A0A3Q0KHI3_SCHMA Loading...

Transcription initiation factor IIA subunit 2

AlphaFold DB , UniProt , Accession A0A3Q0KHI3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 144 aa.

						>A0A3Q0KHI3_SCHMA|A0A3Q0KHI3
MTYHEMYRSTTLGTTLREALDEMLAHNLLQPGMDHKVMQKFDQCISNALAKRVKNRLSLRGHLNTYRNCDNVWTLVMNDVEIKDSSAIMTVDKIKIVACEGKNAKPTSSKISVSSISDRSRLGAGIGGEDNEQREAFDSGDEME
					

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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	56.5	Low	88.4	Confident	101 Å²	101	78.7 Å²	78.7	50%	0.498	41%	0.413	S	S	.	.				0	107.3	0	174.2	143.6	-162.8	0	0	106.2	Y3 N47 K102	M1-Y3 HydrophobicContact CB-CE1 4.29Å; M1-Y3 HydrophobicContact CE-CE1 4.49Å; M1-Y3 HydrophobicContact CG-CD1 4Å; M1-Y3 HydrophobicContact CG-CE1 3.45Å; M1-Y3 VanDerWaalsContact CG-CE1 3.45Å; M1-Y3 HydrophobicContact CG-CE2 4.49Å; M1-Y3 WeakPolarHBondContact O-CD2 3.49Å; M1-Y3 HydrophobicContact SD-CE1 4.1Å; M1-N47 WeakPolarHBondContact CE-OD1 3.28Å; M1-N47 PolarHBondContact SD-OD1 3.03Å; M1-N47 VanDerWaalsContact SD-OD1 3.38Å; M1-K102 VanDerWaalsContact CE-NZ 3.31Å; M1-K102 PolarHBondContact SD-NZ 2.97Å
2	T	72.2	Confident	89.2	Confident	86 Å²	86	81.1 Å²	81.1	53%	0.528	43%	0.425	S	S	.	.			trans	-67.1	129.3	172.9	43.5	0	0	0	0	108.4
3	Y	83.2	Confident	89.9	Confident	92 Å²	92	74.8 Å²	74.8	36%	0.361	39%	0.392	S	S	.	.			trans	-107.1	118	176.2	-60	-65.9	0	0	0	106.8	M1 Q43	M1-Y3 HydrophobicContact CB-CE1 4.29Å; M1-Y3 HydrophobicContact CE-CE1 4.49Å; M1-Y3 HydrophobicContact CG-CD1 4Å; M1-Y3 HydrophobicContact CG-CE1 3.45Å; M1-Y3 VanDerWaalsContact CG-CE1 3.45Å; M1-Y3 HydrophobicContact CG-CE2 4.49Å; M1-Y3 WeakPolarHBondContact O-CD2 3.49Å; M1-Y3 HydrophobicContact SD-CE1 4.1Å; Y3-Q43 VanDerWaalsContact CD1-CA 3.45Å; Y3-Q43 HydrophobicContact CD1-CB 4.14Å; Y3-Q43 HydrophobicContact CD1-CG 4.09Å; Y3-Q43 HydrophobicContact CD2-CG 3.75Å; Y3-Q43 HydrophobicContact CE1-CB 3.85Å; Y3-Q43 HydrophobicContact CE1-CG 3.96Å; Y3-Q43 HydrophobicContact CE2-CB 4.42Å; Y3-Q43 HydrophobicContact CE2-CG 3.65Å; Y3-Q43 HydrophobicContact CG-CB 4.48Å; Y3-Q43 HydrophobicContact CG-CG 3.96Å
4	H	86.5	Confident	90.5	Very high	53 Å²	53	72.7 Å²	72.7	25%	0.245	38%	0.384	C	S	.	.			trans	-91.7	126.8	-174	-60.7	-79.4	0	0	0	110.3	M6	H4-M6 HydrophobicContact CB-CB 4.5Å; H4-M6 HydrophobicContact CB-CG 3.79Å; H4-M6 HydrophobicContact CB-SD 4.12Å; H4-M6 PolarHBondContact O-N 3.47Å
5	E	93.7	Very high	91.1	Very high	111 Å²	111	73 Å²	73	52%	0.519	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-70.1	-7.6	174.9	-55.7	-166.3	146.1	0	0	112.6	Y7 R8	E5-Y7 PolarHBondContact O-N 2.92Å; E5-Y7 VanDerWaalsContact O-N 3.1Å; E5-R8 HydrophobicContact CB-CG 4.48Å; E5-R8 VanDerWaalsContact CD-CZ 3.5Å; E5-R8 WeakPolarHBondContact O-CB 3.25Å; E5-R8 WeakPolarHBondContact O-CG 3.19Å; E5-R8 PolarHBondContact O-N 3.36Å; E5-R8 IonicContact OE1-CZ 3.21Å; E5-R8 IonicContact OE1-NH1 3.17Å; E5-R8 PolarHBondContact OE1-NH1 3.5Å; E5-R8 VanDerWaalsContact OE1-NH1 3.17Å; E5-R8 IonicContact OE1-NH2 2.77Å; E5-R8 PolarHBondContact OE1-NH2 2.92Å; E5-R8 IonicContact OE2-NH1 3.66Å
6	M	93.4	Very high	91.5	Very high	55 Å²	55	71.7 Å²	71.7	27%	0.271	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-54.8	-31.6	178.4	72.1	-177.5	-73	0	0	112.8	H4 R8 S9 V97 C99	H4-M6 HydrophobicContact CB-CB 4.5Å; H4-M6 HydrophobicContact CB-CG 3.79Å; H4-M6 HydrophobicContact CB-SD 4.12Å; H4-M6 PolarHBondContact O-N 3.47Å; M6-R8 PolarHBondContact O-N 3.05Å; M6-S9 PolarHBondContact O-N 3.22Å; M6-S9 PolarHBondContact O-OG 3.1Å; M6-V97 HydrophobicContact CE-CB 4.46Å; M6-V97 HydrophobicContact CE-CG1 4.35Å; M6-V97 VanDerWaalsContact CE-O 3.23Å; M6-V97 WeakPolarHBondContact CE-O 3.28Å; M6-C99 HydrophobicContact SD-CB 4.22Å
7	Y	96.5	Very high	91.9	Very high	64 Å²	64	73.1 Å²	73.1	25%	0.251	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-70.5	-14.4	-179.7	-62.6	-62.8	0	0	0	112.9	E5 S9 T10 I45 L49	E5-Y7 PolarHBondContact O-N 2.92Å; E5-Y7 VanDerWaalsContact O-N 3.1Å; Y7-S9 PolarHBondContact O-N 3.47Å; Y7-T10 HydrophobicContact CD1-CG2 4.37Å; Y7-T10 WeakPolarHBondContact O-CB 3.45Å; Y7-T10 WeakPolarHBondContact O-CG2 3.49Å; Y7-T10 PolarHBondContact O-N 3.01Å; Y7-T10 VanDerWaalsContact O-N 3.14Å; Y7-T10 PolarHBondContact O-OG1 2.97Å; Y7-I45 HydrophobicContact CD2-CG2 3.74Å; Y7-I45 HydrophobicContact CG-CG1 4.19Å; Y7-I45 HydrophobicContact CG-CG2 3.96Å; Y7-L49 HydrophobicContact CD1-CD1 4.1Å; Y7-L49 HydrophobicContact CE1-CD1 3.52Å; Y7-L49 HydrophobicContact CE2-CD1 4.27Å
8	R	97.5	Very high	92.2	Very high	35 Å²	35	75.9 Å²	75.9	13%	0.132	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-66.1	-21.3	174.1	-57.6	-175	-179.1	168.5	7	112.2	E5 M6 T10 G13 T14 R17 M38 F41 D42	E5-R8 HydrophobicContact CB-CG 4.48Å; E5-R8 VanDerWaalsContact CD-CZ 3.5Å; E5-R8 WeakPolarHBondContact O-CB 3.25Å; E5-R8 WeakPolarHBondContact O-CG 3.19Å; E5-R8 PolarHBondContact O-N 3.36Å; E5-R8 IonicContact OE1-CZ 3.21Å; E5-R8 IonicContact OE1-NH1 3.17Å; E5-R8 PolarHBondContact OE1-NH1 3.5Å; E5-R8 VanDerWaalsContact OE1-NH1 3.17Å; E5-R8 IonicContact OE1-NH2 2.77Å; E5-R8 PolarHBondContact OE1-NH2 2.92Å; E5-R8 IonicContact OE2-NH1 3.66Å; M6-R8 PolarHBondContact O-N 3.05Å; R8-T10 VanDerWaalsContact C-N 3.31Å; R8-G13 CarbonylContact O-C 3.53Å; R8-G13 VanDerWaalsContact O-C 3.25Å; R8-T14 PolarHBondContact O-N 3.47Å; R8-R17 PolarHBondContact O-NH2 2.99Å; R8-M38 HydrophobicContact CB-CE 3.95Å; R8-M38 VanDerWaalsContact CD-CE 3.49Å; R8-M38 HydrophobicContact CG-CE 3.45Å; R8-M38 VanDerWaalsContact CG-CE 3.45Å; R8-F41 HydrophobicContact CG-CD1 4.2Å; R8-F41 HydrophobicContact CG-CE1 4.12Å; R8-D42 WeakPolarHBondContact CG-OD1 3.41Å; R8-D42 IonicContact CZ-OD1 3.85Å; R8-D42 IonicContact CZ-OD2 3.3Å; R8-D42 VanDerWaalsContact CZ-OD2 3.3Å; R8-D42 IonicContact NE-OD1 2.95Å; R8-D42 PolarHBondContact NE-OD1 3.3Å; R8-D42 IonicContact NE-OD2 3.21Å; R8-D42 PolarHBondContact NE-OD2 3.19Å; R8-D42 IonicContact NH2-OD1 3.92Å; R8-D42 IonicContact NH2-OD2 2.65Å; R8-D42 PolarHBondContact NH2-OD2 3.34Å
9	S	96.4	Very high	92.5	Very high	100 Å²	100	74.2 Å²	74.2	70%	0.699	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-88.2	5.6	175	73.3	0	0	0	0	113.9	M6 Y7	M6-S9 PolarHBondContact O-N 3.22Å; M6-S9 PolarHBondContact O-OG 3.1Å; Y7-S9 PolarHBondContact O-N 3.47Å
10	T	98	Very high	92.8	Very high	53 Å²	53	71.1 Å²	71.1	33%	0.325	37%	0.374	S	S	.	.	S	Bend	trans	-78.8	164.9	171.6	65.1	0	0	0	0	110.5	Y7 R8 L12 G13 T14	Y7-T10 HydrophobicContact CD1-CG2 4.37Å; Y7-T10 WeakPolarHBondContact O-CB 3.45Å; Y7-T10 WeakPolarHBondContact O-CG2 3.49Å; Y7-T10 PolarHBondContact O-N 3.01Å; Y7-T10 VanDerWaalsContact O-N 3.14Å; Y7-T10 PolarHBondContact O-OG1 2.97Å; R8-T10 VanDerWaalsContact C-N 3.31Å; T10-L12 VanDerWaalsContact C-N 3.25Å; T10-L12 PolarHBondContact O-N 3.31Å; T10-G13 PolarHBondContact O-N 3.38Å; T10-G13 VanDerWaalsContact O-N 3.11Å; T10-G13 PolarHBondContact OG1-N 2.99Å; T10-T14 WeakPolarHBondContact O-CB 3.4Å; T10-T14 WeakPolarHBondContact O-CG2 3.42Å; T10-T14 PolarHBondContact O-N 3.18Å; T10-T14 PolarHBondContact O-OG1 3.36Å
11	T	98.6	Very high	92.9	Very high	116 Å²	116	71.6 Å²	71.6	71%	0.712	38%	0.377	S	S	*	.	H	α-helix	trans	-52.2	-45.8	172.4	-49.1	0	0	0	0	111.4	G13 T14 T15	T11-G13 PolarHBondContact O-N 3.18Å; T11-T14 VanDerWaalsContact CA-OG1 3.31Å; T11-T14 WeakPolarHBondContact CA-OG1 3.4Å; T11-T14 PolarHBondContact O-N 3.37Å; T11-T14 PolarHBondContact O-OG1 2.85Å; T11-T15 WeakPolarHBondContact O-CB 3.46Å; T11-T15 PolarHBondContact O-N 2.93Å; T11-T15 PolarHBondContact O-OG1 2.99Å
