A0A068LRW4_HUMAN Loading...

Ig heavy chain variable region

AlphaFold DB , UniProt , Accession A0A068LRW4, Species HUMAN (Homo sapiens, Human), Gene n/a, Length 120 aa.

						>A0A068LRW4_HUMAN|A0A068LRW4
QVQLQESGPGLVKPSETLSLTCTVSGDSINSFYWGWIRQPPGKGLEWIGYMYNGGSTNYNPSLKSRVTISLDTSKNQLSLKLTSVTAADTAVYYCGRYQNNIVMYGMDVWGQGTTVAASS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	Q	82.1	Confident	94.6	Very high	203 Å²	203	73.5 Å²	73.5	95%	0.949	42%	0.42	S	S	*	.				0	134.2	0	-174.3	177	20.4	0	0	107.4
2	V	90.6	Very high	94.8	Very high	33 Å²	33	67.9 Å²	67.9	20%	0.2	39%	0.388	C	S	.	.			trans	-78.2	135.1	179.5	-170.5	0	0	0	0	109.3	L4 V24 S25 D27 V109	V2-L4 HydrophobicContact CG1-CD2 4.35Å; V2-V24 HydrophobicContact CG1-CG1 4.44Å; V2-S25 CarbonylContact C-O 3.56Å; V2-S25 WeakPolarHBondContact CA-O 3.41Å; V2-D27 HydrophobicContact CB-CB 4.47Å; V2-D27 HydrophobicContact CG1-CB 3.88Å; V2-D27 HydrophobicContact CG2-CB 3.81Å; V2-V109 HydrophobicContact CB-CG1 4.21Å; V2-V109 HydrophobicContact CB-CG2 4.34Å; V2-V109 HydrophobicContact CG1-CG1 4.01Å; V2-V109 HydrophobicContact CG1-CG2 4.49Å
3	Q	94.6	Very high	94.9	Very high	99 Å²	99	71.4 Å²	71.4	46%	0.463	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	136.1	178.6	-65.7	-68.5	-13.5	0	0	109.7	S25	Q3-S25 PolarHBondContact N-O 3.49Å; Q3-S25 PolarHBondContact O-N 3.25Å
4	L	96.4	Very high	95	Very high	10 Å²	10	70.1 Å²	70.1	5%	0.052	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.8	178.7	-53.4	-176.2	0	0	0	109.1	V2 V24 W34 V109 G111	V2-L4 HydrophobicContact CG1-CD2 4.35Å; L4-V24 HydrophobicContact CD2-CB 4.2Å; L4-V24 HydrophobicContact CD2-CG1 3.98Å; L4-V24 HydrophobicContact CD2-CG2 3.83Å; L4-W34 HydrophobicContact CD1-CZ3 4.09Å; L4-W34 HydrophobicContact CD2-CE3 4.42Å; L4-W34 HydrophobicContact CD2-CH2 4.07Å; L4-W34 HydrophobicContact CD2-CZ3 3.47Å; L4-W34 VanDerWaalsContact CD2-CZ3 3.47Å; L4-W34 HydrophobicContact CG-CZ3 4.44Å; L4-V109 HydrophobicContact CD1-CB 4.28Å; L4-V109 HydrophobicContact CD1-CG1 3.77Å; L4-V109 HydrophobicContact CD2-CG1 4.48Å; L4-V109 HydrophobicContact CG-CG1 3.79Å; L4-G111 WeakPolarHBondContact O-CA 3.47Å
5	Q	97.6	Very high	95	Very high	141 Å²	141	72.1 Å²	72.1	66%	0.659	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.9	107.6	-177.6	-172.9	167.3	32.4	0	0	111	C22 T23	Q5-C22 WeakPolarHBondContact O-CA 3.32Å; Q5-T23 PolarHBondContact N-O 3.23Å; Q5-T23 PolarHBondContact O-N 2.96Å
6	E	98.3	Very high	95.2	Very high	22 Å²	22	73.6 Å²	73.6	10%	0.103	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	145.3	172.9	-59.1	89.6	161	0	0	112.2	T21 C22 W36 Y94 C95 G111 Q112 G113 T114	E6-T21 CarbonylContact C-O 3.59Å; E6-T21 WeakPolarHBondContact CA-O 3.31Å; E6-C22 HydrophobicContact CG-CB 4.48Å; E6-W36 HydrophobicContact CB-CH2 4.3Å; E6-W36 HydrophobicContact CB-CZ3 4.47Å; E6-W36 HydrophobicContact CG-CH2 3.82Å; E6-W36 HydrophobicContact CG-CZ3 3.76Å; E6-Y94 WeakPolarHBondContact OE1-CA 3.33Å; E6-C95 HydrophobicContact CG-CB 4.4Å; E6-C95 PolarHBondContact OE1-N 2.76Å; E6-C95 PolarHBondContact OE1-SG 3.24Å; E6-C95 VanDerWaalsContact OE1-SG 3.37Å; E6-G111 WeakPolarHBondContact OE1-CA 3.27Å; E6-G111 WeakPolarHBondContact OE2-CA 3.48Å; E6-Q112 PolarHBondContact OE2-N 3.39Å; E6-G113 PolarHBondContact OE1-N 3.07Å; E6-G113 PolarHBondContact OE2-N 3.37Å; E6-T114 HydrophobicContact CB-CG2 3.84Å
7	S	97.6	Very high	95.3	Very high	59 Å²	59	73.5 Å²	73.5	41%	0.413	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	151.3	177.4	58.9	0	0	0	0	110.1	L20 T21	S7-L20 WeakPolarHBondContact O-CA 3.14Å; S7-T21 PolarHBondContact N-O 3.29Å; S7-T21 PolarHBondContact O-N 3.03Å; S7-T21 PolarHBondContact OG-O 3.05Å; S7-T21 VanDerWaalsContact OG-O 3.09Å
8	G	96.4	Very high	95.5	Very high	43 Å²	43	69.5 Å²	69.5	44%	0.443	39%	0.394	S	S	.	.			trans	158.7	-176.3	-179.4	0	0	0	0	0	111.9
9	P	95.2	Very high	95.6	Very high	52 Å²	52	68.7 Å²	68.7	34%	0.338	39%	0.394	S	S	.	.			trans	-70.4	135.8	179.2	30.2	-34.6	0	0	0	110.9	L11 V12 L18 S19	P9-L11 VanDerWaalsContact C-N 3.31Å; P9-V12 HydrophobicContact CB-CG2 3.94Å; P9-V12 HydrophobicContact CG-CG2 3.49Å; P9-V12 VanDerWaalsContact CG-CG2 3.49Å; P9-L18 HydrophobicContact CG-CD1 3.67Å; P9-S19 VanDerWaalsContact CD-O 3.23Å; P9-S19 WeakPolarHBondContact CD-O 3.34Å
10	G	95.1	Very high	95.8	Very high	46 Å²	46	65.3 Å²	65.3	47%	0.474	37%	0.374	S	S	.	.	S	Bend	trans	-77.3	-17.8	173.3	0	0	0	0	0	113.9	A117	G10-A117 PolarHBondContact O-N 3.18Å
11	L	96.8	Very high	95.9	Very high	101 Å²	101	63.9 Å²	63.9	53%	0.529	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	133.3	179.7	178.8	65.3	0	0	0	109.3	P9 A117 S119	P9-L11 VanDerWaalsContact C-N 3.31Å; L11-A117 WeakPolarHBondContact CA-O 3.29Å; L11-A117 HydrophobicContact CD1-CB 3.91Å; L11-S119 WeakPolarHBondContact CD1-OG 3.43Å
12	V	96.9	Very high	96.6	Very high	6 Å²	6	54.2 Å²	54.2	4%	0.036	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	137	177.4	179	0	0	0	0	108.9	P9 E16 L18 V85 V116 A117 A118 S119	P9-V12 HydrophobicContact CB-CG2 3.94Å; P9-V12 HydrophobicContact CG-CG2 3.49Å; P9-V12 VanDerWaalsContact CG-CG2 3.49Å; V12-E16 HydrophobicContact CG1-CB 3.76Å; V12-L18 HydrophobicContact CG2-CB 4.36Å; V12-L18 HydrophobicContact CG2-CD1 3.84Å; V12-V85 HydrophobicContact CG1-CB 4.36Å; V12-V85 HydrophobicContact CG1-CG1 4.32Å; V12-V85 HydrophobicContact CG1-CG2 4.25Å; V12-V116 HydrophobicContact CG2-CG1 4.22Å; V12-A117 PolarHBondContact N-O 2.59Å; V12-A118 VanDerWaalsContact O-CA 3.3Å; V12-A118 WeakPolarHBondContact O-CA 3.39Å; V12-S119 PolarHBondContact O-N 3.3Å
13	K	96.4	Very high	97	Very high	113 Å²	113	54.5 Å²	54.5	49%	0.491	32%	0.323	S	S	.	.			trans	-77.3	153	179.4	-63	178.2	177.9	177.3	0	111	E16	K13-E16 HydrophobicContact CB-CG 4.02Å; K13-E16 PolarHBondContact N-OE2 3.3Å; K13-E16 WeakPolarHBondContact O-CB 3.23Å; K13-E16 PolarHBondContact O-N 2.8Å; K13-E16 VanDerWaalsContact O-N 3.16Å
14	P	95.7	Very high	97	Very high	53 Å²	53	50 Å²	50	34%	0.344	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	145.7	171.7	-25.9	35	0	0	0	112.2	E16 V85	P14-E16 PolarHBondContact O-N 3.02Å; P14-V85 CarbonylContact C-O 3.52Å; P14-V85 VanDerWaalsContact CA-O 3.29Å; P14-V85 WeakPolarHBondContact CA-O 3.22Å
15	S	95.8	Very high	96.9	Very high	101 Å²	101	52.5 Å²	52.5	71%	0.706	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	-10.2	-174.3	-45.6	0	0	0	0	116.3	V85	S15-V85 PolarHBondContact N-O 2.8Å
16	E	97.1	Very high	96.6	Very high	95 Å²	95	48.9 Å²	48.9	44%	0.444	32%	0.321	S	S	.	.	S	Bend	trans	-75.6	177.6	173.5	-64.8	-176.6	159.9	0	0	111.8	V12 K13 P14 S84 V85	V12-E16 HydrophobicContact CG1-CB 3.76Å; K13-E16 HydrophobicContact CB-CG 4.02Å; K13-E16 PolarHBondContact N-OE2 3.3Å; K13-E16 WeakPolarHBondContact O-CB 3.23Å; K13-E16 PolarHBondContact O-N 2.8Å; K13-E16 VanDerWaalsContact O-N 3.16Å; P14-E16 PolarHBondContact O-N 3.02Å; E16-S84 PolarHBondContact O-N 2.81Å; E16-V85 WeakPolarHBondContact O-CG2 2.98Å; E16-V85 PolarHBondContact O-N 2.91Å; E16-V85 VanDerWaalsContact O-N 3.09Å
17	T	98.1	Very high	96.1	Very high	73 Å²	73	50 Å²	50	45%	0.448	33%	0.328	S	S	.	.			trans	-105.7	119.9	176.2	-61.3	0	0	0	0	110.1	K81 L82 T83	T17-K81 HydrophobicContact CG2-CB 4.49Å; T17-L82 CarbonylContact C-O 3.46Å; T17-L82 WeakPolarHBondContact CA-O 3.44Å; T17-T83 HydrophobicContact CG2-CG2 4.17Å
18	L	98.1	Very high	95.6	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	130	168.6	169.2	63.3	0	0	0	109.3	P9 V12 L20 K81 L82 V85 Y93 V116	P9-L18 HydrophobicContact CG-CD1 3.67Å; V12-L18 HydrophobicContact CG2-CB 4.36Å; V12-L18 HydrophobicContact CG2-CD1 3.84Å; L18-L20 HydrophobicContact CD1-CD2 3.7Å; L18-L20 HydrophobicContact CD1-CG 3.93Å; L18-L20 HydrophobicContact CD2-CD1 4.28Å; L18-L20 HydrophobicContact CD2-CG 4.3Å; L18-L20 HydrophobicContact CG-CD2 4.38Å; L18-L20 HydrophobicContact CG-CG 4.06Å; L18-K81 CarbonylContact O-C 3.46Å; L18-K81 WeakPolarHBondContact O-CA 3.37Å; L18-L82 HydrophobicContact CB-CB 4.27Å; L18-L82 HydrophobicContact CD2-CD2 4.42Å; L18-L82 PolarHBondContact N-O 3.05Å; L18-L82 PolarHBondContact O-N 2.98Å; L18-V85 HydrophobicContact CB-CG2 3.78Å; L18-Y93 HydrophobicContact CD2-CE1 4.23Å; L18-Y93 HydrophobicContact CD2-CE2 4.09Å; L18-V116 HydrophobicContact CD1-CG1 3.82Å; L18-V116 HydrophobicContact CD1-CG2 4.04Å; L18-V116 HydrophobicContact CD2-CB 4.47Å; L18-V116 HydrophobicContact CD2-CG1 4.02Å; L18-V116 HydrophobicContact CD2-CG2 4.27Å
19	S	98.2	Very high	95.3	Very high	55 Å²	55	47.3 Å²	47.3	39%	0.385	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	115.6	172.8	-63.4	0	0	0	0	110	P9 L80	P9-S19 VanDerWaalsContact CD-O 3.23Å; P9-S19 WeakPolarHBondContact CD-O 3.34Å; S19-L80 CarbonylContact C-O 3.59Å; S19-L80 WeakPolarHBondContact CA-O 3.31Å
