A0A093K701_STRCA Loading...

GTP-binding protein Di-Ras2

Displays low GTPase activity and exists predominantly in the GTP-bound form.

AlphaFold DB , UniProt , Accession A0A093K701, Species STRCA (Struthio camelus australis), Gene n/a, Length 199 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.9	Very low	71.9	Confident	231 Å²	231	89.2 Å²	89.2	100%	1.138	46%	0.457	S	S	*	.				0	128.7	0	-65.5	-173.2	163.1	0	0	106.7	E3	M1-E3 PolarHBondContact O-N 3.33Å
2	P	41.2	Very low	74.1	Confident	132 Å²	132	81.8 Å²	81.8	86%	0.857	42%	0.419	S	S	*	.			trans	-64.9	125.7	176.8	25	-25.8	0	0	0	107.7	Q4	P2-Q4 PolarHBondContact O-N 3.36Å
3	E	43.9	Very low	75.9	Confident	189 Å²	189	75.8 Å²	75.8	88%	0.883	39%	0.389	S	S	*	.			trans	-49.2	126.4	175.2	-82.7	-179	141.8	0	0	109.1	M1 S5	M1-E3 PolarHBondContact O-N 3.33Å; E3-S5 VanDerWaalsContact C-N 3.34Å; E3-S5 PolarHBondContact O-N 3.26Å
4	Q	50.1	Low	77.4	Confident	195 Å²	195	70.6 Å²	70.6	91%	0.911	36%	0.362	S	S	*	.			trans	-66.3	99.3	174.3	-152.8	158.6	43	0	0	106.4	P2 N6	P2-Q4 PolarHBondContact O-N 3.36Å; Q4-N6 PolarHBondContact O-N 2.93Å
5	S	62.8	Low	78.7	Confident	61 Å²	61	66.5 Å²	66.5	43%	0.427	34%	0.343	S	S	.	.			trans	-59.2	128.6	-174.5	84.6	0	0	0	0	108.8	E3 D7	E3-S5 VanDerWaalsContact C-N 3.34Å; E3-S5 PolarHBondContact O-N 3.26Å; S5-D7 WeakPolarHBondContact CB-OD2 3.33Å; S5-D7 PolarHBondContact O-N 3.3Å; S5-D7 PolarHBondContact OG-OD2 2.77Å
6	N	77.9	Confident	79.6	Confident	74 Å²	74	64.4 Å²	64.4	40%	0.396	34%	0.343	S	S	.	.			trans	-76.1	24.1	-176.7	-153	14	0	0	0	112	Q4 C55 R172	Q4-N6 PolarHBondContact O-N 2.93Å; N6-C55 HydrophobicContact CB-CB 4.2Å; N6-C55 WeakPolarHBondContact O-CB 3.49Å; N6-R172 PolarHBondContact OD1-NH1 3.16Å
7	D	89.6	Confident	80.5	Confident	19 Å²	19	62.2 Å²	62.2	10%	0.102	34%	0.34	C	S	.	.			trans	-70.2	134.9	-168.3	-63.6	-21.5	0	0	0	111.2	S5 T56 Q58 H80	S5-D7 WeakPolarHBondContact CB-OD2 3.33Å; S5-D7 PolarHBondContact O-N 3.3Å; S5-D7 PolarHBondContact OG-OD2 2.77Å; D7-T56 CarbonylContact C-O 3.42Å; D7-T56 VanDerWaalsContact CA-O 3.28Å; D7-T56 WeakPolarHBondContact CA-O 3.45Å; D7-T56 VanDerWaalsContact OD1-CB 3.23Å; D7-T56 WeakPolarHBondContact OD1-CB 3.45Å; D7-T56 PolarHBondContact OD1-OG1 2.93Å; D7-Q58 HydrophobicContact CB-CG 4.24Å; D7-Q58 PolarHBondContact OD2-NE2 2.88Å; D7-H80 PolarHBondContact O-CE1 3.11Å; D7-H80 PolarHBondContact O-ND1 2.65Å
8	Y	94.6	Very high	81.4	Confident	2 Å²	2	59 Å²	59	1%	0.008	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	127.6	170	-160.9	-97.5	0	0	0	109	V10 T56 L57 Q58 H80 A81 L166 E169 V174	Y8-V10 HydrophobicContact CD1-CG2 4.18Å; Y8-V10 HydrophobicContact CE1-CG2 4.15Å; Y8-T56 PolarHBondContact N-O 3.3Å; Y8-L57 HydrophobicContact CD1-CD1 3.85Å; Y8-L57 CarbonylContact O-C 3.57Å; Y8-L57 WeakPolarHBondContact O-CA 3.34Å; Y8-Q58 PolarHBondContact O-N 3.44Å; Y8-H80 HydrophobicContact CD2-CB 4.19Å; Y8-H80 HydrophobicContact CE1-CB 4.42Å; Y8-H80 HydrophobicContact CE2-CB 3.82Å; Y8-A81 HydrophobicContact CE1-CB 3.93Å; Y8-L166 HydrophobicContact CD1-CD2 3.52Å; Y8-L166 HydrophobicContact CE1-CD2 3.43Å; Y8-L166 VanDerWaalsContact CE1-CD2 3.43Å; Y8-L166 HydrophobicContact CG-CD2 4.47Å; Y8-E169 HydrophobicContact CE2-CB 4.41Å; Y8-E169 HydrophobicContact CE2-CG 3.83Å; Y8-E169 VanDerWaalsContact CE2-OE2 3.3Å; Y8-E169 WeakPolarHBondContact CE2-OE2 3.32Å; Y8-E169 PolarHBondContact OH-OE2 3.2Å; Y8-V174 HydrophobicContact CD2-CG2 4.01Å; Y8-V174 HydrophobicContact CE2-CG2 4.16Å; Y8-V174 HydrophobicContact CG-CG1 4.39Å; Y8-V174 HydrophobicContact CG-CG2 4.48Å
9	R	96.6	Very high	82.2	Confident	73 Å²	73	56.5 Å²	56.5	28%	0.275	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	113.3	-166.1	-65.6	179.4	-177.5	165.7	4.9	109.3	Q58 K78 H80 A81	R9-Q58 CarbonylContact C-O 3.56Å; R9-Q58 WeakPolarHBondContact CA-O 3.27Å; R9-Q58 HydrophobicContact CG-CB 4.24Å; R9-K78 WeakPolarHBondContact CD-O 3.3Å; R9-H80 PolarHBondContact N-ND1 2.79Å; R9-H80 WeakPolarHBondContact O-CA 3.35Å; R9-H80 WeakPolarHBondContact O-CB 3.38Å; R9-H80 PolarHBondContact O-N 3.39Å; R9-A81 PolarHBondContact O-N 3Å; R9-A81 VanDerWaalsContact O-N 3.1Å
10	V	98.1	Very high	82.9	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.006	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	129.9	174.8	176.7	0	0	0	0	108	Y8 L57 Q58 I59 T60 A81 I83 L165	Y8-V10 HydrophobicContact CD1-CG2 4.18Å; Y8-V10 HydrophobicContact CE1-CG2 4.15Å; V10-L57 HydrophobicContact CG2-CD1 3.73Å; V10-Q58 PolarHBondContact N-O 2.96Å; V10-I59 HydrophobicContact CB-CG1 4.38Å; V10-I59 WeakPolarHBondContact O-CA 3.13Å; V10-T60 PolarHBondContact O-N 2.99Å; V10-A81 WeakPolarHBondContact CA-O 3.42Å; V10-A81 HydrophobicContact CG2-CB 4.2Å; V10-I83 HydrophobicContact CG1-CD1 3.76Å; V10-I83 HydrophobicContact CG1-CG1 3.94Å; V10-L165 HydrophobicContact CB-CD2 4.49Å; V10-L165 HydrophobicContact CG1-CD2 3.68Å; V10-L165 HydrophobicContact CG2-CD2 3.93Å
11	V	98.2	Very high	83.6	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.024	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	130.9	175.1	-171.8	0	0	0	0	109.3	F13 T62 A81 F82 I83	V11-F13 HydrophobicContact CB-CE2 4.06Å; V11-F13 HydrophobicContact CB-CZ 4.48Å; V11-F13 HydrophobicContact CG1-CD2 4.05Å; V11-F13 HydrophobicContact CG1-CE1 4.07Å; V11-F13 HydrophobicContact CG1-CE2 3.48Å; V11-F13 VanDerWaalsContact CG1-CE2 3.48Å; V11-F13 HydrophobicContact CG1-CZ 3.49Å; V11-F13 VanDerWaalsContact CG1-CZ 3.49Å; V11-T62 HydrophobicContact CG1-CG2 3.94Å; V11-A81 PolarHBondContact N-O 2.83Å; V11-F82 HydrophobicContact CB-CD1 4.02Å; V11-F82 HydrophobicContact CB-CE1 4.17Å; V11-F82 HydrophobicContact CG2-CE1 4.25Å; V11-F82 WeakPolarHBondContact O-CA 3.12Å; V11-I83 PolarHBondContact O-N 3.22Å
12	V	98.3	Very high	86.4	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	116.3	-178.8	-170	0	0	0	0	109.6	K20 V24 I59 T60 T62 I83 V85	V12-K20 HydrophobicContact CG1-CB 3.87Å; V12-K20 HydrophobicContact CG1-CD 4.25Å; V12-K20 HydrophobicContact CG1-CG 3.99Å; V12-V24 HydrophobicContact CG2-CG2 3.87Å; V12-I59 HydrophobicContact CG2-CG2 3.83Å; V12-T60 PolarHBondContact N-O 3.23Å; V12-T62 WeakPolarHBondContact O-CB 3.46Å; V12-T62 VanDerWaalsContact O-CG2 3.29Å; V12-T62 WeakPolarHBondContact O-CG2 3.48Å; V12-T62 PolarHBondContact O-OG1 3.29Å; V12-I83 WeakPolarHBondContact CA-O 3.41Å; V12-I83 HydrophobicContact CG1-CB 4.31Å; V12-I83 HydrophobicContact CG1-CG2 4.32Å; V12-I83 HydrophobicContact CG2-CB 4.34Å; V12-I83 HydrophobicContact CG2-CD1 4.28Å; V12-V85 HydrophobicContact CG1-CG2 3.68Å
13	F	97.8	Very high	89.1	Confident	4 Å²	4	37 Å²	37	2%	0.018	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	163.4	177.6	-69.8	-65.7	0	0	0	111.6	V11 T62 Q72 I76 F82 I83 L84 V85 I100 I104	V11-F13 HydrophobicContact CB-CE2 4.06Å; V11-F13 HydrophobicContact CB-CZ 4.48Å; V11-F13 HydrophobicContact CG1-CD2 4.05Å; V11-F13 HydrophobicContact CG1-CE1 4.07Å; V11-F13 HydrophobicContact CG1-CE2 3.48Å; V11-F13 VanDerWaalsContact CG1-CE2 3.48Å; V11-F13 HydrophobicContact CG1-CZ 3.49Å; V11-F13 VanDerWaalsContact CG1-CZ 3.49Å; F13-T62 HydrophobicContact CD1-CG2 4.09Å; F13-T62 HydrophobicContact CE1-CG2 3.93Å; F13-Q72 HydrophobicContact CE1-CG 3.84Å; F13-Q72 HydrophobicContact CZ-CG 4.08Å; F13-I76 HydrophobicContact CE2-CG1 3.88Å; F13-I76 HydrophobicContact CZ-CG1 3.89Å; F13-F82 HydrophobicContact CD2-CD1 4.29Å; F13-F82 AromaticContact CE2-CD1 3.92Å; F13-F82 HydrophobicContact CE2-CD1 3.92Å; F13-F82 HydrophobicContact CE2-CE1 4.24Å; F13-I83 PolarHBondContact N-O 3.17Å; F13-L84 HydrophobicContact CB-CD2 3.92Å; F13-L84 HydrophobicContact CD2-CD2 4.28Å; F13-V85 PolarHBondContact O-N 3.44Å; F13-I100 HydrophobicContact CB-CD1 4.15Å; F13-I100 HydrophobicContact CB-CG2 3.92Å; F13-I100 HydrophobicContact CD1-CG2 4.31Å; F13-I100 HydrophobicContact CD2-CG2 3.87Å; F13-I100 HydrophobicContact CE2-CG2 4.44Å; F13-I100 HydrophobicContact CG-CG2 3.79Å; F13-I104 HydrophobicContact CD2-CD1 4.48Å
14	G	97.3	Very high	91.7	Very high	2 Å²	2	28 Å²	28	2%	0.021	17%	0.165	C	C	.	.			trans	143.3	159.1	-177.5	0	0	0	0	0	112.1	K20 G64 V85	G14-K20 WeakPolarHBondContact O-CE 3.32Å; G14-K20 PolarHBondContact O-NZ 3.45Å; G14-G64 WeakPolarHBondContact O-CA 3.23Å; G14-V85 WeakPolarHBondContact CA-O 3.22Å
15	A	95.8	Very high	93.8	Very high	9 Å²	9	20.1 Å²	20.1	7%	0.074	13%	0.129	C	C	.	.			trans	-58.9	168.1	-177.3	0	0	0	0	0	113.3	V18 K20 S65 E96	A15-V18 HydrophobicContact CB-CG1 3.85Å; A15-V18 VanDerWaalsContact O-CG2 3.27Å; A15-V18 WeakPolarHBondContact O-CG2 3.23Å; A15-K20 PolarHBondContact O-NZ 3.39Å; A15-S65 WeakPolarHBondContact CA-OG 3.39Å; A15-E96 VanDerWaalsContact CB-OE2 3.3Å; A15-E96 WeakPolarHBondContact CB-OE2 3.42Å
16	G	93.8	Very high	95.5	Very high	33 Å²	33	19.3 Å²	19.3	34%	0.34	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	143.3	169.7	0	0	0	0	0	111.3	V18	G16-V18 PolarHBondContact O-N 2.87Å; G16-V18 VanDerWaalsContact O-N 3.09Å
17	G	93.9	Very high	96.4	Very high	28 Å²	28	17 Å²	17	29%	0.289	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	-2.3	172.8	0	0	0	0	0	117.7	G19 Y36 K122	G17-G19 PolarHBondContact O-N 2.71Å; G17-Y36 PolarHBondContact N-OH 3.28Å; G17-K122 VanDerWaalsContact O-CE 3.25Å; G17-K122 WeakPolarHBondContact O-CE 3.46Å; G17-K122 PolarHBondContact O-NZ 3.27Å
18	V	97	Very high	96.6	Very high	4 Å²	4	17.9 Å²	17.9	2%	0.024	11%	0.11	C	C	.	.	S	Bend	trans	-70.6	-14.7	177.9	-56.2	0	0	0	0	113.8	A15 G16 K20 V85 N121	A15-V18 HydrophobicContact CB-CG1 3.85Å; A15-V18 VanDerWaalsContact O-CG2 3.27Å; A15-V18 WeakPolarHBondContact O-CG2 3.23Å; G16-V18 PolarHBondContact O-N 2.87Å; G16-V18 VanDerWaalsContact O-N 3.09Å; V18-K20 HydrophobicContact CG2-CD 4.47Å; V18-K20 HydrophobicContact CG2-CG 3.7Å; V18-V85 HydrophobicContact CB-CG1 4.26Å; V18-V85 HydrophobicContact CG2-CB 3.96Å; V18-V85 HydrophobicContact CG2-CG1 3.78Å; V18-N121 PolarHBondContact O-ND2 3.12Å
19	G	96.9	Very high	96.5	Very high	11 Å²	11	24 Å²	24	11%	0.113	14%	0.136	C	C	.	.	S	Bend	trans	100.2	23.4	175.7	0	0	0	0	0	116	G17 S22 L23	G17-G19 PolarHBondContact O-N 2.71Å; G19-S22 PolarHBondContact O-N 2.83Å; G19-L23 PolarHBondContact O-N 3.02Å
20	K	97.3	Very high	96.4	Very high	9 Å²	9	22.8 Å²	22.8	4%	0.039	15%	0.146	C	C	.	.	H	α-helix	trans	-49.3	-58.5	173.2	-57	-174.1	-62.3	-73.4	0	112.1	V12 G14 A15 V18 S22 L23 V24 D61 T62 G64 V85	V12-K20 HydrophobicContact CG1-CB 3.87Å; V12-K20 HydrophobicContact CG1-CD 4.25Å; V12-K20 HydrophobicContact CG1-CG 3.99Å; G14-K20 WeakPolarHBondContact O-CE 3.32Å; G14-K20 PolarHBondContact O-NZ 3.45Å; A15-K20 PolarHBondContact O-NZ 3.39Å; V18-K20 HydrophobicContact CG2-CD 4.47Å; V18-K20 HydrophobicContact CG2-CG 3.7Å; K20-S22 VanDerWaalsContact C-N 3.29Å; K20-S22 PolarHBondContact O-N 2.97Å; K20-L23 PolarHBondContact O-N 2.93Å; K20-L23 VanDerWaalsContact O-N 3.16Å; K20-V24 WeakPolarHBondContact O-CG2 3.38Å; K20-V24 PolarHBondContact O-N 2.8Å; K20-D61 WeakPolarHBondContact CB-OD1 3.37Å; K20-T62 WeakPolarHBondContact CE-O 3.49Å; K20-G64 VanDerWaalsContact NZ-CA 3.3Å; K20-V85 HydrophobicContact CG-CB 4.21Å; K20-V85 HydrophobicContact CG-CG2 4.3Å
21	S	96.4	Very high	96.1	Very high	24 Å²	24	25.7 Å²	25.7	17%	0.168	16%	0.164	C	C	.	.	H	α-helix	trans	-60.2	-38.4	178.9	-47.8	0	0	0	0	112.5	V24 L25 T39 D61	S21-V24 PolarHBondContact O-N 2.85Å; S21-L25 VanDerWaalsContact O-CB 3.23Å; S21-L25 WeakPolarHBondContact O-CB 3.28Å; S21-L25 VanDerWaalsContact O-CG 3.26Å; S21-L25 WeakPolarHBondContact O-CG 3.22Å; S21-L25 PolarHBondContact O-N 3.08Å; S21-T39 PolarHBondContact OG-OG1 3.41Å; S21-D61 WeakPolarHBondContact CA-OD2 3.46Å; S21-D61 WeakPolarHBondContact CB-OD2 3.42Å; S21-D61 PolarHBondContact N-OD1 2.84Å; S21-D61 PolarHBondContact OG-OD1 2.54Å; S21-D61 PolarHBondContact OG-OD2 3.49Å
22	S	97.2	Very high	95.9	Very high	32 Å²	32	28.6 Å²	28.6	22%	0.224	18%	0.176	C	C	.	.	H	α-helix	trans	-65.4	-40.5	177.5	-54.9	0	0	0	0	112	G19 K20 R26	G19-S22 PolarHBondContact O-N 2.83Å; K20-S22 VanDerWaalsContact C-N 3.29Å; K20-S22 PolarHBondContact O-N 2.97Å; S22-R26 WeakPolarHBondContact O-CB 3.48Å; S22-R26 PolarHBondContact O-N 2.83Å
23	L	98.3	Very high	95.4	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-64.2	-47.8	174.3	-75.1	170.7	0	0	0	111.3	G19 K20 R26 F27 V85 V119 N121 T150 A152 V158 L161	G19-L23 PolarHBondContact O-N 3.02Å; K20-L23 PolarHBondContact O-N 2.93Å; K20-L23 VanDerWaalsContact O-N 3.16Å; L23-R26 PolarHBondContact O-N 3.36Å; L23-F27 WeakPolarHBondContact O-CB 3.47Å; L23-F27 PolarHBondContact O-N 3.47Å; L23-V85 HydrophobicContact CD1-CG1 3.93Å; L23-V85 HydrophobicContact CD1-CG2 4.06Å; L23-V119 HydrophobicContact CD1-CG1 4.17Å; L23-N121 HydrophobicContact CD1-CB 4.29Å; L23-T150 HydrophobicContact CD2-CG2 4.5Å; L23-A152 HydrophobicContact CD2-CB 3.96Å; L23-A152 HydrophobicContact CG-CB 4.18Å; L23-V158 HydrophobicContact CD2-CG2 3.97Å; L23-L161 HydrophobicContact CD1-CD2 4.32Å; L23-L161 HydrophobicContact CD2-CD2 4.5Å
24	V	97.1	Very high	94.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.9	-47.7	-179.2	177.9	0	0	0	0	111.1	V12 K20 S21 R26 F27 V28 Y44 I59 D61	V12-V24 HydrophobicContact CG2-CG2 3.87Å; K20-V24 WeakPolarHBondContact O-CG2 3.38Å; K20-V24 PolarHBondContact O-N 2.8Å; S21-V24 PolarHBondContact O-N 2.85Å; V24-R26 PolarHBondContact O-N 2.91Å; V24-F27 PolarHBondContact O-N 2.98Å; V24-V28 HydrophobicContact CG1-CG2 4.31Å; V24-V28 WeakPolarHBondContact O-CB 3.5Å; V24-V28 VanDerWaalsContact O-CG2 3.3Å; V24-V28 WeakPolarHBondContact O-CG2 3.22Å; V24-V28 PolarHBondContact O-N 2.84Å; V24-Y44 HydrophobicContact CG1-CD2 3.27Å; V24-Y44 HydrophobicContact CG1-CE2 3.68Å; V24-Y44 HydrophobicContact CG1-CG 3.75Å; V24-I59 HydrophobicContact CG1-CB 4.42Å; V24-I59 HydrophobicContact CG1-CG2 3.91Å; V24-I59 HydrophobicContact CG2-CG2 3.79Å; V24-D61 HydrophobicContact CG2-CB 4.33Å
25	L	95.6	Very high	94.1	Very high	29 Å²	29	47.4 Å²	47.4	15%	0.152	27%	0.266	C	S	.	.	H	α-helix	trans	-65.6	-38.9	177.6	-73.8	171.8	0	0	0	112.4	S21 F27 K29 G30 T31 Y44	S21-L25 VanDerWaalsContact O-CB 3.23Å; S21-L25 WeakPolarHBondContact O-CB 3.28Å; S21-L25 VanDerWaalsContact O-CG 3.26Å; S21-L25 WeakPolarHBondContact O-CG 3.22Å; S21-L25 PolarHBondContact O-N 3.08Å; L25-F27 VanDerWaalsContact C-N 3.32Å; L25-K29 HydrophobicContact CD2-CD 3.9Å; L25-K29 WeakPolarHBondContact O-CA 3.33Å; L25-K29 WeakPolarHBondContact O-CB 3.45Å; L25-K29 PolarHBondContact O-N 3.34Å; L25-G30 PolarHBondContact O-N 2.9Å; L25-T31 CarbonylContact C-O 3.42Å; L25-Y44 HydrophobicContact CD2-CE1 3.61Å; L25-Y44 WeakPolarHBondContact CD2-OH 3.4Å
