident	125 Å²	125	108.6 Å²	108.6	64%	0.641	55%	0.55	S	S	*	.	H	α-helix	trans	-74.5	-23.1	175.4	-67.3	165.7	0	0	0	111.5	I141 R142 L143	I141-I145 HydrophobicContact CG2-CD1 3.72Å; I141-I145 WeakPolarHBondContact O-CD1 3.11Å; I141-I145 VanDerWaalsContact O-CG1 3.26Å; I141-I145 WeakPolarHBondContact O-CG1 3.41Å; I141-I145 PolarHBondContact O-N 3.27Å; R142-I145 PolarHBondContact O-N 3.43Å; R142-I145 VanDerWaalsContact O-N 3.14Å; L143-I145 PolarHBondContact O-N 2.79Å
146	Y	66.8	Low	74.7	Confident	152 Å²	152	115.6 Å²	115.6	60%	0.596	58%	0.578	S	S	*	*	H	α-helix	trans	-97.5	-9.6	-179.1	-77.6	-69	0	0	0	114.8	R142 L143 L144	R142-Y146 HydrophobicContact CB-CD2 4.47Å; R142-Y146 PolarHBondContact NH1-OH 2.94Å; R142-Y146 WeakPolarHBondContact O-CD2 3.28Å; R142-Y146 PolarHBondContact O-N 2.58Å; R142-Y146 VanDerWaalsContact O-N 3.1Å; L143-Y146 PolarHBondContact O-N 3.26Å; L144-Y146 VanDerWaalsContact C-N 3.3Å
147	T	57.8	Low	74.4	Confident	153 Å²	153	116.9 Å²	116.9	94%	0.939	58%	0.583	S	S	*	*			trans	-91	0	166.6	52.2	0	0	0	0	110.8	L143 L144	L143-T147 PolarHBondContact O-N 3.47Å; L143-T147 VanDerWaalsContact O-N 3.1Å; L143-T147 PolarHBondContact O-OG1 2.98Å; L144-T147 PolarHBondContact O-OG1 3.22Å

Retrieved 147 of 147 residues in 28.8 ms (Link to these results)

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