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Electron transfer flavoprotein subunit alpha

Heterodimeric electron transfer flavoprotein that accepts electrons from several mitochondrial dehydrogenases, including acyl-CoA dehydrogenases, glutaryl-CoA and sarcosine dehydrogenase. It transfers the electrons to the main mitochondrial respiratory chain via ETF-ubiquinone oxidoreductase (ETF dehydrogenase). Required for normal mitochondrial fatty acid oxidation and normal amino acid metabolism. The electron transfer flavoprotein serves as a specific electron acceptor for several dehydrogenases, including five acyl-CoA dehydrogenases, glutaryl-CoA and sarcosine dehydrogenase. It transfers the electrons to the main mitochondrial respiratory chain via ETF-ubiquinone oxidoreductase (ETF dehydrogenase).

AlphaFold DB , UniProt , Accession A0A087XAM7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 333 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.8	Very low	46.4	Very low	243 Å²	243	143.6 Å²	143.6	100%	1.197	71%	0.706	S	S	*	*				0	88.7	0	-83	158.3	100.6	0	0	108.8
2	N	39.1	Very low	46.1	Very low	162 Å²	162	141.4 Å²	141.4	87%	0.866	70%	0.699	S	S	*	*			trans	-139.6	91.1	169	-99.4	-13.3	0	0	0	106	V4	N2-V4 PolarHBondContact O-N 3.21Å
3	R	43.9	Very low	46.6	Very low	248 Å²	248	138.5 Å²	138.5	94%	0.936	69%	0.687	S	S	*	*			trans	-77.1	103.2	171.6	-99.1	-176.1	174.2	178.4	-1.2	107.1	L5	R3-L5 PolarHBondContact O-N 3.11Å; R3-L5 VanDerWaalsContact O-N 3.11Å
4	V	47	Very low	47.2	Very low	136 Å²	136	134.9 Å²	134.9	82%	0.824	68%	0.676	S	S	*	*			trans	-57.1	111.8	168.5	178.6	0	0	0	0	107.7	N2 N6	N2-V4 PolarHBondContact O-N 3.21Å; V4-N6 PolarHBondContact O-N 3.21Å
5	L	47.7	Very low	47.4	Very low	125 Å²	125	128.4 Å²	128.4	65%	0.654	66%	0.657	S	S	*	*			trans	-64.8	114.4	173.4	-76.6	159.7	0	0	0	108.5	R3 L10	R3-L5 PolarHBondContact O-N 3.11Å; R3-L5 VanDerWaalsContact O-N 3.11Å; L5-L10 HydrophobicContact CB-CD1 4.39Å
6	N	51.3	Low	47.7	Very low	106 Å²	106	127.1 Å²	127.1	57%	0.567	65%	0.651	S	S	*	*			trans	-70.3	144.2	-179.8	-169	-6.3	0	0	0	110.6	V4 S8 S9 L10	V4-N6 PolarHBondContact O-N 3.21Å; N6-S8 PolarHBondContact O-N 3.19Å; N6-S8 VanDerWaalsContact O-N 3.07Å; N6-S9 WeakPolarHBondContact O-CA 3.37Å; N6-S9 WeakPolarHBondContact O-CB 3.49Å; N6-S9 PolarHBondContact O-N 2.9Å; N6-L10 PolarHBondContact O-N 3.07Å
7	K	50.7	Low	48.1	Very low	163 Å²	163	124.9 Å²	124.9	71%	0.709	64%	0.64	S	S	*	*	H	α-helix	trans	-54	-28.6	179.8	-78.2	-178.8	176.5	177.8	0	113.4	R11	K7-R11 WeakPolarHBondContact O-CG 3.41Å; K7-R11 PolarHBondContact O-N 3.03Å
8	S	47.3	Very low	48.5	Very low	65 Å²	65	123.8 Å²	123.8	46%	0.455	63%	0.632	S	S	.	*	H	α-helix	trans	-69	-38.6	174	57.6	0	0	0	0	113	N6 R11 N12	N6-S8 PolarHBondContact O-N 3.19Å; N6-S8 VanDerWaalsContact O-N 3.07Å; S8-R11 PolarHBondContact O-N 3.42Å; S8-N12 WeakPolarHBondContact O-CB 3.5Å; S8-N12 PolarHBondContact O-N 2.99Å
9	S	45.3	Very low	49	Very low	51 Å²	51	128.7 Å²	128.7	36%	0.357	64%	0.642	S	S	.	*	H	α-helix	trans	-68.7	-37.1	175.8	175.9	0	0	0	0	111.6	N6 L13	N6-S9 WeakPolarHBondContact O-CA 3.37Å; N6-S9 WeakPolarHBondContact O-CB 3.49Å; N6-S9 PolarHBondContact O-N 2.9Å; S9-L13 PolarHBondContact O-N 2.98Å
10	L	50.2	Low	50.1	Low	93 Å²	93	130.1 Å²	130.1	49%	0.487	64%	0.644	S	S	.	*	H	α-helix	trans	-65.4	-44.7	172.8	-79.1	149.9	0	0	0	111.7	L5 N6 N12 L13 T14	L5-L10 HydrophobicContact CB-CD1 4.39Å; N6-L10 PolarHBondContact O-N 3.07Å; L10-N12 PolarHBondContact O-N 2.86Å; L10-L13 PolarHBondContact O-N 3.48Å; L10-T14 PolarHBondContact O-N 3.22Å; L10-T14 PolarHBondContact O-OG1 3.03Å
11	R	49.8	Very low	51.9	Low	188 Å²	188	125.3 Å²	125.3	71%	0.709	62%	0.62	S	S	*	*	H	α-helix	trans	-60	-43.6	175.2	-79	-179.9	-172.1	172.2	1.4	112.6	K7 S8 L13 T14 G15	K7-R11 WeakPolarHBondContact O-CG 3.41Å; K7-R11 PolarHBondContact O-N 3.03Å; S8-R11 PolarHBondContact O-N 3.42Å; R11-L13 VanDerWaalsContact C-N 3.34Å; R11-T14 VanDerWaalsContact CA-OG1 3.25Å; R11-T14 WeakPolarHBondContact CA-OG1 3.25Å; R11-T14 PolarHBondContact O-N 3.27Å; R11-T14 PolarHBondContact O-OG1 2.95Å; R11-G15 PolarHBondContact O-N 2.83Å
12	N	43.8	Very low	54.7	Low	117 Å²	117	115.1 Å²	115.1	63%	0.626	57%	0.573	S	S	*	*	H	α-helix	trans	-66	-35.1	176.6	-75.9	-6.4	0	0	0	112.4	S8 L10 G15 L16	S8-N12 WeakPolarHBondContact O-CB 3.5Å; S8-N12 PolarHBondContact O-N 2.99Å; L10-N12 PolarHBondContact O-N 2.86Å; N12-G15 PolarHBondContact O-N 2.96Å; N12-L16 PolarHBondContact O-N 2.98Å
13	L	52.2	Low	57.5	Low	104 Å²	104	107.4 Å²	107.4	55%	0.545	53%	0.531	S	S	.	.	H	α-helix	trans	-66.7	-44.8	173.7	-127.4	86.7	0	0	0	111.8	S9 L10 R11 G15 L16 I17	S9-L13 PolarHBondContact O-N 2.98Å; L10-L13 PolarHBondContact O-N 3.48Å; R11-L13 VanDerWaalsContact C-N 3.34Å; L13-G15 VanDerWaalsContact C-N 3.33Å; L13-G15 PolarHBondContact O-N 3.46Å; L13-L16 PolarHBondContact O-N 3.45Å; L13-I17 VanDerWaalsContact O-CG1 3.28Å; L13-I17 WeakPolarHBondContact O-CG1 3.19Å; L13-I17 PolarHBondContact O-N 2.95Å
14	T	54.5	Low	60.1	Low	87 Å²	87	95.6 Å²	95.6	53%	0.534	49%	0.487	S	S	.	.	H	α-helix	trans	-60.8	-40.5	174.3	24.7	0	0	0	0	112.4	L10 R11 I17 Q18	L10-T14 PolarHBondContact O-N 3.22Å; L10-T14 PolarHBondContact O-OG1 3.03Å; R11-T14 VanDerWaalsContact CA-OG1 3.25Å; R11-T14 WeakPolarHBondContact CA-OG1 3.25Å; R11-T14 PolarHBondContact O-N 3.27Å; R11-T14 PolarHBondContact O-OG1 2.95Å; T14-I17 PolarHBondContact O-N 3.49Å; T14-Q18 WeakPolarHBondContact O-CB 3.28Å; T14-Q18 PolarHBondContact O-N 3.36Å
15	G	50	Low	62.6	Low	38 Å²	38	89.1 Å²	89.1	39%	0.392	45%	0.447	S	S	.	.	H	α-helix	trans	-67.5	-35.3	175.8	0	0	0	0	0	113.3	R11 N12 L13 R19	R11-G15 PolarHBondContact O-N 2.83Å; N12-G15 PolarHBondContact O-N 2.96Å; L13-G15 VanDerWaalsContact C-N 3.33Å; L13-G15 PolarHBondContact O-N 3.46Å; G15-R19 PolarHBondContact O-N 3.26Å
16	L	52.3	Low	65	Low	108 Å²	108	83.5 Å²	83.5	57%	0.565	42%	0.418	S	S	*	.	H	α-helix	trans	-67.3	-45.3	173.3	-120.6	92	0	0	0	111.6	N12 L13 Q18 R19 F20	N12-L16 PolarHBondContact O-N 2.98Å; L13-L16 PolarHBondContact O-N 3.45Å; L16-Q18 VanDerWaalsContact C-N 3.35Å; L16-Q18 PolarHBondContact O-N 3.19Å; L16-R19 VanDerWaalsContact O-CB 3.27Å; L16-R19 WeakPolarHBondContact O-CB 3.46Å; L16-R19 PolarHBondContact O-N 3.5Å; L16-R19 VanDerWaalsContact O-N 3.11Å; L16-F20 WeakPolarHBondContact O-CD2 3.27Å
17	I	55.4	Low	67.3	Low	90 Å²	90	78.7 Å²	78.7	46%	0.462	39%	0.393	S	S	.	.	H	α-helix	trans	-66.2	-37.4	-179.4	-66.4	165.5	0	0	0	111.1	L13 T14 R19 F20	L13-I17 VanDerWaalsContact O-CG1 3.28Å; L13-I17 WeakPolarHBondContact O-CG1 3.19Å; L13-I17 PolarHBondContact O-N 2.95Å; T14-I17 PolarHBondContact O-N 3.49Å; I17-R19 PolarHBondContact O-N 3.11Å; I17-F20 PolarHBondContact O-N 3.43Å
18	Q	54.7	Low	69.5	Low	104 Å²	104	72.7 Å²	72.7	49%	0.486	37%	0.368	S	S	.	.	H	α-helix	trans	-58.8	-30.1	172.7	-102.6	178.6	-30.8	0	0	112.9	T14 L16 F20 Q21 G50	T14-Q18 WeakPolarHBondContact O-CB 3.28Å; T14-Q18 PolarHBondContact O-N 3.36Å; L16-Q18 VanDerWaalsContact C-N 3.35Å; L16-Q18 PolarHBondContact O-N 3.19Å; Q18-F20 VanDerWaalsContact C-N 3.27Å; Q18-F20 PolarHBondContact O-N 3.42Å; Q18-Q21 PolarHBondContact O-N 3.37Å; Q18-G50 WeakPolarHBondContact O-CA 3.41Å
19	R	57.7	Low	71.9	Confident	218 Å²	218	71.1 Å²	71.1	82%	0.823	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-14.3	-178.5	-144.4	175.1	173.4	-175.8	-3.1	113.6	G15 L16 I17	G15-R19 PolarHBondContact O-N 3.26Å; L16-R19 VanDerWaalsContact O-CB 3.27Å; L16-R19 WeakPolarHBondContact O-CB 3.46Å; L16-R19 PolarHBondContact O-N 3.5Å; L16-R19 VanDerWaalsContact O-N 3.11Å; I17-R19 PolarHBondContact O-N 3.11Å
20	F	71.7	Confident	74.2	Confident	155 Å²	155	73.5 Å²	73.5	68%	0.68	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-0.3	175.1	-67.8	-76.5	0	0	0	113	L16 I17 Q18 T107	L16-F20 WeakPolarHBondContact O-CD2 3.27Å; I17-F20 PolarHBondContact O-N 3.43Å; Q18-F20 VanDerWaalsContact C-N 3.27Å; Q18-F20 PolarHBondContact O-N 3.42Å; F20-T107 WeakPolarHBondContact O-CG2 3.36Å
21	Q	87.6	Confident	76.1	Confident	31 Å²	31	71.4 Å²	71.4	15%	0.145	35%	0.351	C	S	.	.			trans	-80.4	135.1	173.7	-60.5	-57.3	-26.9	0	0	109.9	Q18 G49 G50 D51 T107 H108	Q18-Q21 PolarHBondContact O-N 3.37Å; Q21-G49 WeakPolarHBondContact CB-O 3.27Å; Q21-G50 VanDerWaalsContact O-CA 3.27Å; Q21-G50 WeakPolarHBondContact O-CA 3.4Å; Q21-D51 PolarHBondContact O-N 3.35Å; Q21-T107 PolarHBondContact OE1-OG1 3.46Å; Q21-H108 PolarHBondContact OE1-CE1 2.93Å; Q21-H108 PolarHBondContact OE1-ND1 2.78Å
22	S	96.2	Very high	78.1	Confident	29 Å²	29	66.4 Å²	66.4	20%	0.203	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	129.9	173.7	-175.9	0	0	0	0	108.5	D51 F106 T107 H108	S22-D51 WeakPolarHBondContact CA-O 3.46Å; S22-F106 WeakPolarHBondContact OG-CD1 3.34Å; S22-F106 WeakPolarHBondContact OG-CE1 3.44Å; S22-T107 PolarHBondContact N-OG1 2.9Å; S22-T107 PolarHBondContact O-N 3.41Å; S22-T107 PolarHBondContact O-OG1 3.45Å; S22-H108 PolarHBondContact O-N 2.91Å
23	T	98.6	Very high	80.5	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131	-174.2	-54.5	0	0	0	0	110.8	V25 A45 L48 D51 S53 H108	T23-V25 HydrophobicContact CG2-CG2 4.47Å; T23-A45 HydrophobicContact CG2-CB 3.62Å; T23-L48 HydrophobicContact CG2-CD1 4.19Å; T23-D51 PolarHBondContact N-O 2.72Å; T23-S53 PolarHBondContact O-N 3.21Å; T23-H108 WeakPolarHBondContact CA-O 3.3Å; T23-H108 HydrophobicContact CG2-CB 3.82Å
24	L	98.8	Very high	82.6	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	116.1	168.2	-175.2	62.9	0	0	0	109.8	L55 L78 I97 T100 F106 H108 I109 C110	L24-L55 HydrophobicContact CD1-CB 3.91Å; L24-L78 HydrophobicContact CD1-CD1 4.15Å; L24-I97 HydrophobicContact CD2-CG2 4.42Å; L24-T100 HydrophobicContact CD1-CG2 4.5Å; L24-T100 HydrophobicContact CD2-CG2 4Å; L24-F106 HydrophobicContact CB-CB 4.27Å; L24-F106 HydrophobicContact CB-CD1 3.9Å; L24-F106 HydrophobicContact CB-CD2 3.75Å; L24-F106 HydrophobicContact CB-CE1 4.15Å; L24-F106 HydrophobicContact CB-CE2 3.99Å; L24-F106 HydrophobicContact CB-CG 3.7Å; L24-F106 HydrophobicContact CB-CZ 4.2Å; L24-F106 HydrophobicContact CD1-CD2 4.49Å; L24-F106 HydrophobicContact CD1-CE1 4.42Å; L24-F106 HydrophobicContact CD1-CE2 3.9Å; L24-F106 HydrophobicContact CD1-CZ 3.87Å; L24-F106 HydrophobicContact CD2-CD2 4.01Å; L24-F106 HydrophobicContact CD2-CE2 4.01Å; L24-F106 HydrophobicContact CG-CD2 4.31Å; L24-F106 HydrophobicContact CG-CE2 4.19Å; L24-H108 PolarHBondContact N-O 2.86Å; L24-I109 HydrophobicContact CB-CG1 4.29Å; L24-I109 HydrophobicContact CD2-CG2 4.48Å; L24-I109 CarbonylContact O-C 3.56Å; L24-I109 WeakPolarHBondContact O-CA 3.34Å; L24-C110 PolarHBondContact O-N 2.84Å
25	V	98.9	Very high	84.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	121.1	167.5	-177.8	0	0	0	0	108.2	T23 A27 T38 A41 I42 A45 V52 S53 C54 L55 C110	T23-V25 HydrophobicContact CG2-CG2 4.47Å; V25-A27 PolarHBondContact O-N 2.85Å; V25-T38 HydrophobicContact CG1-CG2 4.24Å; V25-A41 HydrophobicContact CG1-CB 4.12Å; V25-I42 HydrophobicContact CG1-CG1 4.23Å; V25-I42 HydrophobicContact CG2-CG1 4.33Å; V25-A45 HydrophobicContact CG2-CB 3.74Å; V25-V52 HydrophobicContact CG2-CG1 3.77Å; V25-S53 PolarHBondContact N-O 3.5Å; V25-C54 CarbonylContact O-C 3.56Å; V25-C54 VanDerWaalsContact O-CA 3.29Å; V25-C54 WeakPolarHBondContact O-CA 3.39Å; V25-L55 PolarHBondContact O-N 2.65Å; V25-C110 CarbonylContact C-O 3.53Å; V25-C110 WeakPolarHBondContact CA-O 3.36Å
26	V	98.8	Very high	86.7	Confident	7 Å²	7	61.8 Å²	61.8	4%	0.042	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	111.7	171	-172.7	0	0	0	0	107.9	I97 I109 C110 A111 F116 L120	V26-I97 HydrophobicContact CG1-CD1 4.36Å; V26-I97 HydrophobicContact CG2-CD1 3.95Å; V26-I97 HydrophobicContact CG2-CG1 4.43Å; V26-I109 HydrophobicContact CG2-CG2 4.36Å; V26-C110 PolarHBondContact N-O 3.22Å; V26-A111 HydrophobicContact CB-CB 4.39Å; V26-F116 HydrophobicContact CG1-CE1 4.02Å; V26-F116 HydrophobicContact CG1-CZ 3.85Å; V26-L120 HydrophobicContact CG1-CD2 3.93Å
27	A	98.4	Very high	88.9	Confident	4 Å²	4	58.1 Å²	58.1	3%	0.033	28%	0.282	C	S	.	.			trans	-75.5	129	-175.3	0	0	0	0	0	111.1	V25 L34 T38 L55 I56 I68	V25-A27 PolarHBondContact O-N 2.85Å; A27-L34 HydrophobicContact CB-CD1 4.13Å; A27-T38 HydrophobicContact CB-CG2 3.94Å; A27-L55 WeakPolarHBondContact CB-O 3.23Å; A27-L55 PolarHBondContact N-O 3.35Å; A27-I56 HydrophobicContact CB-CG1 4.13Å; A27-I68 HydrophobicContact CB-CD1 3.67Å
28	E	98.2	Very high	90.9	Very high	38 Å²	38	53.9 Å²	53.9	18%	0.178	26%	0.26	C	S	.	.			trans	-91.3	130.3	170	-173	-178.4	164.9	0	0	109.4	T35 I37 T38 S114 F116	E28-T35 HydrophobicContact CG-CG2 4.29Å; E28-T35 VanDerWaalsContact O-CB 3.28Å; E28-T35 WeakPolarHBondContact O-CB 3.46Å; E28-T35 PolarHBondContact O-N 2.72Å; E28-T35 PolarHBondContact O-OG1 2.88Å; E28-I37 WeakPolarHBondContact OE2-CG2 3.33Å; E28-T38 PolarHBondContact N-OG1 3.47Å; E28-T38 PolarHBondContact O-OG1 3.05Å; E28-S114 WeakPolarHBondContact OE2-CB 3.29Å; E28-S114 PolarHBondContact OE2-OG 3.44Å; E28-F116 HydrophobicContact CB-CD1 3.69Å; E28-F116 HydrophobicContact CB-CE1 4.07Å; E28-F116 HydrophobicContact CB-CG 4.38Å; E28-F116 HydrophobicContact CG-CB 3.95Å; E28-F116 HydrophobicContact CG-CD1 3.75Å; E28-F116 HydrophobicContact CG-CE1 4.48Å; E28-F116 HydrophobicContact CG-CG 3.93Å
29	H	97.4	Very high	93	Very high	32 Å²	32	50.2 Å²	50.2	15%	0.148	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-158.2	170.7	-179.3	68	103.2	0	0	0	111	N31 K33 A57 V64	H29-N31 VanDerWaalsContact ND1-CA 3.35Å; H29-N31 WeakPolarHBondContact ND1-CA 3.18Å; H29-N31 PolarHBondContact ND1-N 3.32Å; H29-K33 WeakPolarHBondContact CA-O 3.16Å; H29-K33 WeakPolarHBondContact CB-O 3.09Å; H29-A57 PolarHBondContact NE2-O 3.02Å; H29-V64 HydrophobicContact CB-CB 4.48Å; H29-V64 HydrophobicContact CB-CG1 3.77Å; H29-V64 HydrophobicContact CB-CG2 3.91Å
30	N	93.8	Very high	94.9	Very high	101 Å²	101	41 Å²	41	54%	0.54	21%	0.211	S	C	.	.			trans	-111.7	26	177.5	70.1	0.6	0	0	0	113.4	D32 K33	N30-D32 PolarHBondContact O-N 2.97Å; N30-D32 WeakPolarHBondContact OD1-CB 3.35Å; N30-D32 PolarHBondContact OD1-N 2.81Å; N30-K33 PolarHBondContact N-O 3.23Å; N30-K33 PolarHBondContact OD1-N 2.97Å; N30-K33 PolarHBondContact OD1-O 3Å
31	N	89.5	Confident	96.2	Very high	49 Å²	49	33.7 Å²	33.7	26%	0.262	18%	0.178	S	C	.	.	S	Bend	trans	70.2	-20.3	-168.8	-53.3	-65.3	0	0	0	116	H29 T59 N60	H29-N31 VanDerWaalsContact ND1-CA 3.35Å; H29-N31 WeakPolarHBondContact ND1-CA 3.18Å; H29-N31 PolarHBondContact ND1-N 3.32Å; N31-T59 PolarHBondContact OD1-N 2.64Å; N31-T59 VanDerWaalsContact OD1-N 3.12Å; N31-N60 CarbonylContact C-O 3.58Å; N31-N60 WeakPolarHBondContact CA-O 3.45Å; N31-N60 HydrophobicContact CB-CB 4.43Å; N31-N60 VanDerWaalsContact CB-O 3.26Å; N31-N60 WeakPolarHBondContact CB-O 3.49Å
32	D	92.3	Very high	96.7	Very high	82 Å²	82	32.4 Å²	32.4	44%	0.439	17%	0.172	S	C	.	.	S	Bend	trans	-103.5	-42.5	179.6	-167.1	44.4	0	0	0	111.9	N30 K63	N30-D32 PolarHBondContact O-N 2.97Å; N30-D32 WeakPolarHBondContact OD1-CB 3.35Å; N30-D32 PolarHBondContact OD1-N 2.81Å; D32-K63 WeakPolarHBondContact O-CB 3.49Å; D32-K63 WeakPolarHBondContact OD1-CD 3.49Å; D32-K63 WeakPolarHBondContact OD1-CE 3.27Å; D32-K63 IonicContact OD1-NZ 2.95Å; D32-K63 PolarHBondContact OD1-NZ 2.7Å
33	K	94.4	Very high	96.8	Very high	129 Å²	129	32.8 Å²	32.8	56%	0.561	17%	0.174	S	C	*	.	S	Bend	trans	-136.4	142.2	-170.9	-171.3	175.5	-177.6	177.4	0	111.3	H29 N30	H29-K33 WeakPolarHBondContact CA-O 3.16Å; H29-K33 WeakPolarHBondContact CB-O 3.09Å; N30-K33 PolarHBondContact N-O 3.23Å; N30-K33 PolarHBondContact OD1-N 2.97Å; N30-K33 PolarHBondContact OD1-O 3Å
34	L	95.9	Very high	96.8	Very high	13 Å²	13	32.8 Å²	32.8	7%	0.068	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-67.7	134.8	171.6	-168.9	68.1	0	0	0	111.2	A27 T38 L39 V64 E67 I68	A27-L34 HydrophobicContact CB-CD1 4.13Å; L34-T38 HydrophobicContact CD1-CG2 3.93Å; L34-T38 HydrophobicContact CD2-CG2 4.33Å; L34-T38 HydrophobicContact CG-CG2 4.41Å; L34-L39 HydrophobicContact CD2-CD2 3.8Å; L34-L39 HydrophobicContact CD2-CG 4.26Å; L34-V64 HydrophobicContact CB-CG1 4.44Å; L34-V64 HydrophobicContact CD1-CG1 3.92Å; L34-E67 WeakPolarHBondContact CB-OE2 3.43Å; L34-E67 PolarHBondContact N-OE2 3.06Å; L34-I68 HydrophobicContact CD1-CD1 3.53Å; L34-I68 HydrophobicContact CD1-CG1 3.88Å; L34-I68 HydrophobicContact CD2-CD1 4.35Å; L34-I68 HydrophobicContact CD2-CG1 3.83Å; L34-I68 HydrophobicContact CG-CG1 4.44Å
35	T	95.6	Very high	96.8	Very high	40 Å²	40	32.8 Å²	32.8	25%	0.245	17%	0.174	C	C	.	.			trans	-71.9	130	171.1	-57.9	0	0	0	0	109.4	E28 I37 T38	E28-T35 HydrophobicContact CG-CG2 4.29Å; E28-T35 VanDerWaalsContact O-CB 3.28Å; E28-T35 WeakPolarHBondContact O-CB 3.46Å; E28-T35 PolarHBondContact O-N 2.72Å; E28-T35 PolarHBondContact O-OG1 2.88Å; T35-I37 HydrophobicContact CG2-CG2 3.84Å; T35-I37 PolarHBondContact O-N 3.11Å; T35-T38 WeakPolarHBondContact O-CB 3.4Å; T35-T38 PolarHBondContact O-N 3.37Å; T35-T38 PolarHBondContact O-OG1 2.96Å
36	P	95.4	Very high	96.7	Very high	68 Å²	68	35 Å²	35	44%	0.442	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-34	-174.3	-30.3	35.8	0	0	0	114.9	T38 L39 N40	P36-T38 PolarHBondContact O-N 3.18Å; P36-L39 WeakPolarHBondContact O-CB 3.35Å; P36-L39 PolarHBondContact O-N 3.4Å; P36-N40 PolarHBondContact O-OD1 3.28Å; P36-N40 VanDerWaalsContact O-OD1 3.09Å
37	I	97.1	Very high	96.6	Very high	31 Å²	31	40.7 Å²	40.7	16%	0.159	22%	0.221	C	C	.	.	H	α-helix	trans	-57.9	-24.7	179.8	-158.8	172.9	0	0	0	113.3	E28 T35 L39 N40 A41	E28-I37 WeakPolarHBondContact OE2-CG2 3.33Å; T35-I37 HydrophobicContact CG2-CG2 3.84Å; T35-I37 PolarHBondContact O-N 3.11Å; I37-L39 VanDerWaalsContact C-N 3.29Å; I37-L39 PolarHBondContact O-N 3.36Å; I37-N40 WeakPolarHBondContact CA-OD1 3.25Å; I37-N40 PolarHBondContact O-N 2.91Å; I37-A41 PolarHBondContact O-N 2.82Å
38	T	98.4	Very high	96.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-36.8	174.4	-56.6	0	0	0	0	111.2	V25 A27 E28 L34 T35 P36 N40 A41 I42	V25-T38 HydrophobicContact CG1-CG2 4.24Å; A27-T38 HydrophobicContact CB-CG2 3.94Å; E28-T38 PolarHBondContact N-OG1 3.47Å; E28-T38 PolarHBondContact O-OG1 3.05Å; L34-T38 HydrophobicContact CD1-CG2 3.93Å; L34-T38 HydrophobicContact CD2-CG2 4.33Å; L34-T38 HydrophobicContact CG-CG2 4.41Å; T35-T38 WeakPolarHBondContact O-CB 3.4Å; T35-T38 PolarHBondContact O-N 3.37Å; T35-T38 PolarHBondContact O-OG1 2.96Å; P36-T38 PolarHBondContact O-N 3.18Å; T38-N40 VanDerWaalsContact C-N 3.35Å; T38-N40 PolarHBondContact O-N 2.94Å; T38-A41 WeakPolarHBondContact O-CB 3.44Å; T38-A41 PolarHBondContact O-N 3.48Å; T38-I42 HydrophobicContact CG2-CD1 4.11Å; T38-I42 VanDerWaalsContact O-CG1 3.31Å; T38-I42 WeakPolarHBondContact O-CG1 3.44Å; T38-I42 PolarHBondContact O-N 2.89Å
39	L	98.4	Very high	95.9	Very high	27 Å²	27	39.3 Å²	39.3	14%	0.141	22%	0.217	C	C	.	.	H	α-helix	trans	-65.4	-38.6	177.3	-58.9	178.5	0	0	0	111.6	L34 P36 I37 A41 I42 T43 V71 A176 A177	L34-L39 HydrophobicContact CD2-CD2 3.8Å; L34-L39 HydrophobicContact CD2-CG 4.26Å; P36-L39 WeakPolarHBondContact O-CB 3.35Å; P36-L39 PolarHBondContact O-N 3.4Å; I37-L39 VanDerWaalsContact C-N 3.29Å; I37-L39 PolarHBondContact O-N 3.36Å; L39-A41 VanDerWaalsContact C-N 3.35Å; L39-I42 PolarHBondContact O-N 3.41Å; L39-T43 PolarHBondContact O-N 3.47Å; L39-T43 VanDerWaalsContact O-N 3.1Å; L39-T43 PolarHBondContact O-OG1 2.74Å; L39-V71 HydrophobicContact CD2-CB 4.48Å; L39-V71 HydrophobicContact CD2-CG1 3.89Å; L39-V71 HydrophobicContact CD2-CG2 3.64Å; L39-A176 HydrophobicContact CB-CB 3.89Å; L39-A176 HydrophobicContact CD1-CB 4.36Å; L39-A177 HydrophobicContact CB-CB 4.4Å; L39-A177 WeakPolarHBondContact O-CB 3.48Å; L39-A177 PolarHBondContact O-N 2.9Å; L39-A177 VanDerWaalsContact O-N 3.13Å
40	N	98.4	Very high	95.6	Very high	25 Å²	25	39.6 Å²	39.6	13%	0.134	23%	0.228	C	C	.	.	H	α-helix	trans	-66.7	-39	174.9	-50.1	91.8	0	0	0	111	P36 I37 T38 T43 A44 G171 F174 A176	P36-N40 PolarHBondContact O-OD1 3.28Å; P36-N40 VanDerWaalsContact O-OD1 3.09Å; I37-N40 WeakPolarHBondContact CA-OD1 3.25Å; I37-N40 PolarHBondContact O-N 2.91Å; T38-N40 VanDerWaalsContact C-N 3.35Å; T38-N40 PolarHBondContact O-N 2.94Å; N40-T43 PolarHBondContact O-N 2.8Å; N40-A44 PolarHBondContact O-N 2.74Å; N40-G171 PolarHBondContact ND2-O 2.99Å; N40-G171 VanDerWaalsContact ND2-O 3.15Å; N40-F174 HydrophobicContact CB-CB 4.49Å; N40-F174 PolarHBondContact ND2-O 2.84Å; N40-A176 PolarHBondContact ND2-N 2.97Å
41	A	98.6	Very high	95.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-37.6	175.3	0	0	0	0	0	112.4	V25 I37 T38 L39 A44 A45 V169	V25-A41 HydrophobicContact CG1-CB 4.12Å; I37-A41 PolarHBondContact O-N 2.82Å; T38-A41 WeakPolarHBondContact O-CB 3.44Å; T38-A41 PolarHBondContact O-N 3.48Å; L39-A41 VanDerWaalsContact C-N 3.35Å; A41-A44 PolarHBondContact O-N 2.81Å; A41-A45 WeakPolarHBondContact O-CB 3.43Å; A41-A45 PolarHBondContact O-N 3.05Å; A41-V169 HydrophobicContact CB-CB 4.42Å; A41-V169 HydrophobicContact CB-CG2 4.45Å
42	I	98.6	Very high	96.1	Very high	4 Å²	4	37 Å²	37	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-63.1	-44.4	173.7	-69.5	164.3	0	0	0	110.7	V25 T38 L39 A44 A45 G46 V71 V74 A177	V25-I42 HydrophobicContact CG1-CG1 4.23Å; V25-I42 HydrophobicContact CG2-CG1 4.33Å; T38-I42 HydrophobicContact CG2-CD1 4.11Å; T38-I42 VanDerWaalsContact O-CG1 3.31Å; T38-I42 WeakPolarHBondContact O-CG1 3.44Å; T38-I42 PolarHBondContact O-N 2.89Å; L39-I42 PolarHBondContact O-N 3.41Å; I42-A44 VanDerWaalsContact C-N 3.32Å; I42-A44 PolarHBondContact O-N 3.33Å; I42-A45 WeakPolarHBondContact O-CB 3.47Å; I42-A45 PolarHBondContact O-N 3.15Å; I42-G46 PolarHBondContact O-N 3.25Å; I42-V71 HydrophobicContact CD1-CG1 3.87Å; I42-V71 HydrophobicContact CG2-CG1 4.23Å; I42-V74 HydrophobicContact CD1-CG2 3.79Å; I42-V74 HydrophobicContact CG1-CG2 4.3Å; I42-V74 HydrophobicContact CG2-CG2 4.04Å; I42-A177 HydrophobicContact CB-CB 4.21Å; I42-A177 HydrophobicContact CG2-CB 3.93Å
43	T	98.4	Very high	96.4	Very high	37 Å²	37	33.6 Å²	33.6	23%	0.227	20%	0.197	C	C	.	.	H	α-helix	trans	-59.4	-43.5	174.2	-62.8	0	0	0	0	111.9	L39 N40 G46 K47 F174 E175 A177	L39-T43 PolarHBondContact O-N 3.47Å; L39-T43 VanDerWaalsContact O-N 3.1Å; L39-T43 PolarHBondContact O-OG1 2.74Å; N40-T43 PolarHBondContact O-N 2.8Å; T43-G46 PolarHBondContact O-N 2.78Å; T43-K47 PolarHBondContact O-N 2.9Å; T43-F174 HydrophobicContact CG2-CB 4.36Å; T43-E175 WeakPolarHBondContact CB-O 3.43Å; T43-E175 WeakPolarHBondContact CG2-O 3.11Å; T43-E175 PolarHBondContact OG1-O 2.65Å; T43-A177 WeakPolarHBondContact OG1-CA 3.45Å; T43-A177 PolarHBondContact OG1-N 3.28Å
44	A	98.4	Very high	96.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.6	-44.8	176	0	0	0	0	0	111.7	N40 A41 I42 G46 K47 I139 V169 F174	N40-A44 PolarHBondContact O-N 2.74Å; A41-A44 PolarHBondContact O-N 2.81Å; I42-A44 VanDerWaalsContact C-N 3.32Å; I42-A44 PolarHBondContact O-N 3.33Å; A44-G46 VanDerWaalsContact C-N 3.32Å; A44-G46 PolarHBondContact O-N 2.77Å; A44-K47 WeakPolarHBondContact O-CB 3.36Å; A44-K47 PolarHBondContact O-N 3.37Å; A44-K47 VanDerWaalsContact O-N 3.11Å; A44-I139 HydrophobicContact CB-CD1 4.04Å; A44-I139 WeakPolarHBondContact O-CD1 3.46Å; A44-V169 HydrophobicContact CB-CB 4.38Å; A44-V169 HydrophobicContact CB-CG1 3.62Å; A44-V169 HydrophobicContact CB-CG2 3.81Å; A44-F174 HydrophobicContact CB-CD1 3.7Å; A44-F174 HydrophobicContact CB-CD2 4.17Å; A44-F174 HydrophobicContact CB-CE1 3.78Å; A44-F174 HydrophobicContact CB-CE2 4.25Å; A44-F174 HydrophobicContact CB-CG 3.92Å; A44-F174 HydrophobicContact CB-CZ 4.07Å