26	R	97.1	Very high	93.2	Very high	44 Å²	44	53.4 Å²	53.4	17%	0.166	29%	0.288	C	S	.	.	H	α-helix	trans	-63.5	-42.7	176.7	178.6	62.6	79.9	-176.9	17.1	110.7	S22 L23 V24 G30 T31 A152 K153 N155 V158	S22-R26 WeakPolarHBondContact O-CB 3.48Å; S22-R26 PolarHBondContact O-N 2.83Å; L23-R26 PolarHBondContact O-N 3.36Å; V24-R26 PolarHBondContact O-N 2.91Å; R26-G30 PolarHBondContact NH1-O 3.3Å; R26-G30 WeakPolarHBondContact O-CA 3.16Å; R26-G30 PolarHBondContact O-N 3.41Å; R26-T31 WeakPolarHBondContact CA-O 3.16Å; R26-T31 PolarHBondContact N-O 2.77Å; R26-A152 PolarHBondContact NE-O 3.41Å; R26-A152 PolarHBondContact NH2-O 3.21Å; R26-K153 PolarHBondContact NH2-O 2.89Å; R26-N155 WeakPolarHBondContact CD-OD1 3.38Å; R26-N155 HydrophobicContact CG-CB 4.27Å; R26-N155 WeakPolarHBondContact CG-OD1 3.45Å; R26-V158 HydrophobicContact CB-CG1 4.09Å; R26-V158 HydrophobicContact CG-CB 4.21Å; R26-V158 HydrophobicContact CG-CG1 3.86Å; R26-V158 HydrophobicContact CG-CG2 3.99Å
27	F	96.7	Very high	92.6	Very high	27 Å²	27	57.2 Å²	57.2	12%	0.118	30%	0.299	C	S	.	.	H	α-helix	trans	-65.8	-50.1	176.8	175.1	-109.8	0	0	0	112.9	L23 V24 L25 L57 I59 V158 F162 L176	L23-F27 WeakPolarHBondContact O-CB 3.47Å; L23-F27 PolarHBondContact O-N 3.47Å; V24-F27 PolarHBondContact O-N 2.98Å; L25-F27 VanDerWaalsContact C-N 3.32Å; F27-L57 HydrophobicContact CE1-CD2 4.16Å; F27-L57 HydrophobicContact CZ-CD2 4.48Å; F27-I59 HydrophobicContact CD1-CD1 3.61Å; F27-I59 HydrophobicContact CE1-CD1 3.59Å; F27-V158 HydrophobicContact CB-CG1 3.87Å; F27-F162 HydrophobicContact CB-CD2 3.73Å; F27-F162 HydrophobicContact CB-CE2 3.39Å; F27-F162 HydrophobicContact CB-CZ 4.1Å; F27-F162 HydrophobicContact CD1-CD1 4.1Å; F27-F162 AromaticContact CD1-CD2 3.76Å; F27-F162 HydrophobicContact CD1-CD2 3.76Å; F27-F162 HydrophobicContact CD1-CE1 4.17Å; F27-F162 AromaticContact CD1-CE2 3.87Å; F27-F162 HydrophobicContact CD1-CE2 3.87Å; F27-F162 AromaticContact CD1-CG 3.91Å; F27-F162 HydrophobicContact CD1-CG 3.91Å; F27-F162 HydrophobicContact CD1-CZ 4.07Å; F27-F162 HydrophobicContact CD2-CB 4.09Å; F27-F162 AromaticContact CD2-CD2 3.36Å; F27-F162 HydrophobicContact CD2-CD2 3.36Å; F27-F162 AromaticContact CD2-CE2 3.99Å; F27-F162 HydrophobicContact CD2-CE2 3.99Å; F27-F162 AromaticContact CD2-CG 3.86Å; F27-F162 HydrophobicContact CD2-CG 3.86Å; F27-F162 HydrophobicContact CE1-CB 4.28Å; F27-F162 HydrophobicContact CE1-CD1 4.12Å; F27-F162 HydrophobicContact CE1-CD2 4.24Å; F27-F162 AromaticContact CE1-CG 3.95Å; F27-F162 HydrophobicContact CE1-CG 3.95Å; F27-F162 HydrophobicContact CE2-CB 3.67Å; F27-F162 AromaticContact CE2-CD2 3.86Å; F27-F162 HydrophobicContact CE2-CD2 3.86Å; F27-F162 AromaticContact CE2-CG 3.89Å; F27-F162 HydrophobicContact CE2-CG 3.89Å; F27-F162 HydrophobicContact CG-CD1 4.47Å; F27-F162 AromaticContact CG-CD2 3.3Å; F27-F162 HydrophobicContact CG-CD2 3.3Å; F27-F162 AromaticContact CG-CE2 3.46Å; F27-F162 HydrophobicContact CG-CE2 3.46Å; F27-F162 VanDerWaalsContact CG-CE2 3.46Å; F27-F162 AromaticContact CG-CG 3.88Å; F27-F162 HydrophobicContact CG-CG 3.88Å; F27-F162 HydrophobicContact CG-CZ 4.12Å; F27-F162 HydrophobicContact CZ-CB 3.79Å; F27-F162 HydrophobicContact CZ-CD1 4.48Å; F27-F162 HydrophobicContact CZ-CD2 4.28Å; F27-F162 AromaticContact CZ-CG 3.94Å; F27-F162 HydrophobicContact CZ-CG 3.94Å; F27-L176 HydrophobicContact CE2-CD1 3.75Å; F27-L176 HydrophobicContact CE2-CD2 4.34Å; F27-L176 HydrophobicContact CZ-CD1 3.95Å; F27-L176 HydrophobicContact CZ-CD2 3.67Å; F27-L176 HydrophobicContact CZ-CG 4.47Å
28	V	94.3	Very high	92	Very high	37 Å²	37	60.3 Å²	60.3	22%	0.224	31%	0.314	C	S	.	.	H	α-helix	trans	-79.3	-42.3	-171.7	177.1	0	0	0	0	112.4	V24 Y44 I59	V24-V28 HydrophobicContact CG1-CG2 4.31Å; V24-V28 WeakPolarHBondContact O-CB 3.5Å; V24-V28 VanDerWaalsContact O-CG2 3.3Å; V24-V28 WeakPolarHBondContact O-CG2 3.22Å; V24-V28 PolarHBondContact O-N 2.84Å; V28-Y44 HydrophobicContact CB-CD1 4.48Å; V28-Y44 HydrophobicContact CG1-CD1 4.21Å; V28-Y44 HydrophobicContact CG2-CG 4.37Å; V28-I59 HydrophobicContact CG2-CD1 4.13Å
29	K	92.9	Very high	91.4	Very high	130 Å²	130	61.4 Å²	61.4	57%	0.565	32%	0.321	S	S	*	.	H	α-helix	trans	-111.6	-9.6	-171.3	-60.8	-174.3	-176.6	172.7	0	113.4	L25 T31	L25-K29 HydrophobicContact CD2-CD 3.9Å; L25-K29 WeakPolarHBondContact O-CA 3.33Å; L25-K29 WeakPolarHBondContact O-CB 3.45Å; L25-K29 PolarHBondContact O-N 3.34Å; K29-T31 HydrophobicContact CB-CG2 4.23Å; K29-T31 PolarHBondContact O-N 2.93Å
30	G	93.6	Very high	90.7	Very high	47 Å²	47	68 Å²	68	49%	0.485	35%	0.352	S	S	.	.	S	Bend	trans	70.1	10	-173.9	0	0	0	0	0	113.5	L25 R26	L25-G30 PolarHBondContact O-N 2.9Å; R26-G30 PolarHBondContact NH1-O 3.3Å; R26-G30 WeakPolarHBondContact O-CA 3.16Å; R26-G30 PolarHBondContact O-N 3.41Å
31	T	92.7	Very high	90.2	Very high	63 Å²	63	71.3 Å²	71.3	39%	0.387	37%	0.368	S	S	.	.			trans	-106.6	151.1	-174.3	58.3	0	0	0	0	112.1	L25 R26 K29	L25-T31 CarbonylContact C-O 3.42Å; R26-T31 WeakPolarHBondContact CA-O 3.16Å; R26-T31 PolarHBondContact N-O 2.77Å; K29-T31 HydrophobicContact CB-CG2 4.23Å; K29-T31 PolarHBondContact O-N 2.93Å
32	F	93.1	Very high	89.9	Confident	64 Å²	64	73.8 Å²	73.8	28%	0.281	38%	0.379	S	S	.	.			trans	-132.8	147.1	170.4	173.6	-98.1	0	0	0	109.7	E34 A152 K153	F32-E34 HydrophobicContact CD1-CG 4.4Å; F32-E34 HydrophobicContact CE1-CG 3.65Å; F32-E34 HydrophobicContact CZ-CG 4.49Å; F32-A152 HydrophobicContact CD2-CB 4.24Å; F32-A152 HydrophobicContact CE2-CB 4.28Å; F32-K153 HydrophobicContact CD1-CG 4.41Å; F32-K153 HydrophobicContact CE1-CB 4.07Å; F32-K153 HydrophobicContact CE1-CG 3.79Å; F32-K153 HydrophobicContact CE2-CB 3.98Å; F32-K153 HydrophobicContact CZ-CB 3.72Å; F32-K153 HydrophobicContact CZ-CG 3.91Å
33	R	87.8	Confident	89.8	Confident	160 Å²	160	74.6 Å²	74.6	60%	0.604	38%	0.383	S	S	*	.			trans	-127.6	131.5	176.3	-65.8	-178.4	177.8	-178.2	-2.2	108
34	E	83.1	Confident	89.6	Confident	159 Å²	159	75.9 Å²	75.9	74%	0.743	39%	0.388	S	S	*	.	S	Bend	trans	-75.5	-32	175.8	-73.6	-174.8	169.4	0	0	112	F32 Y36	F32-E34 HydrophobicContact CD1-CG 4.4Å; F32-E34 HydrophobicContact CE1-CG 3.65Å; F32-E34 HydrophobicContact CZ-CG 4.49Å; E34-Y36 PolarHBondContact O-N 2.81Å
35	S	84.6	Confident	89.5	Confident	84 Å²	84	82.9 Å²	82.9	59%	0.587	41%	0.414	S	S	*	.	S	Bend	trans	-70.4	128.1	178.2	52.7	0	0	0	0	111.5
36	Y	78.9	Confident	89.2	Confident	135 Å²	135	84.3 Å²	84.3	53%	0.529	42%	0.42	S	S	.	.			trans	-82.4	117.2	173.2	-179.1	-116.4	0	0	0	110.3	G17 E34 P38	G17-Y36 PolarHBondContact N-OH 3.28Å; E34-Y36 PolarHBondContact O-N 2.81Å; Y36-P38 HydrophobicContact CD1-CG 4.37Å; Y36-P38 HydrophobicContact CE1-CB 4.44Å; Y36-P38 HydrophobicContact CE1-CG 3.82Å
37	I	81.1	Confident	89	Confident	113 Å²	113	86 Å²	86	58%	0.579	44%	0.435	S	S	*	.			trans	-112.9	117.5	167.7	-58.8	175.9	0	0	0	105.9	T39	I37-T39 PolarHBondContact O-N 3.23Å
38	P	81.1	Confident	88.7	Confident	92 Å²	92	84.7 Å²	84.7	60%	0.597	43%	0.429	S	S	*	.			trans	-54.9	128.4	175.3	-25.2	33.5	0	0	0	111.4	Y36	Y36-P38 HydrophobicContact CD1-CG 4.37Å; Y36-P38 HydrophobicContact CE1-CB 4.44Å; Y36-P38 HydrophobicContact CE1-CG 3.82Å
39	T	84.1	Confident	88.4	Confident	28 Å²	28	83.2 Å²	83.2	17%	0.172	42%	0.42	C	S	.	.			trans	-83.5	142.2	179.9	-58.6	0	0	0	0	110.1	S21 I37 T63	S21-T39 PolarHBondContact OG-OG1 3.41Å; I37-T39 PolarHBondContact O-N 3.23Å; T39-T63 WeakPolarHBondContact O-CA 3.48Å; T39-T63 WeakPolarHBondContact O-CG2 3.49Å
40	I	82.9	Confident	88	Confident	148 Å²	148	77 Å²	77	76%	0.759	39%	0.394	S	S	*	.			trans	-82.2	-82.6	168.1	-59.4	175.1	0	0	0	107.6	T63	I40-T63 WeakPolarHBondContact O-CA 3.4Å; I40-T63 WeakPolarHBondContact O-CB 3.4Å; I40-T63 PolarHBondContact O-N 3.16Å; I40-T63 PolarHBondContact O-OG1 3.1Å
41	E	86.4	Confident	87.6	Confident	79 Å²	79	78.4 Å²	78.4	37%	0.369	39%	0.39	S	S	.	.			trans	-159.1	134.9	166.4	-175.3	177.5	107.9	0	0	105.6	T60 D61 Q67	E41-T60 HydrophobicContact CG-CG2 3.9Å; E41-D61 WeakPolarHBondContact CA-O 3.48Å; E41-Q67 PolarHBondContact OE2-NE2 3.48Å
42	D	90.2	Very high	86.9	Confident	77 Å²	77	84.8 Å²	84.8	41%	0.412	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	145.1	177.6	-160.2	-1.5	0	0	0	110.3	Y44 T60 D61	D42-Y44 HydrophobicContact CB-CE2 3.88Å; D42-Y44 PolarHBondContact OD2-OH 3.12Å; D42-T60 WeakPolarHBondContact O-CA 3.46Å; D42-D61 PolarHBondContact N-O 3.3Å; D42-D61 PolarHBondContact O-N 2.94Å
43	T	94.1	Very high	86.5	Confident	49 Å²	49	85 Å²	85	30%	0.301	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	112.2	179.2	-64.9	0	0	0	0	110.2	Q58 I59 T60	T43-Q58 HydrophobicContact CG2-CB 4.01Å; T43-Q58 HydrophobicContact CG2-CG 4.45Å; T43-I59 WeakPolarHBondContact CA-O 3.35Å; T43-T60 PolarHBondContact OG1-OG1 2.95Å
44	Y	94.7	Very high	86.5	Confident	29 Å²	29	82.5 Å²	82.5	11%	0.114	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	145.6	177.3	-61.2	-95.5	0	0	0	110.2	V24 L25 V28 D42 Q58 I59 D61	V24-Y44 HydrophobicContact CG1-CD2 3.27Å; V24-Y44 HydrophobicContact CG1-CE2 3.68Å; V24-Y44 HydrophobicContact CG1-CG 3.75Å; L25-Y44 HydrophobicContact CD2-CE1 3.61Å; L25-Y44 WeakPolarHBondContact CD2-OH 3.4Å; V28-Y44 HydrophobicContact CB-CD1 4.48Å; V28-Y44 HydrophobicContact CG1-CD1 4.21Å; V28-Y44 HydrophobicContact CG2-CG 4.37Å; D42-Y44 HydrophobicContact CB-CE2 3.88Å; D42-Y44 PolarHBondContact OD2-OH 3.12Å; Y44-Q58 CarbonylContact O-C 3.48Å; Y44-Q58 WeakPolarHBondContact O-CA 3.5Å; Y44-I59 PolarHBondContact N-O 2.87Å; Y44-I59 PolarHBondContact O-N 3.09Å; Y44-D61 HydrophobicContact CE2-CB 4.14Å
45	R	94.1	Very high	86.9	Confident	147 Å²	147	75.3 Å²	75.3	56%	0.555	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.2	-177.8	-65.9	174.9	-175.9	-85	-9.6	110.2	T56 L57 Q58	R45-T56 HydrophobicContact CB-CG2 3.82Å; R45-T56 HydrophobicContact CG-CG2 4Å; R45-L57 CarbonylContact C-O 3.55Å; R45-L57 VanDerWaalsContact CA-O 3.32Å; R45-L57 WeakPolarHBondContact CA-O 3.3Å; R45-Q58 HydrophobicContact CG-CG 4.49Å
46	Q	90.8	Very high	87.3	Confident	58 Å²	58	73.2 Å²	73.2	27%	0.271	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.2	171.5	-167.5	171.4	57.9	0	0	109.9	T56 L57	Q46-T56 CarbonylContact O-C 3.56Å; Q46-L57 HydrophobicContact CB-CB 4.4Å; Q46-L57 PolarHBondContact N-O 3.03Å; Q46-L57 WeakPolarHBondContact O-CB 3.28Å; Q46-L57 PolarHBondContact O-N 3.31Å
47	V	91.3	Very high	88	Confident	79 Å²	79	66.8 Å²	66.8	48%	0.479	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	125.7	175.8	-177.3	0	0	0	0	108.8	I54 I178	V47-I54 HydrophobicContact CG1-CG2 3.23Å; V47-I178 HydrophobicContact CB-CD1 4.42Å; V47-I178 HydrophobicContact CG1-CD1 3.81Å
48	I	90.6	Very high	88.8	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	167.4	-178.9	61.4	168.6	0	0	0	110.4	I54 C55 L57 V174 S175 L176	I48-I54 WeakPolarHBondContact O-CA 3.41Å; I48-C55 VanDerWaalsContact CD1-SG 3.59Å; I48-C55 WeakPolarHBondContact CG1-O 3.4Å; I48-C55 WeakPolarHBondContact CG1-SG 3.21Å; I48-C55 PolarHBondContact N-O 3.46Å; I48-C55 PolarHBondContact O-N 3.14Å; I48-L57 HydrophobicContact CB-CB 4.49Å; I48-L57 HydrophobicContact CD1-CB 3.73Å; I48-L57 HydrophobicContact CD1-CD1 4.22Å; I48-L57 HydrophobicContact CD1-CG 4.46Å; I48-L57 HydrophobicContact CG1-CB 4.04Å; I48-L57 HydrophobicContact CG2-CB 3.68Å; I48-L57 HydrophobicContact CG2-CD2 4.12Å; I48-V174 HydrophobicContact CD1-CG1 3.26Å; I48-V174 HydrophobicContact CG1-CG1 4.36Å; I48-S175 WeakPolarHBondContact CB-O 3.37Å; I48-L176 HydrophobicContact CG2-CD2 4.02Å
49	S	87.9	Confident	89.6	Confident	6 Å²	6	58.1 Å²	58.1	4%	0.042	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	137	169	-172.5	0	0	0	0	110.6	S53 V174 S175 Q177	S49-S53 CarbonylContact C-O 3.54Å; S49-S53 VanDerWaalsContact CA-O 3.32Å; S49-S53 WeakPolarHBondContact CA-O 3.45Å; S49-S53 PolarHBondContact OG-O 3.5Å; S49-V174 CarbonylContact O-C 3.53Å; S49-V174 WeakPolarHBondContact O-CA 3.35Å; S49-S175 PolarHBondContact N-O 2.78Å; S49-S175 PolarHBondContact O-N 3.46Å; S49-Q177 VanDerWaalsContact CB-O 3.23Å; S49-Q177 WeakPolarHBondContact CB-O 3.39Å
50	C	85.5	Confident	90.2	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.007	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	120.6	173.7	-173.1	0	0	0	0	109.5	K52 S53 C55 T173	C50-K52 VanDerWaalsContact C-N 3.3Å; C50-K52 PolarHBondContact O-N 3.1Å; C50-S53 PolarHBondContact N-O 3.01Å; C50-S53 CarbonylContact O-C 3.6Å; C50-S53 WeakPolarHBondContact O-CA 3.48Å; C50-S53 WeakPolarHBondContact O-CB 3.33Å; C50-S53 PolarHBondContact O-N 3.36Å; C50-C55 HydrophobicContact CB-CB 3.91Å; C50-C55 WeakPolarHBondContact CB-SG 3.4Å; C50-T173 CarbonylContact C-O 3.59Å; C50-T173 WeakPolarHBondContact CA-O 3.48Å
51	D	84.9	Confident	90.7	Very high	76 Å²	76	50.6 Å²	50.6	41%	0.406	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	46.2	178	-57.9	-44.4	0	0	0	113.5	S53 T173	D51-S53 PolarHBondContact O-N 3.34Å; D51-S53 VanDerWaalsContact O-N 3.11Å; D51-T173 PolarHBondContact N-O 3.32Å; D51-T173 PolarHBondContact OD1-N 3.26Å
52	K	78.4	Confident	91.1	Very high	197 Å²	197	46.9 Å²	46.9	86%	0.857	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.9	8.7	-176.1	-50.8	173.2	-178	172.9	0	114.7	C50	C50-K52 VanDerWaalsContact C-N 3.3Å; C50-K52 PolarHBondContact O-N 3.1Å
53	S	85	Confident	91	Very high	68 Å²	68	44.8 Å²	44.8	48%	0.476	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-178.7	170.6	-60.1	0	0	0	0	110.3	S49 C50 D51	S49-S53 CarbonylContact C-O 3.54Å; S49-S53 VanDerWaalsContact CA-O 3.32Å; S49-S53 WeakPolarHBondContact CA-O 3.45Å; S49-S53 PolarHBondContact OG-O 3.5Å; C50-S53 PolarHBondContact N-O 3.01Å; C50-S53 CarbonylContact O-C 3.6Å; C50-S53 WeakPolarHBondContact O-CA 3.48Å; C50-S53 WeakPolarHBondContact O-CB 3.33Å; C50-S53 PolarHBondContact O-N 3.36Å; D51-S53 PolarHBondContact O-N 3.34Å; D51-S53 VanDerWaalsContact O-N 3.11Å
54	I	87.3	Confident	90.2	Very high	108 Å²	108	43 Å²	43	55%	0.554	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	137.6	175	-63.6	175.4	0	0	0	108.6	V47 I48 I178	V47-I54 HydrophobicContact CG1-CG2 3.23Å; I48-I54 WeakPolarHBondContact O-CA 3.41Å; I54-I178 HydrophobicContact CD1-CG2 4.39Å; I54-I178 HydrophobicContact CG1-CG2 4.38Å
55	C	90.3	Very high	89.2	Confident	8 Å²	8	45 Å²	45	5%	0.054	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	173.5	166.5	83.3	0	0	0	0	112.1	N6 I48 C50	N6-C55 HydrophobicContact CB-CB 4.2Å; N6-C55 WeakPolarHBondContact O-CB 3.49Å; I48-C55 VanDerWaalsContact CD1-SG 3.59Å; I48-C55 WeakPolarHBondContact CG1-O 3.4Å; I48-C55 WeakPolarHBondContact CG1-SG 3.21Å; I48-C55 PolarHBondContact N-O 3.46Å; I48-C55 PolarHBondContact O-N 3.14Å; C50-C55 HydrophobicContact CB-CB 3.91Å; C50-C55 WeakPolarHBondContact CB-SG 3.4Å
56	T	93	Very high	88.4	Confident	39 Å²	39	45.5 Å²	45.5	24%	0.239	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	121.9	176.4	-45.6	0	0	0	0	110	D7 Y8 R45 Q46 Q58	D7-T56 CarbonylContact C-O 3.42Å; D7-T56 VanDerWaalsContact CA-O 3.28Å; D7-T56 WeakPolarHBondContact CA-O 3.45Å; D7-T56 VanDerWaalsContact OD1-CB 3.23Å; D7-T56 WeakPolarHBondContact OD1-CB 3.45Å; D7-T56 PolarHBondContact OD1-OG1 2.93Å; Y8-T56 PolarHBondContact N-O 3.3Å; R45-T56 HydrophobicContact CB-CG2 3.82Å; R45-T56 HydrophobicContact CG-CG2 4Å; Q46-T56 CarbonylContact O-C 3.56Å; T56-Q58 HydrophobicContact CG2-CG 4.32Å; T56-Q58 PolarHBondContact O-N 3.16Å
