A0A077ZJ36_TRITR Loading...

Small ribosomal subunit protein uS17

AlphaFold DB , UniProt , Accession A0A077ZJ36, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 267 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	44.2	Very low	75.4	Confident	240 Å²	240	146.2 Å²	146.2	100%	1.182	70%	0.696	S	S	*	*				0	113.7	0	-70.7	-179.6	-179.6	0	0	107.2	E3	M1-E3 PolarHBondContact O-N 3.17Å
2	T	54.3	Low	77.2	Confident	146 Å²	146	143.1 Å²	143.1	90%	0.896	68%	0.68	S	S	*	*			trans	-78	108.1	173.8	-31.4	0	0	0	0	105.9	E4	T2-E4 PolarHBondContact O-N 3.29Å
3	E	62.7	Low	78.7	Confident	183 Å²	183	132.7 Å²	132.7	86%	0.855	63%	0.634	S	S	*	*			trans	-52.8	124	174.9	-71.6	-175.9	157	0	0	109	M1 R5	M1-E3 PolarHBondContact O-N 3.17Å; E3-R5 PolarHBondContact O-N 3.23Å
4	E	67.3	Low	80	Confident	193 Å²	193	133.2 Å²	133.2	90%	0.902	63%	0.627	S	S	*	*			trans	-62.8	108.6	178.4	-136.4	178.3	-175.8	0	0	108	T2 N6	T2-E4 PolarHBondContact O-N 3.29Å; E4-N6 PolarHBondContact O-N 2.99Å
5	R	68.5	Low	81.2	Confident	171 Å²	171	124.3 Å²	124.3	65%	0.645	59%	0.585	S	S	*	*			trans	-65.8	123.3	-171.3	-162.9	-175.5	-164.1	-175.4	9.5	109.2	E3 Q7	E3-R5 PolarHBondContact O-N 3.23Å; R5-Q7 PolarHBondContact O-N 3.05Å
6	N	76.7	Confident	82.1	Confident	145 Å²	145	120.1 Å²	120.1	78%	0.775	57%	0.57	S	S	*	*			trans	-45.2	135.6	174	-83.5	-22.5	0	0	0	112.2	E4 R8	E4-N6 PolarHBondContact O-N 2.99Å; N6-R8 PolarHBondContact O-N 3.39Å
7	Q	81.9	Confident	82.8	Confident	202 Å²	202	114.6 Å²	114.6	94%	0.944	55%	0.548	S	S	*	.			trans	-61.2	111.4	175.6	-69	-174.9	11	0	0	109.7	R5	R5-Q7 PolarHBondContact O-N 3.05Å
8	R	88.5	Confident	83.5	Confident	85 Å²	85	111.2 Å²	111.2	32%	0.321	53%	0.533	S	S	.	.			trans	-85.2	142.6	178.4	-61.8	-164.1	-178.7	173.4	-5.7	110.1	N6 V10 M65 E66	N6-R8 PolarHBondContact O-N 3.39Å; R8-V10 PolarHBondContact O-N 3.2Å; R8-M65 HydrophobicContact CB-CG 4.04Å; R8-E66 HydrophobicContact CB-CB 4.27Å; R8-E66 WeakPolarHBondContact CD-O 3.01Å; R8-E66 PolarHBondContact NH1-O 3.26Å
9	K	92.7	Very high	84	Confident	123 Å²	123	115.1 Å²	115.1	54%	0.535	55%	0.547	S	S	.	.			trans	-67	139.5	178.3	-57.1	-179.8	-177.1	171.7	0	110.2	Y11 E66	K9-Y11 HydrophobicContact CB-CE2 4.25Å; K9-Y11 WeakPolarHBondContact CD-OH 3.31Å; K9-E66 HydrophobicContact CB-CG 4.11Å; K9-E66 PolarHBondContact O-N 2.94Å
10	V	95.9	Very high	84.6	Confident	60 Å²	60	112.5 Å²	112.5	36%	0.364	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.3	176.7	180	0	0	0	0	107.9	R8 K63 I64 M65	R8-V10 PolarHBondContact O-N 3.2Å; V10-K63 HydrophobicContact CG1-CD 3.94Å; V10-K63 HydrophobicContact CG1-CG 3.37Å; V10-I64 CarbonylContact C-O 3.57Å; V10-I64 VanDerWaalsContact CA-O 3.31Å; V10-I64 WeakPolarHBondContact CA-O 3.01Å; V10-M65 HydrophobicContact CG2-CB 4.19Å; V10-M65 HydrophobicContact CG2-CE 3.87Å; V10-M65 HydrophobicContact CG2-CG 4.13Å
11	Y	96.6	Very high	85.1	Confident	60 Å²	60	112.6 Å²	112.6	24%	0.235	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	147.7	175	-59.1	-63	0	0	0	110.1	K9 V28 Y47 K63 I64 F76	K9-Y11 HydrophobicContact CB-CE2 4.25Å; K9-Y11 WeakPolarHBondContact CD-OH 3.31Å; Y11-V28 HydrophobicContact CD1-CG1 4.34Å; Y11-V28 HydrophobicContact CG-CG1 4.37Å; Y11-V28 HydrophobicContact CG-CG2 4.37Å; Y11-Y47 HydrophobicContact CD2-CE2 4.2Å; Y11-Y47 HydrophobicContact CE2-CE2 4.45Å; Y11-K63 CarbonylContact O-C 3.47Å; Y11-K63 WeakPolarHBondContact O-CA 3.33Å; Y11-I64 PolarHBondContact N-O 2.87Å; Y11-I64 WeakPolarHBondContact O-CG1 3.49Å; Y11-I64 PolarHBondContact O-N 2.84Å; Y11-F76 HydrophobicContact CD2-CD1 4.34Å; Y11-F76 AromaticContact CD2-CE1 3.44Å; Y11-F76 HydrophobicContact CD2-CE1 3.44Å; Y11-F76 VanDerWaalsContact CD2-CE1 3.44Å; Y11-F76 AromaticContact CD2-CZ 3.95Å; Y11-F76 HydrophobicContact CD2-CZ 3.95Å; Y11-F76 AromaticContact CE2-CE1 3.55Å; Y11-F76 HydrophobicContact CE2-CE1 3.55Å; Y11-F76 AromaticContact CE2-CZ 3.7Å; Y11-F76 HydrophobicContact CE2-CZ 3.7Å
12	Q	97.5	Very high	87.6	Confident	109 Å²	109	105.3 Å²	105.3	51%	0.509	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	137.8	166.6	-174.7	173.2	-27.1	0	0	108.5	I61 V62 V82	Q12-I61 HydrophobicContact CG-CG2 3.72Å; Q12-I61 VanDerWaalsContact NE2-CG2 3.31Å; Q12-V62 WeakPolarHBondContact CA-O 3.13Å; Q12-V82 HydrophobicContact CG-CG2 4.47Å
13	G	97	Very high	89.6	Confident	8 Å²	8	99 Å²	99	8%	0.082	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	173.8	-178.7	0	0	0	0	0	112.3	V26 V27 V62	G13-V26 VanDerWaalsContact C-CG1 3.49Å; G13-V27 CarbonylContact C-O 3.56Å; G13-V27 WeakPolarHBondContact CA-O 3.46Å; G13-V62 PolarHBondContact N-O 2.83Å; G13-V62 PolarHBondContact O-N 2.84Å
14	R	96.6	Very high	91.3	Very high	140 Å²	140	90.4 Å²	90.4	53%	0.528	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	136.5	-178.6	-177.4	178.7	176.7	142.3	6.7	111.1	V16 V26 V27 D60 I61	R14-V16 PolarHBondContact O-N 3.49Å; R14-V26 CarbonylContact O-C 3.56Å; R14-V26 WeakPolarHBondContact O-CA 3.41Å; R14-V27 HydrophobicContact CB-CG1 4.04Å; R14-V27 PolarHBondContact N-O 2.8Å; R14-V27 PolarHBondContact O-N 2.9Å; R14-D60 CarbonylContact C-O 3.57Å; R14-D60 WeakPolarHBondContact CA-O 3.44Å; R14-I61 HydrophobicContact CB-CD1 3.89Å; R14-I61 HydrophobicContact CG-CD1 4.17Å
15	V	96.9	Very high	92.7	Very high	0 Å²	0	81.9 Å²	81.9	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	123	172	-177.7	0	0	0	0	109.6	I24 V26 A56 K57 G59 D60 V62	V15-I24 HydrophobicContact CG1-CB 4.26Å; V15-I24 HydrophobicContact CG1-CG2 4.49Å; V15-I24 HydrophobicContact CG2-CD1 4.24Å; V15-V26 HydrophobicContact CG2-CG2 4.36Å; V15-A56 HydrophobicContact CG2-CB 4.21Å; V15-K57 VanDerWaalsContact CB-O 3.24Å; V15-K57 WeakPolarHBondContact CB-O 3.25Å; V15-K57 WeakPolarHBondContact CG1-O 3.38Å; V15-G59 PolarHBondContact O-N 2.79Å; V15-D60 HydrophobicContact CG2-CB 4.11Å; V15-D60 PolarHBondContact N-O 2.85Å; V15-V62 HydrophobicContact CG2-CB 4.32Å; V15-V62 HydrophobicContact CG2-CG1 3.63Å; V15-V62 HydrophobicContact CG2-CG2 3.67Å
16	V	95.6	Very high	94.1	Very high	57 Å²	57	73.8 Å²	73.8	35%	0.345	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-16.7	177.6	-63.1	0	0	0	0	113	R14 T25 V27 K46	R14-V16 PolarHBondContact O-N 3.49Å; V16-T25 HydrophobicContact CG2-CG2 3.58Å; V16-T25 VanDerWaalsContact CG2-O 3.28Å; V16-T25 WeakPolarHBondContact CG2-O 3.48Å; V16-T25 PolarHBondContact N-O 2.84Å; V16-V27 HydrophobicContact CG1-CB 3.8Å; V16-V27 HydrophobicContact CG1-CG1 3.48Å; V16-V27 VanDerWaalsContact CG1-CG1 3.48Å; V16-K46 HydrophobicContact CG2-CD 4.44Å
17	S	95.6	Very high	95.1	Very high	27 Å²	27	67.7 Å²	67.7	19%	0.189	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	131.4	176.4	-173.9	0	0	0	0	111.3	I24 T25	S17-I24 CarbonylContact O-C 3.58Å; S17-I24 WeakPolarHBondContact O-CA 3.39Å; S17-T25 PolarHBondContact N-O 2.91Å; S17-T25 PolarHBondContact O-N 3.5Å
18	D	94.1	Very high	95.9	Very high	53 Å²	53	58.5 Å²	58.5	28%	0.283	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	16.9	174.9	62.8	-12.2	0	0	0	111.6	M20 I24 I58	D18-M20 VanDerWaalsContact C-N 3.26Å; D18-M20 PolarHBondContact O-N 3.34Å; D18-I24 HydrophobicContact CB-CG2 4.47Å; D18-I58 HydrophobicContact CB-CG1 4.39Å; D18-I58 WeakPolarHBondContact OD1-CD1 3.33Å; D18-I58 VanDerWaalsContact OD1-CG1 3.27Å; D18-I58 WeakPolarHBondContact OD1-CG1 3.38Å; D18-I58 PolarHBondContact OD2-N 2.89Å
19	K	94.2	Very high	96.2	Very high	184 Å²	184	61.1 Å²	61.1	80%	0.8	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	-19.4	-174	-64.5	-175.4	179.2	-176.4	0	114.2
20	M	94.5	Very high	96.3	Very high	64 Å²	64	58.5 Å²	58.5	32%	0.315	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	135.8	-174.9	-67.3	168.3	-70.8	0	0	108.7	D18 K22 T23 T25 K48	D18-M20 VanDerWaalsContact C-N 3.26Å; D18-M20 PolarHBondContact O-N 3.34Å; M20-K22 PolarHBondContact O-N 2.91Å; M20-T23 HydrophobicContact CB-CG2 4.36Å; M20-T23 HydrophobicContact CE-CG2 3.84Å; M20-T23 PolarHBondContact O-N 2.98Å; M20-T23 VanDerWaalsContact O-O 3.1Å; M20-T23 HydrophobicContact SD-CG2 4.17Å; M20-T25 WeakPolarHBondContact CE-OG1 3.39Å; M20-K48 HydrophobicContact CE-CD 4.31Å; M20-K48 VanDerWaalsContact CE-NZ 3.32Å; M20-K48 HydrophobicContact SD-CD 4.41Å; M20-K48 PolarHBondContact SD-NZ 2.92Å; M20-K48 VanDerWaalsContact SD-NZ 3.37Å
21	D	95.7	Very high	96.1	Very high	115 Å²	115	62.3 Å²	62.3	62%	0.615	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	135.2	176.7	-173.8	47.1	0	0	0	111.6	T23 N54	D21-T23 PolarHBondContact O-N 3.44Å; D21-T23 PolarHBondContact O-OG1 2.77Å; D21-N54 PolarHBondContact OD1-ND2 2.66Å
22	K	95.9	Very high	95.9	Very high	86 Å²	86	66.2 Å²	66.2	37%	0.374	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	23.1	-176.9	-57.5	179.6	-178.4	-173.9	0	115.1	M20 H50 D51 N54 K74	M20-K22 PolarHBondContact O-N 2.91Å; K22-H50 PolarHBondContact O-ND1 3Å; K22-D51 CarbonylContact C-O 3.59Å; K22-D51 WeakPolarHBondContact CA-O 3.26Å; K22-D51 WeakPolarHBondContact CB-O 3.41Å; K22-D51 PolarHBondContact O-N 3.46Å; K22-N54 WeakPolarHBondContact CA-OD1 3.26Å; K22-N54 PolarHBondContact N-OD1 3.17Å; K22-K74 PolarHBondContact O-NZ 3.14Å
23	T	97.7	Very high	95.7	Very high	15 Å²	15	65.4 Å²	65.4	9%	0.092	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	114.5	-168.5	-47.6	0	0	0	0	112.1	M20 D21 K48 A49 K74	M20-T23 HydrophobicContact CB-CG2 4.36Å; M20-T23 HydrophobicContact CE-CG2 3.84Å; M20-T23 PolarHBondContact O-N 2.98Å; M20-T23 VanDerWaalsContact O-O 3.1Å; M20-T23 HydrophobicContact SD-CG2 4.17Å; D21-T23 PolarHBondContact O-N 3.44Å; D21-T23 PolarHBondContact O-OG1 2.77Å; T23-K48 HydrophobicContact CG2-CB 4.19Å; T23-K48 HydrophobicContact CG2-CD 4.19Å; T23-A49 WeakPolarHBondContact CA-O 3.49Å; T23-K74 VanDerWaalsContact CG2-CE 3.5Å; T23-K74 WeakPolarHBondContact OG1-CE 3.2Å; T23-K74 PolarHBondContact OG1-NZ 3.14Å
24	I	97.1	Very high	95.4	Very high	2 Å²	2	67.2 Å²	67.2	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	145	172.2	62.4	177	0	0	0	110.8	V15 S17 D18 V26 K48 A49 D51 A56 V62 L78	V15-I24 HydrophobicContact CG1-CB 4.26Å; V15-I24 HydrophobicContact CG1-CG2 4.49Å; V15-I24 HydrophobicContact CG2-CD1 4.24Å; S17-I24 CarbonylContact O-C 3.58Å; S17-I24 WeakPolarHBondContact O-CA 3.39Å; D18-I24 HydrophobicContact CB-CG2 4.47Å; I24-V26 HydrophobicContact CD1-CG2 3.85Å; I24-V26 HydrophobicContact CG1-CG2 3.96Å; I24-K48 CarbonylContact O-C 3.51Å; I24-K48 WeakPolarHBondContact O-CA 3.43Å; I24-A49 HydrophobicContact CD1-CB 4.31Å; I24-A49 HydrophobicContact CG1-CB 3.85Å; I24-A49 PolarHBondContact N-O 2.68Å; I24-A49 PolarHBondContact O-N 2.63Å; I24-D51 HydrophobicContact CG1-CB 4.47Å; I24-D51 HydrophobicContact CG2-CB 4.14Å; I24-A56 HydrophobicContact CD1-CB 3.95Å; I24-A56 HydrophobicContact CG2-CB 4.25Å; I24-V62 HydrophobicContact CD1-CG2 4.34Å; I24-L78 HydrophobicContact CD1-CB 4.43Å; I24-L78 HydrophobicContact CD1-CD1 4.1Å
25	T	98	Very high	95.2	Very high	14 Å²	14	66.3 Å²	66.3	9%	0.086	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.6	167.5	-53.9	0	0	0	0	108.4	V16 S17 M20 K46 Y47	V16-T25 HydrophobicContact CG2-CG2 3.58Å; V16-T25 VanDerWaalsContact CG2-O 3.28Å; V16-T25 WeakPolarHBondContact CG2-O 3.48Å; V16-T25 PolarHBondContact N-O 2.84Å; S17-T25 PolarHBondContact N-O 2.91Å; S17-T25 PolarHBondContact O-N 3.5Å; M20-T25 WeakPolarHBondContact CE-OG1 3.39Å; T25-K46 HydrophobicContact CG2-CB 4.04Å; T25-K46 HydrophobicContact CG2-CD 4.32Å; T25-K46 HydrophobicContact CG2-CG 4.43Å; T25-Y47 CarbonylContact C-O 3.42Å; T25-Y47 WeakPolarHBondContact CA-O 3.46Å
26	V	97.9	Very high	94.9	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128.2	-177.1	-176.8	0	0	0	0	109.1	G13 R14 V15 I24 V28 K46 Y47 V62 I64	G13-V26 VanDerWaalsContact C-CG1 3.49Å; R14-V26 CarbonylContact O-C 3.56Å; R14-V26 WeakPolarHBondContact O-CA 3.41Å; V15-V26 HydrophobicContact CG2-CG2 4.36Å; I24-V26 HydrophobicContact CD1-CG2 3.85Å; I24-V26 HydrophobicContact CG1-CG2 3.96Å; V26-V28 HydrophobicContact CG1-CG2 4.41Å; V26-K46 CarbonylContact O-C 3.47Å; V26-K46 VanDerWaalsContact O-CA 3.29Å; V26-K46 WeakPolarHBondContact O-CA 3.46Å; V26-Y47 PolarHBondContact N-O 2.95Å; V26-Y47 PolarHBondContact O-N 2.85Å; V26-V62 HydrophobicContact CB-CG2 4.33Å; V26-V62 HydrophobicContact CG1-CG2 3.75Å; V26-V62 HydrophobicContact CG2-CG2 3.55Å; V26-I64 HydrophobicContact CB-CD1 4.18Å; V26-I64 HydrophobicContact CG1-CD1 4.3Å; V26-I64 HydrophobicContact CG2-CG2 3.92Å
27	V	98	Very high	94.7	Very high	18 Å²	18	79 Å²	79	11%	0.109	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	123.1	169.8	70.6	0	0	0	0	109.3	G13 R14 V16 K46	G13-V27 CarbonylContact C-O 3.56Å; G13-V27 WeakPolarHBondContact CA-O 3.46Å; R14-V27 HydrophobicContact CB-CG1 4.04Å; R14-V27 PolarHBondContact N-O 2.8Å; R14-V27 PolarHBondContact O-N 2.9Å; V16-V27 HydrophobicContact CG1-CB 3.8Å; V16-V27 HydrophobicContact CG1-CG1 3.48Å; V16-V27 VanDerWaalsContact CG1-CG1 3.48Å; V27-K46 HydrophobicContact CB-CG 4.34Å; V27-K46 HydrophobicContact CG2-CG 4.31Å
28	V	97.5	Very high	94.4	Very high	9 Å²	9	79.7 Å²	79.7	6%	0.055	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	119.6	173.2	176.9	0	0	0	0	107	Y11 V26 T30 S44 K45 Y47 I64	Y11-V28 HydrophobicContact CD1-CG1 4.34Å; Y11-V28 HydrophobicContact CG-CG1 4.37Å; Y11-V28 HydrophobicContact CG-CG2 4.37Å; V26-V28 HydrophobicContact CG1-CG2 4.41Å; V28-T30 HydrophobicContact CG1-CG2 4.24Å; V28-S44 WeakPolarHBondContact O-CA 3.35Å; V28-K45 PolarHBondContact N-O 2.88Å; V28-K45 PolarHBondContact O-N 3.44Å; V28-Y47 HydrophobicContact CB-CD2 4.17Å; V28-Y47 HydrophobicContact CB-CE2 3.9Å; V28-Y47 HydrophobicContact CG2-CD2 3.65Å; V28-Y47 HydrophobicContact CG2-CE2 3.78Å; V28-I64 HydrophobicContact CG2-CD1 4.41Å
29	E	95.5	Very high	94.2	Very high	139 Å²	139	84.7 Å²	84.7	65%	0.65	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.6	176.9	-61.4	-168.7	160.8	0	0	110.1	Y43	E29-Y43 CarbonylContact C-O 3.55Å; E29-Y43 WeakPolarHBondContact CA-O 3.41Å
30	T	93.6	Very high	94.1	Very high	69 Å²	69	84 Å²	84	42%	0.423	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	173.1	174.8	67.1	0	0	0	0	109.3	V28 Y43	V28-T30 HydrophobicContact CG1-CG2 4.24Å; T30-Y43 PolarHBondContact N-O 3.08Å; T30-Y43 PolarHBondContact O-N 2.77Å; T30-Y43 WeakPolarHBondContact OG1-CD1 3.32Å
31	K	93.3	Very high	93.9	Very high	139 Å²	139	84.7 Å²	84.7	60%	0.604	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	134.4	171.5	-64.8	178.2	-176.4	174.3	0	108.7	M41	K31-M41 VanDerWaalsContact CA-O 3.31Å; K31-M41 WeakPolarHBondContact CA-O 3.31Å
32	K	91.8	Very high	93.8	Very high	143 Å²	143	87.9 Å²	87.9	62%	0.622	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	142.2	173.7	-170.2	179.1	178.5	-178.7	0	108.8	M41	K32-M41 PolarHBondContact N-O 2.93Å; K32-M41 PolarHBondContact O-N 3.18Å
33	N	93.5	Very high	93.8	Very high	91 Å²	91	89.8 Å²	89.8	49%	0.487	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	140	174	-68	-4.8	0	0	0	110	R40	N33-R40 WeakPolarHBondContact OD1-CG 3.29Å
34	H	91	Very high	93.7	Very high	47 Å²	47	92.3 Å²	92.3	22%	0.218	45%	0.447	C	S	.	.			trans	-62.3	131.4	169.3	-172.6	-74.1	0	0	0	109.2	I36 Y37 G38 K39 M41	H34-I36 VanDerWaalsContact C-N 3.29Å; H34-I36 PolarHBondContact ND1-N 3.19Å; H34-I36 VanDerWaalsContact ND1-N 3.15Å; H34-I36 PolarHBondContact O-N 2.82Å; H34-Y37 AromaticContact CD2-CD2 3.95Å; H34-Y37 AromaticContact CE1-CD2 3.22Å; H34-Y37 WeakPolarHBondContact CE1-CD2 3.44Å; H34-Y37 AromaticContact CE1-CE2 3.52Å; H34-Y37 AromaticContact CG-CD2 3.75Å; H34-Y37 AromaticContact ND1-CD2 3.29Å; H34-Y37 VanDerWaalsContact ND1-CD2 3.29Å; H34-Y37 WeakPolarHBondContact ND1-CD2 3.36Å; H34-Y37 AromaticContact ND1-CG 3.9Å; H34-Y37 PolarHBondContact ND1-N 2.96Å; H34-Y37 VanDerWaalsContact ND1-N 3.18Å; H34-Y37 AromaticContact NE2-CD2 3.65Å; H34-Y37 AromaticContact NE2-CE2 3.88Å; H34-G38 WeakPolarHBondContact O-CA 3.42Å; H34-G38 PolarHBondContact O-N 2.76Å; H34-K39 PolarHBondContact N-O 3.22Å; H34-M41 HydrophobicContact CB-CE 3.65Å; H34-M41 HydrophobicContact CB-CG 4.41Å; H34-M41 HydrophobicContact CB-SD 3.91Å
35	P	90.7	Very high	93.6	Very high	121 Å²	121	97.2 Å²	97.2	79%	0.786	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-36.4	-171.5	20.5	-32.8	0	0	0	113.8
36	I	92.4	Very high	93.6	Very high	137 Å²	137	103.4 Å²	103.4	70%	0.703	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-55.5	179.2	-59.4	171.4	0	0	0	111.7	H34 G38	H34-I36 VanDerWaalsContact C-N 3.29Å; H34-I36 PolarHBondContact ND1-N 3.19Å; H34-I36 VanDerWaalsContact ND1-N 3.15Å; H34-I36 PolarHBondContact O-N 2.82Å; I36-G38 PolarHBondContact O-N 2.83Å
37	Y	91.5	Very high	93.6	Very high	185 Å²	185	105 Å²	105	73%	0.725	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.6	-172.3	-52.6	-60.8	0	0	0	116.1	H34 K39	H34-Y37 AromaticContact CD2-CD2 3.95Å; H34-Y37 AromaticContact CE1-CD2 3.22Å; H34-Y37 WeakPolarHBondContact CE1-CD2 3.44Å; H34-Y37 AromaticContact CE1-CE2 3.52Å; H34-Y37 AromaticContact CG-CD2 3.75Å; H34-Y37 AromaticContact ND1-CD2 3.29Å; H34-Y37 VanDerWaalsContact ND1-CD2 3.29Å; H34-Y37 WeakPolarHBondContact ND1-CD2 3.36Å; H34-Y37 AromaticContact ND1-CG 3.9Å; H34-Y37 PolarHBondContact ND1-N 2.96Å; H34-Y37 VanDerWaalsContact ND1-N 3.18Å; H34-Y37 AromaticContact NE2-CD2 3.65Å; H34-Y37 AromaticContact NE2-CE2 3.88Å; Y37-K39 PolarHBondContact O-N 3.15Å
