G4VF55_SCHMA Loading...

RNA-binding protein 8A

Core component of the splicing-dependent multiprotein exon junction complex (EJC) deposited at splice junctions on mRNAs.

AlphaFold DB , UniProt , Accession G4VF55, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 143 aa.

						>G4VF55_SCHMA|G4VF55
MFLSPVDSVGTTKEGYESLVVDDGSSKSGPQRSVEGWILFVRNVQEEATEEDIRDKFCEYGDIKNIHLNLDRRTGYLKGYALVEYENFKEAFTAMEHLNGSELNGQRILVDWAFTKGPNPIKMSTKHRTRERSRSRSVDRARR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.7	Low	54.8	Low	244 Å²	244	141.3 Å²	141.3	100%	1.202	83%	0.828	S	S	*	*				0	147.5	0	-83.6	179.3	-178.2	0	0	108.7
2	F	49.6	Very low	54.7	Low	208 Å²	208	141.3 Å²	141.3	91%	0.912	83%	0.831	S	S	*	*			trans	-71	141.7	-155.6	-69	-100.5	0	0	0	115.2
3	L	49.7	Very low	54.9	Low	168 Å²	168	144.8 Å²	144.8	88%	0.88	83%	0.83	S	S	*	*			trans	-77.5	135.5	153.3	-85.5	149.2	0	0	0	108.5
4	S	61.5	Low	54.8	Low	117 Å²	117	148.6 Å²	148.6	82%	0.818	84%	0.837	S	S	*	*			trans	-143.7	113.4	154	52.3	0	0	0	0	109
5	P	61.4	Low	54.2	Low	118 Å²	118	143.3 Å²	143.3	77%	0.766	83%	0.828	S	S	*	*			trans	-90.5	148.4	166.3	11.6	6.8	0	0	0	110.7
6	V	60.1	Low	54.3	Low	125 Å²	125	147.3 Å²	147.3	76%	0.758	83%	0.827	S	S	*	*			trans	-172.4	141.9	167.4	82.1	0	0	0	0	107.8
7	D	54.3	Low	54.6	Low	153 Å²	153	149.8 Å²	149.8	82%	0.818	83%	0.831	S	S	*	*			cis	-153.8	169.4	-24.5	-106.4	-36.1	0	0	0	107.7
8	S	57.5	Low	54.8	Low	101 Å²	101	146.5 Å²	146.5	71%	0.706	82%	0.82	S	S	*	*			trans	-63.7	157.1	-176.7	-155	0	0	0	0	117.2
9	V	52.6	Low	55.2	Low	135 Å²	135	147.1 Å²	147.1	82%	0.818	82%	0.82	S	S	*	*			trans	77.3	129.7	134.1	138.6	0	0	0	0	121
10	G	49.5	Very low	55.3	Low	71 Å²	71	146.9 Å²	146.9	73%	0.732	82%	0.822	S	S	*	*			trans	-171.6	70.7	165.5	0	0	0	0	0	113.2
11	T	52.2	Low	55.5	Low	114 Å²	114	146.5 Å²	146.5	70%	0.699	82%	0.823	S	S	*	*			trans	18.8	111.3	150.1	-44.3	0	0	0	0	118.6	K13	T11-K13 HydrophobicContact CG2-CG 4.35Å; T11-K13 PolarHBondContact O-N 2.93Å
12	T	53.1	Low	55.7	Low	141 Å²	141	140.4 Å²	140.4	87%	0.865	80%	0.796	S	S	*	*			trans	-70.7	104.9	157.6	49.1	0	0	0	0	108.9
13	K	57.9	Low	55.9	Low	188 Å²	188	137.6 Å²	137.6	82%	0.817	79%	0.79	S	S	*	*			trans	-81.1	123.4	159.3	-77.7	-176.6	175.4	174.9	0	107.2	T11 G15	T11-K13 HydrophobicContact CG2-CG 4.35Å; T11-K13 PolarHBondContact O-N 2.93Å; K13-G15 PolarHBondContact O-N 2.97Å
14	E	53.5	Low	55.9	Low	198 Å²	198	132 Å²	132	93%	0.925	77%	0.773	S	S	*	*			trans	-55.8	103.9	170.2	-60.1	-154.9	149.1	0	0	109
15	G	45.5	Very low	55.6	Low	68 Å²	68	130.4 Å²	130.4	70%	0.701	76%	0.762	S	S	*	*			trans	-83.2	115.9	171	0	0	0	0	0	107.7	K13 E17	K13-G15 PolarHBondContact O-N 2.97Å; G15-E17 PolarHBondContact O-N 2.86Å
16	Y	55.4	Low	55.2	Low	208 Å²	208	130.4 Å²	130.4	82%	0.816	76%	0.764	S	S	*	*			trans	-59.2	122.4	159.1	56.3	-85	0	0	0	107.2	S18	Y16-S18 PolarHBondContact O-N 2.71Å
17	E	59.9	Low	55.2	Low	190 Å²	190	132.4 Å²	132.4	89%	0.888	76%	0.763	S	S	*	*			trans	-68.2	106.3	175.8	-165.1	167.9	161.5	0	0	107.9	G15 L19	G15-E17 PolarHBondContact O-N 2.86Å; E17-L19 PolarHBondContact O-N 2.95Å
18	S	58.5	Low	56.3	Low	90 Å²	90	130.2 Å²	130.2	63%	0.629	76%	0.759	S	S	*	*			trans	-65.2	124.4	176.5	-179.8	0	0	0	0	108.8	Y16 V20	Y16-S18 PolarHBondContact O-N 2.71Å; S18-V20 PolarHBondContact O-N 2.99Å; S18-V20 VanDerWaalsContact O-N 3.11Å
19	L	61.6	Low	57.8	Low	157 Å²	157	126.3 Å²	126.3	82%	0.822	74%	0.735	S	S	*	*			trans	-55.7	119.1	170.7	-66.7	173.3	0	0	0	109.2	E17 V21	E17-L19 PolarHBondContact O-N 2.95Å; L19-V21 PolarHBondContact O-N 3.05Å; L19-V21 VanDerWaalsContact O-N 3.08Å
20	V	58.5	Low	59.8	Low	144 Å²	144	121.4 Å²	121.4	87%	0.873	71%	0.706	S	S	*	*			trans	-62.7	108.3	170.8	-78.2	0	0	0	0	108.7	S18 D22	S18-V20 PolarHBondContact O-N 2.99Å; S18-V20 VanDerWaalsContact O-N 3.11Å; V20-D22 PolarHBondContact O-N 2.79Å
21	V	58.3	Low	61.9	Low	139 Å²	139	122.1 Å²	122.1	84%	0.842	69%	0.69	S	S	*	*			trans	-75.7	101.2	169.3	-75.4	0	0	0	0	108.2	L19 D23	L19-V21 PolarHBondContact O-N 3.05Å; L19-V21 VanDerWaalsContact O-N 3.08Å; V21-D23 PolarHBondContact O-N 2.86Å
22	D	59.1	Low	64	Low	116 Å²	116	121.2 Å²	121.2	62%	0.62	67%	0.674	S	S	*	*			trans	-53.5	123.6	175.3	-176.2	48.2	0	0	0	110.8	V20 G24 K116	V20-D22 PolarHBondContact O-N 2.79Å; D22-G24 PolarHBondContact O-N 3.18Å; D22-K116 IonicContact OD2-NZ 2.74Å; D22-K116 PolarHBondContact OD2-NZ 3.46Å
23	D	53.9	Low	66	Low	148 Å²	148	115.7 Å²	115.7	79%	0.791	64%	0.642	S	S	*	*			trans	-74.8	106.6	-173.8	-177.7	53.8	0	0	0	111.4	V21 S25	V21-D23 PolarHBondContact O-N 2.86Å; D23-S25 PolarHBondContact O-N 2.72Å
24	G	50.2	Low	67.8	Low	51 Å²	51	113.2 Å²	113.2	53%	0.526	64%	0.642	S	S	.	*	S	Bend		72.4	-0.8	128.7	0	0	0	0	0	120.9	D22	D22-G24 PolarHBondContact O-N 3.18Å
25	S	54.4	Low	69.7	Low	83 Å²	83	109 Å²	109	58%	0.58	62%	0.622	S	S	*	*			trans	-106.9	117.9	176.1	86.5	0	0	0	0	112.9	D23 K27	D23-S25 PolarHBondContact O-N 2.72Å; S25-K27 PolarHBondContact O-N 2.92Å
26	S	52.6	Low	72.2	Confident	118 Å²	118	105.8 Å²	105.8	83%	0.825	59%	0.589	S	S	*	*			trans	-55.3	79.6	-170.6	-54.3	0	0	0	0	116.7
27	K	61.8	Low	74.2	Confident	168 Å²	168	97.9 Å²	97.9	73%	0.73	56%	0.558	S	S	*	*			trans	-127.2	100	168.8	-62.5	-174.3	-176.2	177.5	0	110	S25 G29	S25-K27 PolarHBondContact O-N 2.92Å; K27-G29 VanDerWaalsContact C-N 3.33Å; K27-G29 PolarHBondContact O-N 2.79Å
28	S	77.2	Confident	76.1	Confident	106 Å²	106	89.9 Å²	89.9	74%	0.741	52%	0.52	S	S	*	.			trans	-56.6	100.9	163.9	175.9	0	0	0	0	107.2
29	G	87.7	Confident	78	Confident	19 Å²	19	85.6 Å²	85.6	20%	0.196	49%	0.49	C	S	.	.			trans	-137.2	172.6	-176.7	0	0	0	0	0	110.1	K27 T115 K116	K27-G29 VanDerWaalsContact C-N 3.33Å; K27-G29 PolarHBondContact O-N 2.79Å; G29-T115 CarbonylContact O-C 3.5Å; G29-T115 VanDerWaalsContact O-CA 3.31Å; G29-T115 WeakPolarHBondContact O-CA 3.3Å; G29-K116 PolarHBondContact O-N 3.12Å
30	P	94.8	Very high	79.7	Confident	33 Å²	33	80.9 Å²	80.9	21%	0.214	46%	0.464	C	S	.	.	B	Isolated β-bridge	trans	-60.1	141.7	179.2	23.9	-32.1	0	0	0	111.7	W37 F88 W112	P30-W37 HydrophobicContact CB-CE3 4.2Å; P30-W37 HydrophobicContact CB-CZ3 3.86Å; P30-W37 HydrophobicContact CG-CZ3 4.18Å; P30-F88 HydrophobicContact CB-CE2 4.29Å; P30-F88 HydrophobicContact CG-CE2 3.52Å; P30-F88 HydrophobicContact CG-CZ 4.11Å; P30-W112 HydrophobicContact CB-CB 4.3Å; P30-W112 HydrophobicContact CB-CD2 3.4Å; P30-W112 VanDerWaalsContact CB-CE2 3.48Å; P30-W112 HydrophobicContact CB-CE3 3.88Å; P30-W112 HydrophobicContact CB-CG 3.6Å; P30-W112 HydrophobicContact CB-CH2 4.43Å; P30-W112 HydrophobicContact CB-CZ2 4Å; P30-W112 HydrophobicContact CB-CZ3 4.39Å; P30-W112 HydrophobicContact CG-CD2 4.21Å; P30-W112 HydrophobicContact CG-CZ2 3.98Å
31	Q	95.1	Very high	81.7	Confident	85 Å²	85	74 Å²	74	40%	0.397	42%	0.422	S	S	.	.			trans	-108.5	125.3	176.1	176.4	57.7	59.1	0	0	108.7	F114 K116	Q31-F114 HydrophobicContact CB-CB 3.92Å; Q31-F114 HydrophobicContact CG-CB 4.35Å; Q31-F114 PolarHBondContact N-O 2.84Å; Q31-K116 HydrophobicContact CB-CG 4.31Å
32	R	95.3	Very high	83.6	Confident	96 Å²	96	71.9 Å²	71.9	36%	0.362	40%	0.399	S	S	.	.			trans	-66	138.3	173.3	-161.7	-178.6	-178.2	-84.2	3.6	109.7	V34 G36 W37	R32-V34 PolarHBondContact NH1-O 3.03Å; R32-G36 WeakPolarHBondContact CG-O 3.1Å; R32-W37 HydrophobicContact CB-CD2 4.14Å; R32-W37 HydrophobicContact CB-CE3 4.19Å; R32-W37 HydrophobicContact CB-CH2 3.91Å; R32-W37 HydrophobicContact CB-CZ2 3.83Å; R32-W37 HydrophobicContact CB-CZ3 4.07Å; R32-W37 HydrophobicContact CG-CD2 3.98Å; R32-W37 HydrophobicContact CG-CG 4.36Å; R32-W37 HydrophobicContact CG-CZ2 3.98Å
33	S	95.5	Very high	85.4	Confident	25 Å²	25	70.3 Å²	70.3	18%	0.175	39%	0.39	C	S	.	.			trans	-77.1	-174.3	168	-59.3	0	0	0	0	110.4	E35 G36 I38 F114	S33-E35 PolarHBondContact O-N 2.94Å; S33-G36 WeakPolarHBondContact CA-O 3.41Å; S33-G36 WeakPolarHBondContact CB-O 3.5Å; S33-G36 PolarHBondContact N-O 3.26Å; S33-I38 WeakPolarHBondContact OG-CD1 3.18Å; S33-I38 WeakPolarHBondContact OG-CG1 3.19Å; S33-F114 WeakPolarHBondContact OG-CD2 3.42Å; S33-F114 VanDerWaalsContact OG-CE2 3.23Å; S33-F114 WeakPolarHBondContact OG-CE2 3.34Å
34	V	94.5	Very high	87.6	Confident	135 Å²	135	63.5 Å²	63.5	82%	0.818	35%	0.354	S	S	*	.	S	Bend	trans	-55.7	-43.9	177.8	-175.6	0	0	0	0	110.8	R32	R32-V34 PolarHBondContact NH1-O 3.03Å