20	L	98.6	Very high	94.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	150.5	175.5	-59.3	-178.5	0	0	0	110.5	S7 L18 W36 S79 L80 Y93 T114 V116	S7-L20 WeakPolarHBondContact O-CA 3.14Å; L18-L20 HydrophobicContact CD1-CD2 3.7Å; L18-L20 HydrophobicContact CD1-CG 3.93Å; L18-L20 HydrophobicContact CD2-CD1 4.28Å; L18-L20 HydrophobicContact CD2-CG 4.3Å; L18-L20 HydrophobicContact CG-CD2 4.38Å; L18-L20 HydrophobicContact CG-CG 4.06Å; L20-W36 HydrophobicContact CB-CH2 3.73Å; L20-W36 HydrophobicContact CB-CZ2 4.05Å; L20-W36 HydrophobicContact CB-CZ3 4.23Å; L20-W36 HydrophobicContact CD1-CE3 4.48Å; L20-W36 HydrophobicContact CD1-CH2 4.32Å; L20-W36 HydrophobicContact CD1-CZ3 3.98Å; L20-S79 CarbonylContact O-C 3.59Å; L20-S79 VanDerWaalsContact O-CA 3.27Å; L20-S79 WeakPolarHBondContact O-CA 3.41Å; L20-L80 HydrophobicContact CB-CB 4.31Å; L20-L80 HydrophobicContact CD1-CD2 4.23Å; L20-L80 PolarHBondContact N-O 3.12Å; L20-L80 PolarHBondContact O-N 3.28Å; L20-Y93 HydrophobicContact CD1-CD1 3.71Å; L20-Y93 HydrophobicContact CD1-CD2 4.08Å; L20-Y93 HydrophobicContact CD1-CG 3.46Å; L20-Y93 VanDerWaalsContact CD1-CG 3.46Å; L20-T114 HydrophobicContact CD1-CG2 3.99Å; L20-T114 HydrophobicContact CD2-CG2 3.87Å; L20-V116 HydrophobicContact CD1-CG2 4.42Å; L20-V116 HydrophobicContact CD2-CG2 4.04Å
21	T	98.3	Very high	94.3	Very high	35 Å²	35	48.7 Å²	48.7	22%	0.215	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	135.8	173.7	-60.3	0	0	0	0	109.9	E6 S7 Q77 L78	E6-T21 CarbonylContact C-O 3.59Å; E6-T21 WeakPolarHBondContact CA-O 3.31Å; S7-T21 PolarHBondContact N-O 3.29Å; S7-T21 PolarHBondContact O-N 3.03Å; S7-T21 PolarHBondContact OG-O 3.05Å; S7-T21 VanDerWaalsContact OG-O 3.09Å; T21-Q77 HydrophobicContact CG2-CB 3.99Å; T21-Q77 HydrophobicContact CG2-CG 3.85Å; T21-L78 CarbonylContact C-O 3.56Å; T21-L78 WeakPolarHBondContact CA-O 3.34Å
22	C	97.6	Very high	93.9	Very high	0 Å²	0	46 Å²	46	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	118.6	172.2	168.5	0	0	0	0	108.7	Q5 E6 W36 Q77 L78 C95	Q5-C22 WeakPolarHBondContact O-CA 3.32Å; E6-C22 HydrophobicContact CG-CB 4.48Å; C22-W36 HydrophobicContact CB-CH2 3.84Å; C22-W36 HydrophobicContact CB-CZ2 3.63Å; C22-Q77 WeakPolarHBondContact O-CA 3.49Å; C22-L78 HydrophobicContact CB-CB 4.29Å; C22-L78 PolarHBondContact N-O 3.34Å; C22-L78 PolarHBondContact O-N 3.23Å; C22-C95 HydrophobicContact CB-CB 3.38Å; C22-C95 WeakPolarHBondContact CB-SG 3.36Å; C22-C95 WeakPolarHBondContact SG-CB 3.39Å; C22-C95 CovalentContact SG-SG 2.02Å; C22-C95 PolarHBondContact SG-SG 2.89Å
23	T	97.3	Very high	93.5	Very high	39 Å²	39	48 Å²	48	24%	0.239	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	128.7	176.4	-57.6	0	0	0	0	109.5	Q5 Q77	Q5-T23 PolarHBondContact N-O 3.23Å; Q5-T23 PolarHBondContact O-N 2.96Å; T23-Q77 HydrophobicContact CG2-CG 4.4Å; T23-Q77 PolarHBondContact OG1-NE2 2.87Å
24	V	95.4	Very high	93.3	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.024	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	125.4	178.2	-176.6	0	0	0	0	109	V2 L4 D27 I29 W34 N76	V2-V24 HydrophobicContact CG1-CG1 4.44Å; L4-V24 HydrophobicContact CD2-CB 4.2Å; L4-V24 HydrophobicContact CD2-CG1 3.98Å; L4-V24 HydrophobicContact CD2-CG2 3.83Å; V24-D27 HydrophobicContact CG1-CB 4.32Å; V24-I29 HydrophobicContact CG2-CD1 3.87Å; V24-I29 HydrophobicContact CG2-CG1 4.14Å; V24-W34 HydrophobicContact CB-CH2 4.44Å; V24-W34 HydrophobicContact CG1-CH2 3.57Å; V24-W34 HydrophobicContact CG1-CZ2 4.06Å; V24-W34 HydrophobicContact CG1-CZ3 4.21Å; V24-W34 HydrophobicContact CG2-CE3 4.2Å; V24-W34 HydrophobicContact CG2-CH2 3.98Å; V24-W34 HydrophobicContact CG2-CZ2 4.39Å; V24-W34 HydrophobicContact CG2-CZ3 3.89Å; V24-N76 WeakPolarHBondContact CB-O 3.44Å; V24-N76 PolarHBondContact N-O 2.78Å; V24-N76 PolarHBondContact O-ND2 2.75Å
25	S	94.8	Very high	93.3	Very high	63 Å²	63	40.1 Å²	40.1	44%	0.441	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	141.1	175	-65.1	0	0	0	0	111	V2 Q3 D27	V2-S25 CarbonylContact C-O 3.56Å; V2-S25 WeakPolarHBondContact CA-O 3.41Å; Q3-S25 PolarHBondContact N-O 3.49Å; Q3-S25 PolarHBondContact O-N 3.25Å; S25-D27 VanDerWaalsContact C-N 3.33Å
26	G	91.1	Very high	93.3	Very high	65 Å²	65	35.3 Å²	35.3	67%	0.67	22%	0.22	S	C	*	.	S	Bend	trans	78	11.6	177.1	0	0	0	0	0	115.6
27	D	86.8	Confident	93.3	Very high	46 Å²	46	31 Å²	31	25%	0.246	20%	0.2	C	C	.	.	S	Bend	trans	-154.7	168.6	172.2	-157	-6.3	0	0	0	110.5	V2 V24 S25 F32 N76 R97	V2-D27 HydrophobicContact CB-CB 4.47Å; V2-D27 HydrophobicContact CG1-CB 3.88Å; V2-D27 HydrophobicContact CG2-CB 3.81Å; V24-D27 HydrophobicContact CG1-CB 4.32Å; S25-D27 VanDerWaalsContact C-N 3.33Å; D27-F32 WeakPolarHBondContact OD2-CE2 3.3Å; D27-N76 PolarHBondContact O-ND2 2.79Å; D27-R97 IonicContact OD2-CZ 2.79Å; D27-R97 IonicContact OD2-NH1 3.59Å; D27-R97 PolarHBondContact OD2-NH1 2.91Å
28	S	88.7	Confident	93.3	Very high	46 Å²	46	28.2 Å²	28.2	32%	0.322	18%	0.181	S	C	.	.			trans	-98.3	131.6	172.9	-173.7	0	0	0	0	111.8	N30 S31	S28-N30 PolarHBondContact O-N 2.73Å; S28-N30 VanDerWaalsContact O-N 3.12Å; S28-N30 PolarHBondContact OG-N 3.27Å; S28-S31 PolarHBondContact O-N 3.14Å
29	I	89.5	Confident	93.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-66.5	-13.3	176.5	-148.4	167.4	0	0	0	112.9	V24 W34 L71 T73 N76 Q77 L78	V24-I29 HydrophobicContact CG2-CD1 3.87Å; V24-I29 HydrophobicContact CG2-CG1 4.14Å; I29-W34 VanDerWaalsContact CG1-CD1 3.47Å; I29-W34 HydrophobicContact CG1-CD2 3.94Å; I29-W34 HydrophobicContact CG1-CG 3.82Å; I29-W34 HydrophobicContact CG1-CZ2 4.33Å; I29-W34 VanDerWaalsContact O-CD1 3.28Å; I29-W34 PolarHBondContact O-NE1 3.07Å; I29-L71 HydrophobicContact CD1-CD2 3.22Å; I29-L71 HydrophobicContact CG1-CD2 3.49Å; I29-L71 VanDerWaalsContact CG1-CD2 3.49Å; I29-L71 HydrophobicContact CG2-CD2 4.49Å; I29-T73 HydrophobicContact CG2-CG2 4.26Å; I29-N76 VanDerWaalsContact CB-OD1 3.27Å; I29-N76 WeakPolarHBondContact CB-OD1 3.09Å; I29-N76 PolarHBondContact N-OD1 2.62Å; I29-Q77 WeakPolarHBondContact CD1-O 3.45Å; I29-L78 HydrophobicContact CD1-CB 4.08Å
30	N	87.2	Confident	93.2	Very high	57 Å²	57	29.6 Å²	29.6	31%	0.305	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-76.9	-20.9	-178	-69.3	-15.1	0	0	0	114.3	S28 N53 T73	S28-N30 PolarHBondContact O-N 2.73Å; S28-N30 VanDerWaalsContact O-N 3.12Å; S28-N30 PolarHBondContact OG-N 3.27Å; N30-N53 VanDerWaalsContact CG-ND2 3.32Å; N30-N53 PolarHBondContact OD1-ND2 2.88Å; N30-T73 VanDerWaalsContact OD1-CB 3.29Å; N30-T73 WeakPolarHBondContact OD1-CB 3.37Å; N30-T73 WeakPolarHBondContact OD1-CG2 3.11Å
31	S	82.3	Confident	93.1	Very high	70 Å²	70	34.2 Å²	34.2	49%	0.49	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-96.8	-4.5	-166.6	-60.7	0	0	0	0	114.1	S28	S28-S31 PolarHBondContact O-N 3.14Å
32	F	87.6	Confident	93.1	Very high	45 Å²	45	37 Å²	37	20%	0.197	25%	0.248	C	C	.	.	S	Bend	trans	-142.5	162.9	-170.8	-59.1	-80.4	0	0	0	112.5	D27 W34 Y52 R97 Q99	D27-F32 WeakPolarHBondContact OD2-CE2 3.3Å; F32-W34 HydrophobicContact CB-CZ2 4.22Å; F32-W34 HydrophobicContact CD2-CZ2 4.25Å; F32-W34 PolarHBondContact O-NE1 3.48Å; F32-Y52 WeakPolarHBondContact O-CD2 3.21Å; F32-R97 HydrophobicContact CB-CG 3.62Å; F32-R97 HydrophobicContact CD1-CG 4.23Å; F32-R97 HydrophobicContact CD2-CG 4.4Å; F32-R97 HydrophobicContact CG-CG 3.84Å; F32-Q99 HydrophobicContact CD1-CG 4.5Å; F32-Q99 HydrophobicContact CE1-CG 4.33Å
33	Y	89.8	Confident	93	Very high	48 Å²	48	43.7 Å²	43.7	19%	0.188	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	135.6	166.3	-75.1	-92.4	0	0	0	108.6	Y50 Y52 Y98 N100	Y33-Y50 AromaticContact CD1-CD2 3.49Å; Y33-Y50 HydrophobicContact CD1-CD2 3.49Å; Y33-Y50 VanDerWaalsContact CD1-CD2 3.49Å; Y33-Y50 AromaticContact CD1-CE2 3.65Å; Y33-Y50 HydrophobicContact CD1-CE2 3.65Å; Y33-Y50 HydrophobicContact CD1-CG 4.44Å; Y33-Y50 HydrophobicContact CE1-CD2 4.05Å; Y33-Y50 AromaticContact CE1-CE2 3.74Å; Y33-Y50 HydrophobicContact CE1-CE2 3.74Å; Y33-Y52 VanDerWaalsContact CD1-CB 3.49Å; Y33-Y52 HydrophobicContact CD1-CG 4.43Å; Y33-Y52 HydrophobicContact CD2-CD2 4.18Å; Y33-Y52 HydrophobicContact CE1-CG 4.19Å; Y33-Y52 HydrophobicContact CE2-CD2 4.22Å; Y33-Y52 HydrophobicContact CE2-CG 4.29Å; Y33-Y52 HydrophobicContact CG-CD2 4.4Å; Y33-Y98 PolarHBondContact O-N 2.87Å; Y33-N100 HydrophobicContact CD2-CB 4.38Å; Y33-N100 HydrophobicContact CE2-CB 4.25Å
