A0A068LKR4_HUMAN Loading...

Ig heavy chain variable region

AlphaFold DB , UniProt , Accession A0A068LKR4, Species HUMAN (Homo sapiens, Human), Gene n/a, Length 118 aa.

						>A0A068LKR4_HUMAN|A0A068LKR4
EVQLVESGGGLVQPGGSLRLSCAASGFTFSDYWMHWVRQVPGKGLMWVSRITGDENTTTYADSVRGRFTISRDNAKSTLYLQMSGLRDEDTAVYYCVLGGSFGSCKDWGQGTLVIVSS
					

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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	E	84.1	Confident	95.5	Very high	198 Å²	198	63.4 Å²	63.4	93%	0.925	38%	0.378	S	S	*	.				0	138	0	-172.3	172.3	-179.9	0	0	108	G26	E1-G26 WeakPolarHBondContact O-CA 3.46Å
2	V	90.7	Very high	95.7	Very high	38 Å²	38	59.8 Å²	59.8	23%	0.23	36%	0.357	C	S	.	.			trans	-76.5	135.7	178.4	174.6	0	0	0	0	108.7	F27 L98 D107	V2-F27 HydrophobicContact CG1-CD1 3.86Å; V2-F27 HydrophobicContact CG1-CE1 3.99Å; V2-F27 HydrophobicContact CG2-CD1 4.28Å; V2-L98 HydrophobicContact CG1-CD1 4.49Å; V2-D107 HydrophobicContact CB-CB 4.22Å; V2-D107 HydrophobicContact CG1-CB 3.61Å
3	Q	94.9	Very high	95.8	Very high	86 Å²	86	62.8 Å²	62.8	40%	0.402	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	135.1	179	-65.7	-68.9	-54.2	0	0	110.3	A24 S25	Q3-A24 WeakPolarHBondContact O-CA 3.45Å; Q3-S25 PolarHBondContact N-O 3.23Å; Q3-S25 PolarHBondContact O-N 2.89Å
4	L	96.9	Very high	95.9	Very high	8 Å²	8	62.9 Å²	62.9	4%	0.042	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	118.4	179.3	-66.7	-177.2	0	0	0	107.9	A23 A24 F27 M34 L98 D107 G109	L4-A23 WeakPolarHBondContact CA-O 3.27Å; L4-A24 HydrophobicContact CD2-CB 3.69Å; L4-F27 HydrophobicContact CD2-CE1 4.19Å; L4-F27 HydrophobicContact CD2-CZ 4.36Å; L4-M34 HydrophobicContact CD2-CE 3.94Å; L4-L98 HydrophobicContact CD1-CB 4.12Å; L4-D107 HydrophobicContact CD1-CB 4.46Å; L4-D107 WeakPolarHBondContact CD1-O 3.48Å; L4-G109 VanDerWaalsContact O-CA 3.29Å; L4-G109 WeakPolarHBondContact O-CA 3.4Å
5	V	97.9	Very high	96	Very high	85 Å²	85	62.3 Å²	62.3	52%	0.515	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	105.3	-171.6	-175.4	0	0	0	0	110.4	C22 A23	V5-C22 VanDerWaalsContact O-CA 3.31Å; V5-C22 WeakPolarHBondContact O-CA 3.24Å; V5-A23 PolarHBondContact N-O 3.15Å; V5-A23 PolarHBondContact O-N 2.93Å
6	E	98.5	Very high	96.1	Very high	21 Å²	21	59.7 Å²	59.7	10%	0.098	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	147.9	178.8	-59.7	92.2	154.9	0	0	114	S21 C22 W36 Y95 C96 G109 Q110 G111 T112	E6-S21 CarbonylContact C-O 3.56Å; E6-S21 VanDerWaalsContact CA-O 3.27Å; E6-S21 WeakPolarHBondContact CA-O 3.31Å; E6-C22 HydrophobicContact CG-CB 4.28Å; E6-W36 HydrophobicContact CB-CH2 4.49Å; E6-W36 HydrophobicContact CG-CH2 3.93Å; E6-W36 HydrophobicContact CG-CZ3 3.91Å; E6-Y95 VanDerWaalsContact OE1-CA 3.3Å; E6-Y95 WeakPolarHBondContact OE1-CA 3.41Å; E6-C96 VanDerWaalsContact CD-SG 3.5Å; E6-C96 HydrophobicContact CG-CB 4.23Å; E6-C96 VanDerWaalsContact CG-SG 3.6Å; E6-C96 PolarHBondContact OE1-N 3.32Å; E6-C96 PolarHBondContact OE1-SG 2.88Å; E6-C96 VanDerWaalsContact OE1-SG 3.34Å; E6-G109 WeakPolarHBondContact OE1-CA 3.5Å; E6-G109 WeakPolarHBondContact OE2-CA 3.45Å; E6-Q110 PolarHBondContact OE2-N 2.83Å; E6-G111 VanDerWaalsContact CD-N 3.28Å; E6-G111 PolarHBondContact OE1-N 2.96Å; E6-G111 PolarHBondContact OE2-N 2.98Å; E6-T112 HydrophobicContact CB-CG2 4Å
7	S	98.3	Very high	96.2	Very high	58 Å²	58	60.1 Å²	60.1	41%	0.406	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	170.1	171.4	64	0	0	0	0	111.6	L20 S21	S7-L20 WeakPolarHBondContact O-CA 3.27Å; S7-S21 PolarHBondContact N-O 3.12Å; S7-S21 PolarHBondContact O-N 3.2Å; S7-S21 PolarHBondContact OG-OG 2.77Å
8	G	97.4	Very high	96.3	Very high	37 Å²	37	58.6 Å²	58.6	38%	0.381	36%	0.364	S	S	.	.			trans	91.3	1.1	178.5	0	0	0	0	0	115.1	L20	G8-L20 VanDerWaalsContact C-CD2 3.44Å; G8-L20 WeakPolarHBondContact O-CD2 3.28Å
9	G	97.5	Very high	96.4	Very high	29 Å²	29	62.2 Å²	62.2	30%	0.299	37%	0.37	S	S	.	.			trans	-65.6	160.7	166.1	0	0	0	0	0	111.9	T112 L113	G9-T112 WeakPolarHBondContact CA-OG1 3.45Å; G9-T112 PolarHBondContact N-OG1 3.04Å; G9-L113 CarbonylContact C-O 3.54Å; G9-L113 VanDerWaalsContact CA-O 3.27Å; G9-L113 WeakPolarHBondContact CA-O 3.49Å
10	G	97.3	Very high	96.5	Very high	27 Å²	27	59.1 Å²	59.1	28%	0.278	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	165.6	-175.7	-178	0	0	0	0	0	113.1	L113 I115	G10-L113 PolarHBondContact N-O 3.41Å; G10-I115 PolarHBondContact O-N 2.98Å
11	L	97.4	Very high	96.6	Very high	110 Å²	110	57.5 Å²	57.5	58%	0.576	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	134	174.3	177.7	64.7	0	0	0	110.3	I115 S117	L11-I115 CarbonylContact C-O 3.49Å; L11-I115 WeakPolarHBondContact CA-O 3.24Å; L11-I115 HydrophobicContact CD1-CB 3.9Å; L11-I115 HydrophobicContact CD1-CG2 3.66Å; L11-S117 WeakPolarHBondContact CD1-OG 2.94Å
12	V	97.3	Very high	97.3	Very high	21 Å²	21	48.1 Å²	48.1	13%	0.127	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	151.4	174.8	68.2	0	0	0	0	110.6	L18 L86 I115 V116 S117	V12-L18 HydrophobicContact CB-CD1 4.14Å; V12-L18 HydrophobicContact CB-CD2 4.48Å; V12-L18 HydrophobicContact CB-CG 4.15Å; V12-L18 HydrophobicContact CG1-CD1 3.83Å; V12-L18 HydrophobicContact CG1-CG 4.15Å; V12-L18 HydrophobicContact CG2-CG 4.47Å; V12-L86 HydrophobicContact CG1-CB 4.34Å; V12-L86 HydrophobicContact CG1-CD1 3.6Å; V12-I115 PolarHBondContact N-O 3.46Å; V12-V116 HydrophobicContact CG1-CG2 3.99Å; V12-V116 VanDerWaalsContact O-CA 3.27Å; V12-V116 WeakPolarHBondContact O-CA 3.35Å; V12-S117 PolarHBondContact O-N 3.02Å
13	Q	97.1	Very high	97.7	Very high	99 Å²	99	48.6 Å²	48.6	46%	0.463	31%	0.308	S	S	.	.			trans	-74.9	150.9	175.4	-66.9	-73.7	-36.7	0	0	110.9	G15 G16 S117 S118	Q13-G15 PolarHBondContact O-N 3.47Å; Q13-G16 WeakPolarHBondContact O-CA 3.32Å; Q13-G16 PolarHBondContact O-N 3.05Å; Q13-S117 PolarHBondContact NE2-O 2.74Å; Q13-S118 PolarHBondContact NE2-OXT 3.1Å; Q13-S118 VanDerWaalsContact OE1-CA 3.27Å; Q13-S118 PolarHBondContact OE1-OXT 3.21Å
14	P	97.7	Very high	97.7	Very high	64 Å²	64	45 Å²	45	42%	0.416	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	137.5	172	-25.2	33.8	0	0	0	111.9	G16 V116	P14-G16 PolarHBondContact O-N 2.81Å; P14-V116 HydrophobicContact CB-CG1 4.33Å; P14-V116 HydrophobicContact CG-CG1 4.09Å
15	G	97.2	Very high	97.7	Very high	54 Å²	54	47.8 Å²	47.8	56%	0.557	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	-10.9	-173.1	0	0	0	0	0	114.7	Q13 L86	Q13-G15 PolarHBondContact O-N 3.47Å; G15-L86 PolarHBondContact N-O 2.8Å
16	G	97.4	Very high	97.4	Very high	20 Å²	20	46.4 Å²	46.4	21%	0.206	32%	0.316	C	S	.	.			trans	-71.3	-178.6	177.5	0	0	0	0	0	114	Q13 P14 G85 L86	Q13-G16 WeakPolarHBondContact O-CA 3.32Å; Q13-G16 PolarHBondContact O-N 3.05Å; P14-G16 PolarHBondContact O-N 2.81Å; G16-G85 PolarHBondContact O-N 2.79Å; G16-G85 VanDerWaalsContact O-N 3.16Å; G16-L86 PolarHBondContact O-N 3.16Å
17	S	97.9	Very high	97.1	Very high	66 Å²	66	47.2 Å²	47.2	46%	0.462	32%	0.319	S	S	.	.			trans	-132.2	145.2	-176.6	-60.2	0	0	0	0	111.4	M83	S17-M83 CarbonylContact C-O 3.56Å; S17-M83 WeakPolarHBondContact CA-O 3.44Å; S17-M83 VanDerWaalsContact CB-O 3.31Å; S17-M83 WeakPolarHBondContact CB-O 3.44Å
18	L	97.7	Very high	96.8	Very high	33 Å²	33	48.3 Å²	48.3	17%	0.173	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	160.7	172.3	-73.8	175	0	0	0	109.9	V12 Q82 M83 L86 V114	V12-L18 HydrophobicContact CB-CD1 4.14Å; V12-L18 HydrophobicContact CB-CD2 4.48Å; V12-L18 HydrophobicContact CB-CG 4.15Å; V12-L18 HydrophobicContact CG1-CD1 3.83Å; V12-L18 HydrophobicContact CG1-CG 4.15Å; V12-L18 HydrophobicContact CG2-CG 4.47Å; L18-Q82 PolarHBondContact O-NE2 3.34Å; L18-M83 PolarHBondContact N-O 3.04Å; L18-M83 PolarHBondContact O-N 2.83Å; L18-M83 VanDerWaalsContact O-O 3.14Å; L18-L86 HydrophobicContact CB-CD1 4.05Å; L18-L86 HydrophobicContact CD1-CD1 4.04Å; L18-L86 HydrophobicContact CG-CD1 3.99Å; L18-V114 HydrophobicContact CD1-CG1 3.78Å; L18-V114 HydrophobicContact CD1-CG2 4.26Å
19	R	98.4	Very high	96.5	Very high	127 Å²	127	46.8 Å²	46.8	48%	0.479	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	111.7	170.7	-174.2	176.3	177.1	176.5	-0.5	109.2	L81	R19-L81 WeakPolarHBondContact CA-O 3.41Å
20	L	98.8	Very high	96.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	149.6	171.7	-50.2	-174.5	0	0	0	109.6	S7 G8 W36 Y80 L81 M83 Y94 T112 V114	S7-L20 WeakPolarHBondContact O-CA 3.27Å; G8-L20 VanDerWaalsContact C-CD2 3.44Å; G8-L20 WeakPolarHBondContact O-CD2 3.28Å; L20-W36 HydrophobicContact CB-CH2 3.74Å; L20-W36 HydrophobicContact CB-CZ2 3.95Å; L20-W36 HydrophobicContact CB-CZ3 4.33Å; L20-W36 HydrophobicContact CD1-CE3 4.4Å; L20-W36 HydrophobicContact CD1-CH2 4.29Å; L20-W36 HydrophobicContact CD1-CZ3 4.03Å; L20-Y80 VanDerWaalsContact O-CA 3.3Å; L20-Y80 WeakPolarHBondContact O-CA 3.36Å; L20-L81 HydrophobicContact CB-CB 4.24Å; L20-L81 HydrophobicContact CD1-CD2 4.39Å; L20-L81 PolarHBondContact N-O 3.02Å; L20-L81 PolarHBondContact O-N 3.09Å; L20-M83 HydrophobicContact CD1-SD 3.65Å; L20-M83 HydrophobicContact CD2-SD 4.37Å; L20-M83 HydrophobicContact CG-SD 3.67Å; L20-Y94 HydrophobicContact CD1-CD1 3.86Å; L20-Y94 HydrophobicContact CD1-CD2 4.31Å; L20-Y94 HydrophobicContact CD1-CG 3.65Å; L20-T112 HydrophobicContact CD1-CG2 4.07Å; L20-T112 HydrophobicContact CD2-CG2 3.93Å; L20-T112 HydrophobicContact CG-CG2 4.48Å; L20-V114 HydrophobicContact CD1-CG2 4.25Å; L20-V114 HydrophobicContact CD2-CG2 3.89Å