12	L	98.2	Very high	94.9	Very high	107 Å²	107	72.6 Å²	72.6	56%	0.56	38%	0.381	S	S	*	.	H	α-helix	trans	-61.9	-42.9	178.1	-176.7	63.6	0	0	0	112.5	T10 L16 F41 I45	T10-L12 VanDerWaalsContact C-N 3.25Å; T10-L12 PolarHBondContact O-N 3.31Å; L12-L16 WeakPolarHBondContact O-CB 3.44Å; L12-L16 PolarHBondContact O-N 2.74Å; L12-F41 HydrophobicContact CD2-CE2 4.02Å; L12-F41 HydrophobicContact CG-CE2 4.03Å; L12-I45 HydrophobicContact CD2-CD1 4.28Å
13	G	98.3	Very high	96.1	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-73.2	-28.5	-179.7	0	0	0	0	0	114.3	R8 T10 T11 R17	R8-G13 CarbonylContact O-C 3.53Å; R8-G13 VanDerWaalsContact O-C 3.25Å; T10-G13 PolarHBondContact O-N 3.38Å; T10-G13 VanDerWaalsContact O-N 3.11Å; T10-G13 PolarHBondContact OG1-N 2.99Å; T11-G13 PolarHBondContact O-N 3.18Å; G13-R17 PolarHBondContact O-N 3.19Å
14	T	98.2	Very high	96.7	Very high	45 Å²	45	69.8 Å²	69.8	28%	0.276	37%	0.367	S	S	.	.	H	α-helix	trans	-76.9	-49.3	176.8	44.6	0	0	0	0	110.9	R8 T10 T11 L16 R17 E18	R8-T14 PolarHBondContact O-N 3.47Å; T10-T14 WeakPolarHBondContact O-CB 3.4Å; T10-T14 WeakPolarHBondContact O-CG2 3.42Å; T10-T14 PolarHBondContact O-N 3.18Å; T10-T14 PolarHBondContact O-OG1 3.36Å; T11-T14 VanDerWaalsContact CA-OG1 3.31Å; T11-T14 WeakPolarHBondContact CA-OG1 3.4Å; T11-T14 PolarHBondContact O-N 3.37Å; T11-T14 PolarHBondContact O-OG1 2.85Å; T14-L16 VanDerWaalsContact C-N 3.3Å; T14-L16 PolarHBondContact O-N 2.89Å; T14-R17 WeakPolarHBondContact O-CB 3.35Å; T14-R17 PolarHBondContact O-N 3.39Å; T14-E18 WeakPolarHBondContact O-CG 3.45Å; T14-E18 PolarHBondContact O-N 3.5Å
15	T	98.6	Very high	97.1	Very high	77 Å²	77	70.9 Å²	70.9	47%	0.472	39%	0.385	S	S	.	.	H	α-helix	trans	-60.2	-38.2	176.1	-54.6	0	0	0	0	112.5	T11 R17 E18 A19	T11-T15 WeakPolarHBondContact O-CB 3.46Å; T11-T15 PolarHBondContact O-N 2.93Å; T11-T15 PolarHBondContact O-OG1 2.99Å; T15-R17 VanDerWaalsContact C-N 3.32Å; T15-R17 PolarHBondContact O-N 2.88Å; T15-E18 PolarHBondContact O-N 3.08Å; T15-A19 PolarHBondContact O-N 3.37Å
16	L	98.5	Very high	97.2	Very high	52 Å²	52	71.2 Å²	71.2	27%	0.272	39%	0.386	S	S	.	.	H	α-helix	trans	-61.7	-41.3	173.6	175.8	61.1	0	0	0	111.8	L12 T14 A19 L20 V37 M38 F41	L12-L16 WeakPolarHBondContact O-CB 3.44Å; L12-L16 PolarHBondContact O-N 2.74Å; T14-L16 VanDerWaalsContact C-N 3.3Å; T14-L16 PolarHBondContact O-N 2.89Å; L16-A19 PolarHBondContact O-N 3.33Å; L16-L20 HydrophobicContact CD1-CD1 4.26Å; L16-L20 HydrophobicContact CD1-CG 4.3Å; L16-L20 HydrophobicContact CG-CD1 4.12Å; L16-L20 VanDerWaalsContact O-CG 3.28Å; L16-L20 WeakPolarHBondContact O-CG 3.47Å; L16-L20 PolarHBondContact O-N 2.65Å; L16-V37 HydrophobicContact CD1-CG1 4.48Å; L16-M38 HydrophobicContact CD2-SD 3.89Å; L16-M38 HydrophobicContact CG-SD 4.05Å; L16-F41 HydrophobicContact CD2-CB 3.75Å; L16-F41 HydrophobicContact CD2-CD2 3.71Å; L16-F41 HydrophobicContact CD2-CG 3.8Å
17	R	97.4	Very high	97.3	Very high	96 Å²	96	75.6 Å²	75.6	36%	0.362	41%	0.411	S	S	.	.	H	α-helix	trans	-66.6	-45.3	179.4	-166.4	-175.5	-51.3	128.4	21.8	111.3	R8 G13 T14 T15 A19 L20 D21	R8-R17 PolarHBondContact O-NH2 2.99Å; G13-R17 PolarHBondContact O-N 3.19Å; T14-R17 WeakPolarHBondContact O-CB 3.35Å; T14-R17 PolarHBondContact O-N 3.39Å; T15-R17 VanDerWaalsContact C-N 3.32Å; T15-R17 PolarHBondContact O-N 2.88Å; R17-A19 VanDerWaalsContact C-N 3.3Å; R17-A19 PolarHBondContact O-N 2.77Å; R17-L20 PolarHBondContact O-N 3.17Å; R17-L20 VanDerWaalsContact O-N 3.09Å; R17-D21 VanDerWaalsContact O-CG 3.25Å; R17-D21 PolarHBondContact O-N 3.21Å
18	E	97.8	Very high	97.3	Very high	124 Å²	124	78.3 Å²	78.3	58%	0.579	43%	0.429	S	S	*	.	H	α-helix	trans	-56.8	-43.9	176.4	-69.9	168.4	175.9	0	0	111.5	T14 T15 D21 E22	T14-E18 WeakPolarHBondContact O-CG 3.45Å; T14-E18 PolarHBondContact O-N 3.5Å; T15-E18 PolarHBondContact O-N 3.08Å; E18-D21 PolarHBondContact O-N 2.95Å; E18-E22 PolarHBondContact O-N 3.5Å
19	A	98	Very high	97.2	Very high	43 Å²	43	78.3 Å²	78.3	36%	0.355	43%	0.431	S	S	.	.	H	α-helix	trans	-64.7	-39.7	175.4	0	0	0	0	0	112.9	T15 L16 R17 E22 M23	T15-A19 PolarHBondContact O-N 3.37Å; L16-A19 PolarHBondContact O-N 3.33Å; R17-A19 VanDerWaalsContact C-N 3.3Å; R17-A19 PolarHBondContact O-N 2.77Å; A19-E22 PolarHBondContact O-N 2.82Å; A19-M23 VanDerWaalsContact O-CG 3.25Å; A19-M23 WeakPolarHBondContact O-CG 3.46Å; A19-M23 PolarHBondContact O-N 3.19Å
20	L	97.9	Very high	97	Very high	11 Å²	11	80.6 Å²	80.6	6%	0.058	43%	0.431	C	S	.	.	H	α-helix	trans	-66.3	-39.2	176.2	-71.2	171	0	0	0	111.9	L16 R17 M23 L24 L29 D34 V37 M38	L16-L20 HydrophobicContact CD1-CD1 4.26Å; L16-L20 HydrophobicContact CD1-CG 4.3Å; L16-L20 HydrophobicContact CG-CD1 4.12Å; L16-L20 VanDerWaalsContact O-CG 3.28Å; L16-L20 WeakPolarHBondContact O-CG 3.47Å; L16-L20 PolarHBondContact O-N 2.65Å; R17-L20 PolarHBondContact O-N 3.17Å; R17-L20 VanDerWaalsContact O-N 3.09Å; L20-M23 PolarHBondContact O-N 3.24Å; L20-L24 WeakPolarHBondContact O-CB 3.25Å; L20-L24 WeakPolarHBondContact O-CG 3.45Å; L20-L24 PolarHBondContact O-N 3.12Å; L20-L29 HydrophobicContact CD2-CD1 3.76Å; L20-D34 HydrophobicContact CB-CB 4.22Å; L20-D34 HydrophobicContact CD1-CB 4.43Å; L20-V37 HydrophobicContact CD1-CB 4Å; L20-V37 HydrophobicContact CD1-CG1 3.9Å; L20-V37 HydrophobicContact CD2-CB 4.17Å; L20-V37 HydrophobicContact CD2-CG1 4.1Å; L20-V37 HydrophobicContact CD2-CG2 4.25Å; L20-M38 HydrophobicContact CD1-CG 3.99Å; L20-M38 HydrophobicContact CD1-SD 3.83Å
21	D	96.2	Very high	96.6	Very high	83 Å²	83	83.6 Å²	83.6	44%	0.444	45%	0.452	S	S	.	.	H	α-helix	trans	-64.9	-41.5	176.8	-68.1	-22.8	0	0	0	110.9	R17 E18 L24 A25	R17-D21 VanDerWaalsContact O-CG 3.25Å; R17-D21 PolarHBondContact O-N 3.21Å; E18-D21 PolarHBondContact O-N 2.95Å; D21-L24 PolarHBondContact O-N 2.91Å; D21-A25 WeakPolarHBondContact O-CB 3.31Å; D21-A25 PolarHBondContact O-N 2.93Å
22	E	97.3	Very high	96.3	Very high	122 Å²	122	80 Å²	80	57%	0.57	44%	0.437	S	S	*	.	H	α-helix	trans	-62.9	-45.8	173.5	-177.2	175.3	-173.3	0	0	111.6	E18 A19 L24 A25 H26	E18-E22 PolarHBondContact O-N 3.5Å; A19-E22 PolarHBondContact O-N 2.82Å; E22-L24 VanDerWaalsContact C-N 3.31Å; E22-L24 PolarHBondContact O-N 3.23Å; E22-A25 WeakPolarHBondContact O-CB 3.42Å; E22-A25 PolarHBondContact O-N 2.95Å; E22-H26 PolarHBondContact O-CD2 3.47Å; E22-H26 PolarHBondContact O-N 3.15Å
23	M	97.3	Very high	96.2	Very high	75 Å²	75	78.2 Å²	78.2	37%	0.369	43%	0.427	S	S	.	.	H	α-helix	trans	-62.2	-37.1	176.5	-71	177.3	75.8	0	0	112.7	A19 L20 N27 L28 L29	A19-M23 VanDerWaalsContact O-CG 3.25Å; A19-M23 WeakPolarHBondContact O-CG 3.46Å; A19-M23 PolarHBondContact O-N 3.19Å; L20-M23 PolarHBondContact O-N 3.24Å; M23-N27 PolarHBondContact O-N 3.06Å; M23-L28 HydrophobicContact CB-CB 4.29Å; M23-L28 HydrophobicContact CG-CD1 4.44Å; M23-L28 WeakPolarHBondContact O-CB 3.44Å; M23-L28 PolarHBondContact O-N 3.28Å; M23-L29 HydrophobicContact CB-CD1 3.64Å; M23-L29 HydrophobicContact CB-CG 3.87Å; M23-L29 HydrophobicContact CE-CD1 4.03Å; M23-L29 HydrophobicContact CE-CD2 3.81Å; M23-L29 HydrophobicContact CE-CG 3.87Å; M23-L29 HydrophobicContact CG-CD1 4.49Å; M23-L29 HydrophobicContact SD-CD1 4.08Å