34	W	92.3	Very high	92.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	136.7	-179.9	-61.3	92.2	0	0	0	109.3	L4 V24 I29 F32 Y50 M51 L71 L78 G96 R97	L4-W34 HydrophobicContact CD1-CZ3 4.09Å; L4-W34 HydrophobicContact CD2-CE3 4.42Å; L4-W34 HydrophobicContact CD2-CH2 4.07Å; L4-W34 HydrophobicContact CD2-CZ3 3.47Å; L4-W34 VanDerWaalsContact CD2-CZ3 3.47Å; L4-W34 HydrophobicContact CG-CZ3 4.44Å; V24-W34 HydrophobicContact CB-CH2 4.44Å; V24-W34 HydrophobicContact CG1-CH2 3.57Å; V24-W34 HydrophobicContact CG1-CZ2 4.06Å; V24-W34 HydrophobicContact CG1-CZ3 4.21Å; V24-W34 HydrophobicContact CG2-CE3 4.2Å; V24-W34 HydrophobicContact CG2-CH2 3.98Å; V24-W34 HydrophobicContact CG2-CZ2 4.39Å; V24-W34 HydrophobicContact CG2-CZ3 3.89Å; I29-W34 VanDerWaalsContact CG1-CD1 3.47Å; I29-W34 HydrophobicContact CG1-CD2 3.94Å; I29-W34 HydrophobicContact CG1-CG 3.82Å; I29-W34 HydrophobicContact CG1-CZ2 4.33Å; I29-W34 VanDerWaalsContact O-CD1 3.28Å; I29-W34 PolarHBondContact O-NE1 3.07Å; F32-W34 HydrophobicContact CB-CZ2 4.22Å; F32-W34 HydrophobicContact CD2-CZ2 4.25Å; F32-W34 PolarHBondContact O-NE1 3.48Å; W34-Y50 CarbonylContact O-C 3.6Å; W34-Y50 WeakPolarHBondContact O-CA 3.42Å; W34-Y50 WeakPolarHBondContact O-CB 3.45Å; W34-M51 PolarHBondContact N-O 3.27Å; W34-M51 PolarHBondContact O-N 3.38Å; W34-L71 HydrophobicContact CB-CD2 4.48Å; W34-L78 HydrophobicContact CB-CD1 4.03Å; W34-L78 HydrophobicContact CB-CD2 3.98Å; W34-L78 HydrophobicContact CB-CG 4.46Å; W34-G96 WeakPolarHBondContact CA-O 3.37Å; W34-R97 HydrophobicContact CE3-CB 3.92Å; W34-R97 HydrophobicContact CE3-CG 4.3Å; W34-R97 HydrophobicContact CH2-CB 3.93Å; W34-R97 HydrophobicContact CH2-CG 3.88Å; W34-R97 HydrophobicContact CZ2-CG 4.08Å; W34-R97 HydrophobicContact CZ3-CB 3.56Å; W34-R97 HydrophobicContact CZ3-CG 3.98Å
35	G	94.1	Very high	92.9	Very high	0 Å²	0	49 Å²	49	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	168.9	-176	0	0	0	0	0	114.1	G49 C95 G96	G35-G49 CarbonylContact C-O 3.46Å; G35-G49 WeakPolarHBondContact CA-O 3.11Å; G35-C95 CarbonylContact O-C 3.55Å; G35-C95 VanDerWaalsContact O-CA 3.29Å; G35-C95 WeakPolarHBondContact O-CA 3.49Å; G35-G96 PolarHBondContact N-O 2.76Å; G35-G96 PolarHBondContact O-N 2.95Å
36	W	97.1	Very high	92.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	143.7	177.4	-75.3	95.5	0	0	0	110.6	E6 L20 C22 I48 G49 L78 L80 Y94 C95	E6-W36 HydrophobicContact CB-CH2 4.3Å; E6-W36 HydrophobicContact CB-CZ3 4.47Å; E6-W36 HydrophobicContact CG-CH2 3.82Å; E6-W36 HydrophobicContact CG-CZ3 3.76Å; L20-W36 HydrophobicContact CB-CH2 3.73Å; L20-W36 HydrophobicContact CB-CZ2 4.05Å; L20-W36 HydrophobicContact CB-CZ3 4.23Å; L20-W36 HydrophobicContact CD1-CE3 4.48Å; L20-W36 HydrophobicContact CD1-CH2 4.32Å; L20-W36 HydrophobicContact CD1-CZ3 3.98Å; C22-W36 HydrophobicContact CB-CH2 3.84Å; C22-W36 HydrophobicContact CB-CZ2 3.63Å; W36-I48 HydrophobicContact CB-CB 4.13Å; W36-I48 HydrophobicContact CB-CD1 4.16Å; W36-I48 WeakPolarHBondContact O-CB 3.25Å; W36-I48 PolarHBondContact O-N 3.05Å; W36-G49 PolarHBondContact N-O 3.28Å; W36-G49 PolarHBondContact O-N 2.9Å; W36-L78 HydrophobicContact CG-CD2 4.32Å; W36-L78 VanDerWaalsContact NE1-CD2 3.27Å; W36-L80 HydrophobicContact CB-CD2 4.28Å; W36-L80 HydrophobicContact CD2-CB 3.94Å; W36-L80 HydrophobicContact CD2-CD2 4.13Å; W36-L80 HydrophobicContact CE3-CD2 4.38Å; W36-L80 HydrophobicContact CG-CB 3.96Å; W36-L80 HydrophobicContact CG-CD1 4.44Å; W36-L80 HydrophobicContact CG-CD2 4.09Å; W36-L80 HydrophobicContact CG-CG 4.4Å; W36-L80 HydrophobicContact CZ2-CB 4.27Å; W36-Y94 WeakPolarHBondContact CA-O 3.49Å; W36-Y94 VanDerWaalsContact CE3-O 3.26Å; W36-C95 HydrophobicContact CD2-CB 4.32Å; W36-C95 HydrophobicContact CE3-CB 4.27Å; W36-C95 HydrophobicContact CH2-CB 4.26Å; W36-C95 HydrophobicContact CZ2-CB 4.31Å; W36-C95 HydrophobicContact CZ3-CB 4.24Å
37	I	96.7	Very high	93.1	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.015	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.7	178.6	-55.5	90.4	0	0	0	106.2	L45 E46 Y93 Y94 M107 W110	I37-L45 HydrophobicContact CG2-CB 3.9Å; I37-L45 HydrophobicContact CG2-CD2 3.76Å; I37-L45 HydrophobicContact CG2-CG 4.36Å; I37-E46 WeakPolarHBondContact CA-O 3.44Å; I37-E46 WeakPolarHBondContact CG2-O 3.33Å; I37-Y93 CarbonylContact O-C 3.53Å; I37-Y93 WeakPolarHBondContact O-CA 3.32Å; I37-Y94 PolarHBondContact N-O 3.09Å; I37-Y94 PolarHBondContact O-N 2.9Å; I37-M107 HydrophobicContact CD1-CE 3.42Å; I37-M107 VanDerWaalsContact CD1-CE 3.42Å; I37-M107 HydrophobicContact CD1-SD 3.22Å; I37-M107 WeakPolarHBondContact CD1-SD 3.46Å; I37-M107 HydrophobicContact CG1-CE 3.65Å; I37-M107 HydrophobicContact CG1-SD 4.15Å; I37-W110 HydrophobicContact CB-CH2 4.17Å; I37-W110 HydrophobicContact CB-CZ3 3.96Å; I37-W110 HydrophobicContact CD1-CE3 4.5Å; I37-W110 HydrophobicContact CD1-CH2 3.85Å; I37-W110 HydrophobicContact CD1-CZ3 3.78Å; I37-W110 HydrophobicContact CG1-CH2 3.86Å; I37-W110 HydrophobicContact CG1-CZ3 4.01Å; I37-W110 HydrophobicContact CG2-CH2 4.16Å; I37-W110 HydrophobicContact CG2-CZ3 4.2Å
38	R	97.4	Very high	93.6	Very high	16 Å²	16	46.8 Å²	46.8	6%	0.06	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	152.4	170.7	65.5	179.6	-172.7	-179.7	6	111.7	E46 I48 D89 A91 V92 Y93	R38-E46 HydrophobicContact CG-CB 4.15Å; R38-E46 IonicContact CZ-OE2 3.66Å; R38-E46 PolarHBondContact N-O 3.34Å; R38-E46 IonicContact NE-OE2 3.57Å; R38-E46 PolarHBondContact NE-OE2 2.94Å; R38-E46 IonicContact NH2-OE1 3.71Å; R38-E46 IonicContact NH2-OE2 2.82Å; R38-E46 PolarHBondContact NH2-OE2 2.9Å; R38-E46 PolarHBondContact O-N 3.08Å; R38-I48 HydrophobicContact CB-CD1 3.98Å; R38-I48 HydrophobicContact CG-CD1 3.99Å; R38-I48 HydrophobicContact CG-CG1 4.08Å; R38-D89 IonicContact CZ-OD1 3.21Å; R38-D89 IonicContact NH1-OD1 2.75Å; R38-D89 PolarHBondContact NH1-OD1 2.99Å; R38-A91 HydrophobicContact CB-CB 3.81Å; R38-A91 HydrophobicContact CG-CB 4.38Å; R38-V92 CarbonylContact C-O 3.57Å; R38-V92 WeakPolarHBondContact CA-O 3.36Å; R38-Y93 HydrophobicContact CB-CD1 3.87Å; R38-Y93 HydrophobicContact CB-CE1 3.85Å; R38-Y93 HydrophobicContact CB-CG 4.26Å; R38-Y93 HydrophobicContact CG-CE1 4.49Å
39	Q	98.1	Very high	93.8	Very high	75 Å²	75	44.6 Å²	44.6	35%	0.35	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	100.9	171.6	-168.5	175	22.4	0	0	109.6	K43 L45 A91 V92 Y94	Q39-K43 WeakPolarHBondContact CG-O 3.4Å; Q39-K43 PolarHBondContact NE2-O 3.12Å; Q39-L45 HydrophobicContact CB-CD2 3.96Å; Q39-L45 HydrophobicContact CG-CD2 4.44Å; Q39-A91 VanDerWaalsContact O-CA 3.31Å; Q39-A91 WeakPolarHBondContact O-CA 3.23Å; Q39-A91 WeakPolarHBondContact O-CB 3.39Å; Q39-V92 PolarHBondContact N-O 2.82Å; Q39-V92 PolarHBondContact O-N 2.91Å; Q39-Y94 HydrophobicContact CB-CE2 4.02Å
40	P	97.6	Very high	94	Very high	10 Å²	10	47.7 Å²	47.7	7%	0.065	27%	0.274	C	S	.	.			trans	-64.7	151.3	170.6	-19.2	31.9	0	0	0	111.2	G42 K43 A91	P40-G42 PolarHBondContact O-N 2.8Å; P40-K43 HydrophobicContact CB-CB 4.14Å; P40-K43 HydrophobicContact CB-CD 4.01Å; P40-K43 HydrophobicContact CB-CG 4.24Å; P40-K43 HydrophobicContact CG-CB 4.38Å; P40-K43 HydrophobicContact CG-CD 4.25Å; P40-K43 PolarHBondContact O-N 2.92Å; P40-A91 HydrophobicContact CG-CB 4.43Å
41	P	96.7	Very high	94.1	Very high	97 Å²	97	46.3 Å²	46.3	63%	0.63	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	129.8	176.5	-25.6	33.7	0	0	0	112.2	K43 T90	P41-K43 PolarHBondContact O-N 3.41Å; P41-T90 VanDerWaalsContact CD-O 3.23Å; P41-T90 WeakPolarHBondContact CD-O 3.29Å; P41-T90 HydrophobicContact CG-CG2 4.29Å
42	G	96.9	Very high	94.5	Very high	93 Å²	93	46.9 Å²	46.9	96%	0.959	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	10.8	179.8	0	0	0	0	0	115.2	P40	P40-G42 PolarHBondContact O-N 2.8Å
43	K	96	Very high	94.3	Very high	140 Å²	140	47.8 Å²	47.8	61%	0.609	27%	0.265	S	S	*	.	S	Bend	trans	-120.2	164.4	178.3	-60.1	-168.5	-175.9	177.4	0	112.1	Q39 P40 P41	Q39-K43 WeakPolarHBondContact CG-O 3.4Å; Q39-K43 PolarHBondContact NE2-O 3.12Å; P40-K43 HydrophobicContact CB-CB 4.14Å; P40-K43 HydrophobicContact CB-CD 4.01Å; P40-K43 HydrophobicContact CB-CG 4.24Å; P40-K43 HydrophobicContact CG-CB 4.38Å; P40-K43 HydrophobicContact CG-CD 4.25Å; P40-K43 PolarHBondContact O-N 2.92Å; P41-K43 PolarHBondContact O-N 3.41Å
44	G	94.8	Very high	93.8	Very high	55 Å²	55	49 Å²	49	57%	0.567	29%	0.292	S	S	*	.			trans	-71.5	174.7	170.1	0	0	0	0	0	112.6	E46	G44-E46 PolarHBondContact O-N 2.82Å
45	L	95.2	Very high	92.9	Very high	101 Å²	101	52.1 Å²	52.1	53%	0.529	32%	0.324	S	S	.	.			trans	-64.9	131.3	173.7	-68.7	166.4	0	0	0	110.5	I37 Q39 Y94 W110	I37-L45 HydrophobicContact CG2-CB 3.9Å; I37-L45 HydrophobicContact CG2-CD2 3.76Å; I37-L45 HydrophobicContact CG2-CG 4.36Å; Q39-L45 HydrophobicContact CB-CD2 3.96Å; Q39-L45 HydrophobicContact CG-CD2 4.44Å; L45-Y94 HydrophobicContact CD2-CD2 4.25Å; L45-Y94 HydrophobicContact CD2-CE2 4.14Å; L45-W110 HydrophobicContact CD1-CH2 4.15Å