35	E	94.1	Very high	89.8	Confident	110 Å²	110	63.2 Å²	63.2	51%	0.514	34%	0.339	S	S	.	.	S	Bend	trans	-125.7	3.7	-162.6	-91.1	-161.5	-156.6	0	0	114.9	S33 K64 E84	S33-E35 PolarHBondContact O-N 2.94Å; E35-K64 VanDerWaalsContact CB-NZ 3.32Å; E35-K64 PolarHBondContact O-NZ 3.33Å; E35-K64 WeakPolarHBondContact OE2-CE 3.21Å; E35-K64 IonicContact OE2-NZ 3.67Å; E35-K64 PolarHBondContact OE2-NZ 3.32Å; E35-E84 VanDerWaalsContact C-OE1 3.3Å
36	G	97.3	Very high	91.9	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.336	C	S	.	.	S	Bend	trans	172.1	-164.6	-175.6	0	0	0	0	0	113.6	R32 S33 E84 Y85	R32-G36 WeakPolarHBondContact CG-O 3.1Å; S33-G36 WeakPolarHBondContact CA-O 3.41Å; S33-G36 WeakPolarHBondContact CB-O 3.5Å; S33-G36 PolarHBondContact N-O 3.26Å; G36-E84 WeakPolarHBondContact CA-OE1 3.19Å; G36-E84 PolarHBondContact N-OE1 3.11Å; G36-Y85 CarbonylContact C-O 3.52Å; G36-Y85 WeakPolarHBondContact CA-O 3.43Å
37	W	98.3	Very high	94	Very high	43 Å²	43	64.6 Å²	64.6	16%	0.163	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121.8	179.2	-60.4	86.6	0	0	0	108.7	P30 R32 E84 Y85 F88 A91 W112	P30-W37 HydrophobicContact CB-CE3 4.2Å; P30-W37 HydrophobicContact CB-CZ3 3.86Å; P30-W37 HydrophobicContact CG-CZ3 4.18Å; R32-W37 HydrophobicContact CB-CD2 4.14Å; R32-W37 HydrophobicContact CB-CE3 4.19Å; R32-W37 HydrophobicContact CB-CH2 3.91Å; R32-W37 HydrophobicContact CB-CZ2 3.83Å; R32-W37 HydrophobicContact CB-CZ3 4.07Å; R32-W37 HydrophobicContact CG-CD2 3.98Å; R32-W37 HydrophobicContact CG-CG 4.36Å; R32-W37 HydrophobicContact CG-CZ2 3.98Å; W37-E84 WeakPolarHBondContact O-CA 3.41Å; W37-Y85 PolarHBondContact N-O 3.12Å; W37-Y85 PolarHBondContact O-N 2.82Å; W37-F88 VanDerWaalsContact CD1-N 3.29Å; W37-F88 HydrophobicContact CD2-CB 4.14Å; W37-F88 AromaticContact CD2-CD2 3.7Å; W37-F88 HydrophobicContact CD2-CD2 3.7Å; W37-F88 HydrophobicContact CD2-CG 4.42Å; W37-F88 AromaticContact CE2-CD2 3.76Å; W37-F88 AromaticContact CE3-CD2 3.62Å; W37-F88 HydrophobicContact CE3-CD2 3.62Å; W37-F88 HydrophobicContact CE3-CE2 4.22Å; W37-F88 HydrophobicContact CG-CB 4.43Å; W37-F88 HydrophobicContact CG-CD2 4.44Å; W37-F88 AromaticContact CH2-CD2 3.67Å; W37-F88 HydrophobicContact CH2-CD2 3.67Å; W37-F88 HydrophobicContact CH2-CE2 4.28Å; W37-F88 HydrophobicContact CH2-CG 4.34Å; W37-F88 HydrophobicContact CZ2-CB 3.8Å; W37-F88 AromaticContact CZ2-CD2 3.75Å; W37-F88 HydrophobicContact CZ2-CD2 3.75Å; W37-F88 HydrophobicContact CZ2-CG 4.07Å; W37-F88 AromaticContact CZ3-CD2 3.61Å; W37-F88 HydrophobicContact CZ3-CD2 3.61Å; W37-F88 HydrophobicContact CZ3-CE2 4.01Å; W37-A91 HydrophobicContact CB-CB 3.79Å; W37-W112 HydrophobicContact CB-CZ3 3.94Å; W37-W112 HydrophobicContact CE3-CZ3 4.18Å
38	I	98.6	Very high	95.7	Very high	21 Å²	21	56.9 Å²	56.9	11%	0.108	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.9	-171.1	-55.1	-173	0	0	0	109.3	S33 L82 V83 E84 A113 F114	S33-I38 WeakPolarHBondContact OG-CD1 3.18Å; S33-I38 WeakPolarHBondContact OG-CG1 3.19Å; I38-L82 HydrophobicContact CG2-CB 3.87Å; I38-L82 HydrophobicContact CG2-CD2 4.05Å; I38-L82 HydrophobicContact CG2-CG 4.44Å; I38-V83 WeakPolarHBondContact CA-O 3.23Å; I38-E84 HydrophobicContact CD1-CG 4.45Å; I38-E84 HydrophobicContact CG1-CB 4.03Å; I38-E84 HydrophobicContact CG1-CG 3.88Å; I38-A113 HydrophobicContact CB-CB 3.87Å; I38-A113 HydrophobicContact CG2-CB 3.65Å; I38-A113 VanDerWaalsContact O-CB 3.28Å; I38-A113 WeakPolarHBondContact O-CB 3.3Å; I38-A113 PolarHBondContact O-N 2.77Å; I38-F114 HydrophobicContact CD1-CE2 4.13Å
39	L	98.8	Very high	96.7	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	137.4	170.2	-57.3	-176.5	0	0	0	109.7	F57 L82 V83 Y85 A91 A94 M95 V110 D111 W112	L39-F57 HydrophobicContact CD1-CE1 4.23Å; L39-L82 WeakPolarHBondContact O-CA 3.4Å; L39-V83 PolarHBondContact N-O 3.45Å; L39-V83 PolarHBondContact O-N 3.21Å; L39-Y85 HydrophobicContact CD1-CD2 4.44Å; L39-Y85 HydrophobicContact CD1-CE2 3.98Å; L39-A91 WeakPolarHBondContact CD1-O 3.43Å; L39-A91 HydrophobicContact CD2-CB 4.18Å; L39-A91 HydrophobicContact CG-CB 4.32Å; L39-A94 HydrophobicContact CD1-CB 3.88Å; L39-M95 HydrophobicContact CD1-CB 4.17Å; L39-M95 HydrophobicContact CD2-CB 3.86Å; L39-M95 HydrophobicContact CD2-CG 4.39Å; L39-V110 HydrophobicContact CB-CG1 4.06Å; L39-V110 HydrophobicContact CD1-CG1 3.93Å; L39-V110 HydrophobicContact CG-CG1 4.43Å; L39-D111 CarbonylContact C-O 3.56Å; L39-D111 WeakPolarHBondContact CA-O 3.28Å; L39-W112 HydrophobicContact CD2-CD2 4.18Å; L39-W112 HydrophobicContact CD2-CE3 3.57Å; L39-W112 HydrophobicContact CD2-CH2 4.36Å; L39-W112 HydrophobicContact CD2-CZ3 3.64Å
40	F	98.7	Very high	97.1	Very high	59 Å²	59	59.4 Å²	59.4	26%	0.259	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	111.1	171.4	-176.5	-137.8	0	0	0	109.4	R42 Y80 L82 D111 A113	F40-R42 HydrophobicContact CD1-CG 3.72Å; F40-R42 VanDerWaalsContact CE1-CD 3.48Å; F40-R42 HydrophobicContact CE1-CG 3.39Å; F40-R42 HydrophobicContact CE2-CG 4.32Å; F40-R42 HydrophobicContact CG-CG 4.33Å; F40-R42 HydrophobicContact CZ-CG 3.72Å; F40-Y80 HydrophobicContact CD2-CD2 4.37Å; F40-Y80 HydrophobicContact CE2-CD1 4.49Å; F40-Y80 AromaticContact CE2-CD2 3.61Å; F40-Y80 HydrophobicContact CE2-CD2 3.61Å; F40-Y80 HydrophobicContact CE2-CE2 4.37Å; F40-Y80 AromaticContact CE2-CG 3.67Å; F40-Y80 HydrophobicContact CE2-CG 3.67Å; F40-Y80 HydrophobicContact CZ-CG 4.29Å; F40-L82 HydrophobicContact CB-CD2 4.32Å; F40-L82 HydrophobicContact CD2-CD2 3.7Å; F40-L82 HydrophobicContact CG-CD2 4.44Å; F40-D111 PolarHBondContact N-O 3.08Å; F40-D111 PolarHBondContact O-N 3.34Å; F40-D111 VanDerWaalsContact O-N 3.13Å; F40-A113 HydrophobicContact CB-CB 4.11Å
41	V	98.8	Very high	97.3	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	116.8	-179.1	-170.9	0	0	0	0	107.8	V44 F57 Y80 A81 V83 I108 L109 V110	V41-V44 HydrophobicContact CB-CG2 4.34Å; V41-V44 HydrophobicContact CG1-CG2 3.8Å; V41-F57 HydrophobicContact CB-CZ 4.37Å; V41-F57 HydrophobicContact CG1-CE2 4.36Å; V41-F57 HydrophobicContact CG1-CZ 4.04Å; V41-F57 HydrophobicContact CG2-CE1 3.89Å; V41-F57 HydrophobicContact CG2-CE2 4.11Å; V41-F57 HydrophobicContact CG2-CZ 3.38Å; V41-Y80 CarbonylContact O-C 3.56Å; V41-Y80 WeakPolarHBondContact O-CA 3.25Å; V41-Y80 VanDerWaalsContact O-CB 3.24Å; V41-Y80 WeakPolarHBondContact O-CB 3.46Å; V41-A81 HydrophobicContact CB-CB 4.18Å; V41-A81 PolarHBondContact N-O 3.13Å; V41-A81 PolarHBondContact O-N 3.09Å; V41-V83 HydrophobicContact CG2-CG2 4Å; V41-I108 HydrophobicContact CG1-CB 4.07Å; V41-I108 HydrophobicContact CG1-CD1 4.07Å; V41-I108 HydrophobicContact CG1-CG2 4.29Å; V41-L109 CarbonylContact C-O 3.57Å; V41-L109 WeakPolarHBondContact CA-O 3.36Å; V41-V110 HydrophobicContact CG1-CG2 4.34Å
42	R	98.6	Very high	97.5	Very high	93 Å²	93	62.4 Å²	62.4	35%	0.351	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	163.1	179.3	-60.6	179.7	-71.2	-123.3	-4.1	111	F40 V44 I108 L109 D111	F40-R42 HydrophobicContact CD1-CG 3.72Å; F40-R42 VanDerWaalsContact CE1-CD 3.48Å; F40-R42 HydrophobicContact CE1-CG 3.39Å; F40-R42 HydrophobicContact CE2-CG 4.32Å; F40-R42 HydrophobicContact CG-CG 4.33Å; F40-R42 HydrophobicContact CZ-CG 3.72Å; R42-V44 VanDerWaalsContact C-N 3.29Å; R42-I108 WeakPolarHBondContact O-CA 3.48Å; R42-L109 HydrophobicContact CB-CB 4.29Å; R42-L109 PolarHBondContact N-O 3.24Å; R42-L109 PolarHBondContact O-N 2.76Å; R42-D111 IonicContact NH2-OD2 2.85Å
43	N	98.4	Very high	97.6	Very high	83 Å²	83	57.8 Å²	57.8	44%	0.444	29%	0.286	S	S	.	.	S	Bend	trans	62.8	38.3	-179.7	-161.4	52.9	0	0	0	112	G79 R107	N43-G79 PolarHBondContact N-O 3.25Å; N43-R107 PolarHBondContact ND2-O 2.99Å
44	V	98.4	Very high	97.8	Very high	5 Å²	5	63.1 Å²	63.1	3%	0.03	30%	0.302	C	S	.	.			trans	-76.7	136.1	171.9	179.4	0	0	0	0	108.2	V41 R42 A48 I53 L68 L77 G79 A81 L103	V41-V44 HydrophobicContact CB-CG2 4.34Å; V41-V44 HydrophobicContact CG1-CG2 3.8Å; R42-V44 VanDerWaalsContact C-N 3.29Å; V44-A48 HydrophobicContact CG1-CB 3.68Å; V44-I53 HydrophobicContact CG1-CD1 4.07Å; V44-I53 HydrophobicContact CG2-CD1 4.31Å; V44-L68 HydrophobicContact CG1-CD1 4.37Å; V44-L77 HydrophobicContact CG1-CD1 4.17Å; V44-G79 PolarHBondContact N-O 2.85Å; V44-G79 VanDerWaalsContact N-O 3.11Å; V44-G79 WeakPolarHBondContact O-CA 3.3Å; V44-A81 HydrophobicContact CG2-CB 4.4Å; V44-L103 HydrophobicContact CG1-CD2 4.39Å