24	L	95.7	Very high	96	Very high	43 Å²	43	80.2 Å²	80.2	23%	0.225	44%	0.438	C	S	.	.	H	α-helix	trans	-65.9	-44.1	173.2	-79.3	170.3	0	0	0	111.4	L20 D21 E22 H26 N27 L29 D34	L20-L24 WeakPolarHBondContact O-CB 3.25Å; L20-L24 WeakPolarHBondContact O-CG 3.45Å; L20-L24 PolarHBondContact O-N 3.12Å; D21-L24 PolarHBondContact O-N 2.91Å; E22-L24 VanDerWaalsContact C-N 3.31Å; E22-L24 PolarHBondContact O-N 3.23Å; L24-H26 PolarHBondContact O-N 3.47Å; L24-N27 PolarHBondContact O-N 3.2Å; L24-L29 HydrophobicContact CD2-CB 3.85Å; L24-L29 HydrophobicContact CG-CB 4.3Å; L24-D34 HydrophobicContact CD1-CB 3.71Å; L24-D34 HydrophobicContact CG-CB 4.48Å
25	A	95.3	Very high	95.9	Very high	76 Å²	76	82.4 Å²	82.4	63%	0.628	44%	0.444	S	S	*	.	H	α-helix	trans	-60.4	-34.6	177.9	0	0	0	0	0	112.4	D21 E22 N27	D21-A25 WeakPolarHBondContact O-CB 3.31Å; D21-A25 PolarHBondContact O-N 2.93Å; E22-A25 WeakPolarHBondContact O-CB 3.42Å; E22-A25 PolarHBondContact O-N 2.95Å; A25-N27 VanDerWaalsContact C-N 3.28Å; A25-N27 PolarHBondContact O-N 3.29Å
26	H	96.8	Very high	95.8	Very high	118 Å²	118	85.1 Å²	85.1	55%	0.546	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	8	174.9	-67.4	-61	0	0	0	114.3	E22 L24 L28	E22-H26 PolarHBondContact O-CD2 3.47Å; E22-H26 PolarHBondContact O-N 3.15Å; L24-H26 PolarHBondContact O-N 3.47Å; H26-L28 HydrophobicContact CB-CD1 4.12Å; H26-L28 HydrophobicContact CB-CG 3.88Å; H26-L28 PolarHBondContact O-N 2.95Å
27	N	94.8	Very high	95.7	Very high	147 Å²	147	85.1 Å²	85.1	79%	0.786	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	27.7	-177.1	-58.5	-76.8	0	0	0	113.8	M23 L24 A25 L29	M23-N27 PolarHBondContact O-N 3.06Å; L24-N27 PolarHBondContact O-N 3.2Å; A25-N27 VanDerWaalsContact C-N 3.28Å; A25-N27 PolarHBondContact O-N 3.29Å; N27-L29 VanDerWaalsContact C-N 3.32Å
28	L	96.5	Very high	95.7	Very high	121 Å²	121	81 Å²	81	63%	0.634	44%	0.437	S	S	*	.			trans	-80.6	-18.1	175.9	-57.2	179	0	0	0	111.9	M23 H26	M23-L28 HydrophobicContact CB-CB 4.29Å; M23-L28 HydrophobicContact CG-CD1 4.44Å; M23-L28 WeakPolarHBondContact O-CB 3.44Å; M23-L28 PolarHBondContact O-N 3.28Å; H26-L28 HydrophobicContact CB-CD1 4.12Å; H26-L28 HydrophobicContact CB-CG 3.88Å; H26-L28 PolarHBondContact O-N 2.95Å
29	L	94.5	Very high	95.7	Very high	35 Å²	35	79.4 Å²	79.4	18%	0.183	43%	0.429	C	S	.	.	S	Bend	trans	-123.2	142.7	178	-64.2	177.2	0	0	0	110.6	L20 M23 L24 N27 M33	L20-L29 HydrophobicContact CD2-CD1 3.76Å; M23-L29 HydrophobicContact CB-CD1 3.64Å; M23-L29 HydrophobicContact CB-CG 3.87Å; M23-L29 HydrophobicContact CE-CD1 4.03Å; M23-L29 HydrophobicContact CE-CD2 3.81Å; M23-L29 HydrophobicContact CE-CG 3.87Å; M23-L29 HydrophobicContact CG-CD1 4.49Å; M23-L29 HydrophobicContact SD-CD1 4.08Å; L24-L29 HydrophobicContact CD2-CB 3.85Å; L24-L29 HydrophobicContact CG-CB 4.3Å; N27-L29 VanDerWaalsContact C-N 3.32Å; L29-M33 HydrophobicContact CB-CB 4.39Å; L29-M33 HydrophobicContact CD2-CG 4.18Å
30	Q	93.4	Very high	95.7	Very high	148 Å²	148	82.9 Å²	82.9	69%	0.692	44%	0.436	S	S	*	.			trans	-68	142.9	168.5	-171.8	179.5	17.1	0	0	109.8	G32 M33	Q30-G32 PolarHBondContact O-N 3.03Å; Q30-M33 VanDerWaalsContact O-CB 3.25Å; Q30-M33 WeakPolarHBondContact O-CB 3.5Å; Q30-M33 PolarHBondContact O-N 3.09Å
31	P	90	Very high	95.7	Very high	117 Å²	117	83.4 Å²	83.4	76%	0.76	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	130.6	172.7	-28.4	35.2	0	0	0	112.3
32	G	92	Very high	95.7	Very high	39 Å²	39	79.8 Å²	79.8	40%	0.402	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	-5.9	-179.3	0	0	0	0	0	115.2	Q30 D34 H35	Q30-G32 PolarHBondContact O-N 3.03Å; G32-D34 VanDerWaalsContact C-OD1 3.25Å; G32-D34 WeakPolarHBondContact CA-OD1 3.3Å; G32-D34 PolarHBondContact N-OD1 3.31Å; G32-H35 PolarHBondContact O-N 3.47Å
33	M	95.1	Very high	95.6	Very high	71 Å²	71	77 Å²	77	35%	0.35	41%	0.406	S	S	.	.	H	α-helix	trans	-68.6	-38	172.8	-172.3	61.1	73.3	0	0	111.8	L29 Q30 H35 K36 V37	L29-M33 HydrophobicContact CB-CB 4.39Å; L29-M33 HydrophobicContact CD2-CG 4.18Å; Q30-M33 VanDerWaalsContact O-CB 3.25Å; Q30-M33 WeakPolarHBondContact O-CB 3.5Å; Q30-M33 PolarHBondContact O-N 3.09Å; M33-H35 VanDerWaalsContact C-N 3.27Å; M33-H35 PolarHBondContact O-N 3.11Å; M33-K36 WeakPolarHBondContact O-CB 3.28Å; M33-K36 PolarHBondContact O-N 3.37Å; M33-K36 VanDerWaalsContact O-N 3.08Å; M33-K36 HydrophobicContact SD-CB 4.48Å; M33-K36 HydrophobicContact SD-CD 4.2Å; M33-V37 WeakPolarHBondContact O-CG2 3.41Å; M33-V37 PolarHBondContact O-N 3.33Å
34	D	95.3	Very high	95.6	Very high	42 Å²	42	76.6 Å²	76.6	23%	0.225	41%	0.41	C	S	.	.	H	α-helix	trans	-50	-46.3	171.9	61.8	-53.8	0	0	0	111.9	L20 L24 G32 K36 V37 M38	L20-D34 HydrophobicContact CB-CB 4.22Å; L20-D34 HydrophobicContact CD1-CB 4.43Å; L24-D34 HydrophobicContact CD1-CB 3.71Å; L24-D34 HydrophobicContact CG-CB 4.48Å; G32-D34 VanDerWaalsContact C-OD1 3.25Å; G32-D34 WeakPolarHBondContact CA-OD1 3.3Å; G32-D34 PolarHBondContact N-OD1 3.31Å; D34-K36 VanDerWaalsContact C-N 3.34Å; D34-K36 PolarHBondContact O-N 3.36Å; D34-V37 PolarHBondContact O-N 2.83Å; D34-M38 WeakPolarHBondContact O-CG 3.37Å; D34-M38 PolarHBondContact O-N 2.91Å
35	H	95.3	Very high	95.7	Very high	91 Å²	91	76 Å²	76	42%	0.421	41%	0.406	S	S	.	.	H	α-helix	trans	-62.4	-41.3	178.6	-171	74.9	0	0	0	111.9	G32 M33 V37 M38 Q39	G32-H35 PolarHBondContact O-N 3.47Å; M33-H35 VanDerWaalsContact C-N 3.27Å; M33-H35 PolarHBondContact O-N 3.11Å; H35-V37 VanDerWaalsContact C-N 3.35Å; H35-V37 PolarHBondContact O-N 3.17Å; H35-M38 PolarHBondContact O-N 3.43Å; H35-Q39 PolarHBondContact CD2-NE2 2.85Å; H35-Q39 VanDerWaalsContact CD2-NE2 3.34Å; H35-Q39 PolarHBondContact NE2-NE2 3.01Å; H35-Q39 WeakPolarHBondContact O-CG 3.38Å; H35-Q39 PolarHBondContact O-N 3.1Å
36	K	96.3	Very high	95.6	Very high	133 Å²	133	73 Å²	73	58%	0.578	38%	0.381	S	S	*	.	H	α-helix	trans	-64.5	-39.8	176.4	-66	179.3	-178.4	173.9	0	111.6	M33 D34 Q39 K40	M33-K36 WeakPolarHBondContact O-CB 3.28Å; M33-K36 PolarHBondContact O-N 3.37Å; M33-K36 VanDerWaalsContact O-N 3.08Å; M33-K36 HydrophobicContact SD-CB 4.48Å; M33-K36 HydrophobicContact SD-CD 4.2Å; D34-K36 VanDerWaalsContact C-N 3.34Å; D34-K36 PolarHBondContact O-N 3.36Å; K36-Q39 PolarHBondContact O-N 3.05Å; K36-K40 PolarHBondContact O-N 3.01Å
37	V	97.6	Very high	95.5	Very high	52 Å²	52	69.4 Å²	69.4	32%	0.315	37%	0.366	S	S	.	.	H	α-helix	trans	-64.7	-43.5	175.8	178.1	0	0	0	0	110.5	L16 L20 M33 D34 H35 K40 F41	L16-V37 HydrophobicContact CD1-CG1 4.48Å; L20-V37 HydrophobicContact CD1-CB 4Å; L20-V37 HydrophobicContact CD1-CG1 3.9Å; L20-V37 HydrophobicContact CD2-CB 4.17Å; L20-V37 HydrophobicContact CD2-CG1 4.1Å; L20-V37 HydrophobicContact CD2-CG2 4.25Å; M33-V37 WeakPolarHBondContact O-CG2 3.41Å; M33-V37 PolarHBondContact O-N 3.33Å; D34-V37 PolarHBondContact O-N 2.83Å; H35-V37 VanDerWaalsContact C-N 3.35Å; H35-V37 PolarHBondContact O-N 3.17Å; V37-K40 CarbonylContact O-C 3.25Å; V37-K40 WeakPolarHBondContact O-CB 3.46Å; V37-K40 PolarHBondContact O-N 2.99Å; V37-K40 VanDerWaalsContact O-N 3.1Å; V37-F41 PolarHBondContact O-N 3.35Å