57	L	95.4	Very high	87.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	114.8	159.6	-174.4	58.9	0	0	0	108.5	Y8 V10 F27 R45 Q46 I48 I59 L166 L176	Y8-L57 HydrophobicContact CD1-CD1 3.85Å; Y8-L57 CarbonylContact O-C 3.57Å; Y8-L57 WeakPolarHBondContact O-CA 3.34Å; V10-L57 HydrophobicContact CG2-CD1 3.73Å; F27-L57 HydrophobicContact CE1-CD2 4.16Å; F27-L57 HydrophobicContact CZ-CD2 4.48Å; R45-L57 CarbonylContact C-O 3.55Å; R45-L57 VanDerWaalsContact CA-O 3.32Å; R45-L57 WeakPolarHBondContact CA-O 3.3Å; Q46-L57 HydrophobicContact CB-CB 4.4Å; Q46-L57 PolarHBondContact N-O 3.03Å; Q46-L57 WeakPolarHBondContact O-CB 3.28Å; Q46-L57 PolarHBondContact O-N 3.31Å; I48-L57 HydrophobicContact CB-CB 4.49Å; I48-L57 HydrophobicContact CD1-CB 3.73Å; I48-L57 HydrophobicContact CD1-CD1 4.22Å; I48-L57 HydrophobicContact CD1-CG 4.46Å; I48-L57 HydrophobicContact CG1-CB 4.04Å; I48-L57 HydrophobicContact CG2-CB 3.68Å; I48-L57 HydrophobicContact CG2-CD2 4.12Å; L57-I59 HydrophobicContact CD2-CD1 3.94Å; L57-I59 HydrophobicContact CD2-CG1 4.14Å; L57-I59 HydrophobicContact CG-CD1 4.25Å; L57-I59 HydrophobicContact CG-CG1 3.93Å; L57-L166 HydrophobicContact CD1-CD2 4.25Å; L57-L176 HydrophobicContact CD2-CD2 4.17Å
58	Q	97	Very high	87.6	Confident	22 Å²	22	47.6 Å²	47.6	10%	0.103	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.9	168.8	-63.4	-172.7	2.2	0	0	108.8	D7 Y8 R9 V10 T43 Y44 R45 T56	D7-Q58 HydrophobicContact CB-CG 4.24Å; D7-Q58 PolarHBondContact OD2-NE2 2.88Å; Y8-Q58 PolarHBondContact O-N 3.44Å; R9-Q58 CarbonylContact C-O 3.56Å; R9-Q58 WeakPolarHBondContact CA-O 3.27Å; R9-Q58 HydrophobicContact CG-CB 4.24Å; V10-Q58 PolarHBondContact N-O 2.96Å; T43-Q58 HydrophobicContact CG2-CB 4.01Å; T43-Q58 HydrophobicContact CG2-CG 4.45Å; Y44-Q58 CarbonylContact O-C 3.48Å; Y44-Q58 WeakPolarHBondContact O-CA 3.5Å; R45-Q58 HydrophobicContact CG-CG 4.49Å; T56-Q58 HydrophobicContact CG2-CG 4.32Å; T56-Q58 PolarHBondContact O-N 3.16Å
59	I	97.8	Very high	87.5	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	110.4	175.9	-55.4	164.4	0	0	0	107.9	V10 V12 V24 F27 V28 T43 Y44 L57 F162	V10-I59 HydrophobicContact CB-CG1 4.38Å; V10-I59 WeakPolarHBondContact O-CA 3.13Å; V12-I59 HydrophobicContact CG2-CG2 3.83Å; V24-I59 HydrophobicContact CG1-CB 4.42Å; V24-I59 HydrophobicContact CG1-CG2 3.91Å; V24-I59 HydrophobicContact CG2-CG2 3.79Å; F27-I59 HydrophobicContact CD1-CD1 3.61Å; F27-I59 HydrophobicContact CE1-CD1 3.59Å; V28-I59 HydrophobicContact CG2-CD1 4.13Å; T43-I59 WeakPolarHBondContact CA-O 3.35Å; Y44-I59 PolarHBondContact N-O 2.87Å; Y44-I59 PolarHBondContact O-N 3.09Å; L57-I59 HydrophobicContact CD2-CD1 3.94Å; L57-I59 HydrophobicContact CD2-CG1 4.14Å; L57-I59 HydrophobicContact CG-CD1 4.25Å; L57-I59 HydrophobicContact CG-CG1 3.93Å; I59-F162 HydrophobicContact CD1-CD1 4.02Å; I59-F162 HydrophobicContact CD1-CE1 3.66Å; I59-F162 HydrophobicContact CD1-CZ 4.37Å; I59-F162 HydrophobicContact CG1-CE1 4.22Å; I59-F162 HydrophobicContact CG2-CE1 4.14Å
60	T	96.6	Very high	87.6	Confident	18 Å²	18	54.5 Å²	54.5	11%	0.11	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	112.6	177.1	-58.5	0	0	0	0	109.6	V10 V12 E41 D42 T43 T62	V10-T60 PolarHBondContact O-N 2.99Å; V12-T60 PolarHBondContact N-O 3.23Å; E41-T60 HydrophobicContact CG-CG2 3.9Å; D42-T60 WeakPolarHBondContact O-CA 3.46Å; T43-T60 PolarHBondContact OG1-OG1 2.95Å; T60-T62 HydrophobicContact CG2-CG2 4.35Å
61	D	94.4	Very high	87.8	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.7	171.3	-177.4	29.5	0	0	0	109.4	K20 S21 V24 E41 D42 Y44	K20-D61 WeakPolarHBondContact CB-OD1 3.37Å; S21-D61 WeakPolarHBondContact CA-OD2 3.46Å; S21-D61 WeakPolarHBondContact CB-OD2 3.42Å; S21-D61 PolarHBondContact N-OD1 2.84Å; S21-D61 PolarHBondContact OG-OD1 2.54Å; S21-D61 PolarHBondContact OG-OD2 3.49Å; V24-D61 HydrophobicContact CG2-CB 4.33Å; E41-D61 WeakPolarHBondContact CA-O 3.48Å; D42-D61 PolarHBondContact N-O 3.3Å; D42-D61 PolarHBondContact O-N 2.94Å; Y44-D61 HydrophobicContact CE2-CB 4.14Å
62	T	93.3	Very high	88.2	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.006	31%	0.305	C	S	.	.			trans	-98.7	161.6	-171.5	65.2	0	0	0	0	112.6	V11 V12 F13 K20 T60 G64	V11-T62 HydrophobicContact CG1-CG2 3.94Å; V12-T62 WeakPolarHBondContact O-CB 3.46Å; V12-T62 VanDerWaalsContact O-CG2 3.29Å; V12-T62 WeakPolarHBondContact O-CG2 3.48Å; V12-T62 PolarHBondContact O-OG1 3.29Å; F13-T62 HydrophobicContact CD1-CG2 4.09Å; F13-T62 HydrophobicContact CE1-CG2 3.93Å; K20-T62 WeakPolarHBondContact CE-O 3.49Å; T60-T62 HydrophobicContact CG2-CG2 4.35Å; T62-G64 PolarHBondContact O-N 2.96Å
63	T	87.6	Confident	89	Confident	33 Å²	33	52.9 Å²	52.9	20%	0.202	29%	0.287	C	S	.	.			trans	-59.3	-16.8	175.8	-29.3	0	0	0	0	113.6	T39 I40 H66	T39-T63 WeakPolarHBondContact O-CA 3.48Å; T39-T63 WeakPolarHBondContact O-CG2 3.49Å; I40-T63 WeakPolarHBondContact O-CA 3.4Å; I40-T63 WeakPolarHBondContact O-CB 3.4Å; I40-T63 PolarHBondContact O-N 3.16Å; I40-T63 PolarHBondContact O-OG1 3.1Å; T63-H66 HydrophobicContact CG2-CB 3.86Å
64	G	78.3	Confident	89.4	Confident	10 Å²	10	53.2 Å²	53.2	10%	0.103	28%	0.283	C	S	.	.	S	Bend	trans	78.8	-138.7	-165.8	0	0	0	0	0	112.5	G14 K20 T62 H66 Q67	G14-G64 WeakPolarHBondContact O-CA 3.23Å; K20-G64 VanDerWaalsContact NZ-CA 3.3Å; T62-G64 PolarHBondContact O-N 2.96Å; G64-H66 PolarHBondContact O-N 3.19Å; G64-Q67 PolarHBondContact O-N 2.92Å
65	S	73.8	Confident	89.8	Confident	71 Å²	71	48.7 Å²	48.7	50%	0.497	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-8	-170.7	-38	0	0	0	0	114.8	A15 E96	A15-S65 WeakPolarHBondContact CA-OG 3.39Å; S65-E96 PolarHBondContact OG-OE2 3.32Å
66	H	76.6	Confident	90.1	Very high	159 Å²	159	48.3 Å²	48.3	74%	0.736	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	4.5	178.9	-56.7	-64.5	0	0	0	114.3	T63 G64	T63-H66 HydrophobicContact CG2-CB 3.86Å; G64-H66 PolarHBondContact O-N 3.19Å
67	Q	78.9	Confident	90.2	Very high	18 Å²	18	49.9 Å²	49.9	8%	0.084	27%	0.271	C	S	.	.	S	Bend	trans	-70.3	134.9	179.5	-160.7	-180	30.8	0	0	111	E41 G64 M71	E41-Q67 PolarHBondContact OE2-NE2 3.48Å; G64-Q67 PolarHBondContact O-N 2.92Å; Q67-M71 HydrophobicContact CG-CB 4.13Å
68	F	86.2	Confident	90.2	Very high	162 Å²	162	55.1 Å²	55.1	71%	0.711	29%	0.294	S	S	*	.			trans	-60.7	133.3	176.8	-127.3	-96.2	0	0	0	110.3	A70 M71 Q72	F68-A70 PolarHBondContact O-N 2.89Å; F68-A70 VanDerWaalsContact O-N 3.08Å; F68-M71 HydrophobicContact CB-CB 4.44Å; F68-M71 HydrophobicContact CB-CG 4.18Å; F68-M71 WeakPolarHBondContact O-CA 3.46Å; F68-M71 WeakPolarHBondContact O-CB 3.45Å; F68-M71 PolarHBondContact O-N 3.04Å; F68-Q72 PolarHBondContact O-N 3.02Å; F68-Q72 VanDerWaalsContact O-N 3.08Å
69	P	88.9	Confident	90.2	Very high	83 Å²	83	54.1 Å²	54.1	54%	0.539	29%	0.289	S	S	.	.	H	α-helix	trans	-54.9	-36.3	-173.6	-30.3	35.4	0	0	0	114.6	Q72 R73	P69-Q72 PolarHBondContact O-N 2.9Å; P69-R73 WeakPolarHBondContact O-CG 2.96Å; P69-R73 PolarHBondContact O-N 2.96Å
70	A	90.6	Very high	90.1	Very high	69 Å²	69	56.5 Å²	56.5	57%	0.57	30%	0.3	S	S	*	.	H	α-helix	trans	-64	-39	176.2	0	0	0	0	0	112.6	F68 R73 L74	F68-A70 PolarHBondContact O-N 2.89Å; F68-A70 VanDerWaalsContact O-N 3.08Å; A70-R73 PolarHBondContact O-N 2.84Å; A70-L74 WeakPolarHBondContact O-CB 3.48Å; A70-L74 PolarHBondContact O-N 3.04Å
71	M	90.7	Very high	90.1	Very high	84 Å²	84	55.6 Å²	55.6	41%	0.414	30%	0.295	S	S	.	.	H	α-helix	trans	-70.6	-38.4	177.5	-65.8	-60.6	-69.8	0	0	111.5	Q67 F68 L74 S75	Q67-M71 HydrophobicContact CG-CB 4.13Å; F68-M71 HydrophobicContact CB-CB 4.44Å; F68-M71 HydrophobicContact CB-CG 4.18Å; F68-M71 WeakPolarHBondContact O-CA 3.46Å; F68-M71 WeakPolarHBondContact O-CB 3.45Å; F68-M71 PolarHBondContact O-N 3.04Å; M71-L74 PolarHBondContact O-N 3.05Å; M71-S75 WeakPolarHBondContact O-CB 3.41Å; M71-S75 PolarHBondContact O-N 2.8Å; M71-S75 PolarHBondContact O-OG 3.03Å
72	Q	93.1	Very high	90.3	Very high	28 Å²	28	55.6 Å²	55.6	13%	0.131	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-47.3	172.1	-175.7	-175.1	-33.1	0	0	110.9	F13 F68 P69 L74 S75 I76	F13-Q72 HydrophobicContact CE1-CG 3.84Å; F13-Q72 HydrophobicContact CZ-CG 4.08Å; F68-Q72 PolarHBondContact O-N 3.02Å; F68-Q72 VanDerWaalsContact O-N 3.08Å; P69-Q72 PolarHBondContact O-N 2.9Å; Q72-L74 VanDerWaalsContact C-N 3.32Å; Q72-L74 PolarHBondContact O-N 3.42Å; Q72-S75 PolarHBondContact O-N 2.8Å; Q72-I76 HydrophobicContact CG-CD1 4.02Å; Q72-I76 VanDerWaalsContact O-CG1 3.3Å; Q72-I76 WeakPolarHBondContact O-CG1 3.41Å; Q72-I76 PolarHBondContact O-N 3.09Å
73	R	94.1	Very high	90.6	Very high	128 Å²	128	55.6 Å²	55.6	48%	0.483	30%	0.295	S	S	.	.	H	α-helix	trans	-58.4	-43	175.6	-73.3	-176.4	178.7	-96.9	-2.9	112	P69 A70 I76 S77 I107	P69-R73 WeakPolarHBondContact O-CG 2.96Å; P69-R73 PolarHBondContact O-N 2.96Å; A70-R73 PolarHBondContact O-N 2.84Å; R73-I76 PolarHBondContact O-N 2.81Å; R73-S77 VanDerWaalsContact O-CB 3.32Å; R73-S77 WeakPolarHBondContact O-CB 3.31Å; R73-S77 PolarHBondContact O-N 2.66Å; R73-I107 HydrophobicContact CB-CD1 4.13Å; R73-I107 HydrophobicContact CG-CD1 3.99Å
74	L	93.9	Very high	91.1	Very high	74 Å²	74	54 Å²	54	39%	0.387	29%	0.285	S	S	.	.	H	α-helix	trans	-63.7	-42.8	177.1	-175.2	63.1	0	0	0	111.9	A70 M71 Q72 S77 K78	A70-L74 WeakPolarHBondContact O-CB 3.48Å; A70-L74 PolarHBondContact O-N 3.04Å; M71-L74 PolarHBondContact O-N 3.05Å; Q72-L74 VanDerWaalsContact C-N 3.32Å; Q72-L74 PolarHBondContact O-N 3.42Å; L74-S77 PolarHBondContact O-N 3.44Å; L74-K78 HydrophobicContact CD1-CD 4.12Å; L74-K78 HydrophobicContact CD1-CG 4.4Å; L74-K78 HydrophobicContact CG-CD 4.18Å; L74-K78 WeakPolarHBondContact O-CB 3.36Å; L74-K78 WeakPolarHBondContact O-CG 3.42Å; L74-K78 PolarHBondContact O-N 3.35Å
75	S	95.3	Very high	92.1	Very high	14 Å²	14	53.6 Å²	53.6	10%	0.098	28%	0.28	C	S	.	.	H	α-helix	trans	-62.7	-44.4	177	-60.5	0	0	0	0	111.3	M71 Q72 K78 G79	M71-S75 WeakPolarHBondContact O-CB 3.41Å; M71-S75 PolarHBondContact O-N 2.8Å; M71-S75 PolarHBondContact O-OG 3.03Å; Q72-S75 PolarHBondContact O-N 2.8Å; S75-K78 PolarHBondContact O-N 3.12Å; S75-G79 PolarHBondContact O-N 3.12Å
76	I	96	Very high	93.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-48.3	174.2	-65.6	167.6	0	0	0	110.5	F13 Q72 R73 K78 G79 F82 Q103 I104 I107 K108	F13-I76 HydrophobicContact CE2-CG1 3.88Å; F13-I76 HydrophobicContact CZ-CG1 3.89Å; Q72-I76 HydrophobicContact CG-CD1 4.02Å; Q72-I76 VanDerWaalsContact O-CG1 3.3Å; Q72-I76 WeakPolarHBondContact O-CG1 3.41Å; Q72-I76 PolarHBondContact O-N 3.09Å; R73-I76 PolarHBondContact O-N 2.81Å; I76-K78 VanDerWaalsContact C-N 3.29Å; I76-K78 PolarHBondContact O-N 2.93Å; I76-G79 PolarHBondContact O-N 3.4Å; I76-F82 HydrophobicContact CB-CE1 4.45Å; I76-F82 HydrophobicContact CG1-CE1 4.38Å; I76-F82 HydrophobicContact CG2-CE1 4.5Å; I76-F82 HydrophobicContact CG2-CZ 4.16Å; I76-F82 WeakPolarHBondContact O-CZ 3.31Å; I76-Q103 HydrophobicContact CD1-CB 4.12Å; I76-Q103 HydrophobicContact CD1-CG 3.82Å; I76-I104 HydrophobicContact CD1-CG1 3.92Å; I76-I104 HydrophobicContact CG1-CG1 3.92Å; I76-I104 HydrophobicContact CG2-CB 4.39Å; I76-I104 HydrophobicContact CG2-CG1 4.03Å; I76-I107 HydrophobicContact CB-CD1 3.98Å; I76-I107 HydrophobicContact CD1-CD1 4.21Å; I76-I107 HydrophobicContact CG2-CB 3.74Å; I76-I107 HydrophobicContact CG2-CD1 3.81Å; I76-I107 HydrophobicContact CG2-CG1 4.35Å; I76-I107 HydrophobicContact CG2-CG2 3.78Å; I76-K108 HydrophobicContact CG2-CG 4.39Å; I76-K108 WeakPolarHBondContact O-CE 3.15Å; I76-K108 PolarHBondContact O-NZ 2.91Å
77	S	95.7	Very high	94.3	Very high	71 Å²	71	42.8 Å²	42.8	50%	0.497	22%	0.223	S	C	.	.	H	α-helix	trans	-55.4	-46	179	178.8	0	0	0	0	111.5	R73 L74 K108	R73-S77 VanDerWaalsContact O-CB 3.32Å; R73-S77 WeakPolarHBondContact O-CB 3.31Å; R73-S77 PolarHBondContact O-N 2.66Å; L74-S77 PolarHBondContact O-N 3.44Å; S77-K108 PolarHBondContact O-NZ 3.28Å
78	K	95.2	Very high	95.3	Very high	111 Å²	111	42 Å²	42	48%	0.483	22%	0.219	S	C	.	.	H	α-helix	trans	-81.4	-20.8	-178.3	-71.9	-179.7	176.4	173.8	0	115.5	R9 L74 S75 I76	R9-K78 WeakPolarHBondContact CD-O 3.3Å; L74-K78 HydrophobicContact CD1-CD 4.12Å; L74-K78 HydrophobicContact CD1-CG 4.4Å; L74-K78 HydrophobicContact CG-CD 4.18Å; L74-K78 WeakPolarHBondContact O-CB 3.36Å; L74-K78 WeakPolarHBondContact O-CG 3.42Å; L74-K78 PolarHBondContact O-N 3.35Å; S75-K78 PolarHBondContact O-N 3.12Å; I76-K78 VanDerWaalsContact C-N 3.29Å; I76-K78 PolarHBondContact O-N 2.93Å
79	G	96.5	Very high	95.9	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.01	19%	0.192	C	C	.	.			trans	-71.8	140.9	-176.1	0	0	0	0	0	112.7	S75 I76 K108	S75-G79 PolarHBondContact O-N 3.12Å; I76-G79 PolarHBondContact O-N 3.4Å; G79-K108 VanDerWaalsContact O-CE 3.23Å; G79-K108 WeakPolarHBondContact O-CE 3.32Å; G79-K108 PolarHBondContact O-NZ 2.98Å
80	H	96.2	Very high	96.3	Very high	50 Å²	50	33.1 Å²	33.1	23%	0.231	18%	0.178	C	C	.	.	S	Bend	trans	-92.9	-32.2	174.1	-60.9	126	0	0	0	111.8	D7 Y8 R9	D7-H80 PolarHBondContact O-CE1 3.11Å; D7-H80 PolarHBondContact O-ND1 2.65Å; Y8-H80 HydrophobicContact CD2-CB 4.19Å; Y8-H80 HydrophobicContact CE1-CB 4.42Å; Y8-H80 HydrophobicContact CE2-CB 3.82Å; R9-H80 PolarHBondContact N-ND1 2.79Å; R9-H80 WeakPolarHBondContact O-CA 3.35Å; R9-H80 WeakPolarHBondContact O-CB 3.38Å; R9-H80 PolarHBondContact O-N 3.39Å
81	A	97.8	Very high	96.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	156.9	179.6	0	0	0	0	0	111.2	Y8 R9 V10 V11 P115 L165	Y8-A81 HydrophobicContact CE1-CB 3.93Å; R9-A81 PolarHBondContact O-N 3Å; R9-A81 VanDerWaalsContact O-N 3.1Å; V10-A81 WeakPolarHBondContact CA-O 3.42Å; V10-A81 HydrophobicContact CG2-CB 4.2Å; V11-A81 PolarHBondContact N-O 2.83Å; A81-P115 WeakPolarHBondContact CA-O 3.35Å; A81-P115 HydrophobicContact CB-CB 3.76Å; A81-P115 HydrophobicContact CB-CG 4.29Å; A81-L165 HydrophobicContact CB-CD1 4.28Å; A81-L165 HydrophobicContact CB-CD2 4.02Å; A81-L165 HydrophobicContact CB-CG 4.11Å
82	F	98.4	Very high	97	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.5	-174.1	-56.9	-76.6	0	0	0	112.3	V11 F13 I76 I104 K108 I114 P115 I116 M117	V11-F82 HydrophobicContact CB-CD1 4.02Å; V11-F82 HydrophobicContact CB-CE1 4.17Å; V11-F82 HydrophobicContact CG2-CE1 4.25Å; V11-F82 WeakPolarHBondContact O-CA 3.12Å; F13-F82 HydrophobicContact CD2-CD1 4.29Å; F13-F82 AromaticContact CE2-CD1 3.92Å; F13-F82 HydrophobicContact CE2-CD1 3.92Å; F13-F82 HydrophobicContact CE2-CE1 4.24Å; I76-F82 HydrophobicContact CB-CE1 4.45Å; I76-F82 HydrophobicContact CG1-CE1 4.38Å; I76-F82 HydrophobicContact CG2-CE1 4.5Å; I76-F82 HydrophobicContact CG2-CZ 4.16Å; I76-F82 WeakPolarHBondContact O-CZ 3.31Å; F82-I104 HydrophobicContact CB-CD1 4Å; F82-I104 HydrophobicContact CD1-CD1 3.99Å; F82-I104 HydrophobicContact CD1-CG1 4.38Å; F82-I104 HydrophobicContact CD2-CD1 4.2Å; F82-I104 HydrophobicContact CD2-CG1 4.46Å; F82-I104 HydrophobicContact CD2-CG2 3.82Å; F82-I104 HydrophobicContact CE2-CG2 3.83Å; F82-I104 HydrophobicContact CG-CD1 3.77Å; F82-I104 HydrophobicContact CG-CG1 4.36Å; F82-I104 HydrophobicContact CG-CG2 4.48Å; F82-K108 HydrophobicContact CE2-CG 4.31Å; F82-I114 HydrophobicContact CD2-CG2 3.73Å; F82-I114 HydrophobicContact CE2-CG2 3.78Å; F82-P115 PolarHBondContact N-O 3.45Å; F82-I116 HydrophobicContact CB-CG1 4.38Å; F82-I116 HydrophobicContact CD2-CG1 4.29Å; F82-I116 WeakPolarHBondContact O-CA 3.05Å; F82-M117 PolarHBondContact O-N 2.9Å