38	G	87.4	Confident	93.6	Very high	43 Å²	43	107.2 Å²	107.2	44%	0.443	51%	0.508	S	S	.	.			trans	65.7	-9.6	-178.9	0	0	0	0	0	116	H34 I36 R40	H34-G38 WeakPolarHBondContact O-CA 3.42Å; H34-G38 PolarHBondContact O-N 2.76Å; I36-G38 PolarHBondContact O-N 2.83Å; G38-R40 PolarHBondContact O-N 2.88Å
39	K	90.8	Very high	93.6	Very high	157 Å²	157	106.8 Å²	106.8	68%	0.683	51%	0.506	S	S	*	.			trans	-56.7	128.4	179.1	-174.3	172.9	-177.3	174.2	0	110.7	H34 Y37 M41	H34-K39 PolarHBondContact N-O 3.22Å; Y37-K39 PolarHBondContact O-N 3.15Å; K39-M41 PolarHBondContact O-N 2.96Å
40	R	92.1	Very high	93.7	Very high	170 Å²	170	101.8 Å²	101.8	64%	0.642	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.8	113.3	173.1	-66.4	-173.4	71.3	115.7	0.7	109.5	N33 G38	N33-R40 WeakPolarHBondContact OD1-CG 3.29Å; G38-R40 PolarHBondContact O-N 2.88Å
41	M	91.4	Very high	93.9	Very high	79 Å²	79	98.7 Å²	98.7	39%	0.389	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	145.1	177.5	-60.5	-174.3	-57.3	0	0	110.4	K31 K32 H34 K39 Y43	K31-M41 VanDerWaalsContact CA-O 3.31Å; K31-M41 WeakPolarHBondContact CA-O 3.31Å; K32-M41 PolarHBondContact N-O 2.93Å; K32-M41 PolarHBondContact O-N 3.18Å; H34-M41 HydrophobicContact CB-CE 3.65Å; H34-M41 HydrophobicContact CB-CG 4.41Å; H34-M41 HydrophobicContact CB-SD 3.91Å; K39-M41 PolarHBondContact O-N 2.96Å; M41-Y43 PolarHBondContact O-N 2.82Å
42	K	92.5	Very high	94	Very high	181 Å²	181	97.2 Å²	97.2	79%	0.787	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.8	130.2	168.9	-65.4	-175.8	179.9	-175.5	0	108.4
43	Y	95.1	Very high	94.2	Very high	127 Å²	127	96 Å²	96	50%	0.498	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	141.7	172.6	-178.4	-98.3	0	0	0	107.6	E29 T30 M41 K45	E29-Y43 CarbonylContact C-O 3.55Å; E29-Y43 WeakPolarHBondContact CA-O 3.41Å; T30-Y43 PolarHBondContact N-O 3.08Å; T30-Y43 PolarHBondContact O-N 2.77Å; T30-Y43 WeakPolarHBondContact OG1-CD1 3.32Å; M41-Y43 PolarHBondContact O-N 2.82Å; Y43-K45 HydrophobicContact CE1-CB 4.3Å
44	S	95.6	Very high	94.3	Very high	68 Å²	68	94 Å²	94	48%	0.476	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	145.1	177.5	64.2	0	0	0	0	110.6	V28	V28-S44 WeakPolarHBondContact O-CA 3.35Å
45	K	96.3	Very high	94.4	Very high	104 Å²	104	96.9 Å²	96.9	45%	0.452	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	135.4	175.4	-173.8	163.6	171.9	-173	0	110	V28 Y43 Y47	V28-K45 PolarHBondContact N-O 2.88Å; V28-K45 PolarHBondContact O-N 3.44Å; Y43-K45 HydrophobicContact CE1-CB 4.3Å; K45-Y47 HydrophobicContact CB-CE2 4.09Å; K45-Y47 HydrophobicContact CD-CE1 4.01Å; K45-Y47 HydrophobicContact CD-CE2 4.43Å; K45-Y47 WeakPolarHBondContact CD-OH 3.14Å; K45-Y47 HydrophobicContact CG-CE1 4.14Å; K45-Y47 HydrophobicContact CG-CE2 4.04Å
46	K	97.8	Very high	94.6	Very high	144 Å²	144	91.2 Å²	91.2	63%	0.626	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	136	176.7	-66.2	178.9	-177.4	176.4	0	109.9	V16 T25 V26 V27	V16-K46 HydrophobicContact CG2-CD 4.44Å; T25-K46 HydrophobicContact CG2-CB 4.04Å; T25-K46 HydrophobicContact CG2-CD 4.32Å; T25-K46 HydrophobicContact CG2-CG 4.43Å; V26-K46 CarbonylContact O-C 3.47Å; V26-K46 VanDerWaalsContact O-CA 3.29Å; V26-K46 WeakPolarHBondContact O-CA 3.46Å; V27-K46 HydrophobicContact CB-CG 4.34Å; V27-K46 HydrophobicContact CG2-CG 4.31Å
47	Y	97.5	Very high	94.7	Very high	35 Å²	35	89.9 Å²	89.9	14%	0.137	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.2	176.1	-63.1	-75.9	0	0	0	109.6	Y11 T25 V26 V28 K45 I64 F76	Y11-Y47 HydrophobicContact CD2-CE2 4.2Å; Y11-Y47 HydrophobicContact CE2-CE2 4.45Å; T25-Y47 CarbonylContact C-O 3.42Å; T25-Y47 WeakPolarHBondContact CA-O 3.46Å; V26-Y47 PolarHBondContact N-O 2.95Å; V26-Y47 PolarHBondContact O-N 2.85Å; V28-Y47 HydrophobicContact CB-CD2 4.17Å; V28-Y47 HydrophobicContact CB-CE2 3.9Å; V28-Y47 HydrophobicContact CG2-CD2 3.65Å; V28-Y47 HydrophobicContact CG2-CE2 3.78Å; K45-Y47 HydrophobicContact CB-CE2 4.09Å; K45-Y47 HydrophobicContact CD-CE1 4.01Å; K45-Y47 HydrophobicContact CD-CE2 4.43Å; K45-Y47 WeakPolarHBondContact CD-OH 3.14Å; K45-Y47 HydrophobicContact CG-CE1 4.14Å; K45-Y47 HydrophobicContact CG-CE2 4.04Å; Y47-I64 HydrophobicContact CD2-CD1 4.16Å; Y47-I64 HydrophobicContact CG-CD1 4.21Å; Y47-F76 AromaticContact CD1-CD2 3.82Å; Y47-F76 HydrophobicContact CD1-CD2 3.82Å; Y47-F76 AromaticContact CD1-CE2 3.21Å; Y47-F76 HydrophobicContact CD1-CE2 3.21Å; Y47-F76 AromaticContact CD1-CZ 3.7Å; Y47-F76 HydrophobicContact CD1-CZ 3.7Å; Y47-F76 AromaticContact CE1-CE2 3.68Å; Y47-F76 HydrophobicContact CE1-CE2 3.68Å; Y47-F76 AromaticContact CE1-CZ 3.77Å; Y47-F76 HydrophobicContact CE1-CZ 3.77Å; Y47-F76 HydrophobicContact CG-CD2 4.14Å; Y47-F76 AromaticContact CG-CE2 3.91Å; Y47-F76 HydrophobicContact CG-CE2 3.91Å; Y47-F76 HydrophobicContact CG-CZ 4.3Å
48	K	98.1	Very high	94.7	Very high	63 Å²	63	85.2 Å²	85.2	27%	0.274	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	123.4	167	-65.1	-165	-165.9	-81.3	0	109.3	M20 T23 I24 T73 R75 F76	M20-K48 HydrophobicContact CE-CD 4.31Å; M20-K48 VanDerWaalsContact CE-NZ 3.32Å; M20-K48 HydrophobicContact SD-CD 4.41Å; M20-K48 PolarHBondContact SD-NZ 2.92Å; M20-K48 VanDerWaalsContact SD-NZ 3.37Å; T23-K48 HydrophobicContact CG2-CB 4.19Å; T23-K48 HydrophobicContact CG2-CD 4.19Å; I24-K48 CarbonylContact O-C 3.51Å; I24-K48 WeakPolarHBondContact O-CA 3.43Å; K48-T73 VanDerWaalsContact CD-OG1 3.31Å; K48-T73 WeakPolarHBondContact CD-OG1 3.22Å; K48-T73 WeakPolarHBondContact CE-OG1 3.42Å; K48-R75 PolarHBondContact O-N 3.43Å; K48-F76 PolarHBondContact O-N 2.89Å
49	A	97.9	Very high	94.9	Very high	0 Å²	0	83.6 Å²	83.6	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	145.9	178.4	0	0	0	0	0	111.2	T23 I24 I64 F76	T23-A49 WeakPolarHBondContact CA-O 3.49Å; I24-A49 HydrophobicContact CD1-CB 4.31Å; I24-A49 HydrophobicContact CG1-CB 3.85Å; I24-A49 PolarHBondContact N-O 2.68Å; I24-A49 PolarHBondContact O-N 2.63Å; A49-I64 HydrophobicContact CB-CB 4.31Å; A49-I64 HydrophobicContact CB-CG2 3.7Å; A49-F76 CarbonylContact C-O 3.5Å; A49-F76 VanDerWaalsContact CA-O 3.25Å; A49-F76 WeakPolarHBondContact CA-O 3.39Å; A49-F76 HydrophobicContact CB-CB 3.86Å
50	H	98.2	Very high	95	Very high	34 Å²	34	76.4 Å²	76.4	16%	0.157	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	126.3	172.3	-159.7	57.1	0	0	0	110.9	K22 E52 L70 K74 F76 R77 L78	K22-H50 PolarHBondContact O-ND1 3Å; H50-E52 IonicContact CD2-OE1 2.82Å; H50-E52 PolarHBondContact CD2-OE1 2.8Å; H50-E52 IonicContact CE1-OE1 2.71Å; H50-E52 IonicContact CE1-OE2 3.29Å; H50-E52 IonicContact NE2-OE1 3.6Å; H50-E52 PolarHBondContact NE2-OE1 3.17Å; H50-E52 IonicContact NE2-OE2 2.7Å; H50-E52 PolarHBondContact NE2-OE2 3.05Å; H50-L70 HydrophobicContact CB-CD1 3.62Å; H50-K74 HydrophobicContact CB-CD 3.74Å; H50-K74 HydrophobicContact CB-CG 4.35Å; H50-K74 PolarHBondContact ND1-NZ 2.74Å; H50-F76 PolarHBondContact N-O 2.85Å; H50-R77 HydrophobicContact CB-CB 4.12Å; H50-R77 CarbonylContact O-C 3.57Å; H50-R77 WeakPolarHBondContact O-CA 3.49Å; H50-L78 WeakPolarHBondContact O-CB 3.45Å; H50-L78 PolarHBondContact O-N 2.86Å
51	D	97.6	Very high	95.3	Very high	5 Å²	5	70.1 Å²	70.1	3%	0.027	33%	0.332	C	S	.	.			trans	-130.1	100.7	174.2	175.9	0.2	0	0	0	106.8	K22 I24 N53 N54 E55 A56 L78	K22-D51 CarbonylContact C-O 3.59Å; K22-D51 WeakPolarHBondContact CA-O 3.26Å; K22-D51 WeakPolarHBondContact CB-O 3.41Å; K22-D51 PolarHBondContact O-N 3.46Å; I24-D51 HydrophobicContact CG1-CB 4.47Å; I24-D51 HydrophobicContact CG2-CB 4.14Å; D51-N53 PolarHBondContact O-N 2.66Å; D51-N53 PolarHBondContact OD1-N 3.2Å; D51-N54 PolarHBondContact O-N 2.83Å; D51-N54 PolarHBondContact OD1-N 2.76Å; D51-N54 WeakPolarHBondContact OD2-CA 3.28Å; D51-E55 PolarHBondContact OD1-N 3.43Å; D51-E55 PolarHBondContact OD2-N 3.5Å; D51-A56 PolarHBondContact OD2-N 3.42Å; D51-L78 HydrophobicContact CB-CB 4.37Å; D51-L78 HydrophobicContact CB-CD2 4.18Å
52	E	94.8	Very high	95.6	Very high	108 Å²	108	66.4 Å²	66.4	51%	0.505	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-36	-171.3	-70.1	-71.2	177.8	0	0	113.1	H50	H50-E52 IonicContact CD2-OE1 2.82Å; H50-E52 PolarHBondContact CD2-OE1 2.8Å; H50-E52 IonicContact CE1-OE1 2.71Å; H50-E52 IonicContact CE1-OE2 3.29Å; H50-E52 IonicContact NE2-OE1 3.6Å; H50-E52 PolarHBondContact NE2-OE1 3.17Å; H50-E52 IonicContact NE2-OE2 2.7Å; H50-E52 PolarHBondContact NE2-OE2 3.05Å
53	N	96.2	Very high	95.8	Very high	117 Å²	117	61.1 Å²	61.1	63%	0.626	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	2	-169.6	-66	-27.6	0	0	0	112.4	D51 E55	D51-N53 PolarHBondContact O-N 2.66Å; D51-N53 PolarHBondContact OD1-N 3.2Å; N53-E55 HydrophobicContact CB-CG 3.67Å; N53-E55 VanDerWaalsContact CB-OE1 3.28Å; N53-E55 WeakPolarHBondContact CB-OE1 3.47Å; N53-E55 PolarHBondContact ND2-OE1 3.06Å; N53-E55 PolarHBondContact O-N 2.96Å
54	N	95.2	Very high	96	Very high	50 Å²	50	55.1 Å²	55.1	27%	0.267	27%	0.267	S	S	.	.			trans	52.4	37.6	-172.6	-62	-54.5	0	0	0	112.3	D21 K22 D51 K57	D21-N54 PolarHBondContact OD1-ND2 2.66Å; K22-N54 WeakPolarHBondContact CA-OD1 3.26Å; K22-N54 PolarHBondContact N-OD1 3.17Å; D51-N54 PolarHBondContact O-N 2.83Å; D51-N54 PolarHBondContact OD1-N 2.76Å; D51-N54 WeakPolarHBondContact OD2-CA 3.28Å; N54-K57 PolarHBondContact O-NZ 3.04Å
55	E	94.3	Very high	96	Very high	107 Å²	107	53.9 Å²	53.9	50%	0.5	26%	0.255	S	S	.	.			trans	-69.2	-43.7	-175.6	-80.9	170.3	-147	0	0	112.1	D51 N53 I81	D51-E55 PolarHBondContact OD1-N 3.43Å; D51-E55 PolarHBondContact OD2-N 3.5Å; N53-E55 HydrophobicContact CB-CG 3.67Å; N53-E55 VanDerWaalsContact CB-OE1 3.28Å; N53-E55 WeakPolarHBondContact CB-OE1 3.47Å; N53-E55 PolarHBondContact ND2-OE1 3.06Å; N53-E55 PolarHBondContact O-N 2.96Å; E55-I81 HydrophobicContact CB-CD1 4.17Å
56	A	94.9	Very high	96	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.008	25%	0.247	C	C	.	.			trans	-80.2	131.5	-173.3	0	0	0	0	0	111.7	V15 I24 D51 D60 V62 L78 I81	V15-A56 HydrophobicContact CG2-CB 4.21Å; I24-A56 HydrophobicContact CD1-CB 3.95Å; I24-A56 HydrophobicContact CG2-CB 4.25Å; D51-A56 PolarHBondContact OD2-N 3.42Å; A56-D60 WeakPolarHBondContact CA-OD2 3.43Å; A56-V62 HydrophobicContact CB-CG1 3.94Å; A56-L78 HydrophobicContact CB-CD2 4.01Å; A56-I81 HydrophobicContact CB-CD1 4.1Å; A56-I81 HydrophobicContact CB-CG1 4.14Å
57	K	92.8	Very high	95.8	Very high	109 Å²	109	46 Å²	46	47%	0.474	22%	0.223	S	C	.	.			trans	-106.6	162.8	-178.4	-57.1	-52.1	-179	-159.5	0	111.7	V15 N54 G59 D60	V15-K57 VanDerWaalsContact CB-O 3.24Å; V15-K57 WeakPolarHBondContact CB-O 3.25Å; V15-K57 WeakPolarHBondContact CG1-O 3.38Å; N54-K57 PolarHBondContact O-NZ 3.04Å; K57-G59 PolarHBondContact O-N 2.79Å; K57-D60 PolarHBondContact N-OD2 3.01Å; K57-D60 WeakPolarHBondContact O-CB 3.29Å; K57-D60 VanDerWaalsContact O-CG 3.29Å; K57-D60 PolarHBondContact O-N 3.49Å; K57-D60 VanDerWaalsContact O-N 3.16Å
58	I	92.2	Very high	95.6	Very high	87 Å²	87	53 Å²	53	45%	0.446	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	129.8	173.9	-68.1	165.6	0	0	0	110.1	D18	D18-I58 HydrophobicContact CB-CG1 4.39Å; D18-I58 WeakPolarHBondContact OD1-CD1 3.33Å; D18-I58 VanDerWaalsContact OD1-CG1 3.27Å; D18-I58 WeakPolarHBondContact OD1-CG1 3.38Å; D18-I58 PolarHBondContact OD2-N 2.89Å
59	G	90.7	Very high	95.5	Very high	10 Å²	10	53.8 Å²	53.8	10%	0.103	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	100	-20.8	179.3	0	0	0	0	0	114.4	V15 K57	V15-G59 PolarHBondContact O-N 2.79Å; K57-G59 PolarHBondContact O-N 2.79Å
60	D	94.6	Very high	95.3	Very high	6 Å²	6	57.1 Å²	57.1	3%	0.032	28%	0.278	C	S	.	.			trans	-60.5	143.1	178.8	-68.4	-5.8	0	0	0	110.8	R14 V15 A56 K57 V62 I81 E83 A85	R14-D60 CarbonylContact C-O 3.57Å; R14-D60 WeakPolarHBondContact CA-O 3.44Å; V15-D60 HydrophobicContact CG2-CB 4.11Å; V15-D60 PolarHBondContact N-O 2.85Å; A56-D60 WeakPolarHBondContact CA-OD2 3.43Å; K57-D60 PolarHBondContact N-OD2 3.01Å; K57-D60 WeakPolarHBondContact O-CB 3.29Å; K57-D60 VanDerWaalsContact O-CG 3.29Å; K57-D60 PolarHBondContact O-N 3.49Å; K57-D60 VanDerWaalsContact O-N 3.16Å; D60-V62 HydrophobicContact CB-CG1 3.95Å; D60-I81 HydrophobicContact CB-CG2 4.14Å; D60-E83 WeakPolarHBondContact CA-O 3.44Å; D60-A85 WeakPolarHBondContact OD1-CB 3.32Å; D60-A85 PolarHBondContact OD1-N 2.81Å
61	I	96.8	Very high	95.2	Very high	38 Å²	38	58.7 Å²	58.7	20%	0.195	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	117.4	166	-54.6	-58.3	0	0	0	107.1	Q12 R14 V82 E83	Q12-I61 HydrophobicContact CG-CG2 3.72Å; Q12-I61 VanDerWaalsContact NE2-CG2 3.31Å; R14-I61 HydrophobicContact CB-CD1 3.89Å; R14-I61 HydrophobicContact CG-CD1 4.17Å; I61-V82 HydrophobicContact CG2-CB 4.22Å; I61-V82 WeakPolarHBondContact O-CA 3.33Å; I61-V82 WeakPolarHBondContact O-CB 3.39Å; I61-V82 PolarHBondContact O-N 2.8Å; I61-E83 HydrophobicContact CB-CB 3.98Å; I61-E83 HydrophobicContact CB-CG 4.47Å; I61-E83 HydrophobicContact CG1-CB 4.12Å; I61-E83 PolarHBondContact N-O 3.41Å; I61-E83 PolarHBondContact O-N 3.44Å; I61-E83 VanDerWaalsContact O-N 3.08Å
62	V	98	Very high	95.1	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	151	-173.6	-63.2	0	0	0	0	110.9	Q12 G13 V15 I24 V26 A56 D60 I64 L78 I81	Q12-V62 WeakPolarHBondContact CA-O 3.13Å; G13-V62 PolarHBondContact N-O 2.83Å; G13-V62 PolarHBondContact O-N 2.84Å; V15-V62 HydrophobicContact CG2-CB 4.32Å; V15-V62 HydrophobicContact CG2-CG1 3.63Å; V15-V62 HydrophobicContact CG2-CG2 3.67Å; I24-V62 HydrophobicContact CD1-CG2 4.34Å; V26-V62 HydrophobicContact CB-CG2 4.33Å; V26-V62 HydrophobicContact CG1-CG2 3.75Å; V26-V62 HydrophobicContact CG2-CG2 3.55Å; A56-V62 HydrophobicContact CB-CG1 3.94Å; D60-V62 HydrophobicContact CB-CG1 3.95Å; V62-I64 HydrophobicContact CG2-CG2 4.15Å; V62-L78 HydrophobicContact CB-CD1 3.71Å; V62-L78 HydrophobicContact CG1-CD1 3.87Å; V62-L78 HydrophobicContact CG2-CD1 4.47Å; V62-I81 HydrophobicContact CG1-CG1 4.11Å; V62-I81 HydrophobicContact CG1-CG2 4.47Å
63	K	97.9	Very high	95.1	Very high	71 Å²	71	61.5 Å²	61.5	31%	0.309	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.3	170.1	-169.3	179	-176	174.1	0	108.8	V10 Y11 V79 E80 V82	V10-K63 HydrophobicContact CG1-CD 3.94Å; V10-K63 HydrophobicContact CG1-CG 3.37Å; Y11-K63 CarbonylContact O-C 3.47Å; Y11-K63 WeakPolarHBondContact O-CA 3.33Å; K63-V79 HydrophobicContact CB-CB 4.38Å; K63-V79 HydrophobicContact CD-CG1 4.47Å; K63-V79 HydrophobicContact CG-CB 4.39Å; K63-V79 WeakPolarHBondContact O-CB 3.18Å; K63-V79 PolarHBondContact O-N 2.58Å; K63-E80 HydrophobicContact CB-CG 3.79Å; K63-E80 HydrophobicContact CD-CG 3.95Å; K63-E80 WeakPolarHBondContact CD-OE1 3.18Å; K63-E80 PolarHBondContact N-O 3.03Å; K63-E80 IonicContact NZ-OE1 3.78Å; K63-E80 PolarHBondContact NZ-OE1 2.89Å; K63-V82 HydrophobicContact CB-CG2 3.96Å
64	I	97.8	Very high	95.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	142.7	-179.5	61.8	172.3	0	0	0	110.2	V10 Y11 V26 V28 Y47 A49 V62 F76 R77	V10-I64 CarbonylContact C-O 3.57Å; V10-I64 VanDerWaalsContact CA-O 3.31Å; V10-I64 WeakPolarHBondContact CA-O 3.01Å; Y11-I64 PolarHBondContact N-O 2.87Å; Y11-I64 WeakPolarHBondContact O-CG1 3.49Å; Y11-I64 PolarHBondContact O-N 2.84Å; V26-I64 HydrophobicContact CB-CD1 4.18Å; V26-I64 HydrophobicContact CG1-CD1 4.3Å; V26-I64 HydrophobicContact CG2-CG2 3.92Å; V28-I64 HydrophobicContact CG2-CD1 4.41Å; Y47-I64 HydrophobicContact CD2-CD1 4.16Å; Y47-I64 HydrophobicContact CG-CD1 4.21Å; A49-I64 HydrophobicContact CB-CB 4.31Å; A49-I64 HydrophobicContact CB-CG2 3.7Å; V62-I64 HydrophobicContact CG2-CG2 4.15Å; I64-F76 HydrophobicContact CB-CB 4.22Å; I64-F76 HydrophobicContact CB-CD1 4.33Å; I64-F76 HydrophobicContact CD1-CB 4.2Å; I64-F76 HydrophobicContact CD1-CD1 3.85Å; I64-F76 HydrophobicContact CD1-CE1 4.46Å; I64-F76 HydrophobicContact CD1-CG 3.99Å; I64-F76 HydrophobicContact CG1-CD1 3.98Å; I64-F76 HydrophobicContact CG1-CG 4.48Å; I64-R77 CarbonylContact C-O 3.59Å; I64-R77 VanDerWaalsContact CA-O 3.26Å; I64-R77 WeakPolarHBondContact CA-O 3.47Å
65	M	96.5	Very high	95.2	Very high	43 Å²	43	59.1 Å²	59.1	21%	0.212	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	141	179.9	176.7	-174.9	-72.1	0	0	110.2	R8 V10 F76 R77 V79	R8-M65 HydrophobicContact CB-CG 4.04Å; V10-M65 HydrophobicContact CG2-CB 4.19Å; V10-M65 HydrophobicContact CG2-CE 3.87Å; V10-M65 HydrophobicContact CG2-CG 4.13Å; M65-F76 CarbonylContact O-C 3.56Å; M65-F76 WeakPolarHBondContact O-CA 3.48Å; M65-R77 HydrophobicContact CB-CG 4.47Å; M65-R77 PolarHBondContact N-O 3.29Å; M65-R77 PolarHBondContact O-N 3Å; M65-V79 HydrophobicContact CB-CG2 3.35Å; M65-V79 HydrophobicContact CE-CG2 4.26Å