46	E	95.7	Very high	92.4	Very high	52 Å²	52	54.8 Å²	54.8	24%	0.243	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	115.8	174.8	-176	-177	-166.4	0	0	108.9	I37 R38 G44	I37-E46 WeakPolarHBondContact CA-O 3.44Å; I37-E46 WeakPolarHBondContact CG2-O 3.33Å; R38-E46 HydrophobicContact CG-CB 4.15Å; R38-E46 IonicContact CZ-OE2 3.66Å; R38-E46 PolarHBondContact N-O 3.34Å; R38-E46 IonicContact NE-OE2 3.57Å; R38-E46 PolarHBondContact NE-OE2 2.94Å; R38-E46 IonicContact NH2-OE1 3.71Å; R38-E46 IonicContact NH2-OE2 2.82Å; R38-E46 PolarHBondContact NH2-OE2 2.9Å; R38-E46 PolarHBondContact O-N 3.08Å; G44-E46 PolarHBondContact O-N 2.82Å
47	W	94.8	Very high	92	Very high	73 Å²	73	57.4 Å²	57.4	28%	0.277	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	135.5	172.9	174.5	72	0	0	0	110.7	G49 Y50 N58 N60 Y98	W47-G49 VanDerWaalsContact CE2-CA 3.42Å; W47-G49 PolarHBondContact NE1-O 3.06Å; W47-Y50 AromaticContact CE2-CD1 3.87Å; W47-Y50 HydrophobicContact CH2-CD1 4.36Å; W47-Y50 HydrophobicContact CH2-CE1 4.38Å; W47-Y50 AromaticContact CZ2-CD1 3.33Å; W47-Y50 HydrophobicContact CZ2-CD1 3.33Å; W47-Y50 AromaticContact CZ2-CE1 3.74Å; W47-Y50 HydrophobicContact CZ2-CE1 3.74Å; W47-Y50 HydrophobicContact CZ2-CG 4.18Å; W47-Y50 AromaticContact NE1-CD1 3.91Å; W47-N58 HydrophobicContact CH2-CB 3.92Å; W47-N58 HydrophobicContact CZ2-CB 4.24Å; W47-N60 HydrophobicContact CE3-CB 3.85Å; W47-N60 HydrophobicContact CZ3-CB 4.03Å; W47-N60 VanDerWaalsContact O-CB 3.25Å; W47-N60 WeakPolarHBondContact O-CB 2.92Å; W47-N60 PolarHBondContact O-ND2 3.48Å; W47-Y98 PolarHBondContact NE1-OH 2.91Å
48	I	96.4	Very high	91.7	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.01	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-48.9	179.1	-63.8	177.5	0	0	0	110.9	W36 R38 N60 L63 V67 L80 Y93	W36-I48 HydrophobicContact CB-CB 4.13Å; W36-I48 HydrophobicContact CB-CD1 4.16Å; W36-I48 WeakPolarHBondContact O-CB 3.25Å; W36-I48 PolarHBondContact O-N 3.05Å; R38-I48 HydrophobicContact CB-CD1 3.98Å; R38-I48 HydrophobicContact CG-CD1 3.99Å; R38-I48 HydrophobicContact CG-CG1 4.08Å; I48-N60 PolarHBondContact O-N 3.06Å; I48-L63 HydrophobicContact CB-CD1 4.38Å; I48-L63 HydrophobicContact CG1-CD1 3.98Å; I48-L63 HydrophobicContact CG2-CD1 4.3Å; I48-V67 HydrophobicContact CG2-CB 4.41Å; I48-V67 HydrophobicContact CG2-CG1 3.73Å; I48-V67 HydrophobicContact CG2-CG2 3.93Å; I48-L80 HydrophobicContact CD1-CD2 3.94Å; I48-L80 HydrophobicContact CG2-CD1 3.97Å; I48-Y93 HydrophobicContact CD1-CD1 3.79Å; I48-Y93 HydrophobicContact CD1-CE1 3.69Å
49	G	93.9	Very high	91.6	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.7	163.5	-171.8	0	0	0	0	0	111.8	G35 W36 W47 N58 I69	G35-G49 CarbonylContact C-O 3.46Å; G35-G49 WeakPolarHBondContact CA-O 3.11Å; W36-G49 PolarHBondContact N-O 3.28Å; W36-G49 PolarHBondContact O-N 2.9Å; W47-G49 VanDerWaalsContact CE2-CA 3.42Å; W47-G49 PolarHBondContact NE1-O 3.06Å; G49-N58 CarbonylContact C-O 3.6Å; G49-N58 WeakPolarHBondContact CA-O 3.32Å; G49-I69 VanDerWaalsContact C-CD1 3.47Å
50	Y	92.9	Very high	91.4	Very high	64 Å²	64	59.9 Å²	59.9	25%	0.251	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	159.9	169.9	66.9	-109.2	0	0	0	110.7	Y33 W34 W47 T57 N58	Y33-Y50 AromaticContact CD1-CD2 3.49Å; Y33-Y50 HydrophobicContact CD1-CD2 3.49Å; Y33-Y50 VanDerWaalsContact CD1-CD2 3.49Å; Y33-Y50 AromaticContact CD1-CE2 3.65Å; Y33-Y50 HydrophobicContact CD1-CE2 3.65Å; Y33-Y50 HydrophobicContact CD1-CG 4.44Å; Y33-Y50 HydrophobicContact CE1-CD2 4.05Å; Y33-Y50 AromaticContact CE1-CE2 3.74Å; Y33-Y50 HydrophobicContact CE1-CE2 3.74Å; W34-Y50 CarbonylContact O-C 3.6Å; W34-Y50 WeakPolarHBondContact O-CA 3.42Å; W34-Y50 WeakPolarHBondContact O-CB 3.45Å; W47-Y50 AromaticContact CE2-CD1 3.87Å; W47-Y50 HydrophobicContact CH2-CD1 4.36Å; W47-Y50 HydrophobicContact CH2-CE1 4.38Å; W47-Y50 AromaticContact CZ2-CD1 3.33Å; W47-Y50 HydrophobicContact CZ2-CD1 3.33Å; W47-Y50 AromaticContact CZ2-CE1 3.74Å; W47-Y50 HydrophobicContact CZ2-CE1 3.74Å; W47-Y50 HydrophobicContact CZ2-CG 4.18Å; W47-Y50 AromaticContact NE1-CD1 3.91Å; Y50-T57 WeakPolarHBondContact O-CA 3.38Å; Y50-T57 WeakPolarHBondContact O-CG2 3.35Å; Y50-N58 HydrophobicContact CD1-CB 4.33Å; Y50-N58 HydrophobicContact CD2-CB 4.5Å; Y50-N58 HydrophobicContact CE1-CB 3.68Å; Y50-N58 HydrophobicContact CE2-CB 3.91Å; Y50-N58 VanDerWaalsContact CZ-CB 3.44Å; Y50-N58 PolarHBondContact N-O 2.94Å; Y50-N58 PolarHBondContact O-N 2.91Å
51	M	90.9	Very high	91.3	Very high	29 Å²	29	64.7 Å²	64.7	14%	0.143	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	144.9	173.4	-169.4	156.7	82.3	0	0	111.4	W34 S56 T57 I69 S70 L71	W34-M51 PolarHBondContact N-O 3.27Å; W34-M51 PolarHBondContact O-N 3.38Å; M51-S56 CarbonylContact C-O 3.59Å; M51-S56 WeakPolarHBondContact CA-O 3.45Å; M51-T57 HydrophobicContact CB-CG2 4.19Å; M51-T57 HydrophobicContact CG-CG2 4.28Å; M51-T57 VanDerWaalsContact CG-OG1 3.25Å; M51-T57 WeakPolarHBondContact CG-OG1 3.21Å; M51-T57 HydrophobicContact SD-CG2 4.23Å; M51-T57 PolarHBondContact SD-OG1 2.89Å; M51-I69 HydrophobicContact CB-CG2 4.07Å; M51-S70 VanDerWaalsContact CE-C 3.43Å; M51-S70 VanDerWaalsContact CE-CA 3.49Å; M51-L71 HydrophobicContact CB-CD1 4.35Å; M51-L71 HydrophobicContact CE-CB 3.5Å; M51-L71 VanDerWaalsContact CE-CB 3.5Å; M51-L71 HydrophobicContact CE-CD1 3.71Å; M51-L71 HydrophobicContact CE-CG 3.33Å; M51-L71 HydrophobicContact CG-CD1 4.07Å
52	Y	89.1	Confident	91.2	Very high	81 Å²	81	64.6 Å²	64.6	32%	0.318	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.4	167.6	177.6	-105.5	0	0	0	110.3	F32 Y33 G54 G55 S56	F32-Y52 WeakPolarHBondContact O-CD2 3.21Å; Y33-Y52 VanDerWaalsContact CD1-CB 3.49Å; Y33-Y52 HydrophobicContact CD1-CG 4.43Å; Y33-Y52 HydrophobicContact CD2-CD2 4.18Å; Y33-Y52 HydrophobicContact CE1-CG 4.19Å; Y33-Y52 HydrophobicContact CE2-CD2 4.22Å; Y33-Y52 HydrophobicContact CE2-CG 4.29Å; Y33-Y52 HydrophobicContact CG-CD2 4.4Å; Y52-G54 PolarHBondContact O-N 2.79Å; Y52-G54 VanDerWaalsContact O-N 3.13Å; Y52-G55 PolarHBondContact O-N 2.85Å; Y52-S56 PolarHBondContact N-O 2.81Å
53	N	83.6	Confident	91.1	Very high	65 Å²	65	60.4 Å²	60.4	35%	0.348	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	111.5	175	-174.3	33.6	0	0	0	110.2	N30 L71	N30-N53 VanDerWaalsContact CG-ND2 3.32Å; N30-N53 PolarHBondContact OD1-ND2 2.88Å; N53-L71 HydrophobicContact CB-CD1 4.31Å
54	G	79.3	Confident	91	Very high	74 Å²	74	60 Å²	60	76%	0.763	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	124.1	2.6	-169.5	0	0	0	0	0	114.4	Y52	Y52-G54 PolarHBondContact O-N 2.79Å; Y52-G54 VanDerWaalsContact O-N 3.13Å
55	G	73.1	Confident	91.1	Very high	64 Å²	64	62.7 Å²	62.7	66%	0.66	37%	0.369	S	S	*	.	S	Bend	trans	105.4	3.1	160.5	0	0	0	0	0	116.3	Y52 T57	Y52-G55 PolarHBondContact O-N 2.85Å; G55-T57 PolarHBondContact O-N 2.94Å
56	S	83.3	Confident	91.1	Very high	56 Å²	56	60.2 Å²	60.2	39%	0.392	35%	0.352	S	S	.	.			trans	-83.2	108.5	172.7	-67.5	0	0	0	0	110.2	M51 Y52	M51-S56 CarbonylContact C-O 3.59Å; M51-S56 WeakPolarHBondContact CA-O 3.45Å; Y52-S56 PolarHBondContact N-O 2.81Å
57	T	88.9	Confident	91.2	Very high	55 Å²	55	58.1 Å²	58.1	34%	0.337	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136.3	178.8	-49.2	0	0	0	0	109.9	Y50 M51 G55 Y59	Y50-T57 WeakPolarHBondContact O-CA 3.38Å; Y50-T57 WeakPolarHBondContact O-CG2 3.35Å; M51-T57 HydrophobicContact CB-CG2 4.19Å; M51-T57 HydrophobicContact CG-CG2 4.28Å; M51-T57 VanDerWaalsContact CG-OG1 3.25Å; M51-T57 WeakPolarHBondContact CG-OG1 3.21Å; M51-T57 HydrophobicContact SD-CG2 4.23Å; M51-T57 PolarHBondContact SD-OG1 2.89Å; G55-T57 PolarHBondContact O-N 2.94Å; T57-Y59 HydrophobicContact CG2-CD2 4.27Å; T57-Y59 HydrophobicContact CG2-CE1 4.17Å; T57-Y59 HydrophobicContact CG2-CE2 3.5Å; T57-Y59 VanDerWaalsContact CG2-CZ 3.46Å; T57-Y59 WeakPolarHBondContact CG2-OH 3.49Å
58	N	91.8	Very high	91.3	Very high	75 Å²	75	58.3 Å²	58.3	40%	0.401	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	149.7	173.4	-157.9	-20.8	0	0	0	109.8	W47 G49 Y50	W47-N58 HydrophobicContact CH2-CB 3.92Å; W47-N58 HydrophobicContact CZ2-CB 4.24Å; G49-N58 CarbonylContact C-O 3.6Å; G49-N58 WeakPolarHBondContact CA-O 3.32Å; Y50-N58 HydrophobicContact CD1-CB 4.33Å; Y50-N58 HydrophobicContact CD2-CB 4.5Å; Y50-N58 HydrophobicContact CE1-CB 3.68Å; Y50-N58 HydrophobicContact CE2-CB 3.91Å; Y50-N58 VanDerWaalsContact CZ-CB 3.44Å; Y50-N58 PolarHBondContact N-O 2.94Å; Y50-N58 PolarHBondContact O-N 2.91Å