21	S	98.6	Very high	95.8	Very high	27 Å²	27	50.4 Å²	50.4	19%	0.189	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.7	168.5	75	0	0	0	0	110.8	E6 S7 L79	E6-S21 CarbonylContact C-O 3.56Å; E6-S21 VanDerWaalsContact CA-O 3.27Å; E6-S21 WeakPolarHBondContact CA-O 3.31Å; S7-S21 PolarHBondContact N-O 3.12Å; S7-S21 PolarHBondContact O-N 3.2Å; S7-S21 PolarHBondContact OG-OG 2.77Å; S21-L79 CarbonylContact C-O 3.57Å; S21-L79 WeakPolarHBondContact CA-O 3.47Å
22	C	98.4	Very high	95.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	112.6	174	164.8	0	0	0	0	109.2	V5 E6 W36 T78 L79 C96	V5-C22 VanDerWaalsContact O-CA 3.31Å; V5-C22 WeakPolarHBondContact O-CA 3.24Å; E6-C22 HydrophobicContact CG-CB 4.28Å; C22-W36 HydrophobicContact CB-CH2 3.99Å; C22-W36 HydrophobicContact CB-CZ2 3.96Å; C22-T78 CarbonylContact O-C 3.58Å; C22-T78 WeakPolarHBondContact O-CA 3.49Å; C22-L79 HydrophobicContact CB-CB 4.22Å; C22-L79 PolarHBondContact N-O 3.08Å; C22-L79 PolarHBondContact O-N 3.49Å; C22-C96 HydrophobicContact CB-CB 3.37Å; C22-C96 WeakPolarHBondContact CB-SG 3.38Å; C22-C96 WeakPolarHBondContact SG-CB 3.16Å; C22-C96 CovalentContact SG-SG 2.03Å; C22-C96 PolarHBondContact SG-SG 2.93Å
23	A	98.1	Very high	95.1	Very high	49 Å²	49	53.4 Å²	53.4	41%	0.405	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	130.4	173.9	0	0	0	0	0	109.1	L4 V5	L4-A23 WeakPolarHBondContact CA-O 3.27Å; V5-A23 PolarHBondContact N-O 3.15Å; V5-A23 PolarHBondContact O-N 2.93Å
24	A	96.3	Very high	95	Very high	10 Å²	10	48.7 Å²	48.7	8%	0.083	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	140.3	-176.2	0	0	0	0	0	111.2	Q3 L4 F27 F29 S77	Q3-A24 WeakPolarHBondContact O-CA 3.45Å; L4-A24 HydrophobicContact CD2-CB 3.69Å; A24-F27 HydrophobicContact CB-CE1 3.79Å; A24-F27 HydrophobicContact CB-CZ 3.63Å; A24-F29 HydrophobicContact CB-CD2 3.61Å; A24-F29 HydrophobicContact CB-CE2 3.83Å; A24-S77 WeakPolarHBondContact CB-O 3.01Å; A24-S77 PolarHBondContact N-O 3.01Å; A24-S77 VanDerWaalsContact O-CB 3.3Å; A24-S77 WeakPolarHBondContact O-CB 3.36Å
25	S	95.5	Very high	94.9	Very high	66 Å²	66	45.9 Å²	45.9	46%	0.462	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	164.2	175.5	64.5	0	0	0	0	112.2	Q3 F27	Q3-S25 PolarHBondContact N-O 3.23Å; Q3-S25 PolarHBondContact O-N 2.89Å; S25-F27 WeakPolarHBondContact O-CD1 3.36Å
26	G	93.3	Very high	95	Very high	56 Å²	56	43.3 Å²	43.3	58%	0.577	25%	0.25	S	S	*	.	S	Bend	trans	89.3	8	179.8	0	0	0	0	0	115.4	E1	E1-G26 WeakPolarHBondContact O-CA 3.46Å
27	F	91.1	Very high	94.9	Very high	39 Å²	39	42.3 Å²	42.3	17%	0.171	24%	0.24	C	C	.	.	S	Bend	trans	-156.2	166.1	175	65.1	-79.4	0	0	0	110.7	V2 L4 A24 S25 F29 Y32 M34 L98	V2-F27 HydrophobicContact CG1-CD1 3.86Å; V2-F27 HydrophobicContact CG1-CE1 3.99Å; V2-F27 HydrophobicContact CG2-CD1 4.28Å; L4-F27 HydrophobicContact CD2-CE1 4.19Å; L4-F27 HydrophobicContact CD2-CZ 4.36Å; A24-F27 HydrophobicContact CB-CE1 3.79Å; A24-F27 HydrophobicContact CB-CZ 3.63Å; S25-F27 WeakPolarHBondContact O-CD1 3.36Å; F27-F29 HydrophobicContact CE2-CB 4.21Å; F27-F29 AromaticContact CE2-CD2 3.92Å; F27-F29 HydrophobicContact CE2-CD2 3.92Å; F27-F29 HydrophobicContact CE2-CG 4.5Å; F27-F29 AromaticContact CZ-CD2 3.82Å; F27-F29 HydrophobicContact CZ-CD2 3.82Å; F27-F29 PolarHBondContact O-N 3.18Å; F27-F29 VanDerWaalsContact O-N 3.14Å; F27-Y32 HydrophobicContact CB-CE2 4.43Å; F27-Y32 AromaticContact CD2-CD2 3.6Å; F27-Y32 HydrophobicContact CD2-CD2 3.6Å; F27-Y32 HydrophobicContact CD2-CE2 4.12Å; F27-Y32 HydrophobicContact CD2-CG 4.22Å; F27-Y32 HydrophobicContact CE2-CD2 4.19Å; F27-Y32 HydrophobicContact CE2-CG 4.45Å; F27-M34 HydrophobicContact CE2-SD 4.41Å; F27-M34 HydrophobicContact CZ-SD 4.25Å; F27-L98 HydrophobicContact CD1-CD1 3.75Å; F27-L98 HydrophobicContact CD2-CD1 3.45Å; F27-L98 VanDerWaalsContact CD2-CD1 3.45Å; F27-L98 HydrophobicContact CE1-CD1 3.49Å; F27-L98 VanDerWaalsContact CE1-CD1 3.49Å; F27-L98 HydrophobicContact CE2-CD1 3.15Å; F27-L98 HydrophobicContact CE2-CG 4.5Å; F27-L98 HydrophobicContact CG-CD1 3.73Å; F27-L98 HydrophobicContact CZ-CD1 3.19Å
28	T	91.8	Very high	94.9	Very high	81 Å²	81	39.7 Å²	39.7	50%	0.497	22%	0.22	S	C	.	.			trans	-74.4	100	172.9	-50.8	0	0	0	0	109.6	S30 D31 Y32	T28-S30 VanDerWaalsContact C-N 3.29Å; T28-S30 WeakPolarHBondContact CG2-OG 3.34Å; T28-S30 PolarHBondContact O-N 3.12Å; T28-D31 VanDerWaalsContact CB-OD2 3.24Å; T28-D31 WeakPolarHBondContact CB-OD2 3.43Å; T28-D31 HydrophobicContact CG2-CB 4.49Å; T28-D31 VanDerWaalsContact CG2-CG 3.46Å; T28-D31 WeakPolarHBondContact CG2-OD1 3.44Å; T28-D31 VanDerWaalsContact CG2-OD2 3.28Å; T28-D31 WeakPolarHBondContact CG2-OD2 3.48Å; T28-D31 PolarHBondContact O-N 3.07Å; T28-D31 VanDerWaalsContact O-N 3.1Å; T28-Y32 WeakPolarHBondContact O-CD2 3.31Å
29	F	91.8	Very high	94.8	Very high	5 Å²	5	41.9 Å²	41.9	2%	0.022	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-55.2	-41.6	-170.5	-178.7	-107.6	0	0	0	113.7	A24 F27 D31 Y32 M34 R72 N74 L79	A24-F29 HydrophobicContact CB-CD2 3.61Å; A24-F29 HydrophobicContact CB-CE2 3.83Å; F27-F29 HydrophobicContact CE2-CB 4.21Å; F27-F29 AromaticContact CE2-CD2 3.92Å; F27-F29 HydrophobicContact CE2-CD2 3.92Å; F27-F29 HydrophobicContact CE2-CG 4.5Å; F27-F29 AromaticContact CZ-CD2 3.82Å; F27-F29 HydrophobicContact CZ-CD2 3.82Å; F27-F29 PolarHBondContact O-N 3.18Å; F27-F29 VanDerWaalsContact O-N 3.14Å; F29-D31 PolarHBondContact O-N 3.05Å; F29-Y32 PolarHBondContact O-N 3.46Å; F29-M34 HydrophobicContact CD2-CG 4.41Å; F29-M34 HydrophobicContact CD2-SD 4.26Å; F29-M34 HydrophobicContact CE2-CE 4.07Å; F29-M34 HydrophobicContact CE2-CG 3.66Å; F29-M34 HydrophobicContact CE2-SD 3.86Å; F29-M34 HydrophobicContact CZ-CG 4.01Å; F29-R72 VanDerWaalsContact C-NH2 3.27Å; F29-R72 HydrophobicContact CE1-CB 4.08Å; F29-R72 HydrophobicContact CZ-CB 4.24Å; F29-R72 PolarHBondContact O-NH2 2.82Å; F29-N74 VanDerWaalsContact CD1-OD1 3.28Å; F29-N74 WeakPolarHBondContact CD1-OD1 3.47Å; F29-N74 WeakPolarHBondContact CE1-OD1 3.22Å; F29-L79 HydrophobicContact CZ-CB 4.33Å
30	S	90.8	Very high	94.6	Very high	35 Å²	35	36.6 Å²	36.6	25%	0.245	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-57.8	-30.7	179.9	48	0	0	0	0	114.1	T28 Y32 G53	T28-S30 VanDerWaalsContact C-N 3.29Å; T28-S30 WeakPolarHBondContact CG2-OG 3.34Å; T28-S30 PolarHBondContact O-N 3.12Å; S30-Y32 VanDerWaalsContact C-N 3.26Å; S30-Y32 PolarHBondContact O-N 2.85Å; S30-G53 CarbonylContact O-C 3.6Å; S30-G53 WeakPolarHBondContact O-CA 3.5Å
31	D	89	Confident	94.3	Very high	97 Å²	97	41.2 Å²	41.2	52%	0.519	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-81	-11.1	-168.7	-56.9	-2.1	0	0	0	112.5	T28 F29	T28-D31 VanDerWaalsContact CB-OD2 3.24Å; T28-D31 WeakPolarHBondContact CB-OD2 3.43Å; T28-D31 HydrophobicContact CG2-CB 4.49Å; T28-D31 VanDerWaalsContact CG2-CG 3.46Å; T28-D31 WeakPolarHBondContact CG2-OD1 3.44Å; T28-D31 VanDerWaalsContact CG2-OD2 3.28Å; T28-D31 WeakPolarHBondContact CG2-OD2 3.48Å; T28-D31 PolarHBondContact O-N 3.07Å; T28-D31 VanDerWaalsContact O-N 3.1Å; F29-D31 PolarHBondContact O-N 3.05Å
32	Y	89.1	Confident	93.9	Very high	99 Å²	99	44.4 Å²	44.4	39%	0.388	28%	0.278	S	S	.	.	S	Bend	trans	-115.5	150.1	-173	-67.8	-93.2	0	0	0	112.4	F27 T28 F29 S30 R72 L98	F27-Y32 HydrophobicContact CB-CE2 4.43Å; F27-Y32 AromaticContact CD2-CD2 3.6Å; F27-Y32 HydrophobicContact CD2-CD2 3.6Å; F27-Y32 HydrophobicContact CD2-CE2 4.12Å; F27-Y32 HydrophobicContact CD2-CG 4.22Å; F27-Y32 HydrophobicContact CE2-CD2 4.19Å; F27-Y32 HydrophobicContact CE2-CG 4.45Å; T28-Y32 WeakPolarHBondContact O-CD2 3.31Å; F29-Y32 PolarHBondContact O-N 3.46Å; S30-Y32 VanDerWaalsContact C-N 3.26Å; S30-Y32 PolarHBondContact O-N 2.85Å; Y32-R72 PolarHBondContact O-NH1 2.95Å; Y32-L98 HydrophobicContact CD1-CD1 4.35Å; Y32-L98 HydrophobicContact CD1-CD2 4.08Å; Y32-L98 HydrophobicContact CD1-CG 4.23Å; Y32-L98 HydrophobicContact CE1-CD2 4.43Å; Y32-L98 HydrophobicContact CG-CD1 4.12Å; Y32-L98 HydrophobicContact CG-CG 4.37Å
33	W	92.3	Very high	93.6	Very high	95 Å²	95	50.9 Å²	50.9	36%	0.36	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	146.1	168.6	-53.4	-1.6	0	0	0	108.8	R50 I51 T52 G99 G100	W33-R50 HydrophobicContact CB-CG 4.38Å; W33-R50 VanDerWaalsContact CE3-NH1 3.34Å; W33-I51 WeakPolarHBondContact CA-O 3.29Å; W33-T52 HydrophobicContact CD2-CG2 4Å; W33-T52 HydrophobicContact CG-CG2 4.16Å; W33-T52 HydrophobicContact CZ2-CG2 4.36Å; W33-G99 CarbonylContact C-O 3.48Å; W33-G99 WeakPolarHBondContact CB-O 3.28Å; W33-G99 PolarHBondContact N-O 2.96Å; W33-G99 PolarHBondContact O-N 2.84Å; W33-G100 WeakPolarHBondContact CZ3-O 3.38Å