66	E	96.6	Very high	95.4	Very high	60 Å²	60	54.4 Å²	54.4	28%	0.28	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	146.3	174	-75.3	-179.1	170.7	0	0	112	R8 K9 R75 F76	R8-E66 HydrophobicContact CB-CB 4.27Å; R8-E66 WeakPolarHBondContact CD-O 3.01Å; R8-E66 PolarHBondContact NH1-O 3.26Å; K9-E66 HydrophobicContact CB-CG 4.11Å; K9-E66 PolarHBondContact O-N 2.94Å; E66-R75 CarbonylContact C-O 3.57Å; E66-F76 HydrophobicContact CB-CE1 4.24Å; E66-F76 HydrophobicContact CG-CD1 3.87Å; E66-F76 HydrophobicContact CG-CE1 3.18Å; E66-F76 HydrophobicContact CG-CE2 4.34Å; E66-F76 HydrophobicContact CG-CZ 3.45Å; E66-F76 VanDerWaalsContact CG-CZ 3.45Å
67	T	94.3	Very high	95.5	Very high	23 Å²	23	59.5 Å²	59.5	14%	0.141	30%	0.303	C	S	.	.			trans	-137.4	168.4	178	56.2	0	0	0	0	109.6	R75 F76 R77	T67-R75 PolarHBondContact N-O 3.36Å; T67-R75 PolarHBondContact OG1-O 3.1Å; T67-F76 PolarHBondContact OG1-N 2.9Å; T67-R77 HydrophobicContact CG2-CB 3.7Å; T67-R77 HydrophobicContact CG2-CG 3.51Å
68	R	92.7	Very high	95.7	Very high	181 Å²	181	55.4 Å²	55.4	68%	0.683	29%	0.286	S	S	*	.	S	Bend	trans	-53.5	156.8	162.1	70.3	179.6	-179.3	101.8	-5	109.5	L70	R68-L70 HydrophobicContact CG-CD2 4.1Å; R68-L70 PolarHBondContact O-N 2.95Å
69	P	95.5	Very high	95.9	Very high	80 Å²	80	54 Å²	54	52%	0.519	28%	0.281	S	S	.	.			trans	-52.5	112.6	169.2	-23.8	34.2	0	0	0	110.6
70	L	94	Very high	96.2	Very high	69 Å²	69	58 Å²	58	36%	0.361	30%	0.297	S	S	.	.	S	Bend	trans	-92.7	-27.3	176.5	-65.3	176.9	0	0	0	111.4	H50 R68 K74	H50-L70 HydrophobicContact CB-CD1 3.62Å; R68-L70 HydrophobicContact CG-CD2 4.1Å; R68-L70 PolarHBondContact O-N 2.95Å; L70-K74 HydrophobicContact CB-CB 4.37Å; L70-K74 HydrophobicContact CB-CD 4.04Å; L70-K74 HydrophobicContact CB-CG 4.22Å; L70-K74 HydrophobicContact CD1-CD 4.23Å; L70-K74 HydrophobicContact CD1-CG 4.44Å; L70-K74 PolarHBondContact N-O 3.47Å
71	S	95.4	Very high	96.3	Very high	67 Å²	67	59.6 Å²	59.6	47%	0.469	31%	0.305	S	S	.	.	S	Bend	trans	-155	176.3	175.3	175.9	0	0	0	0	108.3	T73 K74 R75	S71-T73 PolarHBondContact O-N 3.48Å; S71-T73 VanDerWaalsContact O-N 3.07Å; S71-K74 PolarHBondContact O-N 3.45Å; S71-R75 PolarHBondContact O-NH1 2.73Å
72	A	95.2	Very high	96.3	Very high	84 Å²	84	60.6 Å²	60.6	69%	0.694	31%	0.313	S	S	*	.	S	Bend	trans	-48.2	-41.5	-179.5	0	0	0	0	0	113.2	R75	A72-R75 PolarHBondContact O-NH1 2.48Å; A72-R75 PolarHBondContact O-NH2 3.31Å
73	T	95.9	Very high	96.1	Very high	88 Å²	88	66.4 Å²	66.4	54%	0.54	34%	0.34	S	S	.	.	S	Bend	trans	-115.1	-13.9	-176.2	48.6	0	0	0	0	114.6	K48 S71 R75	K48-T73 VanDerWaalsContact CD-OG1 3.31Å; K48-T73 WeakPolarHBondContact CD-OG1 3.22Å; K48-T73 WeakPolarHBondContact CE-OG1 3.42Å; S71-T73 PolarHBondContact O-N 3.48Å; S71-T73 VanDerWaalsContact O-N 3.07Å; T73-R75 PolarHBondContact O-N 2.92Å
74	K	96.5	Very high	95.8	Very high	19 Å²	19	71 Å²	71	8%	0.083	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	107.4	-177.9	-167	-177.2	-82.3	-171.9	0	109.7	K22 T23 H50 L70 S71	K22-K74 PolarHBondContact O-NZ 3.14Å; T23-K74 VanDerWaalsContact CG2-CE 3.5Å; T23-K74 WeakPolarHBondContact OG1-CE 3.2Å; T23-K74 PolarHBondContact OG1-NZ 3.14Å; H50-K74 HydrophobicContact CB-CD 3.74Å; H50-K74 HydrophobicContact CB-CG 4.35Å; H50-K74 PolarHBondContact ND1-NZ 2.74Å; L70-K74 HydrophobicContact CB-CB 4.37Å; L70-K74 HydrophobicContact CB-CD 4.04Å; L70-K74 HydrophobicContact CB-CG 4.22Å; L70-K74 HydrophobicContact CD1-CD 4.23Å; L70-K74 HydrophobicContact CD1-CG 4.44Å; L70-K74 PolarHBondContact N-O 3.47Å; S71-K74 PolarHBondContact O-N 3.45Å
75	R	96.6	Very high	95.1	Very high	98 Å²	98	72.8 Å²	72.8	37%	0.37	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	-3.4	-179.7	-64.8	-70.9	-179.6	-70.8	-6.6	112.8	K48 E66 T67 S71 A72 T73	K48-R75 PolarHBondContact O-N 3.43Å; E66-R75 CarbonylContact C-O 3.57Å; T67-R75 PolarHBondContact N-O 3.36Å; T67-R75 PolarHBondContact OG1-O 3.1Å; S71-R75 PolarHBondContact O-NH1 2.73Å; A72-R75 PolarHBondContact O-NH1 2.48Å; A72-R75 PolarHBondContact O-NH2 3.31Å; T73-R75 PolarHBondContact O-N 2.92Å
76	F	97.8	Very high	94.2	Very high	9 Å²	9	76.8 Å²	76.8	4%	0.039	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	161.5	-176.7	-67.1	-98.4	0	0	0	109.9	Y11 Y47 K48 A49 H50 I64 M65 E66 T67	Y11-F76 HydrophobicContact CD2-CD1 4.34Å; Y11-F76 AromaticContact CD2-CE1 3.44Å; Y11-F76 HydrophobicContact CD2-CE1 3.44Å; Y11-F76 VanDerWaalsContact CD2-CE1 3.44Å; Y11-F76 AromaticContact CD2-CZ 3.95Å; Y11-F76 HydrophobicContact CD2-CZ 3.95Å; Y11-F76 AromaticContact CE2-CE1 3.55Å; Y11-F76 HydrophobicContact CE2-CE1 3.55Å; Y11-F76 AromaticContact CE2-CZ 3.7Å; Y11-F76 HydrophobicContact CE2-CZ 3.7Å; Y47-F76 AromaticContact CD1-CD2 3.82Å; Y47-F76 HydrophobicContact CD1-CD2 3.82Å; Y47-F76 AromaticContact CD1-CE2 3.21Å; Y47-F76 HydrophobicContact CD1-CE2 3.21Å; Y47-F76 AromaticContact CD1-CZ 3.7Å; Y47-F76 HydrophobicContact CD1-CZ 3.7Å; Y47-F76 AromaticContact CE1-CE2 3.68Å; Y47-F76 HydrophobicContact CE1-CE2 3.68Å; Y47-F76 AromaticContact CE1-CZ 3.77Å; Y47-F76 HydrophobicContact CE1-CZ 3.77Å; Y47-F76 HydrophobicContact CG-CD2 4.14Å; Y47-F76 AromaticContact CG-CE2 3.91Å; Y47-F76 HydrophobicContact CG-CE2 3.91Å; Y47-F76 HydrophobicContact CG-CZ 4.3Å; K48-F76 PolarHBondContact O-N 2.89Å; A49-F76 CarbonylContact C-O 3.5Å; A49-F76 VanDerWaalsContact CA-O 3.25Å; A49-F76 WeakPolarHBondContact CA-O 3.39Å; A49-F76 HydrophobicContact CB-CB 3.86Å; H50-F76 PolarHBondContact N-O 2.85Å; I64-F76 HydrophobicContact CB-CB 4.22Å; I64-F76 HydrophobicContact CB-CD1 4.33Å; I64-F76 HydrophobicContact CD1-CB 4.2Å; I64-F76 HydrophobicContact CD1-CD1 3.85Å; I64-F76 HydrophobicContact CD1-CE1 4.46Å; I64-F76 HydrophobicContact CD1-CG 3.99Å; I64-F76 HydrophobicContact CG1-CD1 3.98Å; I64-F76 HydrophobicContact CG1-CG 4.48Å; M65-F76 CarbonylContact O-C 3.56Å; M65-F76 WeakPolarHBondContact O-CA 3.48Å; E66-F76 HydrophobicContact CB-CE1 4.24Å; E66-F76 HydrophobicContact CG-CD1 3.87Å; E66-F76 HydrophobicContact CG-CE1 3.18Å; E66-F76 HydrophobicContact CG-CE2 4.34Å; E66-F76 HydrophobicContact CG-CZ 3.45Å; E66-F76 VanDerWaalsContact CG-CZ 3.45Å; T67-F76 PolarHBondContact OG1-N 2.9Å
77	R	97.2	Very high	92.9	Very high	107 Å²	107	79.5 Å²	79.5	40%	0.404	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	151.4	164.9	68.5	-178.8	-168.7	132.7	5.3	110.1	H50 I64 M65 T67	H50-R77 HydrophobicContact CB-CB 4.12Å; H50-R77 CarbonylContact O-C 3.57Å; H50-R77 WeakPolarHBondContact O-CA 3.49Å; I64-R77 CarbonylContact C-O 3.59Å; I64-R77 VanDerWaalsContact CA-O 3.26Å; I64-R77 WeakPolarHBondContact CA-O 3.47Å; M65-R77 HydrophobicContact CB-CG 4.47Å; M65-R77 PolarHBondContact N-O 3.29Å; M65-R77 PolarHBondContact O-N 3Å; T67-R77 HydrophobicContact CG2-CB 3.7Å; T67-R77 HydrophobicContact CG2-CG 3.51Å
78	L	97.9	Very high	91.7	Very high	24 Å²	24	81.8 Å²	81.8	13%	0.126	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	132.2	166.2	-177.6	62.3	0	0	0	108.8	I24 H50 D51 A56 V62 I81	I24-L78 HydrophobicContact CD1-CB 4.43Å; I24-L78 HydrophobicContact CD1-CD1 4.1Å; H50-L78 WeakPolarHBondContact O-CB 3.45Å; H50-L78 PolarHBondContact O-N 2.86Å; D51-L78 HydrophobicContact CB-CB 4.37Å; D51-L78 HydrophobicContact CB-CD2 4.18Å; A56-L78 HydrophobicContact CB-CD2 4.01Å; V62-L78 HydrophobicContact CB-CD1 3.71Å; V62-L78 HydrophobicContact CG1-CD1 3.87Å; V62-L78 HydrophobicContact CG2-CD1 4.47Å; L78-I81 HydrophobicContact CD2-CG1 4.5Å
79	V	96.4	Very high	91	Very high	57 Å²	57	77.3 Å²	77.3	35%	0.345	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-54.6	172.1	179.7	0	0	0	0	109.1	K63 M65	K63-V79 HydrophobicContact CB-CB 4.38Å; K63-V79 HydrophobicContact CD-CG1 4.47Å; K63-V79 HydrophobicContact CG-CB 4.39Å; K63-V79 WeakPolarHBondContact O-CB 3.18Å; K63-V79 PolarHBondContact O-N 2.58Å; M65-V79 HydrophobicContact CB-CG2 3.35Å; M65-V79 HydrophobicContact CE-CG2 4.26Å
80	E	96.6	Very high	90.8	Very high	93 Å²	93	76.2 Å²	76.2	44%	0.435	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	154.3	-177.8	60.2	-171.5	159.6	0	0	110.3	K63 V82	K63-E80 HydrophobicContact CB-CG 3.79Å; K63-E80 HydrophobicContact CD-CG 3.95Å; K63-E80 WeakPolarHBondContact CD-OE1 3.18Å; K63-E80 PolarHBondContact N-O 3.03Å; K63-E80 IonicContact NZ-OE1 3.78Å; K63-E80 PolarHBondContact NZ-OE1 2.89Å; E80-V82 HydrophobicContact CG-CG2 4.29Å
81	I	96.8	Very high	90.9	Very high	40 Å²	40	72.9 Å²	72.9	21%	0.205	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	109.9	167.2	-58.6	168	0	0	0	106.7	E55 A56 D60 V62 L78 K84	E55-I81 HydrophobicContact CB-CD1 4.17Å; A56-I81 HydrophobicContact CB-CD1 4.1Å; A56-I81 HydrophobicContact CB-CG1 4.14Å; D60-I81 HydrophobicContact CB-CG2 4.14Å; V62-I81 HydrophobicContact CG1-CG1 4.11Å; V62-I81 HydrophobicContact CG1-CG2 4.47Å; L78-I81 HydrophobicContact CD2-CG1 4.5Å; I81-K84 HydrophobicContact CG2-CG 3.8Å
82	V	96	Very high	90.9	Very high	60 Å²	60	74.5 Å²	74.5	36%	0.364	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-46	-177.2	-176.7	0	0	0	0	110.3	Q12 I61 K63 E80	Q12-V82 HydrophobicContact CG-CG2 4.47Å; I61-V82 HydrophobicContact CG2-CB 4.22Å; I61-V82 WeakPolarHBondContact O-CA 3.33Å; I61-V82 WeakPolarHBondContact O-CB 3.39Å; I61-V82 PolarHBondContact O-N 2.8Å; K63-V82 HydrophobicContact CB-CG2 3.96Å; E80-V82 HydrophobicContact CG-CG2 4.29Å
83	E	93.8	Very high	91	Very high	122 Å²	122	72.9 Å²	72.9	57%	0.57	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.7	128.7	173.5	-60.3	172.9	-173	0	0	108.7	D60 I61	D60-E83 WeakPolarHBondContact CA-O 3.44Å; I61-E83 HydrophobicContact CB-CB 3.98Å; I61-E83 HydrophobicContact CB-CG 4.47Å; I61-E83 HydrophobicContact CG1-CB 4.12Å; I61-E83 PolarHBondContact N-O 3.41Å; I61-E83 PolarHBondContact O-N 3.44Å; I61-E83 VanDerWaalsContact O-N 3.08Å
84	K	91.5	Very high	91	Very high	168 Å²	168	76.3 Å²	76.3	73%	0.73	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-76.3	139.3	170.5	-73.9	-172.3	175.3	-174.6	0	109.5	I81 E86	I81-K84 HydrophobicContact CG2-CG 3.8Å; K84-E86 PolarHBondContact O-N 3.27Å
85	A	84.4	Confident	91	Very high	37 Å²	37	76 Å²	76	31%	0.306	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-55.3	139.5	167.9	0	0	0	0	0	109	D60 D87	D60-A85 WeakPolarHBondContact OD1-CB 3.32Å; D60-A85 PolarHBondContact OD1-N 2.81Å; A85-D87 PolarHBondContact O-N 3.42Å
86	E	77.4	Confident	91.1	Very high	126 Å²	126	76.6 Å²	76.6	59%	0.589	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-53.6	127.8	162.9	-68	-177.2	158.9	0	0	108	K84 T88 K167	K84-E86 PolarHBondContact O-N 3.27Å; E86-T88 PolarHBondContact O-N 2.74Å; E86-K167 IonicContact OE2-NZ 3.6Å; E86-K167 PolarHBondContact OE2-NZ 3.45Å
87	D	68.2	Low	91.1	Very high	117 Å²	117	76.2 Å²	76.2	63%	0.626	38%	0.382	S	S	*	.			trans	-62.8	92.6	175	-167.5	13.9	0	0	0	108.4	A85 Q89	A85-D87 PolarHBondContact O-N 3.42Å; D87-Q89 PolarHBondContact O-N 2.89Å
88	T	69.2	Low	91.1	Very high	71 Å²	71	76.7 Å²	76.7	44%	0.436	39%	0.387	S	S	.	.			trans	-73.2	84.4	172.2	41.9	0	0	0	0	106.6	E86 V90	E86-T88 PolarHBondContact O-N 2.74Å; T88-V90 VanDerWaalsContact C-N 3.27Å; T88-V90 PolarHBondContact O-N 3.36Å
89	Q	78.9	Confident	91.1	Very high	87 Å²	87	76.3 Å²	76.3	41%	0.407	39%	0.385	S	S	.	.			trans	-68	92	173.4	-169.5	175.9	60.4	0	0	108.5	D87 N171	D87-Q89 PolarHBondContact O-N 2.89Å; Q89-N171 PolarHBondContact O-ND2 2.74Å; Q89-N171 PolarHBondContact OE1-ND2 2.78Å; Q89-N171 VanDerWaalsContact OE1-ND2 3.14Å
90	V	91.7	Very high	91.2	Very high	57 Å²	57	73.6 Å²	73.6	35%	0.345	37%	0.369	S	S	.	.			trans	-68.1	129.6	171.9	-177.8	0	0	0	0	107.7	T88 Q92 T121	T88-V90 VanDerWaalsContact C-N 3.27Å; T88-V90 PolarHBondContact O-N 3.36Å; V90-Q92 PolarHBondContact O-N 3.07Å; V90-T121 HydrophobicContact CG1-CG2 3.49Å; V90-T121 VanDerWaalsContact CG1-CG2 3.49Å
91	I	96	Very high	91.2	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	121.3	178.7	-63.7	158.9	0	0	0	108.4	L97 T121 A122 I151 T154 N171	I91-L97 HydrophobicContact CD1-CD2 3.76Å; I91-L97 HydrophobicContact CD1-CG 4.5Å; I91-L97 HydrophobicContact CG1-CD2 4.2Å; I91-L97 HydrophobicContact CG2-CD1 4.03Å; I91-L97 HydrophobicContact CG2-CD2 4.22Å; I91-T121 CarbonylContact O-C 3.51Å; I91-T121 VanDerWaalsContact O-CA 3.28Å; I91-T121 WeakPolarHBondContact O-CA 3.38Å; I91-A122 HydrophobicContact CB-CB 4.2Å; I91-A122 HydrophobicContact CG2-CB 3.93Å; I91-A122 PolarHBondContact O-N 2.81Å; I91-I151 HydrophobicContact CD1-CD1 4.07Å; I91-I151 HydrophobicContact CD1-CG1 4.2Å; I91-I151 HydrophobicContact CD1-CG2 3.61Å; I91-I151 HydrophobicContact CG2-CD1 4.35Å; I91-T154 HydrophobicContact CD1-CG2 3.59Å; I91-N171 HydrophobicContact CD1-CB 4.2Å; I91-N171 HydrophobicContact CG1-CB 4.29Å
92	Q	95.9	Very high	91.2	Very high	101 Å²	101	70.5 Å²	70.5	47%	0.472	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	-175	177.1	60.3	-177.6	12	0	0	109.5	V90 E94 S95 T110 K120	V90-Q92 PolarHBondContact O-N 3.07Å; Q92-E94 PolarHBondContact O-N 3.07Å; Q92-S95 PolarHBondContact N-OG 3.17Å; Q92-S95 WeakPolarHBondContact O-CB 3.44Å; Q92-S95 PolarHBondContact O-N 2.92Å; Q92-S95 VanDerWaalsContact O-N 3.15Å; Q92-S95 PolarHBondContact O-OG 2.94Å; Q92-T110 WeakPolarHBondContact O-CB 3.36Å; Q92-T110 VanDerWaalsContact O-CG2 3.3Å; Q92-T110 WeakPolarHBondContact O-CG2 3.24Å; Q92-K120 WeakPolarHBondContact CB-O 3.31Å
93	A	96.6	Very high	91.2	Very high	50 Å²	50	67.7 Å²	67.7	41%	0.413	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	143.7	170.2	0	0	0	0	0	110.8	S95	A93-S95 PolarHBondContact O-N 3.44Å; A93-S95 VanDerWaalsContact O-N 3.11Å
94	E	95.9	Very high	91.2	Very high	160 Å²	160	62.4 Å²	62.4	75%	0.748	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	-4	-177.1	-50.5	-176.6	146.7	0	0	116.2	Q92 T110	Q92-E94 PolarHBondContact O-N 3.07Å; E94-T110 PolarHBondContact N-O 3.26Å
95	S	97.3	Very high	91.5	Very high	12 Å²	12	54.7 Å²	54.7	8%	0.084	29%	0.285	C	S	.	.			trans	-63.9	140	173.1	-61.4	0	0	0	0	111.5	Q92 A93 L109 T110	Q92-S95 PolarHBondContact N-OG 3.17Å; Q92-S95 WeakPolarHBondContact O-CB 3.44Å; Q92-S95 PolarHBondContact O-N 2.92Å; Q92-S95 VanDerWaalsContact O-N 3.15Å; Q92-S95 PolarHBondContact O-OG 2.94Å; A93-S95 PolarHBondContact O-N 3.44Å; A93-S95 VanDerWaalsContact O-N 3.11Å; S95-L109 WeakPolarHBondContact O-CA 3.06Å; S95-T110 PolarHBondContact O-N 3.19Å; S95-T110 PolarHBondContact O-OG1 2.84Å
96	R	97.3	Very high	92.1	Very high	110 Å²	110	60 Å²	60	42%	0.415	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	135.1	173.7	-65	-71.8	179.3	130.5	-0.2	110.3	E107 I108 K133	R96-E107 HydrophobicContact CB-CG 4.42Å; R96-E107 IonicContact CZ-OE2 2.9Å; R96-E107 IonicContact NH1-OE2 3.43Å; R96-E107 PolarHBondContact NH1-OE2 3.19Å; R96-I108 WeakPolarHBondContact CA-O 3.38Å; R96-K133 VanDerWaalsContact NH1-CG 3.28Å
97	L	97.9	Very high	93.1	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	143.2	177.9	-64.8	83.4	0	0	0	110	I91 E107 I108 T110 I128 I151 N171 A173	I91-L97 HydrophobicContact CD1-CD2 3.76Å; I91-L97 HydrophobicContact CD1-CG 4.5Å; I91-L97 HydrophobicContact CG1-CD2 4.2Å; I91-L97 HydrophobicContact CG2-CD1 4.03Å; I91-L97 HydrophobicContact CG2-CD2 4.22Å; L97-E107 WeakPolarHBondContact O-CA 3.34Å; L97-I108 HydrophobicContact CB-CD1 4.3Å; L97-I108 HydrophobicContact CB-CG1 3.9Å; L97-I108 PolarHBondContact N-O 2.76Å; L97-I108 PolarHBondContact O-N 2.99Å; L97-T110 VanDerWaalsContact CD1-OG1 3.23Å; L97-T110 WeakPolarHBondContact CD1-OG1 3.05Å; L97-I128 HydrophobicContact CD1-CD1 4.32Å; L97-I128 HydrophobicContact CD2-CD1 4.3Å; L97-I151 HydrophobicContact CD2-CD1 3.31Å; L97-N171 HydrophobicContact CG-CB 4.19Å; L97-A173 HydrophobicContact CD2-CB 3.96Å
98	K	98	Very high	94.6	Very high	116 Å²	116	50.5 Å²	50.5	50%	0.504	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	148.9	169	-66.1	-168.9	-166.8	163.9	0	110.3	R106 E170 N171 A172 A173	K98-R106 WeakPolarHBondContact CA-O 3.35Å; K98-E170 VanDerWaalsContact CD-OE2 3.27Å; K98-E170 WeakPolarHBondContact CD-OE2 3.39Å; K98-E170 WeakPolarHBondContact CE-OE2 3.23Å; K98-E170 IonicContact NZ-OE2 3.79Å; K98-E170 PolarHBondContact NZ-OE2 2.95Å; K98-N171 PolarHBondContact N-O 2.94Å; K98-N171 VanDerWaalsContact N-O 3.13Å; K98-A172 CarbonylContact O-C 3.53Å; K98-A172 VanDerWaalsContact O-CA 3.23Å; K98-A172 WeakPolarHBondContact O-CA 3.04Å; K98-A173 PolarHBondContact O-N 3.19Å
99	I	98.3	Very high	96	Very high	16 Å²	16	48.6 Å²	48.6	8%	0.082	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	125.2	173.2	-67.2	-55.9	0	0	0	110	D101 A105 R106 I108 A173 I175	I99-D101 VanDerWaalsContact C-N 3.34Å; I99-D101 HydrophobicContact CG2-CB 4.44Å; I99-D101 WeakPolarHBondContact CG2-OD1 3.31Å; I99-A105 HydrophobicContact CB-CB 4.38Å; I99-A105 WeakPolarHBondContact CB-O 3.49Å; I99-A105 HydrophobicContact CG1-CB 3.8Å; I99-A105 HydrophobicContact CG2-CB 4.35Å; I99-A105 WeakPolarHBondContact CG2-O 3.44Å; I99-R106 PolarHBondContact N-O 2.93Å; I99-I108 HydrophobicContact CD1-CB 4.28Å; I99-I108 HydrophobicContact CD1-CD1 3.72Å; I99-I108 HydrophobicContact CD1-CG1 3.79Å; I99-I108 HydrophobicContact CD1-CG2 3.56Å; I99-I108 HydrophobicContact CG1-CG1 4.5Å; I99-I108 HydrophobicContact CG1-CG2 3.82Å; I99-A173 WeakPolarHBondContact CA-O 3.17Å; I99-I175 HydrophobicContact CD1-CD1 4.13Å; I99-I175 HydrophobicContact CD1-CG1 3.81Å; I99-I175 HydrophobicContact CG1-CD1 4.4Å