38	M	97.4	Very high	95.5	Very high	10 Å²	10	64 Å²	64	5%	0.049	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-41.6	177.3	-70.7	-53.3	-59.1	0	0	112.7	R8 L16 L20 D34 H35 K40 F41 D42	R8-M38 HydrophobicContact CB-CE 3.95Å; R8-M38 VanDerWaalsContact CD-CE 3.49Å; R8-M38 HydrophobicContact CG-CE 3.45Å; R8-M38 VanDerWaalsContact CG-CE 3.45Å; L16-M38 HydrophobicContact CD2-SD 3.89Å; L16-M38 HydrophobicContact CG-SD 4.05Å; L20-M38 HydrophobicContact CD1-CG 3.99Å; L20-M38 HydrophobicContact CD1-SD 3.83Å; D34-M38 WeakPolarHBondContact O-CG 3.37Å; D34-M38 PolarHBondContact O-N 2.91Å; H35-M38 PolarHBondContact O-N 3.43Å; M38-K40 VanDerWaalsContact C-N 3.26Å; M38-K40 PolarHBondContact O-N 3.14Å; M38-F41 HydrophobicContact CE-CD1 4.04Å; M38-F41 WeakPolarHBondContact O-CB 3.33Å; M38-F41 PolarHBondContact O-N 3.3Å; M38-D42 VanDerWaalsContact O-CG 3.22Å; M38-D42 PolarHBondContact O-N 3.22Å
39	Q	97	Very high	95.4	Very high	90 Å²	90	61.4 Å²	61.4	42%	0.421	33%	0.328	S	S	.	.	H	α-helix	trans	-59.4	-39.2	171.6	-73.5	-179.4	-13.1	0	0	111.6	H35 K36 D42 Q43	H35-Q39 PolarHBondContact CD2-NE2 2.85Å; H35-Q39 VanDerWaalsContact CD2-NE2 3.34Å; H35-Q39 PolarHBondContact NE2-NE2 3.01Å; H35-Q39 WeakPolarHBondContact O-CG 3.38Å; H35-Q39 PolarHBondContact O-N 3.1Å; K36-Q39 PolarHBondContact O-N 3.05Å; Q39-D42 PolarHBondContact O-N 3.22Å; Q39-Q43 WeakPolarHBondContact O-CG 3.35Å; Q39-Q43 PolarHBondContact O-N 2.65Å
40	K	97.2	Very high	95.3	Very high	117 Å²	117	62.8 Å²	62.8	51%	0.509	34%	0.344	S	S	.	.	H	α-helix	trans	-69	-38.4	176.8	-169	60.4	177.9	179.5	0	112	K36 V37 M38 D42 Q43 C44	K36-K40 PolarHBondContact O-N 3.01Å; V37-K40 CarbonylContact O-C 3.25Å; V37-K40 WeakPolarHBondContact O-CB 3.46Å; V37-K40 PolarHBondContact O-N 2.99Å; V37-K40 VanDerWaalsContact O-N 3.1Å; M38-K40 VanDerWaalsContact C-N 3.26Å; M38-K40 PolarHBondContact O-N 3.14Å; K40-D42 VanDerWaalsContact C-N 3.34Å; K40-D42 PolarHBondContact O-N 2.94Å; K40-Q43 VanDerWaalsContact NZ-OE1 3.15Å; K40-Q43 WeakPolarHBondContact O-CB 3.38Å; K40-Q43 PolarHBondContact O-N 3.32Å; K40-C44 PolarHBondContact O-N 3.23Å; K40-C44 PolarHBondContact O-SG 2.85Å; K40-C44 VanDerWaalsContact O-SG 3.34Å
41	F	98.2	Very high	95.3	Very high	22 Å²	22	62.8 Å²	62.8	10%	0.096	34%	0.342	C	S	.	.	H	α-helix	trans	-55.9	-48	173.2	165.3	-96.9	0	0	0	111.2	R8 L12 L16 V37 M38 Q43 C44 I45	R8-F41 HydrophobicContact CG-CD1 4.2Å; R8-F41 HydrophobicContact CG-CE1 4.12Å; L12-F41 HydrophobicContact CD2-CE2 4.02Å; L12-F41 HydrophobicContact CG-CE2 4.03Å; L16-F41 HydrophobicContact CD2-CB 3.75Å; L16-F41 HydrophobicContact CD2-CD2 3.71Å; L16-F41 HydrophobicContact CD2-CG 3.8Å; V37-F41 PolarHBondContact O-N 3.35Å; M38-F41 HydrophobicContact CE-CD1 4.04Å; M38-F41 WeakPolarHBondContact O-CB 3.33Å; M38-F41 PolarHBondContact O-N 3.3Å; F41-Q43 PolarHBondContact O-N 2.83Å; F41-C44 PolarHBondContact O-N 2.83Å; F41-I45 HydrophobicContact CD1-CG2 4.49Å; F41-I45 HydrophobicContact CE1-CG2 4.13Å; F41-I45 HydrophobicContact CE2-CB 4.24Å; F41-I45 HydrophobicContact CZ-CB 4.24Å; F41-I45 HydrophobicContact CZ-CG1 4.45Å; F41-I45 HydrophobicContact CZ-CG2 4.15Å; F41-I45 WeakPolarHBondContact O-CG2 3.18Å; F41-I45 PolarHBondContact O-N 2.83Å
42	D	97.4	Very high	95.6	Very high	7 Å²	7	67.3 Å²	67.3	4%	0.037	34%	0.344	C	S	.	.	H	α-helix	trans	-56.9	-37.4	179.7	-54.9	-35.4	0	0	0	111.9	R8 M38 Q39 K40 S46	R8-D42 WeakPolarHBondContact CG-OD1 3.41Å; R8-D42 IonicContact CZ-OD1 3.85Å; R8-D42 IonicContact CZ-OD2 3.3Å; R8-D42 VanDerWaalsContact CZ-OD2 3.3Å; R8-D42 IonicContact NE-OD1 2.95Å; R8-D42 PolarHBondContact NE-OD1 3.3Å; R8-D42 IonicContact NE-OD2 3.21Å; R8-D42 PolarHBondContact NE-OD2 3.19Å; R8-D42 IonicContact NH2-OD1 3.92Å; R8-D42 IonicContact NH2-OD2 2.65Å; R8-D42 PolarHBondContact NH2-OD2 3.34Å; M38-D42 VanDerWaalsContact O-CG 3.22Å; M38-D42 PolarHBondContact O-N 3.22Å; Q39-D42 PolarHBondContact O-N 3.22Å; K40-D42 VanDerWaalsContact C-N 3.34Å; K40-D42 PolarHBondContact O-N 2.94Å; D42-S46 VanDerWaalsContact O-CB 3.3Å; D42-S46 WeakPolarHBondContact O-CB 3.35Å; D42-S46 PolarHBondContact O-N 3.43Å; D42-S46 PolarHBondContact O-OG 3.18Å
43	Q	95.5	Very high	95.8	Very high	63 Å²	63	68.9 Å²	68.9	29%	0.294	35%	0.345	S	S	.	.	H	α-helix	trans	-67.2	-48.7	174.7	-58.5	177.7	9.1	0	0	112.3	Y3 Q39 K40 F41 N47	Y3-Q43 VanDerWaalsContact CD1-CA 3.45Å; Y3-Q43 HydrophobicContact CD1-CB 4.14Å; Y3-Q43 HydrophobicContact CD1-CG 4.09Å; Y3-Q43 HydrophobicContact CD2-CG 3.75Å; Y3-Q43 HydrophobicContact CE1-CB 3.85Å; Y3-Q43 HydrophobicContact CE1-CG 3.96Å; Y3-Q43 HydrophobicContact CE2-CB 4.42Å; Y3-Q43 HydrophobicContact CE2-CG 3.65Å; Y3-Q43 HydrophobicContact CG-CB 4.48Å; Y3-Q43 HydrophobicContact CG-CG 3.96Å; Q39-Q43 WeakPolarHBondContact O-CG 3.35Å; Q39-Q43 PolarHBondContact O-N 2.65Å; K40-Q43 VanDerWaalsContact NZ-OE1 3.15Å; K40-Q43 WeakPolarHBondContact O-CB 3.38Å; K40-Q43 PolarHBondContact O-N 3.32Å; F41-Q43 PolarHBondContact O-N 2.83Å; Q43-N47 WeakPolarHBondContact O-CB 3.22Å; Q43-N47 PolarHBondContact O-N 3.1Å; Q43-N47 VanDerWaalsContact O-N 3.12Å; Q43-N47 PolarHBondContact O-ND2 3.46Å
44	C	97.1	Very high	95.7	Very high	67 Å²	67	72.9 Å²	72.9	45%	0.453	36%	0.361	S	S	.	.	H	α-helix	trans	-65.2	-46.8	-175.4	-71.2	0	0	0	0	111.6	K40 F41 N47 A48	K40-C44 PolarHBondContact O-N 3.23Å; K40-C44 PolarHBondContact O-SG 2.85Å; K40-C44 VanDerWaalsContact O-SG 3.34Å; F41-C44 PolarHBondContact O-N 2.83Å; C44-N47 PolarHBondContact O-N 2.85Å; C44-A48 VanDerWaalsContact O-CB 3.3Å; C44-A48 WeakPolarHBondContact O-CB 3.31Å; C44-A48 PolarHBondContact O-N 2.8Å
45	I	97	Very high	95.6	Very high	29 Å²	29	75.3 Å²	75.3	15%	0.149	37%	0.374	C	S	.	.	H	α-helix	trans	-66.9	-43.9	-178.2	-169.4	59.6	0	0	0	111.6	Y7 L12 F41 N47 A48 L49	Y7-I45 HydrophobicContact CD2-CG2 3.74Å; Y7-I45 HydrophobicContact CG-CG1 4.19Å; Y7-I45 HydrophobicContact CG-CG2 3.96Å; L12-I45 HydrophobicContact CD2-CD1 4.28Å; F41-I45 HydrophobicContact CD1-CG2 4.49Å; F41-I45 HydrophobicContact CE1-CG2 4.13Å; F41-I45 HydrophobicContact CE2-CB 4.24Å; F41-I45 HydrophobicContact CZ-CB 4.24Å; F41-I45 HydrophobicContact CZ-CG1 4.45Å; F41-I45 HydrophobicContact CZ-CG2 4.15Å; F41-I45 WeakPolarHBondContact O-CG2 3.18Å; F41-I45 PolarHBondContact O-N 2.83Å; I45-N47 VanDerWaalsContact C-N 3.29Å; I45-N47 PolarHBondContact O-N 3.1Å; I45-A48 PolarHBondContact O-N 3.18Å; I45-L49 HydrophobicContact CD1-CD1 4.24Å; I45-L49 HydrophobicContact CD1-CG 4.1Å; I45-L49 HydrophobicContact CG1-CD1 4Å; I45-L49 HydrophobicContact CG1-CG 4.29Å; I45-L49 WeakPolarHBondContact O-CB 3.23Å; I45-L49 WeakPolarHBondContact O-CG 3.47Å; I45-L49 PolarHBondContact O-N 3.02Å
46	S	93.7	Very high	95.5	Very high	13 Å²	13	81.3 Å²	81.3	9%	0.091	39%	0.393	C	S	.	.	H	α-helix	trans	-60.1	-41	177.3	-59.1	0	0	0	0	111.6	D42 A50	D42-S46 VanDerWaalsContact O-CB 3.3Å; D42-S46 WeakPolarHBondContact O-CB 3.35Å; D42-S46 PolarHBondContact O-N 3.43Å; D42-S46 PolarHBondContact O-OG 3.18Å; S46-A50 VanDerWaalsContact O-CB 3.29Å; S46-A50 WeakPolarHBondContact O-CB 3.48Å; S46-A50 PolarHBondContact O-N 2.84Å; S46-A50 VanDerWaalsContact O-N 3.17Å
47	N	93.5	Very high	95.4	Very high	44 Å²	44	79.7 Å²	79.7	24%	0.235	39%	0.39	C	S	.	.	H	α-helix	trans	-70.8	-41.6	177.2	-79	-47.2	0	0	0	112.6	M1 Q43 C44 I45 K51	M1-N47 WeakPolarHBondContact CE-OD1 3.28Å; M1-N47 PolarHBondContact SD-OD1 3.03Å; M1-N47 VanDerWaalsContact SD-OD1 3.38Å; Q43-N47 WeakPolarHBondContact O-CB 3.22Å; Q43-N47 PolarHBondContact O-N 3.1Å; Q43-N47 VanDerWaalsContact O-N 3.12Å; Q43-N47 PolarHBondContact O-ND2 3.46Å; C44-N47 PolarHBondContact O-N 2.85Å; I45-N47 VanDerWaalsContact C-N 3.29Å; I45-N47 PolarHBondContact O-N 3.1Å; N47-K51 VanDerWaalsContact O-CB 3.29Å; N47-K51 WeakPolarHBondContact O-CB 3.45Å; N47-K51 WeakPolarHBondContact O-CG 3.27Å; N47-K51 PolarHBondContact O-N 3.22Å