83	I	98.8	Very high	97.3	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123	169.1	-60.2	174.4	0	0	0	107.3	V10 V11 V12 F13 V85 M117 V119 L161 F162 L165	V10-I83 HydrophobicContact CG1-CD1 3.76Å; V10-I83 HydrophobicContact CG1-CG1 3.94Å; V11-I83 PolarHBondContact O-N 3.22Å; V12-I83 WeakPolarHBondContact CA-O 3.41Å; V12-I83 HydrophobicContact CG1-CB 4.31Å; V12-I83 HydrophobicContact CG1-CG2 4.32Å; V12-I83 HydrophobicContact CG2-CB 4.34Å; V12-I83 HydrophobicContact CG2-CD1 4.28Å; F13-I83 PolarHBondContact N-O 3.17Å; I83-V85 HydrophobicContact CG2-CG2 3.65Å; I83-M117 WeakPolarHBondContact CA-O 3.47Å; I83-V119 HydrophobicContact CG2-CB 4.39Å; I83-V119 HydrophobicContact CG2-CG2 3.63Å; I83-L161 HydrophobicContact CD1-CD1 4.39Å; I83-L161 HydrophobicContact CD1-CD2 4.39Å; I83-L161 HydrophobicContact CD1-CG 4.34Å; I83-L161 HydrophobicContact CG2-CD1 4.42Å; I83-L161 HydrophobicContact CG2-CD2 4.45Å; I83-F162 HydrophobicContact CD1-CD1 4.05Å; I83-F162 HydrophobicContact CD1-CE1 3.61Å; I83-F162 HydrophobicContact CD1-CZ 4.05Å; I83-L165 HydrophobicContact CD1-CD2 3.85Å; I83-L165 HydrophobicContact CG1-CD2 3.56Å
84	L	98.6	Very high	97.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	103.3	178.9	-56.7	-173.9	0	0	0	108.5	F13 L97 I100 Y101 I104 I116 M117 L118 V119 W143	F13-L84 HydrophobicContact CB-CD2 3.92Å; F13-L84 HydrophobicContact CD2-CD2 4.28Å; L84-L97 HydrophobicContact CB-CD1 3.98Å; L84-L97 HydrophobicContact CB-CD2 3.95Å; L84-L97 HydrophobicContact CB-CG 4.48Å; L84-I100 HydrophobicContact CD2-CG2 4.18Å; L84-Y101 HydrophobicContact CD1-CD2 4.15Å; L84-I104 HydrophobicContact CD2-CD1 3.94Å; L84-I116 HydrophobicContact CD1-CG2 3.95Å; L84-I116 HydrophobicContact CG-CG2 4.15Å; L84-M117 PolarHBondContact N-O 3.29Å; L84-L118 HydrophobicContact CB-CD1 4.26Å; L84-V119 PolarHBondContact O-N 3.18Å; L84-W143 HydrophobicContact CD1-CE3 4.32Å; L84-W143 HydrophobicContact CD1-CZ3 4.01Å
85	V	98.8	Very high	97.7	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.4	-172.5	-169.6	0	0	0	0	110.7	V12 F13 G14 V18 K20 L23 I83 V119 N121	V12-V85 HydrophobicContact CG1-CG2 3.68Å; F13-V85 PolarHBondContact O-N 3.44Å; G14-V85 WeakPolarHBondContact CA-O 3.22Å; V18-V85 HydrophobicContact CB-CG1 4.26Å; V18-V85 HydrophobicContact CG2-CB 3.96Å; V18-V85 HydrophobicContact CG2-CG1 3.78Å; K20-V85 HydrophobicContact CG-CB 4.21Å; K20-V85 HydrophobicContact CG-CG2 4.3Å; L23-V85 HydrophobicContact CD1-CG1 3.93Å; L23-V85 HydrophobicContact CD1-CG2 4.06Å; I83-V85 HydrophobicContact CG2-CG2 3.65Å; V85-V119 WeakPolarHBondContact CA-O 3.27Å; V85-V119 HydrophobicContact CG2-CB 4.39Å; V85-N121 HydrophobicContact CG1-CB 3.83Å
86	Y	98.8	Very high	97.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	167.2	165.3	74.9	-82.6	0	0	0	110	I88 S93 L94 L97 L118 V119 G120 N121 V131 F147	Y86-I88 HydrophobicContact CE2-CG2 4.35Å; Y86-S93 WeakPolarHBondContact CB-OG 3.24Å; Y86-L94 HydrophobicContact CD1-CD1 3.68Å; Y86-L94 HydrophobicContact CD2-CB 3.89Å; Y86-L94 HydrophobicContact CD2-CD1 4.32Å; Y86-L94 HydrophobicContact CE1-CD1 3.89Å; Y86-L94 HydrophobicContact CE2-CB 4.46Å; Y86-L94 HydrophobicContact CE2-CD2 4.5Å; Y86-L94 HydrophobicContact CG-CB 3.99Å; Y86-L94 HydrophobicContact CG-CD1 3.91Å; Y86-L97 HydrophobicContact CD1-CD1 4.28Å; Y86-L118 HydrophobicContact CD1-CD1 3.88Å; Y86-L118 HydrophobicContact CD1-CG 4.36Å; Y86-L118 HydrophobicContact CE1-CD1 4.09Å; Y86-L118 HydrophobicContact CE1-CD2 4.48Å; Y86-L118 HydrophobicContact CE1-CG 4.07Å; Y86-V119 WeakPolarHBondContact CD1-O 3.3Å; Y86-V119 PolarHBondContact N-O 3.17Å; Y86-G120 VanDerWaalsContact CZ-CA 3.41Å; Y86-N121 PolarHBondContact O-N 2.85Å; Y86-V131 HydrophobicContact CE2-CB 3.97Å; Y86-V131 HydrophobicContact CE2-CG1 3.76Å; Y86-V131 HydrophobicContact CE2-CG2 4.26Å; Y86-F147 HydrophobicContact CE1-CE2 4.2Å
87	S	98.6	Very high	97.8	Very high	4 Å²	4	33.4 Å²	33.4	3%	0.028	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	131	172.4	-165.1	0	0	0	0	109.1	T89 S90 S93 K122	S87-T89 PolarHBondContact O-N 3.14Å; S87-T89 PolarHBondContact OG-OG1 3.02Å; S87-S90 PolarHBondContact O-N 3.08Å; S87-S93 PolarHBondContact N-OG 3.26Å; S87-S93 PolarHBondContact O-OG 3.25Å; S87-K122 WeakPolarHBondContact OG-CD 3.46Å
88	I	98.8	Very high	97.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.9	174.7	63.5	145.6	0	0	0	112.6	Y86 N121 K122 N123 R129 E130 V131	Y86-I88 HydrophobicContact CE2-CG2 4.35Å; I88-N121 PolarHBondContact N-O 3.14Å; I88-K122 WeakPolarHBondContact CD1-O 3.36Å; I88-K122 WeakPolarHBondContact CG1-O 3.5Å; I88-N123 HydrophobicContact CD1-CB 4.44Å; I88-R129 HydrophobicContact CD1-CB 4.29Å; I88-R129 HydrophobicContact CD1-CG 4.32Å; I88-E130 PolarHBondContact O-N 3.22Å; I88-V131 PolarHBondContact O-N 2.96Å; I88-V131 VanDerWaalsContact O-N 3.08Å
89	T	98.6	Very high	97.9	Very high	24 Å²	24	33.7 Å²	33.7	15%	0.147	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	11.8	177.7	60.7	0	0	0	0	113.7	S87 E125 N128	S87-T89 PolarHBondContact O-N 3.14Å; S87-T89 PolarHBondContact OG-OG1 3.02Å; T89-E125 HydrophobicContact CG2-CB 3.57Å; T89-E125 WeakPolarHBondContact CG2-OE2 3.43Å; T89-N128 VanDerWaalsContact CA-O 3.32Å; T89-N128 WeakPolarHBondContact CA-O 3.46Å; T89-N128 WeakPolarHBondContact CB-O 3.39Å; T89-N128 HydrophobicContact CG2-CB 3.76Å; T89-N128 WeakPolarHBondContact CG2-O 3.42Å
90	S	98.4	Very high	97.8	Very high	36 Å²	36	34.7 Å²	34.7	25%	0.252	17%	0.17	S	C	.	.			trans	-149.3	101.6	176.9	177.5	0	0	0	0	110.8	S87 Q92 S93 E130	S87-S90 PolarHBondContact O-N 3.08Å; S90-Q92 VanDerWaalsContact C-N 3.28Å; S90-Q92 PolarHBondContact O-N 3.49Å; S90-S93 WeakPolarHBondContact O-CB 3.4Å; S90-S93 PolarHBondContact O-N 3.05Å; S90-S93 VanDerWaalsContact O-N 3.12Å; S90-S93 PolarHBondContact O-OG 3.06Å; S90-S93 PolarHBondContact OG-N 3.33Å; S90-E130 VanDerWaalsContact CA-OE2 3.28Å; S90-E130 WeakPolarHBondContact CA-OE2 3.36Å
91	R	98.3	Very high	97.9	Very high	90 Å²	90	33.6 Å²	33.6	34%	0.34	16%	0.164	S	C	.	.	H	α-helix	trans	-58.7	-41.1	175	178.3	169.4	-65.8	-86.1	-5.1	112.3	S93 L94 E95 E130 V131 E135	R91-S93 PolarHBondContact O-N 3.42Å; R91-L94 WeakPolarHBondContact O-CB 3.24Å; R91-L94 PolarHBondContact O-N 3.41Å; R91-E95 PolarHBondContact O-N 3.24Å; R91-E130 HydrophobicContact CB-CB 4.34Å; R91-E130 PolarHBondContact N-OE2 2.94Å; R91-E130 PolarHBondContact NH2-O 2.92Å; R91-V131 HydrophobicContact CB-CG2 4.02Å; R91-V131 HydrophobicContact CG-CG2 4.48Å; R91-E135 IonicContact CZ-OE1 2.71Å; R91-E135 VanDerWaalsContact CZ-OE1 3.24Å; R91-E135 IonicContact CZ-OE2 2.83Å; R91-E135 IonicContact NH1-OE1 2.87Å; R91-E135 PolarHBondContact NH1-OE1 3.28Å; R91-E135 IonicContact NH2-OE1 2.84Å; R91-E135 PolarHBondContact NH2-OE1 3.41Å; R91-E135 IonicContact NH2-OE2 3.24Å; R91-E135 PolarHBondContact NH2-OE2 3.01Å
92	Q	98	Very high	97.8	Very high	121 Å²	121	37.8 Å²	37.8	57%	0.565	18%	0.184	S	C	*	.	H	α-helix	trans	-54	-40.2	175.8	-177.3	-176.7	-15.9	0	0	111.8	S90 L94 E95 E96	S90-Q92 VanDerWaalsContact C-N 3.28Å; S90-Q92 PolarHBondContact O-N 3.49Å; Q92-L94 PolarHBondContact O-N 3.48Å; Q92-E95 PolarHBondContact O-N 2.94Å; Q92-E95 VanDerWaalsContact O-N 3.11Å; Q92-E96 HydrophobicContact CG-CG 4.43Å; Q92-E96 PolarHBondContact NE2-OE1 2.97Å; Q92-E96 WeakPolarHBondContact O-CG 3.41Å; Q92-E96 PolarHBondContact O-N 3.18Å
93	S	98.4	Very high	97.7	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-65.2	-25.5	-179.5	75.1	0	0	0	0	113.9	Y86 S87 S90 R91	Y86-S93 WeakPolarHBondContact CB-OG 3.24Å; S87-S93 PolarHBondContact N-OG 3.26Å; S87-S93 PolarHBondContact O-OG 3.25Å; S90-S93 WeakPolarHBondContact O-CB 3.4Å; S90-S93 PolarHBondContact O-N 3.05Å; S90-S93 VanDerWaalsContact O-N 3.12Å; S90-S93 PolarHBondContact O-OG 3.06Å; S90-S93 PolarHBondContact OG-N 3.33Å; R91-S93 PolarHBondContact O-N 3.42Å
94	L	98.5	Very high	97.6	Very high	5 Å²	5	39 Å²	39	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-76	-42.1	171.9	178.9	60.5	0	0	0	111.1	Y86 R91 Q92 E96 L97 L118 V131 M139	Y86-L94 HydrophobicContact CD1-CD1 3.68Å; Y86-L94 HydrophobicContact CD2-CB 3.89Å; Y86-L94 HydrophobicContact CD2-CD1 4.32Å; Y86-L94 HydrophobicContact CE1-CD1 3.89Å; Y86-L94 HydrophobicContact CE2-CB 4.46Å; Y86-L94 HydrophobicContact CE2-CD2 4.5Å; Y86-L94 HydrophobicContact CG-CB 3.99Å; Y86-L94 HydrophobicContact CG-CD1 3.91Å; R91-L94 WeakPolarHBondContact O-CB 3.24Å; R91-L94 PolarHBondContact O-N 3.41Å; Q92-L94 PolarHBondContact O-N 3.48Å; L94-E96 VanDerWaalsContact C-N 3.32Å; L94-E96 PolarHBondContact O-N 2.89Å; L94-L97 HydrophobicContact CD1-CD1 4.34Å; L94-L97 WeakPolarHBondContact O-CB 3.37Å; L94-L97 PolarHBondContact O-N 3.42Å; L94-L118 HydrophobicContact CD1-CD1 4.02Å; L94-L118 HydrophobicContact CD1-CD2 4.31Å; L94-V131 HydrophobicContact CD2-CG1 3.83Å; L94-V131 HydrophobicContact CD2-CG2 4.45Å; L94-M139 HydrophobicContact CD1-CE 4.34Å; L94-M139 HydrophobicContact CD1-SD 3.48Å; L94-M139 WeakPolarHBondContact CD1-SD 3.32Å; L94-M139 HydrophobicContact CD2-CE 3.71Å; L94-M139 HydrophobicContact CD2-SD 3.96Å; L94-M139 HydrophobicContact CG-CE 3.86Å; L94-M139 HydrophobicContact CG-SD 3.63Å
95	E	97.3	Very high	97.5	Very high	120 Å²	120	40.5 Å²	40.5	56%	0.561	20%	0.2	S	C	*	.	H	α-helix	trans	-63.5	-38.2	179.1	-65.8	176.4	178.8	0	0	112	R91 Q92 L97 K98	R91-E95 PolarHBondContact O-N 3.24Å; Q92-E95 PolarHBondContact O-N 2.94Å; Q92-E95 VanDerWaalsContact O-N 3.11Å; E95-L97 PolarHBondContact O-N 3.49Å; E95-L97 VanDerWaalsContact O-N 3.17Å; E95-K98 WeakPolarHBondContact O-CB 3.25Å; E95-K98 PolarHBondContact O-N 3.23Å; E95-K98 VanDerWaalsContact O-N 3.14Å
96	E	96.1	Very high	97.3	Very high	63 Å²	63	47.2 Å²	47.2	29%	0.294	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-17	176.1	-76.4	-176	-150.4	0	0	113.9	A15 S65 Q92 L94 P99	A15-E96 VanDerWaalsContact CB-OE2 3.3Å; A15-E96 WeakPolarHBondContact CB-OE2 3.42Å; S65-E96 PolarHBondContact OG-OE2 3.32Å; Q92-E96 HydrophobicContact CG-CG 4.43Å; Q92-E96 PolarHBondContact NE2-OE1 2.97Å; Q92-E96 WeakPolarHBondContact O-CG 3.41Å; Q92-E96 PolarHBondContact O-N 3.18Å; L94-E96 VanDerWaalsContact C-N 3.32Å; L94-E96 PolarHBondContact O-N 2.89Å; E96-P99 WeakPolarHBondContact O-CD 3.49Å
97	L	97.6	Very high	97.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-76.9	-22.2	176.2	-70.1	174.6	0	0	0	113	L84 Y86 L94 E95 I100 Y101 L118 W143	L84-L97 HydrophobicContact CB-CD1 3.98Å; L84-L97 HydrophobicContact CB-CD2 3.95Å; L84-L97 HydrophobicContact CB-CG 4.48Å; Y86-L97 HydrophobicContact CD1-CD1 4.28Å; L94-L97 HydrophobicContact CD1-CD1 4.34Å; L94-L97 WeakPolarHBondContact O-CB 3.37Å; L94-L97 PolarHBondContact O-N 3.42Å; E95-L97 PolarHBondContact O-N 3.49Å; E95-L97 VanDerWaalsContact O-N 3.17Å; L97-I100 HydrophobicContact CD2-CD1 4.4Å; L97-I100 PolarHBondContact O-N 2.94Å; L97-Y101 PolarHBondContact O-N 3.38Å; L97-L118 HydrophobicContact CD1-CD1 3.6Å; L97-W143 HydrophobicContact CB-CH2 3.78Å; L97-W143 HydrophobicContact CB-CZ3 4.1Å
98	K	97	Very high	97	Very high	111 Å²	111	52.4 Å²	52.4	48%	0.483	26%	0.255	S	S	.	.	H	α-helix	trans	-58.9	-49.7	-175	177.7	-176.5	173.1	-170	0	112.8	E95 I100 Y101 E102 W143	E95-K98 WeakPolarHBondContact O-CB 3.25Å; E95-K98 PolarHBondContact O-N 3.23Å; E95-K98 VanDerWaalsContact O-N 3.14Å; K98-I100 VanDerWaalsContact C-N 3.27Å; K98-I100 PolarHBondContact O-N 2.91Å; K98-Y101 PolarHBondContact O-N 3.35Å; K98-E102 WeakPolarHBondContact CE-OE1 3.27Å; K98-E102 WeakPolarHBondContact O-CG 3.19Å; K98-E102 PolarHBondContact O-N 3Å; K98-W143 HydrophobicContact CB-CH2 4.43Å; K98-W143 HydrophobicContact CB-CZ2 3.92Å; K98-W143 HydrophobicContact CG-CZ2 4.37Å
99	P	95.9	Very high	96.6	Very high	77 Å²	77	55 Å²	55	50%	0.5	28%	0.282	S	S	.	.	H	α-helix	trans	-61.7	-35.1	177.3	-22.6	34.4	0	0	0	113	E96 Q103	E96-P99 WeakPolarHBondContact O-CD 3.49Å; P99-Q103 WeakPolarHBondContact O-CB 3.3Å; P99-Q103 PolarHBondContact O-N 3.31Å
100	I	95.9	Very high	96	Very high	23 Å²	23	58.6 Å²	58.6	12%	0.118	30%	0.3	C	S	.	.	H	α-helix	trans	-67	-47	178.3	-56.9	178.2	0	0	0	110.1	F13 L84 L97 K98 Q103 I104	F13-I100 HydrophobicContact CB-CD1 4.15Å; F13-I100 HydrophobicContact CB-CG2 3.92Å; F13-I100 HydrophobicContact CD1-CG2 4.31Å; F13-I100 HydrophobicContact CD2-CG2 3.87Å; F13-I100 HydrophobicContact CE2-CG2 4.44Å; F13-I100 HydrophobicContact CG-CG2 3.79Å; L84-I100 HydrophobicContact CD2-CG2 4.18Å; L97-I100 HydrophobicContact CD2-CD1 4.4Å; L97-I100 PolarHBondContact O-N 2.94Å; K98-I100 VanDerWaalsContact C-N 3.27Å; K98-I100 PolarHBondContact O-N 2.91Å; I100-Q103 PolarHBondContact O-N 3.34Å; I100-I104 HydrophobicContact CG2-CD1 4.21Å; I100-I104 WeakPolarHBondContact O-CG1 3.39Å; I100-I104 PolarHBondContact O-N 3.27Å
101	Y	97.2	Very high	95.2	Very high	27 Å²	27	57.7 Å²	57.7	11%	0.106	29%	0.293	C	S	.	.	H	α-helix	trans	-58.7	-48.1	176	172.9	-98	0	0	0	111.4	L84 L97 K98 Q103 I104 C105 V111 I116 W143	L84-Y101 HydrophobicContact CD1-CD2 4.15Å; L97-Y101 PolarHBondContact O-N 3.38Å; K98-Y101 PolarHBondContact O-N 3.35Å; Y101-Q103 VanDerWaalsContact C-N 3.28Å; Y101-Q103 PolarHBondContact O-N 3.48Å; Y101-I104 WeakPolarHBondContact O-CB 3.35Å; Y101-I104 PolarHBondContact O-N 3.13Å; Y101-I104 VanDerWaalsContact O-N 3.13Å; Y101-C105 WeakPolarHBondContact CE1-SG 3.36Å; Y101-C105 PolarHBondContact O-N 3.16Å; Y101-C105 PolarHBondContact O-SG 3.17Å; Y101-V111 HydrophobicContact CE2-CG1 4.37Å; Y101-I116 HydrophobicContact CD2-CD1 4.43Å; Y101-I116 HydrophobicContact CE2-CD1 4.15Å; Y101-W143 AromaticContact CD1-CD1 3.95Å; Y101-W143 AromaticContact CD1-CD2 3.81Å; Y101-W143 HydrophobicContact CD1-CD2 3.81Å; Y101-W143 AromaticContact CD1-CE2 3.92Å; Y101-W143 HydrophobicContact CD1-CE3 4.34Å; Y101-W143 AromaticContact CD1-CG 3.87Å; Y101-W143 HydrophobicContact CD1-CG 3.87Å; Y101-W143 AromaticContact CD1-NE1 3.97Å; Y101-W143 HydrophobicContact CD2-CB 4.25Å; Y101-W143 HydrophobicContact CD2-CD2 4.02Å; Y101-W143 AromaticContact CD2-CE3 3.86Å; Y101-W143 HydrophobicContact CD2-CE3 3.86Å; Y101-W143 HydrophobicContact CD2-CG 4.21Å; Y101-W143 HydrophobicContact CE1-CB 4Å; Y101-W143 AromaticContact CE1-CD1 3.72Å; Y101-W143 HydrophobicContact CE1-CD2 4.16Å; Y101-W143 AromaticContact CE1-CG 3.7Å; Y101-W143 HydrophobicContact CE1-CG 3.7Å; Y101-W143 HydrophobicContact CE2-CB 3.71Å; Y101-W143 HydrophobicContact CE2-CD2 4.35Å; Y101-W143 HydrophobicContact CE2-CE3 4.47Å; Y101-W143 HydrophobicContact CE2-CG 4.06Å; Y101-W143 AromaticContact CG-CD2 3.75Å; Y101-W143 HydrophobicContact CG-CD2 3.75Å; Y101-W143 AromaticContact CG-CE3 3.81Å; Y101-W143 HydrophobicContact CG-CE3 3.81Å; Y101-W143 HydrophobicContact CG-CG 4.13Å; Y101-W143 HydrophobicContact CG-CZ3 4.25Å; Y101-W143 AromaticContact CZ-CG 3.82Å; Y101-W143 PolarHBondContact OH-O 2.92Å