59	Y	94.4	Very high	91.3	Very high	45 Å²	45	58.5 Å²	58.5	18%	0.176	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	149.1	-177.1	-62.3	-78.1	0	0	0	109.9	T57 P61 K64 V67 I69	T57-Y59 HydrophobicContact CG2-CD2 4.27Å; T57-Y59 HydrophobicContact CG2-CE1 4.17Å; T57-Y59 HydrophobicContact CG2-CE2 3.5Å; T57-Y59 VanDerWaalsContact CG2-CZ 3.46Å; T57-Y59 WeakPolarHBondContact CG2-OH 3.49Å; Y59-P61 WeakPolarHBondContact O-CD 3.35Å; Y59-K64 HydrophobicContact CD2-CG 4.25Å; Y59-K64 HydrophobicContact CG-CG 4.34Å; Y59-V67 HydrophobicContact CD1-CB 4.42Å; Y59-V67 HydrophobicContact CD1-CG1 3.8Å; Y59-V67 HydrophobicContact CE1-CG1 3.8Å; Y59-I69 HydrophobicContact CD1-CD1 4.23Å; Y59-I69 HydrophobicContact CE1-CB 4.07Å; Y59-I69 HydrophobicContact CE1-CD1 3.91Å; Y59-I69 HydrophobicContact CE1-CG1 3.9Å; Y59-I69 PolarHBondContact OH-N 2.93Å
60	N	94.9	Very high	91.3	Very high	27 Å²	27	61.1 Å²	61.1	14%	0.144	37%	0.372	C	S	.	.			trans	-60.6	122.8	166.8	-177.4	-27.6	0	0	0	108.8	W47 I48 S62 L63 K64	W47-N60 HydrophobicContact CE3-CB 3.85Å; W47-N60 HydrophobicContact CZ3-CB 4.03Å; W47-N60 VanDerWaalsContact O-CB 3.25Å; W47-N60 WeakPolarHBondContact O-CB 2.92Å; W47-N60 PolarHBondContact O-ND2 3.48Å; I48-N60 PolarHBondContact O-N 3.06Å; N60-S62 PolarHBondContact O-N 3.5Å; N60-S62 VanDerWaalsContact O-N 3.08Å; N60-S62 WeakPolarHBondContact OD1-CB 3.22Å; N60-S62 PolarHBondContact OD1-N 3.34Å; N60-L63 HydrophobicContact CB-CB 4.47Å; N60-L63 HydrophobicContact CB-CD1 4.46Å; N60-L63 PolarHBondContact O-N 2.86Å; N60-K64 PolarHBondContact O-N 2.98Å
61	P	95.3	Very high	91.3	Very high	111 Å²	111	59.6 Å²	59.6	72%	0.721	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-34.3	-178	-29	35.8	0	0	0	113.8	Y59 L63	Y59-P61 WeakPolarHBondContact O-CD 3.35Å; P61-L63 VanDerWaalsContact C-N 3.25Å; P61-L63 PolarHBondContact O-N 2.9Å
62	S	93.7	Very high	91.4	Very high	95 Å²	95	60.2 Å²	60.2	66%	0.664	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-18.7	179.4	-59.1	0	0	0	0	114	N60	N60-S62 PolarHBondContact O-N 3.5Å; N60-S62 VanDerWaalsContact O-N 3.08Å; N60-S62 WeakPolarHBondContact OD1-CB 3.22Å; N60-S62 PolarHBondContact OD1-N 3.34Å
63	L	94.8	Very high	91.6	Very high	4 Å²	4	59.6 Å²	59.6	2%	0.021	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-12.6	-177	-61.2	176.2	0	0	0	113.3	I48 N60 P61 S65 R66 V67	I48-L63 HydrophobicContact CB-CD1 4.38Å; I48-L63 HydrophobicContact CG1-CD1 3.98Å; I48-L63 HydrophobicContact CG2-CD1 4.3Å; N60-L63 HydrophobicContact CB-CB 4.47Å; N60-L63 HydrophobicContact CB-CD1 4.46Å; N60-L63 PolarHBondContact O-N 2.86Å; P61-L63 VanDerWaalsContact C-N 3.25Å; P61-L63 PolarHBondContact O-N 2.9Å; L63-S65 PolarHBondContact O-N 3.16Å; L63-R66 PolarHBondContact O-N 2.94Å; L63-V67 HydrophobicContact CB-CG2 3.83Å; L63-V67 WeakPolarHBondContact O-CG2 3.36Å; L63-V67 PolarHBondContact O-N 2.94Å
64	K	94.5	Very high	92.1	Very high	133 Å²	133	61.4 Å²	61.4	58%	0.578	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-30.8	-171.4	-174.5	173.3	-178.2	178.9	0	114.7	Y59 N60 R66	Y59-K64 HydrophobicContact CD2-CG 4.25Å; Y59-K64 HydrophobicContact CG-CG 4.34Å; N60-K64 PolarHBondContact O-N 2.98Å; K64-R66 VanDerWaalsContact C-N 3.32Å
65	S	96	Very high	92.8	Very high	110 Å²	110	63.6 Å²	63.6	77%	0.769	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-17.3	179.5	57.3	0	0	0	0	114.1	L63	L63-S65 PolarHBondContact O-N 3.16Å
66	R	96.8	Very high	93.9	Very high	49 Å²	49	62.1 Å²	62.1	19%	0.185	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-13	-174.7	-59.5	-171.7	-60.3	127.2	-0.5	113.5	L63 K64 L82 T83 S84 D89	L63-R66 PolarHBondContact O-N 2.94Å; K64-R66 VanDerWaalsContact C-N 3.32Å; R66-L82 HydrophobicContact CB-CD1 3.83Å; R66-L82 WeakPolarHBondContact O-CA 3.15Å; R66-T83 WeakPolarHBondContact CA-OG1 3.47Å; R66-T83 PolarHBondContact NH1-O 2.99Å; R66-T83 PolarHBondContact O-N 3.45Å; R66-T83 PolarHBondContact O-OG1 2.02Å; R66-S84 PolarHBondContact NH1-O 2.72Å; R66-S84 VanDerWaalsContact NH1-O 3.12Å; R66-D89 IonicContact CZ-OD1 2.65Å; R66-D89 IonicContact CZ-OD2 2.92Å; R66-D89 IonicContact NH1-OD1 2.91Å; R66-D89 IonicContact NH1-OD2 3.34Å; R66-D89 PolarHBondContact NH1-OD2 2.86Å; R66-D89 IonicContact NH2-OD1 3.29Å; R66-D89 PolarHBondContact NH2-OD1 3.03Å; R66-D89 IonicContact NH2-OD2 3.52Å
67	V	97.1	Very high	94.5	Very high	8 Å²	8	61.8 Å²	61.8	5%	0.048	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	134.3	-173.3	169	0	0	0	0	111.8	I48 Y59 L63 I69 L80 K81 L82	I48-V67 HydrophobicContact CG2-CB 4.41Å; I48-V67 HydrophobicContact CG2-CG1 3.73Å; I48-V67 HydrophobicContact CG2-CG2 3.93Å; Y59-V67 HydrophobicContact CD1-CB 4.42Å; Y59-V67 HydrophobicContact CD1-CG1 3.8Å; Y59-V67 HydrophobicContact CE1-CG1 3.8Å; L63-V67 HydrophobicContact CB-CG2 3.83Å; L63-V67 WeakPolarHBondContact O-CG2 3.36Å; L63-V67 PolarHBondContact O-N 2.94Å; V67-I69 HydrophobicContact CG1-CD1 4.41Å; V67-I69 HydrophobicContact CG1-CG1 4.06Å; V67-L80 HydrophobicContact CG1-CD1 3.55Å; V67-K81 CarbonylContact C-O 3.57Å; V67-K81 WeakPolarHBondContact CA-O 3.49Å; V67-L82 HydrophobicContact CG2-CD1 3.51Å
68	T	96.6	Very high	94.8	Very high	78 Å²	78	59.1 Å²	59.1	48%	0.479	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	126.2	166.4	-56.5	0	0	0	0	109.2	K81	T68-K81 PolarHBondContact N-O 3.39Å; T68-K81 PolarHBondContact O-N 2.96Å
69	I	95.8	Very high	95.1	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	136.9	172.2	-66.2	169.8	0	0	0	108.6	G49 M51 Y59 V67 L78 S79 L80	G49-I69 VanDerWaalsContact C-CD1 3.47Å; M51-I69 HydrophobicContact CB-CG2 4.07Å; Y59-I69 HydrophobicContact CD1-CD1 4.23Å; Y59-I69 HydrophobicContact CE1-CB 4.07Å; Y59-I69 HydrophobicContact CE1-CD1 3.91Å; Y59-I69 HydrophobicContact CE1-CG1 3.9Å; Y59-I69 PolarHBondContact OH-N 2.93Å; V67-I69 HydrophobicContact CG1-CD1 4.41Å; V67-I69 HydrophobicContact CG1-CG1 4.06Å; I69-L78 HydrophobicContact CG2-CD1 3.58Å; I69-L78 HydrophobicContact CG2-CG 4.42Å; I69-S79 WeakPolarHBondContact CA-O 3.34Å; I69-L80 HydrophobicContact CG1-CD1 3.85Å
70	S	94.3	Very high	95.3	Very high	54 Å²	54	54.6 Å²	54.6	38%	0.378	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	152.5	178	60.3	0	0	0	0	112.2	M51 S79	M51-S70 VanDerWaalsContact CE-C 3.43Å; M51-S70 VanDerWaalsContact CE-CA 3.49Å; S70-S79 PolarHBondContact N-O 3.29Å; S70-S79 PolarHBondContact O-N 2.65Å
71	L	93.6	Very high	95.4	Very high	32 Å²	32	58.6 Å²	58.6	17%	0.168	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.8	176.8	-76.7	172.5	0	0	0	108.5	I29 W34 M51 N53 Q77 L78	I29-L71 HydrophobicContact CD1-CD2 3.22Å; I29-L71 HydrophobicContact CG1-CD2 3.49Å; I29-L71 VanDerWaalsContact CG1-CD2 3.49Å; I29-L71 HydrophobicContact CG2-CD2 4.49Å; W34-L71 HydrophobicContact CB-CD2 4.48Å; M51-L71 HydrophobicContact CB-CD1 4.35Å; M51-L71 HydrophobicContact CE-CB 3.5Å; M51-L71 VanDerWaalsContact CE-CB 3.5Å; M51-L71 HydrophobicContact CE-CD1 3.71Å; M51-L71 HydrophobicContact CE-CG 3.33Å; M51-L71 HydrophobicContact CG-CD1 4.07Å; N53-L71 HydrophobicContact CB-CD1 4.31Å; L71-Q77 WeakPolarHBondContact CA-O 3.49Å; L71-L78 HydrophobicContact CD2-CB 4.18Å; L71-L78 HydrophobicContact CD2-CD1 3.5Å; L71-L78 HydrophobicContact CD2-CG 4.47Å; L71-L78 HydrophobicContact CG-CD1 4.05Å
72	D	93.6	Very high	95.6	Very high	43 Å²	43	53.5 Å²	53.5	23%	0.23	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	96.3	168	-174.6	-20.8	0	0	0	108	S74 K75 N76 Q77	D72-S74 PolarHBondContact O-N 2.88Å; D72-S74 WeakPolarHBondContact OD1-CB 3.32Å; D72-S74 PolarHBondContact OD1-N 3.09Å; D72-S74 PolarHBondContact OD1-OG 2.85Å; D72-K75 HydrophobicContact CB-CB 4.43Å; D72-K75 PolarHBondContact O-N 3.39Å; D72-K75 PolarHBondContact OD1-N 3.34Å; D72-K75 WeakPolarHBondContact OD2-CD 3.2Å; D72-K75 WeakPolarHBondContact OD2-CE 3.49Å; D72-K75 IonicContact OD2-NZ 2.77Å; D72-K75 PolarHBondContact OD2-NZ 2.88Å; D72-N76 WeakPolarHBondContact O-CA 3.08Å; D72-N76 PolarHBondContact O-N 3.35Å; D72-Q77 HydrophobicContact CB-CB 4.4Å; D72-Q77 PolarHBondContact N-O 3.02Å; D72-Q77 PolarHBondContact O-N 3.23Å
73	T	92.8	Very high	95.8	Very high	67 Å²	67	51.6 Å²	51.6	41%	0.411	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-22.4	-176.7	64.9	0	0	0	0	112.3	I29 N30 K75	I29-T73 HydrophobicContact CG2-CG2 4.26Å; N30-T73 VanDerWaalsContact OD1-CB 3.29Å; N30-T73 WeakPolarHBondContact OD1-CB 3.37Å; N30-T73 WeakPolarHBondContact OD1-CG2 3.11Å; T73-K75 VanDerWaalsContact C-N 3.34Å
74	S	93.3	Very high	95.9	Very high	103 Å²	103	54.6 Å²	54.6	72%	0.72	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-29.6	177.5	76	0	0	0	0	112.1	D72	D72-S74 PolarHBondContact O-N 2.88Å; D72-S74 WeakPolarHBondContact OD1-CB 3.32Å; D72-S74 PolarHBondContact OD1-N 3.09Å; D72-S74 PolarHBondContact OD1-OG 2.85Å