45	A	98.2	Very high	96.7	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.3	-42.7	175.6	0	0	0	0	0	112	T23 V25 A41 I42 K47 L48 V52	T23-A45 HydrophobicContact CG2-CB 3.62Å; V25-A45 HydrophobicContact CG2-CB 3.74Å; A41-A45 WeakPolarHBondContact O-CB 3.43Å; A41-A45 PolarHBondContact O-N 3.05Å; I42-A45 WeakPolarHBondContact O-CB 3.47Å; I42-A45 PolarHBondContact O-N 3.15Å; A45-K47 PolarHBondContact O-N 3.41Å; A45-L48 WeakPolarHBondContact O-CB 3.49Å; A45-L48 PolarHBondContact O-N 2.9Å; A45-V52 HydrophobicContact CB-CG1 3.93Å; A45-V52 HydrophobicContact CB-CG2 3.89Å
46	G	96.8	Very high	96.9	Very high	46 Å²	46	25 Å²	25	47%	0.474	16%	0.156	S	C	.	.	H	α-helix	trans	-60.1	-25.8	176.8	0	0	0	0	0	114.2	I42 T43 A44 L48 G49	I42-G46 PolarHBondContact O-N 3.25Å; T43-G46 PolarHBondContact O-N 2.78Å; A44-G46 VanDerWaalsContact C-N 3.32Å; A44-G46 PolarHBondContact O-N 2.77Å; G46-L48 VanDerWaalsContact C-N 3.31Å; G46-L48 PolarHBondContact O-N 2.93Å; G46-G49 PolarHBondContact O-N 2.92Å
47	K	96.6	Very high	97	Very high	128 Å²	128	22.5 Å²	22.5	56%	0.557	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-17.6	176.1	-68.6	-176.3	179.9	-177.7	0	113.9	T43 A44 A45 I139 F174	T43-K47 PolarHBondContact O-N 2.9Å; A44-K47 WeakPolarHBondContact O-CB 3.36Å; A44-K47 PolarHBondContact O-N 3.37Å; A44-K47 VanDerWaalsContact O-N 3.11Å; A45-K47 PolarHBondContact O-N 3.41Å; K47-I139 HydrophobicContact CB-CD1 4.31Å; K47-F174 HydrophobicContact CD-CD1 4.11Å; K47-F174 HydrophobicContact CD-CE1 3.91Å
48	L	95.4	Very high	97	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.01	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-21.3	176	-60.1	169.7	0	0	0	112.1	T23 A45 G46 H108 I139 P142 F145 F167	T23-L48 HydrophobicContact CG2-CD1 4.19Å; A45-L48 WeakPolarHBondContact O-CB 3.49Å; A45-L48 PolarHBondContact O-N 2.9Å; G46-L48 VanDerWaalsContact C-N 3.31Å; G46-L48 PolarHBondContact O-N 2.93Å; L48-H108 HydrophobicContact CD1-CB 3.91Å; L48-I139 HydrophobicContact CD2-CD1 4.17Å; L48-I139 HydrophobicContact CD2-CG2 3.76Å; L48-I139 HydrophobicContact CG-CD1 4.36Å; L48-P142 HydrophobicContact CD2-CB 4.45Å; L48-F145 HydrophobicContact CD2-CE1 4.19Å; L48-F167 HydrophobicContact CD1-CE1 4.2Å; L48-F167 HydrophobicContact CD1-CZ 3.86Å
49	G	87.3	Confident	96.9	Very high	11 Å²	11	23 Å²	23	11%	0.113	15%	0.145	C	C	.	.			trans	75.8	171	-166.5	0	0	0	0	0	112.4	Q21 G46	Q21-G49 WeakPolarHBondContact CB-O 3.27Å; G46-G49 PolarHBondContact O-N 2.92Å
50	G	91.1	Very high	96.7	Very high	38 Å²	38	25.8 Å²	25.8	39%	0.392	16%	0.161	S	C	.	.	S	Bend	trans	80.6	-169.9	-174.2	0	0	0	0	0	113.5	Q18 Q21	Q18-G50 WeakPolarHBondContact O-CA 3.41Å; Q21-G50 VanDerWaalsContact O-CA 3.27Å; Q21-G50 WeakPolarHBondContact O-CA 3.4Å
51	D	94.8	Very high	96.6	Very high	91 Å²	91	24.6 Å²	24.6	49%	0.487	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	139.3	-177.8	-74.1	-24.9	0	0	0	111.5	Q21 S22 T23 K75	Q21-D51 PolarHBondContact O-N 3.35Å; S22-D51 WeakPolarHBondContact CA-O 3.46Å; T23-D51 PolarHBondContact N-O 2.72Å; D51-K75 HydrophobicContact CB-CB 4.3Å; D51-K75 HydrophobicContact CB-CG 4.32Å
52	V	98	Very high	96.4	Very high	5 Å²	5	27.7 Å²	27.7	3%	0.03	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	118.7	174.1	-177.5	0	0	0	0	109.3	V25 A45 K75	V25-V52 HydrophobicContact CG2-CG1 3.77Å; A45-V52 HydrophobicContact CB-CG1 3.93Å; A45-V52 HydrophobicContact CB-CG2 3.89Å; V52-K75 WeakPolarHBondContact O-CB 3.08Å; V52-K75 PolarHBondContact O-N 2.78Å
53	S	98.6	Very high	96.4	Very high	10 Å²	10	32.9 Å²	32.9	7%	0.07	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	145.4	170	-58.4	0	0	0	0	110.2	T23 V25 K76	T23-S53 PolarHBondContact O-N 3.21Å; V25-S53 PolarHBondContact N-O 3.5Å; S53-K76 CarbonylContact C-O 3.52Å; S53-K76 VanDerWaalsContact CA-O 3.26Å; S53-K76 WeakPolarHBondContact CA-O 3.41Å
54	C	98.6	Very high	96.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.8	173.4	-70	0	0	0	0	110.5	V25 I68 V74 K76 I77 L78	V25-C54 CarbonylContact O-C 3.56Å; V25-C54 VanDerWaalsContact O-CA 3.29Å; V25-C54 WeakPolarHBondContact O-CA 3.39Å; C54-I68 HydrophobicContact CB-CG2 3.99Å; C54-V74 HydrophobicContact CB-CG1 4.22Å; C54-K76 PolarHBondContact N-O 3.21Å; C54-I77 CarbonylContact O-C 3.57Å; C54-I77 WeakPolarHBondContact O-CA 3.43Å; C54-L78 PolarHBondContact O-N 3.14Å
55	L	98.7	Very high	96.3	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125.4	169	176.7	66.2	0	0	0	109.8	L24 V25 A27 L78 L96 I97 V189	L24-L55 HydrophobicContact CD1-CB 3.91Å; V25-L55 PolarHBondContact O-N 2.65Å; A27-L55 WeakPolarHBondContact CB-O 3.23Å; A27-L55 PolarHBondContact N-O 3.35Å; L55-L78 WeakPolarHBondContact CA-O 3.39Å; L55-L78 HydrophobicContact CD1-CB 3.93Å; L55-L96 HydrophobicContact CD1-CD2 4.31Å; L55-L96 HydrophobicContact CD2-CD2 4.18Å; L55-L96 HydrophobicContact CD2-CG 4.34Å; L55-I97 HydrophobicContact CD2-CG1 3.65Å; L55-V189 HydrophobicContact CD1-CG2 4.11Å
56	I	98.4	Very high	96.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.7	172.8	-55.3	173.2	0	0	0	107.4	A27 C61 V64 V65 I68 I77 L78 A80	A27-I56 HydrophobicContact CB-CG1 4.13Å; I56-C61 HydrophobicContact CG2-CB 3.84Å; I56-V64 HydrophobicContact CD1-CG1 4.2Å; I56-V64 HydrophobicContact CG2-CB 4.42Å; I56-V64 HydrophobicContact CG2-CG1 4.14Å; I56-V65 HydrophobicContact CD1-CB 4.3Å; I56-V65 HydrophobicContact CD1-CG2 3.69Å; I56-I68 HydrophobicContact CD1-CB 4.18Å; I56-I68 HydrophobicContact CD1-CD1 3.43Å; I56-I68 VanDerWaalsContact CD1-CD1 3.43Å; I56-I68 HydrophobicContact CD1-CG1 4.23Å; I56-I68 HydrophobicContact CG1-CD1 3.62Å; I56-I77 HydrophobicContact CD1-CG2 3.46Å; I56-I77 VanDerWaalsContact CD1-CG2 3.46Å; I56-I77 HydrophobicContact CG1-CG2 4.05Å; I56-L78 PolarHBondContact N-O 2.86Å; I56-A80 PolarHBondContact O-N 3Å
57	A	97.9	Very high	96.3	Very high	15 Å²	15	38.5 Å²	38.5	12%	0.124	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	119.9	-177.9	0	0	0	0	0	110.2	H29 A80 Y85 L93 L96	H29-A57 PolarHBondContact NE2-O 3.02Å; A57-A80 VanDerWaalsContact CA-O 3.31Å; A57-A80 WeakPolarHBondContact CA-O 3.47Å; A57-A80 HydrophobicContact CB-CB 4.21Å; A57-Y85 HydrophobicContact CB-CD2 4.44Å; A57-Y85 HydrophobicContact CB-CG 4.47Å; A57-L93 HydrophobicContact CB-CD2 3.49Å; A57-L93 VanDerWaalsContact CB-CD2 3.49Å; A57-L96 HydrophobicContact CB-CD2 3.54Å
58	G	96.9	Very high	96.3	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.9	-174.7	-173.6	0	0	0	0	0	112.9	A80 Q81 H82	G58-A80 PolarHBondContact N-O 3.43Å; G58-A80 VanDerWaalsContact N-O 3.15Å; G58-Q81 VanDerWaalsContact O-CA 3.3Å; G58-Q81 WeakPolarHBondContact O-CA 3.31Å; G58-H82 PolarHBondContact O-N 3.3Å
59	T	96.4	Very high	96.4	Very high	41 Å²	41	33.8 Å²	33.8	25%	0.252	20%	0.198	S	C	.	.	S	Bend	trans	-88.3	-28.1	-179	59.4	0	0	0	0	112.2	N31 Q81 K86	N31-T59 PolarHBondContact OD1-N 2.64Å; N31-T59 VanDerWaalsContact OD1-N 3.12Å; T59-Q81 VanDerWaalsContact O-CG 3.3Å; T59-Q81 WeakPolarHBondContact O-CG 3.26Å; T59-K86 HydrophobicContact CG2-CB 3.88Å
60	N	95.1	Very high	96.9	Very high	86 Å²	86	37.6 Å²	37.6	46%	0.46	21%	0.212	S	C	.	.			trans	-145.3	109.7	174.6	-178	9.2	0	0	0	108.7	N31	N31-N60 CarbonylContact C-O 3.58Å; N31-N60 WeakPolarHBondContact CA-O 3.45Å; N31-N60 HydrophobicContact CB-CB 4.43Å; N31-N60 VanDerWaalsContact CB-O 3.26Å; N31-N60 WeakPolarHBondContact CB-O 3.49Å
61	C	95.3	Very high	97.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.			trans	-109.2	-9.4	-168.7	-60.5	0	0	0	0	113.3	I56 K63 V64 V65 V79	I56-C61 HydrophobicContact CG2-CB 3.84Å; C61-K63 PolarHBondContact O-N 2.86Å; C61-V64 PolarHBondContact O-N 3.24Å; C61-V64 VanDerWaalsContact O-N 3.09Å; C61-V65 HydrophobicContact CB-CG2 4.16Å; C61-V65 VanDerWaalsContact O-CG2 3.27Å; C61-V65 WeakPolarHBondContact O-CG2 3.36Å; C61-V65 PolarHBondContact O-N 2.93Å; C61-V79 HydrophobicContact CB-CG1 3.96Å
62	A	96.1	Very high	97.3	Very high	65 Å²	65	37 Å²	37	54%	0.537	20%	0.196	S	C	.	.	H	α-helix	trans	-55	-47.1	-166.3	0	0	0	0	0	113.8	V65 E66	A62-V65 PolarHBondContact O-N 3.18Å; A62-E66 PolarHBondContact O-N 3.47Å
63	K	96.8	Very high	97.1	Very high	113 Å²	113	39.3 Å²	39.3	49%	0.491	22%	0.22	S	C	.	.	H	α-helix	trans	-66.1	-41.5	179.4	-71.4	176	169.5	178.8	0	112.5	D32 C61 V65 E66 E67	D32-K63 WeakPolarHBondContact O-CB 3.49Å; D32-K63 WeakPolarHBondContact OD1-CD 3.49Å; D32-K63 WeakPolarHBondContact OD1-CE 3.27Å; D32-K63 IonicContact OD1-NZ 2.95Å; D32-K63 PolarHBondContact OD1-NZ 2.7Å; C61-K63 PolarHBondContact O-N 2.86Å; K63-V65 VanDerWaalsContact C-N 3.35Å; K63-E66 WeakPolarHBondContact O-CB 3.38Å; K63-E66 PolarHBondContact O-N 2.68Å; K63-E67 PolarHBondContact O-N 3.49Å
64	V	97.4	Very high	97.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-69.3	-35.9	179.5	-176.2	0	0	0	0	111.1	H29 L34 I56 C61 E66 E67 I68	H29-V64 HydrophobicContact CB-CB 4.48Å; H29-V64 HydrophobicContact CB-CG1 3.77Å; H29-V64 HydrophobicContact CB-CG2 3.91Å; L34-V64 HydrophobicContact CB-CG1 4.44Å; L34-V64 HydrophobicContact CD1-CG1 3.92Å; I56-V64 HydrophobicContact CD1-CG1 4.2Å; I56-V64 HydrophobicContact CG2-CB 4.42Å; I56-V64 HydrophobicContact CG2-CG1 4.14Å; C61-V64 PolarHBondContact O-N 3.24Å; C61-V64 VanDerWaalsContact O-N 3.09Å; V64-E66 VanDerWaalsContact C-N 3.34Å; V64-E67 PolarHBondContact O-N 2.85Å; V64-I68 HydrophobicContact CG1-CD1 4.11Å; V64-I68 WeakPolarHBondContact O-CB 3.48Å; V64-I68 WeakPolarHBondContact O-CG1 3.41Å; V64-I68 PolarHBondContact O-N 3.29Å
65	V	97.6	Very high	97	Very high	23 Å²	23	45.7 Å²	45.7	14%	0.139	25%	0.247	C	C	.	.	H	α-helix	trans	-61.3	-44.7	171.3	172.3	0	0	0	0	110.3	I56 C61 A62 K63 I68 S69 I77 V79	I56-V65 HydrophobicContact CD1-CB 4.3Å; I56-V65 HydrophobicContact CD1-CG2 3.69Å; C61-V65 HydrophobicContact CB-CG2 4.16Å; C61-V65 VanDerWaalsContact O-CG2 3.27Å; C61-V65 WeakPolarHBondContact O-CG2 3.36Å; C61-V65 PolarHBondContact O-N 2.93Å; A62-V65 PolarHBondContact O-N 3.18Å; K63-V65 VanDerWaalsContact C-N 3.35Å; V65-I68 PolarHBondContact O-N 3.1Å; V65-S69 WeakPolarHBondContact O-CB 3.13Å; V65-S69 PolarHBondContact O-N 3.35Å; V65-I77 HydrophobicContact CG1-CD1 4.39Å; V65-I77 HydrophobicContact CG2-CG2 4.48Å; V65-V79 HydrophobicContact CG1-CG2 4.5Å; V65-V79 HydrophobicContact CG2-CG1 4.1Å; V65-V79 HydrophobicContact CG2-CG2 3.57Å
66	E	97.1	Very high	96.9	Very high	108 Å²	108	48.7 Å²	48.7	51%	0.505	26%	0.26	S	S	.	.	H	α-helix	trans	-60.4	-47.5	176.2	-166.4	-164.8	151.6	0	0	111.6	A62 K63 V64 S69 K70	A62-E66 PolarHBondContact O-N 3.47Å; K63-E66 WeakPolarHBondContact O-CB 3.38Å; K63-E66 PolarHBondContact O-N 2.68Å; V64-E66 VanDerWaalsContact C-N 3.34Å; E66-S69 PolarHBondContact O-N 3.39Å; E66-S69 PolarHBondContact O-OG 3.13Å; E66-K70 IonicContact OE1-NZ 2.71Å; E66-K70 PolarHBondContact OE1-NZ 3.02Å
67	E	97.5	Very high	96.9	Very high	69 Å²	69	48.7 Å²	48.7	32%	0.322	26%	0.26	S	S	.	.	H	α-helix	trans	-58.3	-51.9	176.3	-73	-175.5	-179.3	0	0	111.4	L34 K63 V64 S69 K70	L34-E67 WeakPolarHBondContact CB-OE2 3.43Å; L34-E67 PolarHBondContact N-OE2 3.06Å; K63-E67 PolarHBondContact O-N 3.49Å; V64-E67 PolarHBondContact O-N 2.85Å; E67-S69 VanDerWaalsContact C-N 3.29Å; E67-S69 PolarHBondContact O-N 2.91Å; E67-K70 PolarHBondContact O-N 2.81Å
68	I	97.3	Very high	96.9	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.2	-33	-178.6	-72.2	177.7	0	0	0	111.9	A27 L34 C54 I56 V64 V65 K70 V71 V74 I77	A27-I68 HydrophobicContact CB-CD1 3.67Å; L34-I68 HydrophobicContact CD1-CD1 3.53Å; L34-I68 HydrophobicContact CD1-CG1 3.88Å; L34-I68 HydrophobicContact CD2-CD1 4.35Å; L34-I68 HydrophobicContact CD2-CG1 3.83Å; L34-I68 HydrophobicContact CG-CG1 4.44Å; C54-I68 HydrophobicContact CB-CG2 3.99Å; I56-I68 HydrophobicContact CD1-CB 4.18Å; I56-I68 HydrophobicContact CD1-CD1 3.43Å; I56-I68 VanDerWaalsContact CD1-CD1 3.43Å; I56-I68 HydrophobicContact CD1-CG1 4.23Å; I56-I68 HydrophobicContact CG1-CD1 3.62Å; V64-I68 HydrophobicContact CG1-CD1 4.11Å; V64-I68 WeakPolarHBondContact O-CB 3.48Å; V64-I68 WeakPolarHBondContact O-CG1 3.41Å; V64-I68 PolarHBondContact O-N 3.29Å; V65-I68 PolarHBondContact O-N 3.1Å; I68-K70 PolarHBondContact O-N 2.81Å; I68-K70 VanDerWaalsContact O-N 3.14Å; I68-V71 WeakPolarHBondContact O-CB 3.19Å; I68-V71 PolarHBondContact O-N 3.37Å; I68-V74 HydrophobicContact CG2-CG1 4.09Å; I68-V74 HydrophobicContact CG2-CG2 4.3Å; I68-I77 HydrophobicContact CB-CD1 4.06Å; I68-I77 HydrophobicContact CG2-CD1 3.65Å; I68-I77 HydrophobicContact CG2-CG1 3.74Å
69	S	97.6	Very high	97	Very high	31 Å²	31	48.8 Å²	48.8	22%	0.217	26%	0.259	C	S	.	.	H	α-helix	trans	-58.9	-28.8	-179.8	75	0	0	0	0	113.5	V65 E66 E67 G182 S183 A184	V65-S69 WeakPolarHBondContact O-CB 3.13Å; V65-S69 PolarHBondContact O-N 3.35Å; E66-S69 PolarHBondContact O-N 3.39Å; E66-S69 PolarHBondContact O-OG 3.13Å; E67-S69 VanDerWaalsContact C-N 3.29Å; E67-S69 PolarHBondContact O-N 2.91Å; S69-G182 CarbonylContact O-C 3.57Å; S69-S183 WeakPolarHBondContact O-CA 3.4Å; S69-S183 PolarHBondContact O-N 3.38Å; S69-S183 VanDerWaalsContact O-N 3.15Å; S69-A184 PolarHBondContact O-N 3.07Å
70	K	97.8	Very high	97.1	Very high	92 Å²	92	46.9 Å²	46.9	40%	0.4	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-10.9	-179.6	-59.1	171.7	-169.2	167.7	0	112.6	E66 E67 I68 Q72 A179 E180 G181 G182	E66-K70 IonicContact OE1-NZ 2.71Å; E66-K70 PolarHBondContact OE1-NZ 3.02Å; E67-K70 PolarHBondContact O-N 2.81Å; I68-K70 PolarHBondContact O-N 2.81Å; I68-K70 VanDerWaalsContact O-N 3.14Å; K70-Q72 PolarHBondContact O-N 2.99Å; K70-A179 CarbonylContact C-O 3.17Å; K70-A179 WeakPolarHBondContact CB-O 3.22Å; K70-A179 CarbonylContact O-C 3.58Å; K70-E180 CarbonylContact O-C 3.56Å; K70-E180 WeakPolarHBondContact O-CA 3.3Å; K70-E180 PolarHBondContact O-N 2.99Å; K70-G181 PolarHBondContact O-N 3.23Å; K70-G182 WeakPolarHBondContact O-CA 3.38Å; K70-G182 PolarHBondContact O-N 3.45Å
71	V	98.1	Very high	97.1	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.012	25%	0.248	C	C	.	.	S	Bend	trans	-72	125	-177.8	179.3	0	0	0	0	110.7	L39 I42 I68 G73 V74 A177 S178 G182	L39-V71 HydrophobicContact CD2-CB 4.48Å; L39-V71 HydrophobicContact CD2-CG1 3.89Å; L39-V71 HydrophobicContact CD2-CG2 3.64Å; I42-V71 HydrophobicContact CD1-CG1 3.87Å; I42-V71 HydrophobicContact CG2-CG1 4.23Å; I68-V71 WeakPolarHBondContact O-CB 3.19Å; I68-V71 PolarHBondContact O-N 3.37Å; V71-G73 PolarHBondContact O-N 2.88Å; V71-V74 HydrophobicContact CB-CG2 4.03Å; V71-V74 HydrophobicContact CG1-CG2 4.02Å; V71-V74 PolarHBondContact O-N 2.88Å; V71-A177 HydrophobicContact CG1-CB 3.78Å; V71-S178 CarbonylContact C-O 3.54Å; V71-S178 WeakPolarHBondContact CA-O 3.26Å; V71-G182 WeakPolarHBondContact O-CA 3.33Å
72	Q	96.2	Very high	97.1	Very high	115 Å²	115	51.6 Å²	51.6	54%	0.537	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	135.5	176.9	-169.7	179.9	10.8	0	0	111.1	K70 S178	K70-Q72 PolarHBondContact O-N 2.99Å; Q72-S178 PolarHBondContact N-O 3.26Å
73	G	93.9	Very high	97	Very high	52 Å²	52	54.6 Å²	54.6	54%	0.536	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	-12.9	176.9	0	0	0	0	0	114.6	V71	V71-G73 PolarHBondContact O-N 2.88Å
74	V	97.7	Very high	96.9	Very high	10 Å²	10	50.2 Å²	50.2	6%	0.061	26%	0.258	C	S	.	.			trans	-79.4	128.8	171.8	-174	0	0	0	0	109.5	I42 C54 I68 V71 I77 A184	I42-V74 HydrophobicContact CD1-CG2 3.79Å; I42-V74 HydrophobicContact CG1-CG2 4.3Å; I42-V74 HydrophobicContact CG2-CG2 4.04Å; C54-V74 HydrophobicContact CB-CG1 4.22Å; I68-V74 HydrophobicContact CG2-CG1 4.09Å; I68-V74 HydrophobicContact CG2-CG2 4.3Å; V71-V74 HydrophobicContact CB-CG2 4.03Å; V71-V74 HydrophobicContact CG1-CG2 4.02Å; V71-V74 PolarHBondContact O-N 2.88Å; V74-I77 HydrophobicContact CG1-CG1 4.22Å; V74-A184 HydrophobicContact CB-CB 4.02Å; V74-A184 HydrophobicContact CG1-CB 3.71Å; V74-A184 WeakPolarHBondContact O-CB 3.36Å
75	K	96.6	Very high	96.9	Very high	134 Å²	134	50.4 Å²	50.4	58%	0.583	26%	0.258	S	S	*	.			trans	-98.4	-39	179.7	-173.7	59.8	174.4	179.5	0	112.8	D51 V52	D51-K75 HydrophobicContact CB-CB 4.3Å; D51-K75 HydrophobicContact CB-CG 4.32Å; V52-K75 WeakPolarHBondContact O-CB 3.08Å; V52-K75 PolarHBondContact O-N 2.78Å
76	K	97.4	Very high	96.8	Very high	65 Å²	65	54.5 Å²	54.5	28%	0.283	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	142.9	-177	-175.7	-179.8	-72	-155.3	0	110.5	S53 C54 L78 E187	S53-K76 CarbonylContact C-O 3.52Å; S53-K76 VanDerWaalsContact CA-O 3.26Å; S53-K76 WeakPolarHBondContact CA-O 3.41Å; C54-K76 PolarHBondContact N-O 3.21Å; K76-L78 HydrophobicContact CD-CD2 3.6Å; K76-L78 HydrophobicContact CD-CG 4.48Å; K76-L78 HydrophobicContact CG-CD2 4.05Å; K76-E187 IonicContact NZ-OE2 2.74Å; K76-E187 PolarHBondContact NZ-OE2 3.36Å
77	I	98.4	Very high	96.7	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127	171.5	-53.4	173.9	0	0	0	107.9	C54 I56 V65 I68 V74 V79 A184 A185 S186 E187	C54-I77 CarbonylContact O-C 3.57Å; C54-I77 WeakPolarHBondContact O-CA 3.43Å; I56-I77 HydrophobicContact CD1-CG2 3.46Å; I56-I77 VanDerWaalsContact CD1-CG2 3.46Å; I56-I77 HydrophobicContact CG1-CG2 4.05Å; V65-I77 HydrophobicContact CG1-CD1 4.39Å; V65-I77 HydrophobicContact CG2-CG2 4.48Å; I68-I77 HydrophobicContact CB-CD1 4.06Å; I68-I77 HydrophobicContact CG2-CD1 3.65Å; I68-I77 HydrophobicContact CG2-CG1 3.74Å; V74-I77 HydrophobicContact CG1-CG1 4.22Å; I77-V79 HydrophobicContact CG2-CG2 3.87Å; I77-A184 HydrophobicContact CD1-CB 4.08Å; I77-A184 HydrophobicContact CG1-CB 3.89Å; I77-A185 PolarHBondContact N-O 3.01Å; I77-S186 CarbonylContact O-C 3.58Å; I77-S186 WeakPolarHBondContact O-CA 3.43Å; I77-E187 PolarHBondContact O-N 3.5Å
78	L	98.6	Very high	96.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.1	174.1	-58.2	178.9	0	0	0	107.5	L24 C54 L55 I56 K76 T100 F104 F106 E187 V189	L24-L78 HydrophobicContact CD1-CD1 4.15Å; C54-L78 PolarHBondContact O-N 3.14Å; L55-L78 WeakPolarHBondContact CA-O 3.39Å; L55-L78 HydrophobicContact CD1-CB 3.93Å; I56-L78 PolarHBondContact N-O 2.86Å; K76-L78 HydrophobicContact CD-CD2 3.6Å; K76-L78 HydrophobicContact CD-CG 4.48Å; K76-L78 HydrophobicContact CG-CD2 4.05Å; L78-T100 HydrophobicContact CD1-CG2 3.6Å; L78-F104 HydrophobicContact CD1-CD2 4.02Å; L78-F104 HydrophobicContact CD1-CE2 3.89Å; L78-F104 HydrophobicContact CD2-CE2 3.93Å; L78-F104 HydrophobicContact CD2-CZ 3.86Å; L78-F106 HydrophobicContact CD1-CE2 4.42Å; L78-F106 HydrophobicContact CD1-CZ 4.13Å; L78-E187 WeakPolarHBondContact CA-O 3.45Å; L78-E187 HydrophobicContact CD2-CB 4.4Å; L78-V189 HydrophobicContact CB-CG1 3.88Å; L78-V189 HydrophobicContact CB-CG2 4.41Å; L78-V189 HydrophobicContact CD1-CG1 4.39Å; L78-V189 HydrophobicContact CD2-CG1 3.81Å; L78-V189 HydrophobicContact CG-CG1 4.24Å
79	V	98.3	Very high	96.7	Very high	18 Å²	18	50.8 Å²	50.8	11%	0.109	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123	-173.4	-171.3	0	0	0	0	109.9	C61 V65 I77 E187 E188 V189	C61-V79 HydrophobicContact CB-CG1 3.96Å; V65-V79 HydrophobicContact CG1-CG2 4.5Å; V65-V79 HydrophobicContact CG2-CG1 4.1Å; V65-V79 HydrophobicContact CG2-CG2 3.57Å; I77-V79 HydrophobicContact CG2-CG2 3.87Å; V79-E187 PolarHBondContact N-O 2.94Å; V79-E188 WeakPolarHBondContact O-CA 3.33Å; V79-V189 PolarHBondContact O-N 3.46Å
80	A	97.4	Very high	96.7	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.008	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	96.6	173.3	0	0	0	0	0	109.1	I56 A57 G58 Y85 L96 V189	I56-A80 PolarHBondContact O-N 3Å; A57-A80 VanDerWaalsContact CA-O 3.31Å; A57-A80 WeakPolarHBondContact CA-O 3.47Å; A57-A80 HydrophobicContact CB-CB 4.21Å; G58-A80 PolarHBondContact N-O 3.43Å; G58-A80 VanDerWaalsContact N-O 3.15Å; A80-Y85 HydrophobicContact CB-CE2 3.76Å; A80-Y85 WeakPolarHBondContact O-CD2 3.43Å; A80-Y85 WeakPolarHBondContact O-CE2 3.42Å; A80-L96 HydrophobicContact CB-CD1 3.74Å; A80-L96 HydrophobicContact CB-CD2 3.45Å; A80-L96 VanDerWaalsContact CB-CD2 3.45Å; A80-L96 HydrophobicContact CB-CG 4.23Å; A80-V189 HydrophobicContact CB-CG2 3.86Å
81	Q	96.1	Very high	96.7	Very high	101 Å²	101	47.4 Å²	47.4	47%	0.472	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	117.1	-180	-169.1	171.7	-72.7	0	0	110.9	G58 T59	G58-Q81 VanDerWaalsContact O-CA 3.3Å; G58-Q81 WeakPolarHBondContact O-CA 3.31Å; T59-Q81 VanDerWaalsContact O-CG 3.3Å; T59-Q81 WeakPolarHBondContact O-CG 3.26Å
82	H	95.5	Very high	96.7	Very high	84 Å²	84	47.7 Å²	47.7	39%	0.389	26%	0.257	S	S	.	.			trans	-163.1	150.9	177.6	-165.7	-102.7	0	0	0	111.4	G58 S84 Y85	G58-H82 PolarHBondContact O-N 3.3Å; H82-S84 WeakPolarHBondContact ND1-CB 3.31Å; H82-S84 PolarHBondContact ND1-N 3.33Å; H82-S84 VanDerWaalsContact ND1-N 3.17Å; H82-S84 PolarHBondContact ND1-OG 3.37Å; H82-S84 PolarHBondContact O-N 3.27Å; H82-Y85 HydrophobicContact CB-CD2 3.83Å; H82-Y85 HydrophobicContact CB-CE2 3.73Å; H82-Y85 PolarHBondContact O-N 2.91Å; H82-Y85 VanDerWaalsContact O-N 3.1Å
83	D	94.4	Very high	96.7	Very high	128 Å²	128	42.4 Å²	42.4	68%	0.684	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-63.2	-26	-179.5	-74.9	-21.7	0	0	0	113.4	Y85 K86	D83-Y85 PolarHBondContact O-N 2.9Å; D83-K86 VanDerWaalsContact O-CB 3.27Å; D83-K86 WeakPolarHBondContact O-CB 3.16Å; D83-K86 PolarHBondContact O-N 2.83Å; D83-K86 VanDerWaalsContact O-N 3.1Å
84	S	94.5	Very high	97	Very high	22 Å²	22	40.1 Å²	40.1	15%	0.154	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-64	-17.8	175.8	62.7	0	0	0	0	113.5	H82 K86 E92	H82-S84 WeakPolarHBondContact ND1-CB 3.31Å; H82-S84 PolarHBondContact ND1-N 3.33Å; H82-S84 VanDerWaalsContact ND1-N 3.17Å; H82-S84 PolarHBondContact ND1-OG 3.37Å; H82-S84 PolarHBondContact O-N 3.27Å; S84-K86 PolarHBondContact O-N 2.94Å; S84-E92 WeakPolarHBondContact O-CG 3.39Å
85	Y	96.5	Very high	97	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.016	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-84.9	5.6	176.4	-56.1	-46.5	0	0	0	113.3	A57 A80 H82 D83 G87 A88 E92 L93 L96 S191 T192	A57-Y85 HydrophobicContact CB-CD2 4.44Å; A57-Y85 HydrophobicContact CB-CG 4.47Å; A80-Y85 HydrophobicContact CB-CE2 3.76Å; A80-Y85 WeakPolarHBondContact O-CD2 3.43Å; A80-Y85 WeakPolarHBondContact O-CE2 3.42Å; H82-Y85 HydrophobicContact CB-CD2 3.83Å; H82-Y85 HydrophobicContact CB-CE2 3.73Å; H82-Y85 PolarHBondContact O-N 2.91Å; H82-Y85 VanDerWaalsContact O-N 3.1Å; D83-Y85 PolarHBondContact O-N 2.9Å; Y85-G87 PolarHBondContact O-N 2.82Å; Y85-A88 PolarHBondContact O-N 2.71Å; Y85-E92 HydrophobicContact CD1-CB 4.32Å; Y85-L93 HydrophobicContact CD1-CD2 3.74Å; Y85-L93 HydrophobicContact CE1-CD2 4.24Å; Y85-L93 HydrophobicContact CG-CD2 4.32Å; Y85-L96 HydrophobicContact CE1-CB 4.44Å; Y85-L96 HydrophobicContact CE1-CD2 4.07Å; Y85-L96 HydrophobicContact CE2-CD2 4.31Å; Y85-S191 WeakPolarHBondContact OH-CA 3.4Å; Y85-T192 PolarHBondContact OH-N 2.68Å
86	K	95.9	Very high	97	Very high	108 Å²	108	35.3 Å²	35.3	47%	0.47	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-56.4	127.8	172.2	-170.9	-174.9	-175.6	-162.3	0	110.6	T59 D83 S84 A88 W200	T59-K86 HydrophobicContact CG2-CB 3.88Å; D83-K86 VanDerWaalsContact O-CB 3.27Å; D83-K86 WeakPolarHBondContact O-CB 3.16Å; D83-K86 PolarHBondContact O-N 2.83Å; D83-K86 VanDerWaalsContact O-N 3.1Å; S84-K86 PolarHBondContact O-N 2.94Å; K86-A88 PolarHBondContact O-N 2.79Å; K86-W200 HydrophobicContact CD-CE3 4.12Å; K86-W200 VanDerWaalsContact CE-CZ3 3.45Å; K86-W200 HydrophobicContact CG-CE3 4.24Å
87	G	94.9	Very high	97.1	Very high	35 Å²	35	32.2 Å²	32.2	36%	0.361	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	77.3	2.8	-179.4	0	0	0	0	0	115	Y85 L89	Y85-G87 PolarHBondContact O-N 2.82Å; G87-L89 VanDerWaalsContact C-N 3.29Å; G87-L89 PolarHBondContact O-N 2.89Å
88	A	96.4	Very high	97.1	Very high	36 Å²	36	33.8 Å²	33.8	30%	0.298	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	53.4	41.9	175.4	0	0	0	0	0	113.8	Y85 K86 L93 F116	Y85-A88 PolarHBondContact O-N 2.71Å; K86-A88 PolarHBondContact O-N 2.79Å; A88-L93 HydrophobicContact CB-CD1 4.01Å; A88-F116 HydrophobicContact CB-CD2 4.19Å; A88-F116 HydrophobicContact CB-CE2 3.99Å