100	A	97.5	Very high	96.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.			trans	-99.3	33.1	-179.9	0	0	0	0	0	111.8	V152 A172 A173 V174 I187 F188	A100-V152 HydrophobicContact CB-CG2 3.89Å; A100-A172 HydrophobicContact CB-CB 4.1Å; A100-A173 PolarHBondContact N-O 3.15Å; A100-V174 HydrophobicContact CB-CG2 4.13Å; A100-I187 CarbonylContact O-C 3.45Å; A100-I187 WeakPolarHBondContact O-CA 3.41Å; A100-I187 WeakPolarHBondContact O-CG2 3.4Å; A100-F188 PolarHBondContact O-N 2.78Å
101	D	96.9	Very high	97.2	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.016	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-142.1	169.5	174.9	70.7	33.7	0	0	0	111.8	I99 S103 V174 I175 R186 I187 F188	I99-D101 VanDerWaalsContact C-N 3.34Å; I99-D101 HydrophobicContact CG2-CB 4.44Å; I99-D101 WeakPolarHBondContact CG2-OD1 3.31Å; D101-S103 VanDerWaalsContact C-N 3.34Å; D101-S103 PolarHBondContact O-N 2.78Å; D101-S103 WeakPolarHBondContact OD1-CB 3.47Å; D101-S103 PolarHBondContact OD1-N 2.73Å; D101-S103 PolarHBondContact OD1-OG 3.16Å; D101-V174 HydrophobicContact CB-CG1 4.23Å; D101-I175 PolarHBondContact OD2-N 2.91Å; D101-R186 VanDerWaalsContact CA-O 3.26Å; D101-R186 WeakPolarHBondContact CA-O 3.36Å; D101-I187 HydrophobicContact CB-CD1 3.88Å; D101-F188 WeakPolarHBondContact O-CE2 3.12Å
102	N	95.7	Very high	97.2	Very high	66 Å²	66	51.3 Å²	51.3	35%	0.353	24%	0.244	S	C	.	.	S	Bend	trans	-91.1	24.9	177.2	71.6	-29.5	0	0	0	114.2	G104 G184 T185 R186 F188	N102-G104 PolarHBondContact O-N 3.27Å; N102-G104 VanDerWaalsContact O-N 3.15Å; N102-G184 WeakPolarHBondContact OD1-CA 3.4Å; N102-T185 PolarHBondContact ND2-OG1 3.39Å; N102-T185 PolarHBondContact OD1-N 2.8Å; N102-R186 HydrophobicContact CB-CB 4.45Å; N102-R186 PolarHBondContact N-O 2.82Å; N102-R186 VanDerWaalsContact N-O 3.15Å; N102-R186 PolarHBondContact OD1-N 2.85Å; N102-R186 PolarHBondContact OD1-O 3.39Å; N102-F188 HydrophobicContact CB-CE1 4.21Å; N102-F188 HydrophobicContact CB-CE2 4.46Å; N102-F188 HydrophobicContact CB-CZ 3.65Å
103	S	95.8	Very high	97.2	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.007	22%	0.224	C	C	.	.	S	Bend	trans	-65.9	-13.8	179.3	64.2	0	0	0	0	114.1	D101 V140 V141	D101-S103 VanDerWaalsContact C-N 3.34Å; D101-S103 PolarHBondContact O-N 2.78Å; D101-S103 WeakPolarHBondContact OD1-CB 3.47Å; D101-S103 PolarHBondContact OD1-N 2.73Å; D101-S103 PolarHBondContact OD1-OG 3.16Å; S103-V140 PolarHBondContact O-N 3.18Å; S103-V141 PolarHBondContact O-N 2.94Å
104	G	95.1	Very high	97.2	Very high	11 Å²	11	47 Å²	47	11%	0.113	22%	0.217	C	C	.	.	S	Bend	trans	105	-21	-177.6	0	0	0	0	0	113.4	N102 A135 T136	N102-G104 PolarHBondContact O-N 3.27Å; N102-G104 VanDerWaalsContact O-N 3.15Å; G104-A135 CarbonylContact O-C 3.57Å; G104-A135 VanDerWaalsContact O-CA 3.29Å; G104-A135 WeakPolarHBondContact O-CA 3.36Å; G104-T136 PolarHBondContact O-N 3.15Å
105	A	97.7	Very high	97	Very high	6 Å²	6	42.7 Å²	42.7	5%	0.05	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	144.4	171.8	0	0	0	0	0	110.9	I99 V132 V141 I175	I99-A105 HydrophobicContact CB-CB 4.38Å; I99-A105 WeakPolarHBondContact CB-O 3.49Å; I99-A105 HydrophobicContact CG1-CB 3.8Å; I99-A105 HydrophobicContact CG2-CB 4.35Å; I99-A105 WeakPolarHBondContact CG2-O 3.44Å; A105-V132 HydrophobicContact CB-CG1 3.76Å; A105-V132 HydrophobicContact CB-CG2 4.21Å; A105-V141 HydrophobicContact CB-CB 4.46Å; A105-V141 HydrophobicContact CB-CG1 4.4Å; A105-I175 HydrophobicContact CB-CD1 3.57Å
106	R	97.6	Very high	96.6	Very high	148 Å²	148	44.2 Å²	44.2	56%	0.558	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	-40.7	176.5	-65.7	-175.3	-178.4	-166.5	-3.6	111.9	K98 I99 Q134 T136	K98-R106 WeakPolarHBondContact CA-O 3.35Å; I99-R106 PolarHBondContact N-O 2.93Å; R106-Q134 HydrophobicContact CB-CB 4.1Å; R106-Q134 PolarHBondContact N-O 3.01Å; R106-T136 PolarHBondContact NE-OG1 3.25Å; R106-T136 PolarHBondContact NH2-OG1 3.37Å
107	E	98.2	Very high	96.2	Very high	44 Å²	44	45.4 Å²	45.4	21%	0.206	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	135.7	-178.7	-172.7	-175	-113.3	0	0	110.2	R96 L97 K133 Q134	R96-E107 HydrophobicContact CB-CG 4.42Å; R96-E107 IonicContact CZ-OE2 2.9Å; R96-E107 IonicContact NH1-OE2 3.43Å; R96-E107 PolarHBondContact NH1-OE2 3.19Å; L97-E107 WeakPolarHBondContact O-CA 3.34Å; E107-K133 PolarHBondContact O-N 2.89Å; E107-Q134 HydrophobicContact CB-CB 4.01Å; E107-Q134 HydrophobicContact CB-CG 4.12Å; E107-Q134 PolarHBondContact N-O 2.81Å; E107-Q134 PolarHBondContact O-N 3.33Å; E107-Q134 PolarHBondContact OE2-NE2 3.29Å; E107-Q134 VanDerWaalsContact OE2-NE2 3.13Å
108	I	98.4	Very high	95.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	153	173.4	59.6	168.4	0	0	0	110.8	R96 L97 I99 I128 A130 T131 V132 V147 A149 A173	R96-I108 WeakPolarHBondContact CA-O 3.38Å; L97-I108 HydrophobicContact CB-CD1 4.3Å; L97-I108 HydrophobicContact CB-CG1 3.9Å; L97-I108 PolarHBondContact N-O 2.76Å; L97-I108 PolarHBondContact O-N 2.99Å; I99-I108 HydrophobicContact CD1-CB 4.28Å; I99-I108 HydrophobicContact CD1-CD1 3.72Å; I99-I108 HydrophobicContact CD1-CG1 3.79Å; I99-I108 HydrophobicContact CD1-CG2 3.56Å; I99-I108 HydrophobicContact CG1-CG1 4.5Å; I99-I108 HydrophobicContact CG1-CG2 3.82Å; I108-I128 HydrophobicContact CD1-CD1 3.96Å; I108-A130 HydrophobicContact CB-CB 3.97Å; I108-A130 HydrophobicContact CD1-CB 3.79Å; I108-A130 HydrophobicContact CG1-CB 4.28Å; I108-T131 CarbonylContact C-O 3.36Å; I108-T131 VanDerWaalsContact CA-O 3.31Å; I108-T131 WeakPolarHBondContact CA-O 3Å; I108-V132 HydrophobicContact CG2-CG2 4.05Å; I108-V147 HydrophobicContact CG2-CG2 4.45Å; I108-A149 HydrophobicContact CD1-CB 3.87Å; I108-A173 HydrophobicContact CD1-CB 3.93Å
109	L	98.4	Very high	95.6	Very high	30 Å²	30	47.8 Å²	47.8	16%	0.157	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.4	168.9	176.8	151.3	0	0	0	109	S95 I111 A130 T131 K133	S95-L109 WeakPolarHBondContact O-CA 3.06Å; L109-I111 HydrophobicContact CD2-CG1 4.48Å; L109-I111 PolarHBondContact O-N 2.85Å; L109-A130 CarbonylContact O-C 3.53Å; L109-A130 WeakPolarHBondContact O-CA 3.28Å; L109-A130 VanDerWaalsContact O-CB 3.24Å; L109-A130 WeakPolarHBondContact O-CB 3.34Å; L109-T131 HydrophobicContact CB-CG2 3.94Å; L109-T131 HydrophobicContact CD2-CG2 3.99Å; L109-T131 PolarHBondContact N-O 3.43Å; L109-T131 PolarHBondContact O-N 2.97Å; L109-K133 HydrophobicContact CB-CD 4.3Å; L109-K133 HydrophobicContact CB-CG 3.71Å
110	T	98.3	Very high	95.4	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	125.5	176.6	-58.9	0	0	0	0	110.7	Q92 E94 S95 L97 V113 I128	Q92-T110 WeakPolarHBondContact O-CB 3.36Å; Q92-T110 VanDerWaalsContact O-CG2 3.3Å; Q92-T110 WeakPolarHBondContact O-CG2 3.24Å; E94-T110 PolarHBondContact N-O 3.26Å; S95-T110 PolarHBondContact O-N 3.19Å; S95-T110 PolarHBondContact O-OG1 2.84Å; L97-T110 VanDerWaalsContact CD1-OG1 3.23Å; L97-T110 WeakPolarHBondContact CD1-OG1 3.05Å; T110-V113 HydrophobicContact CG2-CG2 4.42Å; T110-I128 HydrophobicContact CG2-CB 4.18Å; T110-I128 HydrophobicContact CG2-CD1 4.23Å; T110-I128 HydrophobicContact CG2-CG2 4.21Å; T110-I128 VanDerWaalsContact OG1-CD1 3.31Å; T110-I128 WeakPolarHBondContact OG1-CD1 3.27Å
111	I	97.4	Very high	95.3	Very high	81 Å²	81	58.1 Å²	58.1	42%	0.415	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-49.1	172.1	-61.1	167.1	0	0	0	109.2	L109 V129 T131 V146	L109-I111 HydrophobicContact CD2-CG1 4.48Å; L109-I111 PolarHBondContact O-N 2.85Å; I111-V129 WeakPolarHBondContact CA-O 3.47Å; I111-V129 WeakPolarHBondContact CB-O 3.45Å; I111-V129 HydrophobicContact CD1-CG1 4.42Å; I111-V129 PolarHBondContact N-O 3.43Å; I111-T131 HydrophobicContact CD1-CG2 4.28Å; I111-T131 HydrophobicContact CG1-CG2 4.31Å; I111-V146 HydrophobicContact CD1-CG1 4.15Å; I111-V146 HydrophobicContact CD1-CG2 4.33Å
112	K	96.3	Very high	95.3	Very high	121 Å²	121	58.1 Å²	58.1	53%	0.526	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	140	-174.1	-179.1	174.7	-179.8	177.2	0	111.4	I128 V129	K112-I128 CarbonylContact O-C 3.46Å; K112-I128 WeakPolarHBondContact O-CA 3.32Å; K112-V129 HydrophobicContact CB-CB 4.48Å; K112-V129 PolarHBondContact N-O 2.94Å; K112-V129 VanDerWaalsContact N-O 3.11Å; K112-V129 PolarHBondContact O-N 3.49Å
113	V	97.5	Very high	95.2	Very high	6 Å²	6	57.2 Å²	57.2	4%	0.036	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	131.7	169.1	-174.9	0	0	0	0	109.8	T110 R119 A122 I128	T110-V113 HydrophobicContact CG2-CG2 4.42Å; V113-R119 HydrophobicContact CG1-CG 4.03Å; V113-A122 HydrophobicContact CB-CB 4.44Å; V113-A122 HydrophobicContact CG1-CB 3.69Å; V113-A122 HydrophobicContact CG2-CB 3.89Å; V113-I128 HydrophobicContact CG1-CG2 4.45Å; V113-I128 HydrophobicContact CG2-CG2 4.2Å
114	L	95.6	Very high	95.2	Very high	54 Å²	54	57.9 Å²	57.9	28%	0.283	34%	0.335	S	S	.	.			trans	-90.2	158.3	178.9	-57.8	-175.8	0	0	0	112.1	R119 V127 V129	L114-R119 VanDerWaalsContact O-CD 3.28Å; L114-R119 WeakPolarHBondContact O-CD 3.26Å; L114-R119 PolarHBondContact O-NH1 2.81Å; L114-V127 HydrophobicContact CB-CB 4.41Å; L114-V127 VanDerWaalsContact CB-O 3.27Å; L114-V127 WeakPolarHBondContact CB-O 3.3Å; L114-V127 HydrophobicContact CD1-CB 4.19Å; L114-V127 HydrophobicContact CD1-CG1 3.72Å; L114-V127 PolarHBondContact N-O 3.01Å; L114-V129 HydrophobicContact CD1-CG2 4.11Å; L114-V129 HydrophobicContact CD2-CG2 3.86Å; L114-V129 HydrophobicContact CG-CG2 4.13Å
115	G	91.7	Very high	95.2	Very high	70 Å²	70	58 Å²	58	72%	0.722	34%	0.337	S	S	*	.	S	Bend	trans	112.5	17.5	178.8	0	0	0	0	0	115.5
116	G	89.9	Confident	95.2	Very high	44 Å²	44	59 Å²	59	45%	0.454	34%	0.341	S	S	.	.	S	Bend	trans	147.3	155.6	171.9	0	0	0	0	0	113	G118 R119	G116-G118 VanDerWaalsContact C-N 3.31Å; G116-G118 PolarHBondContact O-N 3.24Å; G116-R119 PolarHBondContact O-N 3.25Å
117	S	88.1	Confident	95.1	Very high	135 Å²	135	53.3 Å²	53.3	94%	0.944	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-31.3	-176.7	-55.2	0	0	0	0	113.7
118	G	89.8	Confident	95.1	Very high	69 Å²	69	51.2 Å²	51.2	71%	0.711	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	1.9	-179.8	0	0	0	0	0	115	G116 K120	G116-G118 VanDerWaalsContact C-N 3.31Å; G116-G118 PolarHBondContact O-N 3.24Å; G118-K120 PolarHBondContact O-N 2.94Å
119	R	94	Very high	95.1	Very high	98 Å²	98	52.8 Å²	52.8	37%	0.37	32%	0.322	S	S	.	.			trans	-78.9	118.2	-172.9	-166.9	176.2	-174.1	159.8	17.7	111.1	V113 L114 G116 T121 D126	V113-R119 HydrophobicContact CG1-CG 4.03Å; L114-R119 VanDerWaalsContact O-CD 3.28Å; L114-R119 WeakPolarHBondContact O-CD 3.26Å; L114-R119 PolarHBondContact O-NH1 2.81Å; G116-R119 PolarHBondContact O-N 3.25Å; R119-T121 PolarHBondContact NE-O 2.93Å; R119-D126 VanDerWaalsContact CZ-CG 3.45Å; R119-D126 IonicContact CZ-OD1 3.72Å; R119-D126 IonicContact CZ-OD2 3.06Å; R119-D126 IonicContact NH1-OD1 2.63Å; R119-D126 PolarHBondContact NH1-OD1 3.36Å; R119-D126 IonicContact NH2-OD1 3.03Å; R119-D126 PolarHBondContact NH2-OD1 3.24Å; R119-D126 IonicContact NH2-OD2 2.66Å; R119-D126 PolarHBondContact NH2-OD2 2.76Å
120	K	94.1	Very high	95.1	Very high	166 Å²	166	51.3 Å²	51.3	72%	0.722	32%	0.315	S	S	*	.			trans	-104.2	-25.5	-176.2	-63	-177.5	-178.9	-176.9	0	114.3	Q92 G118	Q92-K120 WeakPolarHBondContact CB-O 3.31Å; G118-K120 PolarHBondContact O-N 2.94Å
121	T	95.7	Very high	95.1	Very high	68 Å²	68	52.2 Å²	52.2	42%	0.417	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.7	-171.5	58.3	0	0	0	0	111.3	V90 I91 R119	V90-T121 HydrophobicContact CG1-CG2 3.49Å; V90-T121 VanDerWaalsContact CG1-CG2 3.49Å; I91-T121 CarbonylContact O-C 3.51Å; I91-T121 VanDerWaalsContact O-CA 3.28Å; I91-T121 WeakPolarHBondContact O-CA 3.38Å; R119-T121 PolarHBondContact NE-O 2.93Å
122	A	95.5	Very high	95.2	Very high	3 Å²	3	48.4 Å²	48.4	3%	0.025	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	147.6	175.4	0	0	0	0	0	110.4	I91 V113 D126 I128 I151	I91-A122 HydrophobicContact CB-CB 4.2Å; I91-A122 HydrophobicContact CG2-CB 3.93Å; I91-A122 PolarHBondContact O-N 2.81Å; V113-A122 HydrophobicContact CB-CB 4.44Å; V113-A122 HydrophobicContact CG1-CB 3.69Å; V113-A122 HydrophobicContact CG2-CB 3.89Å; A122-D126 WeakPolarHBondContact CA-OD2 3.44Å; A122-D126 HydrophobicContact CB-CB 4Å; A122-I128 HydrophobicContact CB-CG2 3.78Å; A122-I151 HydrophobicContact CB-CG1 4.07Å
123	N	94.7	Very high	95.3	Very high	46 Å²	46	46 Å²	46	25%	0.246	29%	0.29	C	S	.	.			trans	-133.1	-177.1	169.5	-146.8	-31.5	0	0	0	109.5	G125 D126 I151 T154 G157	N123-G125 PolarHBondContact O-N 2.88Å; N123-D126 PolarHBondContact N-OD2 3.48Å; N123-D126 VanDerWaalsContact O-CB 3.26Å; N123-D126 WeakPolarHBondContact O-CB 3.4Å; N123-D126 PolarHBondContact O-N 3.39Å; N123-I151 WeakPolarHBondContact O-CB 3.28Å; N123-T154 WeakPolarHBondContact OD1-CG2 3.35Å; N123-T154 PolarHBondContact OD1-OG1 2.78Å; N123-G157 PolarHBondContact ND2-O 3Å; N123-G157 PolarHBondContact OD1-O 3.39Å
124	I	95.5	Very high	95.3	Very high	15 Å²	15	50.2 Å²	50.2	8%	0.077	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50	130.6	179.9	-57.4	173.4	0	0	0	110.7	D126 T154 A158 I166 F168 A192 E194 L195	I124-D126 VanDerWaalsContact C-N 3.33Å; I124-T154 HydrophobicContact CG1-CG2 3.71Å; I124-A158 HydrophobicContact CD1-CB 4.06Å; I124-A158 HydrophobicContact CG1-CB 4.46Å; I124-I166 HydrophobicContact CD1-CG2 3.97Å; I124-F168 HydrophobicContact CD1-CD2 4.18Å; I124-F168 HydrophobicContact CD1-CE2 3.79Å; I124-A192 HydrophobicContact CD1-CB 3.98Å; I124-A192 HydrophobicContact CG2-CB 3.73Å; I124-E194 HydrophobicContact CG2-CB 3.92Å; I124-L195 HydrophobicContact CG2-CD2 4.48Å
125	G	95.4	Very high	95.4	Very high	15 Å²	15	49 Å²	49	16%	0.155	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	-13.6	-178.5	0	0	0	0	0	114.9	N123 I151	N123-G125 PolarHBondContact O-N 2.88Å; G125-I151 PolarHBondContact N-O 3.49Å
126	D	96.1	Very high	95.6	Very high	26 Å²	26	48.3 Å²	48.3	14%	0.139	29%	0.289	C	S	.	.			trans	-77.3	148.4	176.4	-66.4	-39.7	0	0	0	112.1	R119 A122 N123 I124 V150 I151	R119-D126 VanDerWaalsContact CZ-CG 3.45Å; R119-D126 IonicContact CZ-OD1 3.72Å; R119-D126 IonicContact CZ-OD2 3.06Å; R119-D126 IonicContact NH1-OD1 2.63Å; R119-D126 PolarHBondContact NH1-OD1 3.36Å; R119-D126 IonicContact NH2-OD1 3.03Å; R119-D126 PolarHBondContact NH2-OD1 3.24Å; R119-D126 IonicContact NH2-OD2 2.66Å; R119-D126 PolarHBondContact NH2-OD2 2.76Å; A122-D126 WeakPolarHBondContact CA-OD2 3.44Å; A122-D126 HydrophobicContact CB-CB 4Å; N123-D126 PolarHBondContact N-OD2 3.48Å; N123-D126 VanDerWaalsContact O-CB 3.26Å; N123-D126 WeakPolarHBondContact O-CB 3.4Å; N123-D126 PolarHBondContact O-N 3.39Å; I124-D126 VanDerWaalsContact C-N 3.33Å; D126-V150 WeakPolarHBondContact O-CA 3.19Å; D126-I151 PolarHBondContact O-N 2.94Å
127	V	97.1	Very high	95.8	Very high	28 Å²	28	52.2 Å²	52.2	17%	0.17	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	136.1	174.7	-174.3	0	0	0	0	109.8	L114 K148 A149 I176 F200	L114-V127 HydrophobicContact CB-CB 4.41Å; L114-V127 VanDerWaalsContact CB-O 3.27Å; L114-V127 WeakPolarHBondContact CB-O 3.3Å; L114-V127 HydrophobicContact CD1-CB 4.19Å; L114-V127 HydrophobicContact CD1-CG1 3.72Å; L114-V127 PolarHBondContact N-O 3.01Å; V127-K148 HydrophobicContact CG1-CB 4.33Å; V127-A149 CarbonylContact C-O 3.41Å; V127-A149 WeakPolarHBondContact CA-O 3.47Å; V127-I176 HydrophobicContact CB-CD1 4.49Å; V127-I176 HydrophobicContact CG1-CD1 3.74Å; V127-I176 HydrophobicContact CG2-CD1 3.87Å; V127-F200 HydrophobicContact CG2-CZ 3.75Å
128	I	98	Very high	95.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	152.4	174.2	61.6	165.5	0	0	0	110.4	L97 I108 T110 K112 V113 A122 A130 K148 A149 I151	L97-I128 HydrophobicContact CD1-CD1 4.32Å; L97-I128 HydrophobicContact CD2-CD1 4.3Å; I108-I128 HydrophobicContact CD1-CD1 3.96Å; T110-I128 HydrophobicContact CG2-CB 4.18Å; T110-I128 HydrophobicContact CG2-CD1 4.23Å; T110-I128 HydrophobicContact CG2-CG2 4.21Å; T110-I128 VanDerWaalsContact OG1-CD1 3.31Å; T110-I128 WeakPolarHBondContact OG1-CD1 3.27Å; K112-I128 CarbonylContact O-C 3.46Å; K112-I128 WeakPolarHBondContact O-CA 3.32Å; V113-I128 HydrophobicContact CG1-CG2 4.45Å; V113-I128 HydrophobicContact CG2-CG2 4.2Å; A122-I128 HydrophobicContact CB-CG2 3.78Å; I128-A130 HydrophobicContact CD1-CB 4.13Å; I128-K148 CarbonylContact O-C 3.57Å; I128-K148 WeakPolarHBondContact O-CA 3.33Å; I128-A149 HydrophobicContact CG1-CB 4.13Å; I128-A149 WeakPolarHBondContact CG1-O 3.17Å; I128-A149 PolarHBondContact N-O 3.3Å; I128-A149 PolarHBondContact O-N 3.37Å; I128-I151 HydrophobicContact CD1-CD1 3.74Å; I128-I151 HydrophobicContact CG1-CD1 3.99Å; I128-I151 HydrophobicContact CG2-CD1 4.12Å; I128-I151 HydrophobicContact CG2-CG1 4.36Å
129	V	98.2	Very high	96	Very high	33 Å²	33	47.8 Å²	47.8	20%	0.2	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	130.2	161.3	179.4	0	0	0	0	107	I111 K112 L114 V146 V147 K148	I111-V129 WeakPolarHBondContact CA-O 3.47Å; I111-V129 WeakPolarHBondContact CB-O 3.45Å; I111-V129 HydrophobicContact CD1-CG1 4.42Å; I111-V129 PolarHBondContact N-O 3.43Å; K112-V129 HydrophobicContact CB-CB 4.48Å; K112-V129 PolarHBondContact N-O 2.94Å; K112-V129 VanDerWaalsContact N-O 3.11Å; K112-V129 PolarHBondContact O-N 3.49Å; L114-V129 HydrophobicContact CD1-CG2 4.11Å; L114-V129 HydrophobicContact CD2-CG2 3.86Å; L114-V129 HydrophobicContact CG-CG2 4.13Å; V129-V146 HydrophobicContact CG1-CG1 3.64Å; V129-V147 WeakPolarHBondContact CA-O 3.39Å; V129-K148 HydrophobicContact CG2-CG 4.43Å
