X5J597_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J597, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 106 aa.

						>X5J597_MOUSE|X5J597
AELVKPGASVKMSCKASGYTFTTYPIEWMKQNHGKSLEWIGNFHPYNDDTKYNEKFKGKATLTVEKSSSTVYLELSRLTSDDSAVYYCASSWFAYWGQGTLVTVSA
					

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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	A	84.3	Confident	95.1	Very high	102 Å²	102	77 Å²	77	84%	0.843	46%	0.462	S	S	*	.				0	135	0	0	0	0	0	0	106.7	L101	A1-L101 CarbonylContact C-O 3.48Å; A1-L101 WeakPolarHBondContact CA-O 3.38Å; A1-L101 HydrophobicContact CB-CB 4.02Å
2	E	91.8	Very high	95.2	Very high	91 Å²	91	71.3 Å²	71.3	43%	0.425	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123.6	-171.6	-61.6	-60.7	142.7	0	0	109.3	V4 V10 T100 L101 V102 T103	E2-V4 HydrophobicContact CB-CG1 4.47Å; E2-V10 HydrophobicContact CB-CG2 3.97Å; E2-V10 HydrophobicContact CG-CG2 3.8Å; E2-T100 HydrophobicContact CG-CG2 4.16Å; E2-L101 PolarHBondContact N-O 3.13Å; E2-V102 HydrophobicContact CB-CG2 4.34Å; E2-V102 CarbonylContact O-C 3.57Å; E2-V102 WeakPolarHBondContact O-CA 3.42Å; E2-T103 PolarHBondContact O-N 3.05Å
3	L	95.3	Very high	95.2	Very high	127 Å²	127	71.5 Å²	71.5	67%	0.665	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	118.7	172.3	-177.5	66.2	0	0	0	108.3	T103 S105	L3-T103 HydrophobicContact CD1-CG2 3.82Å; L3-S105 WeakPolarHBondContact CD1-OG 3.28Å
4	V	96.2	Very high	94.9	Very high	21 Å²	21	67.4 Å²	67.4	13%	0.127	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	153.5	-171.9	-61.3	0	0	0	0	111.4	E2 A8 L78 V102 T103 V104 S105	E2-V4 HydrophobicContact CB-CG1 4.47Å; V4-A8 HydrophobicContact CB-CB 4.41Å; V4-L78 HydrophobicContact CB-CD1 4.5Å; V4-L78 HydrophobicContact CG2-CD1 3.55Å; V4-V102 HydrophobicContact CG2-CG1 4.21Å; V4-T103 PolarHBondContact N-O 3.28Å; V4-V104 HydrophobicContact CG2-CB 4.45Å; V4-V104 HydrophobicContact CG2-CG2 3.87Å; V4-V104 WeakPolarHBondContact O-CA 2.84Å; V4-S105 PolarHBondContact O-N 2.64Å
5	K	96.4	Very high	94.6	Very high	146 Å²	146	72.8 Å²	72.8	64%	0.635	43%	0.425	S	S	*	.			trans	-81.6	152.1	176.7	-67.1	-176.5	177.7	-177	0	111.1	G7 A8	K5-G7 PolarHBondContact O-N 2.96Å; K5-A8 WeakPolarHBondContact O-CB 3.44Å; K5-A8 PolarHBondContact O-N 3.06Å; K5-A8 VanDerWaalsContact O-N 3.14Å
6	P	97.3	Very high	93.9	Very high	78 Å²	78	68.9 Å²	68.9	51%	0.506	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	139.5	169.6	-25.3	33.7	0	0	0	112	A8 L78 V104 S105	P6-A8 VanDerWaalsContact C-N 3.26Å; P6-A8 PolarHBondContact O-N 2.89Å; P6-L78 CarbonylContact C-O 3.39Å; P6-L78 WeakPolarHBondContact CA-O 3.48Å; P6-V104 HydrophobicContact CB-CG1 4.42Å; P6-V104 HydrophobicContact CG-CG1 4.14Å; P6-S105 WeakPolarHBondContact CD-O 3.3Å
7	G	96.2	Very high	93	Very high	54 Å²	54	70.7 Å²	70.7	56%	0.557	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	-14.6	-177.2	0	0	0	0	0	115	K5 L78	K5-G7 PolarHBondContact O-N 2.96Å; G7-L78 PolarHBondContact N-O 2.93Å