102	E	96	Very high	94.5	Very high	87 Å²	87	58.6 Å²	58.6	41%	0.407	30%	0.301	S	S	.	.	H	α-helix	trans	-59.3	-39.4	177	-72.4	172.7	176.3	0	0	112	K98 C105 Q106	K98-E102 WeakPolarHBondContact CE-OE1 3.27Å; K98-E102 WeakPolarHBondContact O-CG 3.19Å; K98-E102 PolarHBondContact O-N 3Å; E102-C105 WeakPolarHBondContact O-CB 3.34Å; E102-C105 PolarHBondContact O-N 3.02Å; E102-Q106 WeakPolarHBondContact O-CG 3.35Å; E102-Q106 PolarHBondContact O-N 3.14Å
103	Q	95.9	Very high	93.9	Very high	28 Å²	28	54.5 Å²	54.5	13%	0.131	29%	0.286	C	S	.	.	H	α-helix	trans	-68.8	-35.5	176.6	-167.8	175.5	-44.8	0	0	112.7	I76 P99 I100 Y101 C105 Q106 I107	I76-Q103 HydrophobicContact CD1-CB 4.12Å; I76-Q103 HydrophobicContact CD1-CG 3.82Å; P99-Q103 WeakPolarHBondContact O-CB 3.3Å; P99-Q103 PolarHBondContact O-N 3.31Å; I100-Q103 PolarHBondContact O-N 3.34Å; Y101-Q103 VanDerWaalsContact C-N 3.28Å; Y101-Q103 PolarHBondContact O-N 3.48Å; Q103-C105 VanDerWaalsContact C-N 3.35Å; Q103-Q106 PolarHBondContact O-N 2.8Å; Q103-I107 HydrophobicContact CG-CD1 3.86Å; Q103-I107 WeakPolarHBondContact O-CG1 3.46Å; Q103-I107 PolarHBondContact O-N 2.93Å; Q103-I107 VanDerWaalsContact O-N 3.09Å
104	I	96.8	Very high	93.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.9	-48.4	170.2	-68.9	163.6	0	0	0	109.5	F13 I76 F82 L84 I100 Y101 Q106 I107 K108 I116	F13-I104 HydrophobicContact CD2-CD1 4.48Å; I76-I104 HydrophobicContact CD1-CG1 3.92Å; I76-I104 HydrophobicContact CG1-CG1 3.92Å; I76-I104 HydrophobicContact CG2-CB 4.39Å; I76-I104 HydrophobicContact CG2-CG1 4.03Å; F82-I104 HydrophobicContact CB-CD1 4Å; F82-I104 HydrophobicContact CD1-CD1 3.99Å; F82-I104 HydrophobicContact CD1-CG1 4.38Å; F82-I104 HydrophobicContact CD2-CD1 4.2Å; F82-I104 HydrophobicContact CD2-CG1 4.46Å; F82-I104 HydrophobicContact CD2-CG2 3.82Å; F82-I104 HydrophobicContact CE2-CG2 3.83Å; F82-I104 HydrophobicContact CG-CD1 3.77Å; F82-I104 HydrophobicContact CG-CG1 4.36Å; F82-I104 HydrophobicContact CG-CG2 4.48Å; L84-I104 HydrophobicContact CD2-CD1 3.94Å; I100-I104 HydrophobicContact CG2-CD1 4.21Å; I100-I104 WeakPolarHBondContact O-CG1 3.39Å; I100-I104 PolarHBondContact O-N 3.27Å; Y101-I104 WeakPolarHBondContact O-CB 3.35Å; Y101-I104 PolarHBondContact O-N 3.13Å; Y101-I104 VanDerWaalsContact O-N 3.13Å; I104-Q106 VanDerWaalsContact C-N 3.34Å; I104-Q106 PolarHBondContact O-N 3.4Å; I104-I107 PolarHBondContact O-N 2.85Å; I104-K108 HydrophobicContact CG2-CG 4.22Å; I104-K108 VanDerWaalsContact O-CB 3.22Å; I104-K108 WeakPolarHBondContact O-CB 3.48Å; I104-K108 WeakPolarHBondContact O-CG 3.23Å; I104-K108 PolarHBondContact O-N 3.37Å; I104-I116 HydrophobicContact CG2-CD1 3.93Å
105	C	95.6	Very high	93.7	Very high	32 Å²	32	55 Å²	55	22%	0.216	29%	0.288	C	S	.	.	H	α-helix	trans	-54.9	-49.6	178.1	-56.5	0	0	0	0	111.7	Y101 E102 Q103 I107 G109 V111	Y101-C105 WeakPolarHBondContact CE1-SG 3.36Å; Y101-C105 PolarHBondContact O-N 3.16Å; Y101-C105 PolarHBondContact O-SG 3.17Å; E102-C105 WeakPolarHBondContact O-CB 3.34Å; E102-C105 PolarHBondContact O-N 3.02Å; Q103-C105 VanDerWaalsContact C-N 3.35Å; C105-I107 PolarHBondContact O-N 3.26Å; C105-G109 WeakPolarHBondContact O-CA 3.39Å; C105-G109 PolarHBondContact O-N 2.98Å; C105-V111 VanDerWaalsContact CA-CG2 3.49Å; C105-V111 HydrophobicContact CB-CG2 3.8Å; C105-V111 VanDerWaalsContact SG-CG2 3.57Å
106	Q	95.8	Very high	93.7	Very high	141 Å²	141	49.5 Å²	49.5	66%	0.659	26%	0.263	S	S	*	.	H	α-helix	trans	-63.1	-43.3	-177.8	-72.3	173	8.5	0	0	113.1	E102 Q103 I104	E102-Q106 WeakPolarHBondContact O-CG 3.35Å; E102-Q106 PolarHBondContact O-N 3.14Å; Q103-Q106 PolarHBondContact O-N 2.8Å; I104-Q106 VanDerWaalsContact C-N 3.34Å; I104-Q106 PolarHBondContact O-N 3.4Å
107	I	96.3	Very high	93.8	Very high	56 Å²	56	46.7 Å²	46.7	29%	0.287	25%	0.25	S	C	.	.	H	α-helix	trans	-77.8	-33	-174.8	-68.2	171	0	0	0	111.4	R73 I76 Q103 I104 C105	R73-I107 HydrophobicContact CB-CD1 4.13Å; R73-I107 HydrophobicContact CG-CD1 3.99Å; I76-I107 HydrophobicContact CB-CD1 3.98Å; I76-I107 HydrophobicContact CD1-CD1 4.21Å; I76-I107 HydrophobicContact CG2-CB 3.74Å; I76-I107 HydrophobicContact CG2-CD1 3.81Å; I76-I107 HydrophobicContact CG2-CG1 4.35Å; I76-I107 HydrophobicContact CG2-CG2 3.78Å; Q103-I107 HydrophobicContact CG-CD1 3.86Å; Q103-I107 WeakPolarHBondContact O-CG1 3.46Å; Q103-I107 PolarHBondContact O-N 2.93Å; Q103-I107 VanDerWaalsContact O-N 3.09Å; I104-I107 PolarHBondContact O-N 2.85Å; C105-I107 PolarHBondContact O-N 3.26Å
108	K	94.5	Very high	93.9	Very high	57 Å²	57	46.7 Å²	46.7	25%	0.248	25%	0.25	C	C	.	.	H	α-helix	trans	-94	-22.5	-174.5	-69.8	-57.4	-161.3	-170.1	0	114.7	I76 S77 G79 F82 I104 D110 I114	I76-K108 HydrophobicContact CG2-CG 4.39Å; I76-K108 WeakPolarHBondContact O-CE 3.15Å; I76-K108 PolarHBondContact O-NZ 2.91Å; S77-K108 PolarHBondContact O-NZ 3.28Å; G79-K108 VanDerWaalsContact O-CE 3.23Å; G79-K108 WeakPolarHBondContact O-CE 3.32Å; G79-K108 PolarHBondContact O-NZ 2.98Å; F82-K108 HydrophobicContact CE2-CG 4.31Å; I104-K108 HydrophobicContact CG2-CG 4.22Å; I104-K108 VanDerWaalsContact O-CB 3.22Å; I104-K108 WeakPolarHBondContact O-CB 3.48Å; I104-K108 WeakPolarHBondContact O-CG 3.23Å; I104-K108 PolarHBondContact O-N 3.37Å; K108-D110 PolarHBondContact O-N 3.09Å; K108-D110 VanDerWaalsContact O-N 3.14Å; K108-I114 HydrophobicContact CB-CD1 3.22Å; K108-I114 HydrophobicContact CD-CD1 3.58Å; K108-I114 HydrophobicContact CG-CD1 3.29Å
109	G	90	Very high	94	Very high	55 Å²	55	41.4 Å²	41.4	57%	0.567	23%	0.227	S	C	*	.	S	Bend	trans	76.3	-93.3	-175.8	0	0	0	0	0	111.4	C105 V111	C105-G109 WeakPolarHBondContact O-CA 3.39Å; C105-G109 PolarHBondContact O-N 2.98Å; G109-V111 PolarHBondContact O-N 2.91Å; G109-V111 VanDerWaalsContact O-N 3.07Å
110	D	86.1	Confident	94.1	Very high	98 Å²	98	37.7 Å²	37.7	52%	0.524	20%	0.203	S	C	.	.			trans	-79.7	90.8	-175.4	-176.9	8.6	0	0	0	112.2	K108 E112 S113	K108-D110 PolarHBondContact O-N 3.09Å; K108-D110 VanDerWaalsContact O-N 3.14Å; D110-E112 VanDerWaalsContact C-N 3.33Å; D110-E112 PolarHBondContact O-N 2.84Å; D110-E112 PolarHBondContact OD1-N 2.97Å; D110-S113 PolarHBondContact O-N 2.67Å; D110-S113 PolarHBondContact O-OG 3.35Å
111	V	81.5	Confident	94.3	Very high	17 Å²	17	36.8 Å²	36.8	10%	0.103	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-64.8	-31.6	179.5	159.8	0	0	0	0	113.7	Y101 C105 G109 S113 I114 I116	Y101-V111 HydrophobicContact CE2-CG1 4.37Å; C105-V111 VanDerWaalsContact CA-CG2 3.49Å; C105-V111 HydrophobicContact CB-CG2 3.8Å; C105-V111 VanDerWaalsContact SG-CG2 3.57Å; G109-V111 PolarHBondContact O-N 2.91Å; G109-V111 VanDerWaalsContact O-N 3.07Å; V111-S113 PolarHBondContact O-N 3.18Å; V111-I114 PolarHBondContact O-N 3.23Å; V111-I116 HydrophobicContact CG1-CD1 4.04Å
112	E	84.4	Confident	94.3	Very high	109 Å²	109	38 Å²	38	51%	0.509	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-70.2	-15	-178.2	-62.6	-174.4	-170.1	0	0	112.4	D110 K144 K170	D110-E112 VanDerWaalsContact C-N 3.33Å; D110-E112 PolarHBondContact O-N 2.84Å; D110-E112 PolarHBondContact OD1-N 2.97Å; E112-K144 HydrophobicContact CG-CD 4.17Å; E112-K144 VanDerWaalsContact OE1-CD 3.22Å; E112-K144 WeakPolarHBondContact OE1-CD 3.26Å; E112-K144 WeakPolarHBondContact OE1-CE 3.34Å; E112-K144 IonicContact OE1-NZ 2.65Å; E112-K144 PolarHBondContact OE1-NZ 2.82Å; E112-K170 PolarHBondContact O-NZ 2.96Å; E112-K170 VanDerWaalsContact O-NZ 3.12Å
113	S	85.5	Confident	94.4	Very high	35 Å²	35	35 Å²	35	25%	0.245	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-87	-9.1	172.7	80	0	0	0	0	113.8	D110 V111	D110-S113 PolarHBondContact O-N 2.67Å; D110-S113 PolarHBondContact O-OG 3.35Å; V111-S113 PolarHBondContact O-N 3.18Å
114	I	93.9	Very high	94.5	Very high	17 Å²	17	36 Å²	36	9%	0.087	20%	0.197	C	C	.	.	S	Bend	trans	-110	128	-172	-62.9	-171	0	0	0	110.9	F82 K108 V111 I116	F82-I114 HydrophobicContact CD2-CG2 3.73Å; F82-I114 HydrophobicContact CE2-CG2 3.78Å; K108-I114 HydrophobicContact CB-CD1 3.22Å; K108-I114 HydrophobicContact CD-CD1 3.58Å; K108-I114 HydrophobicContact CG-CD1 3.29Å; V111-I114 PolarHBondContact O-N 3.23Å; I114-I116 HydrophobicContact CG2-CG1 4.07Å; I114-I116 PolarHBondContact O-N 3.07Å; I114-I116 VanDerWaalsContact O-N 3.09Å
115	P	97.6	Very high	94.5	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.013	21%	0.211	C	C	.	.			trans	-62.7	114.2	171.7	-25.7	37.7	0	0	0	111.2	A81 F82 L165 L168 E169	A81-P115 WeakPolarHBondContact CA-O 3.35Å; A81-P115 HydrophobicContact CB-CB 3.76Å; A81-P115 HydrophobicContact CB-CG 4.29Å; F82-P115 PolarHBondContact N-O 3.45Å; P115-L165 HydrophobicContact CB-CD1 3.87Å; P115-L165 HydrophobicContact CB-CG 4.34Å; P115-L168 HydrophobicContact CB-CB 3.86Å; P115-L168 HydrophobicContact CG-CB 4.11Å; P115-E169 HydrophobicContact CG-CB 4.06Å
116	I	98.4	Very high	94.5	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	128.3	172.3	-55.4	179.5	0	0	0	107.9	F82 L84 Y101 I104 V111 I114 C145 A146	F82-I116 HydrophobicContact CB-CG1 4.38Å; F82-I116 HydrophobicContact CD2-CG1 4.29Å; F82-I116 WeakPolarHBondContact O-CA 3.05Å; L84-I116 HydrophobicContact CD1-CG2 3.95Å; L84-I116 HydrophobicContact CG-CG2 4.15Å; Y101-I116 HydrophobicContact CD2-CD1 4.43Å; Y101-I116 HydrophobicContact CE2-CD1 4.15Å; I104-I116 HydrophobicContact CG2-CD1 3.93Å; V111-I116 HydrophobicContact CG1-CD1 4.04Å; I114-I116 HydrophobicContact CG2-CG1 4.07Å; I114-I116 PolarHBondContact O-N 3.07Å; I114-I116 VanDerWaalsContact O-N 3.09Å; I116-C145 HydrophobicContact CB-CB 3.79Å; I116-C145 HydrophobicContact CG2-CB 3.82Å; I116-C145 WeakPolarHBondContact O-CB 3.39Å; I116-A146 PolarHBondContact O-N 3.34Å
117	M	98.7	Very high	94.6	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.02	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	119.5	173.2	-175	73.4	69.6	0	0	110	F82 I83 L84 V119 A146 M148 L161 E164 L165 L168	F82-M117 PolarHBondContact O-N 2.9Å; I83-M117 WeakPolarHBondContact CA-O 3.47Å; L84-M117 PolarHBondContact N-O 3.29Å; M117-V119 HydrophobicContact CB-CG2 4.42Å; M117-V119 HydrophobicContact CG-CG2 3.65Å; M117-A146 HydrophobicContact CE-CB 3.65Å; M117-A146 VanDerWaalsContact SD-C 3.52Å; M117-A146 HydrophobicContact SD-CB 3.45Å; M117-A146 WeakPolarHBondContact SD-CB 3.23Å; M117-M148 HydrophobicContact SD-CB 4.05Å; M117-L161 HydrophobicContact CB-CD1 4.18Å; M117-L161 HydrophobicContact CG-CD1 3.49Å; M117-L161 VanDerWaalsContact CG-CD1 3.49Å; M117-E164 HydrophobicContact CE-CB 3.87Å; M117-L165 HydrophobicContact CB-CD1 3.85Å; M117-L168 HydrophobicContact CE-CD1 4.47Å
118	L	98.9	Very high	94.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	128.7	165.2	-179.2	64	0	0	0	109.1	L84 Y86 L94 L97 M139 A140 W143 A146 F147 M148	L84-L118 HydrophobicContact CB-CD1 4.26Å; Y86-L118 HydrophobicContact CD1-CD1 3.88Å; Y86-L118 HydrophobicContact CD1-CG 4.36Å; Y86-L118 HydrophobicContact CE1-CD1 4.09Å; Y86-L118 HydrophobicContact CE1-CD2 4.48Å; Y86-L118 HydrophobicContact CE1-CG 4.07Å; L94-L118 HydrophobicContact CD1-CD1 4.02Å; L94-L118 HydrophobicContact CD1-CD2 4.31Å; L97-L118 HydrophobicContact CD1-CD1 3.6Å; L118-M139 HydrophobicContact CD2-CB 4.13Å; L118-M139 HydrophobicContact CD2-CG 4.3Å; L118-A140 HydrophobicContact CB-CB 4.4Å; L118-A140 HydrophobicContact CD2-CB 4.12Å; L118-W143 HydrophobicContact CD1-CZ3 4.16Å; L118-A146 PolarHBondContact N-O 3.09Å; L118-F147 HydrophobicContact CB-CD2 4.29Å; L118-F147 HydrophobicContact CD2-CD2 4.16Å; L118-F147 HydrophobicContact CG-CD2 4.12Å; L118-F147 WeakPolarHBondContact O-CA 3.39Å; L118-M148 PolarHBondContact O-N 3.38Å
119	V	98.9	Very high	94.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	114.3	-172.9	-178.9	0	0	0	0	111.4	L23 I83 L84 V85 Y86 M117 N121 M148 T150 L161	L23-V119 HydrophobicContact CD1-CG1 4.17Å; I83-V119 HydrophobicContact CG2-CB 4.39Å; I83-V119 HydrophobicContact CG2-CG2 3.63Å; L84-V119 PolarHBondContact O-N 3.18Å; V85-V119 WeakPolarHBondContact CA-O 3.27Å; V85-V119 HydrophobicContact CG2-CB 4.39Å; Y86-V119 WeakPolarHBondContact CD1-O 3.3Å; Y86-V119 PolarHBondContact N-O 3.17Å; M117-V119 HydrophobicContact CB-CG2 4.42Å; M117-V119 HydrophobicContact CG-CG2 3.65Å; V119-N121 HydrophobicContact CG1-CB 4.49Å; V119-N121 PolarHBondContact O-N 2.88Å; V119-M148 VanDerWaalsContact CA-O 3.3Å; V119-M148 WeakPolarHBondContact CA-O 3.43Å; V119-T150 HydrophobicContact CG1-CG2 3.78Å; V119-T150 WeakPolarHBondContact CG1-OG1 3.46Å; V119-L161 HydrophobicContact CG1-CD2 4.36Å; V119-L161 HydrophobicContact CG2-CD1 3.44Å; V119-L161 VanDerWaalsContact CG2-CD1 3.44Å; V119-L161 HydrophobicContact CG2-CD2 4.07Å; V119-L161 HydrophobicContact CG2-CG 4.41Å
120	G	98.8	Very high	95.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	95.7	168.2	0	0	0	0	0	110.4	Y86 M148 E149 T150	Y86-G120 VanDerWaalsContact CZ-CA 3.41Å; G120-M148 PolarHBondContact N-O 3.47Å; G120-E149 CarbonylContact O-C 3.58Å; G120-E149 WeakPolarHBondContact O-CA 3.09Å; G120-T150 PolarHBondContact O-N 2.72Å
121	N	98.8	Very high	95.8	Very high	3 Å²	3	44 Å²	44	2%	0.016	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	165.9	-178	-169.5	40.5	0	0	0	112.2	V18 L23 V85 Y86 I88 V119 T150 A152	V18-N121 PolarHBondContact O-ND2 3.12Å; L23-N121 HydrophobicContact CD1-CB 4.29Å; V85-N121 HydrophobicContact CG1-CB 3.83Å; Y86-N121 PolarHBondContact O-N 2.85Å; I88-N121 PolarHBondContact N-O 3.14Å; V119-N121 HydrophobicContact CG1-CB 4.49Å; V119-N121 PolarHBondContact O-N 2.88Å; N121-T150 CarbonylContact C-O 3.55Å; N121-T150 WeakPolarHBondContact CA-O 3.45Å; N121-T150 PolarHBondContact OD1-O 3.02Å; N121-T150 PolarHBondContact OD1-OG1 2.86Å; N121-A152 PolarHBondContact OD1-N 2.85Å
122	K	98.4	Very high	96.6	Very high	52 Å²	52	48 Å²	48	23%	0.226	24%	0.235	C	C	.	.			trans	66.9	35.9	-176.9	-44.6	-167.7	-164.7	176	0	113.4	G17 S87 I88 D124 E125 T150	G17-K122 VanDerWaalsContact O-CE 3.25Å; G17-K122 WeakPolarHBondContact O-CE 3.46Å; G17-K122 PolarHBondContact O-NZ 3.27Å; S87-K122 WeakPolarHBondContact OG-CD 3.46Å; I88-K122 WeakPolarHBondContact CD1-O 3.36Å; I88-K122 WeakPolarHBondContact CG1-O 3.5Å; K122-D124 WeakPolarHBondContact CA-OD1 3Å; K122-D124 PolarHBondContact O-N 2.97Å; K122-E125 HydrophobicContact CB-CG 4.34Å; K122-E125 WeakPolarHBondContact CD-OE1 3.42Å; K122-E125 WeakPolarHBondContact O-CB 3.47Å; K122-E125 PolarHBondContact O-N 2.96Å; K122-T150 PolarHBondContact N-O 3.31Å
123	N	98.1	Very high	97.3	Very high	26 Å²	26	44.7 Å²	44.7	14%	0.139	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-7.1	178.1	78.6	-24.1	0	0	0	114.2	I88 E125 E149 T150 S151 H156	I88-N123 HydrophobicContact CD1-CB 4.44Å; N123-E125 VanDerWaalsContact C-N 3.27Å; N123-E149 HydrophobicContact CB-CB 4.14Å; N123-E149 WeakPolarHBondContact CB-OE2 3.19Å; N123-T150 PolarHBondContact N-O 3.27Å; N123-T150 VanDerWaalsContact N-O 3.1Å; N123-T150 PolarHBondContact OD1-O 3.11Å; N123-S151 WeakPolarHBondContact OD1-CB 3.44Å; N123-S151 PolarHBondContact OD1-N 3.25Å; N123-H156 PolarHBondContact ND2-ND1 2.79Å