75	K	95	Very high	96	Very high	121 Å²	121	48.4 Å²	48.4	53%	0.526	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-3.7	178.5	-61.2	-175.1	-164	121.3	0	113.8	D72 T73 Q77	D72-K75 HydrophobicContact CB-CB 4.43Å; D72-K75 PolarHBondContact O-N 3.39Å; D72-K75 PolarHBondContact OD1-N 3.34Å; D72-K75 WeakPolarHBondContact OD2-CD 3.2Å; D72-K75 WeakPolarHBondContact OD2-CE 3.49Å; D72-K75 IonicContact OD2-NZ 2.77Å; D72-K75 PolarHBondContact OD2-NZ 2.88Å; T73-K75 VanDerWaalsContact C-N 3.34Å; K75-Q77 HydrophobicContact CB-CB 4.31Å; K75-Q77 HydrophobicContact CB-CG 4.07Å
76	N	95.3	Very high	96	Very high	33 Å²	33	46.1 Å²	46.1	18%	0.176	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	58	46.8	-175.6	-144.9	38.9	0	0	0	112.2	V24 D27 I29 D72	V24-N76 WeakPolarHBondContact CB-O 3.44Å; V24-N76 PolarHBondContact N-O 2.78Å; V24-N76 PolarHBondContact O-ND2 2.75Å; D27-N76 PolarHBondContact O-ND2 2.79Å; I29-N76 VanDerWaalsContact CB-OD1 3.27Å; I29-N76 WeakPolarHBondContact CB-OD1 3.09Å; I29-N76 PolarHBondContact N-OD1 2.62Å; D72-N76 WeakPolarHBondContact O-CA 3.08Å; D72-N76 PolarHBondContact O-N 3.35Å
77	Q	96.5	Very high	96	Very high	48 Å²	48	47.3 Å²	47.3	22%	0.224	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	139.7	-171.6	-79.1	175.6	-10.5	0	0	113.1	T21 C22 T23 I29 L71 D72 K75	T21-Q77 HydrophobicContact CG2-CB 3.99Å; T21-Q77 HydrophobicContact CG2-CG 3.85Å; C22-Q77 WeakPolarHBondContact O-CA 3.49Å; T23-Q77 HydrophobicContact CG2-CG 4.4Å; T23-Q77 PolarHBondContact OG1-NE2 2.87Å; I29-Q77 WeakPolarHBondContact CD1-O 3.45Å; L71-Q77 WeakPolarHBondContact CA-O 3.49Å; D72-Q77 HydrophobicContact CB-CB 4.4Å; D72-Q77 PolarHBondContact N-O 3.02Å; D72-Q77 PolarHBondContact O-N 3.23Å; K75-Q77 HydrophobicContact CB-CB 4.31Å; K75-Q77 HydrophobicContact CB-CG 4.07Å
78	L	95.9	Very high	95.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.4	168.4	-179.6	75.9	0	0	0	108.8	T21 C22 I29 W34 W36 I69 L71 C95	T21-L78 CarbonylContact C-O 3.56Å; T21-L78 WeakPolarHBondContact CA-O 3.34Å; C22-L78 HydrophobicContact CB-CB 4.29Å; C22-L78 PolarHBondContact N-O 3.34Å; C22-L78 PolarHBondContact O-N 3.23Å; I29-L78 HydrophobicContact CD1-CB 4.08Å; W34-L78 HydrophobicContact CB-CD1 4.03Å; W34-L78 HydrophobicContact CB-CD2 3.98Å; W34-L78 HydrophobicContact CB-CG 4.46Å; W36-L78 HydrophobicContact CG-CD2 4.32Å; W36-L78 VanDerWaalsContact NE1-CD2 3.27Å; I69-L78 HydrophobicContact CG2-CD1 3.58Å; I69-L78 HydrophobicContact CG2-CG 4.42Å; L71-L78 HydrophobicContact CD2-CB 4.18Å; L71-L78 HydrophobicContact CD2-CD1 3.5Å; L71-L78 HydrophobicContact CD2-CG 4.47Å; L71-L78 HydrophobicContact CG-CD1 4.05Å; L78-C95 HydrophobicContact CD2-CB 4.25Å
79	S	97.2	Very high	95.9	Very high	24 Å²	24	46.5 Å²	46.5	17%	0.168	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	147.9	176.8	-54.1	0	0	0	0	111.9	L20 I69 S70	L20-S79 CarbonylContact O-C 3.59Å; L20-S79 VanDerWaalsContact O-CA 3.27Å; L20-S79 WeakPolarHBondContact O-CA 3.41Å; I69-S79 WeakPolarHBondContact CA-O 3.34Å; S70-S79 PolarHBondContact N-O 3.29Å; S70-S79 PolarHBondContact O-N 2.65Å
80	L	98.2	Very high	96	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.4	170.8	175.2	69.8	0	0	0	108.5	S19 L20 W36 I48 V67 I69 Y93	S19-L80 CarbonylContact C-O 3.59Å; S19-L80 WeakPolarHBondContact CA-O 3.31Å; L20-L80 HydrophobicContact CB-CB 4.31Å; L20-L80 HydrophobicContact CD1-CD2 4.23Å; L20-L80 PolarHBondContact N-O 3.12Å; L20-L80 PolarHBondContact O-N 3.28Å; W36-L80 HydrophobicContact CB-CD2 4.28Å; W36-L80 HydrophobicContact CD2-CB 3.94Å; W36-L80 HydrophobicContact CD2-CD2 4.13Å; W36-L80 HydrophobicContact CE3-CD2 4.38Å; W36-L80 HydrophobicContact CG-CB 3.96Å; W36-L80 HydrophobicContact CG-CD1 4.44Å; W36-L80 HydrophobicContact CG-CD2 4.09Å; W36-L80 HydrophobicContact CG-CG 4.4Å; W36-L80 HydrophobicContact CZ2-CB 4.27Å; I48-L80 HydrophobicContact CD1-CD2 3.94Å; I48-L80 HydrophobicContact CG2-CD1 3.97Å; V67-L80 HydrophobicContact CG1-CD1 3.55Å; I69-L80 HydrophobicContact CG1-CD1 3.85Å; L80-Y93 HydrophobicContact CD2-CD1 3.87Å; L80-Y93 HydrophobicContact CD2-CE1 4.05Å
81	K	98.2	Very high	96.2	Very high	111 Å²	111	45.8 Å²	45.8	48%	0.483	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	129.8	164	-67.6	-174.5	176.6	-178.7	0	109.1	T17 L18 V67 T68	T17-K81 HydrophobicContact CG2-CB 4.49Å; L18-K81 CarbonylContact O-C 3.46Å; L18-K81 WeakPolarHBondContact O-CA 3.37Å; V67-K81 CarbonylContact C-O 3.57Å; V67-K81 WeakPolarHBondContact CA-O 3.49Å; T68-K81 PolarHBondContact N-O 3.39Å; T68-K81 PolarHBondContact O-N 2.96Å
82	L	98	Very high	96.4	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	114	174.6	175.4	67.9	0	0	0	108.5	T17 L18 R66 V67 V85 D89	T17-L82 CarbonylContact C-O 3.46Å; T17-L82 WeakPolarHBondContact CA-O 3.44Å; L18-L82 HydrophobicContact CB-CB 4.27Å; L18-L82 HydrophobicContact CD2-CD2 4.42Å; L18-L82 PolarHBondContact N-O 3.05Å; L18-L82 PolarHBondContact O-N 2.98Å; R66-L82 HydrophobicContact CB-CD1 3.83Å; R66-L82 WeakPolarHBondContact O-CA 3.15Å; V67-L82 HydrophobicContact CG2-CD1 3.51Å; L82-V85 HydrophobicContact CD2-CG2 4.38Å; L82-V85 HydrophobicContact CG-CG2 4.3Å; L82-V85 WeakPolarHBondContact O-CG2 3.36Å; L82-D89 HydrophobicContact CD2-CB 3.8Å
83	T	98.1	Very high	96.7	Very high	54 Å²	54	43.8 Å²	43.8	33%	0.331	27%	0.267	S	S	.	.			trans	-89.8	161.2	-179.7	60.6	0	0	0	0	111.7	T17 R66 V85	T17-T83 HydrophobicContact CG2-CG2 4.17Å; R66-T83 WeakPolarHBondContact CA-OG1 3.47Å; R66-T83 PolarHBondContact NH1-O 2.99Å; R66-T83 PolarHBondContact O-N 3.45Å; R66-T83 PolarHBondContact O-OG1 2.02Å; T83-V85 VanDerWaalsContact C-N 3.32Å; T83-V85 PolarHBondContact O-N 3.37Å
84	S	96.4	Very high	96.9	Very high	68 Å²	68	42.6 Å²	42.6	48%	0.476	26%	0.255	S	S	.	.	S	Bend	trans	51	53.6	177.3	-56.3	0	0	0	0	111.2	E16 R66	E16-S84 PolarHBondContact O-N 2.81Å; R66-S84 PolarHBondContact NH1-O 2.72Å; R66-S84 VanDerWaalsContact NH1-O 3.12Å
85	V	97.2	Very high	97	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.018	22%	0.221	C	C	.	.			trans	-59.6	139.5	-177.8	169.7	0	0	0	0	110.3	V12 P14 S15 E16 L18 L82 T83 D89 A118	V12-V85 HydrophobicContact CG1-CB 4.36Å; V12-V85 HydrophobicContact CG1-CG1 4.32Å; V12-V85 HydrophobicContact CG1-CG2 4.25Å; P14-V85 CarbonylContact C-O 3.52Å; P14-V85 VanDerWaalsContact CA-O 3.29Å; P14-V85 WeakPolarHBondContact CA-O 3.22Å; S15-V85 PolarHBondContact N-O 2.8Å; E16-V85 WeakPolarHBondContact O-CG2 2.98Å; E16-V85 PolarHBondContact O-N 2.91Å; E16-V85 VanDerWaalsContact O-N 3.09Å; L18-V85 HydrophobicContact CB-CG2 3.78Å; L82-V85 HydrophobicContact CD2-CG2 4.38Å; L82-V85 HydrophobicContact CG-CG2 4.3Å; L82-V85 WeakPolarHBondContact O-CG2 3.36Å; T83-V85 VanDerWaalsContact C-N 3.32Å; T83-V85 PolarHBondContact O-N 3.37Å; V85-D89 HydrophobicContact CG1-CB 4.24Å; V85-A118 HydrophobicContact CG1-CB 3.53Å
86	T	96.6	Very high	97	Very high	62 Å²	62	32 Å²	32	38%	0.38	20%	0.196	S	C	.	.			trans	-125.2	166	177.3	66.2	0	0	0	0	110	A88 D89 A118	T86-A88 PolarHBondContact O-N 2.98Å; T86-A88 VanDerWaalsContact O-N 3.07Å; T86-A88 PolarHBondContact OG1-N 2.95Å; T86-D89 PolarHBondContact N-OD2 2.82Å; T86-D89 WeakPolarHBondContact O-CB 3.41Å; T86-D89 PolarHBondContact O-N 2.86Å; T86-D89 PolarHBondContact OG1-OD2 2.9Å; T86-A118 WeakPolarHBondContact O-CB 3.5Å
87	A	95.9	Very high	96.8	Very high	73 Å²	73	31.7 Å²	31.7	60%	0.603	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-54.3	-30.2	175	0	0	0	0	0	113	D89 T90	A87-D89 PolarHBondContact O-N 2.9Å; A87-T90 VanDerWaalsContact O-CB 3.31Å; A87-T90 WeakPolarHBondContact O-CB 3.38Å; A87-T90 PolarHBondContact O-N 3.29Å; A87-T90 VanDerWaalsContact O-N 3.14Å; A87-T90 PolarHBondContact O-OG1 3.37Å
88	A	95.1	Very high	96.1	Very high	68 Å²	68	30.8 Å²	30.8	56%	0.562	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-68.2	-14.8	177.2	0	0	0	0	0	113.9	T86 T90	T86-A88 PolarHBondContact O-N 2.98Å; T86-A88 VanDerWaalsContact O-N 3.07Å; T86-A88 PolarHBondContact OG1-N 2.95Å; A88-T90 VanDerWaalsContact C-N 3.3Å
89	D	97.2	Very high	94.9	Very high	2 Å²	2	35 Å²	35	1%	0.011	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-88	1.8	175.5	-55.7	-55.8	0	0	0	112.2	R38 R66 L82 V85 T86 A87 A91 Y93	R38-D89 IonicContact CZ-OD1 3.21Å; R38-D89 IonicContact NH1-OD1 2.75Å; R38-D89 PolarHBondContact NH1-OD1 2.99Å; R66-D89 IonicContact CZ-OD1 2.65Å; R66-D89 IonicContact CZ-OD2 2.92Å; R66-D89 IonicContact NH1-OD1 2.91Å; R66-D89 IonicContact NH1-OD2 3.34Å; R66-D89 PolarHBondContact NH1-OD2 2.86Å; R66-D89 IonicContact NH2-OD1 3.29Å; R66-D89 PolarHBondContact NH2-OD1 3.03Å; R66-D89 IonicContact NH2-OD2 3.52Å; L82-D89 HydrophobicContact CD2-CB 3.8Å; V85-D89 HydrophobicContact CG1-CB 4.24Å; T86-D89 PolarHBondContact N-OD2 2.82Å; T86-D89 WeakPolarHBondContact O-CB 3.41Å; T86-D89 PolarHBondContact O-N 2.86Å; T86-D89 PolarHBondContact OG1-OD2 2.9Å; A87-D89 PolarHBondContact O-N 2.9Å; D89-A91 PolarHBondContact O-N 3.33Å; D89-Y93 WeakPolarHBondContact O-CE2 3.29Å; D89-Y93 PolarHBondContact O-OH 2.78Å