48	A	96.1	Very high	95.3	Very high	34 Å²	34	80.7 Å²	80.7	28%	0.281	40%	0.399	S	S	.	.	H	α-helix	trans	-63.8	-48.7	179.7	0	0	0	0	0	111.1	C44 I45 A50 K51 R52	C44-A48 VanDerWaalsContact O-CB 3.3Å; C44-A48 WeakPolarHBondContact O-CB 3.31Å; C44-A48 PolarHBondContact O-N 2.8Å; I45-A48 PolarHBondContact O-N 3.18Å; A48-A50 PolarHBondContact O-N 3.48Å; A48-K51 PolarHBondContact O-N 3.19Å; A48-R52 VanDerWaalsContact O-CB 3.28Å; A48-R52 WeakPolarHBondContact O-CB 3.31Å; A48-R52 PolarHBondContact O-N 3.37Å
49	L	94.7	Very high	95.3	Very high	66 Å²	66	84.1 Å²	84.1	35%	0.346	42%	0.417	S	S	.	.	H	α-helix	trans	-60.1	-46.4	176.6	-67.5	176	0	0	0	111.4	Y7 I45 K51 V53	Y7-L49 HydrophobicContact CD1-CD1 4.1Å; Y7-L49 HydrophobicContact CE1-CD1 3.52Å; Y7-L49 HydrophobicContact CE2-CD1 4.27Å; I45-L49 HydrophobicContact CD1-CD1 4.24Å; I45-L49 HydrophobicContact CD1-CG 4.1Å; I45-L49 HydrophobicContact CG1-CD1 4Å; I45-L49 HydrophobicContact CG1-CG 4.29Å; I45-L49 WeakPolarHBondContact O-CB 3.23Å; I45-L49 WeakPolarHBondContact O-CG 3.47Å; I45-L49 PolarHBondContact O-N 3.02Å; L49-K51 PolarHBondContact O-N 2.83Å; L49-V53 HydrophobicContact CD2-CG2 3.96Å; L49-V53 WeakPolarHBondContact O-CB 3.18Å
50	A	91.4	Very high	95.3	Very high	64 Å²	64	88.9 Å²	88.9	53%	0.529	43%	0.431	S	S	.	.	H	α-helix	trans	-67.6	-37.4	-178.6	0	0	0	0	0	113.9	S46 A48	S46-A50 VanDerWaalsContact O-CB 3.29Å; S46-A50 WeakPolarHBondContact O-CB 3.48Å; S46-A50 PolarHBondContact O-N 2.84Å; S46-A50 VanDerWaalsContact O-N 3.17Å; A48-A50 PolarHBondContact O-N 3.48Å
51	K	93.7	Very high	95.3	Very high	148 Å²	148	84.7 Å²	84.7	64%	0.643	42%	0.421	S	S	*	.	H	α-helix	trans	-93.5	-40.4	-171.9	-66.7	-177.2	179.6	-177.8	0	113.3	N47 A48 L49 K54	N47-K51 VanDerWaalsContact O-CB 3.29Å; N47-K51 WeakPolarHBondContact O-CB 3.45Å; N47-K51 WeakPolarHBondContact O-CG 3.27Å; N47-K51 PolarHBondContact O-N 3.22Å; A48-K51 PolarHBondContact O-N 3.19Å; L49-K51 PolarHBondContact O-N 2.83Å; K51-K54 VanDerWaalsContact O-CE 3.3Å; K51-K54 WeakPolarHBondContact O-CE 3.47Å; K51-K54 PolarHBondContact O-NZ 3.34Å
52	R	96.9	Very high	95.3	Very high	212 Å²	212	89.6 Å²	89.6	80%	0.8	44%	0.444	S	S	*	.	H	α-helix	trans	-99.8	-28.7	-167.1	-58.7	-179.6	167.7	-173.3	-4.6	113.6	A48	A48-R52 VanDerWaalsContact O-CB 3.28Å; A48-R52 WeakPolarHBondContact O-CB 3.31Å; A48-R52 PolarHBondContact O-N 3.37Å
53	V	95.4	Very high	95.4	Very high	71 Å²	71	93.7 Å²	93.7	43%	0.43	47%	0.466	S	S	.	.			trans	-87.8	123.1	-177.7	-176.3	0	0	0	0	109.4	L49 N55	L49-V53 HydrophobicContact CD2-CG2 3.96Å; L49-V53 WeakPolarHBondContact O-CB 3.18Å; V53-N55 WeakPolarHBondContact CG1-OD1 3.32Å
54	K	94.1	Very high	95.5	Very high	155 Å²	155	94.8 Å²	94.8	67%	0.674	47%	0.474	S	S	*	.			trans	-125.3	-13.6	-177.3	-58.8	-61.1	175.6	-161.9	0	113.9	K51	K51-K54 VanDerWaalsContact O-CE 3.3Å; K51-K54 WeakPolarHBondContact O-CE 3.47Å; K51-K54 PolarHBondContact O-NZ 3.34Å
55	N	92.8	Very high	95.6	Very high	93 Å²	93	94.9 Å²	94.9	50%	0.497	47%	0.472	S	S	.	.			trans	-62.3	147.4	178.5	63.3	-51.3	0	0	0	110.5	V53	V53-N55 WeakPolarHBondContact CG1-OD1 3.32Å
56	R	92.5	Very high	95.6	Very high	218 Å²	218	100.9 Å²	100.9	82%	0.823	49%	0.494	S	S	*	.			trans	-118.7	132.7	177.9	-63.2	-180	67.7	119.6	0.7	108
57	L	94.7	Very high	95.8	Very high	99 Å²	99	107.9 Å²	107.9	52%	0.518	52%	0.518	S	S	.	.			trans	-110.8	147.9	177.4	-60.6	175.3	0	0	0	109.3	D84	L57-D84 HydrophobicContact CD2-CB 3.59Å
58	S	96	Very high	96	Very high	72 Å²	72	109.4 Å²	109.4	50%	0.503	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135.9	169	179.7	0	0	0	0	109.5	I82 K83	S58-I82 WeakPolarHBondContact O-CA 3.29Å; S58-K83 PolarHBondContact N-O 3.24Å; S58-K83 PolarHBondContact O-N 2.88Å
59	L	96.3	Very high	95.8	Very high	82 Å²	82	111.4 Å²	111.4	43%	0.429	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	131.2	179.8	-61.5	171.7	0	0	0	109.2	V80 E81 I82 I96	L59-V80 HydrophobicContact CD2-CG1 4.39Å; L59-E81 WeakPolarHBondContact CA-O 3.39Å; L59-I82 HydrophobicContact CD2-CB 4.02Å; L59-I82 HydrophobicContact CD2-CD1 4.11Å; L59-I82 HydrophobicContact CD2-CG1 3.59Å; L59-I82 HydrophobicContact CD2-CG2 3.78Å; L59-I96 HydrophobicContact CD1-CD1 4Å
60	R	97.2	Very high	95.7	Very high	191 Å²	191	115.2 Å²	115.2	72%	0.721	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-134.6	138.7	172.4	-174.6	-179.9	-176.6	-174.8	0.8	108.8	V80 E81	R60-V80 CarbonylContact O-C 3.45Å; R60-V80 VanDerWaalsContact O-CA 3.26Å; R60-V80 WeakPolarHBondContact O-CA 3.29Å; R60-E81 PolarHBondContact N-O 2.72Å; R60-E81 PolarHBondContact O-N 2.88Å
61	G	97.3	Very high	95.6	Very high	29 Å²	29	116.9 Å²	116.9	30%	0.299	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	172.4	-173.5	178	0	0	0	0	0	111.2	D79	G61-D79 WeakPolarHBondContact CA-O 3.3Å
62	H	98.2	Very high	95.5	Very high	124 Å²	124	112 Å²	112	57%	0.574	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	121.7	-179.5	-61.4	-62	0	0	0	110.9	N64 M77 N78 D79	H62-N64 PolarHBondContact O-N 2.79Å; H62-M77 CarbonylContact O-C 3.44Å; H62-M77 WeakPolarHBondContact O-CA 3.35Å; H62-M77 WeakPolarHBondContact O-CB 3.46Å; H62-N78 PolarHBondContact N-O 2.9Å; H62-N78 PolarHBondContact O-N 3.33Å; H62-D79 IonicContact CD2-OD2 3.7Å
63	L	98.5	Very high	95.5	Very high	94 Å²	94	107.8 Å²	107.8	49%	0.492	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	124.1	174.2	-175.5	65.1	0	0	0	110	Y66 L75 M77	L63-Y66 HydrophobicContact CD2-CD1 3.76Å; L63-Y66 HydrophobicContact CD2-CG 4.38Å; L63-Y66 HydrophobicContact CG-CD1 4.49Å; L63-L75 HydrophobicContact CD1-CB 4.11Å; L63-L75 HydrophobicContact CD1-CD2 4.14Å; L63-L75 HydrophobicContact CD1-CG 4.47Å; L63-M77 HydrophobicContact CD1-CG 3.97Å
64	N	98.1	Very high	95.6	Very high	86 Å²	86	105.8 Å²	105.8	46%	0.46	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-56.5	178.6	-176.8	-29	0	0	0	110.7	H62 V76 N78	H62-N64 PolarHBondContact O-N 2.79Å; N64-V76 WeakPolarHBondContact CA-O 3.44Å; N64-V76 HydrophobicContact CB-CG1 4.32Å; N64-V76 VanDerWaalsContact CB-O 3.3Å; N64-V76 WeakPolarHBondContact CB-O 3.16Å; N64-V76 PolarHBondContact N-O 2.79Å; N64-N78 PolarHBondContact ND2-ND2 3.03Å; N64-N78 VanDerWaalsContact ND2-ND2 3.1Å; N64-N78 PolarHBondContact ND2-OD1 3Å
65	T	98.6	Very high	95.8	Very high	68 Å²	68	100.6 Å²	100.6	42%	0.417	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	153.4	176	-179.1	0	0	0	0	110.3	V76	T65-V76 HydrophobicContact CG2-CB 3.67Å; T65-V76 HydrophobicContact CG2-CG2 3.74Å; T65-V76 PolarHBondContact N-O 2.9Å; T65-V76 PolarHBondContact O-N 2.91Å
66	Y	98.3	Very high	96.1	Very high	155 Å²	155	97.2 Å²	97.2	61%	0.608	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	155.6	173.6	64.1	-85.1	0	0	0	111.1	L63 W73 T74	L63-Y66 HydrophobicContact CD2-CD1 3.76Å; L63-Y66 HydrophobicContact CD2-CG 4.38Å; L63-Y66 HydrophobicContact CG-CD1 4.49Å; Y66-W73 HydrophobicContact CD2-CZ3 4.4Å; Y66-T74 CarbonylContact C-O 3.58Å; Y66-T74 VanDerWaalsContact CA-O 3.27Å; Y66-T74 WeakPolarHBondContact CA-O 3.32Å
67	R	98.2	Very high	96.3	Very high	160 Å²	160	88 Å²	88	60%	0.604	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.9	141.1	173.8	-172.4	-176.4	-58.8	129.9	2.7	109.3	W73 T74	R67-W73 CarbonylContact O-C 3.6Å; R67-W73 WeakPolarHBondContact O-CA 3.43Å; R67-T74 PolarHBondContact N-O 3.19Å; R67-T74 PolarHBondContact O-N 2.83Å