8	A	96.9	Very high	91.7	Very high	37 Å²	37	71.9 Å²	71.9	31%	0.306	45%	0.451	S	S	.	.			trans	-69.7	168.6	176	0	0	0	0	0	112.3	V4 K5 P6 R77 L78	V4-A8 HydrophobicContact CB-CB 4.41Å; K5-A8 WeakPolarHBondContact O-CB 3.44Å; K5-A8 PolarHBondContact O-N 3.06Å; K5-A8 VanDerWaalsContact O-N 3.14Å; P6-A8 VanDerWaalsContact C-N 3.26Å; P6-A8 PolarHBondContact O-N 2.89Å; A8-R77 PolarHBondContact O-N 2.81Å; A8-L78 WeakPolarHBondContact O-CB 3.03Å; A8-L78 WeakPolarHBondContact O-CG 3.5Å; A8-L78 PolarHBondContact O-N 3.05Å
9	S	97.4	Very high	90.5	Very high	64 Å²	64	71.3 Å²	71.3	45%	0.448	44%	0.44	S	S	.	.			trans	-111.4	151.4	169.3	-58.8	0	0	0	0	110.2	L75 S76	S9-L75 CarbonylContact C-O 3.52Å; S9-L75 WeakPolarHBondContact CA-O 3.32Å; S9-L75 WeakPolarHBondContact CB-O 3.2Å; S9-S76 WeakPolarHBondContact OG-CA 3.49Å
10	V	97.1	Very high	89.5	Confident	10 Å²	10	72.3 Å²	72.3	6%	0.061	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	141.2	171.6	72.9	0	0	0	0	109.5	E2 M12 E74 L75 L78 V102	E2-V10 HydrophobicContact CB-CG2 3.97Å; E2-V10 HydrophobicContact CG-CG2 3.8Å; V10-M12 HydrophobicContact CG1-CE 4.23Å; V10-E74 CarbonylContact O-C 3.49Å; V10-E74 WeakPolarHBondContact O-CA 3.27Å; V10-L75 HydrophobicContact CG1-CB 4.15Å; V10-L75 HydrophobicContact CG1-CD1 4.28Å; V10-L75 PolarHBondContact N-O 2.95Å; V10-L75 PolarHBondContact O-N 3.06Å; V10-L78 HydrophobicContact CB-CD1 4.02Å; V10-L78 HydrophobicContact CG1-CD1 3.8Å; V10-V102 HydrophobicContact CG1-CG1 4.35Å; V10-V102 HydrophobicContact CG1-CG2 4.34Å
11	K	97.2	Very high	88.7	Confident	117 Å²	117	69.2 Å²	69.2	51%	0.509	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	119.9	174.5	-174	174.7	-177.9	173.8	0	109.4	Y72 L73 E74	K11-Y72 VanDerWaalsContact CE-CB 3.48Å; K11-Y72 HydrophobicContact CG-CD1 4.41Å; K11-L73 WeakPolarHBondContact CA-O 3.44Å; K11-E74 HydrophobicContact CB-CB 4.44Å; K11-E74 HydrophobicContact CB-CG 4.44Å; K11-E74 HydrophobicContact CG-CB 4.35Å
12	M	96.3	Very high	88.1	Confident	8 Å²	8	68 Å²	68	4%	0.039	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	149.1	178	55.3	-175.5	70.8	0	0	110.3	V10 W28 Y72 L73 L75 Y86 V102	V10-M12 HydrophobicContact CG1-CE 4.23Å; M12-W28 HydrophobicContact CB-CH2 4.15Å; M12-W28 HydrophobicContact CG-CH2 3.55Å; M12-W28 HydrophobicContact CG-CZ2 4.2Å; M12-W28 HydrophobicContact CG-CZ3 3.77Å; M12-W28 HydrophobicContact SD-CE3 3.97Å; M12-W28 HydrophobicContact SD-CH2 3.78Å; M12-W28 HydrophobicContact SD-CZ3 3.32Å; M12-W28 WeakPolarHBondContact SD-CZ3 3.37Å; M12-Y72 CarbonylContact O-C 3.56Å; M12-Y72 WeakPolarHBondContact O-CA 3.09Å; M12-L73 HydrophobicContact CG-CB 3.76Å; M12-L73 HydrophobicContact CG-CD2 4.33Å; M12-L73 HydrophobicContact CG-CG 4.2Å; M12-L73 VanDerWaalsContact CG-O 3.3Å; M12-L73 WeakPolarHBondContact CG-O 3.29Å; M12-L73 PolarHBondContact N-O 2.98Å; M12-L73 PolarHBondContact O-N 2.8Å; M12-L73 HydrophobicContact SD-CB 4.31Å; M12-L73 HydrophobicContact SD-CD2 3.78Å; M12-L73 HydrophobicContact SD-CG 4.28Å; M12-L75 HydrophobicContact CE-CD1 4.16Å; M12-Y86 HydrophobicContact CE-CD1 4.24Å; M12-Y86 HydrophobicContact CE-CD2 3.87Å; M12-Y86 HydrophobicContact CE-CG 3.67Å; M12-Y86 WeakPolarHBondContact SD-CB 3.39Å; M12-Y86 HydrophobicContact SD-CD1 4.31Å; M12-Y86 HydrophobicContact SD-CG 3.89Å; M12-V102 HydrophobicContact CE-CG2 3.58Å