45	Q	97.8	Very high	97.9	Very high	46 Å²	46	61 Å²	61	22%	0.215	29%	0.286	C	S	.	.			trans	-58.7	143.6	177.9	-166.7	-148.7	-2.6	0	0	111.2	E47 A48 N104 Q106	Q45-E47 PolarHBondContact O-N 2.85Å; Q45-E47 VanDerWaalsContact O-N 3.17Å; Q45-A48 HydrophobicContact CB-CB 4.3Å; Q45-A48 WeakPolarHBondContact O-CB 3.44Å; Q45-A48 PolarHBondContact O-N 2.84Å; Q45-A48 VanDerWaalsContact O-N 3.11Å; Q45-N104 HydrophobicContact CB-CB 4.25Å; Q45-N104 PolarHBondContact OE1-ND2 3.05Å; Q45-Q106 VanDerWaalsContact CB-OE1 3.26Å
46	E	97.2	Very high	98.1	Very high	111 Å²	111	59 Å²	59	52%	0.519	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-19	-175	76.2	-172.9	160.9	0	0	114.5	Y76 L77	E46-Y76 HydrophobicContact CB-CD1 4.44Å; E46-Y76 HydrophobicContact CB-CG 4.46Å; E46-Y76 HydrophobicContact CG-CD1 3.97Å; E46-Y76 HydrophobicContact CG-CG 4.28Å; E46-L77 PolarHBondContact O-N 2.91Å
47	E	96.5	Very high	98.2	Very high	118 Å²	118	59 Å²	59	55%	0.551	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	3.6	177.7	-58.6	-177.7	150.9	0	0	113.4	Q45 Y76	Q45-E47 PolarHBondContact O-N 2.85Å; Q45-E47 VanDerWaalsContact O-N 3.17Å; E47-Y76 HydrophobicContact CG-CD1 4.09Å; E47-Y76 HydrophobicContact CG-CE1 3.96Å
48	A	97.9	Very high	98.2	Very high	7 Å²	7	59.4 Å²	59.4	6%	0.058	29%	0.285	C	S	.	.			trans	-61.1	154.3	177	0	0	0	0	0	111.1	V44 Q45 L77	V44-A48 HydrophobicContact CG1-CB 3.68Å; Q45-A48 HydrophobicContact CB-CB 4.3Å; Q45-A48 WeakPolarHBondContact O-CB 3.44Å; Q45-A48 PolarHBondContact O-N 2.84Å; Q45-A48 VanDerWaalsContact O-N 3.11Å; A48-L77 HydrophobicContact CB-CD1 3.99Å; A48-L77 WeakPolarHBondContact O-CD1 3.42Å
49	T	97.7	Very high	98.1	Very high	65 Å²	65	66 Å²	66	40%	0.399	32%	0.315	S	S	.	.			trans	-110.6	165	179.4	64.8	0	0	0	0	111.1	E51 D52 I53	T49-E51 PolarHBondContact O-N 2.74Å; T49-E51 PolarHBondContact OG1-N 3.03Å; T49-D52 PolarHBondContact N-OD2 2.81Å; T49-D52 PolarHBondContact O-N 2.82Å; T49-D52 PolarHBondContact OG1-N 3.27Å; T49-D52 VanDerWaalsContact OG1-N 3.12Å; T49-D52 PolarHBondContact OG1-OD2 2.92Å; T49-I53 PolarHBondContact O-N 3.19Å
50	E	97.9	Very high	98.1	Very high	113 Å²	113	68.4 Å²	68.4	53%	0.528	33%	0.325	S	S	.	.	H	α-helix	trans	-61.8	-32.1	171	-170.7	175.7	124.5	0	0	111.5	I53 R54 I66 L68	E50-I53 PolarHBondContact O-N 3.25Å; E50-R54 VanDerWaalsContact O-CB 3.3Å; E50-R54 WeakPolarHBondContact O-CB 3.45Å; E50-R54 PolarHBondContact O-N 3.04Å; E50-I66 HydrophobicContact CG-CB 4.06Å; E50-I66 HydrophobicContact CG-CD1 3.92Å; E50-I66 HydrophobicContact CG-CG2 3.97Å; E50-L68 HydrophobicContact CB-CD2 4.49Å
51	E	98.2	Very high	98.1	Very high	132 Å²	132	66.3 Å²	66.3	62%	0.617	32%	0.32	S	S	*	.	H	α-helix	trans	-63.2	-45	174.8	-171.3	171.8	-170.7	0	0	111.4	T49 I53 R54 D55	T49-E51 PolarHBondContact O-N 2.74Å; T49-E51 PolarHBondContact OG1-N 3.03Å; E51-I53 VanDerWaalsContact C-N 3.29Å; E51-I53 PolarHBondContact O-N 3.18Å; E51-R54 PolarHBondContact O-N 2.77Å; E51-R54 VanDerWaalsContact O-N 3.12Å; E51-D55 WeakPolarHBondContact O-CB 3.28Å; E51-D55 PolarHBondContact O-N 3.32Å
52	D	98.2	Very high	98.1	Very high	48 Å²	48	73.1 Å²	73.1	26%	0.257	36%	0.356	S	S	.	.	H	α-helix	trans	-58.1	-41.6	176	-61	-49	0	0	0	112	T49 K56 L103 N104	T49-D52 PolarHBondContact N-OD2 2.81Å; T49-D52 PolarHBondContact O-N 2.82Å; T49-D52 PolarHBondContact OG1-N 3.27Å; T49-D52 VanDerWaalsContact OG1-N 3.12Å; T49-D52 PolarHBondContact OG1-OD2 2.92Å; D52-K56 WeakPolarHBondContact O-CB 3.31Å; D52-K56 PolarHBondContact O-N 3.4Å; D52-L103 HydrophobicContact CB-CD1 4.29Å; D52-N104 PolarHBondContact OD2-ND2 2.78Å
53	I	98.6	Very high	98.1	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-67.5	-47.7	175.8	-57.9	-64.4	0	0	0	110.1	V44 T49 E50 E51 D55 K56 F57 I66 L68 A81 V83 L103	V44-I53 HydrophobicContact CG1-CD1 4.07Å; V44-I53 HydrophobicContact CG2-CD1 4.31Å; T49-I53 PolarHBondContact O-N 3.19Å; E50-I53 PolarHBondContact O-N 3.25Å; E51-I53 VanDerWaalsContact C-N 3.29Å; E51-I53 PolarHBondContact O-N 3.18Å; I53-D55 PolarHBondContact O-N 3.1Å; I53-K56 PolarHBondContact O-N 2.91Å; I53-F57 HydrophobicContact CG2-CD2 4Å; I53-F57 HydrophobicContact CG2-CE2 4.4Å; I53-F57 WeakPolarHBondContact O-CB 3.37Å; I53-F57 VanDerWaalsContact O-CD2 3.25Å; I53-F57 WeakPolarHBondContact O-CD2 3.29Å; I53-F57 PolarHBondContact O-N 2.83Å; I53-I66 HydrophobicContact CB-CD1 4.49Å; I53-I66 HydrophobicContact CB-CG2 4.46Å; I53-I66 HydrophobicContact CG2-CD1 4.16Å; I53-I66 HydrophobicContact CG2-CG2 4.04Å; I53-L68 HydrophobicContact CG1-CD1 4.11Å; I53-L68 HydrophobicContact CG1-CD2 4.5Å; I53-A81 HydrophobicContact CD1-CB 4.23Å; I53-A81 HydrophobicContact CG1-CB 4.46Å; I53-V83 HydrophobicContact CG2-CG2 3.69Å; I53-L103 HydrophobicContact CD1-CD2 3.59Å
54	R	98.6	Very high	98	Very high	136 Å²	136	70.8 Å²	70.8	51%	0.513	35%	0.346	S	S	.	.	H	α-helix	trans	-59.2	-50.2	-178.5	-175.4	179.1	-179.3	-78.6	-4.8	111.1	E50 E51 K56 F57 C58 I63 I66	E50-R54 VanDerWaalsContact O-CB 3.3Å; E50-R54 WeakPolarHBondContact O-CB 3.45Å; E50-R54 PolarHBondContact O-N 3.04Å; E51-R54 PolarHBondContact O-N 2.77Å; E51-R54 VanDerWaalsContact O-N 3.12Å; R54-K56 VanDerWaalsContact C-N 3.28Å; R54-K56 PolarHBondContact O-N 2.86Å; R54-F57 PolarHBondContact O-N 3.48Å; R54-C58 WeakPolarHBondContact O-CB 3.25Å; R54-C58 PolarHBondContact O-N 3.35Å; R54-C58 PolarHBondContact O-SG 3.34Å; R54-I63 HydrophobicContact CG-CD1 4.22Å; R54-I66 HydrophobicContact CB-CD1 3.9Å
55	D	98.1	Very high	98	Very high	90 Å²	90	73.7 Å²	73.7	48%	0.481	36%	0.362	S	S	.	.	H	α-helix	trans	-62.1	-36.9	-178.2	-75	-2.9	0	0	0	112	E51 I53	E51-D55 WeakPolarHBondContact O-CB 3.28Å; E51-D55 PolarHBondContact O-N 3.32Å; I53-D55 PolarHBondContact O-N 3.1Å
56	K	98.1	Very high	98.1	Very high	68 Å²	68	72.2 Å²	72.2	30%	0.296	36%	0.355	S	S	.	.	H	α-helix	trans	-72	-37.1	178	-167.1	76.6	-175.7	-169	0	112.9	D52 I53 R54 L98 E102 L103	D52-K56 WeakPolarHBondContact O-CB 3.31Å; D52-K56 PolarHBondContact O-N 3.4Å; I53-K56 PolarHBondContact O-N 2.91Å; R54-K56 VanDerWaalsContact C-N 3.28Å; R54-K56 PolarHBondContact O-N 2.86Å; K56-L98 HydrophobicContact CD-CD2 4.36Å; K56-L98 HydrophobicContact CG-CD1 4.43Å; K56-L98 HydrophobicContact CG-CD2 4Å; K56-E102 WeakPolarHBondContact CE-O 3.44Å; K56-E102 PolarHBondContact NZ-O 2.83Å; K56-L103 HydrophobicContact CB-CD1 3.98Å; K56-L103 HydrophobicContact CD-CD1 4.23Å; K56-L103 HydrophobicContact CG-CD1 4.12Å
57	F	98.6	Very high	98.1	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-96.7	-21.4	-171.3	-79.9	-99.5	0	0	0	113.4	L39 V41 I53 R54 E59 Y60 I63 V83 Y85 A94 L98 I108 V110	L39-F57 HydrophobicContact CD1-CE1 4.23Å; V41-F57 HydrophobicContact CB-CZ 4.37Å; V41-F57 HydrophobicContact CG1-CE2 4.36Å; V41-F57 HydrophobicContact CG1-CZ 4.04Å; V41-F57 HydrophobicContact CG2-CE1 3.89Å; V41-F57 HydrophobicContact CG2-CE2 4.11Å; V41-F57 HydrophobicContact CG2-CZ 3.38Å; I53-F57 HydrophobicContact CG2-CD2 4Å; I53-F57 HydrophobicContact CG2-CE2 4.4Å; I53-F57 WeakPolarHBondContact O-CB 3.37Å; I53-F57 VanDerWaalsContact O-CD2 3.25Å; I53-F57 WeakPolarHBondContact O-CD2 3.29Å; I53-F57 PolarHBondContact O-N 2.83Å; R54-F57 PolarHBondContact O-N 3.48Å; F57-E59 PolarHBondContact O-N 3.33Å; F57-Y60 PolarHBondContact O-N 2.9Å; F57-I63 HydrophobicContact CB-CD1 3.66Å; F57-I63 HydrophobicContact CB-CG1 4.4Å; F57-V83 HydrophobicContact CB-CG1 4.24Å; F57-V83 HydrophobicContact CD1-CB 4.31Å; F57-V83 HydrophobicContact CD1-CG1 4.04Å; F57-V83 HydrophobicContact CD1-CG2 4.16Å; F57-V83 HydrophobicContact CD2-CG2 4.45Å; F57-V83 HydrophobicContact CE1-CG2 4.32Å; F57-V83 HydrophobicContact CG-CG1 4.26Å; F57-V83 HydrophobicContact CG-CG2 4.25Å; F57-Y85 WeakPolarHBondContact CB-OH 3.18Å; F57-Y85 PolarHBondContact O-OH 3.49Å; F57-A94 HydrophobicContact CD1-CB 4.44Å; F57-L98 HydrophobicContact CB-CD1 4.46Å; F57-L98 HydrophobicContact CD1-CD1 3.46Å; F57-L98 VanDerWaalsContact CD1-CD1 3.46Å; F57-L98 HydrophobicContact CD2-CD1 3.94Å; F57-L98 HydrophobicContact CE1-CD1 3.49Å; F57-L98 VanDerWaalsContact CE1-CD1 3.49Å; F57-L98 HydrophobicContact CE2-CD1 3.97Å; F57-L98 HydrophobicContact CG-CD1 3.69Å; F57-L98 HydrophobicContact CZ-CB 4.49Å; F57-L98 HydrophobicContact CZ-CD1 3.74Å; F57-I108 HydrophobicContact CE2-CD1 4.09Å; F57-I108 HydrophobicContact CZ-CD1 4.1Å; F57-V110 HydrophobicContact CE1-CG1 4.3Å; F57-V110 HydrophobicContact CE1-CG2 4.45Å; F57-V110 HydrophobicContact CZ-CG2 4.03Å