130	A	98.3	Very high	95.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	155.6	-173.1	0	0	0	0	0	111.5	I108 L109 I128 V146 V147	I108-A130 HydrophobicContact CB-CB 3.97Å; I108-A130 HydrophobicContact CD1-CB 3.79Å; I108-A130 HydrophobicContact CG1-CB 4.28Å; L109-A130 CarbonylContact O-C 3.53Å; L109-A130 WeakPolarHBondContact O-CA 3.28Å; L109-A130 VanDerWaalsContact O-CB 3.24Å; L109-A130 WeakPolarHBondContact O-CB 3.34Å; I128-A130 HydrophobicContact CD1-CB 4.13Å; A130-V146 CarbonylContact O-C 3.54Å; A130-V146 WeakPolarHBondContact O-CA 3.44Å; A130-V147 PolarHBondContact N-O 3.13Å; A130-V147 PolarHBondContact O-N 3.32Å
131	T	98.5	Very high	96	Very high	19 Å²	19	39.9 Å²	39.9	12%	0.117	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	138.3	171.2	174.3	0	0	0	0	110.1	I108 L109 I111 K133 G144 D145	I108-T131 CarbonylContact C-O 3.36Å; I108-T131 VanDerWaalsContact CA-O 3.31Å; I108-T131 WeakPolarHBondContact CA-O 3Å; L109-T131 HydrophobicContact CB-CG2 3.94Å; L109-T131 HydrophobicContact CD2-CG2 3.99Å; L109-T131 PolarHBondContact N-O 3.43Å; L109-T131 PolarHBondContact O-N 2.97Å; I111-T131 HydrophobicContact CD1-CG2 4.28Å; I111-T131 HydrophobicContact CG1-CG2 4.31Å; T131-K133 HydrophobicContact CG2-CD 4.14Å; T131-K133 PolarHBondContact O-N 3.32Å; T131-G144 PolarHBondContact OG1-O 3.14Å; T131-D145 CarbonylContact C-O 3.55Å; T131-D145 WeakPolarHBondContact CA-O 3.26Å
132	V	98.5	Very high	96	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	118.6	177.4	-178.5	0	0	0	0	110	A105 I108 Q134 A135 V141 K142 G144 D145 V147 I175	A105-V132 HydrophobicContact CB-CG1 3.76Å; A105-V132 HydrophobicContact CB-CG2 4.21Å; I108-V132 HydrophobicContact CG2-CG2 4.05Å; V132-Q134 WeakPolarHBondContact CG1-O 3.29Å; V132-A135 HydrophobicContact CG1-CB 3.99Å; V132-V141 HydrophobicContact CB-CG1 4.29Å; V132-V141 HydrophobicContact CG1-CG1 4.42Å; V132-V141 HydrophobicContact CG2-CG1 3.41Å; V132-V141 VanDerWaalsContact CG2-CG1 3.41Å; V132-K142 WeakPolarHBondContact CB-O 3.37Å; V132-G144 PolarHBondContact O-N 2.73Å; V132-D145 HydrophobicContact CG2-CB 4.35Å; V132-D145 PolarHBondContact N-O 2.85Å; V132-V147 HydrophobicContact CG2-CG1 4.11Å; V132-V147 HydrophobicContact CG2-CG2 3.94Å; V132-I175 HydrophobicContact CG2-CD1 4.49Å
133	K	98.4	Very high	96.1	Very high	69 Å²	69	51.2 Å²	51.2	30%	0.3	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-31.8	-176.7	-66.2	-61	-164	-165.4	0	112.7	R96 E107 L109 T131 K143	R96-K133 VanDerWaalsContact NH1-CG 3.28Å; E107-K133 PolarHBondContact O-N 2.89Å; L109-K133 HydrophobicContact CB-CD 4.3Å; L109-K133 HydrophobicContact CB-CG 3.71Å; T131-K133 HydrophobicContact CG2-CD 4.14Å; T131-K133 PolarHBondContact O-N 3.32Å; K133-K143 VanDerWaalsContact O-CE 3.28Å; K133-K143 WeakPolarHBondContact O-CE 3.42Å
134	Q	98.1	Very high	96.2	Very high	95 Å²	95	51.1 Å²	51.1	44%	0.444	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	135.1	174.6	-57.9	-176.3	39.2	0	0	109.2	R106 E107 V132	R106-Q134 HydrophobicContact CB-CB 4.1Å; R106-Q134 PolarHBondContact N-O 3.01Å; E107-Q134 HydrophobicContact CB-CB 4.01Å; E107-Q134 HydrophobicContact CB-CG 4.12Å; E107-Q134 PolarHBondContact N-O 2.81Å; E107-Q134 PolarHBondContact O-N 3.33Å; E107-Q134 PolarHBondContact OE2-NE2 3.29Å; E107-Q134 VanDerWaalsContact OE2-NE2 3.13Å; V132-Q134 WeakPolarHBondContact CG1-O 3.29Å
135	A	97.3	Very high	96.3	Very high	30 Å²	30	53.1 Å²	53.1	25%	0.248	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	148.5	178.1	0	0	0	0	0	110.2	G104 V132 K143	G104-A135 CarbonylContact O-C 3.57Å; G104-A135 VanDerWaalsContact O-CA 3.29Å; G104-A135 WeakPolarHBondContact O-CA 3.36Å; V132-A135 HydrophobicContact CG1-CB 3.99Å; A135-K143 HydrophobicContact CB-CB 4.45Å
136	T	96	Very high	96.4	Very high	54 Å²	54	57.1 Å²	57.1	33%	0.331	34%	0.344	S	S	.	.			trans	-73.5	136.2	171.1	-54.9	0	0	0	0	109.3	G104 R106 G139	G104-T136 PolarHBondContact O-N 3.15Å; R106-T136 PolarHBondContact NE-OG1 3.25Å; R106-T136 PolarHBondContact NH2-OG1 3.37Å; T136-G139 PolarHBondContact O-N 2.66Å
137	P	94.7	Very high	96.5	Very high	126 Å²	126	56.2 Å²	56.2	82%	0.818	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	139.3	173.9	-24.8	34.5	0	0	0	112	G139	P137-G139 VanDerWaalsContact C-N 3.27Å; P137-G139 PolarHBondContact O-N 2.88Å
138	G	91	Very high	96.6	Very high	91 Å²	91	58.7 Å²	58.7	94%	0.938	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	2.1	-179	0	0	0	0	0	115.7
139	G	90.9	Very high	96.6	Very high	21 Å²	21	58.7 Å²	58.7	22%	0.216	35%	0.348	C	S	.	.			trans	-64.8	158.4	173.7	0	0	0	0	0	113.9	T136 P137 V141	T136-G139 PolarHBondContact O-N 2.66Å; P137-G139 VanDerWaalsContact C-N 3.27Å; P137-G139 PolarHBondContact O-N 2.88Å; G139-V141 PolarHBondContact O-N 3Å
140	V	92.2	Very high	96.6	Very high	98 Å²	98	57.1 Å²	57.1	59%	0.594	34%	0.339	S	S	*	.	S	Bend	trans	-64.4	-25.1	175.1	-176.5	0	0	0	0	111.6	S103 R183	S103-V140 PolarHBondContact O-N 3.18Å; V140-R183 HydrophobicContact CG1-CG 4.41Å; V140-R183 PolarHBondContact O-NH2 2.96Å
141	V	95.2	Very high	96.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	34%	0.339	C	S	.	.	S	Bend	trans	-114.7	134	175.9	-174.9	0	0	0	0	109.2	S103 A105 V132 G139 D145 V147 I175	S103-V141 PolarHBondContact O-N 2.94Å; A105-V141 HydrophobicContact CB-CB 4.46Å; A105-V141 HydrophobicContact CB-CG1 4.4Å; V132-V141 HydrophobicContact CB-CG1 4.29Å; V132-V141 HydrophobicContact CG1-CG1 4.42Å; V132-V141 HydrophobicContact CG2-CG1 3.41Å; V132-V141 VanDerWaalsContact CG2-CG1 3.41Å; G139-V141 PolarHBondContact O-N 3Å; V141-D145 HydrophobicContact CG1-CB 3.98Å; V141-V147 HydrophobicContact CG1-CG1 3.95Å; V141-I175 HydrophobicContact CG1-CD1 4.34Å; V141-I175 HydrophobicContact CG2-CD1 4.12Å
142	K	96.2	Very high	96.5	Very high	149 Å²	149	56.2 Å²	56.2	65%	0.648	33%	0.333	S	S	*	.			trans	-102.4	159.6	-179.5	-62	-179.9	-176.2	177.8	0	111.2	V132 G144 D145	V132-K142 WeakPolarHBondContact CB-O 3.37Å; K142-G144 PolarHBondContact O-N 2.7Å; K142-D145 PolarHBondContact N-OD2 2.86Å; K142-D145 WeakPolarHBondContact O-CB 3.27Å; K142-D145 VanDerWaalsContact O-CG 3.32Å; K142-D145 PolarHBondContact O-N 2.98Å
143	K	97.5	Very high	96.3	Very high	159 Å²	159	57.1 Å²	57.1	69%	0.691	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	133.6	171.9	-178.9	-179.6	177.4	-176.6	0	109.5	K133 A135	K133-K143 VanDerWaalsContact O-CE 3.28Å; K133-K143 WeakPolarHBondContact O-CE 3.42Å; A135-K143 HydrophobicContact CB-CB 4.45Å
144	G	96.8	Very high	96.2	Very high	45 Å²	45	53.9 Å²	53.9	46%	0.464	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.4	-22.3	-177.4	0	0	0	0	0	113.8	T131 V132 K142 V146	T131-G144 PolarHBondContact OG1-O 3.14Å; V132-G144 PolarHBondContact O-N 2.73Å; K142-G144 PolarHBondContact O-N 2.7Å; G144-V146 PolarHBondContact O-N 2.84Å
145	D	97.7	Very high	95.9	Very high	56 Å²	56	53.2 Å²	53.2	30%	0.299	32%	0.318	S	S	.	.			trans	-57.2	139.5	-179.9	-70.8	-3.9	0	0	0	111.4	T131 V132 V141 K142 V147	T131-D145 CarbonylContact C-O 3.55Å; T131-D145 WeakPolarHBondContact CA-O 3.26Å; V132-D145 HydrophobicContact CG2-CB 4.35Å; V132-D145 PolarHBondContact N-O 2.85Å; V141-D145 HydrophobicContact CG1-CB 3.98Å; K142-D145 PolarHBondContact N-OD2 2.86Å; K142-D145 WeakPolarHBondContact O-CB 3.27Å; K142-D145 VanDerWaalsContact O-CG 3.32Å; K142-D145 PolarHBondContact O-N 2.98Å; D145-V147 HydrophobicContact CB-CG1 4.27Å
146	V	98.1	Very high	95.5	Very high	99 Å²	99	52.8 Å²	52.8	60%	0.6	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.9	169.9	-179.5	0	0	0	0	108.3	I111 V129 A130 G144	I111-V146 HydrophobicContact CD1-CG1 4.15Å; I111-V146 HydrophobicContact CD1-CG2 4.33Å; V129-V146 HydrophobicContact CG1-CG1 3.64Å; A130-V146 CarbonylContact O-C 3.54Å; A130-V146 WeakPolarHBondContact O-CA 3.44Å; G144-V146 PolarHBondContact O-N 2.84Å
147	V	98	Very high	95.2	Very high	7 Å²	7	50.5 Å²	50.5	4%	0.042	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	155.6	-172.7	-63.2	0	0	0	0	111.2	I108 V129 A130 V132 V141 D145 I175	I108-V147 HydrophobicContact CG2-CG2 4.45Å; V129-V147 WeakPolarHBondContact CA-O 3.39Å; A130-V147 PolarHBondContact N-O 3.13Å; A130-V147 PolarHBondContact O-N 3.32Å; V132-V147 HydrophobicContact CG2-CG1 4.11Å; V132-V147 HydrophobicContact CG2-CG2 3.94Å; V141-V147 HydrophobicContact CG1-CG1 3.95Å; D145-V147 HydrophobicContact CB-CG1 4.27Å; V147-I175 HydrophobicContact CB-CG2 3.98Å; V147-I175 HydrophobicContact CG1-CG2 4.25Å; V147-I175 HydrophobicContact CG2-CD1 4.01Å; V147-I175 HydrophobicContact CG2-CG1 4.2Å; V147-I175 HydrophobicContact CG2-CG2 4.37Å
148	K	98.2	Very high	94.9	Very high	81 Å²	81	45.1 Å²	45.1	35%	0.352	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	139.6	163.5	-70.1	178.1	-177.6	168.6	0	108.8	V127 I128 V129 I176 D178	V127-K148 HydrophobicContact CG1-CB 4.33Å; I128-K148 CarbonylContact O-C 3.57Å; I128-K148 WeakPolarHBondContact O-CA 3.33Å; V129-K148 HydrophobicContact CG2-CG 4.43Å; K148-I176 HydrophobicContact CB-CD1 4.47Å; K148-I176 HydrophobicContact CB-CG1 3.86Å; K148-I176 PolarHBondContact O-N 2.71Å; K148-D178 WeakPolarHBondContact CE-OD1 3.47Å; K148-D178 IonicContact NZ-OD1 2.68Å; K148-D178 PolarHBondContact NZ-OD1 2.82Å
149	A	98.3	Very high	94.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	144.2	176.3	0	0	0	0	0	110.6	I108 V127 I128 A173 V174	I108-A149 HydrophobicContact CD1-CB 3.87Å; V127-A149 CarbonylContact C-O 3.41Å; V127-A149 WeakPolarHBondContact CA-O 3.47Å; I128-A149 HydrophobicContact CG1-CB 4.13Å; I128-A149 WeakPolarHBondContact CG1-O 3.17Å; I128-A149 PolarHBondContact N-O 3.3Å; I128-A149 PolarHBondContact O-N 3.37Å; A149-A173 HydrophobicContact CB-CB 4Å; A149-V174 CarbonylContact C-O 3.58Å; A149-V174 WeakPolarHBondContact CA-O 2.93Å; A149-V174 WeakPolarHBondContact CB-O 3.39Å
150	V	98.1	Very high	94.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	136.8	170.6	63.4	0	0	0	0	109.8	D126 V152 A173 V174 I176 L195 F200 I203	D126-V150 WeakPolarHBondContact O-CA 3.19Å; V150-V152 HydrophobicContact CG1-CG1 4.19Å; V150-V152 PolarHBondContact O-N 3.31Å; V150-A173 CarbonylContact O-C 3.55Å; V150-A173 WeakPolarHBondContact O-CA 2.98Å; V150-A173 WeakPolarHBondContact O-CB 3.48Å; V150-V174 HydrophobicContact CG1-CB 4.13Å; V150-V174 PolarHBondContact N-O 2.98Å; V150-V174 PolarHBondContact O-N 2.9Å; V150-I176 HydrophobicContact CB-CD1 4.44Å; V150-I176 HydrophobicContact CB-CG2 4.31Å; V150-I176 HydrophobicContact CG1-CG2 3.78Å; V150-L195 HydrophobicContact CG2-CD2 3.94Å; V150-F200 HydrophobicContact CB-CD1 4.34Å; V150-F200 HydrophobicContact CB-CE1 3.86Å; V150-F200 HydrophobicContact CB-CE2 4.3Å; V150-F200 HydrophobicContact CB-CZ 3.84Å; V150-F200 HydrophobicContact CG1-CD1 4.11Å; V150-F200 HydrophobicContact CG1-CE1 4.07Å; V150-F200 HydrophobicContact CG1-CZ 4.48Å; V150-F200 HydrophobicContact CG2-CD1 4.34Å; V150-F200 HydrophobicContact CG2-CD2 3.9Å; V150-F200 HydrophobicContact CG2-CE1 3.96Å; V150-F200 HydrophobicContact CG2-CE2 3.49Å; V150-F200 VanDerWaalsContact CG2-CE2 3.49Å; V150-F200 HydrophobicContact CG2-CG 4.31Å; V150-F200 HydrophobicContact CG2-CZ 3.53Å; V150-I203 HydrophobicContact CG1-CD1 3.47Å; V150-I203 VanDerWaalsContact CG1-CD1 3.47Å
151	I	97.8	Very high	94.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	123.5	175	-53.6	-48.1	0	0	0	109.6	I91 L97 A122 N123 G125 D126 I128 T154 A173	I91-I151 HydrophobicContact CD1-CD1 4.07Å; I91-I151 HydrophobicContact CD1-CG1 4.2Å; I91-I151 HydrophobicContact CD1-CG2 3.61Å; I91-I151 HydrophobicContact CG2-CD1 4.35Å; L97-I151 HydrophobicContact CD2-CD1 3.31Å; A122-I151 HydrophobicContact CB-CG1 4.07Å; N123-I151 WeakPolarHBondContact O-CB 3.28Å; G125-I151 PolarHBondContact N-O 3.49Å; D126-I151 PolarHBondContact O-N 2.94Å; I128-I151 HydrophobicContact CD1-CD1 3.74Å; I128-I151 HydrophobicContact CG1-CD1 3.99Å; I128-I151 HydrophobicContact CG2-CD1 4.12Å; I128-I151 HydrophobicContact CG2-CG1 4.36Å; I151-T154 HydrophobicContact CG2-CG2 3.34Å; I151-A173 HydrophobicContact CD1-CB 4.03Å
152	V	96.9	Very high	93.9	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-25.4	-179.3	-60.6	0	0	0	0	113.3	A100 V150 A172 V174 V191 L195 I203	A100-V152 HydrophobicContact CB-CG2 3.89Å; V150-V152 HydrophobicContact CG1-CG1 4.19Å; V150-V152 PolarHBondContact O-N 3.31Å; V152-A172 HydrophobicContact CG2-CB 4.23Å; V152-A172 WeakPolarHBondContact CG2-O 3.45Å; V152-A172 PolarHBondContact N-O 3.02Å; V152-V174 HydrophobicContact CB-CG2 4.47Å; V152-V174 HydrophobicContact CG1-CB 4.06Å; V152-V174 HydrophobicContact CG1-CG2 3.57Å; V152-V174 HydrophobicContact CG2-CG2 4.09Å; V152-V191 HydrophobicContact CB-CG1 4.18Å; V152-L195 HydrophobicContact CB-CD1 4.12Å; V152-L195 HydrophobicContact CG1-CD1 3.71Å; V152-L195 HydrophobicContact CG1-CD2 4.23Å; V152-I203 HydrophobicContact CG1-CG2 4.33Å
153	R	95.9	Very high	93.1	Very high	20 Å²	20	54.4 Å²	54.4	8%	0.075	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	140.6	178.2	-65	-167.6	-73.5	-104	7.3	110.5	F168 E170 N171 A172 F188 P190	R153-F168 HydrophobicContact CB-CB 3.84Å; R153-F168 HydrophobicContact CB-CD1 4.15Å; R153-F168 HydrophobicContact CB-CD2 3.89Å; R153-F168 HydrophobicContact CB-CE2 4.47Å; R153-F168 HydrophobicContact CB-CG 3.7Å; R153-F168 HydrophobicContact CG-CB 4.22Å; R153-F168 HydrophobicContact CG-CD1 3.58Å; R153-F168 HydrophobicContact CG-CD2 4.02Å; R153-F168 HydrophobicContact CG-CE1 3.81Å; R153-F168 HydrophobicContact CG-CE2 4.24Å; R153-F168 HydrophobicContact CG-CG 3.68Å; R153-F168 HydrophobicContact CG-CZ 4.13Å; R153-E170 CarbonylContact C-O 3.48Å; R153-E170 WeakPolarHBondContact CB-O 3.32Å; R153-E170 IonicContact CZ-OE1 2.73Å; R153-E170 IonicContact NE-OE1 3.86Å; R153-E170 IonicContact NH2-OE1 3.82Å; R153-E170 PolarHBondContact NH2-OE1 3.29Å; R153-N171 WeakPolarHBondContact O-CA 3.16Å; R153-A172 HydrophobicContact CB-CB 4.04Å; R153-A172 HydrophobicContact CG-CB 4.49Å; R153-A172 PolarHBondContact N-O 2.93Å; R153-A172 VanDerWaalsContact N-O 3.15Å; R153-A172 PolarHBondContact O-N 3Å; R153-F188 PolarHBondContact NH1-O 2.85Å; R153-P190 WeakPolarHBondContact CD-O 3.36Å; R153-P190 PolarHBondContact NH1-O 3.13Å; R153-P190 VanDerWaalsContact NH1-O 3.13Å
154	T	95.2	Very high	92.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.267	C	S	.	.			trans	-137.5	142.6	176.1	64.8	0	0	0	0	112.5	I91 N123 I124 I151 G157 F168 N171	I91-T154 HydrophobicContact CD1-CG2 3.59Å; N123-T154 WeakPolarHBondContact OD1-CG2 3.35Å; N123-T154 PolarHBondContact OD1-OG1 2.78Å; I124-T154 HydrophobicContact CG1-CG2 3.71Å; I151-T154 HydrophobicContact CG2-CG2 3.34Å; T154-G157 WeakPolarHBondContact OG1-CA 3.44Å; T154-G157 PolarHBondContact OG1-N 2.84Å; T154-F168 PolarHBondContact O-N 3.27Å; T154-N171 VanDerWaalsContact CA-OD1 3.29Å; T154-N171 WeakPolarHBondContact CA-OD1 3.38Å
155	K	92.5	Very high	92.1	Very high	82 Å²	82	53.2 Å²	53.2	36%	0.357	27%	0.272	S	S	.	.	S	Bend	trans	-76.8	-34.8	173.1	-172	175.8	179	-175.5	0	112.5	G157 F168 N171	K155-G157 PolarHBondContact O-N 3.27Å; K155-F168 WeakPolarHBondContact CA-O 3.19Å; K155-N171 PolarHBondContact N-OD1 3.39Å
156	S	89	Confident	91.7	Very high	20 Å²	20	51.6 Å²	51.6	14%	0.14	26%	0.263	C	S	.	.	S	Bend	trans	-62.9	-30.3	174.6	62	0	0	0	0	112.5
157	G	88.2	Confident	91.3	Very high	7 Å²	7	51.7 Å²	51.7	7%	0.072	26%	0.255	C	S	.	.			trans	78.8	162.8	-176.4	0	0	0	0	0	114.5	N123 T154 K155 I166	N123-G157 PolarHBondContact ND2-O 3Å; N123-G157 PolarHBondContact OD1-O 3.39Å; T154-G157 WeakPolarHBondContact OG1-CA 3.44Å; T154-G157 PolarHBondContact OG1-N 2.84Å; K155-G157 PolarHBondContact O-N 3.27Å; G157-I166 CarbonylContact C-O 3.59Å; G157-I166 WeakPolarHBondContact CA-O 3.5Å
158	A	88.6	Confident	91.1	Very high	12 Å²	12	52.4 Å²	52.4	10%	0.099	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	138.6	174.3	0	0	0	0	0	110.2	I124 Y165 I166	I124-A158 HydrophobicContact CD1-CB 4.06Å; I124-A158 HydrophobicContact CG1-CB 4.46Å; A158-Y165 WeakPolarHBondContact O-CA 3.33Å; A158-I166 HydrophobicContact CB-CG2 3.89Å; A158-I166 PolarHBondContact N-O 3.15Å; A158-I166 PolarHBondContact O-N 2.68Å
159	R	86.5	Confident	90.8	Very high	181 Å²	181	56.2 Å²	56.2	68%	0.683	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	132.5	177.3	-174.9	-179.3	173.5	-178	-3.1	109.5	Y165	R159-Y165 HydrophobicContact CB-CD1 3.96Å; R159-Y165 HydrophobicContact CB-CE1 3.62Å; R159-Y165 HydrophobicContact CG-CD1 4.41Å; R159-Y165 HydrophobicContact CG-CE1 3.9Å; R159-Y165 HydrophobicContact CG-CE2 4.4Å