13	S	94.8	Very high	87.4	Confident	74 Å²	74	67 Å²	67	52%	0.517	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	149.5	-178.7	63.4	0	0	0	0	111.3	V71 Y72	S13-V71 CarbonylContact C-O 3.56Å; S13-Y72 VanDerWaalsContact CB-CD1 3.49Å; S13-Y72 VanDerWaalsContact CB-CE1 3.46Å
14	C	91.9	Very high	86.9	Confident	14 Å²	14	64.8 Å²	64.8	10%	0.095	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	111.2	171.1	178.9	0	0	0	0	108.7	W28 T70 V71 C88	C14-W28 HydrophobicContact CB-CH2 3.98Å; C14-W28 HydrophobicContact CB-CZ2 3.61Å; C14-T70 CarbonylContact O-C 3.59Å; C14-T70 WeakPolarHBondContact O-CA 3.36Å; C14-V71 PolarHBondContact N-O 2.9Å; C14-V71 PolarHBondContact O-N 3.02Å; C14-C88 HydrophobicContact CB-CB 3.41Å; C14-C88 VanDerWaalsContact CB-CB 3.41Å; C14-C88 WeakPolarHBondContact CB-SG 3.45Å; C14-C88 WeakPolarHBondContact SG-CB 3.41Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 3.21Å
15	K	90.1	Very high	86.5	Confident	149 Å²	149	64.3 Å²	64.3	65%	0.648	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	121	178.1	-172.7	178.2	-177.7	179.6	0	109.5	S68	K15-S68 WeakPolarHBondContact CE-O 2.92Å
16	A	82.6	Confident	86.3	Confident	11 Å²	11	57.4 Å²	57.4	9%	0.091	36%	0.359	C	S	.	.			trans	-68.7	142.3	172.4	0	0	0	0	0	110.5	Y19 F21 I26 S69	A16-Y19 HydrophobicContact CB-CE1 3.98Å; A16-Y19 HydrophobicContact CB-CE2 4.11Å; A16-Y19 WeakPolarHBondContact CB-OH 3.43Å; A16-F21 HydrophobicContact CB-CD2 3.68Å; A16-F21 HydrophobicContact CB-CE2 4.48Å; A16-I26 HydrophobicContact CB-CD1 4.46Å; A16-S69 PolarHBondContact N-O 2.99Å
17	S	79.3	Confident	86.2	Confident	99 Å²	99	54.7 Å²	54.7	69%	0.692	34%	0.339	S	S	*	.			trans	-142.1	145.5	175	62.9	0	0	0	0	110.1	Y19	S17-Y19 VanDerWaalsContact O-CD1 3.23Å; S17-Y19 WeakPolarHBondContact O-CD1 3.08Å; S17-Y19 PolarHBondContact O-N 3.04Å
18	G	70.5	Confident	86.2	Confident	92 Å²	92	52.2 Å²	52.2	95%	0.948	31%	0.313	S	S	*	.	S	Bend	trans	80.6	4.3	174.8	0	0	0	0	0	116.6
19	Y	67.9	Low	86.2	Confident	61 Å²	61	51.2 Å²	51.2	24%	0.239	30%	0.302	C	S	.	.	S	Bend	trans	-151.3	164.8	175	63.5	-85	0	0	0	112.2	A16 S17 F21 Y24 S90	A16-Y19 HydrophobicContact CB-CE1 3.98Å; A16-Y19 HydrophobicContact CB-CE2 4.11Å; A16-Y19 WeakPolarHBondContact CB-OH 3.43Å; S17-Y19 VanDerWaalsContact O-CD1 3.23Å; S17-Y19 WeakPolarHBondContact O-CD1 3.08Å; S17-Y19 PolarHBondContact O-N 3.04Å; Y19-F21 PolarHBondContact O-N 2.98Å; Y19-Y24 HydrophobicContact CD2-CD2 4.36Å; Y19-S90 WeakPolarHBondContact OH-CB 3.28Å; Y19-S90 PolarHBondContact OH-OG 3.41Å; Y19-S90 VanDerWaalsContact OH-OG 3.13Å
20	T	70.3	Confident	86.2	Confident	90 Å²	90	48.7 Å²	48.7	55%	0.552	28%	0.283	S	S	*	.			trans	-68.7	105.1	174.8	-48.9	0	0	0	0	109.5	T22 T23	T20-T22 WeakPolarHBondContact CG2-OG1 3.45Å; T20-T22 PolarHBondContact O-N 3.22Å; T20-T23 PolarHBondContact O-N 2.95Å; T20-T23 VanDerWaalsContact O-N 3.13Å; T20-T23 PolarHBondContact O-OG1 3.08Å