58	C	98.3	Very high	98.1	Very high	53 Å²	53	66.7 Å²	66.7	36%	0.358	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-70.1	-17.4	-174.2	68.1	0	0	0	0	114	R54 Y60 G61 I63	R54-C58 WeakPolarHBondContact O-CB 3.25Å; R54-C58 PolarHBondContact O-N 3.35Å; R54-C58 PolarHBondContact O-SG 3.34Å; C58-Y60 PolarHBondContact O-N 2.93Å; C58-G61 PolarHBondContact O-N 2.8Å; C58-I63 HydrophobicContact CB-CD1 4.18Å
59	E	97.8	Very high	98.1	Very high	160 Å²	160	69.9 Å²	69.9	75%	0.748	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-62.5	-22.4	175.7	-171	176.3	172.7	0	0	112.7	F57	F57-E59 PolarHBondContact O-N 3.33Å
60	Y	98.4	Very high	98.1	Very high	49 Å²	49	71.8 Å²	71.8	19%	0.192	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-99.9	-5.4	-173.9	-57	-81.1	0	0	0	114.5	F57 C58 E90 A94 H97 L98	F57-Y60 PolarHBondContact O-N 2.9Å; C58-Y60 PolarHBondContact O-N 2.93Å; Y60-E90 WeakPolarHBondContact O-CA 3.48Å; Y60-E90 VanDerWaalsContact O-CB 3.29Å; Y60-E90 WeakPolarHBondContact O-CB 3.4Å; Y60-E90 WeakPolarHBondContact O-CG 3.45Å; Y60-A94 HydrophobicContact CD1-CB 4.5Å; Y60-A94 HydrophobicContact CD2-CB 3.99Å; Y60-A94 HydrophobicContact CG-CB 3.78Å; Y60-H97 HydrophobicContact CE1-CB 3.53Å; Y60-H97 AromaticContact CE1-CG 3.77Å; Y60-H97 WeakPolarHBondContact OH-CB 3.35Å; Y60-L98 HydrophobicContact CD2-CD1 3.82Å; Y60-L98 HydrophobicContact CD2-CG 4.2Å; Y60-L98 HydrophobicContact CE2-CD1 3.52Å; Y60-L98 HydrophobicContact CE2-CD2 3.66Å; Y60-L98 HydrophobicContact CE2-CG 3.47Å; Y60-L98 VanDerWaalsContact CE2-CG 3.47Å
61	G	98	Very high	98.1	Very high	16 Å²	16	69 Å²	69	17%	0.165	34%	0.342	C	S	.	.	S	Bend	trans	155	175.3	-179	0	0	0	0	0	113.1	C58 I63	C58-G61 PolarHBondContact O-N 2.8Å; G61-I63 PolarHBondContact O-N 3Å
62	D	98.1	Very high	98	Very high	142 Å²	142	74.3 Å²	74.3	76%	0.759	36%	0.356	S	S	*	.			trans	-75.2	116.1	177.2	-69.9	-39.9	0	0	0	110.2	K64	D62-K64 PolarHBondContact O-N 3.5Å
63	I	98.5	Very high	98	Very high	39 Å²	39	81.7 Å²	81.7	20%	0.2	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	118.6	178	-58.1	169.9	0	0	0	108.7	R54 F57 C58 G61 I66 V83 Y85	R54-I63 HydrophobicContact CG-CD1 4.22Å; F57-I63 HydrophobicContact CB-CD1 3.66Å; F57-I63 HydrophobicContact CB-CG1 4.4Å; C58-I63 HydrophobicContact CB-CD1 4.18Å; G61-I63 PolarHBondContact O-N 3Å; I63-I66 HydrophobicContact CD1-CD1 4.29Å; I63-I66 HydrophobicContact CG2-CD1 4.05Å; I63-I66 HydrophobicContact CG2-CG1 3.57Å; I63-V83 HydrophobicContact CD1-CG1 4.45Å; I63-V83 HydrophobicContact CG1-CG1 4.28Å; I63-V83 HydrophobicContact CG2-CG1 3.93Å; I63-Y85 HydrophobicContact CG1-CE1 4.03Å
64	K	98.1	Very high	97.8	Very high	88 Å²	88	84.6 Å²	84.6	38%	0.383	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	-41.3	178.5	-179.2	170.2	179.9	159.9	0	112	E35 D62 E84	E35-K64 VanDerWaalsContact CB-NZ 3.32Å; E35-K64 PolarHBondContact O-NZ 3.33Å; E35-K64 WeakPolarHBondContact OE2-CE 3.21Å; E35-K64 IonicContact OE2-NZ 3.67Å; E35-K64 PolarHBondContact OE2-NZ 3.32Å; D62-K64 PolarHBondContact O-N 3.5Å; K64-E84 HydrophobicContact CB-CB 4.45Å; K64-E84 HydrophobicContact CB-CG 4.27Å; K64-E84 WeakPolarHBondContact CB-O 3.26Å; K64-E84 HydrophobicContact CD-CG 4.38Å; K64-E84 PolarHBondContact N-O 3.48Å
65	N	98.1	Very high	97.7	Very high	67 Å²	67	80.6 Å²	80.6	36%	0.358	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	150.1	-177.8	-159.9	3.6	0	0	0	111.7	H67 E84	N65-H67 PolarHBondContact ND2-NE2 2.96Å; N65-E84 HydrophobicContact CB-CB 4.13Å; N65-E84 PolarHBondContact O-N 3.38Å
66	I	98.6	Very high	97.7	Very high	15 Å²	15	81.3 Å²	81.3	8%	0.077	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	129.4	173.6	-58.6	174.8	0	0	0	108.3	E50 I53 R54 I63 L82	E50-I66 HydrophobicContact CG-CB 4.06Å; E50-I66 HydrophobicContact CG-CD1 3.92Å; E50-I66 HydrophobicContact CG-CG2 3.97Å; I53-I66 HydrophobicContact CB-CD1 4.49Å; I53-I66 HydrophobicContact CB-CG2 4.46Å; I53-I66 HydrophobicContact CG2-CD1 4.16Å; I53-I66 HydrophobicContact CG2-CG2 4.04Å; R54-I66 HydrophobicContact CB-CD1 3.9Å; I63-I66 HydrophobicContact CD1-CD1 4.29Å; I63-I66 HydrophobicContact CG2-CD1 4.05Å; I63-I66 HydrophobicContact CG2-CG1 3.57Å; I66-L82 CarbonylContact C-O 3.47Å; I66-L82 WeakPolarHBondContact CA-O 3.33Å
67	H	98.2	Very high	97.7	Very high	80 Å²	80	79 Å²	79	37%	0.37	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	115.7	168.8	-58.4	139.9	0	0	0	110.6	N65 A81 L82	N65-H67 PolarHBondContact ND2-NE2 2.96Å; H67-A81 CarbonylContact O-C 3.47Å; H67-A81 VanDerWaalsContact O-CA 3.25Å; H67-A81 WeakPolarHBondContact O-CA 3.45Å; H67-L82 HydrophobicContact CB-CB 4.08Å; H67-L82 HydrophobicContact CB-CD1 4.35Å; H67-L82 HydrophobicContact CB-CG 4.5Å; H67-L82 PolarHBondContact N-O 2.88Å; H67-L82 PolarHBondContact O-N 3.03Å
68	L	97.3	Very high	97.6	Very high	33 Å²	33	85.2 Å²	85.2	17%	0.173	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	92.7	-179.4	-158.4	65.8	0	0	0	109.3	V44 E50 I53 L77 A81	V44-L68 HydrophobicContact CG1-CD1 4.37Å; E50-L68 HydrophobicContact CB-CD2 4.49Å; I53-L68 HydrophobicContact CG1-CD1 4.11Å; I53-L68 HydrophobicContact CG1-CD2 4.5Å; L68-L77 HydrophobicContact CD1-CD1 3.73Å; L68-L77 HydrophobicContact CD1-CD2 4.46Å; L68-L77 HydrophobicContact CD2-CD1 3.68Å; L68-L77 HydrophobicContact CD2-CD2 3.99Å; L68-L77 HydrophobicContact CD2-CG 4.48Å; L68-L77 HydrophobicContact CG-CD1 3.6Å; L68-L77 HydrophobicContact CG-CD2 3.6Å; L68-L77 HydrophobicContact CG-CG 4.24Å; L68-A81 HydrophobicContact CD1-CB 3.63Å
69	N	97.4	Very high	97.6	Very high	73 Å²	73	83.8 Å²	83.8	39%	0.39	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	139.7	-168.8	-69.2	-27.2	0	0	0	112.6	K78 Y80	N69-K78 WeakPolarHBondContact O-CB 3.35Å; N69-K78 PolarHBondContact O-N 2.83Å; N69-Y80 PolarHBondContact ND2-OH 2.86Å
70	L	97.5	Very high	97.6	Very high	106 Å²	106	78.6 Å²	78.6	56%	0.555	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	144.6	175.2	-61.5	167.8	0	0	0	112.5	R72 Y76 L77	L70-R72 PolarHBondContact O-N 3.41Å; L70-Y76 CarbonylContact C-O 3.53Å; L70-Y76 WeakPolarHBondContact CA-O 3.35Å; L70-L77 HydrophobicContact CD2-CD2 3.7Å
71	D	97.4	Very high	97.7	Very high	53 Å²	53	76.3 Å²	76.3	28%	0.283	37%	0.373	S	S	.	.			trans	-74.9	110.2	156.9	-178	-20.3	0	0	0	108.6	R73 T74 G75 Y76	D71-R73 PolarHBondContact O-N 3.45Å; D71-R73 VanDerWaalsContact O-N 3.09Å; D71-R73 WeakPolarHBondContact OD1-CB 3.37Å; D71-R73 PolarHBondContact OD1-N 2.75Å; D71-R73 IonicContact OD2-NH2 3.45Å; D71-T74 PolarHBondContact O-N 3.42Å; D71-G75 PolarHBondContact O-N 2.85Å; D71-Y76 PolarHBondContact N-O 3.4Å
72	R	96.4	Very high	97.7	Very high	244 Å²	244	77.5 Å²	77.5	92%	0.921	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.4	-177.2	-61.6	-161.4	-62	-156.5	0.2	114.4	L70	L70-R72 PolarHBondContact O-N 3.41Å
73	R	97.2	Very high	97.7	Very high	204 Å²	204	70.8 Å²	70.8	77%	0.77	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-38.8	179.2	-178.6	-179.4	57	80.3	10.1	111.7	D71	D71-R73 PolarHBondContact O-N 3.45Å; D71-R73 VanDerWaalsContact O-N 3.09Å; D71-R73 WeakPolarHBondContact OD1-CB 3.37Å; D71-R73 PolarHBondContact OD1-N 2.75Å; D71-R73 IonicContact OD2-NH2 3.45Å
74	T	96.1	Very high	97.7	Very high	60 Å²	60	69.8 Å²	69.8	37%	0.368	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-25.8	-175.4	67	0	0	0	0	112.5	D71 Y76	D71-T74 PolarHBondContact O-N 3.42Å; T74-Y76 VanDerWaalsContact C-N 3.28Å; T74-Y76 WeakPolarHBondContact O-CD2 3.16Å; T74-Y76 PolarHBondContact OG1-N 2.87Å
75	G	96.6	Very high	97.8	Very high	53 Å²	53	65.6 Å²	65.6	55%	0.546	32%	0.316	S	S	.	.	S	Bend	trans	83.9	-1.2	-174.3	0	0	0	0	0	114.2	D71	D71-G75 PolarHBondContact O-N 2.85Å
76	Y	96.9	Very high	97.8	Very high	104 Å²	104	68 Å²	68	41%	0.408	33%	0.325	S	S	.	.	S	Bend	trans	-98.2	171.4	178.9	-65.8	-82.4	0	0	0	112.1	E46 E47 L70 D71 T74	E46-Y76 HydrophobicContact CB-CD1 4.44Å; E46-Y76 HydrophobicContact CB-CG 4.46Å; E46-Y76 HydrophobicContact CG-CD1 3.97Å; E46-Y76 HydrophobicContact CG-CG 4.28Å; E47-Y76 HydrophobicContact CG-CD1 4.09Å; E47-Y76 HydrophobicContact CG-CE1 3.96Å; L70-Y76 CarbonylContact C-O 3.53Å; L70-Y76 WeakPolarHBondContact CA-O 3.35Å; D71-Y76 PolarHBondContact N-O 3.4Å; T74-Y76 VanDerWaalsContact C-N 3.28Å; T74-Y76 WeakPolarHBondContact O-CD2 3.16Å; T74-Y76 PolarHBondContact OG1-N 2.87Å