89	L	97.9	Very high	97	Very high	29 Å²	29	37.9 Å²	37.9	15%	0.152	21%	0.205	C	C	.	.			trans	-64.7	130.2	-175.4	-59.3	175.5	0	0	0	111.2	G87 E91 E92 L93 S198 W200	G87-L89 VanDerWaalsContact C-N 3.29Å; G87-L89 PolarHBondContact O-N 2.89Å; L89-E91 PolarHBondContact O-N 3.1Å; L89-E92 HydrophobicContact CB-CB 4.46Å; L89-E92 HydrophobicContact CB-CG 4.07Å; L89-E92 PolarHBondContact O-N 3.34Å; L89-L93 PolarHBondContact O-N 2.92Å; L89-S198 WeakPolarHBondContact CD1-O 3.2Å; L89-W200 HydrophobicContact CD2-CB 4.47Å
90	P	98.1	Very high	97	Very high	10 Å²	10	37.1 Å²	37.1	7%	0.065	20%	0.201	C	C	.	.	H	α-helix	trans	-57.6	-32.3	179.4	-25.9	33.3	0	0	0	114.1	E92 T94 N119 L120	P90-E92 PolarHBondContact O-N 3.05Å; P90-T94 WeakPolarHBondContact O-CB 3.33Å; P90-T94 PolarHBondContact O-N 2.9Å; P90-T94 PolarHBondContact O-OG1 3.12Å; P90-N119 WeakPolarHBondContact CG-OD1 3.47Å; P90-L120 HydrophobicContact CB-CD1 4.18Å
91	E	97.4	Very high	97	Very high	41 Å²	41	38 Å²	38	19%	0.192	20%	0.204	C	C	.	.	H	α-helix	trans	-58.7	-35.7	175.9	-71.5	57.5	-139	0	0	112.1	L89 P95 R123 A195 V197 S198	L89-E91 PolarHBondContact O-N 3.1Å; E91-P95 WeakPolarHBondContact O-CD 3.1Å; E91-P95 WeakPolarHBondContact O-CG 3.19Å; E91-R123 IonicContact OE1-CZ 3.23Å; E91-R123 VanDerWaalsContact OE1-CZ 3.25Å; E91-R123 IonicContact OE1-NH1 3.77Å; E91-R123 PolarHBondContact OE1-NH1 3.47Å; E91-R123 IonicContact OE1-NH2 2.87Å; E91-A195 HydrophobicContact CB-CB 4.24Å; E91-V197 HydrophobicContact CB-CG2 4.02Å; E91-V197 HydrophobicContact CG-CG2 3.47Å; E91-V197 VanDerWaalsContact CG-CG2 3.47Å; E91-S198 WeakPolarHBondContact CG-OG 3.34Å
92	E	97.4	Very high	97	Very high	8 Å²	8	39.4 Å²	39.4	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-91.3	-37.1	-177.8	-57.4	-60.2	157.1	0	0	111.7	S84 Y85 L89 P90 P194 A195 G196	S84-E92 WeakPolarHBondContact O-CG 3.39Å; Y85-E92 HydrophobicContact CD1-CB 4.32Å; L89-E92 HydrophobicContact CB-CB 4.46Å; L89-E92 HydrophobicContact CB-CG 4.07Å; L89-E92 PolarHBondContact O-N 3.34Å; P90-E92 PolarHBondContact O-N 3.05Å; E92-P194 WeakPolarHBondContact OE2-CA 3.38Å; E92-A195 VanDerWaalsContact CD-N 3.32Å; E92-A195 WeakPolarHBondContact OE1-CB 3.29Å; E92-A195 PolarHBondContact OE1-N 3.4Å; E92-A195 PolarHBondContact OE2-N 2.91Å; E92-G196 PolarHBondContact OE1-N 3.04Å
93	L	98.1	Very high	97.1	Very high	5 Å²	5	40.6 Å²	40.6	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-78.8	-31.8	-179.1	-68.3	179.5	0	0	0	113.7	A57 Y85 A88 L89 L96 I97 F116 L120	A57-L93 HydrophobicContact CB-CD2 3.49Å; A57-L93 VanDerWaalsContact CB-CD2 3.49Å; Y85-L93 HydrophobicContact CD1-CD2 3.74Å; Y85-L93 HydrophobicContact CE1-CD2 4.24Å; Y85-L93 HydrophobicContact CG-CD2 4.32Å; A88-L93 HydrophobicContact CB-CD1 4.01Å; L89-L93 PolarHBondContact O-N 2.92Å; L93-L96 HydrophobicContact CD2-CD2 4.43Å; L93-L96 WeakPolarHBondContact O-CB 3.41Å; L93-L96 PolarHBondContact O-N 3.1Å; L93-I97 WeakPolarHBondContact O-CG1 3.49Å; L93-I97 PolarHBondContact O-N 3.03Å; L93-F116 HydrophobicContact CD1-CE2 3.65Å; L93-F116 HydrophobicContact CD1-CZ 4.13Å; L93-L120 HydrophobicContact CB-CD1 3.83Å; L93-L120 HydrophobicContact CB-CD2 4.43Å; L93-L120 HydrophobicContact CD1-CD2 4.1Å
94	T	98.4	Very high	97.1	Very high	4 Å²	4	36.9 Å²	36.9	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-49.2	-177.8	-60.3	0	0	0	0	112.1	P90 L96 I97 L98 R123 V124 K127	P90-T94 WeakPolarHBondContact O-CB 3.33Å; P90-T94 PolarHBondContact O-N 2.9Å; P90-T94 PolarHBondContact O-OG1 3.12Å; T94-L96 VanDerWaalsContact C-N 3.3Å; T94-L96 PolarHBondContact O-N 3.41Å; T94-I97 PolarHBondContact O-N 3.14Å; T94-I97 VanDerWaalsContact O-N 3.16Å; T94-L98 HydrophobicContact CG2-CD1 4.03Å; T94-L98 HydrophobicContact CG2-CG 4.28Å; T94-L98 VanDerWaalsContact O-CG 3.31Å; T94-L98 WeakPolarHBondContact O-CG 3.24Å; T94-L98 PolarHBondContact O-N 2.89Å; T94-R123 HydrophobicContact CG2-CG 4.33Å; T94-R123 VanDerWaalsContact OG1-CD 3.27Å; T94-R123 WeakPolarHBondContact OG1-CD 3.39Å; T94-V124 HydrophobicContact CG2-CG2 4.17Å; T94-K127 HydrophobicContact CG2-CB 4.38Å; T94-K127 HydrophobicContact CG2-CG 3.87Å
95	P	97.7	Very high	97.2	Very high	42 Å²	42	41.2 Å²	41.2	27%	0.273	21%	0.214	S	C	.	.	H	α-helix	trans	-55.9	-43.5	176	-25.5	35.5	0	0	0	112.9	E91 I97 L98 E99 T192	E91-P95 WeakPolarHBondContact O-CD 3.1Å; E91-P95 WeakPolarHBondContact O-CG 3.19Å; P95-I97 PolarHBondContact O-N 3.15Å; P95-L98 PolarHBondContact O-N 2.86Å; P95-E99 PolarHBondContact O-N 3.27Å; P95-T192 HydrophobicContact CB-CG2 4.06Å
96	L	98.1	Very high	97.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-56.9	-47.2	175.2	171.1	67.3	0	0	0	112.1	L55 A57 A80 Y85 L93 T94 L98 E99 T100 V189	L55-L96 HydrophobicContact CD1-CD2 4.31Å; L55-L96 HydrophobicContact CD2-CD2 4.18Å; L55-L96 HydrophobicContact CD2-CG 4.34Å; A57-L96 HydrophobicContact CB-CD2 3.54Å; A80-L96 HydrophobicContact CB-CD1 3.74Å; A80-L96 HydrophobicContact CB-CD2 3.45Å; A80-L96 VanDerWaalsContact CB-CD2 3.45Å; A80-L96 HydrophobicContact CB-CG 4.23Å; Y85-L96 HydrophobicContact CE1-CB 4.44Å; Y85-L96 HydrophobicContact CE1-CD2 4.07Å; Y85-L96 HydrophobicContact CE2-CD2 4.31Å; L93-L96 HydrophobicContact CD2-CD2 4.43Å; L93-L96 WeakPolarHBondContact O-CB 3.41Å; L93-L96 PolarHBondContact O-N 3.1Å; T94-L96 VanDerWaalsContact C-N 3.3Å; T94-L96 PolarHBondContact O-N 3.41Å; L96-L98 VanDerWaalsContact C-N 3.31Å; L96-L98 PolarHBondContact O-N 2.87Å; L96-E99 PolarHBondContact O-N 2.81Å; L96-T100 VanDerWaalsContact O-CB 3.29Å; L96-T100 WeakPolarHBondContact O-CB 3.23Å; L96-T100 PolarHBondContact O-N 3.37Å; L96-T100 PolarHBondContact O-OG1 3.41Å; L96-V189 HydrophobicContact CD1-CG2 4.06Å
97	I	98.4	Very high	97.4	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-64.8	-36.9	179.2	-67.5	164.3	0	0	0	111	L24 V26 L55 L93 T94 P95 T100 Q101 I109 L120 V124	L24-I97 HydrophobicContact CD2-CG2 4.42Å; V26-I97 HydrophobicContact CG1-CD1 4.36Å; V26-I97 HydrophobicContact CG2-CD1 3.95Å; V26-I97 HydrophobicContact CG2-CG1 4.43Å; L55-I97 HydrophobicContact CD2-CG1 3.65Å; L93-I97 WeakPolarHBondContact O-CG1 3.49Å; L93-I97 PolarHBondContact O-N 3.03Å; T94-I97 PolarHBondContact O-N 3.14Å; T94-I97 VanDerWaalsContact O-N 3.16Å; P95-I97 PolarHBondContact O-N 3.15Å; I97-T100 PolarHBondContact O-N 3.31Å; I97-Q101 VanDerWaalsContact O-CB 3.3Å; I97-Q101 WeakPolarHBondContact O-CB 3.1Å; I97-Q101 PolarHBondContact O-N 2.98Å; I97-I109 HydrophobicContact CG2-CD1 4.38Å; I97-L120 HydrophobicContact CD1-CD1 4.18Å; I97-L120 HydrophobicContact CD1-CD2 3.84Å; I97-L120 HydrophobicContact CD1-CG 4.2Å; I97-V124 HydrophobicContact CB-CG2 4.37Å; I97-V124 HydrophobicContact CD1-CG2 3.82Å; I97-V124 HydrophobicContact CG2-CG1 3.75Å; I97-V124 HydrophobicContact CG2-CG2 4.2Å
98	L	98.2	Very high	97.6	Very high	33 Å²	33	36.1 Å²	36.1	17%	0.173	19%	0.185	C	C	.	.	H	α-helix	trans	-68.2	-42.4	177.6	-64.9	173.3	0	0	0	112.3	T94 P95 L96 Q101 K102 K127 L128	T94-L98 HydrophobicContact CG2-CD1 4.03Å; T94-L98 HydrophobicContact CG2-CG 4.28Å; T94-L98 VanDerWaalsContact O-CG 3.31Å; T94-L98 WeakPolarHBondContact O-CG 3.24Å; T94-L98 PolarHBondContact O-N 2.89Å; P95-L98 PolarHBondContact O-N 2.86Å; L96-L98 VanDerWaalsContact C-N 3.31Å; L96-L98 PolarHBondContact O-N 2.87Å; L98-Q101 PolarHBondContact O-N 3.19Å; L98-K102 WeakPolarHBondContact O-CG 3.39Å; L98-K102 PolarHBondContact O-N 2.68Å; L98-K127 HydrophobicContact CD1-CB 3.69Å; L98-K127 HydrophobicContact CD1-CG 4.12Å; L98-K127 HydrophobicContact CD2-CB 3.93Å; L98-K127 HydrophobicContact CG-CB 4.37Å; L98-L128 HydrophobicContact CD2-CD2 3.53Å; L98-L128 HydrophobicContact CD2-CG 3.76Å
99	E	97.5	Very high	97.7	Very high	85 Å²	85	34.4 Å²	34.4	40%	0.397	17%	0.171	S	C	.	.	H	α-helix	trans	-65.1	-42.4	174.5	-68.3	-50.5	130.8	0	0	111.3	P95 L96 Q101 K102 Q103 T192	P95-E99 PolarHBondContact O-N 3.27Å; L96-E99 PolarHBondContact O-N 2.81Å; E99-Q101 VanDerWaalsContact C-N 3.29Å; E99-Q101 PolarHBondContact O-N 3.44Å; E99-K102 PolarHBondContact O-N 2.85Å; E99-K102 IonicContact OE1-NZ 2.68Å; E99-K102 PolarHBondContact OE1-NZ 3.43Å; E99-K102 IonicContact OE2-NZ 3.85Å; E99-Q103 PolarHBondContact O-N 2.74Å; E99-T192 HydrophobicContact CB-CG2 4.39Å; E99-T192 HydrophobicContact CG-CG2 3.76Å
100	T	97.8	Very high	97.8	Very high	3 Å²	3	33 Å²	33	2%	0.018	16%	0.163	C	C	.	.	H	α-helix	trans	-57.2	-43.5	172.2	-60.3	0	0	0	0	111	L24 L78 L96 I97 Q103 F104 F106	L24-T100 HydrophobicContact CD1-CG2 4.5Å; L24-T100 HydrophobicContact CD2-CG2 4Å; L78-T100 HydrophobicContact CD1-CG2 3.6Å; L96-T100 VanDerWaalsContact O-CB 3.29Å; L96-T100 WeakPolarHBondContact O-CB 3.23Å; L96-T100 PolarHBondContact O-N 3.37Å; L96-T100 PolarHBondContact O-OG1 3.41Å; I97-T100 PolarHBondContact O-N 3.31Å; T100-Q103 PolarHBondContact O-N 2.96Å; T100-F104 HydrophobicContact CG2-CD2 3.99Å; T100-F104 HydrophobicContact CG2-CE2 4.45Å; T100-F104 VanDerWaalsContact O-CD2 3.31Å; T100-F104 WeakPolarHBondContact O-CD2 3.17Å; T100-F104 PolarHBondContact O-N 3.09Å; T100-F106 HydrophobicContact CG2-CE2 3.89Å
101	Q	97.8	Very high	97.8	Very high	18 Å²	18	32.5 Å²	32.5	8%	0.084	16%	0.16	C	C	.	.	H	α-helix	trans	-64.6	-41.6	176.7	176.6	59.1	16	0	0	112.4	I97 L98 E99 Q103 N105 F106 L128	I97-Q101 VanDerWaalsContact O-CB 3.3Å; I97-Q101 WeakPolarHBondContact O-CB 3.1Å; I97-Q101 PolarHBondContact O-N 2.98Å; L98-Q101 PolarHBondContact O-N 3.19Å; E99-Q101 VanDerWaalsContact C-N 3.29Å; E99-Q101 PolarHBondContact O-N 3.44Å; Q101-Q103 VanDerWaalsContact C-N 3.31Å; Q101-Q103 PolarHBondContact O-N 3.49Å; Q101-N105 VanDerWaalsContact O-CA 3.25Å; Q101-N105 WeakPolarHBondContact O-CA 3.31Å; Q101-N105 PolarHBondContact O-N 3.22Å; Q101-F106 PolarHBondContact NE2-O 3.47Å; Q101-F106 VanDerWaalsContact OE1-CB 3.26Å; Q101-F106 PolarHBondContact OE1-O 3.31Å; Q101-L128 HydrophobicContact CG-CD2 4.12Å
102	K	96.3	Very high	97.8	Very high	132 Å²	132	30.7 Å²	30.7	57%	0.574	15%	0.152	S	C	*	.	H	α-helix	trans	-62.4	-39.7	176.5	-71.2	169.6	-173.2	172.6	0	111.9	L98 E99 N105	L98-K102 WeakPolarHBondContact O-CG 3.39Å; L98-K102 PolarHBondContact O-N 2.68Å; E99-K102 PolarHBondContact O-N 2.85Å; E99-K102 IonicContact OE1-NZ 2.68Å; E99-K102 PolarHBondContact OE1-NZ 3.43Å; E99-K102 IonicContact OE2-NZ 3.85Å; K102-N105 PolarHBondContact O-ND2 3.04Å
103	Q	96.4	Very high	97.9	Very high	108 Å²	108	30.8 Å²	30.8	51%	0.505	15%	0.154	S	C	.	.	H	α-helix	trans	-71.3	-44.8	-178.4	-176	175.8	-7.2	0	0	112.4	E99 T100 Q101	E99-Q103 PolarHBondContact O-N 2.74Å; T100-Q103 PolarHBondContact O-N 2.96Å; Q101-Q103 VanDerWaalsContact C-N 3.31Å; Q101-Q103 PolarHBondContact O-N 3.49Å
104	F	95.9	Very high	97.8	Very high	50 Å²	50	31.5 Å²	31.5	22%	0.219	16%	0.16	C	C	.	.	H	α-helix	trans	-108.7	-12	-169.1	-62.9	-73.4	0	0	0	115	L78 T100 F106 V189	L78-F104 HydrophobicContact CD1-CD2 4.02Å; L78-F104 HydrophobicContact CD1-CE2 3.89Å; L78-F104 HydrophobicContact CD2-CE2 3.93Å; L78-F104 HydrophobicContact CD2-CZ 3.86Å; T100-F104 HydrophobicContact CG2-CD2 3.99Å; T100-F104 HydrophobicContact CG2-CE2 4.45Å; T100-F104 VanDerWaalsContact O-CD2 3.31Å; T100-F104 WeakPolarHBondContact O-CD2 3.17Å; T100-F104 PolarHBondContact O-N 3.09Å; F104-F106 HydrophobicContact CB-CD2 3.99Å; F104-F106 HydrophobicContact CB-CE1 4.37Å; F104-F106 HydrophobicContact CB-CE2 3.38Å; F104-F106 HydrophobicContact CB-CZ 3.6Å; F104-F106 HydrophobicContact CD2-CE2 4.14Å; F104-F106 HydrophobicContact CD2-CZ 4.38Å; F104-F106 HydrophobicContact CG-CE2 4.07Å; F104-F106 HydrophobicContact CG-CZ 4.1Å; F104-V189 HydrophobicContact CE2-CG1 4.08Å
105	N	96.3	Very high	97.7	Very high	113 Å²	113	35.5 Å²	35.5	60%	0.604	19%	0.194	S	C	*	.			trans	52.2	55	176.2	-64.3	-81.5	0	0	0	113.8	Q101 K102	Q101-N105 VanDerWaalsContact O-CA 3.25Å; Q101-N105 WeakPolarHBondContact O-CA 3.31Å; Q101-N105 PolarHBondContact O-N 3.22Å; K102-N105 PolarHBondContact O-ND2 3.04Å
106	F	98.3	Very high	97.7	Very high	5 Å²	5	35 Å²	35	2%	0.022	19%	0.187	C	C	.	.			trans	-65.2	141.8	178.2	-60.6	-81.8	0	0	0	111.7	S22 L24 L78 T100 Q101 F104 I109	S22-F106 WeakPolarHBondContact OG-CD1 3.34Å; S22-F106 WeakPolarHBondContact OG-CE1 3.44Å; L24-F106 HydrophobicContact CB-CB 4.27Å; L24-F106 HydrophobicContact CB-CD1 3.9Å; L24-F106 HydrophobicContact CB-CD2 3.75Å; L24-F106 HydrophobicContact CB-CE1 4.15Å; L24-F106 HydrophobicContact CB-CE2 3.99Å; L24-F106 HydrophobicContact CB-CG 3.7Å; L24-F106 HydrophobicContact CB-CZ 4.2Å; L24-F106 HydrophobicContact CD1-CD2 4.49Å; L24-F106 HydrophobicContact CD1-CE1 4.42Å; L24-F106 HydrophobicContact CD1-CE2 3.9Å; L24-F106 HydrophobicContact CD1-CZ 3.87Å; L24-F106 HydrophobicContact CD2-CD2 4.01Å; L24-F106 HydrophobicContact CD2-CE2 4.01Å; L24-F106 HydrophobicContact CG-CD2 4.31Å; L24-F106 HydrophobicContact CG-CE2 4.19Å; L78-F106 HydrophobicContact CD1-CE2 4.42Å; L78-F106 HydrophobicContact CD1-CZ 4.13Å; T100-F106 HydrophobicContact CG2-CE2 3.89Å; Q101-F106 PolarHBondContact NE2-O 3.47Å; Q101-F106 VanDerWaalsContact OE1-CB 3.26Å; Q101-F106 PolarHBondContact OE1-O 3.31Å; F104-F106 HydrophobicContact CB-CD2 3.99Å; F104-F106 HydrophobicContact CB-CE1 4.37Å; F104-F106 HydrophobicContact CB-CE2 3.38Å; F104-F106 HydrophobicContact CB-CZ 3.6Å; F104-F106 HydrophobicContact CD2-CE2 4.14Å; F104-F106 HydrophobicContact CD2-CZ 4.38Å; F104-F106 HydrophobicContact CG-CE2 4.07Å; F104-F106 HydrophobicContact CG-CZ 4.1Å; F106-I109 HydrophobicContact CB-CG1 4.45Å
107	T	98.3	Very high	97.7	Very high	33 Å²	33	35 Å²	35	20%	0.202	19%	0.187	C	C	.	.	S	Bend	trans	-80.8	-25.5	173.2	54.2	0	0	0	0	112.6	F20 Q21 S22 K165	F20-T107 WeakPolarHBondContact O-CG2 3.36Å; Q21-T107 PolarHBondContact OE1-OG1 3.46Å; S22-T107 PolarHBondContact N-OG1 2.9Å; S22-T107 PolarHBondContact O-N 3.41Å; S22-T107 PolarHBondContact O-OG1 3.45Å; T107-K165 PolarHBondContact O-N 3.23Å
108	H	98.8	Very high	97.7	Very high	2 Å²	2	40 Å²	40	1%	0.009	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	136.8	-173.9	-67.2	84	0	0	0	109.7	Q21 S22 T23 L24 L48 P142 K165 F167	Q21-H108 PolarHBondContact OE1-CE1 2.93Å; Q21-H108 PolarHBondContact OE1-ND1 2.78Å; S22-H108 PolarHBondContact O-N 2.91Å; T23-H108 WeakPolarHBondContact CA-O 3.3Å; T23-H108 HydrophobicContact CG2-CB 3.82Å; L24-H108 PolarHBondContact N-O 2.86Å; L48-H108 HydrophobicContact CD1-CB 3.91Å; H108-P142 PolarHBondContact NE2-O 3.05Å; H108-K165 CarbonylContact C-O 3.07Å; H108-K165 WeakPolarHBondContact CA-O 3.3Å; H108-K165 WeakPolarHBondContact CD2-CB 3.31Å; H108-F167 HydrophobicContact CB-CE1 4.16Å; H108-F167 AromaticContact CD2-CE1 3.88Å
109	I	98.9	Very high	97.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.5	173.4	-56.3	176.8	0	0	0	107.9	L24 V26 I97 F106 L121 L128 V164 K165 V166 F167	L24-I109 HydrophobicContact CB-CG1 4.29Å; L24-I109 HydrophobicContact CD2-CG2 4.48Å; L24-I109 CarbonylContact O-C 3.56Å; L24-I109 WeakPolarHBondContact O-CA 3.34Å; V26-I109 HydrophobicContact CG2-CG2 4.36Å; I97-I109 HydrophobicContact CG2-CD1 4.38Å; F106-I109 HydrophobicContact CB-CG1 4.45Å; I109-L121 HydrophobicContact CG2-CD2 4.26Å; I109-L128 HydrophobicContact CD1-CD1 3.87Å; I109-V164 HydrophobicContact CD1-CG1 3.97Å; I109-V164 HydrophobicContact CG1-CG1 3.98Å; I109-K165 PolarHBondContact N-O 3Å; I109-V166 HydrophobicContact CB-CG2 4.38Å; I109-V166 VanDerWaalsContact O-CA 3.31Å; I109-V166 WeakPolarHBondContact O-CA 3.42Å; I109-F167 PolarHBondContact O-N 3.24Å
110	C	98.9	Very high	97.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	164.4	-177.8	64.6	0	0	0	0	114.6	L24 V25 V26 F167 V169	L24-C110 PolarHBondContact O-N 2.84Å; V25-C110 CarbonylContact C-O 3.53Å; V25-C110 WeakPolarHBondContact CA-O 3.36Å; V26-C110 PolarHBondContact N-O 3.22Å; C110-F167 WeakPolarHBondContact CA-O 3.26Å; C110-F167 HydrophobicContact CB-CD1 4.18Å; C110-F167 HydrophobicContact CB-CD2 3.76Å; C110-F167 HydrophobicContact CB-CE1 3.82Å; C110-F167 HydrophobicContact CB-CE2 3.39Å; C110-F167 HydrophobicContact CB-CG 4.14Å; C110-F167 HydrophobicContact CB-CZ 3.41Å; C110-F167 VanDerWaalsContact CB-CZ 3.41Å; C110-F167 VanDerWaalsContact CB-O 3.23Å; C110-F167 WeakPolarHBondContact CB-O 3.31Å; C110-V169 HydrophobicContact CB-CG2 4.47Å
111	A	98.9	Very high	97.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	167.1	175.3	0	0	0	0	0	108.9	V26 L121 T168 V169	V26-A111 HydrophobicContact CB-CB 4.39Å; A111-L121 HydrophobicContact CB-CD1 3.88Å; A111-L121 HydrophobicContact CB-CG 4.15Å; A111-T168 CarbonylContact O-C 3.51Å; A111-T168 WeakPolarHBondContact O-CA 3.43Å; A111-V169 PolarHBondContact O-N 3.16Å
112	G	98.6	Very high	97.9	Very high	2 Å²	2	40.9 Å²	40.9	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	146	169.3	0	0	0	0	0	112.1	S114 G117	G112-S114 PolarHBondContact O-N 2.91Å; G112-G117 WeakPolarHBondContact O-CA 3.49Å
113	A	98.1	Very high	98	Very high	10 Å²	10	38.8 Å²	38.8	8%	0.083	21%	0.208	C	C	.	.	S	Bend	trans	-76.6	41.5	175.6	0	0	0	0	0	113.1	K118 D135 V169	A113-K118 WeakPolarHBondContact O-CE 3.47Å; A113-K118 PolarHBondContact O-NZ 3.04Å; A113-D135 HydrophobicContact CB-CB 4.21Å; A113-D135 WeakPolarHBondContact CB-OD1 3.5Å; A113-V169 VanDerWaalsContact CB-O 3.29Å; A113-V169 WeakPolarHBondContact CB-O 3.29Å; A113-V169 PolarHBondContact N-O 3.29Å
114	S	96.7	Very high	98.1	Very high	21 Å²	21	33.6 Å²	33.6	15%	0.147	18%	0.184	C	C	.	.	S	Bend	trans	-80.3	-179.1	173.1	64.3	0	0	0	0	111.5	E28 G112 F116 G117 K118	E28-S114 WeakPolarHBondContact OE2-CB 3.29Å; E28-S114 PolarHBondContact OE2-OG 3.44Å; G112-S114 PolarHBondContact O-N 2.91Å; S114-F116 VanDerWaalsContact C-N 3.27Å; S114-F116 PolarHBondContact O-N 2.85Å; S114-F116 PolarHBondContact OG-N 3.43Å; S114-G117 PolarHBondContact OG-N 2.94Å; S114-K118 VanDerWaalsContact O-CB 3.22Å; S114-K118 WeakPolarHBondContact O-CB 3.37Å; S114-K118 WeakPolarHBondContact O-CD 3.46Å; S114-K118 VanDerWaalsContact O-CG 3.26Å; S114-K118 WeakPolarHBondContact O-CG 3.34Å; S114-K118 PolarHBondContact O-N 2.95Å
115	A	95.8	Very high	98.3	Very high	88 Å²	88	31.2 Å²	31.2	73%	0.727	17%	0.174	S	C	*	.	H	α-helix	trans	-57.3	-43	171.1	0	0	0	0	0	111.4	N119	A115-N119 WeakPolarHBondContact O-CB 3.32Å; A115-N119 PolarHBondContact O-N 3.4Å; A115-N119 VanDerWaalsContact O-N 3.07Å
116	F	98.3	Very high	98.4	Very high	32 Å²	32	29.4 Å²	29.4	14%	0.14	17%	0.174	C	C	.	.	H	α-helix	trans	-58.9	-57.6	176.1	168.5	-103.2	0	0	0	112.1	V26 E28 A88 L93 S114 K118 N119 L120	V26-F116 HydrophobicContact CG1-CE1 4.02Å; V26-F116 HydrophobicContact CG1-CZ 3.85Å; E28-F116 HydrophobicContact CB-CD1 3.69Å; E28-F116 HydrophobicContact CB-CE1 4.07Å; E28-F116 HydrophobicContact CB-CG 4.38Å; E28-F116 HydrophobicContact CG-CB 3.95Å; E28-F116 HydrophobicContact CG-CD1 3.75Å; E28-F116 HydrophobicContact CG-CE1 4.48Å; E28-F116 HydrophobicContact CG-CG 3.93Å; A88-F116 HydrophobicContact CB-CD2 4.19Å; A88-F116 HydrophobicContact CB-CE2 3.99Å; L93-F116 HydrophobicContact CD1-CE2 3.65Å; L93-F116 HydrophobicContact CD1-CZ 4.13Å; S114-F116 VanDerWaalsContact C-N 3.27Å; S114-F116 PolarHBondContact O-N 2.85Å; S114-F116 PolarHBondContact OG-N 3.43Å; F116-K118 PolarHBondContact O-N 3.22Å; F116-N119 PolarHBondContact O-N 3.46Å; F116-L120 HydrophobicContact CE1-CD2 4.14Å; F116-L120 HydrophobicContact CE2-CD2 3.89Å; F116-L120 HydrophobicContact CZ-CD2 3.52Å; F116-L120 WeakPolarHBondContact O-CB 3.27Å; F116-L120 PolarHBondContact O-N 3.05Å
117	G	98.6	Very high	98.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.5	-36.2	-175.3	0	0	0	0	0	113.4	G112 S114 N119 L120 L121	G112-G117 WeakPolarHBondContact O-CA 3.49Å; S114-G117 PolarHBondContact OG-N 2.94Å; G117-N119 VanDerWaalsContact C-N 3.29Å; G117-N119 PolarHBondContact O-N 3.32Å; G117-L120 PolarHBondContact O-N 3.25Å; G117-L121 WeakPolarHBondContact O-CB 3.36Å; G117-L121 PolarHBondContact O-N 2.72Å
118	K	98.4	Very high	98.4	Very high	104 Å²	104	36.2 Å²	36.2	45%	0.452	20%	0.203	S	C	.	.	H	α-helix	trans	-67.5	-28.7	175.4	-74	169.8	171.1	151.2	0	112.6	A113 S114 F116 P122	A113-K118 WeakPolarHBondContact O-CE 3.47Å; A113-K118 PolarHBondContact O-NZ 3.04Å; S114-K118 VanDerWaalsContact O-CB 3.22Å; S114-K118 WeakPolarHBondContact O-CB 3.37Å; S114-K118 WeakPolarHBondContact O-CD 3.46Å; S114-K118 VanDerWaalsContact O-CG 3.26Å; S114-K118 WeakPolarHBondContact O-CG 3.34Å; S114-K118 PolarHBondContact O-N 2.95Å; F116-K118 PolarHBondContact O-N 3.22Å; K118-P122 VanDerWaalsContact O-CD 3.3Å; K118-P122 WeakPolarHBondContact O-CD 3.4Å; K118-P122 WeakPolarHBondContact O-CG 3.49Å
119	N	98.5	Very high	98.4	Very high	100 Å²	100	43.1 Å²	43.1	54%	0.535	24%	0.24	S	C	.	.	H	α-helix	trans	-81.5	-39	176.8	-178.6	-129	0	0	0	112.1	P90 A115 F116 G117	P90-N119 WeakPolarHBondContact CG-OD1 3.47Å; A115-N119 WeakPolarHBondContact O-CB 3.32Å; A115-N119 PolarHBondContact O-N 3.4Å; A115-N119 VanDerWaalsContact O-N 3.07Å; F116-N119 PolarHBondContact O-N 3.46Å; G117-N119 VanDerWaalsContact C-N 3.29Å; G117-N119 PolarHBondContact O-N 3.32Å
120	L	98.8	Very high	98.4	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-82.4	-52.9	-174.7	179.9	60.6	0	0	0	114.2	V26 P90 L93 I97 F116 G117 R123 V124	V26-L120 HydrophobicContact CG1-CD2 3.93Å; P90-L120 HydrophobicContact CB-CD1 4.18Å; L93-L120 HydrophobicContact CB-CD1 3.83Å; L93-L120 HydrophobicContact CB-CD2 4.43Å; L93-L120 HydrophobicContact CD1-CD2 4.1Å; I97-L120 HydrophobicContact CD1-CD1 4.18Å; I97-L120 HydrophobicContact CD1-CD2 3.84Å; I97-L120 HydrophobicContact CD1-CG 4.2Å; F116-L120 HydrophobicContact CE1-CD2 4.14Å; F116-L120 HydrophobicContact CE2-CD2 3.89Å; F116-L120 HydrophobicContact CZ-CD2 3.52Å; F116-L120 WeakPolarHBondContact O-CB 3.27Å; F116-L120 PolarHBondContact O-N 3.05Å; G117-L120 PolarHBondContact O-N 3.25Å; L120-R123 WeakPolarHBondContact O-CB 3.45Å; L120-R123 PolarHBondContact O-N 2.94Å; L120-R123 VanDerWaalsContact O-N 3.1Å; L120-V124 HydrophobicContact CD1-CG2 4.17Å; L120-V124 HydrophobicContact CG-CG2 4.31Å; L120-V124 PolarHBondContact O-N 3.03Å
121	L	98.8	Very high	98.3	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-36	-165.9	-70.3	-163.2	0	0	0	115.5	I109 A111 G117 R123 V124 A125 V166 F167 T168	I109-L121 HydrophobicContact CG2-CD2 4.26Å; A111-L121 HydrophobicContact CB-CD1 3.88Å; A111-L121 HydrophobicContact CB-CG 4.15Å; G117-L121 WeakPolarHBondContact O-CB 3.36Å; G117-L121 PolarHBondContact O-N 2.72Å; L121-R123 PolarHBondContact O-N 2.94Å; L121-V124 PolarHBondContact O-N 3.14Å; L121-A125 WeakPolarHBondContact O-CB 3.46Å; L121-A125 PolarHBondContact O-N 3.42Å; L121-V166 HydrophobicContact CB-CG1 4Å; L121-V166 HydrophobicContact CD1-CG1 4.23Å; L121-V166 HydrophobicContact CD2-CG1 4.41Å; L121-V166 HydrophobicContact CG-CG1 4.46Å; L121-F167 WeakPolarHBondContact CD1-O 3.48Å; L121-T168 HydrophobicContact CB-CG2 4.19Å; L121-T168 HydrophobicContact CD1-CG2 3.74Å; L121-T168 HydrophobicContact CG-CG2 4.23Å
122	P	98.8	Very high	98.3	Very high	56 Å²	56	49 Å²	49	36%	0.364	28%	0.282	S	S	.	.	H	α-helix	trans	-59.8	-33.6	173.4	-26	36.5	0	0	0	112.8	K118 A126	K118-P122 VanDerWaalsContact O-CD 3.3Å; K118-P122 WeakPolarHBondContact O-CD 3.4Å; K118-P122 WeakPolarHBondContact O-CG 3.49Å; P122-A126 WeakPolarHBondContact O-CB 3.43Å; P122-A126 PolarHBondContact O-N 2.73Å
123	R	98.8	Very high	98.3	Very high	87 Å²	87	49.4 Å²	49.4	33%	0.328	28%	0.284	S	S	.	.	H	α-helix	trans	-68.5	-43.7	176	-173.1	-177	177	101.7	-4.2	111.5	E91 T94 L120 L121 A126 K127	E91-R123 IonicContact OE1-CZ 3.23Å; E91-R123 VanDerWaalsContact OE1-CZ 3.25Å; E91-R123 IonicContact OE1-NH1 3.77Å; E91-R123 PolarHBondContact OE1-NH1 3.47Å; E91-R123 IonicContact OE1-NH2 2.87Å; T94-R123 HydrophobicContact CG2-CG 4.33Å; T94-R123 VanDerWaalsContact OG1-CD 3.27Å; T94-R123 WeakPolarHBondContact OG1-CD 3.39Å; L120-R123 WeakPolarHBondContact O-CB 3.45Å; L120-R123 PolarHBondContact O-N 2.94Å; L120-R123 VanDerWaalsContact O-N 3.1Å; L121-R123 PolarHBondContact O-N 2.94Å; R123-A126 PolarHBondContact O-N 3.32Å; R123-K127 WeakPolarHBondContact O-CG 3.34Å; R123-K127 PolarHBondContact O-N 2.93Å