124	D	98.2	Very high	97.9	Very high	47 Å²	47	46.6 Å²	46.6	25%	0.251	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-18.5	166.1	57.5	-74.9	0	0	0	114	K122 N126 S151 K153 L154	K122-D124 WeakPolarHBondContact CA-OD1 3Å; K122-D124 PolarHBondContact O-N 2.97Å; D124-N126 VanDerWaalsContact C-N 3.34Å; D124-N126 PolarHBondContact O-N 2.99Å; D124-S151 VanDerWaalsContact CG-OG 3.26Å; D124-S151 WeakPolarHBondContact OD1-CB 3.38Å; D124-S151 PolarHBondContact OD1-OG 3.24Å; D124-K153 VanDerWaalsContact OD2-CD 3.28Å; D124-K153 WeakPolarHBondContact OD2-CD 3.02Å; D124-L154 HydrophobicContact CB-CD1 3.53Å; D124-L154 HydrophobicContact CB-CG 3.83Å
125	E	97.1	Very high	98.1	Very high	66 Å²	66	48.7 Å²	48.7	31%	0.308	25%	0.247	S	C	.	.			trans	-95.2	38.9	-179.9	-61.5	-179.6	-158.5	0	0	112.6	T89 K122 N123 Q127 N128	T89-E125 HydrophobicContact CG2-CB 3.57Å; T89-E125 WeakPolarHBondContact CG2-OE2 3.43Å; K122-E125 HydrophobicContact CB-CG 4.34Å; K122-E125 WeakPolarHBondContact CD-OE1 3.42Å; K122-E125 WeakPolarHBondContact O-CB 3.47Å; K122-E125 PolarHBondContact O-N 2.96Å; N123-E125 VanDerWaalsContact C-N 3.27Å; E125-Q127 PolarHBondContact O-N 3.29Å; E125-N128 PolarHBondContact O-N 3.13Å
126	N	95.1	Very high	98.2	Very high	96 Å²	96	48.6 Å²	48.6	51%	0.513	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-54.7	-26.9	-176.1	-93.1	-26.1	0	0	0	114.8	D124 N128 R129	D124-N126 VanDerWaalsContact C-N 3.34Å; D124-N126 PolarHBondContact O-N 2.99Å; N126-N128 PolarHBondContact O-N 3.33Å; N126-R129 WeakPolarHBondContact O-CB 3.22Å; N126-R129 PolarHBondContact O-N 3.33Å; N126-R129 PolarHBondContact OD1-NE 3.06Å; N126-R129 PolarHBondContact OD1-NH2 2.76Å
127	Q	97.3	Very high	98.2	Very high	194 Å²	194	53.8 Å²	53.8	91%	0.907	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-67.6	-23.3	177.7	-62.9	-175.5	7.7	0	0	113.1	E125	E125-Q127 PolarHBondContact O-N 3.29Å
128	N	97.4	Very high	98.2	Very high	102 Å²	102	56.4 Å²	56.4	55%	0.545	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-107.8	18.9	-180	-58.9	-35.3	0	0	0	111.4	T89 E125 N126 E130	T89-N128 VanDerWaalsContact CA-O 3.32Å; T89-N128 WeakPolarHBondContact CA-O 3.46Å; T89-N128 WeakPolarHBondContact CB-O 3.39Å; T89-N128 HydrophobicContact CG2-CB 3.76Å; T89-N128 WeakPolarHBondContact CG2-O 3.42Å; E125-N128 PolarHBondContact O-N 3.13Å; N126-N128 PolarHBondContact O-N 3.33Å; N128-E130 PolarHBondContact O-N 3.26Å
129	R	98.5	Very high	98.1	Very high	46 Å²	46	59 Å²	59	17%	0.174	31%	0.305	C	S	.	.			trans	-64.9	127.2	-175.8	-179.2	175.5	-74.5	-96.1	11.4	110.5	I88 N126 V131 E132 E149	I88-R129 HydrophobicContact CD1-CB 4.29Å; I88-R129 HydrophobicContact CD1-CG 4.32Å; N126-R129 WeakPolarHBondContact O-CB 3.22Å; N126-R129 PolarHBondContact O-N 3.33Å; N126-R129 PolarHBondContact OD1-NE 3.06Å; N126-R129 PolarHBondContact OD1-NH2 2.76Å; R129-V131 WeakPolarHBondContact CD-O 3.49Å; R129-V131 VanDerWaalsContact CG-O 3.23Å; R129-V131 WeakPolarHBondContact CG-O 3.34Å; R129-V131 PolarHBondContact NH1-O 2.88Å; R129-E132 WeakPolarHBondContact CD-OE1 3.43Å; R129-E149 IonicContact CZ-OE1 3.56Å; R129-E149 IonicContact CZ-OE2 3.71Å; R129-E149 IonicContact NH1-OE1 2.8Å; R129-E149 PolarHBondContact NH1-OE1 3.25Å; R129-E149 IonicContact NH1-OE2 3.41Å; R129-E149 IonicContact NH2-OE1 3.86Å; R129-E149 PolarHBondContact NH2-OE1 3.41Å; R129-E149 IonicContact NH2-OE2 3.75Å; R129-E149 PolarHBondContact NH2-OE2 2.99Å
130	E	98.6	Very high	98.1	Very high	104 Å²	104	59.1 Å²	59.1	49%	0.486	31%	0.306	S	S	.	.			trans	-109.7	-20.4	172.6	-65.3	-173.3	-177.9	0	0	112.5	I88 S90 R91 N128	I88-E130 PolarHBondContact O-N 3.22Å; S90-E130 VanDerWaalsContact CA-OE2 3.28Å; S90-E130 WeakPolarHBondContact CA-OE2 3.36Å; R91-E130 HydrophobicContact CB-CB 4.34Å; R91-E130 PolarHBondContact N-OE2 2.94Å; R91-E130 PolarHBondContact NH2-O 2.92Å; N128-E130 PolarHBondContact O-N 3.26Å
131	V	98.6	Very high	98	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.343	C	S	.	.	S	Bend	trans	-122.9	117.2	-179	-177.5	0	0	0	0	109.3	Y86 I88 R91 L94 R129 E135	Y86-V131 HydrophobicContact CE2-CB 3.97Å; Y86-V131 HydrophobicContact CE2-CG1 3.76Å; Y86-V131 HydrophobicContact CE2-CG2 4.26Å; I88-V131 PolarHBondContact O-N 2.96Å; I88-V131 VanDerWaalsContact O-N 3.08Å; R91-V131 HydrophobicContact CB-CG2 4.02Å; R91-V131 HydrophobicContact CG-CG2 4.48Å; L94-V131 HydrophobicContact CD2-CG1 3.83Å; L94-V131 HydrophobicContact CD2-CG2 4.45Å; R129-V131 WeakPolarHBondContact CD-O 3.49Å; R129-V131 VanDerWaalsContact CG-O 3.23Å; R129-V131 WeakPolarHBondContact CG-O 3.34Å; R129-V131 PolarHBondContact NH1-O 2.88Å; V131-E135 HydrophobicContact CG1-CB 4.04Å
132	E	98.5	Very high	97.9	Very high	102 Å²	102	75.4 Å²	75.4	48%	0.477	38%	0.377	S	S	.	.			trans	-71.4	151.9	175.6	-69.1	-56.7	142.2	0	0	111.9	R129 S134 E135 G136	R129-E132 WeakPolarHBondContact CD-OE1 3.43Å; E132-S134 PolarHBondContact O-N 3.39Å; E132-E135 HydrophobicContact CB-CG 4.2Å; E132-E135 PolarHBondContact N-OE2 3.16Å; E132-E135 WeakPolarHBondContact O-CB 3.37Å; E132-E135 PolarHBondContact O-N 2.83Å; E132-G136 PolarHBondContact O-N 3.33Å
133	S	98.2	Very high	97.9	Very high	38 Å²	38	73.9 Å²	73.9	27%	0.266	37%	0.37	S	S	.	.	H	α-helix	trans	-58.4	-38.6	179.7	-142.1	0	0	0	0	111.8	E135 G136 E137 E149	S133-E135 VanDerWaalsContact C-N 3.26Å; S133-E135 PolarHBondContact O-N 2.93Å; S133-G136 PolarHBondContact O-N 3.34Å; S133-G136 VanDerWaalsContact O-N 3.16Å; S133-E137 WeakPolarHBondContact O-CG 3.39Å; S133-E137 PolarHBondContact O-N 2.91Å; S133-E149 WeakPolarHBondContact CA-OE1 3.43Å; S133-E149 VanDerWaalsContact CB-OE1 3.27Å; S133-E149 WeakPolarHBondContact CB-OE1 3.32Å; S133-E149 VanDerWaalsContact OG-CD 3.23Å; S133-E149 PolarHBondContact OG-OE1 3.5Å
134	S	98.4	Very high	97.7	Very high	76 Å²	76	79.3 Å²	79.3	53%	0.531	39%	0.392	S	S	.	.	H	α-helix	trans	-62.2	-29.4	176.3	57.1	0	0	0	0	113.4	E132 A138	E132-S134 PolarHBondContact O-N 3.39Å; S134-A138 VanDerWaalsContact O-CB 3.23Å; S134-A138 WeakPolarHBondContact O-CB 3.33Å; S134-A138 PolarHBondContact O-N 3.21Å
135	E	98.3	Very high	97.7	Very high	61 Å²	61	78.1 Å²	78.1	29%	0.285	39%	0.387	S	S	.	.	H	α-helix	trans	-72.9	-41.3	174.9	-63.8	-178	82.4	0	0	111.4	R91 V131 E132 S133 A138 M139	R91-E135 IonicContact CZ-OE1 2.71Å; R91-E135 VanDerWaalsContact CZ-OE1 3.24Å; R91-E135 IonicContact CZ-OE2 2.83Å; R91-E135 IonicContact NH1-OE1 2.87Å; R91-E135 PolarHBondContact NH1-OE1 3.28Å; R91-E135 IonicContact NH2-OE1 2.84Å; R91-E135 PolarHBondContact NH2-OE1 3.41Å; R91-E135 IonicContact NH2-OE2 3.24Å; R91-E135 PolarHBondContact NH2-OE2 3.01Å; V131-E135 HydrophobicContact CG1-CB 4.04Å; E132-E135 HydrophobicContact CB-CG 4.2Å; E132-E135 PolarHBondContact N-OE2 3.16Å; E132-E135 WeakPolarHBondContact O-CB 3.37Å; E132-E135 PolarHBondContact O-N 2.83Å; S133-E135 VanDerWaalsContact C-N 3.26Å; S133-E135 PolarHBondContact O-N 2.93Å; E135-A138 PolarHBondContact O-N 3.42Å; E135-M139 WeakPolarHBondContact O-CB 3.22Å; E135-M139 PolarHBondContact O-N 2.77Å
136	G	98.2	Very high	97.7	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-60.5	-46.4	172.6	0	0	0	0	0	111.9	E132 S133 M139 A140	E132-G136 PolarHBondContact O-N 3.33Å; S133-G136 PolarHBondContact O-N 3.34Å; S133-G136 VanDerWaalsContact O-N 3.16Å; G136-M139 PolarHBondContact O-N 2.92Å; G136-A140 WeakPolarHBondContact O-CB 3.48Å; G136-A140 PolarHBondContact O-N 2.97Å
137	E	98.5	Very high	97.9	Very high	112 Å²	112	73.9 Å²	73.9	52%	0.523	37%	0.368	S	S	.	.	H	α-helix	trans	-60.3	-46.2	174.4	-72.3	177.6	-175.7	0	0	112.4	S133 M139 A140 K141 F147	S133-E137 WeakPolarHBondContact O-CG 3.39Å; S133-E137 PolarHBondContact O-N 2.91Å; E137-M139 VanDerWaalsContact C-N 3.29Å; E137-M139 PolarHBondContact O-N 3.32Å; E137-A140 PolarHBondContact O-N 2.71Å; E137-K141 WeakPolarHBondContact O-CB 3.3Å; E137-K141 PolarHBondContact O-N 3.09Å; E137-F147 HydrophobicContact CB-CD1 4.35Å; E137-F147 HydrophobicContact CG-CD1 3.41Å; E137-F147 VanDerWaalsContact CG-CD1 3.41Å; E137-F147 HydrophobicContact CG-CE1 3.64Å; E137-F147 HydrophobicContact CG-CG 4.33Å
138	A	98.6	Very high	98	Very high	59 Å²	59	66 Å²	66	49%	0.488	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-39.3	178	0	0	0	0	0	111.6	S134 E135 K142	S134-A138 VanDerWaalsContact O-CB 3.23Å; S134-A138 WeakPolarHBondContact O-CB 3.33Å; S134-A138 PolarHBondContact O-N 3.21Å; E135-A138 PolarHBondContact O-N 3.42Å; A138-K142 WeakPolarHBondContact O-CB 3.43Å; A138-K142 PolarHBondContact O-N 2.85Å
139	M	98.3	Very high	98	Very high	54 Å²	54	62.2 Å²	62.2	27%	0.266	31%	0.311	S	S	.	.	H	α-helix	trans	-68.1	-45.1	176.7	-168.8	161.3	-58.6	0	0	111.9	L94 L118 E135 G136 E137 K141 K142 W143	L94-M139 HydrophobicContact CD1-CE 4.34Å; L94-M139 HydrophobicContact CD1-SD 3.48Å; L94-M139 WeakPolarHBondContact CD1-SD 3.32Å; L94-M139 HydrophobicContact CD2-CE 3.71Å; L94-M139 HydrophobicContact CD2-SD 3.96Å; L94-M139 HydrophobicContact CG-CE 3.86Å; L94-M139 HydrophobicContact CG-SD 3.63Å; L118-M139 HydrophobicContact CD2-CB 4.13Å; L118-M139 HydrophobicContact CD2-CG 4.3Å; E135-M139 WeakPolarHBondContact O-CB 3.22Å; E135-M139 PolarHBondContact O-N 2.77Å; G136-M139 PolarHBondContact O-N 2.92Å; E137-M139 VanDerWaalsContact C-N 3.29Å; E137-M139 PolarHBondContact O-N 3.32Å; M139-K141 VanDerWaalsContact C-N 3.31Å; M139-K141 PolarHBondContact O-N 2.96Å; M139-K142 WeakPolarHBondContact O-CB 3.39Å; M139-K142 PolarHBondContact O-N 2.83Å; M139-K142 VanDerWaalsContact O-N 3.12Å; M139-W143 HydrophobicContact CG-CD2 4.04Å; M139-W143 HydrophobicContact CG-CE3 4.37Å; M139-W143 HydrophobicContact CG-CH2 4.33Å; M139-W143 HydrophobicContact CG-CZ2 4Å; M139-W143 WeakPolarHBondContact O-CB 3.46Å; M139-W143 PolarHBondContact O-N 3.37Å; M139-W143 HydrophobicContact SD-CH2 3.81Å; M139-W143 HydrophobicContact SD-CZ2 3.68Å; M139-W143 HydrophobicContact SD-CZ3 4.41Å
140	A	98	Very high	98.1	Very high	3 Å²	3	60 Å²	60	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-61.1	-40.4	176.4	0	0	0	0	0	112	L118 G136 E137 K142 W143 K144 C145 F147	L118-A140 HydrophobicContact CB-CB 4.4Å; L118-A140 HydrophobicContact CD2-CB 4.12Å; G136-A140 WeakPolarHBondContact O-CB 3.48Å; G136-A140 PolarHBondContact O-N 2.97Å; E137-A140 PolarHBondContact O-N 2.71Å; A140-K142 PolarHBondContact O-N 3.01Å; A140-W143 CarbonylContact O-C 3.36Å; A140-W143 PolarHBondContact O-N 3.44Å; A140-K144 WeakPolarHBondContact O-CA 3.47Å; A140-K144 PolarHBondContact O-N 2.87Å; A140-C145 PolarHBondContact O-N 3.37Å; A140-F147 HydrophobicContact CB-CB 3.62Å; A140-F147 HydrophobicContact CB-CG 4.42Å
141	K	97.7	Very high	98.1	Very high	178 Å²	178	55.1 Å²	55.1	77%	0.774	28%	0.28	S	S	*	.	H	α-helix	trans	-60.6	-43.4	172.8	-174.1	176.7	-178.6	178.2	0	111.9	E137 M139 W143 K144	E137-K141 WeakPolarHBondContact O-CB 3.3Å; E137-K141 PolarHBondContact O-N 3.09Å; M139-K141 VanDerWaalsContact C-N 3.31Å; M139-K141 PolarHBondContact O-N 2.96Å; K141-W143 VanDerWaalsContact C-N 3.31Å; K141-W143 PolarHBondContact O-N 2.84Å; K141-K144 PolarHBondContact O-N 2.97Å
142	K	96.8	Very high	98	Very high	168 Å²	168	55.2 Å²	55.2	73%	0.73	28%	0.281	S	S	*	.	H	α-helix	trans	-63.5	-37.5	175.8	-177.4	178.3	179.5	176.2	0	112.1	A138 M139 A140 K144	A138-K142 WeakPolarHBondContact O-CB 3.43Å; A138-K142 PolarHBondContact O-N 2.85Å; M139-K142 WeakPolarHBondContact O-CB 3.39Å; M139-K142 PolarHBondContact O-N 2.83Å; M139-K142 VanDerWaalsContact O-N 3.12Å; A140-K142 PolarHBondContact O-N 3.01Å; K142-K144 VanDerWaalsContact C-N 3.31Å
143	W	96.7	Very high	98	Very high	19 Å²	19	54.9 Å²	54.9	7%	0.072	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	2.3	177.7	-69	-0.7	0	0	0	113.6	L84 L97 K98 Y101 L118 M139 A140 K141 C145	L84-W143 HydrophobicContact CD1-CE3 4.32Å; L84-W143 HydrophobicContact CD1-CZ3 4.01Å; L97-W143 HydrophobicContact CB-CH2 3.78Å; L97-W143 HydrophobicContact CB-CZ3 4.1Å; K98-W143 HydrophobicContact CB-CH2 4.43Å; K98-W143 HydrophobicContact CB-CZ2 3.92Å; K98-W143 HydrophobicContact CG-CZ2 4.37Å; Y101-W143 AromaticContact CD1-CD1 3.95Å; Y101-W143 AromaticContact CD1-CD2 3.81Å; Y101-W143 HydrophobicContact CD1-CD2 3.81Å; Y101-W143 AromaticContact CD1-CE2 3.92Å; Y101-W143 HydrophobicContact CD1-CE3 4.34Å; Y101-W143 AromaticContact CD1-CG 3.87Å; Y101-W143 HydrophobicContact CD1-CG 3.87Å; Y101-W143 AromaticContact CD1-NE1 3.97Å; Y101-W143 HydrophobicContact CD2-CB 4.25Å; Y101-W143 HydrophobicContact CD2-CD2 4.02Å; Y101-W143 AromaticContact CD2-CE3 3.86Å; Y101-W143 HydrophobicContact CD2-CE3 3.86Å; Y101-W143 HydrophobicContact CD2-CG 4.21Å; Y101-W143 HydrophobicContact CE1-CB 4Å; Y101-W143 AromaticContact CE1-CD1 3.72Å; Y101-W143 HydrophobicContact CE1-CD2 4.16Å; Y101-W143 AromaticContact CE1-CG 3.7Å; Y101-W143 HydrophobicContact CE1-CG 3.7Å; Y101-W143 HydrophobicContact CE2-CB 3.71Å; Y101-W143 HydrophobicContact CE2-CD2 4.35Å; Y101-W143 HydrophobicContact CE2-CE3 4.47Å; Y101-W143 HydrophobicContact CE2-CG 4.06Å; Y101-W143 AromaticContact CG-CD2 3.75Å; Y101-W143 HydrophobicContact CG-CD2 3.75Å; Y101-W143 AromaticContact CG-CE3 3.81Å; Y101-W143 HydrophobicContact CG-CE3 3.81Å; Y101-W143 HydrophobicContact CG-CG 4.13Å; Y101-W143 HydrophobicContact CG-CZ3 4.25Å; Y101-W143 AromaticContact CZ-CG 3.82Å; Y101-W143 PolarHBondContact OH-O 2.92Å; L118-W143 HydrophobicContact CD1-CZ3 4.16Å; M139-W143 HydrophobicContact CG-CD2 4.04Å; M139-W143 HydrophobicContact CG-CE3 4.37Å; M139-W143 HydrophobicContact CG-CH2 4.33Å; M139-W143 HydrophobicContact CG-CZ2 4Å; M139-W143 WeakPolarHBondContact O-CB 3.46Å; M139-W143 PolarHBondContact O-N 3.37Å; M139-W143 HydrophobicContact SD-CH2 3.81Å; M139-W143 HydrophobicContact SD-CZ2 3.68Å; M139-W143 HydrophobicContact SD-CZ3 4.41Å; A140-W143 CarbonylContact O-C 3.36Å; A140-W143 PolarHBondContact O-N 3.44Å; K141-W143 VanDerWaalsContact C-N 3.31Å; K141-W143 PolarHBondContact O-N 2.84Å; W143-C145 PolarHBondContact O-N 3.48Å; W143-C145 VanDerWaalsContact O-N 3.09Å
144	K	95.8	Very high	98	Very high	141 Å²	141	58.7 Å²	58.7	61%	0.613	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	37	-177.5	-56.3	-179.8	175.4	-178.4	0	112.8	E112 A140 K141 K142	E112-K144 HydrophobicContact CG-CD 4.17Å; E112-K144 VanDerWaalsContact OE1-CD 3.22Å; E112-K144 WeakPolarHBondContact OE1-CD 3.26Å; E112-K144 WeakPolarHBondContact OE1-CE 3.34Å; E112-K144 IonicContact OE1-NZ 2.65Å; E112-K144 PolarHBondContact OE1-NZ 2.82Å; A140-K144 WeakPolarHBondContact O-CA 3.47Å; A140-K144 PolarHBondContact O-N 2.87Å; K141-K144 PolarHBondContact O-N 2.97Å; K142-K144 VanDerWaalsContact C-N 3.31Å
145	C	97	Very high	98	Very high	22 Å²	22	59.2 Å²	59.2	15%	0.149	29%	0.291	C	S	.	.			trans	-118.3	169.3	178.3	68.9	0	0	0	0	110.8	I116 A140 W143	I116-C145 HydrophobicContact CB-CB 3.79Å; I116-C145 HydrophobicContact CG2-CB 3.82Å; I116-C145 WeakPolarHBondContact O-CB 3.39Å; A140-C145 PolarHBondContact O-N 3.37Å; W143-C145 PolarHBondContact O-N 3.48Å; W143-C145 VanDerWaalsContact O-N 3.09Å
146	A	98.2	Very high	98	Very high	28 Å²	28	60.1 Å²	60.1	23%	0.231	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	160	176	0	0	0	0	0	111.2	I116 M117 L118 L168	I116-A146 PolarHBondContact O-N 3.34Å; M117-A146 HydrophobicContact CE-CB 3.65Å; M117-A146 VanDerWaalsContact SD-C 3.52Å; M117-A146 HydrophobicContact SD-CB 3.45Å; M117-A146 WeakPolarHBondContact SD-CB 3.23Å; L118-A146 PolarHBondContact N-O 3.09Å; A146-L168 HydrophobicContact CB-CD1 3.67Å