160	R	90.1	Very high	90.5	Very high	69 Å²	69	58.9 Å²	58.9	26%	0.26	29%	0.294	S	S	.	.			trans	-92.6	165.4	173.9	-61.6	-167.1	-169.7	119.4	-9.1	111.8	D162 G163 S164 E194	R160-D162 VanDerWaalsContact C-N 3.28Å; R160-D162 WeakPolarHBondContact CB-OD1 3.28Å; R160-D162 PolarHBondContact O-N 3.27Å; R160-G163 PolarHBondContact O-N 3.28Å; R160-S164 WeakPolarHBondContact CD-OG 3.23Å; R160-S164 PolarHBondContact N-O 2.9Å; R160-S164 PolarHBondContact NH1-OG 3.45Å; R160-S164 VanDerWaalsContact NH1-OG 3.15Å; R160-E194 IonicContact CZ-OE1 2.67Å; R160-E194 IonicContact NE-OE1 2.65Å; R160-E194 PolarHBondContact NE-OE1 2.67Å; R160-E194 IonicContact NH2-OE1 3.13Å
161	T	86.1	Confident	90.5	Very high	160 Å²	160	59.4 Å²	59.4	98%	0.982	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-32.9	-180	50	0	0	0	0	113.1	G163	T161-G163 PolarHBondContact O-N 2.73Å
162	D	86.4	Confident	90.5	Very high	114 Å²	114	59.4 Å²	59.4	61%	0.61	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-4.3	173.2	66.7	-1.3	0	0	0	113.7	R160 S164	R160-D162 VanDerWaalsContact C-N 3.28Å; R160-D162 WeakPolarHBondContact CB-OD1 3.28Å; R160-D162 PolarHBondContact O-N 3.27Å; D162-S164 VanDerWaalsContact C-N 3.33Å; D162-S164 VanDerWaalsContact OD1-CB 3.26Å; D162-S164 WeakPolarHBondContact OD1-CB 3.39Å; D162-S164 PolarHBondContact OD1-N 3.13Å; D162-S164 PolarHBondContact OD1-OG 3Å; D162-S164 PolarHBondContact OD2-OG 2.97Å
163	G	80	Confident	90.5	Very high	30 Å²	30	59.4 Å²	59.4	31%	0.309	30%	0.297	S	S	.	.	S	Bend	trans	86.8	-5.1	-177.9	0	0	0	0	0	114.9	R160 T161	R160-G163 PolarHBondContact O-N 3.28Å; T161-G163 PolarHBondContact O-N 2.73Å
164	S	85.3	Confident	90.7	Very high	38 Å²	38	58.4 Å²	58.4	27%	0.266	29%	0.293	S	S	.	.			trans	-67.8	155.3	172.1	71.3	0	0	0	0	111.2	R160 D162	R160-S164 WeakPolarHBondContact CD-OG 3.23Å; R160-S164 PolarHBondContact N-O 2.9Å; R160-S164 PolarHBondContact NH1-OG 3.45Å; R160-S164 VanDerWaalsContact NH1-OG 3.15Å; D162-S164 VanDerWaalsContact C-N 3.33Å; D162-S164 VanDerWaalsContact OD1-CB 3.26Å; D162-S164 WeakPolarHBondContact OD1-CB 3.39Å; D162-S164 PolarHBondContact OD1-N 3.13Å; D162-S164 PolarHBondContact OD1-OG 3Å; D162-S164 PolarHBondContact OD2-OG 2.97Å
165	Y	86.7	Confident	90.8	Very high	142 Å²	142	58.5 Å²	58.5	56%	0.557	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	137.9	174.1	-69.7	-96.7	0	0	0	109.7	A158 R159	A158-Y165 WeakPolarHBondContact O-CA 3.33Å; R159-Y165 HydrophobicContact CB-CD1 3.96Å; R159-Y165 HydrophobicContact CB-CE1 3.62Å; R159-Y165 HydrophobicContact CG-CD1 4.41Å; R159-Y165 HydrophobicContact CG-CE1 3.9Å; R159-Y165 HydrophobicContact CG-CE2 4.4Å
166	I	90.1	Very high	91.1	Very high	22 Å²	22	55 Å²	55	11%	0.113	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	122.9	166.7	-176.8	62.1	0	0	0	109	I124 G157 A158 F168	I124-I166 HydrophobicContact CD1-CG2 3.97Å; G157-I166 CarbonylContact C-O 3.59Å; G157-I166 WeakPolarHBondContact CA-O 3.5Å; A158-I166 HydrophobicContact CB-CG2 3.89Å; A158-I166 PolarHBondContact N-O 3.15Å; A158-I166 PolarHBondContact O-N 2.68Å; I166-F168 HydrophobicContact CD1-CE2 4.27Å; I166-F168 HydrophobicContact CD1-CZ 4.33Å; I166-F168 HydrophobicContact CG1-CD2 4.42Å; I166-F168 HydrophobicContact CG1-CE2 3.69Å; I166-F168 HydrophobicContact CG1-CZ 4.14Å
167	K	90.1	Very high	91.4	Very high	100 Å²	100	59.9 Å²	59.9	44%	0.435	29%	0.294	S	S	.	.			trans	-126.6	151.7	176.5	-74.4	-177.4	170.8	-167.5	0	109.7	E86	E86-K167 IonicContact OE2-NZ 3.6Å; E86-K167 PolarHBondContact OE2-NZ 3.45Å
168	F	92.8	Very high	91.7	Very high	22 Å²	22	65.7 Å²	65.7	10%	0.096	32%	0.324	C	S	.	.			trans	-127.6	161.6	172.8	-64.7	-93.9	0	0	0	109.5	I124 R153 T154 K155 I166 E170 P190 A192	I124-F168 HydrophobicContact CD1-CD2 4.18Å; I124-F168 HydrophobicContact CD1-CE2 3.79Å; R153-F168 HydrophobicContact CB-CB 3.84Å; R153-F168 HydrophobicContact CB-CD1 4.15Å; R153-F168 HydrophobicContact CB-CD2 3.89Å; R153-F168 HydrophobicContact CB-CE2 4.47Å; R153-F168 HydrophobicContact CB-CG 3.7Å; R153-F168 HydrophobicContact CG-CB 4.22Å; R153-F168 HydrophobicContact CG-CD1 3.58Å; R153-F168 HydrophobicContact CG-CD2 4.02Å; R153-F168 HydrophobicContact CG-CE1 3.81Å; R153-F168 HydrophobicContact CG-CE2 4.24Å; R153-F168 HydrophobicContact CG-CG 3.68Å; R153-F168 HydrophobicContact CG-CZ 4.13Å; T154-F168 PolarHBondContact O-N 3.27Å; K155-F168 WeakPolarHBondContact CA-O 3.19Å; I166-F168 HydrophobicContact CD1-CE2 4.27Å; I166-F168 HydrophobicContact CD1-CZ 4.33Å; I166-F168 HydrophobicContact CG1-CD2 4.42Å; I166-F168 HydrophobicContact CG1-CE2 3.69Å; I166-F168 HydrophobicContact CG1-CZ 4.14Å; F168-E170 PolarHBondContact O-N 2.8Å; F168-P190 HydrophobicContact CE1-CB 4.38Å; F168-P190 HydrophobicContact CE1-CG 4.26Å; F168-A192 HydrophobicContact CE2-CB 3.85Å; F168-A192 HydrophobicContact CZ-CB 3.84Å
169	D	91.4	Very high	92	Very high	162 Å²	162	70.5 Å²	70.5	87%	0.866	35%	0.348	S	S	*	.	S	Bend	trans	-70.7	-23	-177.8	-52.7	-34.5	0	0	0	112.6
170	E	93.8	Very high	92.4	Very high	55 Å²	55	66.4 Å²	66.4	26%	0.257	34%	0.335	S	S	.	.	S	Bend	trans	-138.5	154.6	-175.7	62.9	175.2	-152.7	0	0	113.7	K98 R153 F168	K98-E170 VanDerWaalsContact CD-OE2 3.27Å; K98-E170 WeakPolarHBondContact CD-OE2 3.39Å; K98-E170 WeakPolarHBondContact CE-OE2 3.23Å; K98-E170 IonicContact NZ-OE2 3.79Å; K98-E170 PolarHBondContact NZ-OE2 2.95Å; R153-E170 CarbonylContact C-O 3.48Å; R153-E170 WeakPolarHBondContact CB-O 3.32Å; R153-E170 IonicContact CZ-OE1 2.73Å; R153-E170 IonicContact NE-OE1 3.86Å; R153-E170 IonicContact NH2-OE1 3.82Å; R153-E170 PolarHBondContact NH2-OE1 3.29Å; F168-E170 PolarHBondContact O-N 2.8Å
171	N	96.8	Very high	92.6	Very high	11 Å²	11	63.8 Å²	63.8	6%	0.059	33%	0.327	C	S	.	.			trans	-82.4	117.6	168.4	-68.2	-32.5	0	0	0	109.4	Q89 I91 L97 K98 R153 T154 K155	Q89-N171 PolarHBondContact O-ND2 2.74Å; Q89-N171 PolarHBondContact OE1-ND2 2.78Å; Q89-N171 VanDerWaalsContact OE1-ND2 3.14Å; I91-N171 HydrophobicContact CD1-CB 4.2Å; I91-N171 HydrophobicContact CG1-CB 4.29Å; L97-N171 HydrophobicContact CG-CB 4.19Å; K98-N171 PolarHBondContact N-O 2.94Å; K98-N171 VanDerWaalsContact N-O 3.13Å; R153-N171 WeakPolarHBondContact O-CA 3.16Å; T154-N171 VanDerWaalsContact CA-OD1 3.29Å; T154-N171 WeakPolarHBondContact CA-OD1 3.38Å; K155-N171 PolarHBondContact N-OD1 3.39Å
172	A	97.7	Very high	93.2	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	148.1	-179.8	0	0	0	0	0	112.5	K98 A100 V152 R153	K98-A172 CarbonylContact O-C 3.53Å; K98-A172 VanDerWaalsContact O-CA 3.23Å; K98-A172 WeakPolarHBondContact O-CA 3.04Å; A100-A172 HydrophobicContact CB-CB 4.1Å; V152-A172 HydrophobicContact CG2-CB 4.23Å; V152-A172 WeakPolarHBondContact CG2-O 3.45Å; V152-A172 PolarHBondContact N-O 3.02Å; R153-A172 HydrophobicContact CB-CB 4.04Å; R153-A172 HydrophobicContact CG-CB 4.49Å; R153-A172 PolarHBondContact N-O 2.93Å; R153-A172 VanDerWaalsContact N-O 3.15Å; R153-A172 PolarHBondContact O-N 3Å
173	A	98.2	Very high	93.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	157.9	-179.4	0	0	0	0	0	111.8	L97 K98 I99 A100 I108 A149 V150 I151	L97-A173 HydrophobicContact CD2-CB 3.96Å; K98-A173 PolarHBondContact O-N 3.19Å; I99-A173 WeakPolarHBondContact CA-O 3.17Å; A100-A173 PolarHBondContact N-O 3.15Å; I108-A173 HydrophobicContact CD1-CB 3.93Å; A149-A173 HydrophobicContact CB-CB 4Å; V150-A173 CarbonylContact O-C 3.55Å; V150-A173 WeakPolarHBondContact O-CA 2.98Å; V150-A173 WeakPolarHBondContact O-CB 3.48Å; I151-A173 HydrophobicContact CD1-CB 4.03Å
174	V	98.4	Very high	94.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	131.6	174.6	170	0	0	0	0	108	A100 D101 A149 V150 V152 P182 I187 I203	A100-V174 HydrophobicContact CB-CG2 4.13Å; D101-V174 HydrophobicContact CB-CG1 4.23Å; A149-V174 CarbonylContact C-O 3.58Å; A149-V174 WeakPolarHBondContact CA-O 2.93Å; A149-V174 WeakPolarHBondContact CB-O 3.39Å; V150-V174 HydrophobicContact CG1-CB 4.13Å; V150-V174 PolarHBondContact N-O 2.98Å; V150-V174 PolarHBondContact O-N 2.9Å; V152-V174 HydrophobicContact CB-CG2 4.47Å; V152-V174 HydrophobicContact CG1-CB 4.06Å; V152-V174 HydrophobicContact CG1-CG2 3.57Å; V152-V174 HydrophobicContact CG2-CG2 4.09Å; V174-P182 HydrophobicContact CG1-CB 3.99Å; V174-I187 HydrophobicContact CB-CD1 4.38Å; V174-I187 HydrophobicContact CG1-CD1 3.6Å; V174-I187 HydrophobicContact CG2-CD1 3.8Å; V174-I187 HydrophobicContact CG2-CG2 4.28Å; V174-I203 HydrophobicContact CB-CD1 4.17Å; V174-I203 HydrophobicContact CG1-CD1 3.75Å; V174-I203 HydrophobicContact CG1-CG1 4.21Å; V174-I203 HydrophobicContact CG2-CG2 4.32Å
175	I	98.2	Very high	94.7	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	131	178.9	-63.3	-178.5	0	0	0	108.6	I99 D101 A105 V132 V141 V147 P182 R183	I99-I175 HydrophobicContact CD1-CD1 4.13Å; I99-I175 HydrophobicContact CD1-CG1 3.81Å; I99-I175 HydrophobicContact CG1-CD1 4.4Å; D101-I175 PolarHBondContact OD2-N 2.91Å; A105-I175 HydrophobicContact CB-CD1 3.57Å; V132-I175 HydrophobicContact CG2-CD1 4.49Å; V141-I175 HydrophobicContact CG1-CD1 4.34Å; V141-I175 HydrophobicContact CG2-CD1 4.12Å; V147-I175 HydrophobicContact CB-CG2 3.98Å; V147-I175 HydrophobicContact CG1-CG2 4.25Å; V147-I175 HydrophobicContact CG2-CD1 4.01Å; V147-I175 HydrophobicContact CG2-CG1 4.2Å; V147-I175 HydrophobicContact CG2-CG2 4.37Å; I175-P182 WeakPolarHBondContact O-CA 3.37Å; I175-R183 HydrophobicContact CB-CB 4.31Å; I175-R183 HydrophobicContact CG2-CB 3.83Å; I175-R183 HydrophobicContact CG2-CG 4.45Å; I175-R183 PolarHBondContact O-N 3.41Å
176	I	97.8	Very high	95.1	Very high	10 Å²	10	58 Å²	58	5%	0.051	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	154.9	-177.5	63.3	172.6	0	0	0	111.4	V127 K148 V150 S181 F200 I203	V127-I176 HydrophobicContact CB-CD1 4.49Å; V127-I176 HydrophobicContact CG1-CD1 3.74Å; V127-I176 HydrophobicContact CG2-CD1 3.87Å; K148-I176 HydrophobicContact CB-CD1 4.47Å; K148-I176 HydrophobicContact CB-CG1 3.86Å; K148-I176 PolarHBondContact O-N 2.71Å; V150-I176 HydrophobicContact CB-CD1 4.44Å; V150-I176 HydrophobicContact CB-CG2 4.31Å; V150-I176 HydrophobicContact CG1-CG2 3.78Å; I176-S181 CarbonylContact C-O 3.52Å; I176-S181 VanDerWaalsContact CA-O 3.28Å; I176-S181 WeakPolarHBondContact CA-O 3.28Å; I176-F200 HydrophobicContact CD1-CE1 3.94Å; I176-F200 HydrophobicContact CD1-CZ 4.43Å; I176-F200 HydrophobicContact CG2-CE1 4.34Å; I176-I203 HydrophobicContact CG2-CD1 3.94Å
177	R	96.4	Very high	95.4	Very high	121 Å²	121	57 Å²	57	46%	0.457	27%	0.272	S	S	.	.			trans	-84.4	178.1	165.8	-62.9	-175.2	-171.8	86.2	6.2	110.3	D179 K180 S181 P182	R177-D179 VanDerWaalsContact CB-OD1 3.25Å; R177-D179 WeakPolarHBondContact CB-OD1 2.94Å; R177-D179 PolarHBondContact O-N 2.98Å; R177-K180 PolarHBondContact O-N 2.83Å; R177-K180 VanDerWaalsContact O-N 3.12Å; R177-S181 PolarHBondContact N-O 3.06Å; R177-S181 PolarHBondContact NH1-OG 2.77Å; R177-P182 PolarHBondContact NH1-O 2.88Å
178	D	94.5	Very high	95.7	Very high	130 Å²	130	56.5 Å²	56.5	70%	0.695	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-26.5	178.8	-67.3	-40.8	0	0	0	113.6	K148 K180	K148-D178 WeakPolarHBondContact CE-OD1 3.47Å; K148-D178 IonicContact NZ-OD1 2.68Å; K148-D178 PolarHBondContact NZ-OD1 2.82Å; D178-K180 PolarHBondContact O-N 2.9Å
179	D	94.9	Very high	95.7	Very high	113 Å²	113	56.8 Å²	56.8	60%	0.604	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	7.7	174.3	71.7	-13	0	0	0	113.7	R177 S181	R177-D179 VanDerWaalsContact CB-OD1 3.25Å; R177-D179 WeakPolarHBondContact CB-OD1 2.94Å; R177-D179 PolarHBondContact O-N 2.98Å; D179-S181 VanDerWaalsContact CG-OG 3.25Å; D179-S181 PolarHBondContact O-N 3.4Å; D179-S181 WeakPolarHBondContact OD1-CB 3.3Å; D179-S181 PolarHBondContact OD1-N 2.85Å; D179-S181 PolarHBondContact OD1-OG 3.49Å; D179-S181 WeakPolarHBondContact OD2-CB 3.46Å; D179-S181 PolarHBondContact OD2-OG 3.11Å; D179-S181 VanDerWaalsContact OD2-OG 3.08Å
180	K	94.1	Very high	95.8	Very high	94 Å²	94	51.4 Å²	51.4	41%	0.409	25%	0.253	S	S	.	.	S	Bend	trans	64.4	6.6	-173.7	-55.8	179.8	175.9	-174.9	0	115.5	R177 D178 F200	R177-K180 PolarHBondContact O-N 2.83Å; R177-K180 VanDerWaalsContact O-N 3.12Å; D178-K180 PolarHBondContact O-N 2.9Å; K180-F200 HydrophobicContact CB-CD1 4.16Å; K180-F200 HydrophobicContact CB-CE1 3.78Å; K180-F200 HydrophobicContact CD-CE1 4.25Å; K180-F200 HydrophobicContact CD-CZ 4.31Å; K180-F200 HydrophobicContact CG-CE1 4.13Å
181	S	96	Very high	95.8	Very high	14 Å²	14	49.8 Å²	49.8	10%	0.098	25%	0.247	C	C	.	.			trans	-72.5	145.8	171.8	73.3	0	0	0	0	110.8	I176 R177 D179	I176-S181 CarbonylContact C-O 3.52Å; I176-S181 VanDerWaalsContact CA-O 3.28Å; I176-S181 WeakPolarHBondContact CA-O 3.28Å; R177-S181 PolarHBondContact N-O 3.06Å; R177-S181 PolarHBondContact NH1-OG 2.77Å; D179-S181 VanDerWaalsContact CG-OG 3.25Å; D179-S181 PolarHBondContact O-N 3.4Å; D179-S181 WeakPolarHBondContact OD1-CB 3.3Å; D179-S181 PolarHBondContact OD1-N 2.85Å; D179-S181 PolarHBondContact OD1-OG 3.49Å; D179-S181 WeakPolarHBondContact OD2-CB 3.46Å; D179-S181 PolarHBondContact OD2-OG 3.11Å; D179-S181 VanDerWaalsContact OD2-OG 3.08Å
182	P	97.2	Very high	95.6	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.013	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-65.3	140.6	174.2	26.3	-31.5	0	0	0	110.4	V174 I175 R177 I187 K202 I203 L206	V174-P182 HydrophobicContact CG1-CB 3.99Å; I175-P182 WeakPolarHBondContact O-CA 3.37Å; R177-P182 PolarHBondContact NH1-O 2.88Å; P182-I187 HydrophobicContact CB-CD1 4.35Å; P182-K202 HydrophobicContact CG-CD 4.33Å; P182-K202 HydrophobicContact CG-CG 4.02Å; P182-I203 HydrophobicContact CB-CD1 4.48Å; P182-I203 HydrophobicContact CB-CG1 3.98Å; P182-I203 HydrophobicContact CG-CG1 4.02Å; P182-L206 HydrophobicContact CG-CD1 3.9Å
183	R	95.7	Very high	95.2	Very high	76 Å²	76	56.7 Å²	56.7	29%	0.287	27%	0.273	S	S	.	.	S	Bend	trans	-75.3	-36.9	174.3	-169.5	167.2	176.9	174.2	-8.8	111.1	V140 I175	V140-R183 HydrophobicContact CG1-CG 4.41Å; V140-R183 PolarHBondContact O-NH2 2.96Å; I175-R183 HydrophobicContact CB-CB 4.31Å; I175-R183 HydrophobicContact CG2-CB 3.83Å; I175-R183 HydrophobicContact CG2-CG 4.45Å; I175-R183 PolarHBondContact O-N 3.41Å
184	G	94.3	Very high	94.9	Very high	6 Å²	6	57.8 Å²	57.8	6%	0.062	28%	0.278	C	S	.	.	S	Bend	trans	-73.4	162.6	168.4	0	0	0	0	0	112.7	N102	N102-G184 WeakPolarHBondContact OD1-CA 3.4Å
185	T	94.6	Very high	94.7	Very high	108 Å²	108	57.8 Å²	57.8	66%	0.663	28%	0.278	S	S	*	.	S	Bend	trans	-97.4	-15.1	177.2	59.6	0	0	0	0	113.3	N102	N102-T185 PolarHBondContact ND2-OG1 3.39Å; N102-T185 PolarHBondContact OD1-N 2.8Å
186	R	95.2	Very high	94.4	Very high	170 Å²	170	63.9 Å²	63.9	64%	0.642	30%	0.301	S	S	*	.			trans	-137.5	138.1	-178	-174.4	176.4	-177.4	176.9	2.6	110.6	D101 N102 F188	D101-R186 VanDerWaalsContact CA-O 3.26Å; D101-R186 WeakPolarHBondContact CA-O 3.36Å; N102-R186 HydrophobicContact CB-CB 4.45Å; N102-R186 PolarHBondContact N-O 2.82Å; N102-R186 VanDerWaalsContact N-O 3.15Å; N102-R186 PolarHBondContact OD1-N 2.85Å; N102-R186 PolarHBondContact OD1-O 3.39Å; R186-F188 HydrophobicContact CG-CE1 4.33Å
187	I	96.1	Very high	93.9	Very high	3 Å²	3	70.8 Å²	70.8	2%	0.015	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-104	140.8	178.1	-55.3	-55.6	0	0	0	109.7	A100 D101 V174 P182 V191 I203 L206 A207	A100-I187 CarbonylContact O-C 3.45Å; A100-I187 WeakPolarHBondContact O-CA 3.41Å; A100-I187 WeakPolarHBondContact O-CG2 3.4Å; D101-I187 HydrophobicContact CB-CD1 3.88Å; V174-I187 HydrophobicContact CB-CD1 4.38Å; V174-I187 HydrophobicContact CG1-CD1 3.6Å; V174-I187 HydrophobicContact CG2-CD1 3.8Å; V174-I187 HydrophobicContact CG2-CG2 4.28Å; P182-I187 HydrophobicContact CB-CD1 4.35Å; I187-V191 HydrophobicContact CG2-CG1 3.85Å; I187-I203 HydrophobicContact CD1-CG2 4.27Å; I187-I203 HydrophobicContact CG1-CG2 4.13Å; I187-I203 HydrophobicContact CG2-CG2 4.44Å; I187-L206 HydrophobicContact CB-CB 4.37Å; I187-L206 HydrophobicContact CG1-CB 3.7Å; I187-A207 HydrophobicContact CB-CB 4.36Å; I187-A207 HydrophobicContact CG2-CB 4.07Å
188	F	95.4	Very high	93.5	Very high	88 Å²	88	66 Å²	66	39%	0.386	32%	0.322	S	S	.	.			trans	-103.7	128.6	-176	-56.5	-37.2	0	0	0	112.3	A100 D101 N102 R153 R186	A100-F188 PolarHBondContact O-N 2.78Å; D101-F188 WeakPolarHBondContact O-CE2 3.12Å; N102-F188 HydrophobicContact CB-CE1 4.21Å; N102-F188 HydrophobicContact CB-CE2 4.46Å; N102-F188 HydrophobicContact CB-CZ 3.65Å; R153-F188 PolarHBondContact NH1-O 2.85Å; R186-F188 HydrophobicContact CG-CE1 4.33Å
189	G	93.4	Very high	93.3	Very high	28 Å²	28	65.6 Å²	65.6	29%	0.289	32%	0.319	S	S	.	.	S	Bend	trans	68	177.5	175.8	0	0	0	0	0	113.4	P208	G189-P208 VanDerWaalsContact O-CD 3.28Å; G189-P208 WeakPolarHBondContact O-CD 3.3Å; G189-P208 WeakPolarHBondContact O-CG 3.24Å
190	P	93.6	Very high	93.3	Very high	50 Å²	50	60.5 Å²	60.5	33%	0.325	29%	0.292	S	S	.	.			trans	-65.3	146.6	-175.6	25	-33.4	0	0	0	112	R153 F168 K210	R153-P190 WeakPolarHBondContact CD-O 3.36Å; R153-P190 PolarHBondContact NH1-O 3.13Å; R153-P190 VanDerWaalsContact NH1-O 3.13Å; F168-P190 HydrophobicContact CE1-CB 4.38Å; F168-P190 HydrophobicContact CE1-CG 4.26Å; P190-K210 HydrophobicContact CB-CD 4.12Å; P190-K210 HydrophobicContact CB-CG 3.72Å