21	F	72.9	Confident	86.2	Confident	9 Å²	9	51.5 Å²	51.5	4%	0.039	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-33.4	177.5	178	-95.1	0	0	0	112.6	A16 Y19 T23 I26 F43 P45 V64 K66 S69 V71	A16-F21 HydrophobicContact CB-CD2 3.68Å; A16-F21 HydrophobicContact CB-CE2 4.48Å; Y19-F21 PolarHBondContact O-N 2.98Å; F21-T23 PolarHBondContact O-N 3.5Å; F21-I26 HydrophobicContact CD2-CD1 3.53Å; F21-I26 HydrophobicContact CE2-CD1 3.13Å; F21-I26 HydrophobicContact CZ-CD1 3.95Å; F21-F43 HydrophobicContact CE1-CE1 4.4Å; F21-P45 HydrophobicContact CD1-CB 4.03Å; F21-P45 HydrophobicContact CD1-CG 4.08Å; F21-P45 HydrophobicContact CE1-CB 3.92Å; F21-P45 HydrophobicContact CE1-CG 3.79Å; F21-P45 HydrophobicContact CZ-CG 4.18Å; F21-P45 WeakPolarHBondContact O-CB 3.1Å; F21-P45 WeakPolarHBondContact O-CG 3.41Å; F21-V64 HydrophobicContact CE1-CG2 4.13Å; F21-V64 HydrophobicContact CZ-CG2 3.59Å; F21-K66 HydrophobicContact CE1-CG 4.37Å; F21-S69 WeakPolarHBondContact CB-OG 3.49Å; F21-S69 WeakPolarHBondContact CD2-O 3.16Å; F21-S69 WeakPolarHBondContact CE2-O 3.42Å; F21-V71 HydrophobicContact CE2-CG2 3.74Å; F21-V71 HydrophobicContact CZ-CG2 3.79Å
22	T	71.5	Confident	86	Confident	75 Å²	75	47 Å²	47	46%	0.46	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-12.4	-174	60.3	0	0	0	0	115.1	T20 Y46	T20-T22 WeakPolarHBondContact CG2-OG1 3.45Å; T20-T22 PolarHBondContact O-N 3.22Å; T22-Y46 PolarHBondContact O-N 2.81Å
23	T	77.7	Confident	85.6	Confident	70 Å²	70	54.3 Å²	54.3	43%	0.429	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-34.2	-166.7	-45.5	0	0	0	0	114.3	T20 F21	T20-T23 PolarHBondContact O-N 2.95Å; T20-T23 VanDerWaalsContact O-N 3.13Å; T20-T23 PolarHBondContact O-OG1 3.08Å; F21-T23 PolarHBondContact O-N 3.5Å
24	Y	84.3	Confident	85.1	Confident	82 Å²	82	55.2 Å²	55.2	32%	0.322	33%	0.332	S	S	.	.	S	Bend	trans	-119.7	145.8	-172.6	-64.3	-72.9	0	0	0	111.9	Y19 P45 W92	Y19-Y24 HydrophobicContact CD2-CD2 4.36Å; Y24-P45 VanDerWaalsContact O-CD 3.28Å; Y24-P45 WeakPolarHBondContact O-CD 3.25Å; Y24-W92 AromaticContact CE1-NE1 3.95Å
25	P	88.8	Confident	84.9	Confident	11 Å²	11	61 Å²	61	7%	0.071	36%	0.355	C	S	.	.			trans	-62.6	149.8	171.3	27.7	-33.3	0	0	0	110.4	F43 S90	P25-F43 VanDerWaalsContact CA-O 3.31Å; P25-F43 WeakPolarHBondContact CA-O 3.19Å; P25-S90 PolarHBondContact O-OG 2.81Å
26	I	91.9	Very high	84.9	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.1	171.6	-64.7	170.2	0	0	0	107.2	A16 F21 N42 F43 V71 C88 A89	A16-I26 HydrophobicContact CB-CD1 4.46Å; F21-I26 HydrophobicContact CD2-CD1 3.53Å; F21-I26 HydrophobicContact CE2-CD1 3.13Å; F21-I26 HydrophobicContact CZ-CD1 3.95Å; I26-N42 WeakPolarHBondContact O-CA 3.36Å; I26-N42 VanDerWaalsContact O-CB 3.27Å; I26-N42 WeakPolarHBondContact O-CB 3.36Å; I26-F43 PolarHBondContact N-O 2.79Å; I26-F43 PolarHBondContact O-N 3.39Å; I26-V71 HydrophobicContact CB-CG2 3.88Å; I26-V71 HydrophobicContact CD1-CG2 3.41Å; I26-V71 VanDerWaalsContact CD1-CG2 3.41Å; I26-V71 HydrophobicContact CG1-CG2 4.23Å; I26-V71 HydrophobicContact CG2-CB 4.16Å; I26-V71 HydrophobicContact CG2-CG2 3.81Å; I26-C88 HydrophobicContact CG2-CB 4.46Å; I26-A89 WeakPolarHBondContact CA-O 3.46Å
27	E	94.3	Very high	85.5	Confident	21 Å²	21	61.3 Å²	61.3	10%	0.098	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	139	-172.8	-54.8	-72.3	158.3	0	0	108.8	W39 N42 C88 A89 F93	E27-W39 PolarHBondContact OE2-NE1 3.44Å; E27-N42 VanDerWaalsContact CD-CB 3.5Å; E27-N42 HydrophobicContact CG-CB 4.43Å; E27-N42 PolarHBondContact OE1-ND2 2.79Å; E27-N42 VanDerWaalsContact OE2-CB 3.26Å; E27-N42 WeakPolarHBondContact OE2-CB 3.32Å; E27-N42 PolarHBondContact OE2-ND2 2.81Å; E27-C88 CarbonylContact O-C 3.53Å; E27-C88 WeakPolarHBondContact O-CA 3.2Å; E27-A89 HydrophobicContact CB-CB 4.39Å; E27-A89 PolarHBondContact N-O 3.01Å; E27-A89 PolarHBondContact O-N 3.13Å; E27-F93 HydrophobicContact CB-CE1 3.79Å; E27-F93 HydrophobicContact CB-CZ 4.25Å; E27-F93 HydrophobicContact CG-CE1 3.77Å; E27-F93 HydrophobicContact CG-CZ 3.8Å