34	M	94.4	Very high	93.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	137.2	-177.9	-63	-56.8	-58.9	0	0	109.1	L4 F27 F29 R50 I51 L79 L98	L4-M34 HydrophobicContact CD2-CE 3.94Å; F27-M34 HydrophobicContact CE2-SD 4.41Å; F27-M34 HydrophobicContact CZ-SD 4.25Å; F29-M34 HydrophobicContact CD2-CG 4.41Å; F29-M34 HydrophobicContact CD2-SD 4.26Å; F29-M34 HydrophobicContact CE2-CE 4.07Å; F29-M34 HydrophobicContact CE2-CG 3.66Å; F29-M34 HydrophobicContact CE2-SD 3.86Å; F29-M34 HydrophobicContact CZ-CG 4.01Å; M34-R50 CarbonylContact O-C 3.5Å; M34-R50 VanDerWaalsContact O-CA 3.31Å; M34-R50 WeakPolarHBondContact O-CA 3.38Å; M34-I51 HydrophobicContact CB-CG2 4.09Å; M34-I51 PolarHBondContact N-O 3.35Å; M34-I51 PolarHBondContact O-N 2.95Å; M34-L79 HydrophobicContact CB-CD1 3.64Å; M34-L79 HydrophobicContact CB-CD2 3.81Å; M34-L79 HydrophobicContact CB-CG 4.25Å; M34-L79 HydrophobicContact CE-CD2 4.44Å; M34-L79 HydrophobicContact CG-CD1 4.4Å; M34-L98 HydrophobicContact SD-CB 4.43Å
35	H	95.9	Very high	93.1	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.019	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	150.8	-176.1	-60.1	-111.5	0	0	0	110.8	W47 S49 R50 C96 V97 G100	H35-W47 AromaticContact ND1-CD1 3.91Å; H35-W47 AromaticContact ND1-NE1 3.3Å; H35-W47 PolarHBondContact ND1-NE1 2.84Å; H35-S49 VanDerWaalsContact CA-O 3.3Å; H35-S49 WeakPolarHBondContact CA-O 3.38Å; H35-R50 VanDerWaalsContact CE1-CG 3.45Å; H35-R50 WeakPolarHBondContact CE1-CG 3.31Å; H35-C96 WeakPolarHBondContact O-CA 3.42Å; H35-V97 HydrophobicContact CB-CB 4.3Å; H35-V97 PolarHBondContact N-O 3.08Å; H35-V97 PolarHBondContact O-N 2.92Å; H35-G100 PolarHBondContact NE2-O 3.14Å
36	W	97.6	Very high	93.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	134.3	157.9	-76.3	98.8	0	0	0	109.4	E6 L20 C22 V48 S49 L79 L81 Y95 C96	E6-W36 HydrophobicContact CB-CH2 4.49Å; E6-W36 HydrophobicContact CG-CH2 3.93Å; E6-W36 HydrophobicContact CG-CZ3 3.91Å; L20-W36 HydrophobicContact CB-CH2 3.74Å; L20-W36 HydrophobicContact CB-CZ2 3.95Å; L20-W36 HydrophobicContact CB-CZ3 4.33Å; L20-W36 HydrophobicContact CD1-CE3 4.4Å; L20-W36 HydrophobicContact CD1-CH2 4.29Å; L20-W36 HydrophobicContact CD1-CZ3 4.03Å; C22-W36 HydrophobicContact CB-CH2 3.99Å; C22-W36 HydrophobicContact CB-CZ2 3.96Å; W36-V48 HydrophobicContact CB-CB 4.07Å; W36-V48 HydrophobicContact CB-CG1 4.42Å; W36-V48 WeakPolarHBondContact O-CB 3.42Å; W36-V48 PolarHBondContact O-N 3.11Å; W36-S49 PolarHBondContact N-O 3.44Å; W36-S49 PolarHBondContact O-N 3.39Å; W36-L79 HydrophobicContact CD2-CD2 4.49Å; W36-L79 HydrophobicContact CG-CD2 4.44Å; W36-L79 HydrophobicContact CZ2-CD2 4.36Å; W36-L79 VanDerWaalsContact NE1-CD2 3.28Å; W36-L81 HydrophobicContact CB-CD2 4.19Å; W36-L81 HydrophobicContact CD2-CB 4.2Å; W36-L81 HydrophobicContact CD2-CD2 4.2Å; W36-L81 HydrophobicContact CG-CB 4.2Å; W36-L81 HydrophobicContact CG-CD1 4.43Å; W36-L81 HydrophobicContact CG-CD2 3.93Å; W36-L81 HydrophobicContact CG-CG 4.43Å; W36-L81 HydrophobicContact CZ2-CB 4.36Å; W36-Y95 WeakPolarHBondContact CA-O 3.3Å; W36-C96 HydrophobicContact CE3-CB 4.35Å; W36-C96 HydrophobicContact CH2-CB 4.16Å; W36-C96 HydrophobicContact CZ2-CB 4.35Å; W36-C96 HydrophobicContact CZ3-CB 4.16Å
37	V	96.8	Very high	93.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147.3	174.3	-176.4	0	0	0	0	107.4	L45 M46 Y94 Y95 V97 F102 W108	V37-L45 HydrophobicContact CG1-CB 4.12Å; V37-L45 HydrophobicContact CG1-CD2 4.01Å; V37-M46 WeakPolarHBondContact CG1-O 3.18Å; V37-Y94 CarbonylContact O-C 3.59Å; V37-Y94 WeakPolarHBondContact O-CA 3.2Å; V37-Y95 PolarHBondContact N-O 2.93Å; V37-Y95 PolarHBondContact O-N 3.39Å; V37-V97 HydrophobicContact CB-CG2 4.23Å; V37-V97 HydrophobicContact CG2-CG2 3.76Å; V37-F102 HydrophobicContact CG2-CE2 3.83Å; V37-W108 HydrophobicContact CB-CH2 4.04Å; V37-W108 HydrophobicContact CB-CZ3 3.89Å; V37-W108 HydrophobicContact CG1-CH2 3.85Å; V37-W108 HydrophobicContact CG1-CZ3 3.94Å; V37-W108 HydrophobicContact CG2-CH2 4.02Å; V37-W108 HydrophobicContact CG2-CZ3 4.25Å
38	R	97.1	Very high	93.4	Very high	10 Å²	10	54.1 Å²	54.1	4%	0.038	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.5	174.3	72.3	-178.8	178.6	-175.5	1.6	111.8	V40 M46 V48 D90 A92 V93 Y94	R38-V40 HydrophobicContact CG-CG2 4.38Å; R38-M46 HydrophobicContact CG-CB 4.23Å; R38-M46 PolarHBondContact N-O 2.95Å; R38-M46 PolarHBondContact O-N 2.92Å; R38-V48 HydrophobicContact CB-CG2 3.89Å; R38-V48 HydrophobicContact CG-CG2 3.67Å; R38-D90 IonicContact CZ-OD1 3.82Å; R38-D90 IonicContact NH1-OD1 3.99Å; R38-D90 PolarHBondContact NH1-OD1 2.87Å; R38-D90 IonicContact NH2-OD1 2.74Å; R38-A92 HydrophobicContact CB-CB 3.81Å; R38-A92 HydrophobicContact CG-CB 4.18Å; R38-V93 CarbonylContact C-O 3.35Å; R38-V93 WeakPolarHBondContact CA-O 3.28Å; R38-Y94 HydrophobicContact CB-CD1 3.96Å; R38-Y94 HydrophobicContact CB-CD2 4.34Å; R38-Y94 HydrophobicContact CB-CE1 3.93Å; R38-Y94 HydrophobicContact CB-CE2 4.29Å; R38-Y94 HydrophobicContact CB-CG 4.17Å; R38-Y94 PolarHBondContact NH1-OH 3.23Å; R38-Y94 VanDerWaalsContact NH1-OH 3.11Å
39	Q	96.9	Very high	93.7	Very high	80 Å²	80	50.2 Å²	50.2	37%	0.374	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	108.9	170.2	-172.8	177.5	21.8	0	0	108.7	L45 A92 V93 Y95	Q39-L45 HydrophobicContact CB-CD2 3.95Å; Q39-L45 HydrophobicContact CG-CD2 4.43Å; Q39-A92 WeakPolarHBondContact O-CA 3.38Å; Q39-A92 VanDerWaalsContact O-CB 3.31Å; Q39-A92 WeakPolarHBondContact O-CB 3.3Å; Q39-V93 PolarHBondContact N-O 2.82Å; Q39-V93 PolarHBondContact O-N 2.82Å; Q39-Y95 HydrophobicContact CB-CE2 3.71Å; Q39-Y95 PolarHBondContact OE1-OH 3.01Å
40	V	94.1	Very high	93.8	Very high	16 Å²	16	52.5 Å²	52.5	10%	0.097	29%	0.289	C	S	.	.			trans	-82	133.7	177.1	-179.4	0	0	0	0	108.1	R38 G42 K43 M46 A92	R38-V40 HydrophobicContact CG-CG2 4.38Å; V40-G42 PolarHBondContact O-N 2.88Å; V40-K43 HydrophobicContact CB-CB 4.03Å; V40-K43 HydrophobicContact CB-CD 4.05Å; V40-K43 HydrophobicContact CB-CG 4.19Å; V40-K43 HydrophobicContact CG1-CD 3.89Å; V40-K43 HydrophobicContact CG1-CG 4.13Å; V40-K43 CarbonylContact O-C 3.44Å; V40-K43 WeakPolarHBondContact O-CA 3.27Å; V40-K43 PolarHBondContact O-N 2.93Å; V40-M46 HydrophobicContact CG2-SD 4.17Å; V40-A92 HydrophobicContact CG2-CB 4.08Å
41	P	91.3	Very high	94	Very high	96 Å²	96	51.1 Å²	51.1	62%	0.623	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	131	177.9	-27.4	35	0	0	0	112.2	K43	P41-K43 PolarHBondContact O-N 2.77Å
42	G	91.3	Very high	94.2	Very high	94 Å²	94	47 Å²	47	97%	0.969	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	3	-177	0	0	0	0	0	115.1	V40	V40-G42 PolarHBondContact O-N 2.88Å
43	K	90.9	Very high	93.9	Very high	137 Å²	137	42.4 Å²	42.4	60%	0.596	24%	0.239	S	C	*	.	S	Bend	trans	-120.7	172.9	171.6	-50.9	-173	179.7	179.1	0	110.5	V40 P41	V40-K43 HydrophobicContact CB-CB 4.03Å; V40-K43 HydrophobicContact CB-CD 4.05Å; V40-K43 HydrophobicContact CB-CG 4.19Å; V40-K43 HydrophobicContact CG1-CD 3.89Å; V40-K43 HydrophobicContact CG1-CG 4.13Å; V40-K43 CarbonylContact O-C 3.44Å; V40-K43 WeakPolarHBondContact O-CA 3.27Å; V40-K43 PolarHBondContact O-N 2.93Å; P41-K43 PolarHBondContact O-N 2.77Å
44	G	90.1	Very high	93.1	Very high	49 Å²	49	44.4 Å²	44.4	51%	0.505	26%	0.257	S	S	.	.			trans	-78.8	-173.4	173.9	0	0	0	0	0	113.6
45	L	93.6	Very high	92.3	Very high	94 Å²	94	51.8 Å²	51.8	49%	0.492	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	134.8	170.2	-69.1	165.4	0	0	0	110.4	V37 Q39 Y95 W108	V37-L45 HydrophobicContact CG1-CB 4.12Å; V37-L45 HydrophobicContact CG1-CD2 4.01Å; Q39-L45 HydrophobicContact CB-CD2 3.95Å; Q39-L45 HydrophobicContact CG-CD2 4.43Å; L45-Y95 HydrophobicContact CD2-CD2 4.37Å; L45-Y95 HydrophobicContact CD2-CE2 4.26Å; L45-W108 HydrophobicContact CD1-CH2 3.94Å; L45-W108 HydrophobicContact CD1-CZ3 4.4Å; L45-W108 HydrophobicContact CD2-CH2 4.25Å; L45-W108 HydrophobicContact CD2-CZ3 4.03Å
46	M	95.3	Very high	91.7	Very high	77 Å²	77	55.5 Å²	55.5	38%	0.379	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.3	179.3	-59.7	-173.6	76.2	0	0	109.6	V37 R38 V40	V37-M46 WeakPolarHBondContact CG1-O 3.18Å; R38-M46 HydrophobicContact CG-CB 4.23Å; R38-M46 PolarHBondContact N-O 2.95Å; R38-M46 PolarHBondContact O-N 2.92Å; V40-M46 HydrophobicContact CG2-SD 4.17Å