124	V	98.8	Very high	98.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.4	-47.9	174.7	175.3	0	0	0	0	110.6	T94 I97 L120 L121 A126 K127 L128	T94-V124 HydrophobicContact CG2-CG2 4.17Å; I97-V124 HydrophobicContact CB-CG2 4.37Å; I97-V124 HydrophobicContact CD1-CG2 3.82Å; I97-V124 HydrophobicContact CG2-CG1 3.75Å; I97-V124 HydrophobicContact CG2-CG2 4.2Å; L120-V124 HydrophobicContact CD1-CG2 4.17Å; L120-V124 HydrophobicContact CG-CG2 4.31Å; L120-V124 PolarHBondContact O-N 3.03Å; L121-V124 PolarHBondContact O-N 3.14Å; V124-A126 VanDerWaalsContact C-N 3.35Å; V124-A126 PolarHBondContact O-N 3.49Å; V124-K127 PolarHBondContact O-N 3.41Å; V124-K127 VanDerWaalsContact O-N 3.1Å; V124-L128 HydrophobicContact CG1-CD1 4.01Å; V124-L128 PolarHBondContact O-N 3.45Å
125	A	98.8	Very high	98.4	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.6	-43.8	179.7	0	0	0	0	0	112.2	L121 K127 L128 D129 V130 P132 V166	L121-A125 WeakPolarHBondContact O-CB 3.46Å; L121-A125 PolarHBondContact O-N 3.42Å; A125-K127 VanDerWaalsContact C-N 3.28Å; A125-K127 PolarHBondContact O-N 3.13Å; A125-L128 CarbonylContact O-C 3.5Å; A125-L128 PolarHBondContact O-N 3.34Å; A125-L128 VanDerWaalsContact O-N 3.13Å; A125-D129 PolarHBondContact O-N 3.1Å; A125-V130 CarbonylContact C-O 3.43Å; A125-V130 HydrophobicContact CB-CG2 4.05Å; A125-V130 PolarHBondContact O-N 2.7Å; A125-V130 VanDerWaalsContact O-N 3.1Å; A125-P132 HydrophobicContact CB-CB 3.72Å; A125-P132 HydrophobicContact CB-CG 3.8Å; A125-V166 HydrophobicContact CB-CB 3.98Å; A125-V166 HydrophobicContact CB-CG1 3.99Å; A125-V166 HydrophobicContact CB-CG2 4.18Å
126	A	98.7	Very high	98.6	Very high	74 Å²	74	47.3 Å²	47.3	61%	0.612	26%	0.262	S	S	*	.	H	α-helix	trans	-61.1	-35.2	175.8	0	0	0	0	0	112.9	P122 R123 V124 D129	P122-A126 WeakPolarHBondContact O-CB 3.43Å; P122-A126 PolarHBondContact O-N 2.73Å; R123-A126 PolarHBondContact O-N 3.32Å; V124-A126 VanDerWaalsContact C-N 3.35Å; V124-A126 PolarHBondContact O-N 3.49Å; A126-D129 PolarHBondContact O-N 3.18Å
127	K	98.5	Very high	98.6	Very high	136 Å²	136	47.8 Å²	47.8	59%	0.591	27%	0.266	S	S	*	.	H	α-helix	trans	-76.2	-23.2	176.4	-67.4	-62.3	-175.1	-178.8	0	113.8	T94 L98 R123 V124 A125 D129	T94-K127 HydrophobicContact CG2-CB 4.38Å; T94-K127 HydrophobicContact CG2-CG 3.87Å; L98-K127 HydrophobicContact CD1-CB 3.69Å; L98-K127 HydrophobicContact CD1-CG 4.12Å; L98-K127 HydrophobicContact CD2-CB 3.93Å; L98-K127 HydrophobicContact CG-CB 4.37Å; R123-K127 WeakPolarHBondContact O-CG 3.34Å; R123-K127 PolarHBondContact O-N 2.93Å; V124-K127 PolarHBondContact O-N 3.41Å; V124-K127 VanDerWaalsContact O-N 3.1Å; A125-K127 VanDerWaalsContact C-N 3.28Å; A125-K127 PolarHBondContact O-N 3.13Å; K127-D129 VanDerWaalsContact C-N 3.34Å
128	L	98.4	Very high	98.6	Very high	45 Å²	45	51.8 Å²	51.8	24%	0.236	28%	0.284	C	S	.	.	H	α-helix	trans	-88.3	-3.1	172.7	-68.1	176	0	0	0	113	L98 Q101 I109 V124 A125 V130 V164 V166	L98-L128 HydrophobicContact CD2-CD2 3.53Å; L98-L128 HydrophobicContact CD2-CG 3.76Å; Q101-L128 HydrophobicContact CG-CD2 4.12Å; I109-L128 HydrophobicContact CD1-CD1 3.87Å; V124-L128 HydrophobicContact CG1-CD1 4.01Å; V124-L128 PolarHBondContact O-N 3.45Å; A125-L128 CarbonylContact O-C 3.5Å; A125-L128 PolarHBondContact O-N 3.34Å; A125-L128 VanDerWaalsContact O-N 3.13Å; L128-V130 HydrophobicContact CB-CG2 4.02Å; L128-V164 HydrophobicContact CD1-CG1 4.29Å; L128-V166 HydrophobicContact CD1-CG2 4.19Å
129	D	98.3	Very high	98.6	Very high	148 Å²	148	47.9 Å²	47.9	79%	0.791	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	47	-175.3	-161.4	34.7	0	0	0	113.1	A125 A126 K127	A125-D129 PolarHBondContact O-N 3.1Å; A126-D129 PolarHBondContact O-N 3.18Å; K127-D129 VanDerWaalsContact C-N 3.34Å
130	V	98.6	Very high	98.5	Very high	16 Å²	16	48.6 Å²	48.6	10%	0.097	27%	0.267	C	S	.	.			trans	-131.7	149.6	178.4	-61.2	0	0	0	0	111.6	A125 L128 P132 E162 V166	A125-V130 CarbonylContact C-O 3.43Å; A125-V130 HydrophobicContact CB-CG2 4.05Å; A125-V130 PolarHBondContact O-N 2.7Å; A125-V130 VanDerWaalsContact O-N 3.1Å; L128-V130 HydrophobicContact CB-CG2 4.02Å; V130-P132 WeakPolarHBondContact O-CD 3.29Å; V130-E162 HydrophobicContact CB-CB 3.93Å; V130-E162 HydrophobicContact CB-CG 3.89Å; V130-E162 HydrophobicContact CG1-CB 3.91Å; V130-E162 HydrophobicContact CG1-CG 4.34Å; V130-V166 HydrophobicContact CG2-CB 4.5Å; V130-V166 HydrophobicContact CG2-CG2 3.82Å
131	A	98.6	Very high	98.5	Very high	55 Å²	55	50.2 Å²	50.2	46%	0.455	28%	0.278	S	S	.	.			trans	-79.8	119.9	173.1	0	0	0	0	0	111.8	E162	A131-E162 VanDerWaalsContact CB-OE1 3.29Å; A131-E162 WeakPolarHBondContact CB-OE1 3.2Å; A131-E162 PolarHBondContact N-OE1 3.44Å
132	P	98.5	Very high	98.4	Very high	52 Å²	52	52 Å²	52	34%	0.338	29%	0.29	S	S	.	.			trans	-77.6	153.8	177.4	31.4	-33.7	0	0	0	112.6	A125 V130 V166	A125-P132 HydrophobicContact CB-CB 3.72Å; A125-P132 HydrophobicContact CB-CG 3.8Å; V130-P132 WeakPolarHBondContact O-CD 3.29Å; P132-V166 CarbonylContact C-O 3.57Å; P132-V166 WeakPolarHBondContact CA-O 3.43Å; P132-V166 HydrophobicContact CB-CB 4.36Å; P132-V166 HydrophobicContact CB-CG1 4.37Å
133	V	98.6	Very high	98.3	Very high	10 Å²	10	51.5 Å²	51.5	6%	0.061	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	116.1	171.9	-170.7	0	0	0	0	110.3	I136 F145 V158 C160 V166 F167 T168	V133-I136 HydrophobicContact CB-CG2 4.28Å; V133-I136 HydrophobicContact CG1-CG2 3.6Å; V133-F145 HydrophobicContact CB-CD2 4.46Å; V133-F145 HydrophobicContact CG1-CB 4.22Å; V133-F145 HydrophobicContact CG1-CD2 4.47Å; V133-F145 HydrophobicContact CG2-CD2 4.09Å; V133-V158 HydrophobicContact CG2-CG1 4.46Å; V133-C160 HydrophobicContact CG2-CB 4.29Å; V133-V166 PolarHBondContact N-O 3.3Å; V133-F167 HydrophobicContact CB-CB 4.06Å; V133-F167 CarbonylContact O-C 3.6Å; V133-F167 WeakPolarHBondContact O-CA 3.48Å; V133-F167 WeakPolarHBondContact O-CB 3.22Å; V133-T168 PolarHBondContact O-N 3.15Å
134	S	98.5	Very high	98.3	Very high	53 Å²	53	48.2 Å²	48.2	37%	0.371	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	138.5	-175.1	-49.3	0	0	0	0	113.8	I136 R147 T168	S134-I136 PolarHBondContact O-N 2.88Å; S134-R147 WeakPolarHBondContact O-CD 3.48Å; S134-R147 PolarHBondContact O-NE 2.9Å; S134-T168 WeakPolarHBondContact CA-OG1 3.34Å
135	D	97.9	Very high	98.3	Very high	22 Å²	22	48.3 Å²	48.3	12%	0.118	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	55.7	53	162.8	-162.4	24.9	0	0	0	112.6	A113 T168 R170	A113-D135 HydrophobicContact CB-CB 4.21Å; A113-D135 WeakPolarHBondContact CB-OD1 3.5Å; D135-T168 WeakPolarHBondContact CA-O 3.29Å; D135-T168 PolarHBondContact N-O 3.27Å; D135-T168 VanDerWaalsContact N-O 3.1Å; D135-T168 PolarHBondContact N-OG1 3.3Å; D135-R170 WeakPolarHBondContact OD1-CA 3.29Å; D135-R170 VanDerWaalsContact OD1-CB 3.22Å; D135-R170 WeakPolarHBondContact OD1-CB 3.35Å; D135-R170 IonicContact OD1-NE 3.15Å; D135-R170 PolarHBondContact OD1-NE 3.22Å; D135-R170 VanDerWaalsContact OD1-NE 3.15Å; D135-R170 IonicContact OD1-NH2 3.97Å; D135-R170 IonicContact OD2-CZ 3.42Å; D135-R170 IonicContact OD2-NE 3.3Å; D135-R170 PolarHBondContact OD2-NE 2.89Å; D135-R170 IonicContact OD2-NH2 2.7Å; D135-R170 PolarHBondContact OD2-NH2 3.03Å
136	I	98.7	Very high	98.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	143.5	-179.3	70.3	164.6	0	0	0	110.6	V133 S134 I139 F145 V146 F167 T168 V169 R170	V133-I136 HydrophobicContact CB-CG2 4.28Å; V133-I136 HydrophobicContact CG1-CG2 3.6Å; S134-I136 PolarHBondContact O-N 2.88Å; I136-I139 HydrophobicContact CD1-CD1 4.07Å; I136-I139 HydrophobicContact CD1-CG1 3.7Å; I136-F145 HydrophobicContact CB-CB 4.37Å; I136-F145 HydrophobicContact CD1-CD1 3.67Å; I136-F145 HydrophobicContact CD1-CE1 4.24Å; I136-F145 HydrophobicContact CG2-CB 3.78Å; I136-F145 HydrophobicContact CG2-CD1 4.39Å; I136-F145 HydrophobicContact CG2-CG 4.2Å; I136-V146 CarbonylContact C-O 3.54Å; I136-V146 WeakPolarHBondContact CA-O 3.44Å; I136-F167 HydrophobicContact CD1-CD2 3.46Å; I136-F167 VanDerWaalsContact CD1-CD2 3.46Å; I136-F167 HydrophobicContact CD1-CE2 3.67Å; I136-F167 HydrophobicContact CD1-CG 4.39Å; I136-F167 HydrophobicContact CG1-CD2 4.04Å; I136-F167 HydrophobicContact CG2-CB 4.5Å; I136-T168 WeakPolarHBondContact CG1-O 3.39Å; I136-T168 PolarHBondContact N-O 3.2Å; I136-V169 HydrophobicContact CD1-CG2 4.35Å; I136-V169 HydrophobicContact CG1-CG2 4.25Å; I136-R170 VanDerWaalsContact O-CB 3.24Å; I136-R170 WeakPolarHBondContact O-CB 3.33Å; I136-R170 PolarHBondContact O-N 3.05Å
137	I	98.4	Very high	98.3	Very high	42 Å²	42	48.6 Å²	48.6	22%	0.215	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	-13.3	177.8	64.1	160.8	0	0	0	112.7	V146 T148 L155 R170 A173	I137-V146 HydrophobicContact CD1-CG1 4.38Å; I137-V146 HydrophobicContact CG1-CB 4.33Å; I137-V146 HydrophobicContact CG1-CG1 4.26Å; I137-V146 WeakPolarHBondContact CG1-O 3.44Å; I137-V146 PolarHBondContact N-O 3.25Å; I137-T148 HydrophobicContact CD1-CG2 4Å; I137-T148 HydrophobicContact CG2-CG2 4.48Å; I137-L155 HydrophobicContact CD1-CD2 3.76Å; I137-R170 HydrophobicContact CG2-CB 4.03Å; I137-R170 HydrophobicContact CG2-CG 4.45Å; I137-A173 HydrophobicContact CB-CB 3.87Å; I137-A173 HydrophobicContact CG2-CB 4.18Å; I137-A173 WeakPolarHBondContact O-CB 3.5Å
138	E	98.6	Very high	98.2	Very high	84 Å²	84	43 Å²	43	39%	0.393	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	147.6	-179.7	-158.7	-167.1	143.1	0	0	109.9	K140 F145 V146	E138-K140 WeakPolarHBondContact OE1-CE 3.41Å; E138-K140 WeakPolarHBondContact OE1-CG 3.39Å; E138-F145 WeakPolarHBondContact O-CA 3.24Å; E138-V146 HydrophobicContact CB-CB 3.71Å; E138-V146 HydrophobicContact CB-CG2 3.86Å; E138-V146 HydrophobicContact CG-CG2 4.46Å; E138-V146 PolarHBondContact N-O 2.79Å; E138-V146 PolarHBondContact O-N 2.93Å; E138-V146 WeakPolarHBondContact OE2-CG2 3.34Å
139	I	98.5	Very high	98.1	Very high	23 Å²	23	43.4 Å²	43.4	12%	0.118	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	113.8	170.9	-63.2	169.1	0	0	0	106.6	A44 K47 L48 I136 S141 F145 F174	A44-I139 HydrophobicContact CB-CD1 4.04Å; A44-I139 WeakPolarHBondContact O-CD1 3.46Å; K47-I139 HydrophobicContact CB-CD1 4.31Å; L48-I139 HydrophobicContact CD2-CD1 4.17Å; L48-I139 HydrophobicContact CD2-CG2 3.76Å; L48-I139 HydrophobicContact CG-CD1 4.36Å; I136-I139 HydrophobicContact CD1-CD1 4.07Å; I136-I139 HydrophobicContact CD1-CG1 3.7Å; I139-S141 WeakPolarHBondContact CG2-O 3.31Å; I139-F145 HydrophobicContact CG1-CD1 4.01Å; I139-F145 HydrophobicContact CG1-CE1 4.25Å; I139-F174 HydrophobicContact CD1-CE1 4.16Å; I139-F174 HydrophobicContact CD1-CZ 4.28Å; I139-F174 HydrophobicContact CG1-CE1 4.33Å; I139-F174 HydrophobicContact CG1-CZ 4.16Å
140	K	97.9	Very high	97.9	Very high	114 Å²	114	45.1 Å²	45.1	50%	0.496	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-35	178	-74.1	-177.4	171.5	171.3	0	112.2	E138 T144 V146 T157	E138-K140 WeakPolarHBondContact OE1-CE 3.41Å; E138-K140 WeakPolarHBondContact OE1-CG 3.39Å; K140-T144 HydrophobicContact CB-CG2 4.17Å; K140-T144 HydrophobicContact CD-CG2 4.5Å; K140-T144 PolarHBondContact N-O 2.9Å; K140-V146 HydrophobicContact CD-CG2 3.89Å; K140-V146 HydrophobicContact CG-CG2 4.16Å; K140-T157 HydrophobicContact CD-CG2 4.1Å; K140-T157 PolarHBondContact NZ-OG1 3.26Å
141	S	97.2	Very high	97.4	Very high	37 Å²	37	45.3 Å²	45.3	26%	0.259	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	169.7	172.9	63.8	0	0	0	0	108.4	I139 D143 T144	I139-S141 WeakPolarHBondContact CG2-O 3.31Å; S141-D143 PolarHBondContact O-N 3.1Å; S141-D143 PolarHBondContact OG-OD1 3.2Å; S141-T144 PolarHBondContact N-O 3.22Å; S141-T144 PolarHBondContact O-N 3.19Å; S141-T144 WeakPolarHBondContact OG-CB 3.48Å; S141-T144 PolarHBondContact OG-N 2.83Å; S141-T144 PolarHBondContact OG-OG1 3.1Å
142	P	97.3	Very high	96.9	Very high	39 Å²	39	43.3 Å²	43.3	25%	0.253	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-26.7	179.7	-29.3	37.1	0	0	0	114.4	L48 H108 F145	L48-P142 HydrophobicContact CD2-CB 4.45Å; H108-P142 PolarHBondContact NE2-O 3.05Å; P142-F145 VanDerWaalsContact O-CZ 3.27Å; P142-F145 WeakPolarHBondContact O-CZ 3.47Å
143	D	97.7	Very high	96.4	Very high	44 Å²	44	46 Å²	46	24%	0.235	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	9.1	-179.4	59.4	6.4	0	0	0	113.9	S141 K159 C160	S141-D143 PolarHBondContact O-N 3.1Å; S141-D143 PolarHBondContact OG-OD1 3.2Å; D143-K159 CarbonylContact O-C 3.59Å; D143-K159 WeakPolarHBondContact O-CA 3.19Å; D143-K159 IonicContact OD1-NZ 2.72Å; D143-K159 PolarHBondContact OD1-NZ 3.24Å; D143-K159 WeakPolarHBondContact OD2-CE 3.3Å; D143-K159 IonicContact OD2-NZ 2.65Å; D143-K159 PolarHBondContact OD2-NZ 3.15Å; D143-C160 PolarHBondContact O-N 2.88Å
144	T	98.5	Very high	96.2	Very high	19 Å²	19	47.3 Å²	47.3	12%	0.117	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	117.8	-178	-49.3	0	0	0	0	111.3	K140 S141 T157 V158 K159	K140-T144 HydrophobicContact CB-CG2 4.17Å; K140-T144 HydrophobicContact CD-CG2 4.5Å; K140-T144 PolarHBondContact N-O 2.9Å; S141-T144 PolarHBondContact N-O 3.22Å; S141-T144 PolarHBondContact O-N 3.19Å; S141-T144 WeakPolarHBondContact OG-CB 3.48Å; S141-T144 PolarHBondContact OG-N 2.83Å; S141-T144 PolarHBondContact OG-OG1 3.1Å; T144-T157 HydrophobicContact CG2-CG2 3.55Å; T144-V158 WeakPolarHBondContact CA-O 3.48Å; T144-K159 WeakPolarHBondContact OG1-CD 3.35Å
145	F	98.7	Very high	96.2	Very high	1 Å²	1	50.6 Å²	50.6	0%	0.004	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	151.1	-174.3	-51	-77.8	0	0	0	110.7	L48 V133 I136 E138 I139 P142 T157 V158 C160 K165 F167	L48-F145 HydrophobicContact CD2-CE1 4.19Å; V133-F145 HydrophobicContact CB-CD2 4.46Å; V133-F145 HydrophobicContact CG1-CB 4.22Å; V133-F145 HydrophobicContact CG1-CD2 4.47Å; V133-F145 HydrophobicContact CG2-CD2 4.09Å; I136-F145 HydrophobicContact CB-CB 4.37Å; I136-F145 HydrophobicContact CD1-CD1 3.67Å; I136-F145 HydrophobicContact CD1-CE1 4.24Å; I136-F145 HydrophobicContact CG2-CB 3.78Å; I136-F145 HydrophobicContact CG2-CD1 4.39Å; I136-F145 HydrophobicContact CG2-CG 4.2Å; E138-F145 WeakPolarHBondContact O-CA 3.24Å; I139-F145 HydrophobicContact CG1-CD1 4.01Å; I139-F145 HydrophobicContact CG1-CE1 4.25Å; P142-F145 VanDerWaalsContact O-CZ 3.27Å; P142-F145 WeakPolarHBondContact O-CZ 3.47Å; F145-T157 CarbonylContact O-C 3.53Å; F145-T157 WeakPolarHBondContact O-CA 3.42Å; F145-V158 PolarHBondContact N-O 3.34Å; F145-V158 PolarHBondContact O-N 3.05Å; F145-C160 HydrophobicContact CD2-CB 4.31Å; F145-C160 HydrophobicContact CE2-CB 3.97Å; F145-K165 HydrophobicContact CE2-CG 4.2Å; F145-K165 HydrophobicContact CZ-CB 4.37Å; F145-K165 HydrophobicContact CZ-CG 4.28Å; F145-F167 HydrophobicContact CE1-CD1 4.36Å; F145-F167 HydrophobicContact CE1-CE1 4.39Å; F145-F167 HydrophobicContact CZ-CD1 4.2Å; F145-F167 HydrophobicContact CZ-CE1 4.39Å
146	V	98.7	Very high	96.2	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	135.3	168.3	-170.6	0	0	0	0	108.9	I136 I137 E138 K140 L155 S156 T157	I136-V146 CarbonylContact C-O 3.54Å; I136-V146 WeakPolarHBondContact CA-O 3.44Å; I137-V146 HydrophobicContact CD1-CG1 4.38Å; I137-V146 HydrophobicContact CG1-CB 4.33Å; I137-V146 HydrophobicContact CG1-CG1 4.26Å; I137-V146 WeakPolarHBondContact CG1-O 3.44Å; I137-V146 PolarHBondContact N-O 3.25Å; E138-V146 HydrophobicContact CB-CB 3.71Å; E138-V146 HydrophobicContact CB-CG2 3.86Å; E138-V146 HydrophobicContact CG-CG2 4.46Å; E138-V146 PolarHBondContact N-O 2.79Å; E138-V146 PolarHBondContact O-N 2.93Å; E138-V146 WeakPolarHBondContact OE2-CG2 3.34Å; K140-V146 HydrophobicContact CD-CG2 3.89Å; K140-V146 HydrophobicContact CG-CG2 4.16Å; V146-L155 HydrophobicContact CG1-CB 4.24Å; V146-L155 HydrophobicContact CG1-CD2 4.46Å; V146-S156 WeakPolarHBondContact CA-O 3.31Å; V146-T157 HydrophobicContact CG2-CG2 4.44Å
147	R	98.1	Very high	96.2	Very high	78 Å²	78	54.7 Å²	54.7	29%	0.294	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	164.5	173.7	63.8	176.1	-67.5	-114.8	-6.9	110.7	S134 S156 V158	S134-R147 WeakPolarHBondContact O-CD 3.48Å; S134-R147 PolarHBondContact O-NE 2.9Å; R147-S156 PolarHBondContact N-O 2.87Å; R147-S156 PolarHBondContact O-N 3.29Å; R147-V158 HydrophobicContact CG-CG2 4.49Å
148	T	96.3	Very high	96.2	Very high	20 Å²	20	54.9 Å²	54.9	12%	0.123	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	147.9	173.5	61	0	0	0	0	111.8	I137 A154 L155 R170	I137-T148 HydrophobicContact CD1-CG2 4Å; I137-T148 HydrophobicContact CG2-CG2 4.48Å; T148-A154 WeakPolarHBondContact CA-O 3.32Å; T148-L155 HydrophobicContact CG2-CD2 3.95Å; T148-R170 PolarHBondContact OG1-NH2 3.01Å
149	I	95.8	Very high	96.2	Very high	52 Å²	52	56 Å²	56	27%	0.267	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	170	170.8	58.2	171.3	0	0	0	109.8	A151 G152 N153 A154	I149-A151 PolarHBondContact O-N 3.16Å; I149-G152 PolarHBondContact O-N 3.36Å; I149-G152 VanDerWaalsContact O-N 3.14Å; I149-N153 PolarHBondContact O-N 2.99Å; I149-A154 HydrophobicContact CD1-CB 4.33Å; I149-A154 HydrophobicContact CG1-CB 3.87Å; I149-A154 PolarHBondContact N-O 3.44Å; I149-A154 PolarHBondContact O-N 3.01Å
150	Y	93.9	Very high	96.2	Very high	185 Å²	185	55.3 Å²	55.3	73%	0.725	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	56.8	-179.1	-63.9	-73.4	0	0	0	113.3	G152 N153	Y150-G152 PolarHBondContact O-N 3.19Å; Y150-N153 VanDerWaalsContact O-CB 3.3Å; Y150-N153 WeakPolarHBondContact O-CB 3.28Å; Y150-N153 PolarHBondContact O-N 3.06Å; Y150-N153 PolarHBondContact O-ND2 3.05Å
151	A	88.1	Confident	96.1	Very high	20 Å²	20	56.3 Å²	56.3	17%	0.165	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	33.7	179.6	0	0	0	0	0	113.7	I149 I285 A289	I149-A151 PolarHBondContact O-N 3.16Å; A151-I285 HydrophobicContact CB-CG2 4.01Å; A151-A289 HydrophobicContact CB-CB 3.95Å; A151-A289 VanDerWaalsContact O-CB 3.31Å; A151-A289 WeakPolarHBondContact O-CB 3.16Å
152	G	88.6	Confident	96.1	Very high	13 Å²	13	57.4 Å²	57.4	13%	0.134	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	-3.6	-180	0	0	0	0	0	114.7	I149 Y150 A154 K292	I149-G152 PolarHBondContact O-N 3.36Å; I149-G152 VanDerWaalsContact O-N 3.14Å; Y150-G152 PolarHBondContact O-N 3.19Å; G152-A154 VanDerWaalsContact C-N 3.32Å; G152-A154 PolarHBondContact O-N 3.36Å; G152-K292 VanDerWaalsContact C-NZ 3.27Å; G152-K292 PolarHBondContact O-NZ 2.8Å
153	N	88.8	Confident	96	Very high	109 Å²	109	59.7 Å²	59.7	58%	0.583	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-11.3	-172.8	-67.5	-32.3	0	0	0	114.2	I149 Y150	I149-N153 PolarHBondContact O-N 2.99Å; Y150-N153 VanDerWaalsContact O-CB 3.3Å; Y150-N153 WeakPolarHBondContact O-CB 3.28Å; Y150-N153 PolarHBondContact O-N 3.06Å; Y150-N153 PolarHBondContact O-ND2 3.05Å
154	A	94.6	Very high	96	Very high	37 Å²	37	58.4 Å²	58.4	31%	0.306	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	144.8	173	0	0	0	0	0	111.7	T148 I149 G152	T148-A154 WeakPolarHBondContact CA-O 3.32Å; I149-A154 HydrophobicContact CD1-CB 4.33Å; I149-A154 HydrophobicContact CG1-CB 3.87Å; I149-A154 PolarHBondContact N-O 3.44Å; I149-A154 PolarHBondContact O-N 3.01Å; G152-A154 VanDerWaalsContact C-N 3.32Å; G152-A154 PolarHBondContact O-N 3.36Å
155	L	97.6	Very high	96.1	Very high	122 Å²	122	59.2 Å²	59.2	64%	0.639	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	127.7	172.5	-62.1	-178.7	0	0	0	109.3	I137 V146 T148	I137-L155 HydrophobicContact CD1-CD2 3.76Å; V146-L155 HydrophobicContact CG1-CB 4.24Å; V146-L155 HydrophobicContact CG1-CD2 4.46Å; T148-L155 HydrophobicContact CG2-CD2 3.95Å
156	S	98.4	Very high	96.1	Very high	36 Å²	36	59.2 Å²	59.2	25%	0.252	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	116.2	174.8	-176.8	0	0	0	0	109.2	V146 R147	V146-S156 WeakPolarHBondContact CA-O 3.31Å; R147-S156 PolarHBondContact N-O 2.87Å; R147-S156 PolarHBondContact O-N 3.29Å
157	T	98.7	Very high	96.1	Very high	72 Å²	72	59.2 Å²	59.2	44%	0.442	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	118.2	169.7	-59.9	0	0	0	0	108.2	K140 T144 F145 V146	K140-T157 HydrophobicContact CD-CG2 4.1Å; K140-T157 PolarHBondContact NZ-OG1 3.26Å; T144-T157 HydrophobicContact CG2-CG2 3.55Å; F145-T157 CarbonylContact O-C 3.53Å; F145-T157 WeakPolarHBondContact O-CA 3.42Å; V146-T157 HydrophobicContact CG2-CG2 4.44Å
158	V	98.4	Very high	96.1	Very high	45 Å²	45	55.7 Å²	55.7	27%	0.273	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122.4	-174.7	-176.6	0	0	0	0	109.4	V133 T144 F145 R147	V133-V158 HydrophobicContact CG2-CG1 4.46Å; T144-V158 WeakPolarHBondContact CA-O 3.48Å; F145-V158 PolarHBondContact N-O 3.34Å; F145-V158 PolarHBondContact O-N 3.05Å; R147-V158 HydrophobicContact CG-CG2 4.49Å
159	K	98.4	Very high	96.2	Very high	109 Å²	109	54.8 Å²	54.8	47%	0.474	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	118.2	168.1	-175.8	75.6	175.9	-173	0	108.7	D143 T144	D143-K159 CarbonylContact O-C 3.59Å; D143-K159 WeakPolarHBondContact O-CA 3.19Å; D143-K159 IonicContact OD1-NZ 2.72Å; D143-K159 PolarHBondContact OD1-NZ 3.24Å; D143-K159 WeakPolarHBondContact OD2-CE 3.3Å; D143-K159 IonicContact OD2-NZ 2.65Å; D143-K159 PolarHBondContact OD2-NZ 3.15Å; T144-K159 WeakPolarHBondContact OG1-CD 3.35Å
160	C	97.8	Very high	96.3	Very high	8 Å²	8	53.1 Å²	53.1	5%	0.054	29%	0.292	C	S	.	.			trans	-100.9	108.5	179.7	-177.4	0	0	0	0	110.3	V133 D143 F145 E162 K165	V133-C160 HydrophobicContact CG2-CB 4.29Å; D143-C160 PolarHBondContact O-N 2.88Å; F145-C160 HydrophobicContact CD2-CB 4.31Å; F145-C160 HydrophobicContact CE2-CB 3.97Å; C160-E162 VanDerWaalsContact C-N 3.33Å; C160-E162 WeakPolarHBondContact SG-CG 2.92Å; C160-K165 HydrophobicContact CB-CG 4.24Å; C160-K165 VanDerWaalsContact O-CE 3.23Å; C160-K165 WeakPolarHBondContact O-CE 3.3Å
161	N	96.6	Very high	96.4	Very high	134 Å²	134	45 Å²	45	72%	0.717	27%	0.265	S	S	*	.			trans	-94	9.2	-179.4	-62.1	-37.1	0	0	0	113.1
162	E	97.8	Very high	96.8	Very high	60 Å²	60	46.7 Å²	46.7	28%	0.28	27%	0.273	S	S	.	.			trans	-64.5	152	-179.7	-59.1	-65.6	-177.9	0	0	112	V130 A131 C160 V164 K165	V130-E162 HydrophobicContact CB-CB 3.93Å; V130-E162 HydrophobicContact CB-CG 3.89Å; V130-E162 HydrophobicContact CG1-CB 3.91Å; V130-E162 HydrophobicContact CG1-CG 4.34Å; A131-E162 VanDerWaalsContact CB-OE1 3.29Å; A131-E162 WeakPolarHBondContact CB-OE1 3.2Å; A131-E162 PolarHBondContact N-OE1 3.44Å; C160-E162 VanDerWaalsContact C-N 3.33Å; C160-E162 WeakPolarHBondContact SG-CG 2.92Å; E162-V164 VanDerWaalsContact C-N 3.3Å; E162-V164 WeakPolarHBondContact CB-O 3.34Å; E162-V164 PolarHBondContact O-N 2.9Å; E162-K165 WeakPolarHBondContact O-CE 3.35Å; E162-K165 PolarHBondContact O-NZ 3.09Å
163	A	95	Very high	97.2	Very high	88 Å²	88	47.9 Å²	47.9	73%	0.727	28%	0.281	S	S	*	.	S	Bend	trans	-61	-41.5	177.1	0	0	0	0	0	111.7
164	V	98.2	Very high	97.6	Very high	17 Å²	17	43 Å²	43	10%	0.103	26%	0.255	C	S	.	.	S	Bend	trans	-119.3	126.6	175.2	-176	0	0	0	0	108.8	I109 L128 E162 V166	I109-V164 HydrophobicContact CD1-CG1 3.97Å; I109-V164 HydrophobicContact CG1-CG1 3.98Å; L128-V164 HydrophobicContact CD1-CG1 4.29Å; E162-V164 VanDerWaalsContact C-N 3.3Å; E162-V164 WeakPolarHBondContact CB-O 3.34Å; E162-V164 PolarHBondContact O-N 2.9Å; V164-V166 HydrophobicContact CG1-CG2 4.29Å; V164-V166 PolarHBondContact O-N 3.27Å
165	K	98.7	Very high	97.6	Very high	36 Å²	36	49 Å²	49	16%	0.157	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	104.1	179.7	-78	64.5	173.8	177.8	0	108.5	T107 H108 I109 F145 C160 E162 F167	T107-K165 PolarHBondContact O-N 3.23Å; H108-K165 CarbonylContact C-O 3.07Å; H108-K165 WeakPolarHBondContact CA-O 3.3Å; H108-K165 WeakPolarHBondContact CD2-CB 3.31Å; I109-K165 PolarHBondContact N-O 3Å; F145-K165 HydrophobicContact CE2-CG 4.2Å; F145-K165 HydrophobicContact CZ-CB 4.37Å; F145-K165 HydrophobicContact CZ-CG 4.28Å; C160-K165 HydrophobicContact CB-CG 4.24Å; C160-K165 VanDerWaalsContact O-CE 3.23Å; C160-K165 WeakPolarHBondContact O-CE 3.3Å; E162-K165 WeakPolarHBondContact O-CE 3.35Å; E162-K165 PolarHBondContact O-NZ 3.09Å; K165-F167 HydrophobicContact CB-CD1 4.4Å