68	N	96.6	Very high	96.5	Very high	76 Å²	76	85.4 Å²	85.4	41%	0.406	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	125.5	163.6	-176.6	16.5	0	0	0	108.4	W73	N68-W73 HydrophobicContact CB-CD2 3.86Å; N68-W73 HydrophobicContact CB-CE3 3.79Å; N68-W73 HydrophobicContact CB-CH2 3.79Å; N68-W73 HydrophobicContact CB-CZ2 3.84Å; N68-W73 HydrophobicContact CB-CZ3 3.77Å; N68-W73 WeakPolarHBondContact ND2-CZ2 3.3Å
69	C	93.2	Very high	96.6	Very high	76 Å²	76	87 Å²	87	51%	0.514	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	132.7	175.5	-174.7	0	0	0	0	107.6	N71 V72	C69-N71 VanDerWaalsContact C-N 3.28Å; C69-N71 PolarHBondContact O-N 3.02Å; C69-V72 PolarHBondContact N-O 3.4Å; C69-V72 WeakPolarHBondContact O-CB 3.37Å; C69-V72 PolarHBondContact O-N 3.23Å
70	D	91.5	Very high	96.7	Very high	147 Å²	147	83.2 Å²	83.2	79%	0.786	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	41.7	-179.1	-56.1	-27.3	0	0	0	114.6	V72	D70-V72 PolarHBondContact O-N 2.9Å
71	N	88.8	Confident	96.8	Very high	98 Å²	98	77.5 Å²	77.5	52%	0.524	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	24.2	-176.9	-55.1	-34.6	0	0	0	114.2	C69 E100	C69-N71 VanDerWaalsContact C-N 3.28Å; C69-N71 PolarHBondContact O-N 3.02Å; N71-E100 HydrophobicContact CB-CB 4.31Å; N71-E100 PolarHBondContact O-N 3.36Å
72	V	92.5	Very high	96.7	Very high	46 Å²	46	77.4 Å²	77.4	28%	0.279	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	114.4	171.8	-175.2	0	0	0	0	109.3	C69 D70 V97 A98	C69-V72 PolarHBondContact N-O 3.4Å; C69-V72 WeakPolarHBondContact O-CB 3.37Å; C69-V72 PolarHBondContact O-N 3.23Å; D70-V72 PolarHBondContact O-N 2.9Å; V72-V97 HydrophobicContact CG1-CG1 3.74Å; V72-A98 WeakPolarHBondContact CA-O 3.35Å
73	W	96.3	Very high	96.7	Very high	123 Å²	123	76.9 Å²	76.9	47%	0.466	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	132	171.5	-74.5	92.9	0	0	0	110.3	Y66 R67 N68 L75 V97 A98	Y66-W73 HydrophobicContact CD2-CZ3 4.4Å; R67-W73 CarbonylContact O-C 3.6Å; R67-W73 WeakPolarHBondContact O-CA 3.43Å; N68-W73 HydrophobicContact CB-CD2 3.86Å; N68-W73 HydrophobicContact CB-CE3 3.79Å; N68-W73 HydrophobicContact CB-CH2 3.79Å; N68-W73 HydrophobicContact CB-CZ2 3.84Å; N68-W73 HydrophobicContact CB-CZ3 3.77Å; N68-W73 WeakPolarHBondContact ND2-CZ2 3.3Å; W73-L75 HydrophobicContact CB-CD1 4.02Å; W73-V97 CarbonylContact O-C 3.49Å; W73-V97 VanDerWaalsContact O-CA 3.31Å; W73-V97 WeakPolarHBondContact O-CA 3.4Å; W73-A98 HydrophobicContact CB-CB 4.33Å; W73-A98 PolarHBondContact N-O 3.34Å; W73-A98 PolarHBondContact O-N 3.24Å
74	T	97.6	Very high	96.4	Very high	29 Å²	29	75.1 Å²	75.1	18%	0.178	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.8	168.1	-59	0	0	0	0	108.9	Y66 R67 K95 I96 V97	Y66-T74 CarbonylContact C-O 3.58Å; Y66-T74 VanDerWaalsContact CA-O 3.27Å; Y66-T74 WeakPolarHBondContact CA-O 3.32Å; R67-T74 PolarHBondContact N-O 3.19Å; R67-T74 PolarHBondContact O-N 2.83Å; T74-K95 HydrophobicContact CG2-CG 4.41Å; T74-I96 CarbonylContact C-O 3.54Å; T74-I96 VanDerWaalsContact CA-O 3.28Å; T74-I96 WeakPolarHBondContact CA-O 3.26Å; T74-V97 HydrophobicContact CG2-CG2 4.48Å
75	L	98.4	Very high	95.9	Very high	46 Å²	46	76.3 Å²	76.3	24%	0.241	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	140.4	175.4	-56.9	83.5	0	0	0	108.7	L63 W73 K95 I96	L63-L75 HydrophobicContact CD1-CB 4.11Å; L63-L75 HydrophobicContact CD1-CD2 4.14Å; L63-L75 HydrophobicContact CD1-CG 4.47Å; W73-L75 HydrophobicContact CB-CD1 4.02Å; L75-K95 CarbonylContact O-C 3.55Å; L75-K95 WeakPolarHBondContact O-CA 2.95Å; L75-I96 HydrophobicContact CB-CB 4.27Å; L75-I96 HydrophobicContact CD1-CB 4.42Å; L75-I96 HydrophobicContact CD1-CG2 4.43Å; L75-I96 PolarHBondContact N-O 3.4Å; L75-I96 PolarHBondContact O-N 2.87Å
76	V	98.5	Very high	95.3	Very high	23 Å²	23	78.7 Å²	78.7	14%	0.139	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.4	167.4	-179.5	0	0	0	0	106.7	N64 T65 K93 I94 K95	N64-V76 WeakPolarHBondContact CA-O 3.44Å; N64-V76 HydrophobicContact CB-CG1 4.32Å; N64-V76 VanDerWaalsContact CB-O 3.3Å; N64-V76 WeakPolarHBondContact CB-O 3.16Å; N64-V76 PolarHBondContact N-O 2.79Å; T65-V76 HydrophobicContact CG2-CB 3.67Å; T65-V76 HydrophobicContact CG2-CG2 3.74Å; T65-V76 PolarHBondContact N-O 2.9Å; T65-V76 PolarHBondContact O-N 2.91Å; V76-K93 HydrophobicContact CG1-CD 4.4Å; V76-K93 HydrophobicContact CG1-CG 4.14Å; V76-I94 WeakPolarHBondContact CA-O 3.41Å; V76-K95 HydrophobicContact CG2-CG 4.45Å
77	M	98.5	Very high	95.1	Very high	23 Å²	23	73.4 Å²	73.4	11%	0.113	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.1	180	-57.1	167.5	62.2	0	0	109.6	H62 L63 V80 K93 I94 I96	H62-M77 CarbonylContact O-C 3.44Å; H62-M77 WeakPolarHBondContact O-CA 3.35Å; H62-M77 WeakPolarHBondContact O-CB 3.46Å; L63-M77 HydrophobicContact CD1-CG 3.97Å; M77-V80 HydrophobicContact CB-CG2 3.54Å; M77-V80 HydrophobicContact CE-CG2 4.36Å; M77-K93 CarbonylContact O-C 3.58Å; M77-K93 VanDerWaalsContact O-CA 3.31Å; M77-K93 WeakPolarHBondContact O-CA 3.49Å; M77-I94 HydrophobicContact CB-CG2 3.92Å; M77-I94 PolarHBondContact N-O 2.95Å; M77-I94 PolarHBondContact O-N 3.35Å; M77-I96 HydrophobicContact SD-CD1 3.83Å
78	N	98.5	Very high	94.9	Very high	46 Å²	46	70.8 Å²	70.8	25%	0.246	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	158.3	173.8	-52.7	-25.7	0	0	0	110	H62 N64 V80 D92	H62-N78 PolarHBondContact N-O 2.9Å; H62-N78 PolarHBondContact O-N 3.33Å; N64-N78 PolarHBondContact ND2-ND2 3.03Å; N64-N78 VanDerWaalsContact ND2-ND2 3.1Å; N64-N78 PolarHBondContact ND2-OD1 3Å; N78-V80 PolarHBondContact O-N 3.34Å; N78-D92 CarbonylContact C-O 3.46Å; N78-D92 WeakPolarHBondContact CA-O 3.35Å
79	D	98.2	Very high	94.9	Very high	105 Å²	105	72.8 Å²	72.8	56%	0.561	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.1	55.1	175.5	-47.2	-53.5	0	0	0	112.2	G61 H62 D92	G61-D79 WeakPolarHBondContact CA-O 3.3Å; H62-D79 IonicContact CD2-OD2 3.7Å; D79-D92 PolarHBondContact N-O 2.72Å
80	V	98.2	Very high	95.1	Very high	2 Å²	2	74.7 Å²	74.7	1%	0.012	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	123.6	-170.6	-179.7	0	0	0	0	110.5	L59 R60 M77 N78 I82 T90 V91 I94	L59-V80 HydrophobicContact CD2-CG1 4.39Å; R60-V80 CarbonylContact O-C 3.45Å; R60-V80 VanDerWaalsContact O-CA 3.26Å; R60-V80 WeakPolarHBondContact O-CA 3.29Å; M77-V80 HydrophobicContact CB-CG2 3.54Å; M77-V80 HydrophobicContact CE-CG2 4.36Å; N78-V80 PolarHBondContact O-N 3.34Å; V80-I82 HydrophobicContact CG1-CG1 3.93Å; V80-T90 CarbonylContact O-C 3.52Å; V80-T90 WeakPolarHBondContact O-CA 3.08Å; V80-V91 PolarHBondContact N-O 2.82Å; V80-V91 PolarHBondContact O-N 2.81Å; V80-I94 HydrophobicContact CB-CG2 4.26Å; V80-I94 HydrophobicContact CG1-CG2 4.26Å; V80-I94 HydrophobicContact CG2-CB 4.34Å; V80-I94 HydrophobicContact CG2-CG2 3.52Å
81	E	98.1	Very high	95.3	Very high	72 Å²	72	70 Å²	70	34%	0.336	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	120.4	164.5	-168.2	-172.9	133.5	0	0	109.8	L59 R60 I88	L59-E81 WeakPolarHBondContact CA-O 3.39Å; R60-E81 PolarHBondContact N-O 2.72Å; R60-E81 PolarHBondContact O-N 2.88Å; E81-I88 HydrophobicContact CG-CG2 3.39Å