147	F	98.8	Very high	98	Very high	44 Å²	44	62.3 Å²	62.3	19%	0.193	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	143.7	179	176.9	-111.9	0	0	0	111.7	Y86 L118 E137 A140 E149	Y86-F147 HydrophobicContact CE1-CE2 4.2Å; L118-F147 HydrophobicContact CB-CD2 4.29Å; L118-F147 HydrophobicContact CD2-CD2 4.16Å; L118-F147 HydrophobicContact CG-CD2 4.12Å; L118-F147 WeakPolarHBondContact O-CA 3.39Å; E137-F147 HydrophobicContact CB-CD1 4.35Å; E137-F147 HydrophobicContact CG-CD1 3.41Å; E137-F147 VanDerWaalsContact CG-CD1 3.41Å; E137-F147 HydrophobicContact CG-CE1 3.64Å; E137-F147 HydrophobicContact CG-CG 4.33Å; A140-F147 HydrophobicContact CB-CB 3.62Å; A140-F147 HydrophobicContact CB-CG 4.42Å; F147-E149 HydrophobicContact CE1-CG 4.19Å; F147-E149 HydrophobicContact CZ-CG 3.71Å
148	M	98.6	Very high	98	Very high	29 Å²	29	57 Å²	57	14%	0.143	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	141.5	171.2	-171.9	172.7	-72.2	0	0	111.2	M117 L118 V119 G120 T150 N157 E160 L161 E164	M117-M148 HydrophobicContact SD-CB 4.05Å; L118-M148 PolarHBondContact O-N 3.38Å; V119-M148 VanDerWaalsContact CA-O 3.3Å; V119-M148 WeakPolarHBondContact CA-O 3.43Å; G120-M148 PolarHBondContact N-O 3.47Å; M148-T150 HydrophobicContact CG-CG2 4.25Å; M148-T150 HydrophobicContact SD-CG2 4.44Å; M148-N157 HydrophobicContact CG-CB 4.1Å; M148-N157 HydrophobicContact SD-CB 3.75Å; M148-E160 HydrophobicContact CE-CB 4.19Å; M148-E160 HydrophobicContact SD-CB 4.17Å; M148-L161 HydrophobicContact SD-CB 3.98Å; M148-L161 PolarHBondContact SD-N 2.93Å; M148-E164 HydrophobicContact CE-CB 4.3Å; M148-E164 HydrophobicContact CE-CG 3.93Å
149	E	98.8	Very high	97.9	Very high	23 Å²	23	59.8 Å²	59.8	11%	0.107	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	140.9	164.8	-72	-164.7	-178.3	0	0	111.8	G120 N123 R129 S133 F147 N157	G120-E149 CarbonylContact O-C 3.58Å; G120-E149 WeakPolarHBondContact O-CA 3.09Å; N123-E149 HydrophobicContact CB-CB 4.14Å; N123-E149 WeakPolarHBondContact CB-OE2 3.19Å; R129-E149 IonicContact CZ-OE1 3.56Å; R129-E149 IonicContact CZ-OE2 3.71Å; R129-E149 IonicContact NH1-OE1 2.8Å; R129-E149 PolarHBondContact NH1-OE1 3.25Å; R129-E149 IonicContact NH1-OE2 3.41Å; R129-E149 IonicContact NH2-OE1 3.86Å; R129-E149 PolarHBondContact NH2-OE1 3.41Å; R129-E149 IonicContact NH2-OE2 3.75Å; R129-E149 PolarHBondContact NH2-OE2 2.99Å; S133-E149 WeakPolarHBondContact CA-OE1 3.43Å; S133-E149 VanDerWaalsContact CB-OE1 3.27Å; S133-E149 WeakPolarHBondContact CB-OE1 3.32Å; S133-E149 VanDerWaalsContact OG-CD 3.23Å; S133-E149 PolarHBondContact OG-OE1 3.5Å; F147-E149 HydrophobicContact CE1-CG 4.19Å; F147-E149 HydrophobicContact CZ-CG 3.71Å; E149-N157 WeakPolarHBondContact O-CB 3.29Å; E149-N157 PolarHBondContact O-ND2 2.87Å
150	T	98.8	Very high	97.9	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	157.7	-175.9	63.1	0	0	0	0	112.5	L23 V119 G120 N121 K122 N123 M148 H156 N157 L161	L23-T150 HydrophobicContact CD2-CG2 4.5Å; V119-T150 HydrophobicContact CG1-CG2 3.78Å; V119-T150 WeakPolarHBondContact CG1-OG1 3.46Å; G120-T150 PolarHBondContact O-N 2.72Å; N121-T150 CarbonylContact C-O 3.55Å; N121-T150 WeakPolarHBondContact CA-O 3.45Å; N121-T150 PolarHBondContact OD1-O 3.02Å; N121-T150 PolarHBondContact OD1-OG1 2.86Å; K122-T150 PolarHBondContact N-O 3.31Å; N123-T150 PolarHBondContact N-O 3.27Å; N123-T150 VanDerWaalsContact N-O 3.1Å; N123-T150 PolarHBondContact OD1-O 3.11Å; M148-T150 HydrophobicContact CG-CG2 4.25Å; M148-T150 HydrophobicContact SD-CG2 4.44Å; T150-H156 WeakPolarHBondContact CA-O 3.23Å; T150-N157 HydrophobicContact CG2-CB 3.93Å; T150-L161 HydrophobicContact CG2-CB 4.36Å; T150-L161 HydrophobicContact CG2-CD2 4.3Å
151	S	98.6	Very high	97.9	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-129.5	109.5	160.7	173.3	0	0	0	0	109.6	N123 D124 K153 L154 N155 H156	N123-S151 WeakPolarHBondContact OD1-CB 3.44Å; N123-S151 PolarHBondContact OD1-N 3.25Å; D124-S151 VanDerWaalsContact CG-OG 3.26Å; D124-S151 WeakPolarHBondContact OD1-CB 3.38Å; D124-S151 PolarHBondContact OD1-OG 3.24Å; S151-K153 PolarHBondContact O-N 2.83Å; S151-K153 PolarHBondContact OG-N 2.97Å; S151-L154 PolarHBondContact OG-N 2.92Å; S151-N155 CarbonylContact O-C 3.59Å; S151-N155 VanDerWaalsContact O-CA 3.31Å; S151-N155 WeakPolarHBondContact O-CA 3.41Å; S151-N155 PolarHBondContact O-N 3.11Å; S151-H156 PolarHBondContact N-O 3.04Å; S151-H156 PolarHBondContact O-N 3.31Å
152	A	98.2	Very high	97.9	Very high	3 Å²	3	53 Å²	53	3%	0.025	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-33.1	169.6	0	0	0	0	0	112.1	L23 R26 F32 N121	L23-A152 HydrophobicContact CD2-CB 3.96Å; L23-A152 HydrophobicContact CG-CB 4.18Å; R26-A152 PolarHBondContact NE-O 3.41Å; R26-A152 PolarHBondContact NH2-O 3.21Å; F32-A152 HydrophobicContact CD2-CB 4.24Å; F32-A152 HydrophobicContact CE2-CB 4.28Å; N121-A152 PolarHBondContact OD1-N 2.85Å
153	K	97.6	Very high	97.8	Very high	95 Å²	95	46.9 Å²	46.9	41%	0.413	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-55.5	179.5	-174.7	179.5	-172.4	175.5	0	110.8	R26 F32 D124 S151 N155	R26-K153 PolarHBondContact NH2-O 2.89Å; F32-K153 HydrophobicContact CD1-CG 4.41Å; F32-K153 HydrophobicContact CE1-CB 4.07Å; F32-K153 HydrophobicContact CE1-CG 3.79Å; F32-K153 HydrophobicContact CE2-CB 3.98Å; F32-K153 HydrophobicContact CZ-CB 3.72Å; F32-K153 HydrophobicContact CZ-CG 3.91Å; D124-K153 VanDerWaalsContact OD2-CD 3.28Å; D124-K153 WeakPolarHBondContact OD2-CD 3.02Å; S151-K153 PolarHBondContact O-N 2.83Å; S151-K153 PolarHBondContact OG-N 2.97Å; K153-N155 VanDerWaalsContact C-N 3.27Å; K153-N155 PolarHBondContact O-N 2.85Å
154	L	97.8	Very high	97.9	Very high	117 Å²	117	50.2 Å²	50.2	61%	0.613	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-1.8	-178.6	-57.1	-173.8	0	0	0	113.7	D124 S151 H156	D124-L154 HydrophobicContact CB-CD1 3.53Å; D124-L154 HydrophobicContact CB-CG 3.83Å; S151-L154 PolarHBondContact OG-N 2.92Å; L154-H156 HydrophobicContact CB-CB 4.44Å; L154-H156 PolarHBondContact O-N 2.83Å
155	N	97.9	Very high	98	Very high	87 Å²	87	43.5 Å²	43.5	47%	0.465	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	32.3	-171.8	-167.6	46	0	0	0	112.6	R26 S151 K153	R26-N155 WeakPolarHBondContact CD-OD1 3.38Å; R26-N155 HydrophobicContact CG-CB 4.27Å; R26-N155 WeakPolarHBondContact CG-OD1 3.45Å; S151-N155 CarbonylContact O-C 3.59Å; S151-N155 VanDerWaalsContact O-CA 3.31Å; S151-N155 WeakPolarHBondContact O-CA 3.41Å; S151-N155 PolarHBondContact O-N 3.11Å; K153-N155 VanDerWaalsContact C-N 3.27Å; K153-N155 PolarHBondContact O-N 2.85Å
156	H	98.5	Very high	97.9	Very high	80 Å²	80	42.6 Å²	42.6	37%	0.37	21%	0.208	S	C	.	.	B	Isolated β-bridge	trans	-85.4	126.6	178.5	178.8	-99.8	0	0	0	110.1	N123 T150 S151 L154 V158	N123-H156 PolarHBondContact ND2-ND1 2.79Å; T150-H156 WeakPolarHBondContact CA-O 3.23Å; S151-H156 PolarHBondContact N-O 3.04Å; S151-H156 PolarHBondContact O-N 3.31Å; L154-H156 HydrophobicContact CB-CB 4.44Å; L154-H156 PolarHBondContact O-N 2.83Å; H156-V158 PolarHBondContact O-N 2.8Å; H156-V158 VanDerWaalsContact O-N 3.09Å
157	N	98.4	Very high	97.7	Very high	47 Å²	47	45.3 Å²	45.3	25%	0.251	22%	0.219	S	C	.	.	S	Bend	trans	58.3	13.8	179.6	-75.4	-12.7	0	0	0	115.8	M148 E149 T150 E160 L161	M148-N157 HydrophobicContact CG-CB 4.1Å; M148-N157 HydrophobicContact SD-CB 3.75Å; E149-N157 WeakPolarHBondContact O-CB 3.29Å; E149-N157 PolarHBondContact O-ND2 2.87Å; T150-N157 HydrophobicContact CG2-CB 3.93Å; N157-E160 VanDerWaalsContact C-OE2 3.28Å; N157-E160 WeakPolarHBondContact CA-OE2 3.43Å; N157-L161 VanDerWaalsContact O-CB 3.24Å; N157-L161 WeakPolarHBondContact O-CB 3.47Å; N157-L161 PolarHBondContact O-N 3.1Å
158	V	98.3	Very high	97.6	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-70.9	-43.2	-176.5	178.5	0	0	0	0	111.2	L23 R26 F27 H156 F162	L23-V158 HydrophobicContact CD2-CG2 3.97Å; R26-V158 HydrophobicContact CB-CG1 4.09Å; R26-V158 HydrophobicContact CG-CB 4.21Å; R26-V158 HydrophobicContact CG-CG1 3.86Å; R26-V158 HydrophobicContact CG-CG2 3.99Å; F27-V158 HydrophobicContact CB-CG1 3.87Å; H156-V158 PolarHBondContact O-N 2.8Å; H156-V158 VanDerWaalsContact O-N 3.09Å; V158-F162 VanDerWaalsContact O-CD2 3.22Å; V158-F162 WeakPolarHBondContact O-CD2 3.34Å
159	K	96.5	Very high	97.3	Very high	117 Å²	117	45.8 Å²	45.8	51%	0.509	22%	0.223	S	C	.	.	H	α-helix	trans	-74.9	-38.9	179.4	-176.3	-178.2	176.7	-174.7	0	111	L161 F162 Q163 L176	K159-L161 VanDerWaalsContact C-N 3.31Å; K159-L161 PolarHBondContact O-N 3.03Å; K159-F162 PolarHBondContact O-N 2.82Å; K159-Q163 WeakPolarHBondContact O-CB 3.3Å; K159-Q163 PolarHBondContact O-N 2.54Å; K159-L176 HydrophobicContact CG-CD1 4.32Å
160	E	98.2	Very high	96.8	Very high	88 Å²	88	52.5 Å²	52.5	41%	0.411	25%	0.252	S	S	.	.	H	α-helix	trans	-59	-43.4	178.1	-65.2	69.2	-155.2	0	0	110.1	M148 N157 F162 Q163 E164	M148-E160 HydrophobicContact CE-CB 4.19Å; M148-E160 HydrophobicContact SD-CB 4.17Å; N157-E160 VanDerWaalsContact C-OE2 3.28Å; N157-E160 WeakPolarHBondContact CA-OE2 3.43Å; E160-F162 PolarHBondContact O-N 2.94Å; E160-Q163 PolarHBondContact O-N 3.35Å; E160-E164 WeakPolarHBondContact O-CB 3.4Å; E160-E164 WeakPolarHBondContact O-CG 3.49Å; E160-E164 PolarHBondContact O-N 2.8Å
161	L	98.6	Very high	96.2	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-49.8	-56.1	173.3	166.3	58.4	0	0	0	112.4	L23 I83 M117 V119 M148 T150 N157 K159 L165	L23-L161 HydrophobicContact CD1-CD2 4.32Å; L23-L161 HydrophobicContact CD2-CD2 4.5Å; I83-L161 HydrophobicContact CD1-CD1 4.39Å; I83-L161 HydrophobicContact CD1-CD2 4.39Å; I83-L161 HydrophobicContact CD1-CG 4.34Å; I83-L161 HydrophobicContact CG2-CD1 4.42Å; I83-L161 HydrophobicContact CG2-CD2 4.45Å; M117-L161 HydrophobicContact CB-CD1 4.18Å; M117-L161 HydrophobicContact CG-CD1 3.49Å; M117-L161 VanDerWaalsContact CG-CD1 3.49Å; V119-L161 HydrophobicContact CG1-CD2 4.36Å; V119-L161 HydrophobicContact CG2-CD1 3.44Å; V119-L161 VanDerWaalsContact CG2-CD1 3.44Å; V119-L161 HydrophobicContact CG2-CD2 4.07Å; V119-L161 HydrophobicContact CG2-CG 4.41Å; M148-L161 HydrophobicContact SD-CB 3.98Å; M148-L161 PolarHBondContact SD-N 2.93Å; T150-L161 HydrophobicContact CG2-CB 4.36Å; T150-L161 HydrophobicContact CG2-CD2 4.3Å; N157-L161 VanDerWaalsContact O-CB 3.24Å; N157-L161 WeakPolarHBondContact O-CB 3.47Å; N157-L161 PolarHBondContact O-N 3.1Å; K159-L161 VanDerWaalsContact C-N 3.31Å; K159-L161 PolarHBondContact O-N 3.03Å; L161-L165 WeakPolarHBondContact O-CB 3.41Å; L161-L165 PolarHBondContact O-N 2.69Å
162	F	97.4	Very high	95.6	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.009	29%	0.293	C	S	.	.	H	α-helix	trans	-70.9	-35	-177.9	-69	-87	0	0	0	111.7	F27 I59 I83 V158 K159 E160 L166 L176	F27-F162 HydrophobicContact CB-CD2 3.73Å; F27-F162 HydrophobicContact CB-CE2 3.39Å; F27-F162 HydrophobicContact CB-CZ 4.1Å; F27-F162 HydrophobicContact CD1-CD1 4.1Å; F27-F162 AromaticContact CD1-CD2 3.76Å; F27-F162 HydrophobicContact CD1-CD2 3.76Å; F27-F162 HydrophobicContact CD1-CE1 4.17Å; F27-F162 AromaticContact CD1-CE2 3.87Å; F27-F162 HydrophobicContact CD1-CE2 3.87Å; F27-F162 AromaticContact CD1-CG 3.91Å; F27-F162 HydrophobicContact CD1-CG 3.91Å; F27-F162 HydrophobicContact CD1-CZ 4.07Å; F27-F162 HydrophobicContact CD2-CB 4.09Å; F27-F162 AromaticContact CD2-CD2 3.36Å; F27-F162 HydrophobicContact CD2-CD2 3.36Å; F27-F162 AromaticContact CD2-CE2 3.99Å; F27-F162 HydrophobicContact CD2-CE2 3.99Å; F27-F162 AromaticContact CD2-CG 3.86Å; F27-F162 HydrophobicContact CD2-CG 3.86Å; F27-F162 HydrophobicContact CE1-CB 4.28Å; F27-F162 HydrophobicContact CE1-CD1 4.12Å; F27-F162 HydrophobicContact CE1-CD2 4.24Å; F27-F162 AromaticContact CE1-CG 3.95Å; F27-F162 HydrophobicContact CE1-CG 3.95Å; F27-F162 HydrophobicContact CE2-CB 3.67Å; F27-F162 AromaticContact CE2-CD2 3.86Å; F27-F162 HydrophobicContact CE2-CD2 3.86Å; F27-F162 AromaticContact CE2-CG 3.89Å; F27-F162 HydrophobicContact CE2-CG 3.89Å; F27-F162 HydrophobicContact CG-CD1 4.47Å; F27-F162 AromaticContact CG-CD2 3.3Å; F27-F162 HydrophobicContact CG-CD2 3.3Å; F27-F162 AromaticContact CG-CE2 3.46Å; F27-F162 HydrophobicContact CG-CE2 3.46Å; F27-F162 VanDerWaalsContact CG-CE2 3.46Å; F27-F162 AromaticContact CG-CG 3.88Å; F27-F162 HydrophobicContact CG-CG 3.88Å; F27-F162 HydrophobicContact CG-CZ 4.12Å; F27-F162 HydrophobicContact CZ-CB 3.79Å; F27-F162 HydrophobicContact CZ-CD1 4.48Å; F27-F162 HydrophobicContact CZ-CD2 4.28Å; F27-F162 AromaticContact CZ-CG 3.94Å; F27-F162 HydrophobicContact CZ-CG 3.94Å; I59-F162 HydrophobicContact CD1-CD1 4.02Å; I59-F162 HydrophobicContact CD1-CE1 3.66Å; I59-F162 HydrophobicContact CD1-CZ 4.37Å; I59-F162 HydrophobicContact CG1-CE1 4.22Å; I59-F162 HydrophobicContact CG2-CE1 4.14Å; I83-F162 HydrophobicContact CD1-CD1 4.05Å; I83-F162 HydrophobicContact CD1-CE1 3.61Å; I83-F162 HydrophobicContact CD1-CZ 4.05Å; V158-F162 VanDerWaalsContact O-CD2 3.22Å; V158-F162 WeakPolarHBondContact O-CD2 3.34Å; K159-F162 PolarHBondContact O-N 2.82Å; E160-F162 PolarHBondContact O-N 2.94Å; F162-L166 VanDerWaalsContact O-CG 3.24Å; F162-L166 WeakPolarHBondContact O-CG 2.97Å; F162-L166 PolarHBondContact O-N 3.32Å; F162-L166 VanDerWaalsContact O-N 3.16Å; F162-L176 HydrophobicContact CB-CD1 4.38Å
163	Q	96.3	Very high	95.1	Very high	41 Å²	41	68.5 Å²	68.5	19%	0.192	32%	0.324	C	S	.	.	H	α-helix	trans	-65.3	-47.3	176.9	-175.8	60.3	64.7	0	0	111.7	K159 E160 L166 N167 L176	K159-Q163 WeakPolarHBondContact O-CB 3.3Å; K159-Q163 PolarHBondContact O-N 2.54Å; E160-Q163 PolarHBondContact O-N 3.35Å; Q163-L166 PolarHBondContact O-N 2.84Å; Q163-N167 PolarHBondContact NE2-OD1 3.43Å; Q163-N167 PolarHBondContact O-N 2.86Å; Q163-N167 PolarHBondContact O-ND2 2.85Å; Q163-N167 PolarHBondContact O-OD1 2.89Å; Q163-L176 HydrophobicContact CB-CD1 4.06Å
164	E	97.4	Very high	94.6	Very high	88 Å²	88	64.3 Å²	64.3	41%	0.411	31%	0.306	S	S	.	.	H	α-helix	trans	-67.2	-39.3	179.6	-69.8	-52.2	146.1	0	0	111.8	M117 M148 E160 L166 N167 L168	M117-E164 HydrophobicContact CE-CB 3.87Å; M148-E164 HydrophobicContact CE-CB 4.3Å; M148-E164 HydrophobicContact CE-CG 3.93Å; E160-E164 WeakPolarHBondContact O-CB 3.4Å; E160-E164 WeakPolarHBondContact O-CG 3.49Å; E160-E164 PolarHBondContact O-N 2.8Å; E164-L166 VanDerWaalsContact C-N 3.28Å; E164-L166 PolarHBondContact O-N 2.67Å; E164-N167 WeakPolarHBondContact O-CB 3.23Å; E164-N167 PolarHBondContact O-N 2.92Å; E164-N167 VanDerWaalsContact O-N 3.13Å; E164-N167 PolarHBondContact OE2-ND2 3.31Å; E164-N167 VanDerWaalsContact OE2-ND2 3.16Å; E164-L168 WeakPolarHBondContact O-CG 3.38Å; E164-L168 PolarHBondContact O-N 3.3Å