166	V	98.9	Very high	97.6	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	124.1	173.9	-174.5	0	0	0	0	109.4	I109 L121 A125 L128 V130 P132 V133 V164	I109-V166 HydrophobicContact CB-CG2 4.38Å; I109-V166 VanDerWaalsContact O-CA 3.31Å; I109-V166 WeakPolarHBondContact O-CA 3.42Å; L121-V166 HydrophobicContact CB-CG1 4Å; L121-V166 HydrophobicContact CD1-CG1 4.23Å; L121-V166 HydrophobicContact CD2-CG1 4.41Å; L121-V166 HydrophobicContact CG-CG1 4.46Å; A125-V166 HydrophobicContact CB-CB 3.98Å; A125-V166 HydrophobicContact CB-CG1 3.99Å; A125-V166 HydrophobicContact CB-CG2 4.18Å; L128-V166 HydrophobicContact CD1-CG2 4.19Å; V130-V166 HydrophobicContact CG2-CB 4.5Å; V130-V166 HydrophobicContact CG2-CG2 3.82Å; P132-V166 CarbonylContact C-O 3.57Å; P132-V166 WeakPolarHBondContact CA-O 3.43Å; P132-V166 HydrophobicContact CB-CB 4.36Å; P132-V166 HydrophobicContact CB-CG1 4.37Å; V133-V166 PolarHBondContact N-O 3.3Å; V164-V166 HydrophobicContact CG1-CG2 4.29Å; V164-V166 PolarHBondContact O-N 3.27Å
167	F	98.9	Very high	97.5	Very high	1 Å²	1	44.7 Å²	44.7	0%	0.004	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	153.2	-177.8	62.7	-84.7	0	0	0	114.1	L48 H108 I109 C110 L121 V133 I136 F145 K165 V169	L48-F167 HydrophobicContact CD1-CE1 4.2Å; L48-F167 HydrophobicContact CD1-CZ 3.86Å; H108-F167 HydrophobicContact CB-CE1 4.16Å; H108-F167 AromaticContact CD2-CE1 3.88Å; I109-F167 PolarHBondContact O-N 3.24Å; C110-F167 WeakPolarHBondContact CA-O 3.26Å; C110-F167 HydrophobicContact CB-CD1 4.18Å; C110-F167 HydrophobicContact CB-CD2 3.76Å; C110-F167 HydrophobicContact CB-CE1 3.82Å; C110-F167 HydrophobicContact CB-CE2 3.39Å; C110-F167 HydrophobicContact CB-CG 4.14Å; C110-F167 HydrophobicContact CB-CZ 3.41Å; C110-F167 VanDerWaalsContact CB-CZ 3.41Å; C110-F167 VanDerWaalsContact CB-O 3.23Å; C110-F167 WeakPolarHBondContact CB-O 3.31Å; L121-F167 WeakPolarHBondContact CD1-O 3.48Å; V133-F167 HydrophobicContact CB-CB 4.06Å; V133-F167 CarbonylContact O-C 3.6Å; V133-F167 WeakPolarHBondContact O-CA 3.48Å; V133-F167 WeakPolarHBondContact O-CB 3.22Å; I136-F167 HydrophobicContact CD1-CD2 3.46Å; I136-F167 VanDerWaalsContact CD1-CD2 3.46Å; I136-F167 HydrophobicContact CD1-CE2 3.67Å; I136-F167 HydrophobicContact CD1-CG 4.39Å; I136-F167 HydrophobicContact CG1-CD2 4.04Å; I136-F167 HydrophobicContact CG2-CB 4.5Å; F145-F167 HydrophobicContact CE1-CD1 4.36Å; F145-F167 HydrophobicContact CE1-CE1 4.39Å; F145-F167 HydrophobicContact CZ-CD1 4.2Å; F145-F167 HydrophobicContact CZ-CE1 4.39Å; K165-F167 HydrophobicContact CB-CD1 4.4Å; F167-V169 HydrophobicContact CD2-CG2 3.85Å; F167-V169 HydrophobicContact CE2-CG2 3.6Å
168	T	98.9	Very high	97.4	Very high	5 Å²	5	43.8 Å²	43.8	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	142.3	170.8	53.1	0	0	0	0	111.3	A111 L121 V133 S134 D135 I136	A111-T168 CarbonylContact O-C 3.51Å; A111-T168 WeakPolarHBondContact O-CA 3.43Å; L121-T168 HydrophobicContact CB-CG2 4.19Å; L121-T168 HydrophobicContact CD1-CG2 3.74Å; L121-T168 HydrophobicContact CG-CG2 4.23Å; V133-T168 PolarHBondContact O-N 3.15Å; S134-T168 WeakPolarHBondContact CA-OG1 3.34Å; D135-T168 WeakPolarHBondContact CA-O 3.29Å; D135-T168 PolarHBondContact N-O 3.27Å; D135-T168 VanDerWaalsContact N-O 3.1Å; D135-T168 PolarHBondContact N-OG1 3.3Å; I136-T168 WeakPolarHBondContact CG1-O 3.39Å; I136-T168 PolarHBondContact N-O 3.2Å
169	V	98.7	Very high	97.2	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	127.1	-174	179.7	0	0	0	0	110.8	A41 A44 C110 A111 A113 I136 F167 G171 F174	A41-V169 HydrophobicContact CB-CB 4.42Å; A41-V169 HydrophobicContact CB-CG2 4.45Å; A44-V169 HydrophobicContact CB-CB 4.38Å; A44-V169 HydrophobicContact CB-CG1 3.62Å; A44-V169 HydrophobicContact CB-CG2 3.81Å; C110-V169 HydrophobicContact CB-CG2 4.47Å; A111-V169 PolarHBondContact O-N 3.16Å; A113-V169 VanDerWaalsContact CB-O 3.29Å; A113-V169 WeakPolarHBondContact CB-O 3.29Å; A113-V169 PolarHBondContact N-O 3.29Å; I136-V169 HydrophobicContact CD1-CG2 4.35Å; I136-V169 HydrophobicContact CG1-CG2 4.25Å; F167-V169 HydrophobicContact CD2-CG2 3.85Å; F167-V169 HydrophobicContact CE2-CG2 3.6Å; V169-G171 PolarHBondContact O-N 2.98Å; V169-F174 HydrophobicContact CG1-CD2 3.46Å; V169-F174 VanDerWaalsContact CG1-CD2 3.46Å; V169-F174 HydrophobicContact CG1-CE2 3.69Å; V169-F174 HydrophobicContact CG1-CG 4.25Å
170	R	98.2	Very high	97	Very high	17 Å²	17	46.3 Å²	46.3	6%	0.064	28%	0.278	C	S	.	.			trans	-68.8	116.8	170.9	-173	168	-67.7	-176.4	-4.5	109.7	D135 I136 I137 T148 T172 A173	D135-R170 WeakPolarHBondContact OD1-CA 3.29Å; D135-R170 VanDerWaalsContact OD1-CB 3.22Å; D135-R170 WeakPolarHBondContact OD1-CB 3.35Å; D135-R170 IonicContact OD1-NE 3.15Å; D135-R170 PolarHBondContact OD1-NE 3.22Å; D135-R170 VanDerWaalsContact OD1-NE 3.15Å; D135-R170 IonicContact OD1-NH2 3.97Å; D135-R170 IonicContact OD2-CZ 3.42Å; D135-R170 IonicContact OD2-NE 3.3Å; D135-R170 PolarHBondContact OD2-NE 2.89Å; D135-R170 IonicContact OD2-NH2 2.7Å; D135-R170 PolarHBondContact OD2-NH2 3.03Å; I136-R170 VanDerWaalsContact O-CB 3.24Å; I136-R170 WeakPolarHBondContact O-CB 3.33Å; I136-R170 PolarHBondContact O-N 3.05Å; I137-R170 HydrophobicContact CG2-CB 4.03Å; I137-R170 HydrophobicContact CG2-CG 4.45Å; T148-R170 PolarHBondContact OG1-NH2 3.01Å; R170-T172 VanDerWaalsContact C-N 3.34Å; R170-T172 WeakPolarHBondContact CG-OG1 3.46Å; R170-T172 PolarHBondContact O-N 3.29Å; R170-A173 HydrophobicContact CB-CB 4.1Å; R170-A173 HydrophobicContact CG-CB 4.41Å; R170-A173 PolarHBondContact O-N 3.22Å; R170-A173 VanDerWaalsContact O-N 3.12Å
171	G	96.2	Very high	96.7	Very high	14 Å²	14	49.6 Å²	49.6	14%	0.144	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-54.7	-46.3	-177	0	0	0	0	0	113.5	N40 V169 A173 F174	N40-G171 PolarHBondContact ND2-O 2.99Å; N40-G171 VanDerWaalsContact ND2-O 3.15Å; V169-G171 PolarHBondContact O-N 2.98Å; G171-A173 PolarHBondContact O-N 2.85Å; G171-A173 VanDerWaalsContact O-N 3.14Å; G171-F174 PolarHBondContact O-N 3.18Å
172	T	95.2	Very high	96.7	Very high	56 Å²	56	44.2 Å²	44.2	34%	0.344	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-68	-11.6	-177.8	55.1	0	0	0	0	115	R170 A272	R170-T172 VanDerWaalsContact C-N 3.34Å; R170-T172 WeakPolarHBondContact CG-OG1 3.46Å; R170-T172 PolarHBondContact O-N 3.29Å; T172-A272 HydrophobicContact CG2-CB 3.81Å
173	A	96.8	Very high	96.6	Very high	37 Å²	37	46.9 Å²	46.9	31%	0.306	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-93	-8.7	-176.5	0	0	0	0	0	113.7	I137 R170 G171	I137-A173 HydrophobicContact CB-CB 3.87Å; I137-A173 HydrophobicContact CG2-CB 4.18Å; I137-A173 WeakPolarHBondContact O-CB 3.5Å; R170-A173 HydrophobicContact CB-CB 4.1Å; R170-A173 HydrophobicContact CG-CB 4.41Å; R170-A173 PolarHBondContact O-N 3.22Å; R170-A173 VanDerWaalsContact O-N 3.12Å; G171-A173 PolarHBondContact O-N 2.85Å; G171-A173 VanDerWaalsContact O-N 3.14Å
174	F	97.2	Very high	96.6	Very high	7 Å²	7	43.2 Å²	43.2	3%	0.031	28%	0.284	C	S	.	.	S	Bend	trans	-133.7	136.3	-179	-61.8	-96.7	0	0	0	109	N40 T43 A44 K47 I139 V169 G171	N40-F174 HydrophobicContact CB-CB 4.49Å; N40-F174 PolarHBondContact ND2-O 2.84Å; T43-F174 HydrophobicContact CG2-CB 4.36Å; A44-F174 HydrophobicContact CB-CD1 3.7Å; A44-F174 HydrophobicContact CB-CD2 4.17Å; A44-F174 HydrophobicContact CB-CE1 3.78Å; A44-F174 HydrophobicContact CB-CE2 4.25Å; A44-F174 HydrophobicContact CB-CG 3.92Å; A44-F174 HydrophobicContact CB-CZ 4.07Å; K47-F174 HydrophobicContact CD-CD1 4.11Å; K47-F174 HydrophobicContact CD-CE1 3.91Å; I139-F174 HydrophobicContact CD1-CE1 4.16Å; I139-F174 HydrophobicContact CD1-CZ 4.28Å; I139-F174 HydrophobicContact CG1-CE1 4.33Å; I139-F174 HydrophobicContact CG1-CZ 4.16Å; V169-F174 HydrophobicContact CG1-CD2 3.46Å; V169-F174 VanDerWaalsContact CG1-CD2 3.46Å; V169-F174 HydrophobicContact CG1-CE2 3.69Å; V169-F174 HydrophobicContact CG1-CG 4.25Å; G171-F174 PolarHBondContact O-N 3.18Å
175	E	95.7	Very high	96.5	Very high	163 Å²	163	45.7 Å²	45.7	76%	0.762	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-59.7	147.2	173.1	-66	-59.1	144.1	0	0	111.1	T43 A177	T43-E175 WeakPolarHBondContact CB-O 3.43Å; T43-E175 WeakPolarHBondContact CG2-O 3.11Å; T43-E175 PolarHBondContact OG1-O 2.65Å; E175-A177 PolarHBondContact O-N 2.8Å
176	A	96.5	Very high	96.4	Very high	54 Å²	54	47.5 Å²	47.5	45%	0.446	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-66.1	135	173.3	0	0	0	0	0	109.9	L39 N40	L39-A176 HydrophobicContact CB-CB 3.89Å; L39-A176 HydrophobicContact CD1-CB 4.36Å; N40-A176 PolarHBondContact ND2-N 2.97Å
177	A	97.4	Very high	96.3	Very high	13 Å²	13	50.8 Å²	50.8	11%	0.107	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-59.1	146.2	171.2	0	0	0	0	0	110.7	L39 I42 T43 V71 E175 A179	L39-A177 HydrophobicContact CB-CB 4.4Å; L39-A177 WeakPolarHBondContact O-CB 3.48Å; L39-A177 PolarHBondContact O-N 2.9Å; L39-A177 VanDerWaalsContact O-N 3.13Å; I42-A177 HydrophobicContact CB-CB 4.21Å; I42-A177 HydrophobicContact CG2-CB 3.93Å; T43-A177 WeakPolarHBondContact OG1-CA 3.45Å; T43-A177 PolarHBondContact OG1-N 3.28Å; V71-A177 HydrophobicContact CG1-CB 3.78Å; E175-A177 PolarHBondContact O-N 2.8Å; A177-A179 PolarHBondContact O-N 2.86Å
178	S	96.5	Very high	96.2	Very high	54 Å²	54	59.1 Å²	59.1	38%	0.378	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-58.3	125.5	174	175.9	0	0	0	0	109.7	V71 Q72 E180	V71-S178 CarbonylContact C-O 3.54Å; V71-S178 WeakPolarHBondContact CA-O 3.26Å; Q72-S178 PolarHBondContact N-O 3.26Å; S178-E180 WeakPolarHBondContact CB-O 3.48Å; S178-E180 PolarHBondContact O-N 3.41Å; S178-E180 PolarHBondContact OG-N 3.1Å; S178-E180 PolarHBondContact OG-O 2.81Å
179	A	93.5	Very high	96	Very high	58 Å²	58	59.4 Å²	59.4	48%	0.479	38%	0.38	S	S	.	.	S	Bend	trans	-72.9	-0.6	175.6	0	0	0	0	0	113.2	K70 A177	K70-A179 CarbonylContact C-O 3.17Å; K70-A179 WeakPolarHBondContact CB-O 3.22Å; K70-A179 CarbonylContact O-C 3.58Å; A177-A179 PolarHBondContact O-N 2.86Å
180	E	93.9	Very high	95.4	Very high	149 Å²	149	63.2 Å²	63.2	70%	0.696	41%	0.412	S	S	*	.	S	Bend	trans	-129.7	161.1	177.6	-61.9	-178	178.4	0	0	110.9	K70 S178	K70-E180 CarbonylContact O-C 3.56Å; K70-E180 WeakPolarHBondContact O-CA 3.3Å; K70-E180 PolarHBondContact O-N 2.99Å; S178-E180 WeakPolarHBondContact CB-O 3.48Å; S178-E180 PolarHBondContact O-N 3.41Å; S178-E180 PolarHBondContact OG-N 3.1Å; S178-E180 PolarHBondContact OG-O 2.81Å
181	G	92.8	Very high	94.8	Very high	76 Å²	76	64.7 Å²	64.7	78%	0.784	42%	0.424	S	S	*	.	S	Bend	trans	88.7	0.3	177.6	0	0	0	0	0	115	K70	K70-G181 PolarHBondContact O-N 3.23Å
182	G	95.6	Very high	94.4	Very high	22 Å²	22	64.8 Å²	64.8	23%	0.227	42%	0.422	C	S	.	.			trans	-85.2	163.9	166.9	0	0	0	0	0	113.2	S69 K70 V71	S69-G182 CarbonylContact O-C 3.57Å; K70-G182 WeakPolarHBondContact O-CA 3.38Å; K70-G182 PolarHBondContact O-N 3.45Å; V71-G182 WeakPolarHBondContact O-CA 3.33Å
183	S	95.3	Very high	94	Very high	116 Å²	116	67.5 Å²	67.5	81%	0.811	44%	0.441	S	S	*	.			trans	-151.3	42.1	175.5	70.7	0	0	0	0	111	S69	S69-S183 WeakPolarHBondContact O-CA 3.4Å; S69-S183 PolarHBondContact O-N 3.38Å; S69-S183 VanDerWaalsContact O-N 3.15Å
184	A	96.2	Very high	93.5	Very high	10 Å²	10	69.5 Å²	69.5	8%	0.083	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-69.6	132.8	-173.6	0	0	0	0	0	110.9	S69 V74 I77	S69-A184 PolarHBondContact O-N 3.07Å; V74-A184 HydrophobicContact CB-CB 4.02Å; V74-A184 HydrophobicContact CG1-CB 3.71Å; V74-A184 WeakPolarHBondContact O-CB 3.36Å; I77-A184 HydrophobicContact CD1-CB 4.08Å; I77-A184 HydrophobicContact CG1-CB 3.89Å
185	A	95.8	Very high	93.1	Very high	70 Å²	70	71.3 Å²	71.3	58%	0.579	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	142.1	174.3	0	0	0	0	0	110.7	I77	I77-A185 PolarHBondContact N-O 3.01Å
186	S	96.6	Very high	92.8	Very high	74 Å²	74	66.6 Å²	66.6	52%	0.517	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	140.4	172.8	58.7	0	0	0	0	112.3	I77	I77-S186 CarbonylContact O-C 3.58Å; I77-S186 WeakPolarHBondContact O-CA 3.43Å
187	E	96.8	Very high	92.7	Very high	70 Å²	70	69.4 Å²	69.4	33%	0.327	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	134.4	173.4	-178.7	-178.3	158.8	0	0	108	K76 I77 L78 V79	K76-E187 IonicContact NZ-OE2 2.74Å; K76-E187 PolarHBondContact NZ-OE2 3.36Å; I77-E187 PolarHBondContact O-N 3.5Å; L78-E187 WeakPolarHBondContact CA-O 3.45Å; L78-E187 HydrophobicContact CD2-CB 4.4Å; V79-E187 PolarHBondContact N-O 2.94Å
188	E	96.1	Very high	92.7	Very high	176 Å²	176	70.8 Å²	70.8	82%	0.822	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	136	173.8	-68	-176.6	178.2	0	0	110.1	V79	V79-E188 WeakPolarHBondContact O-CA 3.33Å
189	V	94.6	Very high	92.7	Very high	10 Å²	10	75.5 Å²	75.5	6%	0.061	50%	0.498	C	S	.	.			trans	-111.6	145.9	171	-65.4	0	0	0	0	109.8	L55 L78 V79 A80 L96 F104 S191	L55-V189 HydrophobicContact CD1-CG2 4.11Å; L78-V189 HydrophobicContact CB-CG1 3.88Å; L78-V189 HydrophobicContact CB-CG2 4.41Å; L78-V189 HydrophobicContact CD1-CG1 4.39Å; L78-V189 HydrophobicContact CD2-CG1 3.81Å; L78-V189 HydrophobicContact CG-CG1 4.24Å; V79-V189 PolarHBondContact O-N 3.46Å; A80-V189 HydrophobicContact CB-CG2 3.86Å; L96-V189 HydrophobicContact CD1-CG2 4.06Å; F104-V189 HydrophobicContact CE2-CG1 4.08Å; V189-S191 PolarHBondContact O-N 3.18Å
190	A	87.8	Confident	92.8	Very high	82 Å²	82	76.5 Å²	76.5	68%	0.678	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-63.9	122.5	-177.7	0	0	0	0	0	110.8
191	S	84.1	Confident	92.9	Very high	47 Å²	47	75.4 Å²	75.4	33%	0.329	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-63.1	142.8	169.6	-59	0	0	0	0	110.2	Y85 V189	Y85-S191 WeakPolarHBondContact OH-CA 3.4Å; V189-S191 PolarHBondContact O-N 3.18Å
192	T	88.6	Confident	93	Very high	16 Å²	16	79.6 Å²	79.6	10%	0.098	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-86.8	152.1	175.4	50.6	0	0	0	0	111.2	Y85 P95 E99	Y85-T192 PolarHBondContact OH-N 2.68Å; P95-T192 HydrophobicContact CB-CG2 4.06Å; E99-T192 HydrophobicContact CB-CG2 4.39Å; E99-T192 HydrophobicContact CG-CG2 3.76Å
193	P	86.5	Confident	92.8	Very high	113 Å²	113	84.4 Å²	84.4	73%	0.734	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-54.1	141.3	171.3	-24.9	34.4	0	0	0	111.3	A195	P193-A195 PolarHBondContact O-N 2.67Å
194	P	87.2	Confident	92.4	Very high	79 Å²	79	86.5 Å²	86.5	51%	0.513	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-60	138.3	-179.3	-23	32.7	0	0	0	112.1	E92	E92-P194 WeakPolarHBondContact OE2-CA 3.38Å
195	A	88.8	Confident	91.9	Very high	45 Å²	45	91.6 Å²	91.6	37%	0.372	53%	0.531	S	S	.	.			trans	-71.8	-39.1	174.8	0	0	0	0	0	111.1	E91 E92 P193 V197	E91-A195 HydrophobicContact CB-CB 4.24Å; E92-A195 VanDerWaalsContact CD-N 3.32Å; E92-A195 WeakPolarHBondContact OE1-CB 3.29Å; E92-A195 PolarHBondContact OE1-N 3.4Å; E92-A195 PolarHBondContact OE2-N 2.91Å; P193-A195 PolarHBondContact O-N 2.67Å; A195-V197 VanDerWaalsContact C-N 3.26Å; A195-V197 HydrophobicContact CB-CG2 4.48Å; A195-V197 PolarHBondContact O-N 3.4Å
196	G	88.2	Confident	91.1	Very high	65 Å²	65	92 Å²	92	67%	0.67	53%	0.526	S	S	*	.			trans	68.4	19.6	171.5	0	0	0	0	0	115	E92	E92-G196 PolarHBondContact OE1-N 3.04Å
197	V	95.5	Very high	90.3	Very high	113 Å²	113	98.2 Å²	98.2	69%	0.685	54%	0.544	S	S	*	.	S	Bend	trans	-101	-6	-179.8	-58.1	0	0	0	0	113.5	E91 A195	E91-V197 HydrophobicContact CB-CG2 4.02Å; E91-V197 HydrophobicContact CG-CG2 3.47Å; E91-V197 VanDerWaalsContact CG-CG2 3.47Å; A195-V197 VanDerWaalsContact C-N 3.26Å; A195-V197 HydrophobicContact CB-CG2 4.48Å; A195-V197 PolarHBondContact O-N 3.4Å
198	S	96.3	Very high	89.5	Confident	41 Å²	41	98.3 Å²	98.3	29%	0.287	55%	0.553	S	S	.	*			trans	-147.5	147.8	177.9	55.9	0	0	0	0	109.2	L89 E91	L89-S198 WeakPolarHBondContact CD1-O 3.2Å; E91-S198 WeakPolarHBondContact CG-OG 3.34Å
199	E	96.2	Very high	88.9	Confident	153 Å²	153	98.2 Å²	98.2	72%	0.715	56%	0.558	S	S	*	*			trans	-132	146.7	178.1	66	-179.5	149.8	0	0	111.7	L201	E199-L201 HydrophobicContact CG-CD2 3.82Å; E199-L201 HydrophobicContact CG-CG 4.33Å
200	W	96.4	Very high	88.7	Confident	80 Å²	80	101.1 Å²	101.1	30%	0.303	57%	0.568	S	S	.	*			trans	-93.2	121.4	171.6	-176.1	94.6	0	0	0	109.2	K86 L89 Q203	K86-W200 HydrophobicContact CD-CE3 4.12Å; K86-W200 VanDerWaalsContact CE-CZ3 3.45Å; K86-W200 HydrophobicContact CG-CE3 4.24Å; L89-W200 HydrophobicContact CD2-CB 4.47Å; W200-Q203 HydrophobicContact CH2-CG 4.19Å; W200-Q203 HydrophobicContact CZ2-CB 3.67Å; W200-Q203 HydrophobicContact CZ2-CG 3.62Å
201	L	95.9	Very high	88.7	Confident	125 Å²	125	99.1 Å²	99.1	65%	0.654	55%	0.548	S	S	*	.			trans	-96	-62.9	-177.7	-60.6	-179.2	0	0	0	111.8	E199	E199-L201 HydrophobicContact CG-CD2 3.82Å; E199-L201 HydrophobicContact CG-CG 4.33Å
202	E	94.3	Very high	89	Confident	165 Å²	165	100.7 Å²	100.7	77%	0.771	55%	0.55	S	S	*	*			trans	-150.5	165.8	-176.2	64.4	174.8	-162.1	0	0	112.4
203	Q	91.6	Very high	89.2	Confident	122 Å²	122	100.4 Å²	100.4	57%	0.57	55%	0.548	S	S	*	.			trans	-137.1	144.5	168.2	68.9	-173.9	17.8	0	0	110	W200 L205	W200-Q203 HydrophobicContact CH2-CG 4.19Å; W200-Q203 HydrophobicContact CZ2-CB 3.67Å; W200-Q203 HydrophobicContact CZ2-CG 3.62Å; Q203-L205 HydrophobicContact CG-CG 4.26Å
204	N	87.9	Confident	89.4	Confident	161 Å²	161	98.1 Å²	98.1	86%	0.861	53%	0.532	S	S	*	.			trans	-122.6	107.1	173.4	-147.1	-19	0	0	0	108.5
205	L	84.9	Confident	89.4	Confident	117 Å²	117	97.6 Å²	97.6	61%	0.613	53%	0.53	S	S	*	.			trans	-101.1	129.7	-174.2	-60.9	179.4	0	0	0	110.1	Q203 K207	Q203-L205 HydrophobicContact CG-CG 4.26Å; L205-K207 PolarHBondContact O-N 2.93Å; L205-K207 VanDerWaalsContact O-N 3.12Å
206	T	78.9	Confident	89.7	Confident	77 Å²	77	96 Å²	96	47%	0.472	52%	0.517	S	S	.	.			trans	-61.4	112.9	171.2	-53.9	0	0	0	0	109.2	P259 D261	T206-P259 HydrophobicContact CG2-CG 4.37Å; T206-D261 PolarHBondContact OG1-OD1 3.44Å
207	K	79.5	Confident	90	Very high	205 Å²	205	99.7 Å²	99.7	89%	0.891	51%	0.514	S	S	*	.			trans	-79.9	128.4	173.5	-67.5	-175.6	-179.3	-179.9	0	109	L205	L205-K207 PolarHBondContact O-N 2.93Å; L205-K207 VanDerWaalsContact O-N 3.12Å
208	S	79.9	Confident	90.2	Very high	73 Å²	73	95.4 Å²	95.4	51%	0.51	49%	0.488	S	S	.	.			trans	-145.1	133.5	177.9	171.7	0	0	0	0	109.2	R210	S208-R210 WeakPolarHBondContact OG-CB 3.31Å; S208-R210 PolarHBondContact OG-N 2.89Å
209	D	84.6	Confident	90.3	Very high	174 Å²	174	93.4 Å²	93.4	93%	0.93	48%	0.475	S	S	*	.	S	Bend	trans	-79.9	-10.4	171.1	-58.6	-44.4	0	0	0	112
210	R	89.4	Confident	90.4	Very high	70 Å²	70	86.1 Å²	86.1	26%	0.264	44%	0.441	S	S	.	.	S	Bend	trans	-79.8	154.4	178.9	-61.1	-176.3	179.1	74.9	14.7	111.5	S208 D240	S208-R210 WeakPolarHBondContact OG-CB 3.31Å; S208-R210 PolarHBondContact OG-N 2.89Å; R210-D240 IonicContact CZ-OD1 3.3Å; R210-D240 VanDerWaalsContact CZ-OD1 3.23Å; R210-D240 IonicContact NE-OD1 2.61Å; R210-D240 PolarHBondContact NE-OD1 2.97Å; R210-D240 VanDerWaalsContact NH2-CG 3.31Å; R210-D240 IonicContact NH2-OD1 3.87Å; R210-D240 PolarHBondContact NH2-OD1 3.02Å; R210-D240 IonicContact NH2-OD2 3.83Å; R210-D240 PolarHBondContact NH2-OD2 2.97Å
211	P	87.9	Confident	90.5	Very high	41 Å²	41	82.3 Å²	82.3	27%	0.266	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-50.9	150	173.9	-27	35.3	0	0	0	113	A216 A245	P211-A216 HydrophobicContact CB-CB 4.06Å; P211-A245 VanDerWaalsContact O-CB 3.3Å; P211-A245 WeakPolarHBondContact O-CB 3.49Å
212	E	90.1	Very high	90.6	Very high	80 Å²	80	76.4 Å²	76.4	37%	0.374	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-69.4	135.2	176.5	-168	-69	137.3	0	0	110.2	T214 S215 A216 K269	E212-T214 VanDerWaalsContact CD-N 3.29Å; E212-T214 VanDerWaalsContact CD-OG1 3.23Å; E212-T214 PolarHBondContact O-N 3.12Å; E212-T214 PolarHBondContact OE1-N 3.12Å; E212-T214 PolarHBondContact OE1-OG1 2.78Å; E212-T214 WeakPolarHBondContact OE2-CA 3.14Å; E212-T214 WeakPolarHBondContact OE2-CB 3.15Å; E212-T214 PolarHBondContact OE2-N 3.28Å; E212-T214 PolarHBondContact OE2-OG1 3.19Å; E212-S215 PolarHBondContact O-N 2.58Å; E212-S215 VanDerWaalsContact O-N 3.12Å; E212-S215 PolarHBondContact O-OG 3.23Å; E212-S215 PolarHBondContact OE2-N 3.27Å; E212-S215 VanDerWaalsContact OE2-N 3.12Å; E212-S215 PolarHBondContact OE2-OG 2.98Å; E212-A216 WeakPolarHBondContact O-CB 3.39Å; E212-A216 PolarHBondContact O-N 2.5Å; E212-K269 IonicContact OE1-NZ 2.81Å
213	L	92.9	Very high	90.8	Very high	9 Å²	9	68.5 Å²	68.5	5%	0.047	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-38.2	-167.8	-173.9	60.3	0	0	0	114.6	S215 V219 A245 M262 V264 K269 V271	L213-S215 VanDerWaalsContact C-N 3.32Å; L213-V219 HydrophobicContact CD1-CB 4.45Å; L213-V219 HydrophobicContact CD1-CG1 3.62Å; L213-V219 HydrophobicContact CD1-CG2 3.94Å; L213-A245 HydrophobicContact CB-CB 4.4Å; L213-A245 HydrophobicContact CD1-CB 3.85Å; L213-M262 WeakPolarHBondContact CD2-O 3.5Å; L213-V264 HydrophobicContact CD1-CG2 4.47Å; L213-V264 HydrophobicContact CD2-CG2 3.86Å; L213-V264 HydrophobicContact CG-CG2 4.45Å; L213-K269 HydrophobicContact CB-CD 4.2Å; L213-K269 HydrophobicContact CD2-CB 4.42Å; L213-K269 HydrophobicContact CD2-CD 3.87Å; L213-K269 HydrophobicContact CG-CD 4.37Å; L213-V271 HydrophobicContact CD1-CG1 4.45Å; L213-V271 HydrophobicContact CG-CG1 3.98Å; L213-V271 VanDerWaalsContact O-CG1 3.31Å; L213-V271 WeakPolarHBondContact O-CG1 3.26Å
214	T	90.7	Very high	91	Very high	66 Å²	66	70.4 Å²	70.4	41%	0.405	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-15.1	-179.6	63.4	0	0	0	0	114.3	E212 K269	E212-T214 VanDerWaalsContact CD-N 3.29Å; E212-T214 VanDerWaalsContact CD-OG1 3.23Å; E212-T214 PolarHBondContact O-N 3.12Å; E212-T214 PolarHBondContact OE1-N 3.12Å; E212-T214 PolarHBondContact OE1-OG1 2.78Å; E212-T214 WeakPolarHBondContact OE2-CA 3.14Å; E212-T214 WeakPolarHBondContact OE2-CB 3.15Å; E212-T214 PolarHBondContact OE2-N 3.28Å; E212-T214 PolarHBondContact OE2-OG1 3.19Å; T214-K269 HydrophobicContact CG2-CB 3.9Å; T214-K269 HydrophobicContact CG2-CD 3.95Å; T214-K269 HydrophobicContact CG2-CG 3.79Å
215	S	87.4	Confident	91.3	Very high	68 Å²	68	64 Å²	64	48%	0.476	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-4.5	-178.4	55.5	0	0	0	0	114.3	E212 L213	E212-S215 PolarHBondContact O-N 2.58Å; E212-S215 VanDerWaalsContact O-N 3.12Å; E212-S215 PolarHBondContact O-OG 3.23Å; E212-S215 PolarHBondContact OE2-N 3.27Å; E212-S215 VanDerWaalsContact OE2-N 3.12Å; E212-S215 PolarHBondContact OE2-OG 2.98Å; L213-S215 VanDerWaalsContact C-N 3.32Å
216	A	94.5	Very high	91.9	Very high	11 Å²	11	58.5 Å²	58.5	9%	0.091	30%	0.304	C	S	.	.			trans	-69.7	138.4	-179.4	0	0	0	0	0	112.6	P211 E212 V218 V219 A245	P211-A216 HydrophobicContact CB-CB 4.06Å; E212-A216 WeakPolarHBondContact O-CB 3.39Å; E212-A216 PolarHBondContact O-N 2.5Å; A216-V218 VanDerWaalsContact C-N 3.35Å; A216-V218 WeakPolarHBondContact CB-O 3.17Å; A216-V219 HydrophobicContact CB-CG2 4.27Å; A216-A245 HydrophobicContact CB-CB 3.44Å; A216-A245 VanDerWaalsContact CB-CB 3.44Å
217	K	95.9	Very high	92.8	Very high	142 Å²	142	61.9 Å²	61.9	62%	0.617	31%	0.312	S	S	*	.	S	Bend	trans	-73.7	-28	173.8	-66.3	-170.8	177.2	-170.5	0	113.1	P273 E274 L275	K217-P273 VanDerWaalsContact O-CB 3.24Å; K217-P273 WeakPolarHBondContact O-CB 3.27Å; K217-E274 HydrophobicContact CB-CG 4.29Å; K217-E274 WeakPolarHBondContact O-CA 3.35Å; K217-E274 WeakPolarHBondContact O-CB 3.37Å; K217-E274 PolarHBondContact O-N 3.43Å; K217-L275 PolarHBondContact O-N 3.17Å