77	L	97.7	Very high	97.7	Very high	20 Å²	20	71 Å²	71	11%	0.105	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	150.2	175.4	-61.3	-174.2	0	0	0	112.6	V44 E46 A48 L68 L70 G79	V44-L77 HydrophobicContact CG1-CD1 4.17Å; E46-L77 PolarHBondContact O-N 2.91Å; A48-L77 HydrophobicContact CB-CD1 3.99Å; A48-L77 WeakPolarHBondContact O-CD1 3.42Å; L68-L77 HydrophobicContact CD1-CD1 3.73Å; L68-L77 HydrophobicContact CD1-CD2 4.46Å; L68-L77 HydrophobicContact CD2-CD1 3.68Å; L68-L77 HydrophobicContact CD2-CD2 3.99Å; L68-L77 HydrophobicContact CD2-CG 4.48Å; L68-L77 HydrophobicContact CG-CD1 3.6Å; L68-L77 HydrophobicContact CG-CD2 3.6Å; L68-L77 HydrophobicContact CG-CG 4.24Å; L70-L77 HydrophobicContact CD2-CD2 3.7Å; L77-G79 PolarHBondContact O-N 2.77Å
78	K	97.6	Very high	97.7	Very high	131 Å²	131	71.3 Å²	71.3	57%	0.57	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	1	176.2	-164.4	164.1	172.4	-178.9	0	113.8	N69 Y80	N69-K78 WeakPolarHBondContact O-CB 3.35Å; N69-K78 PolarHBondContact O-N 2.83Å; K78-Y80 HydrophobicContact CB-CD1 4.09Å; K78-Y80 HydrophobicContact CB-CE1 3.8Å; K78-Y80 HydrophobicContact CD-CD1 4.46Å; K78-Y80 HydrophobicContact CD-CE1 3.5Å; K78-Y80 HydrophobicContact CG-CD1 4.02Å; K78-Y80 HydrophobicContact CG-CE1 3.53Å
79	G	97.8	Very high	97.7	Very high	22 Å²	22	77.3 Å²	77.3	23%	0.227	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	84.4	17.9	177.5	0	0	0	0	0	115.3	N43 V44 L77	N43-G79 PolarHBondContact N-O 3.25Å; V44-G79 PolarHBondContact N-O 2.85Å; V44-G79 VanDerWaalsContact N-O 3.11Å; V44-G79 WeakPolarHBondContact O-CA 3.3Å; L77-G79 PolarHBondContact O-N 2.77Å
80	Y	98.6	Very high	97.8	Very high	52 Å²	52	75.9 Å²	75.9	20%	0.204	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	158.3	174.3	68.7	-97.3	0	0	0	112.9	F40 V41 N69 K78	F40-Y80 HydrophobicContact CD2-CD2 4.37Å; F40-Y80 HydrophobicContact CE2-CD1 4.49Å; F40-Y80 AromaticContact CE2-CD2 3.61Å; F40-Y80 HydrophobicContact CE2-CD2 3.61Å; F40-Y80 HydrophobicContact CE2-CE2 4.37Å; F40-Y80 AromaticContact CE2-CG 3.67Å; F40-Y80 HydrophobicContact CE2-CG 3.67Å; F40-Y80 HydrophobicContact CZ-CG 4.29Å; V41-Y80 CarbonylContact O-C 3.56Å; V41-Y80 WeakPolarHBondContact O-CA 3.25Å; V41-Y80 VanDerWaalsContact O-CB 3.24Å; V41-Y80 WeakPolarHBondContact O-CB 3.46Å; N69-Y80 PolarHBondContact ND2-OH 2.86Å; K78-Y80 HydrophobicContact CB-CD1 4.09Å; K78-Y80 HydrophobicContact CB-CE1 3.8Å; K78-Y80 HydrophobicContact CD-CD1 4.46Å; K78-Y80 HydrophobicContact CD-CE1 3.5Å; K78-Y80 HydrophobicContact CG-CD1 4.02Å; K78-Y80 HydrophobicContact CG-CE1 3.53Å
81	A	98.7	Very high	97.9	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	155.9	171.1	0	0	0	0	0	111.3	V41 V44 I53 H67 L68	V41-A81 HydrophobicContact CB-CB 4.18Å; V41-A81 PolarHBondContact N-O 3.13Å; V41-A81 PolarHBondContact O-N 3.09Å; V44-A81 HydrophobicContact CG2-CB 4.4Å; I53-A81 HydrophobicContact CD1-CB 4.23Å; I53-A81 HydrophobicContact CG1-CB 4.46Å; H67-A81 CarbonylContact O-C 3.47Å; H67-A81 VanDerWaalsContact O-CA 3.25Å; H67-A81 WeakPolarHBondContact O-CA 3.45Å; L68-A81 HydrophobicContact CD1-CB 3.63Å
82	L	98.7	Very high	97.9	Very high	42 Å²	42	71.7 Å²	71.7	22%	0.22	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.3	163.9	-58.5	171.3	0	0	0	108.4	I38 L39 F40 I66 H67 A113	I38-L82 HydrophobicContact CG2-CB 3.87Å; I38-L82 HydrophobicContact CG2-CD2 4.05Å; I38-L82 HydrophobicContact CG2-CG 4.44Å; L39-L82 WeakPolarHBondContact O-CA 3.4Å; F40-L82 HydrophobicContact CB-CD2 4.32Å; F40-L82 HydrophobicContact CD2-CD2 3.7Å; F40-L82 HydrophobicContact CG-CD2 4.44Å; I66-L82 CarbonylContact C-O 3.47Å; I66-L82 WeakPolarHBondContact CA-O 3.33Å; H67-L82 HydrophobicContact CB-CB 4.08Å; H67-L82 HydrophobicContact CB-CD1 4.35Å; H67-L82 HydrophobicContact CB-CG 4.5Å; H67-L82 PolarHBondContact N-O 2.88Å; H67-L82 PolarHBondContact O-N 3.03Å; L82-A113 HydrophobicContact CD2-CB 4.21Å
83	V	98.8	Very high	98	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	120.8	178.3	-177.1	0	0	0	0	108.2	I38 L39 V41 I53 F57 I63 Y85	I38-V83 WeakPolarHBondContact CA-O 3.23Å; L39-V83 PolarHBondContact N-O 3.45Å; L39-V83 PolarHBondContact O-N 3.21Å; V41-V83 HydrophobicContact CG2-CG2 4Å; I53-V83 HydrophobicContact CG2-CG2 3.69Å; F57-V83 HydrophobicContact CB-CG1 4.24Å; F57-V83 HydrophobicContact CD1-CB 4.31Å; F57-V83 HydrophobicContact CD1-CG1 4.04Å; F57-V83 HydrophobicContact CD1-CG2 4.16Å; F57-V83 HydrophobicContact CD2-CG2 4.45Å; F57-V83 HydrophobicContact CE1-CG2 4.32Å; F57-V83 HydrophobicContact CG-CG1 4.26Å; F57-V83 HydrophobicContact CG-CG2 4.25Å; I63-V83 HydrophobicContact CD1-CG1 4.45Å; I63-V83 HydrophobicContact CG1-CG1 4.28Å; I63-V83 HydrophobicContact CG2-CG1 3.93Å; V83-Y85 HydrophobicContact CG1-CD2 4.41Å; V83-Y85 HydrophobicContact CG1-CE2 3.82Å
84	E	98.7	Very high	98.1	Very high	19 Å²	19	52.2 Å²	52.2	9%	0.089	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.1	-179.4	-174.1	169	-166.1	0	0	110.9	E35 G36 W37 I38 K64 N65	E35-E84 VanDerWaalsContact C-OE1 3.3Å; G36-E84 WeakPolarHBondContact CA-OE1 3.19Å; G36-E84 PolarHBondContact N-OE1 3.11Å; W37-E84 WeakPolarHBondContact O-CA 3.41Å; I38-E84 HydrophobicContact CD1-CG 4.45Å; I38-E84 HydrophobicContact CG1-CB 4.03Å; I38-E84 HydrophobicContact CG1-CG 3.88Å; K64-E84 HydrophobicContact CB-CB 4.45Å; K64-E84 HydrophobicContact CB-CG 4.27Å; K64-E84 WeakPolarHBondContact CB-O 3.26Å; K64-E84 HydrophobicContact CD-CG 4.38Å; K64-E84 PolarHBondContact N-O 3.48Å; N65-E84 HydrophobicContact CB-CB 4.13Å; N65-E84 PolarHBondContact O-N 3.38Å
85	Y	98.8	Very high	98.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	150.7	165.3	-64.3	-90.6	0	0	0	109.8	G36 W37 L39 F57 I63 V83 E90 A91 A94	G36-Y85 CarbonylContact C-O 3.52Å; G36-Y85 WeakPolarHBondContact CA-O 3.43Å; W37-Y85 PolarHBondContact N-O 3.12Å; W37-Y85 PolarHBondContact O-N 2.82Å; L39-Y85 HydrophobicContact CD1-CD2 4.44Å; L39-Y85 HydrophobicContact CD1-CE2 3.98Å; F57-Y85 WeakPolarHBondContact CB-OH 3.18Å; F57-Y85 PolarHBondContact O-OH 3.49Å; I63-Y85 HydrophobicContact CG1-CE1 4.03Å; V83-Y85 HydrophobicContact CG1-CD2 4.41Å; V83-Y85 HydrophobicContact CG1-CE2 3.82Å; Y85-E90 HydrophobicContact CD1-CB 3.78Å; Y85-E90 HydrophobicContact CE1-CB 4.35Å; Y85-E90 HydrophobicContact CG-CB 4.1Å; Y85-A91 HydrophobicContact CD2-CB 3.75Å; Y85-A91 HydrophobicContact CG-CB 4.24Å; Y85-A94 HydrophobicContact CE2-CB 3.96Å
86	E	98.1	Very high	98.3	Very high	117 Å²	117	53.5 Å²	53.5	55%	0.547	25%	0.251	S	S	.	.	S	Bend	trans	-69.2	-40.1	171.7	-175.6	168	-177.8	0	0	111.3
87	N	97.7	Very high	98.4	Very high	79 Å²	79	54.2 Å²	54.2	42%	0.422	26%	0.258	S	S	.	.	S	Bend	trans	-98.3	138.1	-171.1	-61.7	-54	0	0	0	113	K89 E90 A91	N87-K89 VanDerWaalsContact C-N 3.31Å; N87-K89 PolarHBondContact O-N 3.38Å; N87-E90 HydrophobicContact CB-CB 4.36Å; N87-E90 HydrophobicContact CB-CG 3.99Å; N87-E90 VanDerWaalsContact ND2-CD 3.35Å; N87-E90 PolarHBondContact ND2-OE1 2.65Å; N87-E90 PolarHBondContact ND2-OE2 3.03Å; N87-E90 PolarHBondContact O-N 3.33Å; N87-A91 PolarHBondContact O-N 3.36Å
88	F	97.8	Very high	98.4	Very high	85 Å²	85	53.5 Å²	53.5	37%	0.373	25%	0.254	S	S	.	.	H	α-helix	trans	-59.5	-43.1	176.6	176.3	-108.5	0	0	0	112	P30 W37 E90 A91 F92 W112	P30-F88 HydrophobicContact CB-CE2 4.29Å; P30-F88 HydrophobicContact CG-CE2 3.52Å; P30-F88 HydrophobicContact CG-CZ 4.11Å; W37-F88 VanDerWaalsContact CD1-N 3.29Å; W37-F88 HydrophobicContact CD2-CB 4.14Å; W37-F88 AromaticContact CD2-CD2 3.7Å; W37-F88 HydrophobicContact CD2-CD2 3.7Å; W37-F88 HydrophobicContact CD2-CG 4.42Å; W37-F88 AromaticContact CE2-CD2 3.76Å; W37-F88 AromaticContact CE3-CD2 3.62Å; W37-F88 HydrophobicContact CE3-CD2 3.62Å; W37-F88 HydrophobicContact CE3-CE2 4.22Å; W37-F88 HydrophobicContact CG-CB 4.43Å; W37-F88 HydrophobicContact CG-CD2 4.44Å; W37-F88 AromaticContact CH2-CD2 3.67Å; W37-F88 HydrophobicContact CH2-CD2 3.67Å; W37-F88 HydrophobicContact CH2-CE2 4.28Å; W37-F88 HydrophobicContact CH2-CG 4.34Å; W37-F88 HydrophobicContact CZ2-CB 3.8Å; W37-F88 AromaticContact CZ2-CD2 3.75Å; W37-F88 HydrophobicContact CZ2-CD2 3.75Å; W37-F88 HydrophobicContact CZ2-CG 4.07Å; W37-F88 AromaticContact CZ3-CD2 3.61Å; W37-F88 HydrophobicContact CZ3-CD2 3.61Å; W37-F88 HydrophobicContact CZ3-CE2 4.01Å; F88-E90 PolarHBondContact O-N 3.48Å; F88-A91 PolarHBondContact O-N 2.82Å; F88-F92 HydrophobicContact CE1-CB 4.23Å; F88-F92 HydrophobicContact CE1-CG 4.44Å; F88-F92 HydrophobicContact CE2-CB 4.5Å; F88-F92 HydrophobicContact CZ-CB 4.16Å; F88-F92 HydrophobicContact CZ-CD2 4.15Å; F88-F92 HydrophobicContact CZ-CG 4.35Å; F88-F92 VanDerWaalsContact O-CB 3.26Å; F88-F92 WeakPolarHBondContact O-CB 3.36Å; F88-F92 PolarHBondContact O-N 3.22Å; F88-W112 AromaticContact CD2-CH2 3.85Å; F88-W112 HydrophobicContact CD2-CH2 3.85Å; F88-W112 HydrophobicContact CD2-CZ2 4.29Å; F88-W112 AromaticContact CE2-CH2 3.57Å; F88-W112 HydrophobicContact CE2-CH2 3.57Å; F88-W112 AromaticContact CE2-CZ2 3.54Å; F88-W112 HydrophobicContact CE2-CZ2 3.54Å; F88-W112 HydrophobicContact CZ-CH2 4.46Å; F88-W112 HydrophobicContact CZ-CZ2 4.14Å