28	W	97.1	Very high	86.3	Confident	3 Å²	3	58.8 Å²	58.8	1%	0.011	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.3	168.2	-82.2	97.7	0	0	0	110.4	M12 C14 I40 G41 L62 L73 Y87 C88	M12-W28 HydrophobicContact CB-CH2 4.15Å; M12-W28 HydrophobicContact CG-CH2 3.55Å; M12-W28 HydrophobicContact CG-CZ2 4.2Å; M12-W28 HydrophobicContact CG-CZ3 3.77Å; M12-W28 HydrophobicContact SD-CE3 3.97Å; M12-W28 HydrophobicContact SD-CH2 3.78Å; M12-W28 HydrophobicContact SD-CZ3 3.32Å; M12-W28 WeakPolarHBondContact SD-CZ3 3.37Å; C14-W28 HydrophobicContact CB-CH2 3.98Å; C14-W28 HydrophobicContact CB-CZ2 3.61Å; W28-I40 HydrophobicContact CB-CB 4.11Å; W28-I40 HydrophobicContact CB-CD1 4.3Å; W28-I40 WeakPolarHBondContact O-CB 2.99Å; W28-I40 PolarHBondContact O-N 2.83Å; W28-G41 PolarHBondContact N-O 2.78Å; W28-L62 HydrophobicContact CG-CD2 4.04Å; W28-L73 HydrophobicContact CB-CD2 4.22Å; W28-L73 HydrophobicContact CD2-CB 3.63Å; W28-L73 HydrophobicContact CD2-CD2 3.8Å; W28-L73 HydrophobicContact CD2-CG 4.34Å; W28-L73 VanDerWaalsContact CE2-CB 3.49Å; W28-L73 HydrophobicContact CE3-CB 4.1Å; W28-L73 HydrophobicContact CE3-CD2 3.71Å; W28-L73 HydrophobicContact CG-CB 4.03Å; W28-L73 HydrophobicContact CG-CD2 4.05Å; W28-L73 HydrophobicContact CH2-CB 4.3Å; W28-L73 HydrophobicContact CZ2-CB 3.83Å; W28-L73 HydrophobicContact CZ3-CB 4.42Å; W28-L73 HydrophobicContact CZ3-CD2 4.38Å; W28-Y87 WeakPolarHBondContact CA-O 3.33Å; W28-Y87 VanDerWaalsContact CE3-O 3.27Å; W28-C88 HydrophobicContact CD2-CB 4.24Å; W28-C88 HydrophobicContact CE3-CB 4.22Å; W28-C88 HydrophobicContact CH2-CB 4.25Å; W28-C88 HydrophobicContact CZ2-CB 4.27Å; W28-C88 HydrophobicContact CZ3-CB 4.21Å
29	M	97.3	Very high	87.6	Confident	15 Å²	15	57.9 Å²	57.9	7%	0.074	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.7	-175.8	-53.8	-63.4	-65.7	0	0	110	L37 E38 W39 Y86 Y87 F93 W96	M29-L37 HydrophobicContact CB-CD2 3.97Å; M29-L37 HydrophobicContact CE-CB 3.84Å; M29-E38 CarbonylContact C-O 3.58Å; M29-E38 WeakPolarHBondContact CA-O 3.32Å; M29-W39 HydrophobicContact CE-CB 4.07Å; M29-W39 HydrophobicContact SD-CB 3.94Å; M29-W39 VanDerWaalsContact SD-CD1 3.57Å; M29-W39 HydrophobicContact SD-CG 4.17Å; M29-Y86 CarbonylContact O-C 3.57Å; M29-Y86 WeakPolarHBondContact O-CA 3.34Å; M29-Y87 PolarHBondContact N-O 3.06Å; M29-Y87 PolarHBondContact O-N 3.07Å; M29-F93 HydrophobicContact CG-CE1 4.36Å; M29-F93 HydrophobicContact SD-CE1 3.85Å; M29-W96 HydrophobicContact CB-CZ3 4.11Å; M29-W96 HydrophobicContact CG-CH2 3.84Å; M29-W96 HydrophobicContact CG-CZ3 3.76Å