218	V	98.3	Very high	93.6	Very high	23 Å²	23	53.6 Å²	53.6	14%	0.139	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.4	176.5	-174.1	0	0	0	0	108.4	A216 L242 A244 A245 L275	A216-V218 VanDerWaalsContact C-N 3.35Å; A216-V218 WeakPolarHBondContact CB-O 3.17Å; V218-L242 HydrophobicContact CG1-CB 4.18Å; V218-L242 HydrophobicContact CG1-CD1 4.17Å; V218-A244 HydrophobicContact CB-CB 3.68Å; V218-A244 HydrophobicContact CG1-CB 3.62Å; V218-A244 VanDerWaalsContact O-CA 3.28Å; V218-A244 WeakPolarHBondContact O-CA 3.1Å; V218-A244 VanDerWaalsContact O-CB 3.32Å; V218-A244 WeakPolarHBondContact O-CB 3.41Å; V218-A245 PolarHBondContact O-N 3Å; V218-L275 CarbonylContact C-O 3.59Å; V218-L275 VanDerWaalsContact CA-O 3.32Å; V218-L275 WeakPolarHBondContact CA-O 3.17Å; V218-L275 HydrophobicContact CG1-CB 4.09Å; V218-L275 HydrophobicContact CG1-CD2 3.99Å; V218-L275 HydrophobicContact CG1-CG 4.11Å; V218-L275 HydrophobicContact CG2-CB 4.23Å
219	V	98.6	Very high	94.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.9	174.5	177.3	0	0	0	0	109.2	L213 A216 A245 P273 L275 Y276 I277	L213-V219 HydrophobicContact CD1-CB 4.45Å; L213-V219 HydrophobicContact CD1-CG1 3.62Å; L213-V219 HydrophobicContact CD1-CG2 3.94Å; A216-V219 HydrophobicContact CB-CG2 4.27Å; V219-A245 WeakPolarHBondContact CA-O 3.32Å; V219-P273 HydrophobicContact CB-CG 4.14Å; V219-P273 HydrophobicContact CG2-CB 4.02Å; V219-P273 HydrophobicContact CG2-CG 3.88Å; V219-L275 PolarHBondContact N-O 3.08Å; V219-Y276 HydrophobicContact CB-CD2 3.85Å; V219-Y276 HydrophobicContact CB-CE2 4.12Å; V219-Y276 HydrophobicContact CG1-CD2 3.94Å; V219-Y276 HydrophobicContact CG1-CE2 3.67Å; V219-Y276 CarbonylContact O-C 3.55Å; V219-Y276 WeakPolarHBondContact O-CA 3.48Å; V219-I277 PolarHBondContact O-N 3.37Å
220	V	98.6	Very high	95	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121	169	-177.3	0	0	0	0	107.6	L235 L238 A239 L242 A244 A245 V246 G247 I277	V220-L235 HydrophobicContact CG1-CB 3.93Å; V220-L235 HydrophobicContact CG1-CD2 3.84Å; V220-L235 HydrophobicContact CG1-CG 4.29Å; V220-L238 HydrophobicContact CG1-CD2 3.95Å; V220-L238 HydrophobicContact CG1-CG 4.45Å; V220-L238 HydrophobicContact CG2-CD2 4.28Å; V220-L238 HydrophobicContact CG2-CG 4.17Å; V220-A239 HydrophobicContact CB-CB 4.37Å; V220-A239 HydrophobicContact CG2-CB 4.17Å; V220-L242 HydrophobicContact CG2-CD1 4.31Å; V220-A244 HydrophobicContact CG2-CB 3.96Å; V220-A245 PolarHBondContact N-O 3.36Å; V220-V246 CarbonylContact O-C 3.56Å; V220-V246 VanDerWaalsContact O-CA 3.24Å; V220-V246 WeakPolarHBondContact O-CA 3.26Å; V220-G247 PolarHBondContact O-N 2.82Å; V220-I277 HydrophobicContact CG2-CD1 4.24Å
221	S	98.6	Very high	95.5	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.5	-173.6	-166.4	0	0	0	0	114	G247 A248 Y276 I277 V279 I281	S221-G247 WeakPolarHBondContact CA-O 3.33Å; S221-G247 PolarHBondContact OG-O 2.8Å; S221-G247 VanDerWaalsContact OG-O 3.12Å; S221-A248 WeakPolarHBondContact OG-CA 3.35Å; S221-A248 PolarHBondContact OG-N 2.92Å; S221-Y276 VanDerWaalsContact CB-CZ 3.46Å; S221-Y276 WeakPolarHBondContact CB-OH 3.39Å; S221-Y276 PolarHBondContact OG-OH 3.09Å; S221-Y276 VanDerWaalsContact OG-OH 3.08Å; S221-I277 PolarHBondContact N-O 3.37Å; S221-V279 PolarHBondContact O-N 3.18Å; S221-I281 WeakPolarHBondContact O-CD1 3.45Å; S221-I281 WeakPolarHBondContact OG-CD1 3.14Å
222	G	98.4	Very high	95.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	140.8	-179.3	0	0	0	0	0	114.4	G247 A248 S249	G222-G247 PolarHBondContact N-O 3.19Å; G222-A248 VanDerWaalsContact O-CA 3.26Å; G222-A248 WeakPolarHBondContact O-CA 3.49Å; G222-S249 PolarHBondContact O-N 2.71Å
223	G	97.3	Very high	96.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.258	C	S	.	.			trans	-110.9	-169.6	173.5	0	0	0	0	0	114.3	G225 L226 S249 V279 G280 I281	G223-G225 PolarHBondContact O-N 3.48Å; G223-G225 VanDerWaalsContact O-N 3.1Å; G223-L226 PolarHBondContact O-N 3.36Å; G223-S249 WeakPolarHBondContact CA-OG 3.47Å; G223-V279 PolarHBondContact N-O 3.07Å; G223-G280 CarbonylContact C-O 3.59Å; G223-G280 WeakPolarHBondContact CA-O 3.36Å; G223-I281 VanDerWaalsContact CA-CG1 3.48Å
224	R	95.6	Very high	96.5	Very high	161 Å²	161	51.6 Å²	51.6	61%	0.608	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-58.3	-22.1	173.7	-177.9	173.4	-80.1	-148.1	-2.2	112.6	L226 K227 A251	R224-L226 PolarHBondContact O-N 3.01Å; R224-L226 VanDerWaalsContact O-N 3.09Å; R224-K227 PolarHBondContact O-N 3.49Å; R224-K227 VanDerWaalsContact O-N 3.07Å; R224-A251 HydrophobicContact CB-CB 4.06Å
225	G	95.9	Very high	96.9	Very high	28 Å²	28	48.6 Å²	48.6	29%	0.289	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-55.9	-22.8	175.5	0	0	0	0	0	114.5	G223 K227 G280	G223-G225 PolarHBondContact O-N 3.48Å; G223-G225 VanDerWaalsContact O-N 3.1Å; G225-K227 VanDerWaalsContact C-N 3.26Å; G225-K227 PolarHBondContact O-N 2.85Å; G225-G280 PolarHBondContact N-O 3.21Å; G225-G280 VanDerWaalsContact N-O 3.15Å
226	L	97.7	Very high	97.3	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-72.3	-15.3	177.8	-87.1	67.4	0	0	0	114	G223 R224 S228 N231 F232 L235 V279 L320	G223-L226 PolarHBondContact O-N 3.36Å; R224-L226 PolarHBondContact O-N 3.01Å; R224-L226 VanDerWaalsContact O-N 3.09Å; L226-S228 PolarHBondContact O-N 3.23Å; L226-N231 HydrophobicContact CB-CB 4.41Å; L226-N231 VanDerWaalsContact O-CB 3.26Å; L226-N231 WeakPolarHBondContact O-CB 3.42Å; L226-N231 PolarHBondContact O-ND2 3.33Å; L226-F232 HydrophobicContact CB-CD2 4.33Å; L226-F232 HydrophobicContact CB-CE2 4.19Å; L226-F232 HydrophobicContact CD2-CB 4.34Å; L226-F232 HydrophobicContact CD2-CD1 4.1Å; L226-F232 HydrophobicContact CD2-CD2 3.31Å; L226-F232 HydrophobicContact CD2-CE1 4.21Å; L226-F232 HydrophobicContact CD2-CE2 3.43Å; L226-F232 VanDerWaalsContact CD2-CE2 3.43Å; L226-F232 HydrophobicContact CD2-CG 3.66Å; L226-F232 HydrophobicContact CD2-CZ 3.9Å; L226-F232 HydrophobicContact CG-CD2 4.46Å; L226-F232 HydrophobicContact CG-CE2 4.41Å; L226-L235 HydrophobicContact CD1-CD1 4.38Å; L226-L235 HydrophobicContact CD2-CD1 3.54Å; L226-L235 HydrophobicContact CD2-CG 3.88Å; L226-V279 HydrophobicContact CD1-CG1 4.21Å; L226-L320 HydrophobicContact CD1-CD1 4.28Å; L226-L320 HydrophobicContact CD1-CD2 4.2Å; L226-L320 HydrophobicContact CG-CD1 4.45Å
227	K	97.1	Very high	97.5	Very high	147 Å²	147	50.4 Å²	50.4	64%	0.639	25%	0.245	S	C	*	.			trans	63.9	-27.3	176.2	-53.7	175.8	-177.8	168.9	0	117.2	R224 G225 F257 F321	R224-K227 PolarHBondContact O-N 3.49Å; R224-K227 VanDerWaalsContact O-N 3.07Å; G225-K227 VanDerWaalsContact C-N 3.26Å; G225-K227 PolarHBondContact O-N 2.85Å; K227-F257 VanDerWaalsContact O-CZ 3.23Å; K227-F257 WeakPolarHBondContact O-CZ 3.28Å; K227-F321 HydrophobicContact CD-CE2 4.06Å; K227-F321 HydrophobicContact CD-CZ 4.13Å; K227-F321 HydrophobicContact CG-CZ 4.34Å
228	S	97.2	Very high	97.5	Very high	32 Å²	32	43.7 Å²	43.7	22%	0.224	22%	0.216	C	C	.	.	S	Bend	trans	-151.8	163.1	177.7	71	0	0	0	0	111.9	L226 E230 N231	L226-S228 PolarHBondContact O-N 3.23Å; S228-E230 VanDerWaalsContact C-N 3.34Å; S228-N231 PolarHBondContact O-N 3.3Å; S228-N231 PolarHBondContact OG-N 3.04Å; S228-N231 PolarHBondContact OG-ND2 2.81Å
229	G	96.4	Very high	97.5	Very high	30 Å²	30	42.6 Å²	42.6	31%	0.309	21%	0.21	S	C	.	.	S	Bend	trans	-66.7	-31.9	172	0	0	0	0	0	113.4	N231 F232	G229-N231 VanDerWaalsContact C-N 3.25Å; G229-N231 PolarHBondContact O-N 3.18Å; G229-F232 WeakPolarHBondContact O-CB 3.46Å; G229-F232 PolarHBondContact O-N 3.01Å; G229-F232 VanDerWaalsContact O-N 3.09Å
230	E	97.5	Very high	97.3	Very high	167 Å²	167	46.9 Å²	46.9	78%	0.78	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-60	-38.1	176.9	-65	177.7	172.9	0	0	111.8	S228 F232 K233	S228-E230 VanDerWaalsContact C-N 3.34Å; E230-F232 PolarHBondContact O-N 3.17Å; E230-K233 VanDerWaalsContact O-CB 3.29Å; E230-K233 WeakPolarHBondContact O-CB 3.33Å; E230-K233 PolarHBondContact O-N 3.12Å; E230-K233 VanDerWaalsContact O-N 3.12Å
231	N	98.1	Very high	97.2	Very high	48 Å²	48	52.3 Å²	52.3	26%	0.257	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-71.2	-12.9	179.8	-69.2	-27.2	0	0	0	113.6	L226 S228 G229 K233 L234 F321	L226-N231 HydrophobicContact CB-CB 4.41Å; L226-N231 VanDerWaalsContact O-CB 3.26Å; L226-N231 WeakPolarHBondContact O-CB 3.42Å; L226-N231 PolarHBondContact O-ND2 3.33Å; S228-N231 PolarHBondContact O-N 3.3Å; S228-N231 PolarHBondContact OG-N 3.04Å; S228-N231 PolarHBondContact OG-ND2 2.81Å; G229-N231 VanDerWaalsContact C-N 3.25Å; G229-N231 PolarHBondContact O-N 3.18Å; N231-K233 PolarHBondContact O-N 3.1Å; N231-L234 WeakPolarHBondContact O-CB 3.41Å; N231-L234 WeakPolarHBondContact O-CG 3.47Å; N231-L234 PolarHBondContact O-N 2.82Å; N231-L234 VanDerWaalsContact O-N 3.15Å; N231-F321 HydrophobicContact CB-CE1 4Å; N231-F321 WeakPolarHBondContact ND2-CE1 3.21Å
232	F	97.6	Very high	97.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-62.6	-18.1	169.6	-94.5	-103.2	0	0	0	112.3	L226 G229 E230 L234 L235 Y236 V246 A248 A252 F257 V258	L226-F232 HydrophobicContact CB-CD2 4.33Å; L226-F232 HydrophobicContact CB-CE2 4.19Å; L226-F232 HydrophobicContact CD2-CB 4.34Å; L226-F232 HydrophobicContact CD2-CD1 4.1Å; L226-F232 HydrophobicContact CD2-CD2 3.31Å; L226-F232 HydrophobicContact CD2-CE1 4.21Å; L226-F232 HydrophobicContact CD2-CE2 3.43Å; L226-F232 VanDerWaalsContact CD2-CE2 3.43Å; L226-F232 HydrophobicContact CD2-CG 3.66Å; L226-F232 HydrophobicContact CD2-CZ 3.9Å; L226-F232 HydrophobicContact CG-CD2 4.46Å; L226-F232 HydrophobicContact CG-CE2 4.41Å; G229-F232 WeakPolarHBondContact O-CB 3.46Å; G229-F232 PolarHBondContact O-N 3.01Å; G229-F232 VanDerWaalsContact O-N 3.09Å; E230-F232 PolarHBondContact O-N 3.17Å; F232-L234 PolarHBondContact O-N 3.01Å; F232-L234 VanDerWaalsContact O-N 3.16Å; F232-L235 HydrophobicContact CD1-CD1 4.05Å; F232-L235 HydrophobicContact CE1-CD1 4.03Å; F232-L235 PolarHBondContact O-N 3.22Å; F232-Y236 HydrophobicContact CB-CD2 4.49Å; F232-Y236 HydrophobicContact CB-CE2 3.82Å; F232-Y236 WeakPolarHBondContact O-CD2 3.32Å; F232-Y236 PolarHBondContact O-N 2.99Å; F232-V246 HydrophobicContact CD1-CG1 4.3Å; F232-V246 HydrophobicContact CE1-CG1 4.47Å; F232-A248 HydrophobicContact CE1-CB 4.19Å; F232-A248 HydrophobicContact CZ-CB 4.1Å; F232-A252 HydrophobicContact CE2-CB 4.21Å; F232-A252 HydrophobicContact CZ-CB 3.99Å; F232-F257 HydrophobicContact CD2-CB 3.92Å; F232-F257 HydrophobicContact CE2-CB 3.59Å; F232-F257 AromaticContact CE2-CD2 3.96Å; F232-F257 HydrophobicContact CE2-CD2 3.96Å; F232-F257 HydrophobicContact CE2-CG 4.24Å; F232-F257 HydrophobicContact CZ-CB 4.49Å; F232-V258 HydrophobicContact CD1-CG1 3.49Å; F232-V258 VanDerWaalsContact CD1-CG1 3.49Å; F232-V258 HydrophobicContact CD2-CG1 4.11Å; F232-V258 HydrophobicContact CE1-CG1 3.5Å; F232-V258 HydrophobicContact CE1-CG2 4.31Å; F232-V258 HydrophobicContact CE2-CG1 4.13Å; F232-V258 HydrophobicContact CG-CG1 3.8Å; F232-V258 HydrophobicContact CZ-CG1 3.84Å; F232-V258 HydrophobicContact CZ-CG2 4.12Å
233	K	97.6	Very high	96.9	Very high	121 Å²	121	60.3 Å²	60.3	53%	0.526	30%	0.299	S	S	.	.	H	α-helix	trans	-51.4	-37	170.6	-166.8	-169.5	179.4	-51.4	0	112.6	E230 N231 L235 Y236 D237	E230-K233 VanDerWaalsContact O-CB 3.29Å; E230-K233 WeakPolarHBondContact O-CB 3.33Å; E230-K233 PolarHBondContact O-N 3.12Å; E230-K233 VanDerWaalsContact O-N 3.12Å; N231-K233 PolarHBondContact O-N 3.1Å; K233-L235 VanDerWaalsContact C-N 3.26Å; K233-L235 PolarHBondContact O-N 2.61Å; K233-Y236 PolarHBondContact O-N 3.23Å; K233-D237 IonicContact NZ-OD1 2.75Å; K233-D237 PolarHBondContact NZ-OD1 2.85Å; K233-D237 IonicContact NZ-OD2 2.69Å; K233-D237 PolarHBondContact NZ-OD2 3.05Å; K233-D237 PolarHBondContact O-N 2.94Å
234	L	97.9	Very high	96.9	Very high	39 Å²	39	60.4 Å²	60.4	20%	0.204	30%	0.299	C	S	.	.	H	α-helix	trans	-59.7	-38.4	177	-60	177.6	0	0	0	112.3	N231 F232 L238 F321 V324 P325	N231-L234 WeakPolarHBondContact O-CB 3.41Å; N231-L234 WeakPolarHBondContact O-CG 3.47Å; N231-L234 PolarHBondContact O-N 2.82Å; N231-L234 VanDerWaalsContact O-N 3.15Å; F232-L234 PolarHBondContact O-N 3.01Å; F232-L234 VanDerWaalsContact O-N 3.16Å; L234-L238 PolarHBondContact O-N 3.17Å; L234-F321 HydrophobicContact CD1-CD1 3.82Å; L234-F321 HydrophobicContact CD1-CE1 4.26Å; L234-V324 HydrophobicContact CB-CG1 4.01Å; L234-P325 HydrophobicContact CD2-CG 4.14Å
235	L	98.1	Very high	97	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-78.1	-34.5	178.5	-55	-171.7	0	0	0	111.9	V220 L226 F232 K233 L238 A239 V246 V279 V324	V220-L235 HydrophobicContact CG1-CB 3.93Å; V220-L235 HydrophobicContact CG1-CD2 3.84Å; V220-L235 HydrophobicContact CG1-CG 4.29Å; L226-L235 HydrophobicContact CD1-CD1 4.38Å; L226-L235 HydrophobicContact CD2-CD1 3.54Å; L226-L235 HydrophobicContact CD2-CG 3.88Å; F232-L235 HydrophobicContact CD1-CD1 4.05Å; F232-L235 HydrophobicContact CE1-CD1 4.03Å; F232-L235 PolarHBondContact O-N 3.22Å; K233-L235 VanDerWaalsContact C-N 3.26Å; K233-L235 PolarHBondContact O-N 2.61Å; L235-L238 PolarHBondContact O-N 3.38Å; L235-A239 WeakPolarHBondContact O-CB 3.4Å; L235-A239 PolarHBondContact O-N 3.43Å; L235-V246 HydrophobicContact CB-CG1 4.32Å; L235-V279 HydrophobicContact CD2-CB 3.85Å; L235-V279 HydrophobicContact CD2-CG1 3.99Å; L235-V279 HydrophobicContact CD2-CG2 3.76Å; L235-V324 HydrophobicContact CD2-CG1 4.42Å; L235-V324 HydrophobicContact CD2-CG2 4.5Å
236	Y	97.3	Very high	97.1	Very high	60 Å²	60	52 Å²	52	24%	0.235	26%	0.26	C	S	.	.	H	α-helix	trans	-60.9	-48.4	172.4	-63	-37.6	0	0	0	110.9	F232 K233 L238 A239 D240 V246 M262	F232-Y236 HydrophobicContact CB-CD2 4.49Å; F232-Y236 HydrophobicContact CB-CE2 3.82Å; F232-Y236 WeakPolarHBondContact O-CD2 3.32Å; F232-Y236 PolarHBondContact O-N 2.99Å; K233-Y236 PolarHBondContact O-N 3.23Å; Y236-L238 VanDerWaalsContact C-N 3.34Å; Y236-L238 PolarHBondContact O-N 2.83Å; Y236-A239 PolarHBondContact O-N 2.78Å; Y236-D240 PolarHBondContact O-N 2.91Å; Y236-V246 HydrophobicContact CD1-CB 4.17Å; Y236-V246 HydrophobicContact CD1-CG1 4.2Å; Y236-V246 HydrophobicContact CD1-CG2 3.75Å; Y236-V246 HydrophobicContact CE1-CB 4.02Å; Y236-V246 HydrophobicContact CE1-CG1 3.86Å; Y236-V246 HydrophobicContact CE1-CG2 4.13Å; Y236-M262 HydrophobicContact CE1-CE 4.15Å
237	D	96.9	Very high	97.1	Very high	58 Å²	58	51.9 Å²	51.9	31%	0.31	26%	0.26	S	S	.	.	H	α-helix	trans	-61.4	-42.1	178.8	-64	-18.6	0	0	0	111.6	K233 K241 T328	K233-D237 IonicContact NZ-OD1 2.75Å; K233-D237 PolarHBondContact NZ-OD1 2.85Å; K233-D237 IonicContact NZ-OD2 2.69Å; K233-D237 PolarHBondContact NZ-OD2 3.05Å; K233-D237 PolarHBondContact O-N 2.94Å; D237-K241 PolarHBondContact O-N 3.17Å; D237-T328 HydrophobicContact CB-CG2 4.48Å
238	L	97.7	Very high	97.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.5	-43.3	174.9	177.6	58.5	0	0	0	111.8	V220 L234 L235 Y236 D240 K241 L242 I277 V324 M327 L331	V220-L238 HydrophobicContact CG1-CD2 3.95Å; V220-L238 HydrophobicContact CG1-CG 4.45Å; V220-L238 HydrophobicContact CG2-CD2 4.28Å; V220-L238 HydrophobicContact CG2-CG 4.17Å; L234-L238 PolarHBondContact O-N 3.17Å; L235-L238 PolarHBondContact O-N 3.38Å; Y236-L238 VanDerWaalsContact C-N 3.34Å; Y236-L238 PolarHBondContact O-N 2.83Å; L238-D240 VanDerWaalsContact C-N 3.31Å; L238-D240 PolarHBondContact O-N 3.48Å; L238-K241 PolarHBondContact O-N 3.05Å; L238-L242 HydrophobicContact CD1-CD1 3.95Å; L238-L242 HydrophobicContact CD1-CG 4.48Å; L238-L242 HydrophobicContact CG-CD1 4.17Å; L238-L242 PolarHBondContact O-N 2.73Å; L238-I277 HydrophobicContact CD2-CD1 4.43Å; L238-V324 HydrophobicContact CB-CG1 4.3Å; L238-V324 HydrophobicContact CD2-CG1 4.15Å; L238-M327 HydrophobicContact CD1-CG 4.17Å; L238-M327 HydrophobicContact CD1-SD 4.27Å; L238-M327 HydrophobicContact CD2-SD 4.18Å; L238-L331 HydrophobicContact CD1-CD1 3.64Å
239	A	97.3	Very high	97.2	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.008	22%	0.223	C	C	.	.	H	α-helix	trans	-64	-38.1	-179.7	0	0	0	0	0	111.8	V220 L235 Y236 K241 L242 N243 A244 V246	V220-A239 HydrophobicContact CB-CB 4.37Å; V220-A239 HydrophobicContact CG2-CB 4.17Å; L235-A239 WeakPolarHBondContact O-CB 3.4Å; L235-A239 PolarHBondContact O-N 3.43Å; Y236-A239 PolarHBondContact O-N 2.78Å; A239-K241 VanDerWaalsContact C-N 3.27Å; A239-K241 PolarHBondContact O-N 2.83Å; A239-L242 CarbonylContact O-C 3.6Å; A239-L242 PolarHBondContact O-N 2.76Å; A239-L242 VanDerWaalsContact O-N 3.09Å; A239-N243 WeakPolarHBondContact O-CA 3.32Å; A239-N243 PolarHBondContact O-N 2.91Å; A239-A244 HydrophobicContact CB-CB 3.95Å; A239-A244 PolarHBondContact O-N 3.08Å; A239-V246 HydrophobicContact CB-CG2 3.42Å; A239-V246 VanDerWaalsContact CB-CG2 3.42Å
240	D	95.6	Very high	97.3	Very high	89 Å²	89	49.2 Å²	49.2	48%	0.476	23%	0.233	S	C	.	.	H	α-helix	trans	-64	-34.6	178.6	-64.5	-12.9	0	0	0	111.4	R210 Y236 L238 L242	R210-D240 IonicContact CZ-OD1 3.3Å; R210-D240 VanDerWaalsContact CZ-OD1 3.23Å; R210-D240 IonicContact NE-OD1 2.61Å; R210-D240 PolarHBondContact NE-OD1 2.97Å; R210-D240 VanDerWaalsContact NH2-CG 3.31Å; R210-D240 IonicContact NH2-OD1 3.87Å; R210-D240 PolarHBondContact NH2-OD1 3.02Å; R210-D240 IonicContact NH2-OD2 3.83Å; R210-D240 PolarHBondContact NH2-OD2 2.97Å; Y236-D240 PolarHBondContact O-N 2.91Å; L238-D240 VanDerWaalsContact C-N 3.31Å; L238-D240 PolarHBondContact O-N 3.48Å; D240-L242 VanDerWaalsContact C-N 3.32Å; D240-L242 PolarHBondContact O-N 2.78Å
241	K	96.1	Very high	97.3	Very high	114 Å²	114	42.9 Å²	42.9	50%	0.496	21%	0.21	S	C	.	.	H	α-helix	trans	-68.2	-30.8	173.9	-66.2	-68.2	173.3	167.1	0	113.6	D237 L238 A239 T328 L331 S332	D237-K241 PolarHBondContact O-N 3.17Å; L238-K241 PolarHBondContact O-N 3.05Å; A239-K241 VanDerWaalsContact C-N 3.27Å; A239-K241 PolarHBondContact O-N 2.83Å; K241-T328 HydrophobicContact CG-CG2 3.94Å; K241-L331 HydrophobicContact CB-CB 4.45Å; K241-S332 VanDerWaalsContact CE-OG 3.24Å; K241-S332 WeakPolarHBondContact CE-OG 3.42Å; K241-S332 PolarHBondContact NZ-OG 3.48Å
242	L	95.7	Very high	97.2	Very high	43 Å²	43	40.6 Å²	40.6	23%	0.225	20%	0.197	C	C	.	.	H	α-helix	trans	-98.1	-1.4	-176.7	-66.1	173.4	0	0	0	113.1	V218 V220 L238 A239 D240 A244 I277 L331	V218-L242 HydrophobicContact CG1-CB 4.18Å; V218-L242 HydrophobicContact CG1-CD1 4.17Å; V220-L242 HydrophobicContact CG2-CD1 4.31Å; L238-L242 HydrophobicContact CD1-CD1 3.95Å; L238-L242 HydrophobicContact CD1-CG 4.48Å; L238-L242 HydrophobicContact CG-CD1 4.17Å; L238-L242 PolarHBondContact O-N 2.73Å; A239-L242 CarbonylContact O-C 3.6Å; A239-L242 PolarHBondContact O-N 2.76Å; A239-L242 VanDerWaalsContact O-N 3.09Å; D240-L242 VanDerWaalsContact C-N 3.32Å; D240-L242 PolarHBondContact O-N 2.78Å; L242-A244 HydrophobicContact CB-CB 4.01Å; L242-A244 PolarHBondContact O-N 2.83Å; L242-I277 HydrophobicContact CD1-CD1 3.69Å; L242-L331 HydrophobicContact CD1-CD1 4.26Å; L242-L331 HydrophobicContact CD2-CD1 3.71Å; L242-L331 HydrophobicContact CD2-CD2 4.16Å; L242-L331 HydrophobicContact CG-CD1 3.95Å
243	N	95	Very high	97.2	Very high	125 Å²	125	41.7 Å²	41.7	67%	0.668	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.5	46.9	-165.5	-171.9	34.4	0	0	0	111.4	A239	A239-N243 WeakPolarHBondContact O-CA 3.32Å; A239-N243 PolarHBondContact O-N 2.91Å
244	A	97.1	Very high	97.1	Very high	2 Å²	2	40.8 Å²	40.8	2%	0.017	21%	0.205	C	C	.	.			trans	-98	154.8	-174.7	0	0	0	0	0	111.8	V218 V220 A239 L242	V218-A244 HydrophobicContact CB-CB 3.68Å; V218-A244 HydrophobicContact CG1-CB 3.62Å; V218-A244 VanDerWaalsContact O-CA 3.28Å; V218-A244 WeakPolarHBondContact O-CA 3.1Å; V218-A244 VanDerWaalsContact O-CB 3.32Å; V218-A244 WeakPolarHBondContact O-CB 3.41Å; V220-A244 HydrophobicContact CG2-CB 3.96Å; A239-A244 HydrophobicContact CB-CB 3.95Å; A239-A244 PolarHBondContact O-N 3.08Å; L242-A244 HydrophobicContact CB-CB 4.01Å; L242-A244 PolarHBondContact O-N 2.83Å
245	A	97.5	Very high	97	Very high	1 Å²	1	41 Å²	41	1%	0.008	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	157.6	160.9	0	0	0	0	0	110.4	P211 L213 A216 V218 V219 V220	P211-A245 VanDerWaalsContact O-CB 3.3Å; P211-A245 WeakPolarHBondContact O-CB 3.49Å; L213-A245 HydrophobicContact CB-CB 4.4Å; L213-A245 HydrophobicContact CD1-CB 3.85Å; A216-A245 HydrophobicContact CB-CB 3.44Å; A216-A245 VanDerWaalsContact CB-CB 3.44Å; V218-A245 PolarHBondContact O-N 3Å; V219-A245 WeakPolarHBondContact CA-O 3.32Å; V220-A245 PolarHBondContact N-O 3.36Å
246	V	98	Very high	97	Very high	11 Å²	11	44 Å²	44	7%	0.067	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.5	172.2	-176.5	0	0	0	0	110.3	V220 F232 L235 Y236 A239 M262	V220-V246 CarbonylContact O-C 3.56Å; V220-V246 VanDerWaalsContact O-CA 3.24Å; V220-V246 WeakPolarHBondContact O-CA 3.26Å; F232-V246 HydrophobicContact CD1-CG1 4.3Å; F232-V246 HydrophobicContact CE1-CG1 4.47Å; L235-V246 HydrophobicContact CB-CG1 4.32Å; Y236-V246 HydrophobicContact CD1-CB 4.17Å; Y236-V246 HydrophobicContact CD1-CG1 4.2Å; Y236-V246 HydrophobicContact CD1-CG2 3.75Å; Y236-V246 HydrophobicContact CE1-CB 4.02Å; Y236-V246 HydrophobicContact CE1-CG1 3.86Å; Y236-V246 HydrophobicContact CE1-CG2 4.13Å; A239-V246 HydrophobicContact CB-CG2 3.42Å; A239-V246 VanDerWaalsContact CB-CG2 3.42Å; V246-M262 HydrophobicContact CB-CE 3.77Å; V246-M262 HydrophobicContact CG1-CE 3.45Å; V246-M262 VanDerWaalsContact CG1-CE 3.45Å; V246-M262 WeakPolarHBondContact O-CE 3.44Å
247	G	98.1	Very high	97	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	176.4	175.4	0	0	0	0	0	112.1	V220 S221 G222 M262	V220-G247 PolarHBondContact O-N 2.82Å; S221-G247 WeakPolarHBondContact CA-O 3.33Å; S221-G247 PolarHBondContact OG-O 2.8Å; S221-G247 VanDerWaalsContact OG-O 3.12Å; G222-G247 PolarHBondContact N-O 3.19Å; G247-M262 CarbonylContact C-O 3.55Å; G247-M262 VanDerWaalsContact CA-O 3.3Å; G247-M262 WeakPolarHBondContact CA-O 3.43Å
248	A	98.3	Very high	97	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	157.5	175.8	0	0	0	0	0	113.7	S221 G222 F232 A252 V258 M262 Q263 V264	S221-A248 WeakPolarHBondContact OG-CA 3.35Å; S221-A248 PolarHBondContact OG-N 2.92Å; G222-A248 VanDerWaalsContact O-CA 3.26Å; G222-A248 WeakPolarHBondContact O-CA 3.49Å; F232-A248 HydrophobicContact CE1-CB 4.19Å; F232-A248 HydrophobicContact CZ-CB 4.1Å; A248-A252 HydrophobicContact CB-CB 4.21Å; A248-V258 HydrophobicContact CB-CG2 3.42Å; A248-V258 VanDerWaalsContact CB-CG2 3.42Å; A248-M262 HydrophobicContact CB-CB 4.46Å; A248-M262 PolarHBondContact N-O 2.93Å; A248-Q263 CarbonylContact O-C 3.57Å; A248-Q263 WeakPolarHBondContact O-CA 3.09Å; A248-V264 PolarHBondContact O-N 2.82Å
249	S	98.2	Very high	96.8	Very high	11 Å²	11	43.4 Å²	43.4	8%	0.077	25%	0.246	C	C	.	.			trans	-75.6	157.1	166.5	74.4	0	0	0	0	111.4	G222 G223 A251 A252 V253 H287	G222-S249 PolarHBondContact O-N 2.71Å; G223-S249 WeakPolarHBondContact CA-OG 3.47Å; S249-A251 PolarHBondContact O-N 3.26Å; S249-A251 VanDerWaalsContact O-N 3.17Å; S249-A251 PolarHBondContact OG-N 2.9Å; S249-A252 WeakPolarHBondContact O-CB 3.49Å; S249-A252 PolarHBondContact O-N 3.08Å; S249-V253 PolarHBondContact O-N 3.28Å; S249-H287 WeakPolarHBondContact CA-ND1 3.24Å; S249-H287 WeakPolarHBondContact CB-ND1 3.42Å
250	R	97.3	Very high	96.7	Very high	142 Å²	142	48 Å²	48	54%	0.536	27%	0.271	S	S	.	.	H	α-helix	trans	-51.8	-38.4	170.9	-175.7	179.9	175.5	166.6	5.1	112.7	A252 V253 D254 Q263	R250-A252 PolarHBondContact O-N 3.31Å; R250-V253 PolarHBondContact O-N 2.95Å; R250-V253 VanDerWaalsContact O-N 3.12Å; R250-D254 WeakPolarHBondContact CG-OD2 3.48Å; R250-D254 IonicContact NE-OD1 2.73Å; R250-D254 IonicContact NE-OD2 3.25Å; R250-D254 PolarHBondContact NE-OD2 3.01Å; R250-D254 WeakPolarHBondContact O-CB 3.26Å; R250-D254 PolarHBondContact O-N 3.13Å; R250-Q263 HydrophobicContact CB-CG 4.38Å