89	K	98.2	Very high	98.5	Very high	160 Å²	160	51 Å²	51	70%	0.696	25%	0.247	S	C	*	.	H	α-helix	trans	-62.5	-44.6	-174.3	-172.5	-178.6	176	-171.2	0	111.4	N87 F92 T93	N87-K89 VanDerWaalsContact C-N 3.31Å; N87-K89 PolarHBondContact O-N 3.38Å; K89-F92 PolarHBondContact O-N 3.31Å; K89-T93 WeakPolarHBondContact O-CG2 3.24Å; K89-T93 PolarHBondContact O-N 3.4Å; K89-T93 PolarHBondContact O-OG1 2.86Å
90	E	98.5	Very high	98.5	Very high	42 Å²	42	51.3 Å²	51.3	20%	0.196	25%	0.25	C	S	.	.	H	α-helix	trans	-62.3	-50.8	179	-65.8	167.6	-175.6	0	0	110.9	Y60 Y85 N87 F88 F92 T93 A94	Y60-E90 WeakPolarHBondContact O-CA 3.48Å; Y60-E90 VanDerWaalsContact O-CB 3.29Å; Y60-E90 WeakPolarHBondContact O-CB 3.4Å; Y60-E90 WeakPolarHBondContact O-CG 3.45Å; Y85-E90 HydrophobicContact CD1-CB 3.78Å; Y85-E90 HydrophobicContact CE1-CB 4.35Å; Y85-E90 HydrophobicContact CG-CB 4.1Å; N87-E90 HydrophobicContact CB-CB 4.36Å; N87-E90 HydrophobicContact CB-CG 3.99Å; N87-E90 VanDerWaalsContact ND2-CD 3.35Å; N87-E90 PolarHBondContact ND2-OE1 2.65Å; N87-E90 PolarHBondContact ND2-OE2 3.03Å; N87-E90 PolarHBondContact O-N 3.33Å; F88-E90 PolarHBondContact O-N 3.48Å; E90-F92 VanDerWaalsContact C-N 3.34Å; E90-F92 PolarHBondContact O-N 2.87Å; E90-T93 WeakPolarHBondContact CA-OG1 3.29Å; E90-T93 PolarHBondContact O-N 3.49Å; E90-T93 PolarHBondContact O-OG1 2.94Å; E90-A94 WeakPolarHBondContact O-CB 3.39Å; E90-A94 PolarHBondContact O-N 3.29Å
91	A	98.6	Very high	98.5	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.9	-42	176.8	0	0	0	0	0	112.4	W37 L39 Y85 N87 F88 A94 M95 W112	W37-A91 HydrophobicContact CB-CB 3.79Å; L39-A91 WeakPolarHBondContact CD1-O 3.43Å; L39-A91 HydrophobicContact CD2-CB 4.18Å; L39-A91 HydrophobicContact CG-CB 4.32Å; Y85-A91 HydrophobicContact CD2-CB 3.75Å; Y85-A91 HydrophobicContact CG-CB 4.24Å; N87-A91 PolarHBondContact O-N 3.36Å; F88-A91 PolarHBondContact O-N 2.82Å; A91-A94 PolarHBondContact O-N 2.89Å; A91-M95 VanDerWaalsContact O-CB 3.29Å; A91-M95 WeakPolarHBondContact O-CB 3.09Å; A91-M95 PolarHBondContact O-N 3.27Å; A91-W112 HydrophobicContact CB-CH2 3.73Å; A91-W112 HydrophobicContact CB-CZ3 3.58Å
92	F	98.4	Very high	98.5	Very high	71 Å²	71	54.9 Å²	54.9	31%	0.311	27%	0.271	S	S	.	.	H	α-helix	trans	-63.1	-47.5	177.3	177.2	-97.2	0	0	0	111.1	F88 K89 E90 A94 M95 E96 W112	F88-F92 HydrophobicContact CE1-CB 4.23Å; F88-F92 HydrophobicContact CE1-CG 4.44Å; F88-F92 HydrophobicContact CE2-CB 4.5Å; F88-F92 HydrophobicContact CZ-CB 4.16Å; F88-F92 HydrophobicContact CZ-CD2 4.15Å; F88-F92 HydrophobicContact CZ-CG 4.35Å; F88-F92 VanDerWaalsContact O-CB 3.26Å; F88-F92 WeakPolarHBondContact O-CB 3.36Å; F88-F92 PolarHBondContact O-N 3.22Å; K89-F92 PolarHBondContact O-N 3.31Å; E90-F92 VanDerWaalsContact C-N 3.34Å; E90-F92 PolarHBondContact O-N 2.87Å; F92-A94 PolarHBondContact O-N 2.93Å; F92-M95 HydrophobicContact CD2-CE 3.76Å; F92-M95 HydrophobicContact CE2-CE 4.04Å; F92-M95 PolarHBondContact O-N 2.99Å; F92-E96 HydrophobicContact CD1-CG 4.49Å; F92-E96 HydrophobicContact CE1-CG 4.03Å; F92-E96 WeakPolarHBondContact CE1-OE2 3.33Å; F92-E96 HydrophobicContact CE2-CG 4.15Å; F92-E96 HydrophobicContact CZ-CG 3.84Å; F92-E96 VanDerWaalsContact CZ-OE1 3.31Å; F92-E96 WeakPolarHBondContact CZ-OE1 3.31Å; F92-E96 WeakPolarHBondContact CZ-OE2 3.47Å; F92-E96 PolarHBondContact O-N 3.14Å; F92-W112 HydrophobicContact CB-CH2 4.1Å; F92-W112 HydrophobicContact CB-CZ2 3.99Å; F92-W112 HydrophobicContact CD2-CZ2 4.05Å
93	T	98.5	Very high	98.4	Very high	39 Å²	39	53.3 Å²	53.3	24%	0.239	26%	0.263	C	S	.	.	H	α-helix	trans	-63.6	-41.9	178.2	47.4	0	0	0	0	112.3	K89 E90 E96 H97	K89-T93 WeakPolarHBondContact O-CG2 3.24Å; K89-T93 PolarHBondContact O-N 3.4Å; K89-T93 PolarHBondContact O-OG1 2.86Å; E90-T93 WeakPolarHBondContact CA-OG1 3.29Å; E90-T93 PolarHBondContact O-N 3.49Å; E90-T93 PolarHBondContact O-OG1 2.94Å; T93-E96 PolarHBondContact O-N 2.87Å; T93-H97 PolarHBondContact O-N 3.49Å; T93-H97 VanDerWaalsContact O-N 3.12Å; T93-H97 PolarHBondContact O-ND1 3.32Å
94	A	98.7	Very high	98.3	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-47.3	175.8	0	0	0	0	0	111	L39 F57 Y60 Y85 E90 A91 F92 H97 L98	L39-A94 HydrophobicContact CD1-CB 3.88Å; F57-A94 HydrophobicContact CD1-CB 4.44Å; Y60-A94 HydrophobicContact CD1-CB 4.5Å; Y60-A94 HydrophobicContact CD2-CB 3.99Å; Y60-A94 HydrophobicContact CG-CB 3.78Å; Y85-A94 HydrophobicContact CE2-CB 3.96Å; E90-A94 WeakPolarHBondContact O-CB 3.39Å; E90-A94 PolarHBondContact O-N 3.29Å; A91-A94 PolarHBondContact O-N 2.89Å; F92-A94 PolarHBondContact O-N 2.93Å; A94-H97 PolarHBondContact O-N 3.31Å; A94-L98 HydrophobicContact CB-CD1 4.47Å; A94-L98 WeakPolarHBondContact O-CB 3.12Å; A94-L98 WeakPolarHBondContact O-CG 3.36Å; A94-L98 PolarHBondContact O-N 2.85Å
95	M	98.5	Very high	98.2	Very high	27 Å²	27	58.9 Å²	58.9	13%	0.133	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-47.4	178.7	178.3	-89.8	-56.4	0	0	112.2	L39 A91 F92 H97 N99 V110 W112	L39-M95 HydrophobicContact CD1-CB 4.17Å; L39-M95 HydrophobicContact CD2-CB 3.86Å; L39-M95 HydrophobicContact CD2-CG 4.39Å; A91-M95 VanDerWaalsContact O-CB 3.29Å; A91-M95 WeakPolarHBondContact O-CB 3.09Å; A91-M95 PolarHBondContact O-N 3.27Å; F92-M95 HydrophobicContact CD2-CE 3.76Å; F92-M95 HydrophobicContact CE2-CE 4.04Å; F92-M95 PolarHBondContact O-N 2.99Å; M95-H97 PolarHBondContact O-N 2.97Å; M95-N99 WeakPolarHBondContact O-CB 3.01Å; M95-N99 PolarHBondContact O-N 3.43Å; M95-N99 VanDerWaalsContact O-N 3.14Å; M95-V110 HydrophobicContact CB-CG1 4.11Å; M95-V110 HydrophobicContact CG-CG1 4.17Å; M95-W112 HydrophobicContact CE-CZ2 4.06Å
96	E	98.4	Very high	98.1	Very high	114 Å²	114	62.4 Å²	62.4	53%	0.533	33%	0.326	S	S	.	.	H	α-helix	trans	-62.8	-39.4	179.6	-74.6	-159.8	127.5	0	0	113.2	F92 T93	F92-E96 HydrophobicContact CD1-CG 4.49Å; F92-E96 HydrophobicContact CE1-CG 4.03Å; F92-E96 WeakPolarHBondContact CE1-OE2 3.33Å; F92-E96 HydrophobicContact CE2-CG 4.15Å; F92-E96 HydrophobicContact CZ-CG 3.84Å; F92-E96 VanDerWaalsContact CZ-OE1 3.31Å; F92-E96 WeakPolarHBondContact CZ-OE1 3.31Å; F92-E96 WeakPolarHBondContact CZ-OE2 3.47Å; F92-E96 PolarHBondContact O-N 3.14Å; T93-E96 PolarHBondContact O-N 2.87Å
97	H	98.6	Very high	98.2	Very high	119 Å²	119	63.9 Å²	63.9	55%	0.551	33%	0.327	S	S	*	.	H	α-helix	trans	-87	-33.7	-174.8	-69.1	76	0	0	0	113.5	Y60 T93 A94 M95	Y60-H97 HydrophobicContact CE1-CB 3.53Å; Y60-H97 AromaticContact CE1-CG 3.77Å; Y60-H97 WeakPolarHBondContact OH-CB 3.35Å; T93-H97 PolarHBondContact O-N 3.49Å; T93-H97 VanDerWaalsContact O-N 3.12Å; T93-H97 PolarHBondContact O-ND1 3.32Å; A94-H97 PolarHBondContact O-N 3.31Å; M95-H97 PolarHBondContact O-N 2.97Å
98	L	98.7	Very high	98.2	Very high	4 Å²	4	60.2 Å²	60.2	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-92.2	-18.7	-174.6	-65.4	177.7	0	0	0	113.4	K56 F57 Y60 A94 G100 S101 V110	K56-L98 HydrophobicContact CD-CD2 4.36Å; K56-L98 HydrophobicContact CG-CD1 4.43Å; K56-L98 HydrophobicContact CG-CD2 4Å; F57-L98 HydrophobicContact CB-CD1 4.46Å; F57-L98 HydrophobicContact CD1-CD1 3.46Å; F57-L98 VanDerWaalsContact CD1-CD1 3.46Å; F57-L98 HydrophobicContact CD2-CD1 3.94Å; F57-L98 HydrophobicContact CE1-CD1 3.49Å; F57-L98 VanDerWaalsContact CE1-CD1 3.49Å; F57-L98 HydrophobicContact CE2-CD1 3.97Å; F57-L98 HydrophobicContact CG-CD1 3.69Å; F57-L98 HydrophobicContact CZ-CB 4.49Å; F57-L98 HydrophobicContact CZ-CD1 3.74Å; Y60-L98 HydrophobicContact CD2-CD1 3.82Å; Y60-L98 HydrophobicContact CD2-CG 4.2Å; Y60-L98 HydrophobicContact CE2-CD1 3.52Å; Y60-L98 HydrophobicContact CE2-CD2 3.66Å; Y60-L98 HydrophobicContact CE2-CG 3.47Å; Y60-L98 VanDerWaalsContact CE2-CG 3.47Å; A94-L98 HydrophobicContact CB-CD1 4.47Å; A94-L98 WeakPolarHBondContact O-CB 3.12Å; A94-L98 WeakPolarHBondContact O-CG 3.36Å; A94-L98 PolarHBondContact O-N 2.85Å; L98-G100 PolarHBondContact O-N 3.18Å; L98-G100 VanDerWaalsContact O-N 3.15Å; L98-S101 VanDerWaalsContact O-CB 3.28Å; L98-S101 WeakPolarHBondContact O-CB 3.47Å; L98-S101 PolarHBondContact O-N 3.11Å; L98-S101 PolarHBondContact O-OG 2.82Å; L98-V110 HydrophobicContact CB-CG2 4.1Å