90	T	98.1	Very high	93.1	Very high	41 Å²	41	39.9 Å²	39.9	25%	0.252	23%	0.231	S	C	.	.			trans	-64.6	117.9	168.4	-62.2	0	0	0	0	109.8	P41 A87 A88 V116 A118	P41-T90 VanDerWaalsContact CD-O 3.23Å; P41-T90 WeakPolarHBondContact CD-O 3.29Å; P41-T90 HydrophobicContact CG-CG2 4.29Å; A87-T90 VanDerWaalsContact O-CB 3.31Å; A87-T90 WeakPolarHBondContact O-CB 3.38Å; A87-T90 PolarHBondContact O-N 3.29Å; A87-T90 VanDerWaalsContact O-N 3.14Å; A87-T90 PolarHBondContact O-OG1 3.37Å; A88-T90 VanDerWaalsContact C-N 3.3Å; T90-V116 WeakPolarHBondContact CA-O 3.02Å; T90-A118 PolarHBondContact OG1-N 2.87Å
91	A	98.2	Very high	91	Very high	3 Å²	3	45 Å²	45	3%	0.025	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	168.3	-176	0	0	0	0	0	111.7	R38 Q39 P40 D89 Y93 V116	R38-A91 HydrophobicContact CB-CB 3.81Å; R38-A91 HydrophobicContact CG-CB 4.38Å; Q39-A91 VanDerWaalsContact O-CA 3.31Å; Q39-A91 WeakPolarHBondContact O-CA 3.23Å; Q39-A91 WeakPolarHBondContact O-CB 3.39Å; P40-A91 HydrophobicContact CG-CB 4.43Å; D89-A91 PolarHBondContact O-N 3.33Å; A91-Y93 HydrophobicContact CB-CD2 4.21Å; A91-Y93 HydrophobicContact CB-CE2 3.77Å; A91-Y93 WeakPolarHBondContact O-CD2 3.36Å; A91-V116 PolarHBondContact N-O 2.66Å; A91-V116 VanDerWaalsContact N-O 3.12Å; A91-V116 PolarHBondContact O-N 2.89Å
92	V	98.5	Very high	88.7	Confident	34 Å²	34	48.1 Å²	48.1	21%	0.206	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128.2	157.4	-169.3	0	0	0	0	108.3	R38 Q39 Y94 T114	R38-V92 CarbonylContact C-O 3.57Å; R38-V92 WeakPolarHBondContact CA-O 3.36Å; Q39-V92 PolarHBondContact N-O 2.82Å; Q39-V92 PolarHBondContact O-N 2.91Å; V92-Y94 HydrophobicContact CB-CE2 3.81Å; V92-Y94 HydrophobicContact CG1-CD2 4.48Å; V92-Y94 HydrophobicContact CG1-CE1 3.82Å; V92-Y94 HydrophobicContact CG1-CE2 3.74Å; V92-Y94 WeakPolarHBondContact CG1-OH 3.35Å; V92-T114 CarbonylContact C-O 3.59Å; V92-T114 WeakPolarHBondContact CA-O 2.93Å
93	Y	98.4	Very high	86.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	127.4	-178.9	-72.7	-100.6	0	0	0	110	L18 L20 I37 R38 I48 L80 D89 A91 G113 T114 V116	L18-Y93 HydrophobicContact CD2-CE1 4.23Å; L18-Y93 HydrophobicContact CD2-CE2 4.09Å; L20-Y93 HydrophobicContact CD1-CD1 3.71Å; L20-Y93 HydrophobicContact CD1-CD2 4.08Å; L20-Y93 HydrophobicContact CD1-CG 3.46Å; L20-Y93 VanDerWaalsContact CD1-CG 3.46Å; I37-Y93 CarbonylContact O-C 3.53Å; I37-Y93 WeakPolarHBondContact O-CA 3.32Å; R38-Y93 HydrophobicContact CB-CD1 3.87Å; R38-Y93 HydrophobicContact CB-CE1 3.85Å; R38-Y93 HydrophobicContact CB-CG 4.26Å; R38-Y93 HydrophobicContact CG-CE1 4.49Å; I48-Y93 HydrophobicContact CD1-CD1 3.79Å; I48-Y93 HydrophobicContact CD1-CE1 3.69Å; L80-Y93 HydrophobicContact CD2-CD1 3.87Å; L80-Y93 HydrophobicContact CD2-CE1 4.05Å; D89-Y93 WeakPolarHBondContact O-CE2 3.29Å; D89-Y93 PolarHBondContact O-OH 2.78Å; A91-Y93 HydrophobicContact CB-CD2 4.21Å; A91-Y93 HydrophobicContact CB-CE2 3.77Å; A91-Y93 WeakPolarHBondContact O-CD2 3.36Å; Y93-G113 CarbonylContact O-C 3.46Å; Y93-G113 WeakPolarHBondContact O-CA 3.25Å; Y93-T114 PolarHBondContact N-O 2.77Å; Y93-T114 PolarHBondContact O-N 3.04Å; Y93-V116 HydrophobicContact CD2-CB 4.03Å; Y93-V116 HydrophobicContact CD2-CG2 3.75Å; Y93-V116 HydrophobicContact CE2-CB 3.88Å; Y93-V116 HydrophobicContact CE2-CG2 4.04Å
94	Y	98.1	Very high	83.8	Confident	42 Å²	42	59.1 Å²	59.1	17%	0.165	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	141.8	-178.9	-52.9	-88.9	0	0	0	110.1	E6 W36 I37 Q39 L45 V92 W110 Q112 G113	E6-Y94 WeakPolarHBondContact OE1-CA 3.33Å; W36-Y94 WeakPolarHBondContact CA-O 3.49Å; W36-Y94 VanDerWaalsContact CE3-O 3.26Å; I37-Y94 PolarHBondContact N-O 3.09Å; I37-Y94 PolarHBondContact O-N 2.9Å; Q39-Y94 HydrophobicContact CB-CE2 4.02Å; L45-Y94 HydrophobicContact CD2-CD2 4.25Å; L45-Y94 HydrophobicContact CD2-CE2 4.14Å; V92-Y94 HydrophobicContact CB-CE2 3.81Å; V92-Y94 HydrophobicContact CG1-CD2 4.48Å; V92-Y94 HydrophobicContact CG1-CE1 3.82Å; V92-Y94 HydrophobicContact CG1-CE2 3.74Å; V92-Y94 WeakPolarHBondContact CG1-OH 3.35Å; Y94-W110 HydrophobicContact CD1-CE3 4.48Å; Y94-W110 HydrophobicContact CD2-CZ3 4.47Å; Y94-W110 HydrophobicContact CG-CE3 4.13Å; Y94-W110 HydrophobicContact CG-CZ3 4.16Å; Y94-Q112 WeakPolarHBondContact CE1-O 3.33Å; Y94-G113 VanDerWaalsContact CD1-CA 3.46Å
95	C	95.8	Very high	81.9	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	150.1	161.4	62.4	0	0	0	0	110.7	E6 C22 G35 W36 L78 G111	E6-C95 HydrophobicContact CG-CB 4.4Å; E6-C95 PolarHBondContact OE1-N 2.76Å; E6-C95 PolarHBondContact OE1-SG 3.24Å; E6-C95 VanDerWaalsContact OE1-SG 3.37Å; C22-C95 HydrophobicContact CB-CB 3.38Å; C22-C95 WeakPolarHBondContact CB-SG 3.36Å; C22-C95 WeakPolarHBondContact SG-CB 3.39Å; C22-C95 CovalentContact SG-SG 2.02Å; C22-C95 PolarHBondContact SG-SG 2.89Å; G35-C95 CarbonylContact O-C 3.55Å; G35-C95 VanDerWaalsContact O-CA 3.29Å; G35-C95 WeakPolarHBondContact O-CA 3.49Å; W36-C95 HydrophobicContact CD2-CB 4.32Å; W36-C95 HydrophobicContact CE3-CB 4.27Å; W36-C95 HydrophobicContact CH2-CB 4.26Å; W36-C95 HydrophobicContact CZ2-CB 4.31Å; W36-C95 HydrophobicContact CZ3-CB 4.24Å; L78-C95 HydrophobicContact CD2-CB 4.25Å; C95-G111 PolarHBondContact O-N 3Å
96	G	93.6	Very high	80.2	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	158.8	179	0	0	0	0	0	113.7	W34 G35 V109	W34-G96 WeakPolarHBondContact CA-O 3.37Å; G35-G96 PolarHBondContact N-O 2.76Å; G35-G96 PolarHBondContact O-N 2.95Å; G96-V109 CarbonylContact C-O 3.49Å; G96-V109 WeakPolarHBondContact CA-O 3.34Å
97	R	91.3	Very high	79	Confident	28 Å²	28	67.1 Å²	67.1	11%	0.106	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	133.1	174.3	-169.8	177.3	72.2	174.2	0.4	109.9	D27 F32 W34 M107 D108 V109	D27-R97 IonicContact OD2-CZ 2.79Å; D27-R97 IonicContact OD2-NH1 3.59Å; D27-R97 PolarHBondContact OD2-NH1 2.91Å; F32-R97 HydrophobicContact CB-CG 3.62Å; F32-R97 HydrophobicContact CD1-CG 4.23Å; F32-R97 HydrophobicContact CD2-CG 4.4Å; F32-R97 HydrophobicContact CG-CG 3.84Å; W34-R97 HydrophobicContact CE3-CB 3.92Å; W34-R97 HydrophobicContact CE3-CG 4.3Å; W34-R97 HydrophobicContact CH2-CB 3.93Å; W34-R97 HydrophobicContact CH2-CG 3.88Å; W34-R97 HydrophobicContact CZ2-CG 4.08Å; W34-R97 HydrophobicContact CZ3-CB 3.56Å; W34-R97 HydrophobicContact CZ3-CG 3.98Å; R97-M107 WeakPolarHBondContact O-CA 3.15Å; R97-M107 WeakPolarHBondContact O-CB 3.43Å; R97-M107 WeakPolarHBondContact O-CG 3.49Å; R97-D108 WeakPolarHBondContact CB-OD1 3.27Å; R97-D108 IonicContact CZ-OD1 3.77Å; R97-D108 IonicContact CZ-OD2 3.84Å; R97-D108 IonicContact NE-OD1 2.66Å; R97-D108 PolarHBondContact NE-OD1 2.81Å; R97-D108 IonicContact NE-OD2 3.58Å; R97-D108 PolarHBondContact NE-OD2 3.12Å; R97-D108 IonicContact NH2-OD1 2.73Å; R97-D108 IonicContact NH2-OD2 3.68Å; R97-D108 PolarHBondContact NH2-OD2 3.42Å; R97-D108 PolarHBondContact O-N 3.2Å; R97-V109 HydrophobicContact CB-CB 4.02Å; R97-V109 HydrophobicContact CB-CG2 4.43Å; R97-V109 PolarHBondContact N-O 2.75Å
98	Y	82.6	Confident	78.3	Confident	28 Å²	28	66.8 Å²	66.8	11%	0.11	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.1	174.3	-64.1	-107.2	0	0	0	109.3	Y33 W47 M107	Y33-Y98 PolarHBondContact O-N 2.87Å; W47-Y98 PolarHBondContact NE1-OH 2.91Å; Y98-M107 HydrophobicContact CD1-CG 3.8Å; Y98-M107 HydrophobicContact CD2-CG 3.83Å; Y98-M107 HydrophobicContact CD2-SD 4.24Å; Y98-M107 HydrophobicContact CE1-CE 3.57Å; Y98-M107 HydrophobicContact CE1-CG 3.7Å; Y98-M107 HydrophobicContact CE1-SD 4.04Å; Y98-M107 HydrophobicContact CE2-CE 4.02Å; Y98-M107 HydrophobicContact CE2-CG 3.68Å; Y98-M107 HydrophobicContact CE2-SD 3.52Å; Y98-M107 VanDerWaalsContact CE2-SD 3.52Å; Y98-M107 HydrophobicContact CG-CG 3.87Å; Y98-M107 WeakPolarHBondContact OH-CE 3.32Å; Y98-M107 PolarHBondContact OH-SD 2.77Å
99	Q	69.8	Low	78.1	Confident	88 Å²	88	64.6 Å²	64.6	41%	0.411	33%	0.33	S	S	.	.			trans	-92.5	130.9	177.1	-132.8	-178	18.4	0	0	110.4	F32 N101	F32-Q99 HydrophobicContact CD1-CG 4.5Å; F32-Q99 HydrophobicContact CE1-CG 4.33Å; Q99-N101 PolarHBondContact O-N 2.82Å
100	N	60.3	Low	77.9	Confident	127 Å²	127	69 Å²	69	68%	0.679	35%	0.347	S	S	*	.			trans	-84.2	54.9	-175.4	-157.1	19.5	0	0	0	112	Y33	Y33-N100 HydrophobicContact CD2-CB 4.38Å; Y33-N100 HydrophobicContact CE2-CB 4.25Å
101	N	54	Low	77.7	Confident	110 Å²	110	67.4 Å²	67.4	59%	0.588	34%	0.338	S	S	*	.			trans	-99.5	132.3	173.8	-84.6	-39.8	0	0	0	110.3	Q99 V103 M104	Q99-N101 PolarHBondContact O-N 2.82Å; N101-V103 PolarHBondContact O-N 2.84Å; N101-M104 PolarHBondContact O-N 3.13Å