82	I	97.1	Very high	95.8	Very high	27 Å²	27	71.7 Å²	71.7	14%	0.138	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	111.9	174.4	-48.2	-176.3	0	0	0	107.6	S58 L59 V80 M89 V91 I94	S58-I82 WeakPolarHBondContact O-CA 3.29Å; L59-I82 HydrophobicContact CD2-CB 4.02Å; L59-I82 HydrophobicContact CD2-CD1 4.11Å; L59-I82 HydrophobicContact CD2-CG1 3.59Å; L59-I82 HydrophobicContact CD2-CG2 3.78Å; V80-I82 HydrophobicContact CG1-CG1 3.93Å; I82-M89 HydrophobicContact CB-CB 4.36Å; I82-M89 PolarHBondContact N-O 2.91Å; I82-M89 PolarHBondContact O-N 2.98Å; I82-V91 HydrophobicContact CD1-CG2 4.02Å; I82-I94 HydrophobicContact CD1-CD1 4.18Å
83	K	96.3	Very high	96.1	Very high	113 Å²	113	75.8 Å²	75.8	49%	0.491	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119	176.6	-176.9	175.6	-176.9	175.4	0	110.4	S58 I88	S58-K83 PolarHBondContact N-O 3.24Å; S58-K83 PolarHBondContact O-N 2.88Å; K83-I88 HydrophobicContact CG-CG1 4.27Å
84	D	92.7	Very high	96.2	Very high	56 Å²	56	71.9 Å²	71.9	30%	0.299	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	166.2	164	-164.1	4.1	0	0	0	109.4	L57 S86 A87	L57-D84 HydrophobicContact CD2-CB 3.59Å; D84-S86 PolarHBondContact O-N 3.12Å; D84-A87 PolarHBondContact N-O 2.96Å; D84-A87 PolarHBondContact O-N 3.06Å; D84-A87 VanDerWaalsContact O-O 3.07Å
85	S	88.6	Confident	96.2	Very high	112 Å²	112	77.4 Å²	77.4	78%	0.783	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-31.4	-170.9	-55.1	0	0	0	0	113.9
86	S	86.2	Confident	96.1	Very high	118 Å²	118	77.3 Å²	77.3	83%	0.825	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.6	-0.8	-177.2	55.1	0	0	0	0	114.4	D84	D84-S86 PolarHBondContact O-N 3.12Å
87	A	92.7	Very high	96	Very high	44 Å²	44	79 Å²	79	36%	0.364	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	144.9	-171.5	0	0	0	0	0	112.1	D84	D84-A87 PolarHBondContact N-O 2.96Å; D84-A87 PolarHBondContact O-N 3.06Å; D84-A87 VanDerWaalsContact O-O 3.07Å
88	I	94.4	Very high	95.9	Very high	105 Å²	105	79.9 Å²	79.9	54%	0.538	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127	170	-61.5	174.3	0	0	0	106.9	E81 K83	E81-I88 HydrophobicContact CG-CG2 3.39Å; K83-I88 HydrophobicContact CG-CG1 4.27Å
89	M	96.2	Very high	95.6	Very high	117 Å²	117	79.3 Å²	79.3	58%	0.576	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	136.5	176.4	-58.4	174.9	66.2	0	0	108.8	I82	I82-M89 HydrophobicContact CB-CB 4.36Å; I82-M89 PolarHBondContact N-O 2.91Å; I82-M89 PolarHBondContact O-N 2.98Å
90	T	97.2	Very high	95	Very high	116 Å²	116	79 Å²	79	71%	0.712	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	142.9	175.1	53.4	0	0	0	0	110.4	V80	V80-T90 CarbonylContact O-C 3.52Å; V80-T90 WeakPolarHBondContact O-CA 3.08Å
91	V	97.5	Very high	94.2	Very high	49 Å²	49	81.1 Å²	81.1	30%	0.297	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	123.8	-179.4	-175.9	0	0	0	0	109.2	V80 I82 K93	V80-V91 PolarHBondContact N-O 2.82Å; V80-V91 PolarHBondContact O-N 2.81Å; I82-V91 HydrophobicContact CD1-CG2 4.02Å; V91-K93 WeakPolarHBondContact CG1-O 3.49Å; V91-K93 PolarHBondContact O-N 2.92Å
92	D	98.4	Very high	93	Very high	133 Å²	133	83.3 Å²	83.3	71%	0.711	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59	-35.3	-178.8	-59.9	-10.8	0	0	0	112.8	N78 D79	N78-D92 CarbonylContact C-O 3.46Å; N78-D92 WeakPolarHBondContact CA-O 3.35Å; D79-D92 PolarHBondContact N-O 2.72Å
93	K	98.1	Very high	91.4	Very high	132 Å²	132	89.4 Å²	89.4	57%	0.574	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.7	131.3	-179.1	-168.2	173.9	-174.2	175.2	0	112.6	V76 M77 V91	V76-K93 HydrophobicContact CG1-CD 4.4Å; V76-K93 HydrophobicContact CG1-CG 4.14Å; M77-K93 CarbonylContact O-C 3.58Å; M77-K93 VanDerWaalsContact O-CA 3.31Å; M77-K93 WeakPolarHBondContact O-CA 3.49Å; V91-K93 WeakPolarHBondContact CG1-O 3.49Å; V91-K93 PolarHBondContact O-N 2.92Å
94	I	97.9	Very high	89.5	Confident	41 Å²	41	86.5 Å²	86.5	21%	0.21	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	147.2	174.3	-162.1	174	0	0	0	111.2	V76 M77 V80 I82 I96	V76-I94 WeakPolarHBondContact CA-O 3.41Å; M77-I94 HydrophobicContact CB-CG2 3.92Å; M77-I94 PolarHBondContact N-O 2.95Å; M77-I94 PolarHBondContact O-N 3.35Å; V80-I94 HydrophobicContact CB-CG2 4.26Å; V80-I94 HydrophobicContact CG1-CG2 4.26Å; V80-I94 HydrophobicContact CG2-CB 4.34Å; V80-I94 HydrophobicContact CG2-CG2 3.52Å; I82-I94 HydrophobicContact CD1-CD1 4.18Å; I94-I96 HydrophobicContact CG2-CG1 4.42Å
95	K	98.1	Very high	87.7	Confident	146 Å²	146	92.7 Å²	92.7	64%	0.635	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.8	167.7	-179.2	-175.1	176.7	-174.3	0	109.3	T74 L75 V76 V97	T74-K95 HydrophobicContact CG2-CG 4.41Å; L75-K95 CarbonylContact O-C 3.55Å; L75-K95 WeakPolarHBondContact O-CA 2.95Å; V76-K95 HydrophobicContact CG2-CG 4.45Å; K95-V97 HydrophobicContact CD-CG2 4.41Å; K95-V97 HydrophobicContact CG-CG2 4.34Å
96	I	97.4	Very high	86.1	Confident	44 Å²	44	93 Å²	93	23%	0.226	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	125.1	175.4	-56	173.4	0	0	0	107.8	L59 T74 L75 M77 I94	L59-I96 HydrophobicContact CD1-CD1 4Å; T74-I96 CarbonylContact C-O 3.54Å; T74-I96 VanDerWaalsContact CA-O 3.28Å; T74-I96 WeakPolarHBondContact CA-O 3.26Å; L75-I96 HydrophobicContact CB-CB 4.27Å; L75-I96 HydrophobicContact CD1-CB 4.42Å; L75-I96 HydrophobicContact CD1-CG2 4.43Å; L75-I96 PolarHBondContact N-O 3.4Å; L75-I96 PolarHBondContact O-N 2.87Å; M77-I96 HydrophobicContact SD-CD1 3.83Å; I94-I96 HydrophobicContact CG2-CG1 4.42Å
97	V	96.7	Very high	84.7	Confident	58 Å²	58	93.6 Å²	93.6	35%	0.352	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	122.8	169.4	-178.1	0	0	0	0	107.2	M6 V72 W73 T74 K95	M6-V97 HydrophobicContact CE-CB 4.46Å; M6-V97 HydrophobicContact CE-CG1 4.35Å; M6-V97 VanDerWaalsContact CE-O 3.23Å; M6-V97 WeakPolarHBondContact CE-O 3.28Å; V72-V97 HydrophobicContact CG1-CG1 3.74Å; W73-V97 CarbonylContact O-C 3.49Å; W73-V97 VanDerWaalsContact O-CA 3.31Å; W73-V97 WeakPolarHBondContact O-CA 3.4Å; T74-V97 HydrophobicContact CG2-CG2 4.48Å; K95-V97 HydrophobicContact CD-CG2 4.41Å; K95-V97 HydrophobicContact CG-CG2 4.34Å
98	A	94.9	Very high	82.6	Confident	41 Å²	41	95.8 Å²	95.8	34%	0.339	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	122.8	-176.1	0	0	0	0	0	110.6	V72 W73	V72-A98 WeakPolarHBondContact CA-O 3.35Å; W73-A98 HydrophobicContact CB-CB 4.33Å; W73-A98 PolarHBondContact N-O 3.34Å; W73-A98 PolarHBondContact O-N 3.24Å
99	C	91.8	Very high	80.5	Confident	35 Å²	35	95.7 Å²	95.7	24%	0.236	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	154.5	171.1	-60.7	0	0	0	0	110.1	M6 G101	M6-C99 HydrophobicContact SD-CB 4.22Å; C99-G101 PolarHBondContact O-N 2.86Å
100	E	85.9	Confident	78	Confident	99 Å²	99	98.8 Å²	98.8	46%	0.463	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-56.7	123.3	174	-171.6	172.6	-165	0	0	112.1	N71 A104	N71-E100 HydrophobicContact CB-CB 4.31Å; N71-E100 PolarHBondContact O-N 3.36Å; E100-A104 HydrophobicContact CG-CB 3.89Å
101	G	82.5	Confident	75.8	Confident	45 Å²	45	100.1 Å²	100.1	46%	0.464	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-81.6	148.5	174.9	0	0	0	0	0	111.4	C99 N103 A104	C99-G101 PolarHBondContact O-N 2.86Å; G101-N103 PolarHBondContact O-N 3.17Å; G101-A104 WeakPolarHBondContact O-CB 3.3Å; G101-A104 PolarHBondContact O-N 2.77Å
102	K	71.7	Confident	73.2	Confident	118 Å²	118	103 Å²	103	51%	0.513	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.2	-15.9	-175.7	-54.2	-177.7	-154.4	149.5	0	116.3	M1	M1-K102 VanDerWaalsContact CE-NZ 3.31Å; M1-K102 PolarHBondContact SD-NZ 2.97Å