47	W	95.4	Very high	91.4	Very high	66 Å²	66	58.4 Å²	58.4	25%	0.25	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	140.6	175.7	-179.8	73.1	0	0	0	111.2	H35 S49 R50 T59 A61 F102	H35-W47 AromaticContact ND1-CD1 3.91Å; H35-W47 AromaticContact ND1-NE1 3.3Å; H35-W47 PolarHBondContact ND1-NE1 2.84Å; W47-S49 VanDerWaalsContact CZ2-CA 3.46Å; W47-S49 PolarHBondContact NE1-O 3.07Å; W47-R50 HydrophobicContact CZ2-CB 3.7Å; W47-T59 HydrophobicContact CH2-CG2 3.91Å; W47-A61 HydrophobicContact CE3-CB 3.87Å; W47-A61 HydrophobicContact CZ3-CB 4.01Å; W47-A61 VanDerWaalsContact O-CB 3.31Å; W47-A61 WeakPolarHBondContact O-CB 3.38Å; W47-F102 HydrophobicContact CB-CD2 4.16Å; W47-F102 HydrophobicContact CB-CE2 3.64Å; W47-F102 HydrophobicContact CB-CZ 3.87Å; W47-F102 AromaticContact CD1-CD2 3.53Å; W47-F102 AromaticContact CD1-CE2 3.65Å; W47-F102 HydrophobicContact CG-CD2 4.03Å; W47-F102 AromaticContact CG-CE2 3.95Å; W47-F102 HydrophobicContact CG-CE2 3.95Å
48	V	97.1	Very high	91.4	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.006	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	-55.2	-176.7	178.5	0	0	0	0	111.2	W36 R38 A61 V64 F68 L81 Y94	W36-V48 HydrophobicContact CB-CB 4.07Å; W36-V48 HydrophobicContact CB-CG1 4.42Å; W36-V48 WeakPolarHBondContact O-CB 3.42Å; W36-V48 PolarHBondContact O-N 3.11Å; R38-V48 HydrophobicContact CB-CG2 3.89Å; R38-V48 HydrophobicContact CG-CG2 3.67Å; V48-A61 PolarHBondContact O-N 2.94Å; V48-V64 HydrophobicContact CG1-CG1 4.38Å; V48-V64 HydrophobicContact CG1-CG2 4.01Å; V48-F68 HydrophobicContact CG1-CD2 3.86Å; V48-F68 HydrophobicContact CG1-CE2 4.27Å; V48-L81 HydrophobicContact CG1-CD2 4.15Å; V48-Y94 HydrophobicContact CG2-CE1 4.18Å
49	S	96.8	Very high	91.3	Very high	0 Å²	0	63 Å²	63	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	166.5	-177.2	58.3	0	0	0	0	112.5	H35 W36 W47 T59	H35-S49 VanDerWaalsContact CA-O 3.3Å; H35-S49 WeakPolarHBondContact CA-O 3.38Å; W36-S49 PolarHBondContact N-O 3.44Å; W36-S49 PolarHBondContact O-N 3.39Å; W47-S49 VanDerWaalsContact CZ2-CA 3.46Å; W47-S49 PolarHBondContact NE1-O 3.07Å; S49-T59 CarbonylContact C-O 3.52Å; S49-T59 WeakPolarHBondContact CA-O 3.39Å; S49-T59 WeakPolarHBondContact CB-O 3.4Å
50	R	95	Very high	91.4	Very high	53 Å²	53	61 Å²	61	20%	0.2	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	145.5	176.7	178.2	-161.9	65.1	169.2	-3	109.7	W33 M34 H35 W47 T58 T59	W33-R50 HydrophobicContact CB-CG 4.38Å; W33-R50 VanDerWaalsContact CE3-NH1 3.34Å; M34-R50 CarbonylContact O-C 3.5Å; M34-R50 VanDerWaalsContact O-CA 3.31Å; M34-R50 WeakPolarHBondContact O-CA 3.38Å; H35-R50 VanDerWaalsContact CE1-CG 3.45Å; H35-R50 WeakPolarHBondContact CE1-CG 3.31Å; W47-R50 HydrophobicContact CZ2-CB 3.7Å; R50-T58 CarbonylContact O-C 3.5Å; R50-T58 VanDerWaalsContact O-CA 3.28Å; R50-T58 WeakPolarHBondContact O-CA 3.45Å; R50-T59 PolarHBondContact N-O 2.74Å; R50-T59 PolarHBondContact NH2-OG1 3.22Å; R50-T59 PolarHBondContact O-N 3.05Å
51	I	94.9	Very high	91.5	Very high	5 Å²	5	60.9 Å²	60.9	3%	0.026	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	134	164.7	-170.5	161.8	0	0	0	110	W33 M34 N56 T57 T58 I70 R72 L79	W33-I51 WeakPolarHBondContact CA-O 3.29Å; M34-I51 HydrophobicContact CB-CG2 4.09Å; M34-I51 PolarHBondContact N-O 3.35Å; M34-I51 PolarHBondContact O-N 2.95Å; I51-N56 HydrophobicContact CD1-CB 4.4Å; I51-T57 WeakPolarHBondContact CA-O 3.12Å; I51-T58 HydrophobicContact CB-CG2 4.34Å; I51-T58 HydrophobicContact CD1-CG2 3.89Å; I51-T58 HydrophobicContact CG1-CG2 3.99Å; I51-I70 HydrophobicContact CB-CD1 3.98Å; I51-I70 HydrophobicContact CB-CG1 4.27Å; I51-I70 HydrophobicContact CB-CG2 4.12Å; I51-I70 HydrophobicContact CG2-CD1 3.72Å; I51-I70 HydrophobicContact CG2-CG1 4.08Å; I51-R72 HydrophobicContact CD1-CB 4.28Å; I51-R72 HydrophobicContact CD1-CG 3.74Å; I51-R72 HydrophobicContact CG1-CG 4.35Å; I51-R72 HydrophobicContact CG2-CB 4.4Å; I51-L79 HydrophobicContact CG2-CD1 3.48Å; I51-L79 VanDerWaalsContact CG2-CD1 3.48Å
52	T	91.7	Very high	91.8	Very high	11 Å²	11	62.3 Å²	62.3	7%	0.067	35%	0.351	C	S	.	.			trans	-76.2	167.2	175.6	62.9	0	0	0	0	111.7	W33 N56 T57 R72	W33-T52 HydrophobicContact CD2-CG2 4Å; W33-T52 HydrophobicContact CG-CG2 4.16Å; W33-T52 HydrophobicContact CZ2-CG2 4.36Å; T52-N56 PolarHBondContact OG1-N 2.69Å; T52-T57 PolarHBondContact N-O 3.11Å; T52-T57 VanDerWaalsContact N-O 3.13Å; T52-T57 PolarHBondContact OG1-N 3.05Å; T52-R72 PolarHBondContact O-NH1 3.16Å
53	G	83.1	Confident	91.9	Very high	2 Å²	2	60.2 Å²	60.2	2%	0.021	32%	0.322	C	S	.	.	S	Bend	trans	-64	-79.3	175.8	0	0	0	0	0	113.5	S30 R72	S30-G53 CarbonylContact O-C 3.6Å; S30-G53 WeakPolarHBondContact O-CA 3.5Å; G53-R72 VanDerWaalsContact CA-NH1 3.29Å
54	D	75.1	Confident	92.2	Very high	137 Å²	137	53.7 Å²	53.7	73%	0.733	29%	0.294	S	S	*	.	S	Bend	trans	-80.3	-34.9	-165.8	-55.7	-43.3	0	0	0	113.6
55	E	78.1	Confident	92.5	Very high	155 Å²	155	58.5 Å²	58.5	72%	0.724	30%	0.296	S	S	*	.	S	Bend	trans	-95.7	-7.7	-173.7	-62.9	177.4	173.4	0	0	113.3	T57	E55-T57 PolarHBondContact O-N 2.86Å
56	N	83.4	Confident	92.6	Very high	82 Å²	82	57.9 Å²	57.9	44%	0.439	31%	0.313	S	S	.	.			trans	49.3	29.1	-172.2	-75.5	-42.5	0	0	0	113.8	I51 T52 T58 R72	I51-N56 HydrophobicContact CD1-CB 4.4Å; T52-N56 PolarHBondContact OG1-N 2.69Å; N56-T58 PolarHBondContact O-N 2.76Å; N56-R72 VanDerWaalsContact OD1-CD 3.22Å; N56-R72 WeakPolarHBondContact OD1-CD 3.41Å; N56-R72 WeakPolarHBondContact OD1-CG 3.24Å
57	T	92.5	Very high	92.8	Very high	62 Å²	62	55.7 Å²	55.7	38%	0.38	30%	0.3	S	S	.	.			trans	-69	116.9	179.6	-64.5	0	0	0	0	109.2	I51 T52 E55	I51-T57 WeakPolarHBondContact CA-O 3.12Å; T52-T57 PolarHBondContact N-O 3.11Å; T52-T57 VanDerWaalsContact N-O 3.13Å; T52-T57 PolarHBondContact OG1-N 3.05Å; E55-T57 PolarHBondContact O-N 2.86Å
58	T	95.9	Very high	92.9	Very high	56 Å²	56	52.7 Å²	52.7	34%	0.344	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	147.1	-178.7	68	0	0	0	0	112.6	R50 I51 N56 Y60 I70	R50-T58 CarbonylContact O-C 3.5Å; R50-T58 VanDerWaalsContact O-CA 3.28Å; R50-T58 WeakPolarHBondContact O-CA 3.45Å; I51-T58 HydrophobicContact CB-CG2 4.34Å; I51-T58 HydrophobicContact CD1-CG2 3.89Å; I51-T58 HydrophobicContact CG1-CG2 3.99Å; N56-T58 PolarHBondContact O-N 2.76Å; T58-Y60 WeakPolarHBondContact OG1-CE2 3.47Å; T58-I70 HydrophobicContact CG2-CG2 3.65Å
59	T	95.6	Very high	93	Very high	50 Å²	50	56.4 Å²	56.4	31%	0.307	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	147.8	172.6	-42.5	0	0	0	0	109	W47 S49 R50	W47-T59 HydrophobicContact CH2-CG2 3.91Å; S49-T59 CarbonylContact C-O 3.52Å; S49-T59 WeakPolarHBondContact CA-O 3.39Å; S49-T59 WeakPolarHBondContact CB-O 3.4Å; R50-T59 PolarHBondContact N-O 2.74Å; R50-T59 PolarHBondContact NH2-OG1 3.22Å; R50-T59 PolarHBondContact O-N 3.05Å
60	Y	97.7	Very high	93	Very high	37 Å²	37	56.6 Å²	56.6	15%	0.145	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	148	-173.5	-58	-87.2	0	0	0	111.1	T58 F68 I70	T58-Y60 WeakPolarHBondContact OG1-CE2 3.47Å; Y60-F68 WeakPolarHBondContact CE1-O 3.35Å; Y60-I70 HydrophobicContact CE1-CB 4.22Å; Y60-I70 HydrophobicContact CE1-CG2 3.85Å; Y60-I70 PolarHBondContact OH-N 2.92Å; Y60-I70 VanDerWaalsContact OH-N 3.08Å
61	A	96.8	Very high	93.2	Very high	15 Å²	15	56.2 Å²	56.2	12%	0.124	32%	0.318	C	S	.	.			trans	-68.3	145.7	167	0	0	0	0	0	110.1	W47 V48 S63 V64 R65	W47-A61 HydrophobicContact CE3-CB 3.87Å; W47-A61 HydrophobicContact CZ3-CB 4.01Å; W47-A61 VanDerWaalsContact O-CB 3.31Å; W47-A61 WeakPolarHBondContact O-CB 3.38Å; V48-A61 PolarHBondContact O-N 2.94Å; A61-S63 PolarHBondContact O-N 3.17Å; A61-S63 VanDerWaalsContact O-N 3.17Å; A61-V64 HydrophobicContact CB-CG2 4.28Å; A61-V64 WeakPolarHBondContact O-CG2 3.3Å; A61-V64 PolarHBondContact O-N 3.04Å; A61-R65 PolarHBondContact O-N 2.84Å; A61-R65 VanDerWaalsContact O-N 3.09Å
62	D	96.8	Very high	93.2	Very high	126 Å²	126	57.4 Å²	57.4	67%	0.674	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-28.2	-176	-65.5	-32.6	0	0	0	112.8	V64 R65	D62-V64 PolarHBondContact O-N 2.96Å; D62-R65 IonicContact OD1-CZ 3.38Å; D62-R65 IonicContact OD1-NE 3.04Å; D62-R65 PolarHBondContact OD1-NE 3.05Å; D62-R65 IonicContact OD1-NH2 3.07Å; D62-R65 PolarHBondContact OD1-NH2 3.29Å
63	S	95.1	Very high	93.4	Very high	50 Å²	50	58.7 Å²	58.7	35%	0.35	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-21.6	176.3	59.2	0	0	0	0	114.6	A61 R67	A61-S63 PolarHBondContact O-N 3.17Å; A61-S63 VanDerWaalsContact O-N 3.17Å; S63-R67 PolarHBondContact O-NH2 3.01Å
64	V	97.2	Very high	93.9	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-3.3	-176.7	-57.9	0	0	0	0	113.2	V48 A61 D62 G66 R67 F68	V48-V64 HydrophobicContact CG1-CG1 4.38Å; V48-V64 HydrophobicContact CG1-CG2 4.01Å; A61-V64 HydrophobicContact CB-CG2 4.28Å; A61-V64 WeakPolarHBondContact O-CG2 3.3Å; A61-V64 PolarHBondContact O-N 3.04Å; D62-V64 PolarHBondContact O-N 2.96Å; V64-G66 PolarHBondContact O-N 3.34Å; V64-R67 PolarHBondContact O-N 2.77Å; V64-F68 HydrophobicContact CB-CB 4.08Å; V64-F68 HydrophobicContact CB-CD1 4.3Å; V64-F68 HydrophobicContact CB-CD2 3.61Å; V64-F68 HydrophobicContact CB-CE2 4.03Å; V64-F68 HydrophobicContact CB-CG 3.75Å; V64-F68 HydrophobicContact CG1-CD2 3.64Å; V64-F68 HydrophobicContact CG1-CE2 3.53Å; V64-F68 HydrophobicContact CG1-CG 4.21Å; V64-F68 HydrophobicContact CG1-CZ 4.01Å; V64-F68 HydrophobicContact CG2-CB 4.3Å; V64-F68 HydrophobicContact CG2-CD2 4.11Å; V64-F68 HydrophobicContact CG2-CG 4.38Å; V64-F68 PolarHBondContact O-N 3.18Å