30	K	97.1	Very high	89	Confident	12 Å²	12	55 Å²	55	5%	0.052	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	135.1	171.2	-173	-178.6	-177.4	-172.3	0	109.4	N32 L37 E38 I40 F56 D81 D82 A84 Y86	K30-N32 WeakPolarHBondContact CD-OD1 3.31Å; K30-N32 WeakPolarHBondContact CE-OD1 3.4Å; K30-N32 WeakPolarHBondContact CG-OD1 3.41Å; K30-L37 CarbonylContact O-C 3.53Å; K30-L37 WeakPolarHBondContact O-CA 3.01Å; K30-E38 HydrophobicContact CB-CB 4.5Å; K30-E38 PolarHBondContact N-O 3.47Å; K30-E38 PolarHBondContact O-N 2.84Å; K30-I40 HydrophobicContact CB-CD1 3.98Å; K30-I40 HydrophobicContact CB-CG1 4.11Å; K30-F56 HydrophobicContact CB-CZ 4.3Å; K30-F56 HydrophobicContact CD-CE1 3.9Å; K30-F56 HydrophobicContact CD-CZ 3.89Å; K30-D81 PolarHBondContact NZ-O 2.95Å; K30-D82 IonicContact NZ-OD1 3.59Å; K30-A84 HydrophobicContact CD-CB 4.23Å; K30-A84 HydrophobicContact CG-CB 3.62Å; K30-Y86 HydrophobicContact CB-CD1 4.24Å; K30-Y86 HydrophobicContact CB-CE1 4.01Å; K30-Y86 HydrophobicContact CD-CE1 3.97Å; K30-Y86 VanDerWaalsContact CE-OH 3.32Å; K30-Y86 WeakPolarHBondContact CE-OH 3.42Å; K30-Y86 HydrophobicContact CG-CD1 4.26Å; K30-Y86 HydrophobicContact CG-CE1 3.71Å
31	Q	96.8	Very high	90.2	Very high	68 Å²	68	50.7 Å²	50.7	32%	0.318	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	109.6	170.4	-168.9	-179.7	35	0	0	110	L37 A84 V85 Y87	Q31-L37 HydrophobicContact CB-CD2 3.77Å; Q31-L37 HydrophobicContact CG-CD2 4.27Å; Q31-A84 WeakPolarHBondContact O-CA 3.34Å; Q31-A84 VanDerWaalsContact O-CB 3.27Å; Q31-A84 WeakPolarHBondContact O-CB 3.46Å; Q31-V85 PolarHBondContact N-O 3.09Å; Q31-V85 PolarHBondContact O-N 3.29Å; Q31-Y87 HydrophobicContact CB-CD2 4.33Å; Q31-Y87 HydrophobicContact CB-CE2 3.74Å; Q31-Y87 VanDerWaalsContact OE1-CE2 3.3Å; Q31-Y87 PolarHBondContact OE1-OH 2.84Å
32	N	92.9	Very high	91.2	Very high	24 Å²	24	51.1 Å²	51.1	13%	0.128	28%	0.28	C	S	.	.			trans	-79.2	153.8	172	-59.5	18	0	0	0	109.6	K30 G34 K35	K30-N32 WeakPolarHBondContact CD-OD1 3.31Å; K30-N32 WeakPolarHBondContact CE-OD1 3.4Å; K30-N32 WeakPolarHBondContact CG-OD1 3.41Å; N32-G34 PolarHBondContact O-N 3.36Å; N32-G34 VanDerWaalsContact O-N 3.13Å; N32-K35 HydrophobicContact CB-CB 4.06Å; N32-K35 HydrophobicContact CB-CD 4Å; N32-K35 HydrophobicContact CB-CG 4.12Å; N32-K35 PolarHBondContact O-N 2.8Å
33	H	87.4	Confident	92.2	Very high	160 Å²	160	48.1 Å²	48.1	74%	0.741	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	121.3	173.8	-91.8	-119.6	0	0	0	111.4	K35	H33-K35 PolarHBondContact O-N 2.89Å
34	G	85.7	Confident	92.8	Very high	93 Å²	93	47.3 Å²	47.3	96%	0.959	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	11.5	177.9	0	0	0	0	0	115.7	N32	N32-G34 PolarHBondContact O-N 3.36Å; N32-G34 VanDerWaalsContact O-N 3.13Å
35	K	87.6	Confident	92.8	Very high	135 Å²	135	43.7 Å²	43.7	59%	0.587	24%	0.239	S	C	*	.	S	Bend	trans	-116.3	165.2	178.4	-57	-168.4	-178.7	-178.9	0	112.1	N32 H33	N32-K35 HydrophobicContact CB-CB 4.06Å; N32-K35 HydrophobicContact CB-CD 4Å; N32-K35 HydrophobicContact CB-CG 4.12Å; N32-K35 PolarHBondContact O-N 2.8Å; H33-K35 PolarHBondContact O-N 2.89Å
36	S	90.1	Very high	92.6	Very high	94 Å²	94	52.3 Å²	52.3	66%	0.657	27%	0.271	S	S	*	.			trans	-65.5	160.6	172.5	59.2	0	0	0	0	111.8	E38	S36-E38 PolarHBondContact O-N 3.14Å