191	V	94	Very high	93.3	Very high	20 Å²	20	61 Å²	61	12%	0.121	30%	0.297	C	S	.	.			trans	-115.8	157.3	169.3	-58.5	0	0	0	0	110.5	V152 I187 L195 A207	V152-V191 HydrophobicContact CB-CG1 4.18Å; I187-V191 HydrophobicContact CG2-CG1 3.85Å; V191-L195 HydrophobicContact CB-CD1 3.71Å; V191-L195 HydrophobicContact CG1-CD1 4.18Å; V191-L195 HydrophobicContact CG2-CD1 4.11Å; V191-A207 HydrophobicContact CB-CB 4.14Å; V191-A207 HydrophobicContact CG1-CB 3.7Å; V191-A207 HydrophobicContact CG2-CB 3.39Å
192	A	91.7	Very high	93.2	Very high	5 Å²	5	66 Å²	66	4%	0.041	32%	0.317	C	S	.	.			trans	-85.3	158.2	179.2	0	0	0	0	0	111.8	I124 F168 E194	I124-A192 HydrophobicContact CD1-CB 3.98Å; I124-A192 HydrophobicContact CG2-CB 3.73Å; F168-A192 HydrophobicContact CE2-CB 3.85Å; F168-A192 HydrophobicContact CZ-CB 3.84Å; A192-E194 VanDerWaalsContact C-N 3.25Å; A192-E194 WeakPolarHBondContact CB-OE2 3.21Å; A192-E194 PolarHBondContact O-N 2.8Å
193	R	89.6	Confident	93.2	Very high	152 Å²	152	66 Å²	66	57%	0.574	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-70.4	-25.4	-178.3	-178.4	178	66.2	-162.2	-0.9	112.1	L195 R196	R193-L195 PolarHBondContact O-N 3.22Å; R193-R196 VanDerWaalsContact O-CB 3.3Å; R193-R196 WeakPolarHBondContact O-CB 3.45Å; R193-R196 WeakPolarHBondContact O-CG 3.31Å; R193-R196 PolarHBondContact O-N 3.41Å
194	E	91.9	Very high	93.1	Very high	23 Å²	23	63.3 Å²	63.3	11%	0.107	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-57.6	-22.3	-179	-64.9	71.3	-162.4	0	0	111.7	I124 R160 A192 R196 E197 G198	I124-E194 HydrophobicContact CG2-CB 3.92Å; R160-E194 IonicContact CZ-OE1 2.67Å; R160-E194 IonicContact NE-OE1 2.65Å; R160-E194 PolarHBondContact NE-OE1 2.67Å; R160-E194 IonicContact NH2-OE1 3.13Å; A192-E194 VanDerWaalsContact C-N 3.25Å; A192-E194 WeakPolarHBondContact CB-OE2 3.21Å; A192-E194 PolarHBondContact O-N 2.8Å; E194-R196 PolarHBondContact O-N 2.84Å; E194-E197 PolarHBondContact O-N 2.82Å; E194-G198 PolarHBondContact O-N 3.25Å
195	L	93.5	Very high	93	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-62.4	-25.7	170.3	-67.1	-175.3	0	0	0	114.2	I124 V150 V152 V191 R193 G198 F200 I203 V204	I124-L195 HydrophobicContact CG2-CD2 4.48Å; V150-L195 HydrophobicContact CG2-CD2 3.94Å; V152-L195 HydrophobicContact CB-CD1 4.12Å; V152-L195 HydrophobicContact CG1-CD1 3.71Å; V152-L195 HydrophobicContact CG1-CD2 4.23Å; V191-L195 HydrophobicContact CB-CD1 3.71Å; V191-L195 HydrophobicContact CG1-CD1 4.18Å; V191-L195 HydrophobicContact CG2-CD1 4.11Å; R193-L195 PolarHBondContact O-N 3.22Å; L195-G198 PolarHBondContact O-N 2.76Å; L195-F200 HydrophobicContact CB-CB 4.23Å; L195-F200 HydrophobicContact CD2-CD2 4.31Å; L195-F200 WeakPolarHBondContact O-CB 3.31Å; L195-F200 PolarHBondContact O-N 3.33Å; L195-I203 HydrophobicContact CD1-CG2 3.95Å; L195-V204 HydrophobicContact CB-CG2 3.62Å; L195-V204 HydrophobicContact CD1-CG2 4.38Å
196	R	91.9	Very high	93	Very high	128 Å²	128	65 Å²	65	48%	0.483	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-41.9	176.5	-65.2	-176.4	-170.6	-92.8	2.9	111.1	R193 E194 G198 N199 M201 V204	R193-R196 VanDerWaalsContact O-CB 3.3Å; R193-R196 WeakPolarHBondContact O-CB 3.45Å; R193-R196 WeakPolarHBondContact O-CG 3.31Å; R193-R196 PolarHBondContact O-N 3.41Å; E194-R196 PolarHBondContact O-N 2.84Å; R196-G198 PolarHBondContact O-N 2.85Å; R196-N199 PolarHBondContact O-N 2.65Å; R196-N199 VanDerWaalsContact O-N 3.12Å; R196-M201 HydrophobicContact CB-SD 4.39Å; R196-M201 HydrophobicContact CG-SD 4.13Å; R196-V204 HydrophobicContact CG-CG1 4.25Å; R196-V204 HydrophobicContact CG-CG2 4.08Å; R196-V204 VanDerWaalsContact CZ-CG1 3.47Å
197	E	88	Confident	92.9	Very high	156 Å²	156	57.6 Å²	57.6	73%	0.729	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-30.1	177.1	-62.1	172	-165.6	0	0	111.7	E194 N199	E194-E197 PolarHBondContact O-N 2.82Å; E197-N199 VanDerWaalsContact C-N 3.25Å; E197-N199 PolarHBondContact O-N 2.9Å
198	G	87	Confident	92.6	Very high	21 Å²	21	60.5 Å²	60.5	22%	0.216	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	1.5	174.8	0	0	0	0	0	115.6	E194 L195 R196 F200	E194-G198 PolarHBondContact O-N 3.25Å; L195-G198 PolarHBondContact O-N 2.76Å; R196-G198 PolarHBondContact O-N 2.85Å; G198-F200 WeakPolarHBondContact O-CD2 3.4Å; G198-F200 VanDerWaalsContact O-CE2 3.29Å; G198-F200 WeakPolarHBondContact O-CE2 3.43Å
199	N	91.3	Very high	91.8	Very high	120 Å²	120	64.6 Å²	64.6	64%	0.642	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	32.5	-173.1	-59.5	-29.1	0	0	0	114.5	R196 E197 M201	R196-N199 PolarHBondContact O-N 2.65Å; R196-N199 VanDerWaalsContact O-N 3.12Å; E197-N199 VanDerWaalsContact C-N 3.25Å; E197-N199 PolarHBondContact O-N 2.9Å; N199-M201 VanDerWaalsContact C-N 3.32Å; N199-M201 PolarHBondContact O-N 3.46Å
200	F	94.8	Very high	90.2	Very high	6 Å²	6	68.1 Å²	68.1	3%	0.026	34%	0.341	C	S	.	.			trans	-95.6	44	176.8	-62.4	-78.5	0	0	0	112.6	V127 V150 I176 K180 L195 G198 K202 I203 V204	V127-F200 HydrophobicContact CG2-CZ 3.75Å; V150-F200 HydrophobicContact CB-CD1 4.34Å; V150-F200 HydrophobicContact CB-CE1 3.86Å; V150-F200 HydrophobicContact CB-CE2 4.3Å; V150-F200 HydrophobicContact CB-CZ 3.84Å; V150-F200 HydrophobicContact CG1-CD1 4.11Å; V150-F200 HydrophobicContact CG1-CE1 4.07Å; V150-F200 HydrophobicContact CG1-CZ 4.48Å; V150-F200 HydrophobicContact CG2-CD1 4.34Å; V150-F200 HydrophobicContact CG2-CD2 3.9Å; V150-F200 HydrophobicContact CG2-CE1 3.96Å; V150-F200 HydrophobicContact CG2-CE2 3.49Å; V150-F200 VanDerWaalsContact CG2-CE2 3.49Å; V150-F200 HydrophobicContact CG2-CG 4.31Å; V150-F200 HydrophobicContact CG2-CZ 3.53Å; I176-F200 HydrophobicContact CD1-CE1 3.94Å; I176-F200 HydrophobicContact CD1-CZ 4.43Å; I176-F200 HydrophobicContact CG2-CE1 4.34Å; K180-F200 HydrophobicContact CB-CD1 4.16Å; K180-F200 HydrophobicContact CB-CE1 3.78Å; K180-F200 HydrophobicContact CD-CE1 4.25Å; K180-F200 HydrophobicContact CD-CZ 4.31Å; K180-F200 HydrophobicContact CG-CE1 4.13Å; L195-F200 HydrophobicContact CB-CB 4.23Å; L195-F200 HydrophobicContact CD2-CD2 4.31Å; L195-F200 WeakPolarHBondContact O-CB 3.31Å; L195-F200 PolarHBondContact O-N 3.33Å; G198-F200 WeakPolarHBondContact O-CD2 3.4Å; G198-F200 VanDerWaalsContact O-CE2 3.29Å; G198-F200 WeakPolarHBondContact O-CE2 3.43Å; F200-K202 VanDerWaalsContact C-N 3.27Å; F200-K202 PolarHBondContact O-N 2.89Å; F200-I203 HydrophobicContact CB-CB 4.27Å; F200-I203 HydrophobicContact CB-CD1 4.14Å; F200-I203 HydrophobicContact CB-CG1 4.44Å; F200-I203 HydrophobicContact CD1-CD1 3.83Å; F200-I203 HydrophobicContact CG-CD1 4.3Å; F200-I203 PolarHBondContact O-N 2.86Å; F200-V204 PolarHBondContact O-N 2.56Å; F200-V204 VanDerWaalsContact O-N 3.11Å
201	M	93.9	Very high	88.2	Confident	106 Å²	106	70.7 Å²	70.7	52%	0.522	37%	0.366	S	S	.	.	H	α-helix	trans	-56.2	-39.3	-174.4	-72.3	-60.8	-69.8	0	0	113.1	R196 N199 I203 V204 S205	R196-M201 HydrophobicContact CB-SD 4.39Å; R196-M201 HydrophobicContact CG-SD 4.13Å; N199-M201 VanDerWaalsContact C-N 3.32Å; N199-M201 PolarHBondContact O-N 3.46Å; M201-I203 VanDerWaalsContact C-N 3.31Å; M201-I203 PolarHBondContact O-N 3.01Å; M201-V204 PolarHBondContact O-N 2.87Å; M201-S205 PolarHBondContact O-N 3.49Å; M201-S205 PolarHBondContact O-OG 3.15Å
202	K	94.3	Very high	86.2	Confident	119 Å²	119	73.3 Å²	73.3	52%	0.517	39%	0.386	S	S	.	.	H	α-helix	trans	-65.5	-30.6	177.8	-172.3	165.3	176.1	176.1	0	113.4	P182 F200 S205 L206	P182-K202 HydrophobicContact CG-CD 4.33Å; P182-K202 HydrophobicContact CG-CG 4.02Å; F200-K202 VanDerWaalsContact C-N 3.27Å; F200-K202 PolarHBondContact O-N 2.89Å; K202-S205 WeakPolarHBondContact CA-OG 3.29Å; K202-S205 PolarHBondContact O-OG 2.84Å; K202-L206 HydrophobicContact CG-CD1 4.16Å; K202-L206 WeakPolarHBondContact O-CB 3.39Å; K202-L206 WeakPolarHBondContact O-CD1 3.32Å; K202-L206 WeakPolarHBondContact O-CG 3.07Å; K202-L206 PolarHBondContact O-N 2.85Å
203	I	96.2	Very high	84.3	Confident	0 Å²	0	82 Å²	82	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-74.1	-44.2	175.3	-64.5	176.9	0	0	0	109.5	V150 V152 V174 I176 P182 I187 L195 F200 M201 S205 L206 A207	V150-I203 HydrophobicContact CG1-CD1 3.47Å; V150-I203 VanDerWaalsContact CG1-CD1 3.47Å; V152-I203 HydrophobicContact CG1-CG2 4.33Å; V174-I203 HydrophobicContact CB-CD1 4.17Å; V174-I203 HydrophobicContact CG1-CD1 3.75Å; V174-I203 HydrophobicContact CG1-CG1 4.21Å; V174-I203 HydrophobicContact CG2-CG2 4.32Å; I176-I203 HydrophobicContact CG2-CD1 3.94Å; P182-I203 HydrophobicContact CB-CD1 4.48Å; P182-I203 HydrophobicContact CB-CG1 3.98Å; P182-I203 HydrophobicContact CG-CG1 4.02Å; I187-I203 HydrophobicContact CD1-CG2 4.27Å; I187-I203 HydrophobicContact CG1-CG2 4.13Å; I187-I203 HydrophobicContact CG2-CG2 4.44Å; L195-I203 HydrophobicContact CD1-CG2 3.95Å; F200-I203 HydrophobicContact CB-CB 4.27Å; F200-I203 HydrophobicContact CB-CD1 4.14Å; F200-I203 HydrophobicContact CB-CG1 4.44Å; F200-I203 HydrophobicContact CD1-CD1 3.83Å; F200-I203 HydrophobicContact CG-CD1 4.3Å; F200-I203 PolarHBondContact O-N 2.86Å; M201-I203 VanDerWaalsContact C-N 3.31Å; M201-I203 PolarHBondContact O-N 3.01Å; I203-S205 VanDerWaalsContact C-N 3.28Å; I203-S205 PolarHBondContact O-N 3.32Å; I203-L206 PolarHBondContact O-N 3.38Å; I203-A207 PolarHBondContact O-N 3.15Å
204	V	94	Very high	82.4	Confident	21 Å²	21	83.2 Å²	83.2	13%	0.127	44%	0.438	C	S	.	.	H	α-helix	trans	-61.4	-37.8	177.9	179.1	0	0	0	0	111.4	L195 R196 F200 M201	L195-V204 HydrophobicContact CB-CG2 3.62Å; L195-V204 HydrophobicContact CD1-CG2 4.38Å; R196-V204 HydrophobicContact CG-CG1 4.25Å; R196-V204 HydrophobicContact CG-CG2 4.08Å; R196-V204 VanDerWaalsContact CZ-CG1 3.47Å; F200-V204 PolarHBondContact O-N 2.56Å; F200-V204 VanDerWaalsContact O-N 3.11Å; M201-V204 PolarHBondContact O-N 2.87Å
205	S	92.5	Very high	80.6	Confident	90 Å²	90	86.1 Å²	86.1	63%	0.629	47%	0.466	S	S	*	.	H	α-helix	trans	-73.5	-28	178	66.8	0	0	0	0	114.1	M201 K202 I203	M201-S205 PolarHBondContact O-N 3.49Å; M201-S205 PolarHBondContact O-OG 3.15Å; K202-S205 WeakPolarHBondContact CA-OG 3.29Å; K202-S205 PolarHBondContact O-OG 2.84Å; I203-S205 VanDerWaalsContact C-N 3.28Å; I203-S205 PolarHBondContact O-N 3.32Å
206	L	95	Very high	78.7	Confident	60 Å²	60	91.7 Å²	91.7	31%	0.314	50%	0.502	S	S	.	.	H	α-helix	trans	-88.2	-16.2	179.4	-71.5	173.4	0	0	0	113	P182 I187 K202 I203	P182-L206 HydrophobicContact CG-CD1 3.9Å; I187-L206 HydrophobicContact CB-CB 4.37Å; I187-L206 HydrophobicContact CG1-CB 3.7Å; K202-L206 HydrophobicContact CG-CD1 4.16Å; K202-L206 WeakPolarHBondContact O-CB 3.39Å; K202-L206 WeakPolarHBondContact O-CD1 3.32Å; K202-L206 WeakPolarHBondContact O-CG 3.07Å; K202-L206 PolarHBondContact O-N 2.85Å; I203-L206 PolarHBondContact O-N 3.38Å
207	A	93	Very high	77.3	Confident	14 Å²	14	94.9 Å²	94.9	12%	0.116	52%	0.522	C	S	.	.	S	Bend	trans	-69.3	142.1	177.1	0	0	0	0	0	110.3	I187 V191 I203 E209	I187-A207 HydrophobicContact CB-CB 4.36Å; I187-A207 HydrophobicContact CG2-CB 4.07Å; V191-A207 HydrophobicContact CB-CB 4.14Å; V191-A207 HydrophobicContact CG1-CB 3.7Å; V191-A207 HydrophobicContact CG2-CB 3.39Å; I203-A207 PolarHBondContact O-N 3.15Å; A207-E209 PolarHBondContact O-N 3.45Å
208	P	89.2	Confident	75.5	Confident	64 Å²	64	91.4 Å²	91.4	42%	0.416	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-57.6	130.9	171.3	26.2	-34.2	0	0	0	108.9	G189 K210	G189-P208 VanDerWaalsContact O-CD 3.28Å; G189-P208 WeakPolarHBondContact O-CD 3.3Å; G189-P208 WeakPolarHBondContact O-CG 3.24Å; P208-K210 PolarHBondContact O-N 3.36Å
209	E	78	Confident	74.7	Confident	174 Å²	174	93.2 Å²	93.2	81%	0.813	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-56	130	172.5	-157.5	173.2	-179.5	0	0	107.6	A207	A207-E209 PolarHBondContact O-N 3.45Å
210	K	61.2	Low	73.9	Confident	101 Å²	101	95.7 Å²	95.7	44%	0.439	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-59.3	149.4	165.9	-77.4	-175.6	176.8	-172.9	0	106.5	P190 P208 S212	P190-K210 HydrophobicContact CB-CD 4.12Å; P190-K210 HydrophobicContact CB-CG 3.72Å; P208-K210 PolarHBondContact O-N 3.36Å; K210-S212 PolarHBondContact O-N 3.36Å
211	A	51.6	Low	72.9	Confident	104 Å²	104	100.5 Å²	100.5	86%	0.86	59%	0.588	S	S	*	*			trans	-54.5	95.5	151.7	0	0	0	0	0	105.7	Q213	A211-Q213 PolarHBondContact O-N 3.3Å
212	S	52.2	Low	72.1	Confident	76 Å²	76	104.6 Å²	104.6	53%	0.531	61%	0.606	S	S	.	*			trans	-56.7	123.4	164.9	40.7	0	0	0	0	103.1	K210 E214	K210-S212 PolarHBondContact O-N 3.36Å; S212-E214 VanDerWaalsContact C-N 3.3Å; S212-E214 PolarHBondContact O-N 3.31Å
213	Q	51	Low	71.4	Confident	188 Å²	188	104.2 Å²	104.2	88%	0.879	61%	0.613	S	S	*	*			trans	-49.7	116.5	149.2	-69.2	-176.2	-21.5	0	0	103.4	A211 A215	A211-Q213 PolarHBondContact O-N 3.3Å; Q213-A215 PolarHBondContact O-N 3.31Å
214	E	50	Low	70.7	Confident	176 Å²	176	114 Å²	114	82%	0.822	66%	0.659	S	S	*	*			trans	-31.4	113.3	-175.5	-69.5	173.5	159.3	0	0	107.6	S212 P216	S212-E214 VanDerWaalsContact C-N 3.3Å; S212-E214 PolarHBondContact O-N 3.31Å; E214-P216 VanDerWaalsContact C-N 3.33Å; E214-P216 WeakPolarHBondContact O-CD 3.37Å
215	A	53.9	Low	70	Confident	84 Å²	84	116.4 Å²	116.4	69%	0.694	68%	0.681	S	S	*	*			trans	-60.4	107.6	173.3	0	0	0	0	0	103.7	Q213 Q217	Q213-A215 PolarHBondContact O-N 3.31Å; A215-Q217 PolarHBondContact O-N 2.89Å
216	P	53.5	Low	69.7	Low	117 Å²	117	118.6 Å²	118.6	76%	0.76	69%	0.694	S	S	*	*			trans	-59.7	125.2	-174.3	24	-30.8	0	0	0	105.4	E214 G218	E214-P216 VanDerWaalsContact C-N 3.33Å; E214-P216 WeakPolarHBondContact O-CD 3.37Å; P216-G218 PolarHBondContact O-N 2.88Å
217	Q	61.7	Low	69.1	Low	195 Å²	195	121.5 Å²	121.5	91%	0.911	71%	0.708	S	S	*	*			trans	-54.9	108.6	177.3	-151.6	134.6	-5.4	0	0	105.6	A215 G219	A215-Q217 PolarHBondContact O-N 2.89Å; Q217-G219 PolarHBondContact O-N 2.78Å
218	G	50.9	Low	68.7	Low	83 Å²	83	127.2 Å²	127.2	86%	0.856	73%	0.732	S	S	*	*			trans	-55.1	114.9	-167.8	0	0	0	0	0	109.9	P216	P216-G218 PolarHBondContact O-N 2.88Å
219	G	70.1	Confident	68.3	Low	60 Å²	60	127.8 Å²	127.8	62%	0.619	74%	0.742	S	S	*	*			trans	-112.2	148.3	171.3	0	0	0	0	0	109.3	Q217 V221	Q217-G219 PolarHBondContact O-N 2.78Å; G219-V221 PolarHBondContact O-N 3.27Å
220	I	74.2	Confident	68.5	Low	171 Å²	171	123.5 Å²	123.5	88%	0.877	73%	0.731	S	S	*	*			trans	-71.3	114.4	166.9	-58.3	173.2	0	0	0	106.2
221	V	74.9	Confident	69.7	Low	108 Å²	108	124.6 Å²	124.6	66%	0.655	74%	0.742	S	S	*	*			trans	-98	117.5	169.1	-175.7	0	0	0	0	106.9	G219 V223	G219-V221 PolarHBondContact O-N 3.27Å; V221-V223 HydrophobicContact CG1-CG1 3.99Å; V221-V223 HydrophobicContact CG1-CG2 4.4Å; V221-V223 PolarHBondContact O-N 3.11Å
222	E	77.3	Confident	71.4	Confident	191 Å²	191	123.9 Å²	123.9	89%	0.893	73%	0.727	S	S	*	*			trans	-74.2	105.7	163.8	-73	-168.6	161.8	0	0	108
223	V	79.9	Confident	73.2	Confident	111 Å²	111	126.2 Å²	126.2	67%	0.673	73%	0.731	S	S	*	*			trans	-114	130	171.8	-99.8	0	0	0	0	108.2	V221 A225	V221-V223 HydrophobicContact CG1-CG1 3.99Å; V221-V223 HydrophobicContact CG1-CG2 4.4Å; V221-V223 PolarHBondContact O-N 3.11Å; V223-A225 PolarHBondContact O-N 3.24Å; V223-A225 VanDerWaalsContact O-N 3.14Å
224	E	81	Confident	75	Confident	206 Å²	206	120.2 Å²	120.2	96%	0.963	71%	0.707	S	S	*	*			trans	-58.3	119.1	168.2	-72.7	-171.2	164.1	0	0	109.1
225	A	79.9	Confident	77	Confident	71 Å²	71	116.9 Å²	116.9	59%	0.587	69%	0.694	S	S	*	*			trans	-121.7	143.4	179	0	0	0	0	0	109.7	V223 I227	V223-A225 PolarHBondContact O-N 3.24Å; V223-A225 VanDerWaalsContact O-N 3.14Å; A225-I227 PolarHBondContact O-N 3.39Å; A225-I227 VanDerWaalsContact O-N 3.14Å
226	P	84.3	Confident	78.7	Confident	137 Å²	137	112.9 Å²	112.9	89%	0.89	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-61.8	120.5	174.7	25.2	-32.5	0	0	0	109.9
227	I	82.5	Confident	80.4	Confident	120 Å²	120	111 Å²	111	62%	0.615	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-89.7	134.1	172.7	-62	176.2	0	0	0	108.2	A225 A229 N231 V232	A225-I227 PolarHBondContact O-N 3.39Å; A225-I227 VanDerWaalsContact O-N 3.14Å; I227-A229 PolarHBondContact O-N 3.03Å; I227-N231 HydrophobicContact CG2-CB 3.73Å; I227-V232 HydrophobicContact CB-CG1 4.43Å; I227-V232 HydrophobicContact CG2-CG1 3.95Å
228	H	85.3	Confident	81.8	Confident	134 Å²	134	104.3 Å²	104.3	62%	0.62	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-61.6	136	176.1	-169.9	-101.4	0	0	0	110.4	S230 N231	H228-S230 WeakPolarHBondContact ND1-CB 3.34Å; H228-S230 PolarHBondContact ND1-N 3.21Å; H228-S230 PolarHBondContact ND1-OG 3.02Å; H228-S230 PolarHBondContact O-N 3.4Å; H228-N231 WeakPolarHBondContact O-CB 3.39Å; H228-N231 PolarHBondContact O-N 2.99Å
229	A	81.7	Confident	83.6	Confident	77 Å²	77	103.9 Å²	103.9	64%	0.636	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-59.1	-19.7	-173.4	0	0	0	0	0	114.4	I227 N231 V232	I227-A229 PolarHBondContact O-N 3.03Å; A229-N231 PolarHBondContact O-N 3.12Å; A229-V232 VanDerWaalsContact O-CG2 3.26Å; A229-V232 WeakPolarHBondContact O-CG2 3.26Å
230	S	81.5	Confident	84.5	Confident	83 Å²	83	103.4 Å²	103.4	58%	0.58	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-70.3	-19.6	173.3	64.4	0	0	0	0	114	H228	H228-S230 WeakPolarHBondContact ND1-CB 3.34Å; H228-S230 PolarHBondContact ND1-N 3.21Å; H228-S230 PolarHBondContact ND1-OG 3.02Å; H228-S230 PolarHBondContact O-N 3.4Å