99	N	98.7	Very high	98.3	Very high	80 Å²	80	60 Å²	60	43%	0.428	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	118.5	175	-176.3	41.2	0	0	0	110.9	M95 S101 L109 V110	M95-N99 WeakPolarHBondContact O-CB 3.01Å; M95-N99 PolarHBondContact O-N 3.43Å; M95-N99 VanDerWaalsContact O-N 3.14Å; N99-S101 VanDerWaalsContact C-N 3.33Å; N99-L109 WeakPolarHBondContact OD1-CA 3.4Å; N99-V110 HydrophobicContact CB-CB 4.06Å; N99-V110 PolarHBondContact OD1-N 3.35Å; N99-V110 PolarHBondContact OD1-O 3.26Å
100	G	98.5	Very high	98.3	Very high	28 Å²	28	52.5 Å²	52.5	29%	0.289	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-0.1	-176.3	0	0	0	0	0	115.1	L98 R107 I108	L98-G100 PolarHBondContact O-N 3.18Å; L98-G100 VanDerWaalsContact O-N 3.15Å; G100-R107 PolarHBondContact O-NH1 3.3Å; G100-R107 VanDerWaalsContact O-NH1 3.12Å; G100-I108 VanDerWaalsContact CA-O 3.3Å; G100-I108 WeakPolarHBondContact CA-O 3.35Å; G100-I108 PolarHBondContact N-O 2.81Å
101	S	98.5	Very high	98.3	Very high	25 Å²	25	53.7 Å²	53.7	18%	0.175	28%	0.284	C	S	.	.			trans	-74.4	164.5	173.6	76.3	0	0	0	0	111.8	L98 N99 R107 I108	L98-S101 VanDerWaalsContact O-CB 3.28Å; L98-S101 WeakPolarHBondContact O-CB 3.47Å; L98-S101 PolarHBondContact O-N 3.11Å; L98-S101 PolarHBondContact O-OG 2.82Å; N99-S101 VanDerWaalsContact C-N 3.33Å; S101-R107 CarbonylContact O-C 3.58Å; S101-R107 VanDerWaalsContact O-CA 3.3Å; S101-R107 WeakPolarHBondContact O-CA 3.38Å; S101-I108 WeakPolarHBondContact O-CG1 3.37Å; S101-I108 PolarHBondContact O-N 3.03Å
102	E	98.1	Very high	98.3	Very high	102 Å²	102	55.2 Å²	55.2	48%	0.477	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	134.6	179.6	-69.2	178.3	-173.2	0	0	112	K56 Q106 R107	K56-E102 WeakPolarHBondContact CE-O 3.44Å; K56-E102 PolarHBondContact NZ-O 2.83Å; E102-Q106 CarbonylContact C-O 3.57Å; E102-Q106 WeakPolarHBondContact CA-O 3.38Å; E102-R107 HydrophobicContact CG-CG 3.87Å; E102-R107 IonicContact OE1-CZ 3.77Å; E102-R107 IonicContact OE1-NE 2.81Å; E102-R107 IonicContact OE1-NH2 3.96Å; E102-R107 PolarHBondContact OE1-NH2 3.3Å
103	L	97.9	Very high	98.2	Very high	9 Å²	9	53.2 Å²	53.2	5%	0.047	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	122.6	170.1	-178.1	75.2	0	0	0	107.3	V44 D52 I53 K56 G105 Q106 I108	V44-L103 HydrophobicContact CG1-CD2 4.39Å; D52-L103 HydrophobicContact CB-CD1 4.29Å; I53-L103 HydrophobicContact CD1-CD2 3.59Å; K56-L103 HydrophobicContact CB-CD1 3.98Å; K56-L103 HydrophobicContact CD-CD1 4.23Å; K56-L103 HydrophobicContact CG-CD1 4.12Å; L103-G105 PolarHBondContact O-N 3.44Å; L103-G105 VanDerWaalsContact O-N 3.15Å; L103-Q106 PolarHBondContact N-O 2.82Å; L103-Q106 PolarHBondContact O-N 2.98Å; L103-Q106 VanDerWaalsContact O-O 3.12Å; L103-I108 HydrophobicContact CB-CG2 3.74Å; L103-I108 HydrophobicContact CD2-CG2 4.09Å
104	N	96.7	Very high	98.1	Very high	68 Å²	68	56.5 Å²	56.5	36%	0.364	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	41.6	-178.5	-58.7	12.9	0	0	0	113.4	Q45 D52 Q106	Q45-N104 HydrophobicContact CB-CB 4.25Å; Q45-N104 PolarHBondContact OE1-ND2 3.05Å; D52-N104 PolarHBondContact OD2-ND2 2.78Å; N104-Q106 VanDerWaalsContact C-N 3.26Å; N104-Q106 PolarHBondContact O-N 3.29Å
105	G	96.5	Very high	97.8	Very high	68 Å²	68	60.2 Å²	60.2	70%	0.701	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	4.4	-180	0	0	0	0	0	115.4	L103	L103-G105 PolarHBondContact O-N 3.44Å; L103-G105 VanDerWaalsContact O-N 3.15Å
106	Q	97.5	Very high	97.2	Very high	74 Å²	74	62.5 Å²	62.5	35%	0.346	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	141.6	177	-64.2	-172.4	-45	0	0	111.5	Q45 E102 L103 N104 I108	Q45-Q106 VanDerWaalsContact CB-OE1 3.26Å; E102-Q106 CarbonylContact C-O 3.57Å; E102-Q106 WeakPolarHBondContact CA-O 3.38Å; L103-Q106 PolarHBondContact N-O 2.82Å; L103-Q106 PolarHBondContact O-N 2.98Å; L103-Q106 VanDerWaalsContact O-O 3.12Å; N104-Q106 VanDerWaalsContact C-N 3.26Å; N104-Q106 PolarHBondContact O-N 3.29Å; Q106-I108 PolarHBondContact O-N 3.12Å
107	R	98.5	Very high	96.2	Very high	148 Å²	148	59.4 Å²	59.4	56%	0.558	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	117.1	176.1	-70.1	-179.7	-179.3	-87.5	-12.7	110.3	N43 G100 S101 E102	N43-R107 PolarHBondContact ND2-O 2.99Å; G100-R107 PolarHBondContact O-NH1 3.3Å; G100-R107 VanDerWaalsContact O-NH1 3.12Å; S101-R107 CarbonylContact O-C 3.58Å; S101-R107 VanDerWaalsContact O-CA 3.3Å; S101-R107 WeakPolarHBondContact O-CA 3.38Å; E102-R107 HydrophobicContact CG-CG 3.87Å; E102-R107 IonicContact OE1-CZ 3.77Å; E102-R107 IonicContact OE1-NE 2.81Å; E102-R107 IonicContact OE1-NH2 3.96Å; E102-R107 PolarHBondContact OE1-NH2 3.3Å
108	I	98.7	Very high	94.9	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	34%	0.341	C	S	.	.			trans	-83.9	150.2	176.8	56.6	168.3	0	0	0	110.8	V41 R42 F57 G100 S101 L103 Q106 V110	V41-I108 HydrophobicContact CG1-CB 4.07Å; V41-I108 HydrophobicContact CG1-CD1 4.07Å; V41-I108 HydrophobicContact CG1-CG2 4.29Å; R42-I108 WeakPolarHBondContact O-CA 3.48Å; F57-I108 HydrophobicContact CE2-CD1 4.09Å; F57-I108 HydrophobicContact CZ-CD1 4.1Å; G100-I108 VanDerWaalsContact CA-O 3.3Å; G100-I108 WeakPolarHBondContact CA-O 3.35Å; G100-I108 PolarHBondContact N-O 2.81Å; S101-I108 WeakPolarHBondContact O-CG1 3.37Å; S101-I108 PolarHBondContact O-N 3.03Å; L103-I108 HydrophobicContact CB-CG2 3.74Å; L103-I108 HydrophobicContact CD2-CG2 4.09Å; Q106-I108 PolarHBondContact O-N 3.12Å; I108-V110 HydrophobicContact CD1-CG2 3.99Å; I108-V110 HydrophobicContact CG1-CG2 4.35Å
109	L	98.8	Very high	93.1	Very high	81 Å²	81	64.6 Å²	64.6	42%	0.424	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128	170.8	-60.3	170.9	0	0	0	108.2	V41 R42 N99	V41-L109 CarbonylContact C-O 3.57Å; V41-L109 WeakPolarHBondContact CA-O 3.36Å; R42-L109 HydrophobicContact CB-CB 4.29Å; R42-L109 PolarHBondContact N-O 3.24Å; R42-L109 PolarHBondContact O-N 2.76Å; N99-L109 WeakPolarHBondContact OD1-CA 3.4Å
110	V	98.8	Very high	91.4	Very high	3 Å²	3	66.2 Å²	66.2	2%	0.018	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.1	-177.1	-171	0	0	0	0	108.9	L39 V41 F57 M95 L98 N99 I108	L39-V110 HydrophobicContact CB-CG1 4.06Å; L39-V110 HydrophobicContact CD1-CG1 3.93Å; L39-V110 HydrophobicContact CG-CG1 4.43Å; V41-V110 HydrophobicContact CG1-CG2 4.34Å; F57-V110 HydrophobicContact CE1-CG1 4.3Å; F57-V110 HydrophobicContact CE1-CG2 4.45Å; F57-V110 HydrophobicContact CZ-CG2 4.03Å; M95-V110 HydrophobicContact CB-CG1 4.11Å; M95-V110 HydrophobicContact CG-CG1 4.17Å; L98-V110 HydrophobicContact CB-CG2 4.1Å; N99-V110 HydrophobicContact CB-CB 4.06Å; N99-V110 PolarHBondContact OD1-N 3.35Å; N99-V110 PolarHBondContact OD1-O 3.26Å; I108-V110 HydrophobicContact CD1-CG2 3.99Å; I108-V110 HydrophobicContact CG1-CG2 4.35Å
111	D	98.4	Very high	89.7	Confident	66 Å²	66	72.2 Å²	72.2	35%	0.353	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	170.4	-179.7	-154.1	-23.6	0	0	0	109.7	L39 F40 R42	L39-D111 CarbonylContact C-O 3.56Å; L39-D111 WeakPolarHBondContact CA-O 3.28Å; F40-D111 PolarHBondContact N-O 3.08Å; F40-D111 PolarHBondContact O-N 3.34Å; F40-D111 VanDerWaalsContact O-N 3.13Å; R42-D111 IonicContact NH2-OD2 2.85Å