65	R	96	Very high	94.8	Very high	150 Å²	150	60 Å²	60	57%	0.566	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	131.8	-178.8	-172.5	-176.7	-64.7	-95.1	2.2	110.5	A61 D62 R67	A61-R65 PolarHBondContact O-N 2.84Å; A61-R65 VanDerWaalsContact O-N 3.09Å; D62-R65 IonicContact OD1-CZ 3.38Å; D62-R65 IonicContact OD1-NE 3.04Å; D62-R65 PolarHBondContact OD1-NE 3.05Å; D62-R65 IonicContact OD1-NH2 3.07Å; D62-R65 PolarHBondContact OD1-NH2 3.29Å; R65-R67 PolarHBondContact O-N 2.9Å
66	G	96.4	Very high	95.7	Very high	81 Å²	81	58.9 Å²	58.9	84%	0.835	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	-6.3	-178.3	0	0	0	0	0	115	V64	V64-G66 PolarHBondContact O-N 3.34Å
67	R	97.9	Very high	96.3	Very high	30 Å²	30	56.6 Å²	56.6	11%	0.113	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-37.9	177.7	-64.6	-166.9	-57.3	116	0.1	112.6	S63 V64 R65 S84 G85 D90	S63-R67 PolarHBondContact O-NH2 3.01Å; V64-R67 PolarHBondContact O-N 2.77Å; R65-R67 PolarHBondContact O-N 2.9Å; R67-S84 WeakPolarHBondContact CB-O 3.3Å; R67-S84 WeakPolarHBondContact O-CB 3.33Å; R67-S84 PolarHBondContact O-N 2.93Å; R67-S84 VanDerWaalsContact O-N 3.08Å; R67-G85 PolarHBondContact NH1-O 2.96Å; R67-D90 IonicContact CZ-OD1 3.05Å; R67-D90 IonicContact CZ-OD2 3.11Å; R67-D90 IonicContact NH1-OD1 3.35Å; R67-D90 IonicContact NH1-OD2 2.83Å; R67-D90 PolarHBondContact NH1-OD2 3.31Å; R67-D90 IonicContact NH2-OD1 3.97Å; R67-D90 PolarHBondContact NH2-OD1 2.79Å; R67-D90 IonicContact NH2-OD2 2.69Å; R67-D90 PolarHBondContact NH2-OD2 2.97Å; R67-D90 VanDerWaalsContact NH2-OD2 3.11Å
68	F	98.3	Very high	96.5	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.018	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	145.1	-176.8	-67	11.5	0	0	0	110.8	V48 Y60 V64 L81 Q82 M83 L86 D90 Y94	V48-F68 HydrophobicContact CG1-CD2 3.86Å; V48-F68 HydrophobicContact CG1-CE2 4.27Å; Y60-F68 WeakPolarHBondContact CE1-O 3.35Å; V64-F68 HydrophobicContact CB-CB 4.08Å; V64-F68 HydrophobicContact CB-CD1 4.3Å; V64-F68 HydrophobicContact CB-CD2 3.61Å; V64-F68 HydrophobicContact CB-CE2 4.03Å; V64-F68 HydrophobicContact CB-CG 3.75Å; V64-F68 HydrophobicContact CG1-CD2 3.64Å; V64-F68 HydrophobicContact CG1-CE2 3.53Å; V64-F68 HydrophobicContact CG1-CG 4.21Å; V64-F68 HydrophobicContact CG1-CZ 4.01Å; V64-F68 HydrophobicContact CG2-CB 4.3Å; V64-F68 HydrophobicContact CG2-CD2 4.11Å; V64-F68 HydrophobicContact CG2-CG 4.38Å; V64-F68 PolarHBondContact O-N 3.18Å; F68-L81 HydrophobicContact CB-CD1 4.25Å; F68-L81 HydrophobicContact CD2-CD1 4.49Å; F68-L81 HydrophobicContact CD2-CD2 4.11Å; F68-L81 HydrophobicContact CD2-CG 4.44Å; F68-Q82 CarbonylContact C-O 3.56Å; F68-Q82 VanDerWaalsContact CA-O 3.24Å; F68-Q82 WeakPolarHBondContact CA-O 3.17Å; F68-M83 HydrophobicContact CD1-CB 3.96Å; F68-M83 HydrophobicContact CD1-CG 4.07Å; F68-M83 HydrophobicContact CD2-CG 3.93Å; F68-M83 HydrophobicContact CE1-CB 3.83Å; F68-M83 HydrophobicContact CE1-CG 4.03Å; F68-M83 HydrophobicContact CE2-CE 3.97Å; F68-M83 HydrophobicContact CE2-CG 3.87Å; F68-M83 HydrophobicContact CE2-SD 4.41Å; F68-M83 HydrophobicContact CG-CB 4.43Å; F68-M83 HydrophobicContact CG-CG 4.05Å; F68-M83 HydrophobicContact CZ-CB 4.15Å; F68-M83 HydrophobicContact CZ-CE 3.77Å; F68-M83 HydrophobicContact CZ-CG 3.95Å; F68-L86 HydrophobicContact CE1-CD2 3.88Å; F68-L86 HydrophobicContact CZ-CD2 3.75Å; F68-D90 HydrophobicContact CZ-CB 4.3Å; F68-Y94 HydrophobicContact CE2-CE1 4.22Å
69	T	98.3	Very high	96.6	Very high	78 Å²	78	51.7 Å²	51.7	48%	0.479	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	118.9	178.1	-54.7	0	0	0	0	109.4	Q82	T69-Q82 PolarHBondContact N-O 2.96Å; T69-Q82 PolarHBondContact O-N 3.38Å
70	I	98.3	Very high	96.8	Very high	5 Å²	5	51.1 Å²	51.1	3%	0.026	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	139.3	173.5	-167.5	176	0	0	0	109	I51 T58 Y60 L79 Y80 L81	I51-I70 HydrophobicContact CB-CD1 3.98Å; I51-I70 HydrophobicContact CB-CG1 4.27Å; I51-I70 HydrophobicContact CB-CG2 4.12Å; I51-I70 HydrophobicContact CG2-CD1 3.72Å; I51-I70 HydrophobicContact CG2-CG1 4.08Å; T58-I70 HydrophobicContact CG2-CG2 3.65Å; Y60-I70 HydrophobicContact CE1-CB 4.22Å; Y60-I70 HydrophobicContact CE1-CG2 3.85Å; Y60-I70 PolarHBondContact OH-N 2.92Å; Y60-I70 VanDerWaalsContact OH-N 3.08Å; I70-L79 HydrophobicContact CD1-CD1 3.97Å; I70-L79 HydrophobicContact CG1-CD1 3.99Å; I70-Y80 WeakPolarHBondContact CA-O 3.31Å; I70-Y80 WeakPolarHBondContact CG1-O 3.21Å; I70-L81 HydrophobicContact CB-CD1 4.2Å
71	S	97.4	Very high	96.8	Very high	45 Å²	45	49.4 Å²	49.4	32%	0.315	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	164.8	173.5	62	0	0	0	0	110.5	Y80	S71-Y80 PolarHBondContact N-O 3.06Å; S71-Y80 PolarHBondContact O-N 3.08Å
72	R	96.4	Very high	96.9	Very high	29 Å²	29	51.8 Å²	51.8	11%	0.109	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	152.4	-178.7	67.4	-174.1	-69.2	163.8	2.3	111.3	F29 Y32 I51 T52 G53 N56 N74 T78 L79	F29-R72 VanDerWaalsContact C-NH2 3.27Å; F29-R72 HydrophobicContact CE1-CB 4.08Å; F29-R72 HydrophobicContact CZ-CB 4.24Å; F29-R72 PolarHBondContact O-NH2 2.82Å; Y32-R72 PolarHBondContact O-NH1 2.95Å; I51-R72 HydrophobicContact CD1-CB 4.28Å; I51-R72 HydrophobicContact CD1-CG 3.74Å; I51-R72 HydrophobicContact CG1-CG 4.35Å; I51-R72 HydrophobicContact CG2-CB 4.4Å; T52-R72 PolarHBondContact O-NH1 3.16Å; G53-R72 VanDerWaalsContact CA-NH1 3.29Å; N56-R72 VanDerWaalsContact OD1-CD 3.22Å; N56-R72 WeakPolarHBondContact OD1-CD 3.41Å; N56-R72 WeakPolarHBondContact OD1-CG 3.24Å; R72-N74 VanDerWaalsContact CZ-OD1 3.27Å; R72-N74 PolarHBondContact NE-OD1 2.92Å; R72-N74 PolarHBondContact NH2-OD1 2.98Å; R72-T78 CarbonylContact C-O 3.52Å; R72-T78 WeakPolarHBondContact CA-O 3.41Å; R72-L79 HydrophobicContact CB-CD1 4.19Å
73	D	95.8	Very high	97	Very high	39 Å²	39	45.8 Å²	45.8	21%	0.209	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	107.4	171.1	-176.5	-25	0	0	0	108	A75 K76 S77 T78 Y80	D73-A75 WeakPolarHBondContact OD1-CB 3.46Å; D73-A75 PolarHBondContact OD1-N 2.76Å; D73-K76 HydrophobicContact CB-CB 4.18Å; D73-K76 PolarHBondContact O-N 2.8Å; D73-K76 PolarHBondContact OD1-N 3.42Å; D73-K76 WeakPolarHBondContact OD2-CD 3.01Å; D73-K76 WeakPolarHBondContact OD2-CE 3.36Å; D73-K76 VanDerWaalsContact OD2-CG 3.31Å; D73-K76 WeakPolarHBondContact OD2-CG 3.47Å; D73-K76 IonicContact OD2-NZ 2.74Å; D73-K76 PolarHBondContact OD2-NZ 2.9Å; D73-S77 WeakPolarHBondContact O-CA 3.5Å; D73-S77 PolarHBondContact O-N 3.01Å; D73-T78 PolarHBondContact N-O 2.86Å; D73-T78 PolarHBondContact O-N 2.97Å; D73-Y80 HydrophobicContact CB-CE2 4Å
74	N	93.9	Very high	97.1	Very high	66 Å²	66	45.6 Å²	45.6	35%	0.353	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-31.9	-177.5	-72.4	-16.6	0	0	0	112.6	F29 R72 K76 S77	F29-N74 VanDerWaalsContact CD1-OD1 3.28Å; F29-N74 WeakPolarHBondContact CD1-OD1 3.47Å; F29-N74 WeakPolarHBondContact CE1-OD1 3.22Å; R72-N74 VanDerWaalsContact CZ-OD1 3.27Å; R72-N74 PolarHBondContact NE-OD1 2.92Å; R72-N74 PolarHBondContact NH2-OD1 2.98Å; N74-K76 VanDerWaalsContact C-N 3.29Å; N74-K76 PolarHBondContact O-N 3.23Å; N74-S77 PolarHBondContact O-N 3.3Å
75	A	93.8	Very high	97.1	Very high	99 Å²	99	47 Å²	47	82%	0.818	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-33.8	177.7	0	0	0	0	0	111.3	D73	D73-A75 WeakPolarHBondContact OD1-CB 3.46Å; D73-A75 PolarHBondContact OD1-N 2.76Å
76	K	96.1	Very high	97.2	Very high	132 Å²	132	40 Å²	40	57%	0.574	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-1	176.2	-60.1	-169.9	-168.9	105.6	0	114.2	D73 N74 T78	D73-K76 HydrophobicContact CB-CB 4.18Å; D73-K76 PolarHBondContact O-N 2.8Å; D73-K76 PolarHBondContact OD1-N 3.42Å; D73-K76 WeakPolarHBondContact OD2-CD 3.01Å; D73-K76 WeakPolarHBondContact OD2-CE 3.36Å; D73-K76 VanDerWaalsContact OD2-CG 3.31Å; D73-K76 WeakPolarHBondContact OD2-CG 3.47Å; D73-K76 IonicContact OD2-NZ 2.74Å; D73-K76 PolarHBondContact OD2-NZ 2.9Å; N74-K76 VanDerWaalsContact C-N 3.29Å; N74-K76 PolarHBondContact O-N 3.23Å; K76-T78 PolarHBondContact O-N 3.31Å; K76-T78 PolarHBondContact O-OG1 2.91Å
77	S	96.1	Very high	97.2	Very high	34 Å²	34	42 Å²	42	24%	0.238	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.7	45.8	-171.2	-59.5	0	0	0	0	112.5	A24 D73 N74	A24-S77 WeakPolarHBondContact CB-O 3.01Å; A24-S77 PolarHBondContact N-O 3.01Å; A24-S77 VanDerWaalsContact O-CB 3.3Å; A24-S77 WeakPolarHBondContact O-CB 3.36Å; D73-S77 WeakPolarHBondContact O-CA 3.5Å; D73-S77 PolarHBondContact O-N 3.01Å; N74-S77 PolarHBondContact O-N 3.3Å