37	L	94.5	Very high	92.5	Very high	73 Å²	73	56.7 Å²	56.7	38%	0.382	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	132.1	170	-75.6	158.8	0	0	0	110.4	M29 K30 Q31 Y87 W96	M29-L37 HydrophobicContact CB-CD2 3.97Å; M29-L37 HydrophobicContact CE-CB 3.84Å; K30-L37 CarbonylContact O-C 3.53Å; K30-L37 WeakPolarHBondContact O-CA 3.01Å; Q31-L37 HydrophobicContact CB-CD2 3.77Å; Q31-L37 HydrophobicContact CG-CD2 4.27Å; L37-Y87 HydrophobicContact CD2-CD2 4.02Å; L37-Y87 HydrophobicContact CD2-CE2 4.33Å; L37-W96 HydrophobicContact CD1-CH2 3.84Å; L37-W96 HydrophobicContact CD1-CZ3 4.23Å; L37-W96 HydrophobicContact CD2-CZ3 4.38Å
38	E	96.1	Very high	92.2	Very high	47 Å²	47	59.8 Å²	59.8	22%	0.22	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.4	172.6	-68.5	-169.6	-95.5	0	0	109.4	M29 K30 S36 K55 F56	M29-E38 CarbonylContact C-O 3.58Å; M29-E38 WeakPolarHBondContact CA-O 3.32Å; K30-E38 HydrophobicContact CB-CB 4.5Å; K30-E38 PolarHBondContact N-O 3.47Å; K30-E38 PolarHBondContact O-N 2.84Å; S36-E38 PolarHBondContact O-N 3.14Å; E38-K55 IonicContact OE2-NZ 2.81Å; E38-K55 PolarHBondContact OE2-NZ 2.79Å; E38-F56 HydrophobicContact CB-CE2 4.49Å
39	W	96.6	Very high	92	Very high	72 Å²	72	62.5 Å²	62.5	27%	0.273	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	129.7	175.4	179.3	72.8	0	0	0	111	E27 M29 G41 N42 K51 N53	E27-W39 PolarHBondContact OE2-NE1 3.44Å; M29-W39 HydrophobicContact CE-CB 4.07Å; M29-W39 HydrophobicContact SD-CB 3.94Å; M29-W39 VanDerWaalsContact SD-CD1 3.57Å; M29-W39 HydrophobicContact SD-CG 4.17Å; W39-G41 PolarHBondContact NE1-O 2.78Å; W39-N42 HydrophobicContact CZ2-CB 4.31Å; W39-N42 WeakPolarHBondContact CZ2-ND2 3.12Å; W39-K51 HydrophobicContact CH2-CB 4.01Å; W39-K51 HydrophobicContact CZ2-CB 4.34Å; W39-N53 HydrophobicContact CE3-CB 3.62Å; W39-N53 HydrophobicContact CZ3-CB 3.8Å; W39-N53 VanDerWaalsContact CZ3-N 3.34Å; W39-N53 VanDerWaalsContact O-CB 3.24Å; W39-N53 WeakPolarHBondContact O-CB 3.26Å; W39-N53 PolarHBondContact O-ND2 2.97Å
40	I	97.3	Very high	91.8	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-47.3	-179.2	-58.6	177.4	0	0	0	110.4	W28 K30 N53 F56 A60 L73 Y86	W28-I40 HydrophobicContact CB-CB 4.11Å; W28-I40 HydrophobicContact CB-CD1 4.3Å; W28-I40 WeakPolarHBondContact O-CB 2.99Å; W28-I40 PolarHBondContact O-N 2.83Å; K30-I40 HydrophobicContact CB-CD1 3.98Å; K30-I40 HydrophobicContact CB-CG1 4.11Å; I40-N53 WeakPolarHBondContact O-CB 3.38Å; I40-N53 PolarHBondContact O-N 3.31Å; I40-F56 HydrophobicContact CB-CD2 4.38Å; I40-F56 HydrophobicContact CB-CG 4.32Å; I40-F56 HydrophobicContact CG1-CD1 4.23Å; I40-F56 HydrophobicContact CG1-CD2 4.36Å; I40-F56 HydrophobicContact CG1-CE1 4.06Å; I40-F56 HydrophobicContact CG1-CE2 4.17Å; I40-F56 HydrophobicContact CG1-CG 4.37Å; I40-F56 HydrophobicContact CG1-CZ 4.02Å; I40-F56 HydrophobicContact CG2-CB 3.92Å; I40-F56 HydrophobicContact CG2-CD1 4.04Å; I40-F56 HydrophobicContact CG2-CD2 4.39Å; I40-F56 HydrophobicContact CG2-CG 3.86Å; I40-A60 HydrophobicContact CG2-CB 3.76Å; I40-L73 HydrophobicContact CD1-CD2 3.69Å; I40-L73 HydrophobicContact CG2-CD1 4.23Å; I40-Y86 HydrophobicContact CD1-CD1 3.61Å; I40-Y86 HydrophobicContact CD1-CE1 3.77Å
41	G	95.9	Very high	91.7	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168	171.3	-170.8	0	0	0	0	0	111.2	W28 W39 K51	W28-G41 PolarHBondContact N-O 2.78Å; W39-G41 PolarHBondContact NE1-O 2.78Å; G41-K51 CarbonylContact C-O 3.43Å; G41-K51 WeakPolarHBondContact CA-O 3.32Å