103	N	64.3	Low	71.2	Confident	156 Å²	156	102.5 Å²	102.5	83%	0.834	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	10.3	-179	-65.2	0.7	0	0	0	112.3	G101 K105	G101-N103 PolarHBondContact O-N 3.17Å; N103-K105 PolarHBondContact O-N 3.38Å
104	A	55.5	Low	68.8	Low	51 Å²	51	101.2 Å²	101.2	42%	0.421	58%	0.581	S	S	.	*			trans	-62.2	107.7	168.9	0	0	0	0	0	107.4	E100 G101	E100-A104 HydrophobicContact CG-CB 3.89Å; G101-A104 WeakPolarHBondContact O-CB 3.3Å; G101-A104 PolarHBondContact O-N 2.77Å
105	K	54.8	Low	66.5	Low	187 Å²	187	104 Å²	104	81%	0.813	60%	0.604	S	S	*	*			trans	-58	129.6	163	-67.3	-179	-179.6	179.9	0	105.3	N103 T107	N103-K105 PolarHBondContact O-N 3.38Å; K105-T107 PolarHBondContact O-N 2.85Å
106	P	56.3	Low	64.4	Low	119 Å²	119	105.1 Å²	105.1	77%	0.773	62%	0.615	S	S	*	*			trans	-57.2	114.3	175.4	22.8	-31.3	0	0	0	106.9	S108	P106-S108 PolarHBondContact O-N 2.84Å
107	T	56.1	Low	62.2	Low	129 Å²	129	108.1 Å²	108.1	79%	0.791	64%	0.64	S	S	*	*			trans	-67.5	88.9	170.4	47.5	0	0	0	0	106	K105 S109	K105-T107 PolarHBondContact O-N 2.85Å; T107-S109 VanDerWaalsContact C-N 3.28Å; T107-S109 PolarHBondContact O-N 2.9Å
108	S	49.5	Very low	59.8	Low	91 Å²	91	112.2 Å²	112.2	64%	0.636	66%	0.66	S	S	*	*			trans	-61	95.8	167.8	169.7	0	0	0	0	107	P106 K110	P106-S108 PolarHBondContact O-N 2.84Å; S108-K110 PolarHBondContact O-N 2.94Å
109	S	49.2	Very low	57.6	Low	102 Å²	102	122 Å²	122	71%	0.713	69%	0.688	S	S	*	*			trans	-66	80.5	165.7	-54.5	0	0	0	0	107.9	T107 I111	T107-S109 VanDerWaalsContact C-N 3.28Å; T107-S109 PolarHBondContact O-N 2.9Å; S109-I111 PolarHBondContact O-N 2.88Å
110	K	44.8	Very low	55.4	Low	182 Å²	182	125 Å²	125	79%	0.791	71%	0.71	S	S	*	*			trans	-69.5	88.7	164.2	-71.3	-172.9	-179.4	176.9	0	107.3	S108 S112	S108-K110 PolarHBondContact O-N 2.94Å; K110-S112 VanDerWaalsContact C-N 3.31Å; K110-S112 PolarHBondContact O-N 3.49Å; K110-S112 VanDerWaalsContact O-N 3.12Å
111	I	50	Low	53.7	Low	144 Å²	144	130.9 Å²	130.9	74%	0.738	73%	0.728	S	S	*	*			trans	-70.8	97.7	156.7	-62.8	173.7	0	0	0	105.2	S109 V113	S109-I111 PolarHBondContact O-N 2.88Å; I111-V113 HydrophobicContact CG2-CG2 3.87Å; I111-V113 PolarHBondContact O-N 3.45Å
112	S	44.2	Very low	52.1	Low	110 Å²	110	136.9 Å²	136.9	77%	0.769	75%	0.748	S	S	*	*			trans	-75.8	97	167.8	53.7	0	0	0	0	108.1	K110 S114	K110-S112 VanDerWaalsContact C-N 3.31Å; K110-S112 PolarHBondContact O-N 3.49Å; K110-S112 VanDerWaalsContact O-N 3.12Å; S112-S114 PolarHBondContact O-N 3.48Å
113	V	55	Low	50.9	Low	123 Å²	123	134.9 Å²	134.9	75%	0.745	76%	0.761	S	S	*	*			trans	-79.1	99.3	162.7	-175.1	0	0	0	0	106.4	I111 S115	I111-V113 HydrophobicContact CG2-CG2 3.87Å; I111-V113 PolarHBondContact O-N 3.45Å; V113-S115 PolarHBondContact O-N 2.83Å; V113-S115 VanDerWaalsContact O-N 3.15Å
114	S	47.9	Very low	50.1	Low	104 Å²	104	132.8 Å²	132.8	73%	0.727	77%	0.766	S	S	*	*			trans	-70.1	105.9	166.6	53.4	0	0	0	0	108.1	S112 I116	S112-S114 PolarHBondContact O-N 3.48Å; S114-I116 PolarHBondContact O-N 3.19Å
115	S	49.9	Very low	49.6	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	78%	0.78	S	S	*	*			trans	-54.6	119.2	169.5	36.5	0	0	0	0	110.6	V113 S117	V113-S115 PolarHBondContact O-N 2.83Å; V113-S115 VanDerWaalsContact O-N 3.15Å; S115-S117 PolarHBondContact O-N 3.23Å
116	I	54.2	Low	49.2	Very low	169 Å²	169	133.6 Å²	133.6	87%	0.867	79%	0.786	S	S	*	*			trans	-71.7	104.5	168.4	-64	167.4	0	0	0	106.8	S114	S114-I116 PolarHBondContact O-N 3.19Å
117	S	51.8	Low	48.6	Very low	107 Å²	107	131.4 Å²	131.4	75%	0.748	79%	0.786	S	S	*	*			trans	-89.5	105.4	167.8	16.1	0	0	0	0	109.3	S115 R119	S115-S117 PolarHBondContact O-N 3.23Å; S117-R119 PolarHBondContact O-N 2.96Å
118	D	45.3	Very low	47.8	Very low	143 Å²	143	128.6 Å²	128.6	77%	0.765	78%	0.782	S	S	*	*			trans	-49.1	123.6	167.7	-145.4	-30.1	0	0	0	111.3
119	R	48.7	Very low	47.7	Very low	246 Å²	246	132.9 Å²	132.9	93%	0.928	79%	0.792	S	S	*	*			trans	-132.1	84.1	168.8	-98.3	-173.3	176	-124.2	1.5	109.4	S117	S117-R119 PolarHBondContact O-N 2.96Å
120	S	46.4	Very low	47.7	Very low	99 Å²	99	134.9 Å²	134.9	69%	0.692	80%	0.795	S	S	*	*			trans	-71.9	125	155.1	52	0	0	0	0	109.6
121	R	49	Very low	47.8	Very low	223 Å²	223	133 Å²	133	84%	0.842	79%	0.794	S	S	*	*			trans	159.6	112.2	134.7	-89.7	177.8	-179.5	-171.6	0.3	112.7
122	L	50.5	Low	47.6	Very low	170 Å²	170	133.2 Å²	133.2	89%	0.89	79%	0.791	S	S	*	*				57.4	122	126.3	-60.1	165.6	0	0	0	119.6
123	G	44.9	Very low	47.7	Very low	76 Å²	76	135.2 Å²	135.2	78%	0.784	79%	0.789	S	S	*	*			trans	143	90.4	139.9	0	0	0	0	0	117.7
124	A	48.1	Very low	47.2	Very low	113 Å²	113	141.5 Å²	141.5	93%	0.934	80%	0.799	S	S	*	*			trans	47.3	132.3	133.4	0	0	0	0	0	123.5
125	G	44.7	Very low	47.2	Very low	71 Å²	71	145.4 Å²	145.4	73%	0.732	81%	0.806	S	S	*	*			trans	122.6	88.7	153.4	0	0	0	0	0	113.8
126	I	46.1	Very low	47.3	Very low	183 Å²	183	145.3 Å²	145.3	94%	0.938	81%	0.811	S	S	*	*				51.8	112.5	91.8	-51.9	-179.1	0	0	0	115
127	G	43.4	Very low	47.1	Very low	74 Å²	74	147.4 Å²	147.4	76%	0.763	81%	0.814	S	S	*	*			trans	137.6	117.5	140.5	0	0	0	0	0	118.1
128	G	40.4	Very low	47.4	Very low	70 Å²	70	149 Å²	149	72%	0.722	82%	0.815	S	S	*	*			trans	78.7	103.7	149.4	0	0	0	0	0	116.9
129	E	48.2	Very low	47.5	Very low	180 Å²	180	147.5 Å²	147.5	84%	0.841	82%	0.815	S	S	*	*				72.4	120.8	78.5	-76.6	-177.2	145.8	0	0	114.9
130	D	49	Very low	47.9	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	81%	0.807	S	S	*	*			trans	96.6	122	145.7	-53.1	-21.5	0	0	0	122.2
131	N	46.3	Very low	48.1	Very low	143 Å²	143	142.2 Å²	142.2	77%	0.765	82%	0.815	S	S	*	*				120.6	83.4	129.4	-136.8	30.5	0	0	0	117.3
132	E	45.9	Very low	48.4	Very low	147 Å²	147	141.2 Å²	141.2	69%	0.687	82%	0.82	S	S	*	*				46.2	136.3	116.5	-95.1	173.4	95.2	0	0	123.4
133	Q	46.4	Very low	49.1	Very low	152 Å²	152	141.7 Å²	141.7	71%	0.71	82%	0.819	S	S	*	*			trans	83.2	106.7	142.2	-68.3	171.3	17.9	0	0	119.4
134	R	43.5	Very low	49.7	Very low	256 Å²	256	150.9 Å²	150.9	97%	0.966	84%	0.842	S	S	*	*			trans	-141.5	123.6	141.5	-123	174.4	161.2	163.8	-4.7	110.3
135	E	48.4	Very low	49.8	Very low	185 Å²	185	152.8 Å²	152.8	86%	0.864	84%	0.837	S	S	*	*			trans	-71.1	158.7	-162.2	-65.5	170.5	133.4	0	0	115.1
136	A	51.4	Low	50	Low	99 Å²	99	157.1 Å²	157.1	82%	0.818	84%	0.843	S	S	*	*			trans	-74.2	148.2	178.4	0	0	0	0	0	112.7
137	F	49.9	Very low	50.2	Low	213 Å²	213	155.6 Å²	155.6	93%	0.934	84%	0.837	S	S	*	*			trans	-85.6	115.3	168.8	-151.1	-96.1	0	0	0	108.3
138	D	58	Low	50.6	Low	141 Å²	141	160.4 Å²	160.4	75%	0.754	84%	0.842	S	S	*	*			trans	-75.2	141.8	180	-174.8	27	0	0	0	111.4
139	S	48.9	Very low	51.3	Low	112 Å²	112	166.1 Å²	166.1	78%	0.783	85%	0.849	S	S	*	*			trans	-110	111	174.5	48.7	0	0	0	0	107.7
140	G	56.1	Low	51.5	Low	72 Å²	72	165.1 Å²	165.1	74%	0.742	85%	0.85	S	S	*	*			trans	-117.5	112.5	172.9	0	0	0	0	0	110.6
141	D	51.5	Low	51.7	Low	161 Å²	161	166.6 Å²	166.6	86%	0.861	86%	0.855	S	S	*	*			trans	-51	151.7	159.2	-68.7	-58	0	0	0	111.5
142	E	55.5	Low	52.1	Low	203 Å²	203	168.4 Å²	168.4	95%	0.949	86%	0.862	S	S	*	*				-169.1	153.4	123.7	-103.6	174.8	-177	0	0	112.5
143	M	63.6	Low	52.6	Low	180 Å²	180	170.2 Å²	170.2	89%	0.887	88%	0.877	S	S	*	*			trans	-91.1	139	-155.7	-174	-168.9	-57.4	0	0	112.3
144	E	58	Low	53.2	Low	268 Å²	268	171.8 Å²	171.8	100%	1.252	89%	0.892	S	S	*	*			trans	-158.7	0	141.4	-104.6	-174	170.5	0	0	110

Retrieved 144 of 144 residues in 261.3 ms (Link to these results)

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