78	T	97.8	Very high	97.1	Very high	16 Å²	16	45.6 Å²	45.6	10%	0.098	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.1	-173.3	-54.8	0	0	0	0	111.4	C22 R72 D73 K76 Y80	C22-T78 CarbonylContact O-C 3.58Å; C22-T78 WeakPolarHBondContact O-CA 3.49Å; R72-T78 CarbonylContact C-O 3.52Å; R72-T78 WeakPolarHBondContact CA-O 3.41Å; D73-T78 PolarHBondContact N-O 2.86Å; D73-T78 PolarHBondContact O-N 2.97Å; K76-T78 PolarHBondContact O-N 3.31Å; K76-T78 PolarHBondContact O-OG1 2.91Å; T78-Y80 HydrophobicContact CG2-CD1 4.23Å; T78-Y80 HydrophobicContact CG2-CE1 3.56Å; T78-Y80 HydrophobicContact CG2-CE2 3.9Å; T78-Y80 WeakPolarHBondContact CG2-OH 3.36Å
79	L	98.1	Very high	97	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	144.5	171.5	-173.5	70.7	0	0	0	110	S21 C22 F29 M34 W36 I51 I70 R72 C96	S21-L79 CarbonylContact C-O 3.57Å; S21-L79 WeakPolarHBondContact CA-O 3.47Å; C22-L79 HydrophobicContact CB-CB 4.22Å; C22-L79 PolarHBondContact N-O 3.08Å; C22-L79 PolarHBondContact O-N 3.49Å; F29-L79 HydrophobicContact CZ-CB 4.33Å; M34-L79 HydrophobicContact CB-CD1 3.64Å; M34-L79 HydrophobicContact CB-CD2 3.81Å; M34-L79 HydrophobicContact CB-CG 4.25Å; M34-L79 HydrophobicContact CE-CD2 4.44Å; M34-L79 HydrophobicContact CG-CD1 4.4Å; W36-L79 HydrophobicContact CD2-CD2 4.49Å; W36-L79 HydrophobicContact CG-CD2 4.44Å; W36-L79 HydrophobicContact CZ2-CD2 4.36Å; W36-L79 VanDerWaalsContact NE1-CD2 3.28Å; I51-L79 HydrophobicContact CG2-CD1 3.48Å; I51-L79 VanDerWaalsContact CG2-CD1 3.48Å; I70-L79 HydrophobicContact CD1-CD1 3.97Å; I70-L79 HydrophobicContact CG1-CD1 3.99Å; R72-L79 HydrophobicContact CB-CD1 4.19Å; L79-C96 HydrophobicContact CD2-CB 4.17Å
80	Y	98.5	Very high	96.9	Very high	38 Å²	38	46.6 Å²	46.6	15%	0.149	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	149.3	176.9	-57.1	-77.4	0	0	0	111.8	L20 I70 S71 D73 T78	L20-Y80 VanDerWaalsContact O-CA 3.3Å; L20-Y80 WeakPolarHBondContact O-CA 3.36Å; I70-Y80 WeakPolarHBondContact CA-O 3.31Å; I70-Y80 WeakPolarHBondContact CG1-O 3.21Å; S71-Y80 PolarHBondContact N-O 3.06Å; S71-Y80 PolarHBondContact O-N 3.08Å; D73-Y80 HydrophobicContact CB-CE2 4Å; T78-Y80 HydrophobicContact CG2-CD1 4.23Å; T78-Y80 HydrophobicContact CG2-CE1 3.56Å; T78-Y80 HydrophobicContact CG2-CE2 3.9Å; T78-Y80 WeakPolarHBondContact CG2-OH 3.36Å
81	L	98.7	Very high	96.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	106.7	166.9	-169.9	67.1	0	0	0	108.9	R19 L20 W36 V48 F68 I70 M83 Y94	R19-L81 WeakPolarHBondContact CA-O 3.41Å; L20-L81 HydrophobicContact CB-CB 4.24Å; L20-L81 HydrophobicContact CD1-CD2 4.39Å; L20-L81 PolarHBondContact N-O 3.02Å; L20-L81 PolarHBondContact O-N 3.09Å; W36-L81 HydrophobicContact CB-CD2 4.19Å; W36-L81 HydrophobicContact CD2-CB 4.2Å; W36-L81 HydrophobicContact CD2-CD2 4.2Å; W36-L81 HydrophobicContact CG-CB 4.2Å; W36-L81 HydrophobicContact CG-CD1 4.43Å; W36-L81 HydrophobicContact CG-CD2 3.93Å; W36-L81 HydrophobicContact CG-CG 4.43Å; W36-L81 HydrophobicContact CZ2-CB 4.36Å; V48-L81 HydrophobicContact CG1-CD2 4.15Å; F68-L81 HydrophobicContact CB-CD1 4.25Å; F68-L81 HydrophobicContact CD2-CD1 4.49Å; F68-L81 HydrophobicContact CD2-CD2 4.11Å; F68-L81 HydrophobicContact CD2-CG 4.44Å; I70-L81 HydrophobicContact CB-CD1 4.2Å; L81-M83 HydrophobicContact CD2-CG 3.93Å; L81-M83 HydrophobicContact CD2-SD 3.93Å; L81-M83 HydrophobicContact CG-CG 3.88Å; L81-M83 HydrophobicContact CG-SD 4.4Å; L81-Y94 HydrophobicContact CD2-CD1 4.17Å; L81-Y94 HydrophobicContact CD2-CE1 4.2Å
82	Q	98.6	Very high	96.9	Very high	65 Å²	65	45.8 Å²	45.8	30%	0.304	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	121.8	168.3	-176.7	60.7	48.1	0	0	108.2	L18 F68 T69	L18-Q82 PolarHBondContact O-NE2 3.34Å; F68-Q82 CarbonylContact C-O 3.56Å; F68-Q82 VanDerWaalsContact CA-O 3.24Å; F68-Q82 WeakPolarHBondContact CA-O 3.17Å; T69-Q82 PolarHBondContact N-O 2.96Å; T69-Q82 PolarHBondContact O-N 3.38Å
83	M	98.4	Very high	97	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.3	-179	-63.6	165.1	61	0	0	107.9	S17 L18 L20 F68 L81 L86 Y94 V114	S17-M83 CarbonylContact C-O 3.56Å; S17-M83 WeakPolarHBondContact CA-O 3.44Å; S17-M83 VanDerWaalsContact CB-O 3.31Å; S17-M83 WeakPolarHBondContact CB-O 3.44Å; L18-M83 PolarHBondContact N-O 3.04Å; L18-M83 PolarHBondContact O-N 2.83Å; L18-M83 VanDerWaalsContact O-O 3.14Å; L20-M83 HydrophobicContact CD1-SD 3.65Å; L20-M83 HydrophobicContact CD2-SD 4.37Å; L20-M83 HydrophobicContact CG-SD 3.67Å; F68-M83 HydrophobicContact CD1-CB 3.96Å; F68-M83 HydrophobicContact CD1-CG 4.07Å; F68-M83 HydrophobicContact CD2-CG 3.93Å; F68-M83 HydrophobicContact CE1-CB 3.83Å; F68-M83 HydrophobicContact CE1-CG 4.03Å; F68-M83 HydrophobicContact CE2-CE 3.97Å; F68-M83 HydrophobicContact CE2-CG 3.87Å; F68-M83 HydrophobicContact CE2-SD 4.41Å; F68-M83 HydrophobicContact CG-CB 4.43Å; F68-M83 HydrophobicContact CG-CG 4.05Å; F68-M83 HydrophobicContact CZ-CB 4.15Å; F68-M83 HydrophobicContact CZ-CE 3.77Å; F68-M83 HydrophobicContact CZ-CG 3.95Å; L81-M83 HydrophobicContact CD2-CG 3.93Å; L81-M83 HydrophobicContact CD2-SD 3.93Å; L81-M83 HydrophobicContact CG-CG 3.88Å; L81-M83 HydrophobicContact CG-SD 4.4Å; M83-L86 HydrophobicContact CB-CD1 4.14Å; M83-L86 HydrophobicContact CB-CD2 4.11Å; M83-L86 HydrophobicContact CB-CG 4.23Å; M83-L86 HydrophobicContact CE-CD1 4.24Å; M83-L86 HydrophobicContact CE-CD2 3.4Å; M83-L86 HydrophobicContact CE-CG 4.41Å; M83-Y94 HydrophobicContact CE-CE1 3.96Å; M83-Y94 HydrophobicContact CE-CE2 3.97Å; M83-Y94 WeakPolarHBondContact CE-OH 3.47Å; M83-Y94 HydrophobicContact SD-CE1 4.3Å; M83-V114 HydrophobicContact CE-CG1 4.05Å; M83-V114 HydrophobicContact CE-CG2 4.22Å
84	S	98	Very high	97.1	Very high	46 Å²	46	44.4 Å²	44.4	32%	0.322	24%	0.244	S	C	.	.			trans	-122	148.2	-179.9	-58	0	0	0	0	110.7	R67	R67-S84 WeakPolarHBondContact CB-O 3.3Å; R67-S84 WeakPolarHBondContact O-CB 3.33Å; R67-S84 PolarHBondContact O-N 2.93Å; R67-S84 VanDerWaalsContact O-N 3.08Å
85	G	97.3	Very high	97.3	Very high	30 Å²	30	43.1 Å²	43.1	31%	0.309	24%	0.235	S	C	.	.	S	Bend	trans	60	50.4	179.2	0	0	0	0	0	111.5	G16 R67	G16-G85 PolarHBondContact O-N 2.79Å; G16-G85 VanDerWaalsContact O-N 3.16Å; R67-G85 PolarHBondContact NH1-O 2.96Å
86	L	97.9	Very high	97.4	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.01	20%	0.196	C	C	.	.			trans	-63.6	142.3	-177.7	-81.8	164.6	0	0	0	111.9	V12 G15 G16 L18 F68 M83 D90 V116	V12-L86 HydrophobicContact CG1-CB 4.34Å; V12-L86 HydrophobicContact CG1-CD1 3.6Å; G15-L86 PolarHBondContact N-O 2.8Å; G16-L86 PolarHBondContact O-N 3.16Å; L18-L86 HydrophobicContact CB-CD1 4.05Å; L18-L86 HydrophobicContact CD1-CD1 4.04Å; L18-L86 HydrophobicContact CG-CD1 3.99Å; F68-L86 HydrophobicContact CE1-CD2 3.88Å; F68-L86 HydrophobicContact CZ-CD2 3.75Å; M83-L86 HydrophobicContact CB-CD1 4.14Å; M83-L86 HydrophobicContact CB-CD2 4.11Å; M83-L86 HydrophobicContact CB-CG 4.23Å; M83-L86 HydrophobicContact CE-CD1 4.24Å; M83-L86 HydrophobicContact CE-CD2 3.4Å; M83-L86 HydrophobicContact CE-CG 4.41Å; L86-D90 HydrophobicContact CD2-CB 3.57Å; L86-V116 HydrophobicContact CB-CG1 4.42Å; L86-V116 HydrophobicContact CB-CG2 3.95Å; L86-V116 HydrophobicContact CD2-CG2 4.35Å
87	R	96.8	Very high	97.4	Very high	124 Å²	124	32.1 Å²	32.1	47%	0.468	17%	0.169	S	C	.	.			trans	-120.6	160.9	-179.1	-59.9	171.9	-178.1	172.8	-2.3	109.5	E89 D90 V116	R87-E89 HydrophobicContact CB-CG 3.73Å; R87-E89 VanDerWaalsContact CD-OE1 3.24Å; R87-E89 WeakPolarHBondContact CD-OE1 3.45Å; R87-E89 IonicContact NH1-OE1 3.73Å; R87-E89 PolarHBondContact NH1-OE1 2.95Å; R87-E89 PolarHBondContact O-N 2.9Å; R87-E89 VanDerWaalsContact O-N 3.12Å; R87-D90 PolarHBondContact N-OD2 2.83Å; R87-D90 WeakPolarHBondContact O-CA 3.33Å; R87-D90 VanDerWaalsContact O-CB 3.28Å; R87-D90 WeakPolarHBondContact O-CB 3.33Å; R87-D90 PolarHBondContact O-N 2.96Å; R87-V116 WeakPolarHBondContact O-CG2 3.46Å
88	D	95.4	Very high	97.1	Very high	106 Å²	106	30.8 Å²	30.8	57%	0.567	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-54.3	-36.7	178.5	-58	-10.1	0	0	0	112.2	D90 T91	D88-D90 PolarHBondContact O-N 2.03Å; D88-T91 WeakPolarHBondContact O-CB 3.31Å; D88-T91 PolarHBondContact O-N 2.92Å; D88-T91 VanDerWaalsContact O-N 3.08Å; D88-T91 PolarHBondContact O-OG1 2.97Å
89	E	94.8	Very high	96.4	Very high	102 Å²	102	30.1 Å²	30.1	48%	0.477	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-64.8	-12.5	175.6	63.2	-177.2	-164.1	0	0	114.9	R87	R87-E89 HydrophobicContact CB-CG 3.73Å; R87-E89 VanDerWaalsContact CD-OE1 3.24Å; R87-E89 WeakPolarHBondContact CD-OE1 3.45Å; R87-E89 IonicContact NH1-OE1 3.73Å; R87-E89 PolarHBondContact NH1-OE1 2.95Å; R87-E89 PolarHBondContact O-N 2.9Å; R87-E89 VanDerWaalsContact O-N 3.12Å