231	N	86.8	Confident	85.3	Confident	125 Å²	125	100 Å²	100	67%	0.668	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-97.8	-4.9	-175.6	-61.8	-2	0	0	0	112	I227 H228 A229	I227-N231 HydrophobicContact CG2-CB 3.73Å; H228-N231 WeakPolarHBondContact O-CB 3.39Å; H228-N231 PolarHBondContact O-N 2.99Å; A229-N231 PolarHBondContact O-N 3.12Å
232	V	86.8	Confident	86.2	Confident	89 Å²	89	97.2 Å²	97.2	54%	0.539	57%	0.565	S	S	.	*			trans	-98.3	142.4	172.1	-58.6	0	0	0	0	109.5	I227 A229	I227-V232 HydrophobicContact CB-CG1 4.43Å; I227-V232 HydrophobicContact CG2-CG1 3.95Å; A229-V232 VanDerWaalsContact O-CG2 3.26Å; A229-V232 WeakPolarHBondContact O-CG2 3.26Å
233	M	89.4	Confident	86.9	Confident	125 Å²	125	88.4 Å²	88.4	62%	0.616	53%	0.525	S	S	*	.			trans	-109.7	146.8	173.8	-160.8	166.4	-67.5	0	0	109.4	A242	M233-A242 HydrophobicContact CB-CB 4.19Å; M233-A242 HydrophobicContact CG-CB 3.91Å; M233-A242 HydrophobicContact SD-CB 3.4Å; M233-A242 WeakPolarHBondContact SD-CB 3.33Å
234	V	89.9	Confident	87.5	Confident	61 Å²	61	92 Å²	92	37%	0.37	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	135.8	174.2	-176.9	0	0	0	0	108.4	T243 V245 L265	V234-T243 HydrophobicContact CG1-CG2 4.43Å; V234-T243 PolarHBondContact O-N 3.28Å; V234-V245 HydrophobicContact CB-CG2 4.46Å; V234-V245 HydrophobicContact CG2-CG2 3.83Å; V234-L265 HydrophobicContact CG1-CD1 3.99Å; V234-L265 HydrophobicContact CG1-CD2 3.88Å; V234-L265 HydrophobicContact CG1-CG 4.42Å
235	I	90.7	Very high	88	Confident	106 Å²	106	84.7 Å²	84.7	54%	0.544	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	134.4	175.9	-66.5	176.8	0	0	0	108.9	G240 E241	I235-G240 VanDerWaalsContact CG2-CA 3.47Å; I235-G240 WeakPolarHBondContact CG2-O 3.26Å; I235-E241 WeakPolarHBondContact CA-O 3.05Å
236	D	90.7	Very high	88.6	Confident	0 Å²	0	81.6 Å²	81.6	0%	0	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-69.7	123.8	172.5	-168.7	-41.7	0	0	0	109.8	S238 N239 G240 E241 T243 S258 T261	D236-S238 PolarHBondContact O-N 3.11Å; D236-S238 WeakPolarHBondContact OD1-CB 3.17Å; D236-S238 PolarHBondContact OD1-N 2.78Å; D236-S238 PolarHBondContact OD1-OG 2.9Å; D236-N239 VanDerWaalsContact CB-OD1 3.31Å; D236-N239 WeakPolarHBondContact CB-OD1 3.38Å; D236-G240 WeakPolarHBondContact O-CA 3.39Å; D236-G240 PolarHBondContact O-N 3.36Å; D236-E241 WeakPolarHBondContact CB-O 3.45Å; D236-E241 PolarHBondContact N-O 2.98Å; D236-T243 HydrophobicContact CB-CG2 3.81Å; D236-S258 WeakPolarHBondContact OD2-CB 3.28Å; D236-S258 PolarHBondContact OD2-OG 2.84Å; D236-T261 PolarHBondContact OD1-OG1 3.46Å; D236-T261 WeakPolarHBondContact OD2-CG2 3.44Å; D236-T261 PolarHBondContact OD2-OG1 3.49Å
237	P	89.7	Confident	89	Confident	77 Å²	77	81.8 Å²	81.8	50%	0.5	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.1	-176.9	22.5	-31.3	0	0	0	113.4	E263 L265	P237-E263 HydrophobicContact CG-CB 4.1Å; P237-L265 HydrophobicContact CG-CD2 4.41Å
238	S	89.4	Confident	89.4	Confident	55 Å²	55	82.1 Å²	82.1	39%	0.385	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-41.2	-177.2	60.3	0	0	0	0	113.6	D236 T261 E263	D236-S238 PolarHBondContact O-N 3.11Å; D236-S238 WeakPolarHBondContact OD1-CB 3.17Å; D236-S238 PolarHBondContact OD1-N 2.78Å; D236-S238 PolarHBondContact OD1-OG 2.9Å; S238-T261 WeakPolarHBondContact OG-CG2 3.48Å; S238-E263 WeakPolarHBondContact CA-OE2 3.25Å; S238-E263 VanDerWaalsContact CB-CD 3.49Å; S238-E263 VanDerWaalsContact CB-OE2 3.26Å; S238-E263 WeakPolarHBondContact CB-OE2 3.5Å; S238-E263 PolarHBondContact N-OE2 3.35Å
239	N	90.1	Very high	89.7	Confident	75 Å²	75	80.6 Å²	80.6	40%	0.401	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.3	-3.7	-168.3	71.6	4.3	0	0	0	114.1	D236 E241	D236-N239 VanDerWaalsContact CB-OD1 3.31Å; D236-N239 WeakPolarHBondContact CB-OD1 3.38Å; N239-E241 PolarHBondContact ND2-OE2 3.46Å; N239-E241 PolarHBondContact O-N 3.35Å; N239-E241 VanDerWaalsContact OD1-CB 3.3Å; N239-E241 WeakPolarHBondContact OD1-CB 3.43Å; N239-E241 PolarHBondContact OD1-N 3.38Å
240	G	88.9	Confident	90	Very high	50 Å²	50	80 Å²	80	52%	0.515	44%	0.44	S	S	.	.			trans	73.1	5.4	179.1	0	0	0	0	0	114.4	I235 D236	I235-G240 VanDerWaalsContact CG2-CA 3.47Å; I235-G240 WeakPolarHBondContact CG2-O 3.26Å; D236-G240 WeakPolarHBondContact O-CA 3.39Å; D236-G240 PolarHBondContact O-N 3.36Å
241	E	90.9	Very high	90.3	Very high	99 Å²	99	83.6 Å²	83.6	46%	0.463	45%	0.452	S	S	.	.			trans	-85.5	154.6	179.9	-62.5	-173.9	168.3	0	0	112.3	I235 D236 N239 T243 K260	I235-E241 WeakPolarHBondContact CA-O 3.05Å; D236-E241 WeakPolarHBondContact CB-O 3.45Å; D236-E241 PolarHBondContact N-O 2.98Å; N239-E241 PolarHBondContact ND2-OE2 3.46Å; N239-E241 PolarHBondContact O-N 3.35Å; N239-E241 VanDerWaalsContact OD1-CB 3.3Å; N239-E241 WeakPolarHBondContact OD1-CB 3.43Å; N239-E241 PolarHBondContact OD1-N 3.38Å; E241-T243 PolarHBondContact O-N 2.85Å; E241-K260 IonicContact OE2-NZ 2.89Å; E241-K260 PolarHBondContact OE2-NZ 2.95Å
242	A	92.3	Very high	90.3	Very high	50 Å²	50	81.1 Å²	81.1	41%	0.413	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	131.9	172.5	0	0	0	0	0	111	M233 K260	M233-A242 HydrophobicContact CB-CB 4.19Å; M233-A242 HydrophobicContact CG-CB 3.91Å; M233-A242 HydrophobicContact SD-CB 3.4Å; M233-A242 WeakPolarHBondContact SD-CB 3.33Å; A242-K260 VanDerWaalsContact O-CE 3.32Å; A242-K260 WeakPolarHBondContact O-CE 3.46Å; A242-K260 PolarHBondContact O-NZ 3.28Å
243	T	93.3	Very high	90.5	Very high	6 Å²	6	84.5 Å²	84.5	4%	0.037	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	168.6	-178	-166.6	0	0	0	0	111.7	V234 D236 E241 S258 L265	V234-T243 HydrophobicContact CG1-CG2 4.43Å; V234-T243 PolarHBondContact O-N 3.28Å; D236-T243 HydrophobicContact CB-CG2 3.81Å; E241-T243 PolarHBondContact O-N 2.85Å; T243-S258 WeakPolarHBondContact CB-OG 3.14Å; T243-S258 WeakPolarHBondContact CG2-OG 3.28Å; T243-S258 PolarHBondContact OG1-OG 3.37Å; T243-L265 HydrophobicContact CG2-CD2 4.24Å
244	R	91.6	Very high	90.5	Very high	187 Å²	187	85.7 Å²	85.7	71%	0.706	47%	0.465	S	S	*	.			trans	-105.6	146.2	173.1	-66.2	-174.7	-168.2	-156.4	5	110	G246 K259	R244-G246 PolarHBondContact O-N 2.79Å; R244-K259 HydrophobicContact CB-CB 4.45Å; R244-K259 HydrophobicContact CB-CD 4.11Å; R244-K259 HydrophobicContact CB-CG 4.47Å; R244-K259 WeakPolarHBondContact O-CB 3.48Å; R244-K259 PolarHBondContact O-N 2.86Å
245	V	91.9	Very high	90.6	Very high	51 Å²	51	84.5 Å²	84.5	31%	0.309	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	121.9	174.4	-176	0	0	0	0	110.1	V234 R256 L265	V234-V245 HydrophobicContact CB-CG2 4.46Å; V234-V245 HydrophobicContact CG2-CG2 3.83Å; V245-R256 HydrophobicContact CG1-CB 3.92Å; V245-R256 HydrophobicContact CG1-CG 3.82Å; V245-L265 HydrophobicContact CB-CD1 4.27Å; V245-L265 HydrophobicContact CG1-CD1 4.29Å; V245-L265 HydrophobicContact CG2-CD1 3.91Å
246	G	92.6	Very high	90.8	Very high	7 Å²	7	85.2 Å²	85.2	7%	0.072	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	179.8	163.6	0	0	0	0	0	110.6	R244 R256 V257	R244-G246 PolarHBondContact O-N 2.79Å; G246-R256 WeakPolarHBondContact O-CA 3.49Å; G246-V257 WeakPolarHBondContact CA-O 3.34Å; G246-V257 PolarHBondContact N-O 2.86Å; G246-V257 PolarHBondContact O-N 3.18Å
247	Y	93.4	Very high	90.9	Very high	140 Å²	140	86 Å²	86	55%	0.549	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	140.1	176.5	-62.1	-84.6	0	0	0	110.5	K254 V255 R256	Y247-K254 VanDerWaalsContact CB-CE 3.49Å; Y247-K254 HydrophobicContact CD1-CD 4.06Å; Y247-K254 HydrophobicContact CD1-CG 3.86Å; Y247-K254 HydrophobicContact CG-CD 4.34Å; Y247-K254 HydrophobicContact CG-CG 4.25Å; Y247-V255 VanDerWaalsContact CA-O 3.32Å; Y247-V255 WeakPolarHBondContact CA-O 3.48Å; Y247-R256 HydrophobicContact CD1-CG 3.99Å; Y247-R256 HydrophobicContact CE1-CG 3.57Å
248	K	91.3	Very high	91.1	Very high	128 Å²	128	82.4 Å²	82.4	56%	0.557	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	146.6	171.9	-170.4	175	178.7	-177.9	0	108.9	V250 V255 V257	K248-V250 HydrophobicContact CD-CG2 4.42Å; K248-V250 HydrophobicContact CG-CG2 4.31Å; K248-V255 PolarHBondContact N-O 2.85Å; K248-V255 PolarHBondContact O-N 3.06Å; K248-V257 HydrophobicContact CB-CG1 3.97Å; K248-V257 HydrophobicContact CB-CG2 4.23Å
249	V	90.8	Very high	91.2	Very high	101 Å²	101	87 Å²	87	61%	0.612	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	119.8	171.2	-177.6	0	0	0	0	107.9	K253	V249-K253 WeakPolarHBondContact CA-O 3.36Å
250	V	87.5	Confident	91.3	Very high	66 Å²	66	88.9 Å²	88.9	40%	0.4	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125.7	174.9	-176.1	0	0	0	0	106.3	K248 G252 K253 V255	K248-V250 HydrophobicContact CD-CG2 4.42Å; K248-V250 HydrophobicContact CG-CG2 4.31Å; V250-G252 PolarHBondContact O-N 2.9Å; V250-G252 VanDerWaalsContact O-N 3.17Å; V250-K253 PolarHBondContact N-O 2.89Å; V250-K253 PolarHBondContact O-N 2.8Å; V250-K253 VanDerWaalsContact O-O 3.12Å; V250-V255 HydrophobicContact CB-CG2 4.29Å
251	D	87.5	Confident	91.5	Very high	158 Å²	158	89.6 Å²	89.6	85%	0.845	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	41.8	-178.7	-53.7	-35.7	0	0	0	114.3	K253	D251-K253 PolarHBondContact O-N 2.82Å
252	G	88.3	Confident	91.4	Very high	72 Å²	72	86.8 Å²	86.8	74%	0.742	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	-0.2	-179.2	0	0	0	0	0	115.1	V250	V250-G252 PolarHBondContact O-N 2.9Å; V250-G252 VanDerWaalsContact O-N 3.17Å
253	K	89.4	Confident	91.3	Very high	160 Å²	160	88.7 Å²	88.7	70%	0.696	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	139.4	177.5	-64.4	-177.1	-174.8	174.5	0	111.3	V249 V250 D251 V255	V249-K253 WeakPolarHBondContact CA-O 3.36Å; V250-K253 PolarHBondContact N-O 2.89Å; V250-K253 PolarHBondContact O-N 2.8Å; V250-K253 VanDerWaalsContact O-O 3.12Å; D251-K253 PolarHBondContact O-N 2.82Å; K253-V255 PolarHBondContact O-N 3.36Å
254	K	90.3	Very high	91.2	Very high	150 Å²	150	91 Å²	91	65%	0.652	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	112.9	175.3	-172.8	178.4	-179.5	179.4	0	109.3	Y247	Y247-K254 VanDerWaalsContact CB-CE 3.49Å; Y247-K254 HydrophobicContact CD1-CD 4.06Å; Y247-K254 HydrophobicContact CD1-CG 3.86Å; Y247-K254 HydrophobicContact CG-CD 4.34Å; Y247-K254 HydrophobicContact CG-CG 4.25Å
255	V	92.3	Very high	91.1	Very high	36 Å²	36	83.7 Å²	83.7	22%	0.218	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	141.7	-179.3	-175.6	0	0	0	0	109.7	Y247 K248 V250 K253 A264	Y247-V255 VanDerWaalsContact CA-O 3.32Å; Y247-V255 WeakPolarHBondContact CA-O 3.48Å; K248-V255 PolarHBondContact N-O 2.85Å; K248-V255 PolarHBondContact O-N 3.06Å; V250-V255 HydrophobicContact CB-CG2 4.29Å; K253-V255 PolarHBondContact O-N 3.36Å; V255-A264 HydrophobicContact CG1-CB 4.15Å
256	R	93.8	Very high	90.4	Very high	122 Å²	122	84 Å²	84	46%	0.46	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	129.6	172.8	-68.6	-175.8	-68.2	178.6	1.6	109.6	V245 G246 Y247 A264 L265 D266	V245-R256 HydrophobicContact CG1-CB 3.92Å; V245-R256 HydrophobicContact CG1-CG 3.82Å; G246-R256 WeakPolarHBondContact O-CA 3.49Å; Y247-R256 HydrophobicContact CD1-CG 3.99Å; Y247-R256 HydrophobicContact CE1-CG 3.57Å; R256-A264 WeakPolarHBondContact O-CA 3.4Å; R256-L265 HydrophobicContact CB-CB 4.27Å; R256-L265 PolarHBondContact O-N 3.29Å; R256-D266 WeakPolarHBondContact CB-OD2 3.19Å; R256-D266 IonicContact CZ-OD1 3.87Å; R256-D266 PolarHBondContact N-OD2 2.87Å; R256-D266 IonicContact NE-OD1 3.2Å; R256-D266 PolarHBondContact NE-OD1 3.08Å; R256-D266 IonicContact NE-OD2 3.05Å; R256-D266 IonicContact NH2-OD1 2.66Å; R256-D266 PolarHBondContact NH2-OD1 2.64Å
257	V	93.7	Very high	89	Confident	17 Å²	17	97.1 Å²	97.1	10%	0.103	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	153.1	179.6	-62.6	0	0	0	0	111.2	G246 K248 K259 G262 E263 L265	G246-V257 WeakPolarHBondContact CA-O 3.34Å; G246-V257 PolarHBondContact N-O 2.86Å; G246-V257 PolarHBondContact O-N 3.18Å; K248-V257 HydrophobicContact CB-CG1 3.97Å; K248-V257 HydrophobicContact CB-CG2 4.23Å; V257-K259 PolarHBondContact O-N 3.03Å; V257-G262 WeakPolarHBondContact CB-O 3.29Å; V257-G262 WeakPolarHBondContact CG1-O 3.27Å; V257-E263 CarbonylContact C-O 3.57Å; V257-E263 WeakPolarHBondContact CA-O 3.36Å; V257-E263 WeakPolarHBondContact CB-O 3.45Å; V257-L265 VanDerWaalsContact C-CD1 3.48Å; V257-L265 WeakPolarHBondContact O-CD1 3.36Å
258	S	93.8	Very high	88.8	Confident	1 Å²	1	95 Å²	95	1%	0.007	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	130.9	167.7	175.1	0	0	0	0	109.1	D236 T243 K260 G262 E263	D236-S258 WeakPolarHBondContact OD2-CB 3.28Å; D236-S258 PolarHBondContact OD2-OG 2.84Å; T243-S258 WeakPolarHBondContact CB-OG 3.14Å; T243-S258 WeakPolarHBondContact CG2-OG 3.28Å; T243-S258 PolarHBondContact OG1-OG 3.37Å; S258-K260 PolarHBondContact O-N 2.84Å; S258-K260 PolarHBondContact OG-N 3.37Å; S258-K260 VanDerWaalsContact OG-N 3.1Å; S258-G262 WeakPolarHBondContact O-CA 3.35Å; S258-G262 PolarHBondContact O-N 2.9Å; S258-E263 PolarHBondContact N-O 3.12Å
259	K	91.9	Very high	88.7	Confident	150 Å²	150	93.3 Å²	93.3	65%	0.652	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.7	170.4	-82.4	-166.9	173.8	-172.2	0	113.5	R244 V257	R244-K259 HydrophobicContact CB-CB 4.45Å; R244-K259 HydrophobicContact CB-CD 4.11Å; R244-K259 HydrophobicContact CB-CG 4.47Å; R244-K259 WeakPolarHBondContact O-CB 3.48Å; R244-K259 PolarHBondContact O-N 2.86Å; V257-K259 PolarHBondContact O-N 3.03Å
260	K	91.8	Very high	88.6	Confident	115 Å²	115	92.8 Å²	92.8	50%	0.5	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-57.4	179.6	-77.9	-177	168.3	179.7	0	111.6	E241 A242 S258	E241-K260 IonicContact OE2-NZ 2.89Å; E241-K260 PolarHBondContact OE2-NZ 2.95Å; A242-K260 VanDerWaalsContact O-CE 3.32Å; A242-K260 WeakPolarHBondContact O-CE 3.46Å; A242-K260 PolarHBondContact O-NZ 3.28Å; S258-K260 PolarHBondContact O-N 2.84Å; S258-K260 PolarHBondContact OG-N 3.37Å; S258-K260 VanDerWaalsContact OG-N 3.1Å
261	T	91.9	Very high	88.6	Confident	66 Å²	66	94.4 Å²	94.4	41%	0.405	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-16.5	-173.8	57.5	0	0	0	0	114.2	D236 S238 E263	D236-T261 PolarHBondContact OD1-OG1 3.46Å; D236-T261 WeakPolarHBondContact OD2-CG2 3.44Å; D236-T261 PolarHBondContact OD2-OG1 3.49Å; S238-T261 WeakPolarHBondContact OG-CG2 3.48Å; T261-E263 PolarHBondContact O-N 2.66Å; T261-E263 PolarHBondContact OG1-N 3.32Å
262	G	89.5	Confident	88.7	Confident	39 Å²	39	90.4 Å²	90.4	40%	0.402	46%	0.464	S	S	.	.			trans	77.3	1.3	-174	0	0	0	0	0	114.3	V257 S258	V257-G262 WeakPolarHBondContact CB-O 3.29Å; V257-G262 WeakPolarHBondContact CG1-O 3.27Å; S258-G262 WeakPolarHBondContact O-CA 3.35Å; S258-G262 PolarHBondContact O-N 2.9Å
263	E	90.4	Very high	88.7	Confident	91 Å²	91	91.7 Å²	91.7	43%	0.425	45%	0.446	S	S	.	.			trans	-65.6	148.5	174.6	-76.5	-164.8	171.9	0	0	111.8	P237 S238 V257 S258 T261 L265	P237-E263 HydrophobicContact CG-CB 4.1Å; S238-E263 WeakPolarHBondContact CA-OE2 3.25Å; S238-E263 VanDerWaalsContact CB-CD 3.49Å; S238-E263 VanDerWaalsContact CB-OE2 3.26Å; S238-E263 WeakPolarHBondContact CB-OE2 3.5Å; S238-E263 PolarHBondContact N-OE2 3.35Å; V257-E263 CarbonylContact C-O 3.57Å; V257-E263 WeakPolarHBondContact CA-O 3.36Å; V257-E263 WeakPolarHBondContact CB-O 3.45Å; S258-E263 PolarHBondContact N-O 3.12Å; T261-E263 PolarHBondContact O-N 2.66Å; T261-E263 PolarHBondContact OG1-N 3.32Å; E263-L265 PolarHBondContact O-N 3.03Å
264	A	90.5	Very high	88.7	Confident	55 Å²	55	86.8 Å²	86.8	46%	0.455	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-64.9	129.5	177.3	0	0	0	0	0	110.7	V255 R256	V255-A264 HydrophobicContact CG1-CB 4.15Å; R256-A264 WeakPolarHBondContact O-CA 3.4Å
265	L	89.4	Confident	88.6	Confident	32 Å²	32	81.9 Å²	81.9	17%	0.168	41%	0.41	C	S	.	.			trans	-88.9	-16.3	174.3	-64	172.5	0	0	0	112.1	V234 P237 T243 V245 R256 V257 E263 K267	V234-L265 HydrophobicContact CG1-CD1 3.99Å; V234-L265 HydrophobicContact CG1-CD2 3.88Å; V234-L265 HydrophobicContact CG1-CG 4.42Å; P237-L265 HydrophobicContact CG-CD2 4.41Å; T243-L265 HydrophobicContact CG2-CD2 4.24Å; V245-L265 HydrophobicContact CB-CD1 4.27Å; V245-L265 HydrophobicContact CG1-CD1 4.29Å; V245-L265 HydrophobicContact CG2-CD1 3.91Å; R256-L265 HydrophobicContact CB-CB 4.27Å; R256-L265 PolarHBondContact O-N 3.29Å; V257-L265 VanDerWaalsContact C-CD1 3.48Å; V257-L265 WeakPolarHBondContact O-CD1 3.36Å; E263-L265 PolarHBondContact O-N 3.03Å; L265-K267 PolarHBondContact O-N 3.19Å
266	D	79	Confident	88.3	Confident	58 Å²	58	85.8 Å²	85.8	31%	0.31	43%	0.426	S	S	.	.			trans	-80	111.4	175.1	-64.7	-39	0	0	0	108.2	R256	R256-D266 WeakPolarHBondContact CB-OD2 3.19Å; R256-D266 IonicContact CZ-OD1 3.87Å; R256-D266 PolarHBondContact N-OD2 2.87Å; R256-D266 IonicContact NE-OD1 3.2Å; R256-D266 PolarHBondContact NE-OD1 3.08Å; R256-D266 IonicContact NE-OD2 3.05Å; R256-D266 IonicContact NH2-OD1 2.66Å; R256-D266 PolarHBondContact NH2-OD1 2.64Å
267	K	63.3	Low	87.7	Confident	283 Å²	283	82.5 Å²	82.5	100%	1.23	42%	0.423	S	S	*	.			trans	-67.9	0	167.5	-72.4	-172.2	177.9	-176	0	111	L265	L265-K267 PolarHBondContact O-N 3.19Å

Retrieved 267 of 267 residues in 116.6 ms (Link to these results)

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