112	W	98.1	Very high	88	Confident	32 Å²	32	80.7 Å²	80.7	12%	0.121	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	131.9	171.3	-63.3	108.5	0	0	0	110.7	P30 W37 L39 F88 A91 F92 M95 F114 T115	P30-W112 HydrophobicContact CB-CB 4.3Å; P30-W112 HydrophobicContact CB-CD2 3.4Å; P30-W112 VanDerWaalsContact CB-CE2 3.48Å; P30-W112 HydrophobicContact CB-CE3 3.88Å; P30-W112 HydrophobicContact CB-CG 3.6Å; P30-W112 HydrophobicContact CB-CH2 4.43Å; P30-W112 HydrophobicContact CB-CZ2 4Å; P30-W112 HydrophobicContact CB-CZ3 4.39Å; P30-W112 HydrophobicContact CG-CD2 4.21Å; P30-W112 HydrophobicContact CG-CZ2 3.98Å; W37-W112 HydrophobicContact CB-CZ3 3.94Å; W37-W112 HydrophobicContact CE3-CZ3 4.18Å; L39-W112 HydrophobicContact CD2-CD2 4.18Å; L39-W112 HydrophobicContact CD2-CE3 3.57Å; L39-W112 HydrophobicContact CD2-CH2 4.36Å; L39-W112 HydrophobicContact CD2-CZ3 3.64Å; F88-W112 AromaticContact CD2-CH2 3.85Å; F88-W112 HydrophobicContact CD2-CH2 3.85Å; F88-W112 HydrophobicContact CD2-CZ2 4.29Å; F88-W112 AromaticContact CE2-CH2 3.57Å; F88-W112 HydrophobicContact CE2-CH2 3.57Å; F88-W112 AromaticContact CE2-CZ2 3.54Å; F88-W112 HydrophobicContact CE2-CZ2 3.54Å; F88-W112 HydrophobicContact CZ-CH2 4.46Å; F88-W112 HydrophobicContact CZ-CZ2 4.14Å; A91-W112 HydrophobicContact CB-CH2 3.73Å; A91-W112 HydrophobicContact CB-CZ3 3.58Å; F92-W112 HydrophobicContact CB-CH2 4.1Å; F92-W112 HydrophobicContact CB-CZ2 3.99Å; F92-W112 HydrophobicContact CD2-CZ2 4.05Å; M95-W112 HydrophobicContact CE-CZ2 4.06Å; W112-F114 VanDerWaalsContact C-N 3.31Å; W112-F114 PolarHBondContact O-N 3.32Å; W112-T115 HydrophobicContact CB-CG2 4.28Å
113	A	97.5	Very high	86.1	Confident	30 Å²	30	83.8 Å²	83.8	25%	0.248	46%	0.457	C	S	.	.	S	Bend	trans	-68.8	-32.3	177.2	0	0	0	0	0	112.3	I38 F40 L82	I38-A113 HydrophobicContact CB-CB 3.87Å; I38-A113 HydrophobicContact CG2-CB 3.65Å; I38-A113 VanDerWaalsContact O-CB 3.28Å; I38-A113 WeakPolarHBondContact O-CB 3.3Å; I38-A113 PolarHBondContact O-N 2.77Å; F40-A113 HydrophobicContact CB-CB 4.11Å; L82-A113 HydrophobicContact CD2-CB 4.21Å
114	F	95.3	Very high	84.3	Confident	108 Å²	108	88.6 Å²	88.6	47%	0.474	49%	0.491	S	S	.	.			trans	-127.8	131.4	177.1	-54.5	-66.2	0	0	0	110.5	Q31 S33 I38 W112	Q31-F114 HydrophobicContact CB-CB 3.92Å; Q31-F114 HydrophobicContact CG-CB 4.35Å; Q31-F114 PolarHBondContact N-O 2.84Å; S33-F114 WeakPolarHBondContact OG-CD2 3.42Å; S33-F114 VanDerWaalsContact OG-CE2 3.23Å; S33-F114 WeakPolarHBondContact OG-CE2 3.34Å; I38-F114 HydrophobicContact CD1-CE2 4.13Å; W112-F114 VanDerWaalsContact C-N 3.31Å; W112-F114 PolarHBondContact O-N 3.32Å
115	T	92.6	Very high	82.8	Confident	77 Å²	77	91.2 Å²	91.2	47%	0.472	51%	0.509	S	S	.	.	B	Isolated β-bridge	trans	-118.4	149.9	173	56.6	0	0	0	0	109.4	G29 W112 G117	G29-T115 CarbonylContact O-C 3.5Å; G29-T115 VanDerWaalsContact O-CA 3.31Å; G29-T115 WeakPolarHBondContact O-CA 3.3Å; W112-T115 HydrophobicContact CB-CG2 4.28Å; T115-G117 PolarHBondContact O-N 2.8Å; T115-G117 VanDerWaalsContact O-N 3.1Å
116	K	87.4	Confident	80.9	Confident	75 Å²	75	96.7 Å²	96.7	33%	0.326	51%	0.514	S	S	.	.			trans	-60.8	114.4	168.6	-68	-178.5	176.5	-176.8	0	107	D22 G29 Q31	D22-K116 IonicContact OD2-NZ 2.74Å; D22-K116 PolarHBondContact OD2-NZ 3.46Å; G29-K116 PolarHBondContact O-N 3.12Å; Q31-K116 HydrophobicContact CB-CG 4.31Å
117	G	76.3	Confident	78.9	Confident	50 Å²	50	101 Å²	101	52%	0.515	53%	0.534	S	S	.	.			trans	-59.3	158.4	178.3	0	0	0	0	0	111.4	T115 N119	T115-G117 PolarHBondContact O-N 2.8Å; T115-G117 VanDerWaalsContact O-N 3.1Å; G117-N119 PolarHBondContact O-N 3.17Å
118	P	71.7	Confident	76.7	Confident	124 Å²	124	104.2 Å²	104.2	81%	0.805	55%	0.546	S	S	*	.			trans	-55.6	131	165	25.6	-31.9	0	0	0	107.7	P120	P118-P120 VanDerWaalsContact O-N 3.12Å
119	N	59.7	Low	74.8	Confident	107 Å²	107	110.6 Å²	110.6	57%	0.572	59%	0.585	S	S	*	*			trans	-45	125.2	-179.5	-85.9	-14.4	0	0	0	109.3	G117 I121	G117-N119 PolarHBondContact O-N 3.17Å; N119-I121 PolarHBondContact O-N 3.11Å
120	P	63.6	Low	72.2	Confident	114 Å²	114	116.1 Å²	116.1	74%	0.74	60%	0.6	S	S	*	*			trans	-56.8	120.9	176.1	22.9	-31.3	0	0	0	106.7	P118 K122	P118-P120 VanDerWaalsContact O-N 3.12Å; P120-K122 PolarHBondContact O-N 2.99Å
121	I	62.1	Low	70	Confident	155 Å²	155	124.3 Å²	124.3	80%	0.795	64%	0.638	S	S	*	*			trans	-54.2	109.5	176	-61.7	171.6	0	0	0	105.4	N119 M123	N119-I121 PolarHBondContact O-N 3.11Å; I121-M123 PolarHBondContact O-N 2.74Å
122	K	63.7	Low	67.7	Low	202 Å²	202	129.2 Å²	129.2	88%	0.878	65%	0.652	S	S	*	*			trans	-63.5	92.2	174.1	-70.8	-177.1	-179.3	177.5	0	106.3	P120 S124	P120-K122 PolarHBondContact O-N 2.99Å; K122-S124 PolarHBondContact O-N 3.15Å
123	M	58.5	Low	65.5	Low	168 Å²	168	132.3 Å²	132.3	83%	0.828	68%	0.679	S	S	*	*			trans	-59.3	107.7	166.5	-73.7	-162.8	-79.1	0	0	105.8	I121 T125	I121-M123 PolarHBondContact O-N 2.74Å; M123-T125 VanDerWaalsContact C-N 3.33Å; M123-T125 PolarHBondContact O-N 2.79Å
124	S	60.8	Low	63.2	Low	110 Å²	110	141.3 Å²	141.3	77%	0.769	71%	0.706	S	S	*	*			trans	-62.5	100.1	176.3	53.6	0	0	0	0	107.3	K122 K126	K122-S124 PolarHBondContact O-N 3.15Å; S124-K126 PolarHBondContact O-N 2.85Å
125	T	63.4	Low	61.4	Low	122 Å²	122	141.1 Å²	141.1	75%	0.748	72%	0.718	S	S	*	*			trans	-66	91.7	163.2	-35.2	0	0	0	0	105	M123 H127	M123-T125 VanDerWaalsContact C-N 3.33Å; M123-T125 PolarHBondContact O-N 2.79Å; T125-H127 PolarHBondContact O-N 3.04Å
126	K	57	Low	59.5	Low	183 Å²	183	148.4 Å²	148.4	80%	0.796	74%	0.737	S	S	*	*			trans	-61.9	87.3	172.5	-167.6	176.1	-173.8	176	0	106.2	S124 R128	S124-K126 PolarHBondContact O-N 2.85Å; K126-R128 PolarHBondContact O-N 2.75Å
127	H	56.1	Low	58	Low	164 Å²	164	150.5 Å²	150.5	76%	0.759	76%	0.762	S	S	*	*			trans	-58.7	96.4	164	-100.6	-79.6	0	0	0	105.6	T125 T129	T125-H127 PolarHBondContact O-N 3.04Å; H127-T129 VanDerWaalsContact C-N 3.26Å; H127-T129 PolarHBondContact O-N 3.39Å
128	R	51.2	Low	57.3	Low	217 Å²	217	155 Å²	155	82%	0.819	78%	0.778	S	S	*	*			trans	-58.2	101.1	164	-71.1	-176.2	72.7	-168.4	1.6	105.2	K126 R130	K126-R128 PolarHBondContact O-N 2.75Å; R128-R130 PolarHBondContact O-N 3.34Å
129	T	58.9	Low	56.7	Low	134 Å²	134	156 Å²	156	82%	0.822	78%	0.777	S	S	*	*			trans	-53.5	110	170.3	31.1	0	0	0	0	107.7	H127 E131	H127-T129 VanDerWaalsContact C-N 3.26Å; H127-T129 PolarHBondContact O-N 3.39Å; T129-E131 PolarHBondContact O-N 2.83Å
130	R	45.7	Very low	56.3	Low	197 Å²	197	163.1 Å²	163.1	74%	0.743	80%	0.796	S	S	*	*			trans	14	85.1	146.8	-79.9	173.7	145.6	168.5	-2.9	114.3	R128 R132	R128-R130 PolarHBondContact O-N 3.34Å; R130-R132 HydrophobicContact CB-CB 4.46Å; R130-R132 PolarHBondContact O-N 2.92Å
131	E	52	Low	55.9	Low	176 Å²	176	161.6 Å²	161.6	82%	0.822	79%	0.793	S	S	*	*			trans	-76.6	76.8	145.6	-152.2	159.2	-158.4	0	0	105.8	T129 S133	T129-E131 PolarHBondContact O-N 2.83Å; E131-S133 PolarHBondContact O-N 3.15Å
132	R	50.1	Low	55.7	Low	168 Å²	168	165.9 Å²	165.9	63%	0.634	80%	0.799	S	S	*	*			trans	-66.7	93.3	175.3	-161.3	176	-167.7	-179.5	2.3	104.5	R130 R134	R130-R132 HydrophobicContact CB-CB 4.46Å; R130-R132 PolarHBondContact O-N 2.92Å; R132-R134 PolarHBondContact O-N 2.91Å
133	S	52	Low	55.4	Low	98 Å²	98	171.7 Å²	171.7	69%	0.685	82%	0.816	S	S	*	*			trans	-50.1	90.4	170.3	-42.2	0	0	0	0	107.9	E131 S135	E131-S133 PolarHBondContact O-N 3.15Å; S133-S135 PolarHBondContact O-N 3.12Å
134	R	49	Very low	55.3	Low	218 Å²	218	171.9 Å²	171.9	82%	0.823	82%	0.815	S	S	*	*			trans	-78.2	70.4	165.9	-81.3	-178.4	168.9	145.8	-5.9	105.9	R132 R136	R132-R134 PolarHBondContact O-N 2.91Å; R134-R136 PolarHBondContact O-N 2.85Å
135	S	57.2	Low	55	Low	105 Å²	105	175.2 Å²	175.2	73%	0.734	82%	0.818	S	S	*	*			trans	-72.3	76.7	166.4	-36	0	0	0	0	107.2	S133	S133-S135 PolarHBondContact O-N 3.12Å
136	R	52.8	Low	54.5	Low	229 Å²	229	178.1 Å²	178.1	86%	0.864	82%	0.822	S	S	*	*			trans	-144.5	80.6	169.6	-73	-169	-178.7	163.3	-0.5	108.4	R134	R134-R136 PolarHBondContact O-N 2.85Å
137	S	55.4	Low	54.4	Low	120 Å²	120	177.8 Å²	177.8	84%	0.839	82%	0.823	S	S	*	*			trans	-176.9	87.7	149.4	-78.4	0	0	0	0	106.9
138	V	61.9	Low	54.3	Low	143 Å²	143	178.7 Å²	178.7	87%	0.867	83%	0.827	S	S	*	*			trans	-119.6	118.8	155.1	178.2	0	0	0	0	105.7
139	D	59.5	Low	54.5	Low	147 Å²	147	176.1 Å²	176.1	79%	0.786	83%	0.828	S	S	*	*			trans	-17.3	122	175.9	-69.2	-94.5	0	0	0	117.4
140	R	52.4	Low	54.1	Low	255 Å²	255	179.1 Å²	179.1	96%	0.962	83%	0.828	S	S	*	*			trans	-106.6	75.2	160.8	-159	-179.9	-162.5	171.1	4.5	108.1
141	A	53.3	Low	54.8	Low	83 Å²	83	177.8 Å²	177.8	69%	0.686	84%	0.835	S	S	*	*			trans	-167.1	87	166.6	0	0	0	0	0	111.3
142	R	59.3	Low	55	Low	244 Å²	244	177.9 Å²	177.9	92%	0.921	84%	0.836	S	S	*	*			trans	-144.3	117.3	150.6	-82.3	-164.7	176.6	-171	-1.2	109.5
143	R	57.4	Low	55.5	Low	325 Å²	325	178.8 Å²	178.8	100%	1.226	85%	0.854	S	S	*	*			trans	46.6	0	150.4	-74	-174.9	174.5	-161.3	-2.2	119.4

Retrieved 143 of 143 residues in 32.3 ms (Link to these results)

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