90	D	97.1	Very high	95.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-88.2	-3.1	174.5	-59.1	-49.4	0	0	0	113	R38 R67 F68 L86 R87 D88 A92 Y94 V116	R38-D90 IonicContact CZ-OD1 3.82Å; R38-D90 IonicContact NH1-OD1 3.99Å; R38-D90 PolarHBondContact NH1-OD1 2.87Å; R38-D90 IonicContact NH2-OD1 2.74Å; R67-D90 IonicContact CZ-OD1 3.05Å; R67-D90 IonicContact CZ-OD2 3.11Å; R67-D90 IonicContact NH1-OD1 3.35Å; R67-D90 IonicContact NH1-OD2 2.83Å; R67-D90 PolarHBondContact NH1-OD2 3.31Å; R67-D90 IonicContact NH2-OD1 3.97Å; R67-D90 PolarHBondContact NH2-OD1 2.79Å; R67-D90 IonicContact NH2-OD2 2.69Å; R67-D90 PolarHBondContact NH2-OD2 2.97Å; R67-D90 VanDerWaalsContact NH2-OD2 3.11Å; F68-D90 HydrophobicContact CZ-CB 4.3Å; L86-D90 HydrophobicContact CD2-CB 3.57Å; R87-D90 PolarHBondContact N-OD2 2.83Å; R87-D90 WeakPolarHBondContact O-CA 3.33Å; R87-D90 VanDerWaalsContact O-CB 3.28Å; R87-D90 WeakPolarHBondContact O-CB 3.33Å; R87-D90 PolarHBondContact O-N 2.96Å; D88-D90 PolarHBondContact O-N 2.03Å; D90-A92 PolarHBondContact O-N 3.04Å; D90-A92 VanDerWaalsContact O-N 3.16Å; D90-Y94 WeakPolarHBondContact O-CE2 3.46Å; D90-Y94 PolarHBondContact O-OH 3.43Å; D90-Y94 VanDerWaalsContact O-OH 3.07Å; D90-V116 HydrophobicContact CB-CG2 4.47Å
91	T	97.9	Very high	93.4	Very high	33 Å²	33	33.6 Å²	33.6	20%	0.202	19%	0.19	C	C	.	.			trans	-63.8	113.3	171.5	-64.9	0	0	0	0	110.4	D88 V114 V116	D88-T91 WeakPolarHBondContact O-CB 3.31Å; D88-T91 PolarHBondContact O-N 2.92Å; D88-T91 VanDerWaalsContact O-N 3.08Å; D88-T91 PolarHBondContact O-OG1 2.97Å; T91-V114 WeakPolarHBondContact CA-O 3.28Å; T91-V116 PolarHBondContact OG1-N 3.02Å; T91-V116 PolarHBondContact OG1-O 3.46Å
92	A	98.1	Very high	91.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	166	-176.2	0	0	0	0	0	111.6	R38 Q39 V40 D90 Y94 V114	R38-A92 HydrophobicContact CB-CB 3.81Å; R38-A92 HydrophobicContact CG-CB 4.18Å; Q39-A92 WeakPolarHBondContact O-CA 3.38Å; Q39-A92 VanDerWaalsContact O-CB 3.31Å; Q39-A92 WeakPolarHBondContact O-CB 3.3Å; V40-A92 HydrophobicContact CG2-CB 4.08Å; D90-A92 PolarHBondContact O-N 3.04Å; D90-A92 VanDerWaalsContact O-N 3.16Å; A92-Y94 HydrophobicContact CB-CD2 4.17Å; A92-Y94 HydrophobicContact CB-CE2 3.78Å; A92-Y94 WeakPolarHBondContact O-CD2 3.36Å; A92-V114 PolarHBondContact N-O 3.3Å; A92-V114 VanDerWaalsContact N-O 3.12Å; A92-V114 PolarHBondContact O-N 3.2Å
93	V	98.4	Very high	89.4	Confident	40 Å²	40	39.2 Å²	39.2	24%	0.242	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	125.4	160.2	-174.4	0	0	0	0	108.1	R38 Q39 Y95 L113	R38-V93 CarbonylContact C-O 3.35Å; R38-V93 WeakPolarHBondContact CA-O 3.28Å; Q39-V93 PolarHBondContact N-O 2.82Å; Q39-V93 PolarHBondContact O-N 2.82Å; V93-Y95 HydrophobicContact CB-CE2 3.92Å; V93-Y95 HydrophobicContact CG1-CD1 4.47Å; V93-Y95 HydrophobicContact CG1-CD2 4.44Å; V93-Y95 HydrophobicContact CG1-CE1 3.78Å; V93-Y95 HydrophobicContact CG1-CE2 3.74Å; V93-Y95 WeakPolarHBondContact CG1-OH 3.43Å; V93-L113 HydrophobicContact CG2-CD1 4.02Å
94	Y	98.4	Very high	87.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.1	-179.7	-77.4	-104.2	0	0	0	110.2	L20 V37 R38 V48 F68 L81 M83 D90 A92 G111 T112 V114	L20-Y94 HydrophobicContact CD1-CD1 3.86Å; L20-Y94 HydrophobicContact CD1-CD2 4.31Å; L20-Y94 HydrophobicContact CD1-CG 3.65Å; V37-Y94 CarbonylContact O-C 3.59Å; V37-Y94 WeakPolarHBondContact O-CA 3.2Å; R38-Y94 HydrophobicContact CB-CD1 3.96Å; R38-Y94 HydrophobicContact CB-CD2 4.34Å; R38-Y94 HydrophobicContact CB-CE1 3.93Å; R38-Y94 HydrophobicContact CB-CE2 4.29Å; R38-Y94 HydrophobicContact CB-CG 4.17Å; R38-Y94 PolarHBondContact NH1-OH 3.23Å; R38-Y94 VanDerWaalsContact NH1-OH 3.11Å; V48-Y94 HydrophobicContact CG2-CE1 4.18Å; F68-Y94 HydrophobicContact CE2-CE1 4.22Å; L81-Y94 HydrophobicContact CD2-CD1 4.17Å; L81-Y94 HydrophobicContact CD2-CE1 4.2Å; M83-Y94 HydrophobicContact CE-CE1 3.96Å; M83-Y94 HydrophobicContact CE-CE2 3.97Å; M83-Y94 WeakPolarHBondContact CE-OH 3.47Å; M83-Y94 HydrophobicContact SD-CE1 4.3Å; D90-Y94 WeakPolarHBondContact O-CE2 3.46Å; D90-Y94 PolarHBondContact O-OH 3.43Å; D90-Y94 VanDerWaalsContact O-OH 3.07Å; A92-Y94 HydrophobicContact CB-CD2 4.17Å; A92-Y94 HydrophobicContact CB-CE2 3.78Å; A92-Y94 WeakPolarHBondContact O-CD2 3.36Å; Y94-G111 CarbonylContact O-C 3.56Å; Y94-G111 WeakPolarHBondContact O-CA 3.31Å; Y94-T112 PolarHBondContact N-O 2.95Å; Y94-T112 PolarHBondContact O-N 3.13Å; Y94-V114 HydrophobicContact CD2-CB 3.93Å; Y94-V114 HydrophobicContact CD2-CG2 3.73Å; Y94-V114 HydrophobicContact CE2-CB 3.83Å; Y94-V114 HydrophobicContact CE2-CG1 4.45Å; Y94-V114 HydrophobicContact CE2-CG2 3.99Å
95	Y	97.9	Very high	86.2	Confident	39 Å²	39	40.8 Å²	40.8	15%	0.153	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.1	-179.6	-53.9	-87.4	0	0	0	110	E6 W36 V37 Q39 L45 V93 W108 Q110 G111	E6-Y95 VanDerWaalsContact OE1-CA 3.3Å; E6-Y95 WeakPolarHBondContact OE1-CA 3.41Å; W36-Y95 WeakPolarHBondContact CA-O 3.3Å; V37-Y95 PolarHBondContact N-O 2.93Å; V37-Y95 PolarHBondContact O-N 3.39Å; Q39-Y95 HydrophobicContact CB-CE2 3.71Å; Q39-Y95 PolarHBondContact OE1-OH 3.01Å; L45-Y95 HydrophobicContact CD2-CD2 4.37Å; L45-Y95 HydrophobicContact CD2-CE2 4.26Å; V93-Y95 HydrophobicContact CB-CE2 3.92Å; V93-Y95 HydrophobicContact CG1-CD1 4.47Å; V93-Y95 HydrophobicContact CG1-CD2 4.44Å; V93-Y95 HydrophobicContact CG1-CE1 3.78Å; V93-Y95 HydrophobicContact CG1-CE2 3.74Å; V93-Y95 WeakPolarHBondContact CG1-OH 3.43Å; Y95-W108 HydrophobicContact CD2-CZ3 4.33Å; Y95-W108 HydrophobicContact CG-CE3 4.05Å; Y95-W108 HydrophobicContact CG-CZ3 4.22Å; Y95-Q110 WeakPolarHBondContact CE1-O 3.33Å; Y95-G111 VanDerWaalsContact CD1-CA 3.44Å
96	C	96.1	Very high	85	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	142.2	161.5	63.9	0	0	0	0	109.8	E6 C22 H35 W36 L79 G109	E6-C96 VanDerWaalsContact CD-SG 3.5Å; E6-C96 HydrophobicContact CG-CB 4.23Å; E6-C96 VanDerWaalsContact CG-SG 3.6Å; E6-C96 PolarHBondContact OE1-N 3.32Å; E6-C96 PolarHBondContact OE1-SG 2.88Å; E6-C96 VanDerWaalsContact OE1-SG 3.34Å; C22-C96 HydrophobicContact CB-CB 3.37Å; C22-C96 WeakPolarHBondContact CB-SG 3.38Å; C22-C96 WeakPolarHBondContact SG-CB 3.16Å; C22-C96 CovalentContact SG-SG 2.03Å; C22-C96 PolarHBondContact SG-SG 2.93Å; H35-C96 WeakPolarHBondContact O-CA 3.42Å; W36-C96 HydrophobicContact CE3-CB 4.35Å; W36-C96 HydrophobicContact CH2-CB 4.16Å; W36-C96 HydrophobicContact CZ2-CB 4.35Å; W36-C96 HydrophobicContact CZ3-CB 4.16Å; L79-C96 HydrophobicContact CD2-CB 4.17Å; C96-G109 PolarHBondContact O-N 2.77Å
97	V	94.7	Very high	84.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	135.1	-172.3	-167.7	0	0	0	0	109.8	H35 V37 C105 D107 W108	H35-V97 HydrophobicContact CB-CB 4.3Å; H35-V97 PolarHBondContact N-O 3.08Å; H35-V97 PolarHBondContact O-N 2.92Å; V37-V97 HydrophobicContact CB-CG2 4.23Å; V37-V97 HydrophobicContact CG2-CG2 3.76Å; V97-C105 HydrophobicContact CG1-CB 3.45Å; V97-C105 VanDerWaalsContact CG1-CB 3.45Å; V97-C105 VanDerWaalsContact CG1-SG 3.54Å; V97-D107 WeakPolarHBondContact CG1-O 3.22Å; V97-W108 HydrophobicContact CB-CD2 4.4Å; V97-W108 HydrophobicContact CG1-CD2 3.92Å; V97-W108 HydrophobicContact CG1-CG 4.12Å; V97-W108 HydrophobicContact CG1-CZ2 4.09Å; V97-W108 HydrophobicContact CG2-CD2 3.6Å; V97-W108 HydrophobicContact CG2-CE3 3.41Å; V97-W108 VanDerWaalsContact CG2-CE3 3.41Å; V97-W108 HydrophobicContact CG2-CG 4.3Å; V97-W108 HydrophobicContact CG2-CH2 3.91Å; V97-W108 HydrophobicContact CG2-CZ2 4.08Å; V97-W108 HydrophobicContact CG2-CZ3 3.58Å
98	L	91.4	Very high	84.5	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.026	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	130.9	171.9	176.4	140.4	0	0	0	110.2	V2 L4 F27 Y32 M34 C105 K106 D107	V2-L98 HydrophobicContact CG1-CD1 4.49Å; L4-L98 HydrophobicContact CD1-CB 4.12Å; F27-L98 HydrophobicContact CD1-CD1 3.75Å; F27-L98 HydrophobicContact CD2-CD1 3.45Å; F27-L98 VanDerWaalsContact CD2-CD1 3.45Å; F27-L98 HydrophobicContact CE1-CD1 3.49Å; F27-L98 VanDerWaalsContact CE1-CD1 3.49Å; F27-L98 HydrophobicContact CE2-CD1 3.15Å; F27-L98 HydrophobicContact CE2-CG 4.5Å; F27-L98 HydrophobicContact CG-CD1 3.73Å; F27-L98 HydrophobicContact CZ-CD1 3.19Å; Y32-L98 HydrophobicContact CD1-CD1 4.35Å; Y32-L98 HydrophobicContact CD1-CD2 4.08Å; Y32-L98 HydrophobicContact CD1-CG 4.23Å; Y32-L98 HydrophobicContact CE1-CD2 4.43Å; Y32-L98 HydrophobicContact CG-CD1 4.12Å; Y32-L98 HydrophobicContact CG-CG 4.37Å; M34-L98 HydrophobicContact SD-CB 4.43Å; L98-C105 WeakPolarHBondContact O-CA 3.47Å; L98-K106 HydrophobicContact CD2-CB 4.32Å; L98-K106 PolarHBondContact O-N 3.23Å; L98-D107 HydrophobicContact CB-CB 4.31Å; L98-D107 PolarHBondContact N-O 2.99Å
99	G	82.4	Confident	84.5	Confident	2 Å²	2	43.4 Å²	43.4	2%	0.021	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.5	171.4	175.5	0	0	0	0	0	113.9	W33	W33-G99 CarbonylContact C-O 3.48Å; W33-G99 WeakPolarHBondContact CB-O 3.28Å; W33-G99 PolarHBondContact N-O 2.96Å; W33-G99 PolarHBondContact O-N 2.84Å
100	G	70.6	Confident	84.5	Confident	32 Å²	32	46.8 Å²	46.8	33%	0.33	27%	0.266	S	S	.	.	S	Bend	trans	-84.6	-92.6	165.3	0	0	0	0	0	109.6	W33 H35 S104	W33-G100 WeakPolarHBondContact CZ3-O 3.38Å; H35-G100 PolarHBondContact NE2-O 3.14Å; G100-S104 PolarHBondContact N-OG 3.18Å