165	L	97.6	Very high	94.2	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.7	-42.4	173.3	-175.5	74.3	0	0	0	111.9	V10 A81 I83 P115 M117 L161 L168	V10-L165 HydrophobicContact CB-CD2 4.49Å; V10-L165 HydrophobicContact CG1-CD2 3.68Å; V10-L165 HydrophobicContact CG2-CD2 3.93Å; A81-L165 HydrophobicContact CB-CD1 4.28Å; A81-L165 HydrophobicContact CB-CD2 4.02Å; A81-L165 HydrophobicContact CB-CG 4.11Å; I83-L165 HydrophobicContact CD1-CD2 3.85Å; I83-L165 HydrophobicContact CG1-CD2 3.56Å; P115-L165 HydrophobicContact CB-CD1 3.87Å; P115-L165 HydrophobicContact CB-CG 4.34Å; M117-L165 HydrophobicContact CB-CD1 3.85Å; L161-L165 WeakPolarHBondContact O-CB 3.41Å; L161-L165 PolarHBondContact O-N 2.69Å; L165-L168 PolarHBondContact O-N 3.43Å
166	L	95.3	Very high	93.7	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-68.9	-34.7	177.1	-66.6	177.5	0	0	0	112.3	Y8 L57 F162 Q163 E164 L168 E169 V174 L176	Y8-L166 HydrophobicContact CD1-CD2 3.52Å; Y8-L166 HydrophobicContact CE1-CD2 3.43Å; Y8-L166 VanDerWaalsContact CE1-CD2 3.43Å; Y8-L166 HydrophobicContact CG-CD2 4.47Å; L57-L166 HydrophobicContact CD1-CD2 4.25Å; F162-L166 VanDerWaalsContact O-CG 3.24Å; F162-L166 WeakPolarHBondContact O-CG 2.97Å; F162-L166 PolarHBondContact O-N 3.32Å; F162-L166 VanDerWaalsContact O-N 3.16Å; Q163-L166 PolarHBondContact O-N 2.84Å; E164-L166 VanDerWaalsContact C-N 3.28Å; E164-L166 PolarHBondContact O-N 2.67Å; L166-L168 PolarHBondContact O-N 3.05Å; L166-E169 WeakPolarHBondContact O-CB 3.13Å; L166-E169 PolarHBondContact O-N 3.22Å; L166-E169 VanDerWaalsContact O-N 3.14Å; L166-V174 HydrophobicContact CB-CB 4.45Å; L166-V174 HydrophobicContact CD1-CG1 4.17Å; L166-V174 HydrophobicContact CD2-CB 4.28Å; L166-V174 HydrophobicContact CD2-CG1 3.77Å; L166-V174 HydrophobicContact CG-CG1 4.37Å; L166-L176 HydrophobicContact CD1-CD2 3.52Å; L166-L176 HydrophobicContact CD1-CG 3.91Å
167	N	94.8	Very high	92.9	Very high	85 Å²	85	57.8 Å²	57.8	46%	0.455	27%	0.274	S	S	.	.	H	α-helix	trans	-64.6	-24.4	176.2	-65.2	-17.6	0	0	0	112.9	Q163 E164 E169	Q163-N167 PolarHBondContact NE2-OD1 3.43Å; Q163-N167 PolarHBondContact O-N 2.86Å; Q163-N167 PolarHBondContact O-ND2 2.85Å; Q163-N167 PolarHBondContact O-OD1 2.89Å; E164-N167 WeakPolarHBondContact O-CB 3.23Å; E164-N167 PolarHBondContact O-N 2.92Å; E164-N167 VanDerWaalsContact O-N 3.13Å; E164-N167 PolarHBondContact OE2-ND2 3.31Å; E164-N167 VanDerWaalsContact OE2-ND2 3.16Å; N167-E169 VanDerWaalsContact C-N 3.26Å; N167-E169 PolarHBondContact O-N 3.34Å
168	L	95.2	Very high	91.8	Very high	68 Å²	68	59.5 Å²	59.5	36%	0.356	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-14.2	176	-65.5	171.2	0	0	0	113.1	P115 M117 A146 E164 L165 L166 K170	P115-L168 HydrophobicContact CB-CB 3.86Å; P115-L168 HydrophobicContact CG-CB 4.11Å; M117-L168 HydrophobicContact CE-CD1 4.47Å; A146-L168 HydrophobicContact CB-CD1 3.67Å; E164-L168 WeakPolarHBondContact O-CG 3.38Å; E164-L168 PolarHBondContact O-N 3.3Å; L165-L168 PolarHBondContact O-N 3.43Å; L166-L168 PolarHBondContact O-N 3.05Å; L168-K170 PolarHBondContact O-N 3.42Å
169	E	93.3	Very high	89.9	Confident	15 Å²	15	65 Å²	65	7%	0.07	31%	0.312	C	S	.	.			trans	-70.6	116.1	178.3	-179.1	57.6	-108.8	0	0	110.6	Y8 P115 L166 N167 R171 R172 V174	Y8-E169 HydrophobicContact CE2-CB 4.41Å; Y8-E169 HydrophobicContact CE2-CG 3.83Å; Y8-E169 VanDerWaalsContact CE2-OE2 3.3Å; Y8-E169 WeakPolarHBondContact CE2-OE2 3.32Å; Y8-E169 PolarHBondContact OH-OE2 3.2Å; P115-E169 HydrophobicContact CG-CB 4.06Å; L166-E169 WeakPolarHBondContact O-CB 3.13Å; L166-E169 PolarHBondContact O-N 3.22Å; L166-E169 VanDerWaalsContact O-N 3.14Å; N167-E169 VanDerWaalsContact C-N 3.26Å; N167-E169 PolarHBondContact O-N 3.34Å; E169-R171 VanDerWaalsContact OE1-CB 3.27Å; E169-R171 WeakPolarHBondContact OE1-CB 3.28Å; E169-R171 IonicContact OE1-CZ 3.6Å; E169-R171 PolarHBondContact OE1-N 2.76Å; E169-R171 IonicContact OE1-NE 2.87Å; E169-R171 PolarHBondContact OE1-NE 3.23Å; E169-R171 IonicContact OE1-NH2 3.44Å; E169-R171 PolarHBondContact OE1-NH2 3.4Å; E169-R171 IonicContact OE2-CZ 3.89Å; E169-R171 IonicContact OE2-NE 3.87Å; E169-R171 IonicContact OE2-NH2 3.01Å; E169-R171 PolarHBondContact OE2-NH2 2.99Å; E169-R172 HydrophobicContact CG-CB 4.34Å; E169-V174 HydrophobicContact CG-CG2 4.31Å
170	K	88.9	Confident	87.7	Confident	163 Å²	163	62 Å²	62	71%	0.709	31%	0.313	S	S	*	.	S	Bend	trans	-92	-20.3	-176.7	-64.4	172.6	-175.1	163.4	0	113.1	E112 L168	E112-K170 PolarHBondContact O-NZ 2.96Å; E112-K170 VanDerWaalsContact O-NZ 3.12Å; L168-K170 PolarHBondContact O-N 3.42Å
171	R	86.1	Confident	85.2	Confident	143 Å²	143	66.4 Å²	66.4	54%	0.54	33%	0.331	S	S	.	.	S	Bend	trans	-89	-20	-172.5	-59.8	167.3	-66.4	-171.3	-2.3	113.2	E169	E169-R171 VanDerWaalsContact OE1-CB 3.27Å; E169-R171 WeakPolarHBondContact OE1-CB 3.28Å; E169-R171 IonicContact OE1-CZ 3.6Å; E169-R171 PolarHBondContact OE1-N 2.76Å; E169-R171 IonicContact OE1-NE 2.87Å; E169-R171 PolarHBondContact OE1-NE 3.23Å; E169-R171 IonicContact OE1-NH2 3.44Å; E169-R171 PolarHBondContact OE1-NH2 3.4Å; E169-R171 IonicContact OE2-CZ 3.89Å; E169-R171 IonicContact OE2-NE 3.87Å; E169-R171 IonicContact OE2-NH2 3.01Å; E169-R171 PolarHBondContact OE2-NH2 2.99Å
172	R	85.9	Confident	82.6	Confident	88 Å²	88	72.7 Å²	72.7	33%	0.332	36%	0.359	S	S	.	.	S	Bend	trans	-146.1	143.2	-176.9	-57.6	-176.4	-170.3	-175	1.1	109.4	N6 E169 V174	N6-R172 PolarHBondContact OD1-NH1 3.16Å; E169-R172 HydrophobicContact CG-CB 4.34Å; R172-V174 HydrophobicContact CB-CG2 3.95Å; R172-V174 PolarHBondContact O-N 2.93Å
173	T	86.4	Confident	80.2	Confident	108 Å²	108	76.1 Å²	76.1	66%	0.663	38%	0.383	S	S	*	.			trans	-81.3	103.4	172.2	-56.4	0	0	0	0	108.7	C50 D51	C50-T173 CarbonylContact C-O 3.59Å; C50-T173 WeakPolarHBondContact CA-O 3.48Å; D51-T173 PolarHBondContact N-O 3.32Å; D51-T173 PolarHBondContact OD1-N 3.26Å
174	V	88.1	Confident	77.7	Confident	7 Å²	7	82.4 Å²	82.4	4%	0.042	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.6	-178.4	-166.3	0	0	0	0	110.6	Y8 I48 S49 L166 E169 R172	Y8-V174 HydrophobicContact CD2-CG2 4.01Å; Y8-V174 HydrophobicContact CE2-CG2 4.16Å; Y8-V174 HydrophobicContact CG-CG1 4.39Å; Y8-V174 HydrophobicContact CG-CG2 4.48Å; I48-V174 HydrophobicContact CD1-CG1 3.26Å; I48-V174 HydrophobicContact CG1-CG1 4.36Å; S49-V174 CarbonylContact O-C 3.53Å; S49-V174 WeakPolarHBondContact O-CA 3.35Å; L166-V174 HydrophobicContact CB-CB 4.45Å; L166-V174 HydrophobicContact CD1-CG1 4.17Å; L166-V174 HydrophobicContact CD2-CB 4.28Å; L166-V174 HydrophobicContact CD2-CG1 3.77Å; L166-V174 HydrophobicContact CG-CG1 4.37Å; E169-V174 HydrophobicContact CG-CG2 4.31Å; R172-V174 HydrophobicContact CB-CG2 3.95Å; R172-V174 PolarHBondContact O-N 2.93Å
175	S	89.3	Confident	75.4	Confident	29 Å²	29	85.9 Å²	85.9	20%	0.203	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	150.3	177	83.9	0	0	0	0	113.9	I48 S49 Q177	I48-S175 WeakPolarHBondContact CB-O 3.37Å; S49-S175 PolarHBondContact N-O 2.78Å; S49-S175 PolarHBondContact O-N 3.46Å; S175-Q177 PolarHBondContact O-N 2.89Å; S175-Q177 PolarHBondContact OG-O 2.87Å; S175-Q177 VanDerWaalsContact OG-O 3.06Å
176	L	87.7	Confident	73.1	Confident	27 Å²	27	91.9 Å²	91.9	14%	0.141	45%	0.454	C	S	.	.	S	Bend	trans	-68.8	-15.2	177.4	-62	-178.6	0	0	0	113.6	F27 I48 L57 K159 F162 Q163 L166	F27-L176 HydrophobicContact CE2-CD1 3.75Å; F27-L176 HydrophobicContact CE2-CD2 4.34Å; F27-L176 HydrophobicContact CZ-CD1 3.95Å; F27-L176 HydrophobicContact CZ-CD2 3.67Å; F27-L176 HydrophobicContact CZ-CG 4.47Å; I48-L176 HydrophobicContact CG2-CD2 4.02Å; L57-L176 HydrophobicContact CD2-CD2 4.17Å; K159-L176 HydrophobicContact CG-CD1 4.32Å; F162-L176 HydrophobicContact CB-CD1 4.38Å; Q163-L176 HydrophobicContact CB-CD1 4.06Å; L166-L176 HydrophobicContact CD1-CD2 3.52Å; L166-L176 HydrophobicContact CD1-CG 3.91Å
177	Q	81.5	Confident	70.8	Confident	91 Å²	91	98.6 Å²	98.6	43%	0.425	48%	0.483	S	S	.	.	S	Bend	trans	-97.2	123.8	-180	-62.7	-173.2	14.7	0	0	109.7	S49 S175 D179 K182	S49-Q177 VanDerWaalsContact CB-O 3.23Å; S49-Q177 WeakPolarHBondContact CB-O 3.39Å; S175-Q177 PolarHBondContact O-N 2.89Å; S175-Q177 PolarHBondContact OG-O 2.87Å; S175-Q177 VanDerWaalsContact OG-O 3.06Å; Q177-D179 PolarHBondContact O-N 3.25Å; Q177-K182 VanDerWaalsContact OE1-CE 3.23Å
178	I	74.9	Confident	68.8	Low	83 Å²	83	103.3 Å²	103.3	43%	0.426	49%	0.494	S	S	.	.			trans	-72	117.6	167.4	-54.7	172	0	0	0	106.8	V47 I54 G180	V47-I178 HydrophobicContact CB-CD1 4.42Å; V47-I178 HydrophobicContact CG1-CD1 3.81Å; I54-I178 HydrophobicContact CD1-CG2 4.39Å; I54-I178 HydrophobicContact CG1-CG2 4.38Å; I178-G180 VanDerWaalsContact C-N 3.26Å; I178-G180 PolarHBondContact O-N 2.89Å
179	D	58.2	Low	66.8	Low	118 Å²	118	107.9 Å²	107.9	63%	0.631	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	86.1	178.6	-87.5	-30.2	0	0	0	110.8	Q177	Q177-D179 PolarHBondContact O-N 3.25Å
180	G	50.5	Low	65	Low	52 Å²	52	113.6 Å²	113.6	54%	0.536	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-168.2	-12.1	-177.2	0	0	0	0	0	115.1	I178	I178-G180 VanDerWaalsContact C-N 3.26Å; I178-G180 PolarHBondContact O-N 2.89Å
181	K	45.7	Very low	63.4	Low	182 Å²	182	113.9 Å²	113.9	79%	0.791	54%	0.539	S	S	*	.	S	Bend	trans	-106.2	-15.9	-178.8	-79.2	-175.3	177.3	176	0	115.9
182	K	44.3	Very low	62.1	Low	133 Å²	133	112.2 Å²	112.2	58%	0.578	54%	0.54	S	S	*	.	H	α-helix	trans	-70.2	-31.7	178.5	-73.8	-173.3	179.2	173.5	0	113.2	Q177 K184 Q186	Q177-K182 VanDerWaalsContact OE1-CE 3.23Å; K182-K184 PolarHBondContact O-N 3.2Å; K182-Q186 WeakPolarHBondContact O-CB 3.34Å; K182-Q186 PolarHBondContact O-N 3.21Å
183	S	46.3	Very low	60.7	Low	74 Å²	74	116.2 Å²	116.2	52%	0.517	56%	0.56	S	S	.	*	H	α-helix	trans	-74.4	-23.6	-173.5	64.5	0	0	0	0	115.4	K187	S183-K187 WeakPolarHBondContact O-CB 3.4Å; S183-K187 WeakPolarHBondContact O-CD 3.45Å; S183-K187 VanDerWaalsContact O-CG 3.31Å; S183-K187 WeakPolarHBondContact O-CG 3.13Å
184	K	44.8	Very low	59	Low	173 Å²	173	114 Å²	114	75%	0.752	56%	0.559	S	S	*	*	H	α-helix	trans	-93.5	-35.8	-178.3	-77.1	-174.5	179.5	178.2	0	114.2	K182 R188	K182-K184 PolarHBondContact O-N 3.2Å; K184-R188 VanDerWaalsContact O-CB 3.3Å; K184-R188 WeakPolarHBondContact O-CB 3.32Å; K184-R188 PolarHBondContact O-N 2.89Å
185	Q	48	Very low	57.5	Low	161 Å²	161	122.2 Å²	122.2	75%	0.752	59%	0.594	S	S	*	*	H	α-helix	trans	-76	-37	178.5	-91.6	-177.3	-5.9	0	0	112.6	R188 K189	Q185-R188 PolarHBondContact O-N 2.53Å; Q185-K189 PolarHBondContact O-N 2.86Å
186	Q	49.9	Very low	55.6	Low	125 Å²	125	126.5 Å²	126.5	58%	0.584	62%	0.623	S	S	*	*	H	α-helix	trans	-70.6	-44.9	179.1	-140	164.3	-3.1	0	0	111.1	K182 R188 K189 E190	K182-Q186 WeakPolarHBondContact O-CB 3.34Å; K182-Q186 PolarHBondContact O-N 3.21Å; Q186-R188 VanDerWaalsContact C-N 3.31Å; Q186-R188 PolarHBondContact O-N 2.94Å; Q186-K189 PolarHBondContact O-N 3.04Å; Q186-E190 PolarHBondContact O-N 3.41Å
187	K	46.4	Very low	53.9	Low	145 Å²	145	130.8 Å²	130.8	63%	0.63	65%	0.65	S	S	*	*	H	α-helix	trans	-62.1	-32.5	172.6	-77.5	-175.3	176	-179.2	0	113.7	S183 K191	S183-K187 WeakPolarHBondContact O-CB 3.4Å; S183-K187 WeakPolarHBondContact O-CD 3.45Å; S183-K187 VanDerWaalsContact O-CG 3.31Å; S183-K187 WeakPolarHBondContact O-CG 3.13Å; K187-K191 WeakPolarHBondContact O-CB 3.42Å; K187-K191 WeakPolarHBondContact O-CG 3.48Å; K187-K191 PolarHBondContact O-N 3.33Å
188	R	53	Low	52.2	Low	185 Å²	185	132.6 Å²	132.6	70%	0.698	67%	0.667	S	S	*	*	H	α-helix	trans	-73.3	-39.3	176.9	-166.7	174	173.9	-179.2	-2.3	111.5	K184 Q185 Q186 K191 L192	K184-R188 VanDerWaalsContact O-CB 3.3Å; K184-R188 WeakPolarHBondContact O-CB 3.32Å; K184-R188 PolarHBondContact O-N 2.89Å; Q185-R188 PolarHBondContact O-N 2.53Å; Q186-R188 VanDerWaalsContact C-N 3.31Å; Q186-R188 PolarHBondContact O-N 2.94Å; R188-K191 PolarHBondContact O-N 2.96Å; R188-L192 HydrophobicContact CG-CD1 4.09Å; R188-L192 WeakPolarHBondContact O-CB 3.42Å; R188-L192 WeakPolarHBondContact O-CD1 3.45Å; R188-L192 PolarHBondContact O-N 2.89Å; R188-L192 VanDerWaalsContact O-N 3.08Å
189	K	53.5	Low	50.5	Low	164 Å²	164	140.9 Å²	140.9	71%	0.713	71%	0.707	S	S	*	*	H	α-helix	trans	-66.6	-37.5	174.8	-109.6	-178.3	175.3	-179.8	0	112.4	Q185 Q186 L192 K193	Q185-K189 PolarHBondContact O-N 2.86Å; Q186-K189 PolarHBondContact O-N 3.04Å; K189-L192 PolarHBondContact O-N 2.87Å; K189-K193 PolarHBondContact O-N 3.22Å; K189-K193 VanDerWaalsContact O-N 3.1Å
190	E	56.1	Low	50.1	Low	134 Å²	134	142.1 Å²	142.1	63%	0.626	71%	0.711	S	S	*	*	H	α-helix	trans	-69.1	-42.1	174.6	-75.2	175.5	165.6	0	0	112.5	Q186 L192 K193 G194	Q186-E190 PolarHBondContact O-N 3.41Å; E190-L192 VanDerWaalsContact C-N 3.29Å; E190-L192 PolarHBondContact O-N 3.08Å; E190-K193 PolarHBondContact O-N 2.67Å; E190-G194 PolarHBondContact O-N 2.66Å; E190-G194 VanDerWaalsContact O-N 3.14Å
191	K	55.3	Low	50.1	Low	169 Å²	169	146.8 Å²	146.8	74%	0.735	72%	0.72	S	S	*	*	H	α-helix	trans	-64.8	-28.5	174.7	-83.1	-172.2	174.3	-172.9	0	114	K187 R188	K187-K191 WeakPolarHBondContact O-CB 3.42Å; K187-K191 WeakPolarHBondContact O-CG 3.48Å; K187-K191 PolarHBondContact O-N 3.33Å; R188-K191 PolarHBondContact O-N 2.96Å
192	L	58.2	Low	50.3	Low	109 Å²	109	144.8 Å²	144.8	57%	0.571	72%	0.716	S	S	*	*	H	α-helix	trans	-78.4	-37.8	175.8	-86.2	151.7	0	0	0	111.9	R188 K189 E190 G194 K195	R188-L192 HydrophobicContact CG-CD1 4.09Å; R188-L192 WeakPolarHBondContact O-CB 3.42Å; R188-L192 WeakPolarHBondContact O-CD1 3.45Å; R188-L192 PolarHBondContact O-N 2.89Å; R188-L192 VanDerWaalsContact O-N 3.08Å; K189-L192 PolarHBondContact O-N 2.87Å; E190-L192 VanDerWaalsContact C-N 3.29Å; E190-L192 PolarHBondContact O-N 3.08Å; L192-G194 VanDerWaalsContact C-N 3.32Å; L192-G194 PolarHBondContact O-N 3.08Å; L192-K195 PolarHBondContact O-N 3.25Å
193	K	56.5	Low	50.6	Low	171 Å²	171	145.5 Å²	145.5	74%	0.743	72%	0.724	S	S	*	*	H	α-helix	trans	-67.7	-29.1	175.4	-79.6	-172.3	171.9	-170.2	0	113.4	K189 E190 K195	K189-K193 PolarHBondContact O-N 3.22Å; K189-K193 VanDerWaalsContact O-N 3.1Å; E190-K193 PolarHBondContact O-N 2.67Å; K193-K195 VanDerWaalsContact C-N 3.3Å; K193-K195 PolarHBondContact O-N 2.88Å
194	G	50.6	Low	50.9	Low	63 Å²	63	150 Å²	150	65%	0.649	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-4.7	175.5	0	0	0	0	0	115.7	E190 L192	E190-G194 PolarHBondContact O-N 2.66Å; E190-G194 VanDerWaalsContact O-N 3.14Å; L192-G194 VanDerWaalsContact C-N 3.32Å; L192-G194 PolarHBondContact O-N 3.08Å
195	K	56.3	Low	51.3	Low	179 Å²	179	148.5 Å²	148.5	78%	0.778	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-3.5	-179.3	-77.2	-169.9	173	-166.9	0	114.7	L192 K193	L192-K195 PolarHBondContact O-N 3.25Å; K193-K195 VanDerWaalsContact C-N 3.3Å; K193-K195 PolarHBondContact O-N 2.88Å
196	C	49.7	Very low	51.6	Low	119 Å²	119	147.6 Å²	147.6	80%	0.804	74%	0.735	S	S	*	*	S	Bend	trans	-106.6	27.8	177.8	-76.9	0	0	0	0	113.6
197	V	51.9	Low	51.7	Low	116 Å²	116	149.3 Å²	149.3	70%	0.703	75%	0.746	S	S	*	*	S	Bend	trans	-122	123.2	164	-171.1	0	0	0	0	105.7
198	V	46	Very low	52.1	Low	129 Å²	129	149.7 Å²	149.7	78%	0.782	76%	0.756	S	S	*	*			trans	89	78.4	-176.3	-161.7	0	0	0	0	115.5
199	M	38.3	Very low	52	Low	258 Å²	258	146.5 Å²	146.5	100%	1.271	76%	0.761	S	S	*	*				-171.2	0	106.5	-110	180	-90.7	0	0	109.7

Retrieved 199 of 199 residues in 54 ms (Link to these results)

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