102	I	50.5	Low	77.6	Confident	176 Å²	176	75.3 Å²	75.3	90%	0.903	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	1.9	-159.6	-67.8	170.9	0	0	0	116
103	V	45.3	Very low	77.5	Confident	139 Å²	139	74.8 Å²	74.8	84%	0.842	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.7	0.2	-173.8	-150.4	0	0	0	0	114.6	N101	N101-V103 PolarHBondContact O-N 2.84Å
104	M	47.3	Very low	77.5	Confident	150 Å²	150	76 Å²	76	74%	0.739	38%	0.383	S	S	*	.			trans	-148.8	108	-173.9	-143.2	174.9	161.4	0	0	113.4	N101 G106	N101-M104 PolarHBondContact O-N 3.13Å; M104-G106 PolarHBondContact O-N 3.22Å
105	Y	56.6	Low	77.5	Confident	230 Å²	230	78.5 Å²	78.5	90%	0.902	40%	0.404	S	S	*	.			trans	-72.8	47.7	168	-63.9	-81.5	0	0	0	111.5
106	G	60.6	Low	77.6	Confident	30 Å²	30	78.6 Å²	78.6	31%	0.309	40%	0.404	S	S	.	.			trans	-91.8	136.4	178.3	0	0	0	0	0	110.8	M104	M104-G106 PolarHBondContact O-N 3.22Å
107	M	71.3	Confident	77.8	Confident	40 Å²	40	80.1 Å²	80.1	20%	0.197	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	123.3	164.8	-83.5	174	-95.7	0	0	109.6	I37 R97 Y98 W110	I37-M107 HydrophobicContact CD1-CE 3.42Å; I37-M107 VanDerWaalsContact CD1-CE 3.42Å; I37-M107 HydrophobicContact CD1-SD 3.22Å; I37-M107 WeakPolarHBondContact CD1-SD 3.46Å; I37-M107 HydrophobicContact CG1-CE 3.65Å; I37-M107 HydrophobicContact CG1-SD 4.15Å; R97-M107 WeakPolarHBondContact O-CA 3.15Å; R97-M107 WeakPolarHBondContact O-CB 3.43Å; R97-M107 WeakPolarHBondContact O-CG 3.49Å; Y98-M107 HydrophobicContact CD1-CG 3.8Å; Y98-M107 HydrophobicContact CD2-CG 3.83Å; Y98-M107 HydrophobicContact CD2-SD 4.24Å; Y98-M107 HydrophobicContact CE1-CE 3.57Å; Y98-M107 HydrophobicContact CE1-CG 3.7Å; Y98-M107 HydrophobicContact CE1-SD 4.04Å; Y98-M107 HydrophobicContact CE2-CE 4.02Å; Y98-M107 HydrophobicContact CE2-CG 3.68Å; Y98-M107 HydrophobicContact CE2-SD 3.52Å; Y98-M107 VanDerWaalsContact CE2-SD 3.52Å; Y98-M107 HydrophobicContact CG-CG 3.87Å; Y98-M107 WeakPolarHBondContact OH-CE 3.32Å; Y98-M107 PolarHBondContact OH-SD 2.77Å; M107-W110 HydrophobicContact CB-CD2 4.49Å; M107-W110 HydrophobicContact CB-CZ2 3.82Å; M107-W110 HydrophobicContact CE-CH2 3.57Å; M107-W110 HydrophobicContact CE-CZ2 3.38Å; M107-W110 HydrophobicContact CG-CZ2 4.27Å; M107-W110 PolarHBondContact O-NE1 2.9Å; M107-W110 HydrophobicContact SD-CD2 4.33Å; M107-W110 HydrophobicContact SD-CH2 3.84Å; M107-W110 HydrophobicContact SD-CZ2 3.51Å; M107-W110 VanDerWaalsContact SD-CZ2 3.51Å; M107-W110 HydrophobicContact SD-CZ3 4.39Å
108	D	82.6	Confident	78	Confident	66 Å²	66	79 Å²	79	35%	0.353	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-18.1	-176.4	64.5	-14	0	0	0	112.9	R97	R97-D108 WeakPolarHBondContact CB-OD1 3.27Å; R97-D108 IonicContact CZ-OD1 3.77Å; R97-D108 IonicContact CZ-OD2 3.84Å; R97-D108 IonicContact NE-OD1 2.66Å; R97-D108 PolarHBondContact NE-OD1 2.81Å; R97-D108 IonicContact NE-OD2 3.58Å; R97-D108 PolarHBondContact NE-OD2 3.12Å; R97-D108 IonicContact NH2-OD1 2.73Å; R97-D108 IonicContact NH2-OD2 3.68Å; R97-D108 PolarHBondContact NH2-OD2 3.42Å; R97-D108 PolarHBondContact O-N 3.2Å
109	V	89.4	Confident	78.3	Confident	23 Å²	23	80.3 Å²	80.3	14%	0.139	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	132.3	175.7	-171.5	0	0	0	0	109.7	V2 L4 G96 R97	V2-V109 HydrophobicContact CB-CG1 4.21Å; V2-V109 HydrophobicContact CB-CG2 4.34Å; V2-V109 HydrophobicContact CG1-CG1 4.01Å; V2-V109 HydrophobicContact CG1-CG2 4.49Å; L4-V109 HydrophobicContact CD1-CB 4.28Å; L4-V109 HydrophobicContact CD1-CG1 3.77Å; L4-V109 HydrophobicContact CD2-CG1 4.48Å; L4-V109 HydrophobicContact CG-CG1 3.79Å; G96-V109 CarbonylContact C-O 3.49Å; G96-V109 WeakPolarHBondContact CA-O 3.34Å; R97-V109 HydrophobicContact CB-CB 4.02Å; R97-V109 HydrophobicContact CB-CG2 4.43Å; R97-V109 PolarHBondContact N-O 2.75Å
110	W	92.9	Very high	78.7	Confident	95 Å²	95	83 Å²	83	36%	0.36	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	146.9	178.1	-70.8	74.4	0	0	0	110.9	I37 L45 Y94 M107	I37-W110 HydrophobicContact CB-CH2 4.17Å; I37-W110 HydrophobicContact CB-CZ3 3.96Å; I37-W110 HydrophobicContact CD1-CE3 4.5Å; I37-W110 HydrophobicContact CD1-CH2 3.85Å; I37-W110 HydrophobicContact CD1-CZ3 3.78Å; I37-W110 HydrophobicContact CG1-CH2 3.86Å; I37-W110 HydrophobicContact CG1-CZ3 4.01Å; I37-W110 HydrophobicContact CG2-CH2 4.16Å; I37-W110 HydrophobicContact CG2-CZ3 4.2Å; L45-W110 HydrophobicContact CD1-CH2 4.15Å; Y94-W110 HydrophobicContact CD1-CE3 4.48Å; Y94-W110 HydrophobicContact CD2-CZ3 4.47Å; Y94-W110 HydrophobicContact CG-CE3 4.13Å; Y94-W110 HydrophobicContact CG-CZ3 4.16Å; M107-W110 HydrophobicContact CB-CD2 4.49Å; M107-W110 HydrophobicContact CB-CZ2 3.82Å; M107-W110 HydrophobicContact CE-CH2 3.57Å; M107-W110 HydrophobicContact CE-CZ2 3.38Å; M107-W110 HydrophobicContact CG-CZ2 4.27Å; M107-W110 PolarHBondContact O-NE1 2.9Å; M107-W110 HydrophobicContact SD-CD2 4.33Å; M107-W110 HydrophobicContact SD-CH2 3.84Å; M107-W110 HydrophobicContact SD-CZ2 3.51Å; M107-W110 VanDerWaalsContact SD-CZ2 3.51Å; M107-W110 HydrophobicContact SD-CZ3 4.39Å
111	G	95.1	Very high	79.6	Confident	7 Å²	7	80.9 Å²	80.9	7%	0.072	44%	0.444	C	S	.	.			trans	-78.1	169.1	163.5	0	0	0	0	0	112	L4 E6 C95 G113	L4-G111 WeakPolarHBondContact O-CA 3.47Å; E6-G111 WeakPolarHBondContact OE1-CA 3.27Å; E6-G111 WeakPolarHBondContact OE2-CA 3.48Å; C95-G111 PolarHBondContact O-N 3Å; G111-G113 PolarHBondContact O-N 3.03Å
112	Q	95.5	Very high	80.9	Confident	169 Å²	169	79.3 Å²	79.3	79%	0.79	44%	0.437	S	S	*	.			trans	-72.8	-16.5	178.3	-63.2	-60.1	-50.9	0	0	112	E6 Y94	E6-Q112 PolarHBondContact OE2-N 3.39Å; Y94-Q112 WeakPolarHBondContact CE1-O 3.33Å
113	G	97	Very high	82.6	Confident	23 Å²	23	73.9 Å²	73.9	24%	0.237	41%	0.411	C	S	.	.			trans	86.9	159	-179.9	0	0	0	0	0	113.3	E6 Y93 Y94 G111	E6-G113 PolarHBondContact OE1-N 3.07Å; E6-G113 PolarHBondContact OE2-N 3.37Å; Y93-G113 CarbonylContact O-C 3.46Å; Y93-G113 WeakPolarHBondContact O-CA 3.25Å; Y94-G113 VanDerWaalsContact CD1-CA 3.46Å; G111-G113 PolarHBondContact O-N 3.03Å
114	T	98	Very high	84.8	Confident	24 Å²	24	70.1 Å²	70.1	15%	0.147	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132.4	174.7	-174.7	0	0	0	0	110.5	E6 L20 V92 Y93	E6-T114 HydrophobicContact CB-CG2 3.84Å; L20-T114 HydrophobicContact CD1-CG2 3.99Å; L20-T114 HydrophobicContact CD2-CG2 3.87Å; V92-T114 CarbonylContact C-O 3.59Å; V92-T114 WeakPolarHBondContact CA-O 2.93Å; Y93-T114 PolarHBondContact N-O 2.77Å; Y93-T114 PolarHBondContact O-N 3.04Å
115	T	98.2	Very high	87.2	Confident	96 Å²	96	65.1 Å²	65.1	59%	0.589	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	128.3	179	-58.4	0	0	0	0	109.6
116	V	97.9	Very high	89.2	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.006	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.7	175	-176.3	0	0	0	0	109.1	V12 L18 L20 T90 A91 Y93	V12-V116 HydrophobicContact CG2-CG1 4.22Å; L18-V116 HydrophobicContact CD1-CG1 3.82Å; L18-V116 HydrophobicContact CD1-CG2 4.04Å; L18-V116 HydrophobicContact CD2-CB 4.47Å; L18-V116 HydrophobicContact CD2-CG1 4.02Å; L18-V116 HydrophobicContact CD2-CG2 4.27Å; L20-V116 HydrophobicContact CD1-CG2 4.42Å; L20-V116 HydrophobicContact CD2-CG2 4.04Å; T90-V116 WeakPolarHBondContact CA-O 3.02Å; A91-V116 PolarHBondContact N-O 2.66Å; A91-V116 VanDerWaalsContact N-O 3.12Å; A91-V116 PolarHBondContact O-N 2.89Å; Y93-V116 HydrophobicContact CD2-CB 4.03Å; Y93-V116 HydrophobicContact CD2-CG2 3.75Å; Y93-V116 HydrophobicContact CE2-CB 3.88Å; Y93-V116 HydrophobicContact CE2-CG2 4.04Å
117	A	97.6	Very high	91.3	Very high	32 Å²	32	55.9 Å²	55.9	26%	0.264	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	134.8	169.1	0	0	0	0	0	110.7	G10 L11 V12	G10-A117 PolarHBondContact O-N 3.18Å; L11-A117 WeakPolarHBondContact CA-O 3.29Å; L11-A117 HydrophobicContact CD1-CB 3.91Å; V12-A117 PolarHBondContact N-O 2.59Å
118	A	94.9	Very high	92.8	Very high	5 Å²	5	57.1 Å²	57.1	4%	0.041	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	85.6	173	0	0	0	0	0	109.9	V12 V85 T86 T90	V12-A118 VanDerWaalsContact O-CA 3.3Å; V12-A118 WeakPolarHBondContact O-CA 3.39Å; V85-A118 HydrophobicContact CG1-CB 3.53Å; T86-A118 WeakPolarHBondContact O-CB 3.5Å; T90-A118 PolarHBondContact OG1-N 2.87Å
119	S	90.3	Very high	93.6	Very high	55 Å²	55	56.3 Å²	56.3	39%	0.385	34%	0.338	S	S	.	.			trans	-142.3	160.6	-176.6	64.9	0	0	0	0	112.3	L11 V12	L11-S119 WeakPolarHBondContact CD1-OG 3.43Å; V12-S119 PolarHBondContact O-N 3.3Å
120	S	76.9	Confident	94	Very high	146 Å²	146	59.4 Å²	59.4	100%	1.021	36%	0.356	S	S	*	.			trans	-85.7	0	175.7	-61.9	0	0	0	0	112.3

Retrieved 120 of 120 residues in 138.5 ms (Link to these results)

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