101	S	62.1	Low	84.5	Confident	80 Å²	80	47.9 Å²	47.9	56%	0.559	28%	0.276	S	S	*	.	S	Bend	trans	-80.1	159.2	167.3	175.8	0	0	0	0	111.8	G103 S104	S101-G103 PolarHBondContact O-N 2.88Å; S101-S104 PolarHBondContact N-OG 2.98Å; S101-S104 WeakPolarHBondContact O-CA 3.37Å; S101-S104 PolarHBondContact O-N 2.89Å; S101-S104 PolarHBondContact O-OG 3.43Å
102	F	56.4	Low	84.5	Confident	102 Å²	102	47.3 Å²	47.3	45%	0.447	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-54.7	-22.6	176.9	-173.2	-109.6	0	0	0	113.2	V37 W47 C105	V37-F102 HydrophobicContact CG2-CE2 3.83Å; W47-F102 HydrophobicContact CB-CD2 4.16Å; W47-F102 HydrophobicContact CB-CE2 3.64Å; W47-F102 HydrophobicContact CB-CZ 3.87Å; W47-F102 AromaticContact CD1-CD2 3.53Å; W47-F102 AromaticContact CD1-CE2 3.65Å; W47-F102 HydrophobicContact CG-CD2 4.03Å; W47-F102 AromaticContact CG-CE2 3.95Å; W47-F102 HydrophobicContact CG-CE2 3.95Å; F102-C105 PolarHBondContact O-SG 3.33Å; F102-C105 VanDerWaalsContact O-SG 3.42Å
103	G	56.8	Low	84.5	Confident	80 Å²	80	51.5 Å²	51.5	83%	0.825	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-84.8	0.5	173	0	0	0	0	0	115.7	S101	S101-G103 PolarHBondContact O-N 2.88Å
104	S	63.9	Low	84.5	Confident	50 Å²	50	49.6 Å²	49.6	35%	0.35	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-124.9	22	-177.6	65.2	0	0	0	0	112.7	G100 S101 K106	G100-S104 PolarHBondContact N-OG 3.18Å; S101-S104 PolarHBondContact N-OG 2.98Å; S101-S104 WeakPolarHBondContact O-CA 3.37Å; S101-S104 PolarHBondContact O-N 2.89Å; S101-S104 PolarHBondContact O-OG 3.43Å; S104-K106 PolarHBondContact O-N 2.67Å
105	C	66.1	Low	84.5	Confident	29 Å²	29	52.7 Å²	52.7	20%	0.196	30%	0.299	C	S	.	.			trans	-61.8	113.3	174.9	-69.9	0	0	0	0	109.8	V97 L98 F102 W108	V97-C105 HydrophobicContact CG1-CB 3.45Å; V97-C105 VanDerWaalsContact CG1-CB 3.45Å; V97-C105 VanDerWaalsContact CG1-SG 3.54Å; L98-C105 WeakPolarHBondContact O-CA 3.47Å; F102-C105 PolarHBondContact O-SG 3.33Å; F102-C105 VanDerWaalsContact O-SG 3.42Å; C105-W108 HydrophobicContact CB-CZ2 4.44Å
106	K	72.8	Confident	84.5	Confident	162 Å²	162	51.2 Å²	51.2	70%	0.704	29%	0.294	S	S	*	.			trans	-95.7	-40.6	-174.1	-69.5	-171.5	178.9	179.1	0	112.3	L98 S104	L98-K106 HydrophobicContact CD2-CB 4.32Å; L98-K106 PolarHBondContact O-N 3.23Å; S104-K106 PolarHBondContact O-N 2.67Å
107	D	89.1	Confident	84.4	Confident	54 Å²	54	53.5 Å²	53.5	29%	0.289	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.1	-171.5	-55.6	-75.5	0	0	0	110.1	V2 L4 V97 L98	V2-D107 HydrophobicContact CB-CB 4.22Å; V2-D107 HydrophobicContact CG1-CB 3.61Å; L4-D107 HydrophobicContact CD1-CB 4.46Å; L4-D107 WeakPolarHBondContact CD1-O 3.48Å; V97-D107 WeakPolarHBondContact CG1-O 3.22Å; L98-D107 HydrophobicContact CB-CB 4.31Å; L98-D107 PolarHBondContact N-O 2.99Å
108	W	93.7	Very high	84	Confident	96 Å²	96	60.2 Å²	60.2	36%	0.364	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	143.8	-177.5	-70.2	68	0	0	0	109.4	V37 L45 Y95 V97 C105	V37-W108 HydrophobicContact CB-CH2 4.04Å; V37-W108 HydrophobicContact CB-CZ3 3.89Å; V37-W108 HydrophobicContact CG1-CH2 3.85Å; V37-W108 HydrophobicContact CG1-CZ3 3.94Å; V37-W108 HydrophobicContact CG2-CH2 4.02Å; V37-W108 HydrophobicContact CG2-CZ3 4.25Å; L45-W108 HydrophobicContact CD1-CH2 3.94Å; L45-W108 HydrophobicContact CD1-CZ3 4.4Å; L45-W108 HydrophobicContact CD2-CH2 4.25Å; L45-W108 HydrophobicContact CD2-CZ3 4.03Å; Y95-W108 HydrophobicContact CD2-CZ3 4.33Å; Y95-W108 HydrophobicContact CG-CE3 4.05Å; Y95-W108 HydrophobicContact CG-CZ3 4.22Å; V97-W108 HydrophobicContact CB-CD2 4.4Å; V97-W108 HydrophobicContact CG1-CD2 3.92Å; V97-W108 HydrophobicContact CG1-CG 4.12Å; V97-W108 HydrophobicContact CG1-CZ2 4.09Å; V97-W108 HydrophobicContact CG2-CD2 3.6Å; V97-W108 HydrophobicContact CG2-CE3 3.41Å; V97-W108 VanDerWaalsContact CG2-CE3 3.41Å; V97-W108 HydrophobicContact CG2-CG 4.3Å; V97-W108 HydrophobicContact CG2-CH2 3.91Å; V97-W108 HydrophobicContact CG2-CZ2 4.08Å; V97-W108 HydrophobicContact CG2-CZ3 3.58Å; C105-W108 HydrophobicContact CB-CZ2 4.44Å
109	G	95.3	Very high	83.6	Confident	6 Å²	6	63 Å²	63	6%	0.062	37%	0.374	C	S	.	.			trans	-75	173.4	164.7	0	0	0	0	0	112	L4 E6 C96 G111	L4-G109 VanDerWaalsContact O-CA 3.29Å; L4-G109 WeakPolarHBondContact O-CA 3.4Å; E6-G109 WeakPolarHBondContact OE1-CA 3.5Å; E6-G109 WeakPolarHBondContact OE2-CA 3.45Å; C96-G109 PolarHBondContact O-N 2.77Å; G109-G111 PolarHBondContact O-N 2.76Å
110	Q	94.9	Very high	83.7	Confident	173 Å²	173	66.2 Å²	66.2	81%	0.808	39%	0.392	S	S	*	.			trans	-76.2	-16.8	-179	-63.7	-61.4	-56.7	0	0	112.3	E6 Y95	E6-Q110 PolarHBondContact OE2-N 2.83Å; Y95-Q110 WeakPolarHBondContact CE1-O 3.33Å
111	G	97.3	Very high	84.4	Confident	22 Å²	22	68.1 Å²	68.1	23%	0.227	40%	0.396	C	S	.	.			trans	88.4	157.5	178.6	0	0	0	0	0	113.6	E6 Y94 Y95 G109	E6-G111 VanDerWaalsContact CD-N 3.28Å; E6-G111 PolarHBondContact OE1-N 2.96Å; E6-G111 PolarHBondContact OE2-N 2.98Å; Y94-G111 CarbonylContact O-C 3.56Å; Y94-G111 WeakPolarHBondContact O-CA 3.31Å; Y95-G111 VanDerWaalsContact CD1-CA 3.44Å; G109-G111 PolarHBondContact O-N 2.76Å
112	T	98.3	Very high	85.8	Confident	21 Å²	21	67.4 Å²	67.4	13%	0.129	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	137.4	175.2	-165.5	0	0	0	0	110.6	E6 G9 L20 Y94	E6-T112 HydrophobicContact CB-CG2 4Å; G9-T112 WeakPolarHBondContact CA-OG1 3.45Å; G9-T112 PolarHBondContact N-OG1 3.04Å; L20-T112 HydrophobicContact CD1-CG2 4.07Å; L20-T112 HydrophobicContact CD2-CG2 3.93Å; L20-T112 HydrophobicContact CG-CG2 4.48Å; Y94-T112 PolarHBondContact N-O 2.95Å; Y94-T112 PolarHBondContact O-N 3.13Å
113	L	98.3	Very high	87.6	Confident	88 Å²	88	65.2 Å²	65.2	46%	0.461	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	128.2	-176.7	-178.9	62.6	0	0	0	110.6	G9 G10 V93 I115	G9-L113 CarbonylContact C-O 3.54Å; G9-L113 VanDerWaalsContact CA-O 3.27Å; G9-L113 WeakPolarHBondContact CA-O 3.49Å; G10-L113 PolarHBondContact N-O 3.41Å; V93-L113 HydrophobicContact CG2-CD1 4.02Å; L113-I115 HydrophobicContact CD1-CG1 4.29Å; L113-I115 HydrophobicContact CD2-CD1 3.81Å; L113-I115 HydrophobicContact CD2-CG1 3.96Å; L113-I115 HydrophobicContact CG-CD1 4.25Å; L113-I115 HydrophobicContact CG-CG1 3.83Å
114	V	98.4	Very high	89.6	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	126.7	168.1	174.2	0	0	0	0	108.3	L18 L20 M83 T91 A92 Y94 V116	L18-V114 HydrophobicContact CD1-CG1 3.78Å; L18-V114 HydrophobicContact CD1-CG2 4.26Å; L20-V114 HydrophobicContact CD1-CG2 4.25Å; L20-V114 HydrophobicContact CD2-CG2 3.89Å; M83-V114 HydrophobicContact CE-CG1 4.05Å; M83-V114 HydrophobicContact CE-CG2 4.22Å; T91-V114 WeakPolarHBondContact CA-O 3.28Å; A92-V114 PolarHBondContact N-O 3.3Å; A92-V114 VanDerWaalsContact N-O 3.12Å; A92-V114 PolarHBondContact O-N 3.2Å; Y94-V114 HydrophobicContact CD2-CB 3.93Å; Y94-V114 HydrophobicContact CD2-CG2 3.73Å; Y94-V114 HydrophobicContact CE2-CB 3.83Å; Y94-V114 HydrophobicContact CE2-CG1 4.45Å; Y94-V114 HydrophobicContact CE2-CG2 3.99Å; V114-V116 HydrophobicContact CG1-CG2 4.34Å
115	I	97.9	Very high	91.5	Very high	65 Å²	65	65.2 Å²	65.2	33%	0.333	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.3	176.5	-52.1	178.8	0	0	0	108	G10 L11 V12 L113	G10-I115 PolarHBondContact O-N 2.98Å; L11-I115 CarbonylContact C-O 3.49Å; L11-I115 WeakPolarHBondContact CA-O 3.24Å; L11-I115 HydrophobicContact CD1-CB 3.9Å; L11-I115 HydrophobicContact CD1-CG2 3.66Å; V12-I115 PolarHBondContact N-O 3.46Å; L113-I115 HydrophobicContact CD1-CG1 4.29Å; L113-I115 HydrophobicContact CD2-CD1 3.81Å; L113-I115 HydrophobicContact CD2-CG1 3.96Å; L113-I115 HydrophobicContact CG-CD1 4.25Å; L113-I115 HydrophobicContact CG-CG1 3.83Å
116	V	97.2	Very high	93.4	Very high	8 Å²	8	68 Å²	68	5%	0.048	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	108.5	171.6	-171.5	0	0	0	0	107.6	V12 P14 L86 R87 D90 T91 V114	V12-V116 HydrophobicContact CG1-CG2 3.99Å; V12-V116 VanDerWaalsContact O-CA 3.27Å; V12-V116 WeakPolarHBondContact O-CA 3.35Å; P14-V116 HydrophobicContact CB-CG1 4.33Å; P14-V116 HydrophobicContact CG-CG1 4.09Å; L86-V116 HydrophobicContact CB-CG1 4.42Å; L86-V116 HydrophobicContact CB-CG2 3.95Å; L86-V116 HydrophobicContact CD2-CG2 4.35Å; R87-V116 WeakPolarHBondContact O-CG2 3.46Å; D90-V116 HydrophobicContact CB-CG2 4.47Å; T91-V116 PolarHBondContact OG1-N 3.02Å; T91-V116 PolarHBondContact OG1-O 3.46Å; V114-V116 HydrophobicContact CG1-CG2 4.34Å
117	S	94.6	Very high	95.1	Very high	48 Å²	48	60.2 Å²	60.2	34%	0.336	34%	0.337	S	S	.	.			trans	-149	153.7	176.9	93.2	0	0	0	0	111.8	L11 V12 Q13	L11-S117 WeakPolarHBondContact CD1-OG 2.94Å; V12-S117 PolarHBondContact O-N 3.02Å; Q13-S117 PolarHBondContact NE2-O 2.74Å
118	S	86.7	Confident	95.7	Very high	141 Å²	141	60.7 Å²	60.7	99%	0.986	34%	0.341	S	S	*	.			trans	-75.2	0	169.2	62.2	0	0	0	0	112.9	Q13	Q13-S118 PolarHBondContact NE2-OXT 3.1Å; Q13-S118 VanDerWaalsContact OE1-CA 3.27Å; Q13-S118 PolarHBondContact OE1-OXT 3.21Å

Retrieved 118 of 118 residues in 130 ms (Link to these results)

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