251	A	97	Very high	96.5	Very high	34 Å²	34	46.6 Å²	46.6	28%	0.281	26%	0.263	S	S	.	.	H	α-helix	trans	-64.4	-23.3	-178.6	0	0	0	0	0	113.9	R224 S249 A255	R224-A251 HydrophobicContact CB-CB 4.06Å; S249-A251 PolarHBondContact O-N 3.26Å; S249-A251 VanDerWaalsContact O-N 3.17Å; S249-A251 PolarHBondContact OG-N 2.9Å; A251-A255 WeakPolarHBondContact O-CB 3.39Å
252	A	97.5	Very high	96.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-82.6	-37.7	173.6	0	0	0	0	0	111.6	F232 A248 S249 R250 A255 G256 F257 V258	F232-A252 HydrophobicContact CE2-CB 4.21Å; F232-A252 HydrophobicContact CZ-CB 3.99Å; A248-A252 HydrophobicContact CB-CB 4.21Å; S249-A252 WeakPolarHBondContact O-CB 3.49Å; S249-A252 PolarHBondContact O-N 3.08Å; R250-A252 PolarHBondContact O-N 3.31Å; A252-A255 PolarHBondContact O-N 3.24Å; A252-G256 PolarHBondContact O-N 3.27Å; A252-F257 HydrophobicContact CB-CB 4.32Å; A252-F257 HydrophobicContact CB-CD2 3.84Å; A252-F257 HydrophobicContact CB-CG 4.47Å; A252-F257 WeakPolarHBondContact O-CB 3.37Å; A252-F257 PolarHBondContact O-N 2.96Å; A252-V258 HydrophobicContact CB-CG2 4.44Å
253	V	97.3	Very high	96.6	Very high	22 Å²	22	40.4 Å²	40.4	13%	0.133	24%	0.235	C	C	.	.	H	α-helix	trans	-63.6	-50.4	173.5	175.9	0	0	0	0	110.8	S249 R250 A255 G256 V258 N260 Q263	S249-V253 PolarHBondContact O-N 3.28Å; R250-V253 PolarHBondContact O-N 2.95Å; R250-V253 VanDerWaalsContact O-N 3.12Å; V253-A255 PolarHBondContact O-N 3.43Å; V253-A255 VanDerWaalsContact O-N 3.12Å; V253-G256 PolarHBondContact O-N 3.45Å; V253-V258 HydrophobicContact CG2-CG2 4.1Å; V253-N260 HydrophobicContact CG1-CB 3.95Å; V253-Q263 HydrophobicContact CG2-CB 4.06Å; V253-Q263 HydrophobicContact CG2-CG 4.31Å
254	D	96.2	Very high	96.8	Very high	103 Å²	103	34.5 Å²	34.5	55%	0.551	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.7	179.1	-68.8	-10.4	0	0	0	112	R250	R250-D254 WeakPolarHBondContact CG-OD2 3.48Å; R250-D254 IonicContact NE-OD1 2.73Å; R250-D254 IonicContact NE-OD2 3.25Å; R250-D254 PolarHBondContact NE-OD2 3.01Å; R250-D254 WeakPolarHBondContact O-CB 3.26Å; R250-D254 PolarHBondContact O-N 3.13Å
255	A	96	Very high	96.7	Very high	44 Å²	44	34.5 Å²	34.5	36%	0.364	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	1.4	175.8	0	0	0	0	0	113.7	A251 A252 V253 F257	A251-A255 WeakPolarHBondContact O-CB 3.39Å; A252-A255 PolarHBondContact O-N 3.24Å; V253-A255 PolarHBondContact O-N 3.43Å; V253-A255 VanDerWaalsContact O-N 3.12Å; A255-F257 VanDerWaalsContact C-N 3.34Å; A255-F257 HydrophobicContact CB-CD1 3.83Å; A255-F257 HydrophobicContact CB-CD2 4.3Å; A255-F257 HydrophobicContact CB-CE1 3.47Å; A255-F257 VanDerWaalsContact CB-CE1 3.47Å; A255-F257 HydrophobicContact CB-CE2 4.01Å; A255-F257 HydrophobicContact CB-CG 4.23Å; A255-F257 HydrophobicContact CB-CZ 3.57Å; A255-F257 WeakPolarHBondContact O-CD1 3.38Å; A255-F257 PolarHBondContact O-N 3.09Å
256	G	96.5	Very high	96.4	Very high	65 Å²	65	39.6 Å²	39.6	67%	0.67	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.4	19.5	179.5	0	0	0	0	0	114.6	A252 V253	A252-G256 PolarHBondContact O-N 3.27Å; V253-G256 PolarHBondContact O-N 3.45Å
257	F	97.8	Very high	96.1	Very high	35 Å²	35	43.3 Å²	43.3	15%	0.154	25%	0.251	C	S	.	.	S	Bend	trans	-75.6	-34.5	-178.3	-58.5	-12	0	0	0	112.1	K227 F232 A252 A255	K227-F257 VanDerWaalsContact O-CZ 3.23Å; K227-F257 WeakPolarHBondContact O-CZ 3.28Å; F232-F257 HydrophobicContact CD2-CB 3.92Å; F232-F257 HydrophobicContact CE2-CB 3.59Å; F232-F257 AromaticContact CE2-CD2 3.96Å; F232-F257 HydrophobicContact CE2-CD2 3.96Å; F232-F257 HydrophobicContact CE2-CG 4.24Å; F232-F257 HydrophobicContact CZ-CB 4.49Å; A252-F257 HydrophobicContact CB-CB 4.32Å; A252-F257 HydrophobicContact CB-CD2 3.84Å; A252-F257 HydrophobicContact CB-CG 4.47Å; A252-F257 WeakPolarHBondContact O-CB 3.37Å; A252-F257 PolarHBondContact O-N 2.96Å; A255-F257 VanDerWaalsContact C-N 3.34Å; A255-F257 HydrophobicContact CB-CD1 3.83Å; A255-F257 HydrophobicContact CB-CD2 4.3Å; A255-F257 HydrophobicContact CB-CE1 3.47Å; A255-F257 VanDerWaalsContact CB-CE1 3.47Å; A255-F257 HydrophobicContact CB-CE2 4.01Å; A255-F257 HydrophobicContact CB-CG 4.23Å; A255-F257 HydrophobicContact CB-CZ 3.57Å; A255-F257 WeakPolarHBondContact O-CD1 3.38Å; A255-F257 PolarHBondContact O-N 3.09Å
258	V	96.3	Very high	95.9	Very high	12 Å²	12	44.8 Å²	44.8	7%	0.073	27%	0.266	C	S	.	.	S	Bend	trans	-150.3	158.1	-176.9	-71.2	0	0	0	0	110.4	F232 A248 A252 V253 M262	F232-V258 HydrophobicContact CD1-CG1 3.49Å; F232-V258 VanDerWaalsContact CD1-CG1 3.49Å; F232-V258 HydrophobicContact CD2-CG1 4.11Å; F232-V258 HydrophobicContact CE1-CG1 3.5Å; F232-V258 HydrophobicContact CE1-CG2 4.31Å; F232-V258 HydrophobicContact CE2-CG1 4.13Å; F232-V258 HydrophobicContact CG-CG1 3.8Å; F232-V258 HydrophobicContact CZ-CG1 3.84Å; F232-V258 HydrophobicContact CZ-CG2 4.12Å; A248-V258 HydrophobicContact CB-CG2 3.42Å; A248-V258 VanDerWaalsContact CB-CG2 3.42Å; A252-V258 HydrophobicContact CB-CG2 4.44Å; V253-V258 HydrophobicContact CG2-CG2 4.1Å; V258-M262 HydrophobicContact CB-CB 4.5Å; V258-M262 HydrophobicContact CB-CE 4.29Å; V258-M262 HydrophobicContact CB-SD 3.73Å; V258-M262 HydrophobicContact CG1-CE 3.87Å; V258-M262 HydrophobicContact CG1-SD 3.8Å; V258-M262 HydrophobicContact CG2-CB 4.43Å
259	P	94.9	Very high	95.7	Very high	57 Å²	57	47.6 Å²	47.6	37%	0.37	28%	0.278	S	S	.	.			trans	-69.1	160.6	176.6	31.5	-39	0	0	0	112.8	T206 D261 M262	T206-P259 HydrophobicContact CG2-CG 4.37Å; P259-D261 WeakPolarHBondContact CB-OD1 3.45Å; P259-D261 WeakPolarHBondContact CG-OD1 3.1Å; P259-D261 PolarHBondContact O-N 3.48Å; P259-M262 HydrophobicContact CG-CG 4.25Å; P259-M262 HydrophobicContact CG-SD 4.11Å; P259-M262 PolarHBondContact O-N 2.91Å
260	N	94.4	Very high	95.6	Very high	97 Å²	97	48.8 Å²	48.8	52%	0.519	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-64.1	-25.7	-176.4	178.5	-103.2	0	0	0	113.6	V253 M262 Q263	V253-N260 HydrophobicContact CG1-CB 3.95Å; N260-M262 PolarHBondContact O-N 3.3Å; N260-Q263 PolarHBondContact ND2-OE1 3.18Å; N260-Q263 WeakPolarHBondContact O-CB 3.46Å; N260-Q263 PolarHBondContact O-N 3.37Å
261	D	91.4	Very high	95.6	Very high	60 Å²	60	42.2 Å²	42.2	32%	0.321	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-67.4	-16.3	178.5	69.9	-75.5	0	0	0	113.2	T206 P259 Q263 K269	T206-D261 PolarHBondContact OG1-OD1 3.44Å; P259-D261 WeakPolarHBondContact CB-OD1 3.45Å; P259-D261 WeakPolarHBondContact CG-OD1 3.1Å; P259-D261 PolarHBondContact O-N 3.48Å; D261-Q263 VanDerWaalsContact C-N 3.3Å; D261-K269 WeakPolarHBondContact O-CD 3.38Å; D261-K269 VanDerWaalsContact O-CE 3.26Å; D261-K269 WeakPolarHBondContact O-CE 3.24Å; D261-K269 PolarHBondContact O-NZ 2.99Å
262	M	96.3	Very high	95.5	Very high	20 Å²	20	42.2 Å²	42.2	10%	0.099	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-83.4	-6.5	171.8	-66.6	177.8	66	0	0	112.9	L213 Y236 V246 G247 A248 V258 P259 N260 V264	L213-M262 WeakPolarHBondContact CD2-O 3.5Å; Y236-M262 HydrophobicContact CE1-CE 4.15Å; V246-M262 HydrophobicContact CB-CE 3.77Å; V246-M262 HydrophobicContact CG1-CE 3.45Å; V246-M262 VanDerWaalsContact CG1-CE 3.45Å; V246-M262 WeakPolarHBondContact O-CE 3.44Å; G247-M262 CarbonylContact C-O 3.55Å; G247-M262 VanDerWaalsContact CA-O 3.3Å; G247-M262 WeakPolarHBondContact CA-O 3.43Å; A248-M262 HydrophobicContact CB-CB 4.46Å; A248-M262 PolarHBondContact N-O 2.93Å; V258-M262 HydrophobicContact CB-CB 4.5Å; V258-M262 HydrophobicContact CB-CE 4.29Å; V258-M262 HydrophobicContact CB-SD 3.73Å; V258-M262 HydrophobicContact CG1-CE 3.87Å; V258-M262 HydrophobicContact CG1-SD 3.8Å; V258-M262 HydrophobicContact CG2-CB 4.43Å; P259-M262 HydrophobicContact CG-CG 4.25Å; P259-M262 HydrophobicContact CG-SD 4.11Å; P259-M262 PolarHBondContact O-N 2.91Å; N260-M262 PolarHBondContact O-N 3.3Å; M262-V264 PolarHBondContact O-N 3.27Å
263	Q	98.1	Very high	95.5	Very high	7 Å²	7	42.4 Å²	42.4	3%	0.033	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-68.2	126.5	-174.3	-164.5	178.1	-52.9	0	0	112	A248 R250 V253 N260 D261 T267 G268 K269	A248-Q263 CarbonylContact O-C 3.57Å; A248-Q263 WeakPolarHBondContact O-CA 3.09Å; R250-Q263 HydrophobicContact CB-CG 4.38Å; V253-Q263 HydrophobicContact CG2-CB 4.06Å; V253-Q263 HydrophobicContact CG2-CG 4.31Å; N260-Q263 PolarHBondContact ND2-OE1 3.18Å; N260-Q263 WeakPolarHBondContact O-CB 3.46Å; N260-Q263 PolarHBondContact O-N 3.37Å; D261-Q263 VanDerWaalsContact C-N 3.3Å; Q263-T267 PolarHBondContact NE2-OG1 3.43Å; Q263-G268 CarbonylContact O-C 3.52Å; Q263-G268 WeakPolarHBondContact O-CA 2.92Å; Q263-K269 PolarHBondContact O-N 2.91Å
264	V	98.3	Very high	95.6	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.012	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-101.1	137.7	169.5	178.7	0	0	0	0	109.3	L213 A248 M262 K269 V271 Y276 G290 M291	L213-V264 HydrophobicContact CD1-CG2 4.47Å; L213-V264 HydrophobicContact CD2-CG2 3.86Å; L213-V264 HydrophobicContact CG-CG2 4.45Å; A248-V264 PolarHBondContact O-N 2.82Å; M262-V264 PolarHBondContact O-N 3.27Å; V264-K269 WeakPolarHBondContact CA-O 3.46Å; V264-V271 HydrophobicContact CG1-CG2 4.11Å; V264-Y276 HydrophobicContact CG1-CE2 4.23Å; V264-Y276 HydrophobicContact CG2-CE2 4.47Å; V264-G290 WeakPolarHBondContact CG1-O 3.24Å; V264-M291 HydrophobicContact CG1-CB 3.91Å; V264-M291 HydrophobicContact CG1-CG 4.17Å
265	G	96.2	Very high	95.7	Very high	2 Å²	2	42.7 Å²	42.7	2%	0.021	26%	0.258	C	S	.	.	S	Bend	trans	137.1	-173.8	176.1	0	0	0	0	0	113.4	T267 G268 K269 Q286	G265-T267 PolarHBondContact O-N 3.1Å; G265-G268 CarbonylContact O-C 3.58Å; G265-G268 PolarHBondContact O-N 2.86Å; G265-K269 PolarHBondContact N-O 3.37Å; G265-Q286 CarbonylContact C-O 3.53Å; G265-Q286 WeakPolarHBondContact CA-O 3.37Å
266	Q	91.1	Very high	95.8	Very high	107 Å²	107	40.6 Å²	40.6	50%	0.5	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-38.2	-176.5	-175.7	-177.3	8.5	0	0	113.6	Q286 A289	Q266-Q286 HydrophobicContact CB-CB 4.45Å; Q266-Q286 PolarHBondContact N-O 3.48Å; Q266-A289 HydrophobicContact CB-CB 4.06Å
267	T	91.6	Very high	95.9	Very high	90 Å²	90	37.5 Å²	37.5	55%	0.552	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.3	6.2	179.9	58.8	0	0	0	0	113.2	Q263 G265	Q263-T267 PolarHBondContact NE2-OG1 3.43Å; G265-T267 PolarHBondContact O-N 3.1Å
268	G	93.6	Very high	95.9	Very high	31 Å²	31	35.9 Å²	35.9	32%	0.32	20%	0.201	S	C	.	.	S	Bend	trans	-122.3	-139.1	176.5	0	0	0	0	0	110.8	Q263 G265	Q263-G268 CarbonylContact O-C 3.52Å; Q263-G268 WeakPolarHBondContact O-CA 2.92Å; G265-G268 CarbonylContact O-C 3.58Å; G265-G268 PolarHBondContact O-N 2.86Å
269	K	94.8	Very high	96.1	Very high	58 Å²	58	35.3 Å²	35.3	25%	0.252	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-86.6	143.6	176.4	-73.9	163.8	177.1	171.3	0	111.2	E212 L213 T214 D261 Q263 V264 G265	E212-K269 IonicContact OE1-NZ 2.81Å; L213-K269 HydrophobicContact CB-CD 4.2Å; L213-K269 HydrophobicContact CD2-CB 4.42Å; L213-K269 HydrophobicContact CD2-CD 3.87Å; L213-K269 HydrophobicContact CG-CD 4.37Å; T214-K269 HydrophobicContact CG2-CB 3.9Å; T214-K269 HydrophobicContact CG2-CD 3.95Å; T214-K269 HydrophobicContact CG2-CG 3.79Å; D261-K269 WeakPolarHBondContact O-CD 3.38Å; D261-K269 VanDerWaalsContact O-CE 3.26Å; D261-K269 WeakPolarHBondContact O-CE 3.24Å; D261-K269 PolarHBondContact O-NZ 2.99Å; Q263-K269 PolarHBondContact O-N 2.91Å; V264-K269 WeakPolarHBondContact CA-O 3.46Å; G265-K269 PolarHBondContact N-O 3.37Å
270	I	94.8	Very high	96.2	Very high	37 Å²	37	33 Å²	33	19%	0.19	19%	0.185	C	C	.	.			trans	-98.6	126.8	168.1	-58.5	178.1	0	0	0	106.7
271	V	96.9	Very high	96.4	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.018	16%	0.161	C	C	.	.			trans	-127.3	149.6	-179.6	-53.6	0	0	0	0	109.6	L213 V264 P273 Y276 G290 M291	L213-V271 HydrophobicContact CD1-CG1 4.45Å; L213-V271 HydrophobicContact CG-CG1 3.98Å; L213-V271 VanDerWaalsContact O-CG1 3.31Å; L213-V271 WeakPolarHBondContact O-CG1 3.26Å; V264-V271 HydrophobicContact CG1-CG2 4.11Å; V271-P273 HydrophobicContact CG2-CG 4.47Å; V271-Y276 HydrophobicContact CG2-CD2 3.92Å; V271-Y276 HydrophobicContact CG2-CE2 3.73Å; V271-G290 WeakPolarHBondContact CG2-O 3.22Å; V271-G290 PolarHBondContact N-O 3.26Å; V271-M291 HydrophobicContact CG2-CB 4.07Å
272	A	96.3	Very high	96.6	Very high	35 Å²	35	29 Å²	29	29%	0.289	17%	0.169	S	C	.	.			trans	-139.2	59.9	172.9	0	0	0	0	0	110.3	T172 D293	T172-A272 HydrophobicContact CG2-CB 3.81Å; A272-D293 HydrophobicContact CB-CB 4.39Å
273	P	97.5	Very high	96.5	Very high	4 Å²	4	28.2 Å²	28.2	3%	0.026	17%	0.165	C	C	.	.			trans	-64.3	168.3	179.4	29.5	-38.8	0	0	0	112.3	K217 V219 V271 L275 Y276 S294 K295	K217-P273 VanDerWaalsContact O-CB 3.24Å; K217-P273 WeakPolarHBondContact O-CB 3.27Å; V219-P273 HydrophobicContact CB-CG 4.14Å; V219-P273 HydrophobicContact CG2-CB 4.02Å; V219-P273 HydrophobicContact CG2-CG 3.88Å; V271-P273 HydrophobicContact CG2-CG 4.47Å; P273-L275 VanDerWaalsContact C-N 3.3Å; P273-Y276 HydrophobicContact CG-CD2 3.95Å; P273-Y276 HydrophobicContact CG-CG 4.47Å; P273-S294 WeakPolarHBondContact CD-OG 3.45Å; P273-S294 WeakPolarHBondContact O-CA 3.45Å; P273-K295 PolarHBondContact O-N 3.45Å
274	E	97.8	Very high	96.4	Very high	89 Å²	89	29.9 Å²	29.9	42%	0.416	18%	0.181	S	C	.	.	S	Bend	trans	-68.2	-35.1	167.8	-48.6	-161.7	126	0	0	111	K217 K295 T296	K217-E274 HydrophobicContact CB-CG 4.29Å; K217-E274 WeakPolarHBondContact O-CA 3.35Å; K217-E274 WeakPolarHBondContact O-CB 3.37Å; K217-E274 PolarHBondContact O-N 3.43Å; E274-K295 HydrophobicContact CB-CD 4.24Å; E274-K295 HydrophobicContact CG-CD 4.21Å; E274-K295 IonicContact OE1-NZ 2.85Å; E274-K295 PolarHBondContact OE1-NZ 3.05Å; E274-T296 PolarHBondContact O-N 3.32Å; E274-T296 VanDerWaalsContact O-N 3.1Å
275	L	98.4	Very high	96.2	Very high	42 Å²	42	34.3 Å²	34.3	22%	0.22	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	124.1	177.5	176.4	62.3	0	0	0	111	K217 V218 V219 P273 I277 T296 V298	K217-L275 PolarHBondContact O-N 3.17Å; V218-L275 CarbonylContact C-O 3.59Å; V218-L275 VanDerWaalsContact CA-O 3.32Å; V218-L275 WeakPolarHBondContact CA-O 3.17Å; V218-L275 HydrophobicContact CG1-CB 4.09Å; V218-L275 HydrophobicContact CG1-CD2 3.99Å; V218-L275 HydrophobicContact CG1-CG 4.11Å; V218-L275 HydrophobicContact CG2-CB 4.23Å; V219-L275 PolarHBondContact N-O 3.08Å; P273-L275 VanDerWaalsContact C-N 3.3Å; L275-I277 HydrophobicContact CD1-CG1 4.21Å; L275-I277 HydrophobicContact CD2-CD1 4.08Å; L275-I277 HydrophobicContact CD2-CG1 4.26Å; L275-I277 HydrophobicContact CG-CD1 4.37Å; L275-I277 HydrophobicContact CG-CG1 4.01Å; L275-T296 WeakPolarHBondContact CA-O 3.26Å; L275-T296 HydrophobicContact CD1-CG2 4.06Å; L275-V298 HydrophobicContact CD1-CG2 3.68Å
276	Y	98.8	Very high	96.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	120.1	171.3	-166	-77.3	0	0	0	110.3	V219 S221 V264 V271 P273 A278 H287 M291 S294 T296 I297 V298	V219-Y276 HydrophobicContact CB-CD2 3.85Å; V219-Y276 HydrophobicContact CB-CE2 4.12Å; V219-Y276 HydrophobicContact CG1-CD2 3.94Å; V219-Y276 HydrophobicContact CG1-CE2 3.67Å; V219-Y276 CarbonylContact O-C 3.55Å; V219-Y276 WeakPolarHBondContact O-CA 3.48Å; S221-Y276 VanDerWaalsContact CB-CZ 3.46Å; S221-Y276 WeakPolarHBondContact CB-OH 3.39Å; S221-Y276 PolarHBondContact OG-OH 3.09Å; S221-Y276 VanDerWaalsContact OG-OH 3.08Å; V264-Y276 HydrophobicContact CG1-CE2 4.23Å; V264-Y276 HydrophobicContact CG2-CE2 4.47Å; V271-Y276 HydrophobicContact CG2-CD2 3.92Å; V271-Y276 HydrophobicContact CG2-CE2 3.73Å; P273-Y276 HydrophobicContact CG-CD2 3.95Å; P273-Y276 HydrophobicContact CG-CG 4.47Å; Y276-A278 HydrophobicContact CD1-CB 4.19Å; Y276-A278 HydrophobicContact CE1-CB 3.95Å; Y276-H287 AromaticContact CZ-NE2 3.89Å; Y276-H287 PolarHBondContact OH-CE1 3.02Å; Y276-H287 PolarHBondContact OH-NE2 3.01Å; Y276-M291 HydrophobicContact CD1-CE 3.29Å; Y276-M291 HydrophobicContact CD2-CB 3.7Å; Y276-M291 HydrophobicContact CD2-CE 4.33Å; Y276-M291 HydrophobicContact CD2-CG 4.47Å; Y276-M291 HydrophobicContact CE1-CB 4.34Å; Y276-M291 HydrophobicContact CE1-CE 3.56Å; Y276-M291 HydrophobicContact CE1-CG 4.08Å; Y276-M291 HydrophobicContact CE2-CB 3.45Å; Y276-M291 VanDerWaalsContact CE2-CB 3.45Å; Y276-M291 HydrophobicContact CE2-CG 4.01Å; Y276-M291 HydrophobicContact CG-CB 4.26Å; Y276-M291 HydrophobicContact CG-CE 3.71Å; Y276-S294 WeakPolarHBondContact CB-OG 3.5Å; Y276-T296 PolarHBondContact N-O 2.93Å; Y276-I297 CarbonylContact O-C 3.4Å; Y276-I297 WeakPolarHBondContact O-CA 3.4Å; Y276-V298 PolarHBondContact O-N 3.19Å
277	I	98.8	Very high	96.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	106.1	178.1	-54.3	174.1	0	0	0	108.8	V219 V220 S221 L238 L242 L275 V279 V298 M327	V219-I277 PolarHBondContact O-N 3.37Å; V220-I277 HydrophobicContact CG2-CD1 4.24Å; S221-I277 PolarHBondContact N-O 3.37Å; L238-I277 HydrophobicContact CD2-CD1 4.43Å; L242-I277 HydrophobicContact CD1-CD1 3.69Å; L275-I277 HydrophobicContact CD1-CG1 4.21Å; L275-I277 HydrophobicContact CD2-CD1 4.08Å; L275-I277 HydrophobicContact CD2-CG1 4.26Å; L275-I277 HydrophobicContact CG-CD1 4.37Å; L275-I277 HydrophobicContact CG-CG1 4.01Å; I277-V279 HydrophobicContact CG2-CG2 3.86Å; I277-V298 CarbonylContact C-O 3.57Å; I277-V298 WeakPolarHBondContact CA-O 3.22Å; I277-V298 HydrophobicContact CG1-CB 4.23Å; I277-V298 HydrophobicContact CG2-CB 4.42Å; I277-V298 HydrophobicContact CG2-CG1 4.39Å; I277-M327 HydrophobicContact CD1-CE 3.76Å
278	A	98.7	Very high	96.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	108.5	178.1	0	0	0	0	0	111	Y276 I281 V298 A299 I300 I308	Y276-A278 HydrophobicContact CD1-CB 4.19Å; Y276-A278 HydrophobicContact CE1-CB 3.95Å; A278-I281 HydrophobicContact CB-CB 4.42Å; A278-I281 HydrophobicContact CB-CD1 4.29Å; A278-V298 PolarHBondContact N-O 2.97Å; A278-A299 WeakPolarHBondContact O-CA 3.36Å; A278-I300 PolarHBondContact O-N 3.26Å; A278-I308 HydrophobicContact CB-CD1 4.08Å; A278-I308 HydrophobicContact CB-CG1 3.93Å
279	V	98.8	Very high	96.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	114.4	-176.9	-173.9	0	0	0	0	110.9	S221 G223 L226 L235 I277 I281 I300 L320 V324	S221-V279 PolarHBondContact O-N 3.18Å; G223-V279 PolarHBondContact N-O 3.07Å; L226-V279 HydrophobicContact CD1-CG1 4.21Å; L235-V279 HydrophobicContact CD2-CB 3.85Å; L235-V279 HydrophobicContact CD2-CG1 3.99Å; L235-V279 HydrophobicContact CD2-CG2 3.76Å; I277-V279 HydrophobicContact CG2-CG2 3.86Å; V279-I281 PolarHBondContact O-N 2.96Å; V279-I300 HydrophobicContact CG2-CD1 4.37Å; V279-L320 HydrophobicContact CG1-CB 3.61Å; V279-L320 HydrophobicContact CG1-CD1 4.34Å; V279-L320 HydrophobicContact CG1-CD2 4.14Å; V279-L320 HydrophobicContact CG1-CG 4.24Å; V279-V324 HydrophobicContact CG1-CG2 3.73Å; V279-V324 HydrophobicContact CG2-CG2 4.19Å
280	G	97.9	Very high	96.6	Very high	9 Å²	9	28 Å²	28	9%	0.093	16%	0.162	C	C	.	.	S	Bend	trans	63.9	30.3	178.4	0	0	0	0	0	113.7	G223 G225 I300	G223-G280 CarbonylContact C-O 3.59Å; G223-G280 WeakPolarHBondContact CA-O 3.36Å; G225-G280 PolarHBondContact N-O 3.21Å; G225-G280 VanDerWaalsContact N-O 3.15Å; G280-I300 PolarHBondContact N-O 2.91Å
281	I	98.4	Very high	96.7	Very high	5 Å²	5	26.2 Å²	26.2	3%	0.026	15%	0.153	C	C	.	.			trans	-107.6	131.4	177	-64.4	169.5	0	0	0	108.3	S221 G223 A278 V279 N301 I308	S221-I281 WeakPolarHBondContact O-CD1 3.45Å; S221-I281 WeakPolarHBondContact OG-CD1 3.14Å; G223-I281 VanDerWaalsContact CA-CG1 3.48Å; A278-I281 HydrophobicContact CB-CB 4.42Å; A278-I281 HydrophobicContact CB-CD1 4.29Å; V279-I281 PolarHBondContact O-N 2.96Å; I281-N301 PolarHBondContact O-ND2 3.2Å; I281-I308 WeakPolarHBondContact O-CG2 3.46Å
282	S	96.1	Very high	96.6	Very high	69 Å²	69	29.4 Å²	29.4	48%	0.483	17%	0.166	S	C	.	.			trans	-72.7	-27.3	-178.6	56.7	0	0	0	0	113.8	P307 I308	S282-P307 CarbonylContact O-C 3.36Å; S282-P307 WeakPolarHBondContact O-CB 3.47Å; S282-P307 WeakPolarHBondContact O-CD 3.43Å; S282-P307 VanDerWaalsContact O-N 3.11Å; S282-I308 PolarHBondContact O-N 2.81Å
283	G	94.6	Very high	96.4	Very high	2 Å²	2	32 Å²	32	2%	0.021	18%	0.175	C	C	.	.			trans	88	36.1	-175.3	0	0	0	0	0	113.8	L288	G283-L288 WeakPolarHBondContact O-CD1 3.45Å; G283-L288 WeakPolarHBondContact O-CG 3.27Å
284	A	95.2	Very high	96.4	Very high	43 Å²	43	32.2 Å²	32.2	36%	0.355	18%	0.177	S	C	.	.			trans	-56.8	145.9	171.7	0	0	0	0	0	111.4	Q286 H287 L288	A284-Q286 PolarHBondContact O-N 2.9Å; A284-H287 WeakPolarHBondContact O-CA 3.3Å; A284-H287 WeakPolarHBondContact O-CB 3.42Å; A284-H287 PolarHBondContact O-N 3.33Å; A284-L288 PolarHBondContact O-N 2.81Å
285	I	93.5	Very high	96.4	Very high	95 Å²	95	34.7 Å²	34.7	49%	0.487	19%	0.187	S	C	.	.	H	α-helix	trans	-50.2	-39.8	-176.3	-64.6	172.7	0	0	0	111.9	A151 H287 L288 A289	A151-I285 HydrophobicContact CB-CG2 4.01Å; I285-H287 VanDerWaalsContact C-N 3.32Å; I285-H287 PolarHBondContact O-N 2.97Å; I285-L288 PolarHBondContact O-N 3Å; I285-A289 WeakPolarHBondContact O-CB 3.45Å; I285-A289 PolarHBondContact O-N 3.12Å
286	Q	94.4	Very high	96.4	Very high	105 Å²	105	34.8 Å²	34.8	49%	0.491	19%	0.189	S	C	.	.	H	α-helix	trans	-67	-31.9	-180	-60	77.7	10.7	0	0	112.5	G265 Q266 A284	G265-Q286 CarbonylContact C-O 3.53Å; G265-Q286 WeakPolarHBondContact CA-O 3.37Å; Q266-Q286 HydrophobicContact CB-CB 4.45Å; Q266-Q286 PolarHBondContact N-O 3.48Å; A284-Q286 PolarHBondContact O-N 2.9Å
287	H	97.6	Very high	96.4	Very high	12 Å²	12	35 Å²	35	6%	0.056	19%	0.191	C	C	.	.	H	α-helix	trans	-73.9	-48.1	173.8	-168.8	93.8	0	0	0	110.3	S249 Y276 A284 I285 A289 G290	S249-H287 WeakPolarHBondContact CA-ND1 3.24Å; S249-H287 WeakPolarHBondContact CB-ND1 3.42Å; Y276-H287 AromaticContact CZ-NE2 3.89Å; Y276-H287 PolarHBondContact OH-CE1 3.02Å; Y276-H287 PolarHBondContact OH-NE2 3.01Å; A284-H287 WeakPolarHBondContact O-CA 3.3Å; A284-H287 WeakPolarHBondContact O-CB 3.42Å; A284-H287 PolarHBondContact O-N 3.33Å; I285-H287 VanDerWaalsContact C-N 3.32Å; I285-H287 PolarHBondContact O-N 2.97Å; H287-A289 PolarHBondContact O-N 2.95Å; H287-G290 PolarHBondContact O-N 3.2Å
288	L	95.8	Very high	96.4	Very high	26 Å²	26	36.3 Å²	36.3	14%	0.136	20%	0.198	C	C	.	.	H	α-helix	trans	-57.9	-35.9	-179.5	-61.2	-173	0	0	0	112.3	G283 A284 I285 G290 M291 K292 I308 V311	G283-L288 WeakPolarHBondContact O-CD1 3.45Å; G283-L288 WeakPolarHBondContact O-CG 3.27Å; A284-L288 PolarHBondContact O-N 2.81Å; I285-L288 PolarHBondContact O-N 3Å; L288-G290 PolarHBondContact O-N 3.21Å; L288-M291 HydrophobicContact CD2-SD 3.73Å; L288-M291 PolarHBondContact O-N 2.77Å; L288-K292 VanDerWaalsContact O-CB 3.26Å; L288-K292 WeakPolarHBondContact O-CB 3.47Å; L288-K292 WeakPolarHBondContact O-CG 3.5Å; L288-K292 PolarHBondContact O-N 3.04Å; L288-I308 HydrophobicContact CD2-CD1 3.69Å; L288-V311 HydrophobicContact CD1-CG1 4.28Å; L288-V311 HydrophobicContact CD1-CG2 4.28Å; L288-V311 HydrophobicContact CD2-CG2 3.75Å
289	A	93.5	Very high	96.4	Very high	10 Å²	10	36.3 Å²	36.3	8%	0.083	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-23.2	175.2	0	0	0	0	0	114.5	A151 Q266 I285 H287	A151-A289 HydrophobicContact CB-CB 3.95Å; A151-A289 VanDerWaalsContact O-CB 3.31Å; A151-A289 WeakPolarHBondContact O-CB 3.16Å; Q266-A289 HydrophobicContact CB-CB 4.06Å; I285-A289 WeakPolarHBondContact O-CB 3.45Å; I285-A289 PolarHBondContact O-N 3.12Å; H287-A289 PolarHBondContact O-N 2.95Å
290	G	95.4	Very high	96.4	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.01	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-2	179.4	0	0	0	0	0	115.4	V264 V271 H287 L288	V264-G290 WeakPolarHBondContact CG1-O 3.24Å; V271-G290 WeakPolarHBondContact CG2-O 3.22Å; V271-G290 PolarHBondContact N-O 3.26Å; H287-G290 PolarHBondContact O-N 3.2Å; L288-G290 PolarHBondContact O-N 3.21Å
291	M	97.3	Very high	96.4	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-148.4	-3.4	-175.6	58.1	68.8	67.1	0	0	116.3	V264 V271 Y276 L288 D293 S294 I297 I308	V264-M291 HydrophobicContact CG1-CB 3.91Å; V264-M291 HydrophobicContact CG1-CG 4.17Å; V271-M291 HydrophobicContact CG2-CB 4.07Å; Y276-M291 HydrophobicContact CD1-CE 3.29Å; Y276-M291 HydrophobicContact CD2-CB 3.7Å; Y276-M291 HydrophobicContact CD2-CE 4.33Å; Y276-M291 HydrophobicContact CD2-CG 4.47Å; Y276-M291 HydrophobicContact CE1-CB 4.34Å; Y276-M291 HydrophobicContact CE1-CE 3.56Å; Y276-M291 HydrophobicContact CE1-CG 4.08Å; Y276-M291 HydrophobicContact CE2-CB 3.45Å; Y276-M291 VanDerWaalsContact CE2-CB 3.45Å; Y276-M291 HydrophobicContact CE2-CG 4.01Å; Y276-M291 HydrophobicContact CG-CB 4.26Å; Y276-M291 HydrophobicContact CG-CE 3.71Å; L288-M291 HydrophobicContact CD2-SD 3.73Å; L288-M291 PolarHBondContact O-N 2.77Å; M291-D293 PolarHBondContact O-N 3.43Å; M291-S294 WeakPolarHBondContact O-CB 3.45Å; M291-S294 PolarHBondContact O-N 3.41Å; M291-S294 VanDerWaalsContact O-N 3.1Å; M291-S294 PolarHBondContact O-OG 2.99Å; M291-I297 HydrophobicContact CE-CB 4.43Å; M291-I297 HydrophobicContact CE-CD1 3.73Å; M291-I297 HydrophobicContact CE-CG1 3.79Å; M291-I297 HydrophobicContact CE-CG2 3.76Å; M291-I297 HydrophobicContact SD-CD1 4.46Å; M291-I308 HydrophobicContact CE-CD1 4.46Å
292	K	93.1	Very high	96.4	Very high	69 Å²	69	44.5 Å²	44.5	30%	0.3	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-20	-177.5	67.6	178	-171.1	165.9	0	114.8	G152 L288 S294	G152-K292 VanDerWaalsContact C-NZ 3.27Å; G152-K292 PolarHBondContact O-NZ 2.8Å; L288-K292 VanDerWaalsContact O-CB 3.26Å; L288-K292 WeakPolarHBondContact O-CB 3.47Å; L288-K292 WeakPolarHBondContact O-CG 3.5Å; L288-K292 PolarHBondContact O-N 3.04Å; K292-S294 PolarHBondContact O-N 2.95Å
293	D	93.8	Very high	96.4	Very high	89 Å²	89	44.9 Å²	44.9	48%	0.476	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	10.5	178.8	-58.1	-36.1	0	0	0	111.4	A272 M291	A272-D293 HydrophobicContact CB-CB 4.39Å; M291-D293 PolarHBondContact O-N 3.43Å
294	S	97.5	Very high	96.5	Very high	10 Å²	10	48.3 Å²	48.3	7%	0.07	25%	0.251	C	S	.	.			trans	-65.1	141	172.4	-54.3	0	0	0	0	110	P273 Y276 M291 K292 T296	P273-S294 WeakPolarHBondContact CD-OG 3.45Å; P273-S294 WeakPolarHBondContact O-CA 3.45Å; Y276-S294 WeakPolarHBondContact CB-OG 3.5Å; M291-S294 WeakPolarHBondContact O-CB 3.45Å; M291-S294 PolarHBondContact O-N 3.41Å; M291-S294 VanDerWaalsContact O-N 3.1Å; M291-S294 PolarHBondContact O-OG 2.99Å; K292-S294 PolarHBondContact O-N 2.95Å; S294-T296 VanDerWaalsContact C-N 3.28Å; S294-T296 PolarHBondContact O-N 3.02Å
295	K	96.9	Very high	96.6	Very high	140 Å²	140	53.5 Å²	53.5	61%	0.609	27%	0.267	S	S	*	.	S	Bend	trans	-64.3	-33.6	-176.6	-58.1	-177.9	-173.9	170.9	0	112.9	P273 E274	P273-K295 PolarHBondContact O-N 3.45Å; E274-K295 HydrophobicContact CB-CD 4.24Å; E274-K295 HydrophobicContact CG-CD 4.21Å; E274-K295 IonicContact OE1-NZ 2.85Å; E274-K295 PolarHBondContact OE1-NZ 3.05Å
296	T	98.6	Very high	96.8	Very high	45 Å²	45	49 Å²	49	28%	0.276	25%	0.245	S	C	.	.			trans	-141.5	129	175.2	-60.3	0	0	0	0	109.6	E274 L275 Y276 S294 D313 Y314	E274-T296 PolarHBondContact O-N 3.32Å; E274-T296 VanDerWaalsContact O-N 3.1Å; L275-T296 WeakPolarHBondContact CA-O 3.26Å; L275-T296 HydrophobicContact CD1-CG2 4.06Å; Y276-T296 PolarHBondContact N-O 2.93Å; S294-T296 VanDerWaalsContact C-N 3.28Å; S294-T296 PolarHBondContact O-N 3.02Å; T296-D313 VanDerWaalsContact CA-OD2 3.29Å; T296-D313 WeakPolarHBondContact CA-OD2 3.37Å; T296-D313 HydrophobicContact CG2-CB 4.18Å; T296-Y314 HydrophobicContact CG2-CD2 3.92Å; T296-Y314 HydrophobicContact CG2-CE2 3.92Å
297	I	98.7	Very high	96.9	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.026	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	121	178	-62.8	166.3	0	0	0	108.7	Y276 M291 V311 A312 D313 Y314	Y276-I297 CarbonylContact O-C 3.4Å; Y276-I297 WeakPolarHBondContact O-CA 3.4Å; M291-I297 HydrophobicContact CE-CB 4.43Å; M291-I297 HydrophobicContact CE-CD1 3.73Å; M291-I297 HydrophobicContact CE-CG1 3.79Å; M291-I297 HydrophobicContact CE-CG2 3.76Å; M291-I297 HydrophobicContact SD-CD1 4.46Å; I297-V311 WeakPolarHBondContact CD1-O 3.2Å; I297-A312 HydrophobicContact CG2-CB 4.16Å; I297-A312 CarbonylContact O-C 3.42Å; I297-D313 PolarHBondContact N-OD2 3.2Å; I297-D313 PolarHBondContact O-N 3.1Å; I297-Y314 PolarHBondContact O-N 3.02Å
298	V	98.7	Very high	96.9	Very high	26 Å²	26	46.7 Å²	46.7	16%	0.158	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	131.9	171.7	178.7	0	0	0	0	108.5	L275 Y276 I277 A278 Y314	L275-V298 HydrophobicContact CD1-CG2 3.68Å; Y276-V298 PolarHBondContact O-N 3.19Å; I277-V298 CarbonylContact C-O 3.57Å; I277-V298 WeakPolarHBondContact CA-O 3.22Å; I277-V298 HydrophobicContact CG1-CB 4.23Å; I277-V298 HydrophobicContact CG2-CB 4.42Å; I277-V298 HydrophobicContact CG2-CG1 4.39Å; A278-V298 PolarHBondContact N-O 2.97Å; V298-Y314 CarbonylContact C-O 3.4Å; V298-Y314 VanDerWaalsContact CA-O 3.29Å; V298-Y314 WeakPolarHBondContact CA-O 3.45Å; V298-Y314 HydrophobicContact CG2-CD2 4.36Å
299	A	98.7	Very high	97.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.8	177	0	0	0	0	0	111.6	A278 I308 F309 A312 Y314 L316	A278-A299 WeakPolarHBondContact O-CA 3.36Å; A299-I308 HydrophobicContact CB-CG1 3.99Å; A299-I308 HydrophobicContact CB-CG2 3.92Å; A299-F309 HydrophobicContact CB-CD1 3.78Å; A299-F309 HydrophobicContact CB-CE1 3.63Å; A299-A312 HydrophobicContact CB-CB 3.71Å; A299-Y314 PolarHBondContact N-O 2.84Å; A299-L316 PolarHBondContact O-N 3.17Å
300	I	98.7	Very high	97.2	Very high	5 Å²	5	54.6 Å²	54.6	3%	0.026	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	107.8	170.2	-55.7	177	0	0	0	107.5	A278 V279 G280 L320 A323 V324 M327	A278-I300 PolarHBondContact O-N 3.26Å; V279-I300 HydrophobicContact CG2-CD1 4.37Å; G280-I300 PolarHBondContact N-O 2.91Å; I300-L320 HydrophobicContact CG2-CB 4.11Å; I300-A323 HydrophobicContact CG2-CB 3.98Å; I300-V324 HydrophobicContact CD1-CG2 4.11Å; I300-M327 HydrophobicContact CD1-SD 4.49Å
301	N	98.5	Very high	97.2	Very high	17 Å²	17	57 Å²	57	9%	0.091	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	146.7	-179	-155.5	-42.8	0	0	0	110.8	I281 D303 A306 F309 L316 V317 A318	I281-N301 PolarHBondContact O-ND2 3.2Å; N301-D303 PolarHBondContact OD1-N 3.41Å; N301-D303 VanDerWaalsContact OD1-N 3.16Å; N301-A306 HydrophobicContact CB-CB 4.41Å; N301-F309 HydrophobicContact CB-CE2 3.9Å; N301-F309 HydrophobicContact CB-CZ 3.83Å; N301-L316 PolarHBondContact N-O 3.12Å; N301-V317 CarbonylContact O-C 3.41Å; N301-V317 VanDerWaalsContact O-CA 3.22Å; N301-V317 WeakPolarHBondContact O-CA 3.48Å; N301-A318 CarbonylContact C-O 3.52Å; N301-A318 PolarHBondContact O-N 3.35Å
302	K	96.8	Very high	97.3	Very high	164 Å²	164	58 Å²	58	71%	0.713	30%	0.297	S	S	*	.	S	Bend	trans	-79.4	-22.3	177.5	65.1	173.4	-175.4	168.8	0	113.2	P304 A318	K302-P304 WeakPolarHBondContact O-CD 3.3Å; K302-A318 PolarHBondContact N-O 3.24Å
303	D	97.2	Very high	97.5	Very high	78 Å²	78	59.3 Å²	59.3	42%	0.417	31%	0.307	S	S	.	.			trans	-95	107.3	-177.5	176.7	11	0	0	0	109.3	N301 E305 A306 F309	N301-D303 PolarHBondContact OD1-N 3.41Å; N301-D303 VanDerWaalsContact OD1-N 3.16Å; D303-E305 PolarHBondContact O-N 3.49Å; D303-E305 VanDerWaalsContact O-N 3.17Å; D303-E305 PolarHBondContact OD1-N 2.89Å; D303-E305 VanDerWaalsContact OD1-N 3.08Å; D303-A306 HydrophobicContact CB-CB 4.32Å; D303-A306 VanDerWaalsContact O-CB 3.24Å; D303-A306 WeakPolarHBondContact O-CB 2.81Å; D303-A306 PolarHBondContact O-N 3.21Å; D303-A306 VanDerWaalsContact O-N 3.09Å; D303-F309 VanDerWaalsContact O-CE2 3.26Å; D303-F309 WeakPolarHBondContact O-CE2 3.38Å
304	P	96.9	Very high	97.7	Very high	74 Å²	74	62.6 Å²	62.6	48%	0.481	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.8	-178.3	26.2	-34	0	0	0	113.3	K302 A306 F309 V317	K302-P304 WeakPolarHBondContact O-CD 3.3Å; P304-A306 VanDerWaalsContact C-N 3.34Å; P304-F309 WeakPolarHBondContact O-CD2 3.49Å; P304-V317 HydrophobicContact CB-CG1 4Å; P304-V317 HydrophobicContact CB-CG2 4.02Å; P304-V317 HydrophobicContact CG-CG1 4.47Å
305	E	96.8	Very high	97.8	Very high	151 Å²	151	64.8 Å²	64.8	71%	0.706	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	5.9	-179.9	-59.1	-57.5	129.9	0	0	112.6	D303 P307	D303-E305 PolarHBondContact O-N 3.49Å; D303-E305 VanDerWaalsContact O-N 3.17Å; D303-E305 PolarHBondContact OD1-N 2.89Å; D303-E305 VanDerWaalsContact OD1-N 3.08Å; E305-P307 WeakPolarHBondContact O-CD 3.12Å
306	A	97.6	Very high	97.8	Very high	2 Å²	2	62.1 Å²	62.1	2%	0.017	33%	0.33	C	S	.	.			trans	-59.9	127.5	179.9	0	0	0	0	0	111	N301 D303 P304 I308 F309	N301-A306 HydrophobicContact CB-CB 4.41Å; D303-A306 HydrophobicContact CB-CB 4.32Å; D303-A306 VanDerWaalsContact O-CB 3.24Å; D303-A306 WeakPolarHBondContact O-CB 2.81Å; D303-A306 PolarHBondContact O-N 3.21Å; D303-A306 VanDerWaalsContact O-N 3.09Å; P304-A306 VanDerWaalsContact C-N 3.34Å; A306-I308 HydrophobicContact CB-CG2 4.02Å; A306-I308 PolarHBondContact O-N 3Å; A306-F309 HydrophobicContact CB-CD2 4.11Å; A306-F309 HydrophobicContact CB-CE2 4.28Å; A306-F309 PolarHBondContact O-N 3.06Å
307	P	97.1	Very high	97.8	Very high	67 Å²	67	63.9 Å²	63.9	44%	0.435	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-52.5	-25	-179.5	-31.2	34.7	0	0	0	116	S282 E305 F309 Q310	S282-P307 CarbonylContact O-C 3.36Å; S282-P307 WeakPolarHBondContact O-CB 3.47Å; S282-P307 WeakPolarHBondContact O-CD 3.43Å; S282-P307 VanDerWaalsContact O-N 3.11Å; E305-P307 WeakPolarHBondContact O-CD 3.12Å; P307-F309 PolarHBondContact O-N 2.95Å; P307-Q310 VanDerWaalsContact O-CB 3.31Å; P307-Q310 WeakPolarHBondContact O-CB 3.38Å; P307-Q310 WeakPolarHBondContact O-CG 3.16Å; P307-Q310 PolarHBondContact O-N 3.12Å
308	I	98	Very high	97.8	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.005	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-57.1	-31.6	176.2	-165.3	62.6	0	0	0	112.5	A278 I281 S282 L288 M291 A299 A306 Q310 V311 A312	A278-I308 HydrophobicContact CB-CD1 4.08Å; A278-I308 HydrophobicContact CB-CG1 3.93Å; I281-I308 WeakPolarHBondContact O-CG2 3.46Å; S282-I308 PolarHBondContact O-N 2.81Å; L288-I308 HydrophobicContact CD2-CD1 3.69Å; M291-I308 HydrophobicContact CE-CD1 4.46Å; A299-I308 HydrophobicContact CB-CG1 3.99Å; A299-I308 HydrophobicContact CB-CG2 3.92Å; A306-I308 HydrophobicContact CB-CG2 4.02Å; A306-I308 PolarHBondContact O-N 3Å; I308-Q310 PolarHBondContact O-N 3.16Å; I308-V311 HydrophobicContact CD1-CG2 4.21Å; I308-V311 WeakPolarHBondContact O-CG2 3.35Å; I308-V311 PolarHBondContact O-N 3.3Å; I308-A312 PolarHBondContact O-N 3.15Å; I308-A312 VanDerWaalsContact O-N 3.16Å
309	F	98.4	Very high	97.8	Very high	41 Å²	41	68 Å²	68	18%	0.18	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-68.7	-19.6	178.7	-70.5	-56.7	0	0	0	113	A299 N301 D303 P304 A306 P307 V311 V317	A299-F309 HydrophobicContact CB-CD1 3.78Å; A299-F309 HydrophobicContact CB-CE1 3.63Å; N301-F309 HydrophobicContact CB-CE2 3.9Å; N301-F309 HydrophobicContact CB-CZ 3.83Å; D303-F309 VanDerWaalsContact O-CE2 3.26Å; D303-F309 WeakPolarHBondContact O-CE2 3.38Å; P304-F309 WeakPolarHBondContact O-CD2 3.49Å; A306-F309 HydrophobicContact CB-CD2 4.11Å; A306-F309 HydrophobicContact CB-CE2 4.28Å; A306-F309 PolarHBondContact O-N 3.06Å; P307-F309 PolarHBondContact O-N 2.95Å; F309-V311 PolarHBondContact O-N 2.87Å; F309-V317 HydrophobicContact CE2-CG2 4.06Å; F309-V317 HydrophobicContact CZ-CG2 3.91Å
310	Q	96.4	Very high	97.7	Very high	160 Å²	160	68.6 Å²	68.6	75%	0.748	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-70.8	-15.7	176.3	-57	-62.2	-13.7	0	0	113.2	P307 I308	P307-Q310 VanDerWaalsContact O-CB 3.31Å; P307-Q310 WeakPolarHBondContact O-CB 3.38Å; P307-Q310 WeakPolarHBondContact O-CG 3.16Å; P307-Q310 PolarHBondContact O-N 3.12Å; I308-Q310 PolarHBondContact O-N 3.16Å
311	V	96.1	Very high	97.7	Very high	53 Å²	53	71.2 Å²	71.2	32%	0.321	38%	0.38	S	S	.	.	S	Bend	trans	-124.9	3	179.4	-58.6	0	0	0	0	112.7	L288 I297 I308 F309	L288-V311 HydrophobicContact CD1-CG1 4.28Å; L288-V311 HydrophobicContact CD1-CG2 4.28Å; L288-V311 HydrophobicContact CD2-CG2 3.75Å; I297-V311 WeakPolarHBondContact CD1-O 3.2Å; I308-V311 HydrophobicContact CD1-CG2 4.21Å; I308-V311 WeakPolarHBondContact O-CG2 3.35Å; I308-V311 PolarHBondContact O-N 3.3Å; F309-V311 PolarHBondContact O-N 2.87Å
312	A	97.9	Very high	97.7	Very high	22 Å²	22	76.8 Å²	76.8	18%	0.182	40%	0.404	C	S	.	.			trans	-86.1	130.5	179.2	0	0	0	0	0	110.3	I297 A299 I308 Y314	I297-A312 HydrophobicContact CG2-CB 4.16Å; I297-A312 CarbonylContact O-C 3.42Å; A299-A312 HydrophobicContact CB-CB 3.71Å; I308-A312 PolarHBondContact O-N 3.15Å; I308-A312 VanDerWaalsContact O-N 3.16Å; A312-Y314 VanDerWaalsContact C-N 3.33Å
313	D	98.5	Very high	97.7	Very high	96 Å²	96	69.3 Å²	69.3	51%	0.513	37%	0.372	S	S	.	.	S	Bend	trans	-71.8	-33.5	171.1	-56.2	-80	0	0	0	111	T296 I297	T296-D313 VanDerWaalsContact CA-OD2 3.29Å; T296-D313 WeakPolarHBondContact CA-OD2 3.37Å; T296-D313 HydrophobicContact CG2-CB 4.18Å; I297-D313 PolarHBondContact N-OD2 3.2Å; I297-D313 PolarHBondContact O-N 3.1Å
314	Y	98.5	Very high	97.8	Very high	158 Å²	158	65.7 Å²	65.7	62%	0.62	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.1	174.3	-58.4	-83.4	0	0	0	110.7	T296 I297 V298 A299 A312	T296-Y314 HydrophobicContact CG2-CD2 3.92Å; T296-Y314 HydrophobicContact CG2-CE2 3.92Å; I297-Y314 PolarHBondContact O-N 3.02Å; V298-Y314 CarbonylContact C-O 3.4Å; V298-Y314 VanDerWaalsContact CA-O 3.29Å; V298-Y314 WeakPolarHBondContact CA-O 3.45Å; V298-Y314 HydrophobicContact CG2-CD2 4.36Å; A299-Y314 PolarHBondContact N-O 2.84Å; A312-Y314 VanDerWaalsContact C-N 3.33Å
315	G	98.1	Very high	97.8	Very high	55 Å²	55	64.6 Å²	64.6	57%	0.567	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	133.4	178.4	0	0	0	0	0	112.2
316	L	98.3	Very high	97.9	Very high	85 Å²	85	62.2 Å²	62.2	45%	0.445	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	110.7	169.6	-179	62.2	0	0	0	109.7	A299 N301 A318 A323	A299-L316 PolarHBondContact O-N 3.17Å; N301-L316 PolarHBondContact N-O 3.12Å; L316-A318 HydrophobicContact CD1-CB 4.3Å; L316-A318 HydrophobicContact CD2-CB 4.16Å; L316-A318 HydrophobicContact CG-CB 3.81Å; L316-A318 PolarHBondContact O-N 3.01Å; L316-A323 HydrophobicContact CD2-CB 3.78Å
317	V	98.4	Very high	97.8	Very high	82 Å²	82	64.9 Å²	64.9	50%	0.497	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	92.4	173	-174	0	0	0	0	108.9	N301 P304 F309	N301-V317 CarbonylContact O-C 3.41Å; N301-V317 VanDerWaalsContact O-CA 3.22Å; N301-V317 WeakPolarHBondContact O-CA 3.48Å; P304-V317 HydrophobicContact CB-CG1 4Å; P304-V317 HydrophobicContact CB-CG2 4.02Å; P304-V317 HydrophobicContact CG-CG1 4.47Å; F309-V317 HydrophobicContact CE2-CG2 4.06Å; F309-V317 HydrophobicContact CZ-CG2 3.91Å
318	A	98	Very high	97.8	Very high	31 Å²	31	62.7 Å²	62.7	26%	0.256	33%	0.333	S	S	.	.	S	Bend	trans	-156	166	-175.8	0	0	0	0	0	112.2	N301 K302 L316 L320 A323	N301-A318 CarbonylContact C-O 3.52Å; N301-A318 PolarHBondContact O-N 3.35Å; K302-A318 PolarHBondContact N-O 3.24Å; L316-A318 HydrophobicContact CD1-CB 4.3Å; L316-A318 HydrophobicContact CD2-CB 4.16Å; L316-A318 HydrophobicContact CG-CB 3.81Å; L316-A318 PolarHBondContact O-N 3.01Å; A318-L320 PolarHBondContact O-N 3.09Å; A318-A323 HydrophobicContact CB-CB 4.18Å
319	D	98	Very high	97.8	Very high	86 Å²	86	68.5 Å²	68.5	46%	0.46	36%	0.36	S	S	.	.			trans	-70.5	119.8	166.4	-168	-13.5	0	0	0	110.2	F321 K322 A323	D319-F321 PolarHBondContact O-N 2.98Å; D319-F321 WeakPolarHBondContact OD1-CD2 3.49Å; D319-F321 PolarHBondContact OD1-N 3.35Å; D319-K322 PolarHBondContact O-N 2.95Å; D319-K322 VanDerWaalsContact O-N 3.09Å; D319-A323 PolarHBondContact O-N 3.18Å
320	L	97.6	Very high	97.6	Very high	13 Å²	13	69.3 Å²	69.3	7%	0.068	38%	0.375	C	S	.	.	H	α-helix	trans	-58.8	-30.2	177.9	67.7	92.3	0	0	0	112.9	L226 V279 I300 A318 K322 V324	L226-L320 HydrophobicContact CD1-CD1 4.28Å; L226-L320 HydrophobicContact CD1-CD2 4.2Å; L226-L320 HydrophobicContact CG-CD1 4.45Å; V279-L320 HydrophobicContact CG1-CB 3.61Å; V279-L320 HydrophobicContact CG1-CD1 4.34Å; V279-L320 HydrophobicContact CG1-CD2 4.14Å; V279-L320 HydrophobicContact CG1-CG 4.24Å; I300-L320 HydrophobicContact CG2-CB 4.11Å; A318-L320 PolarHBondContact O-N 3.09Å; L320-K322 PolarHBondContact O-N 3.25Å; L320-V324 HydrophobicContact CB-CG2 4.38Å; L320-V324 WeakPolarHBondContact O-CB 3.39Å; L320-V324 WeakPolarHBondContact O-CG2 3.37Å; L320-V324 PolarHBondContact O-N 3.25Å
321	F	98.1	Very high	97.4	Very high	60 Å²	60	65.3 Å²	65.3	26%	0.263	36%	0.358	S	S	.	.	H	α-helix	trans	-68	-17.4	179.9	-67	-69.5	0	0	0	112.8	K227 N231 L234 D319 P325	K227-F321 HydrophobicContact CD-CE2 4.06Å; K227-F321 HydrophobicContact CD-CZ 4.13Å; K227-F321 HydrophobicContact CG-CZ 4.34Å; N231-F321 HydrophobicContact CB-CE1 4Å; N231-F321 WeakPolarHBondContact ND2-CE1 3.21Å; L234-F321 HydrophobicContact CD1-CD1 3.82Å; L234-F321 HydrophobicContact CD1-CE1 4.26Å; D319-F321 PolarHBondContact O-N 2.98Å; D319-F321 WeakPolarHBondContact OD1-CD2 3.49Å; D319-F321 PolarHBondContact OD1-N 3.35Å; F321-P325 WeakPolarHBondContact O-CG 3.45Å
322	K	98.1	Very high	96.7	Very high	134 Å²	134	66 Å²	66	58%	0.583	37%	0.365	S	S	*	.	H	α-helix	trans	-100.9	-49.5	171.9	-179.3	180	173.5	-176.9	0	111.3	D319 L320 V324 P325 E326	D319-K322 PolarHBondContact O-N 2.95Å; D319-K322 VanDerWaalsContact O-N 3.09Å; L320-K322 PolarHBondContact O-N 3.25Å; K322-V324 PolarHBondContact O-N 3.09Å; K322-P325 WeakPolarHBondContact O-CD 3.47Å; K322-E326 WeakPolarHBondContact CE-OE1 3.29Å; K322-E326 WeakPolarHBondContact CG-OE1 3.35Å; K322-E326 IonicContact NZ-OE1 3.56Å; K322-E326 WeakPolarHBondContact O-CG 3.43Å; K322-E326 PolarHBondContact O-N 3.23Å
323	A	98	Very high	94.8	Very high	7 Å²	7	75.5 Å²	75.5	6%	0.058	40%	0.402	C	S	.	.	H	α-helix	trans	-66.4	-38.3	-171.5	0	0	0	0	0	113.7	I300 L316 A318 D319 M327	I300-A323 HydrophobicContact CG2-CB 3.98Å; L316-A323 HydrophobicContact CD2-CB 3.78Å; A318-A323 HydrophobicContact CB-CB 4.18Å; D319-A323 PolarHBondContact O-N 3.18Å; A323-M327 WeakPolarHBondContact O-CB 3.37Å; A323-M327 PolarHBondContact O-N 2.69Å
324	V	98.2	Very high	94.6	Very high	1 Å²	1	74.5 Å²	74.5	1%	0.006	40%	0.396	C	S	.	.	H	α-helix	trans	-66.6	-50.2	-179.7	172.9	0	0	0	0	111.5	L234 L235 L238 V279 I300 L320 K322 E326 M327 T328	L234-V324 HydrophobicContact CB-CG1 4.01Å; L235-V324 HydrophobicContact CD2-CG1 4.42Å; L235-V324 HydrophobicContact CD2-CG2 4.5Å; L238-V324 HydrophobicContact CB-CG1 4.3Å; L238-V324 HydrophobicContact CD2-CG1 4.15Å; V279-V324 HydrophobicContact CG1-CG2 3.73Å; V279-V324 HydrophobicContact CG2-CG2 4.19Å; I300-V324 HydrophobicContact CD1-CG2 4.11Å; L320-V324 HydrophobicContact CB-CG2 4.38Å; L320-V324 WeakPolarHBondContact O-CB 3.39Å; L320-V324 WeakPolarHBondContact O-CG2 3.37Å; L320-V324 PolarHBondContact O-N 3.25Å; K322-V324 PolarHBondContact O-N 3.09Å; V324-E326 PolarHBondContact O-N 3.15Å; V324-M327 PolarHBondContact O-N 2.75Å; V324-T328 PolarHBondContact O-N 3.19Å; V324-T328 PolarHBondContact O-OG1 3.16Å
325	P	97.9	Very high	94.4	Very high	52 Å²	52	70.1 Å²	70.1	34%	0.338	39%	0.385	S	S	.	.	H	α-helix	trans	-54.6	-45.7	172.7	-29.2	35.3	0	0	0	114.3	L234 F321 K322 M327 T328 E329	L234-P325 HydrophobicContact CD2-CG 4.14Å; F321-P325 WeakPolarHBondContact O-CG 3.45Å; K322-P325 WeakPolarHBondContact O-CD 3.47Å; P325-M327 VanDerWaalsContact C-N 3.33Å; P325-M327 PolarHBondContact O-N 3.07Å; P325-T328 PolarHBondContact O-N 3.12Å; P325-E329 PolarHBondContact O-N 2.82Å
326	E	97.9	Very high	94.2	Very high	101 Å²	101	70.9 Å²	70.9	47%	0.472	38%	0.375	S	S	.	.	H	α-helix	trans	-62	-40.5	179.1	-73	177.6	174.8	0	0	111.8	K322 V324 E329 A330	K322-E326 WeakPolarHBondContact CE-OE1 3.29Å; K322-E326 WeakPolarHBondContact CG-OE1 3.35Å; K322-E326 IonicContact NZ-OE1 3.56Å; K322-E326 WeakPolarHBondContact O-CG 3.43Å; K322-E326 PolarHBondContact O-N 3.23Å; V324-E326 PolarHBondContact O-N 3.15Å; E326-E329 PolarHBondContact O-N 3.12Å; E326-A330 WeakPolarHBondContact O-CB 3.23Å; E326-A330 PolarHBondContact O-N 3.38Å
327	M	97.3	Very high	94	Very high	58 Å²	58	70.1 Å²	70.1	29%	0.286	37%	0.37	S	S	.	.	H	α-helix	trans	-63.5	-45.7	174.4	-176.7	177.8	-177.2	0	0	111.7	L238 I277 I300 A323 V324 P325 E329 A330 L331	L238-M327 HydrophobicContact CD1-CG 4.17Å; L238-M327 HydrophobicContact CD1-SD 4.27Å; L238-M327 HydrophobicContact CD2-SD 4.18Å; I277-M327 HydrophobicContact CD1-CE 3.76Å; I300-M327 HydrophobicContact CD1-SD 4.49Å; A323-M327 WeakPolarHBondContact O-CB 3.37Å; A323-M327 PolarHBondContact O-N 2.69Å; V324-M327 PolarHBondContact O-N 2.75Å; P325-M327 VanDerWaalsContact C-N 3.33Å; P325-M327 PolarHBondContact O-N 3.07Å; M327-E329 VanDerWaalsContact C-N 3.31Å; M327-E329 PolarHBondContact O-N 3.09Å; M327-A330 PolarHBondContact O-N 2.83Å; M327-L331 HydrophobicContact CE-CD1 4.49Å; M327-L331 HydrophobicContact CG-CD1 4.32Å; M327-L331 WeakPolarHBondContact O-CG 3.26Å; M327-L331 PolarHBondContact O-N 3.18Å; M327-L331 VanDerWaalsContact O-N 3.08Å
328	T	97.2	Very high	93.7	Very high	21 Å²	21	69.3 Å²	69.3	13%	0.129	36%	0.362	C	S	.	.	H	α-helix	trans	-61.4	-39.7	177.7	-58.3	0	0	0	0	111.8	D237 K241 V324 P325 S332	D237-T328 HydrophobicContact CB-CG2 4.48Å; K241-T328 HydrophobicContact CG-CG2 3.94Å; V324-T328 PolarHBondContact O-N 3.19Å; V324-T328 PolarHBondContact O-OG1 3.16Å; P325-T328 PolarHBondContact O-N 3.12Å; T328-S332 PolarHBondContact O-OG 3.35Å; T328-S332 VanDerWaalsContact O-OG 3.13Å
329	E	96.5	Very high	93.4	Very high	123 Å²	123	71.9 Å²	71.9	58%	0.575	37%	0.37	S	S	*	.	H	α-helix	trans	-66.4	-44.4	175.4	-171.1	-173.3	158.6	0	0	111.4	P325 E326 M327 L331 S332	P325-E329 PolarHBondContact O-N 2.82Å; E326-E329 PolarHBondContact O-N 3.12Å; M327-E329 VanDerWaalsContact C-N 3.31Å; M327-E329 PolarHBondContact O-N 3.09Å; E329-L331 VanDerWaalsContact C-N 3.26Å; E329-L331 PolarHBondContact O-N 3.42Å; E329-S332 WeakPolarHBondContact O-CB 3.37Å; E329-S332 PolarHBondContact O-N 3.31Å
330	A	95.6	Very high	93.1	Very high	58 Å²	58	70.9 Å²	70.9	48%	0.479	36%	0.363	S	S	.	.	H	α-helix	trans	-61.2	-33.3	178.6	0	0	0	0	0	112.9	E326 M327 S332 K333	E326-A330 WeakPolarHBondContact O-CB 3.23Å; E326-A330 PolarHBondContact O-N 3.38Å; M327-A330 PolarHBondContact O-N 2.83Å; A330-S332 PolarHBondContact O-N 3.48Å; A330-K333 PolarHBondContact O-N 2.89Å
331	L	92.3	Very high	92.8	Very high	76 Å²	76	75.3 Å²	75.3	40%	0.398	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-7.1	175.4	-69.7	168.9	0	0	0	114.1	L238 K241 L242 M327 E329	L238-L331 HydrophobicContact CD1-CD1 3.64Å; K241-L331 HydrophobicContact CB-CB 4.45Å; L242-L331 HydrophobicContact CD1-CD1 4.26Å; L242-L331 HydrophobicContact CD2-CD1 3.71Å; L242-L331 HydrophobicContact CD2-CD2 4.16Å; L242-L331 HydrophobicContact CG-CD1 3.95Å; M327-L331 HydrophobicContact CE-CD1 4.49Å; M327-L331 HydrophobicContact CG-CD1 4.32Å; M327-L331 WeakPolarHBondContact O-CG 3.26Å; M327-L331 PolarHBondContact O-N 3.18Å; M327-L331 VanDerWaalsContact O-N 3.08Å; E329-L331 VanDerWaalsContact C-N 3.26Å; E329-L331 PolarHBondContact O-N 3.42Å
332	S	79.9	Confident	92.3	Very high	67 Å²	67	76.6 Å²	76.6	47%	0.469	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	2.7	177.7	-57.1	0	0	0	0	113.3	K241 T328 E329 A330	K241-S332 VanDerWaalsContact CE-OG 3.24Å; K241-S332 WeakPolarHBondContact CE-OG 3.42Å; K241-S332 PolarHBondContact NZ-OG 3.48Å; T328-S332 PolarHBondContact O-OG 3.35Å; T328-S332 VanDerWaalsContact O-OG 3.13Å; E329-S332 WeakPolarHBondContact O-CB 3.37Å; E329-S332 PolarHBondContact O-N 3.31Å; A330-S332 PolarHBondContact O-N 3.48Å
333	K	59	Low	91.8	Very high	221 Å²	221	71.4 Å²	71.4	96%	0.961	38%	0.379	S	S	*	.			trans	-95.1	0	175.3	-65.4	179.8	-178.8	173.7	0	110.3	A330	A330-K333 PolarHBondContact O-N 2.89Å

Retrieved 333 of 333 residues in 94.1 ms (Link to these results)

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