42	N	94.3	Very high	91.7	Very high	19 Å²	19	69 Å²	69	10%	0.102	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	160.9	171.9	67.7	50.1	0	0	0	112.6	I26 E27 W39 T50 K51	I26-N42 WeakPolarHBondContact O-CA 3.36Å; I26-N42 VanDerWaalsContact O-CB 3.27Å; I26-N42 WeakPolarHBondContact O-CB 3.36Å; E27-N42 VanDerWaalsContact CD-CB 3.5Å; E27-N42 HydrophobicContact CG-CB 4.43Å; E27-N42 PolarHBondContact OE1-ND2 2.79Å; E27-N42 VanDerWaalsContact OE2-CB 3.26Å; E27-N42 WeakPolarHBondContact OE2-CB 3.32Å; E27-N42 PolarHBondContact OE2-ND2 2.81Å; W39-N42 HydrophobicContact CZ2-CB 4.31Å; W39-N42 WeakPolarHBondContact CZ2-ND2 3.12Å; N42-T50 WeakPolarHBondContact O-CA 3.3Å; N42-T50 WeakPolarHBondContact O-CG2 3.32Å; N42-K51 PolarHBondContact N-O 2.79Å; N42-K51 PolarHBondContact O-N 2.96Å
43	F	92.3	Very high	91.8	Very high	11 Å²	11	69.7 Å²	69.7	5%	0.048	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.1	167.1	175.9	-102.1	0	0	0	108.5	F21 P25 I26 P45 D48 T50 V64 V71	F21-F43 HydrophobicContact CE1-CE1 4.4Å; P25-F43 VanDerWaalsContact CA-O 3.31Å; P25-F43 WeakPolarHBondContact CA-O 3.19Å; I26-F43 PolarHBondContact N-O 2.79Å; I26-F43 PolarHBondContact O-N 3.39Å; F43-P45 HydrophobicContact CD1-CB 4.45Å; F43-P45 HydrophobicContact CD1-CG 3.75Å; F43-P45 VanDerWaalsContact CE1-CA 3.43Å; F43-P45 HydrophobicContact CE1-CB 3.86Å; F43-P45 HydrophobicContact CE1-CG 3.65Å; F43-P45 WeakPolarHBondContact O-CD 3.44Å; F43-D48 WeakPolarHBondContact CZ-OD1 3.18Å; F43-T50 WeakPolarHBondContact CD2-OG1 3.49Å; F43-V64 HydrophobicContact CD1-CB 4.09Å; F43-V64 HydrophobicContact CD1-CG2 3.41Å; F43-V64 VanDerWaalsContact CD1-CG2 3.41Å; F43-V64 HydrophobicContact CD2-CB 4.47Å; F43-V64 HydrophobicContact CE1-CB 3.85Å; F43-V64 HydrophobicContact CE1-CG1 3.87Å; F43-V64 HydrophobicContact CE1-CG2 3.34Å; F43-V64 HydrophobicContact CE2-CB 4.25Å; F43-V64 HydrophobicContact CE2-CG1 4.2Å; F43-V64 HydrophobicContact CG-CB 4.39Å; F43-V64 HydrophobicContact CG-CG2 4.07Å; F43-V64 HydrophobicContact CZ-CB 3.94Å; F43-V64 HydrophobicContact CZ-CG1 3.65Å; F43-V64 HydrophobicContact CZ-CG2 3.97Å; F43-V71 HydrophobicContact CB-CG1 4.33Å
44	H	90.6	Very high	92.2	Very high	54 Å²	54	68.3 Å²	68.3	25%	0.25	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	103.9	176.4	-161.4	-53.3	0	0	0	110.3	Y46 N47 D48 D49	H44-Y46 VanDerWaalsContact C-N 3.29Å; H44-Y46 VanDerWaalsContact CE1-CB 3.45Å; H44-Y46 WeakPolarHBondContact CE1-CB 3.15Å; H44-Y46 WeakPolarHBondContact ND1-CB 3.44Å; H44-Y46 PolarHBondContact ND1-N 2.76Å; H44-Y46 PolarHBondContact O-N 2.86Å; H44-N47 WeakPolarHBondContact CB-OD1 3.17Å; H44-N47 PolarHBondContact O-N 2.02Å; H44-N47 PolarHBondContact O-OD1 2.8Å; H44-D48 PolarHBondContact O-N 2.86Å; H44-D48 VanDerWaalsContact O-N 3.07Å; H44-D49 HydrophobicContact CB-CB 4.47Å; H44-D49 PolarHBondContact N-O 3.4Å; H44-D49 PolarHBondContact O-N 2.56Å
45	P	85	Confident	92.6	Very high	6 Å²	6	70.9 Å²	70.9	4%	0.039	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-25.8	-171.6	-29	40.5	0	0	0	115.8	F21 Y24 F43	F21-P45 HydrophobicContact CD1-CB 4.03Å; F21-P45 HydrophobicContact CD1-CG 4.08Å; F21-P45 HydrophobicContact CE1-CB 3.92Å; F21-P45 HydrophobicContact CE1-CG 3.79Å; F21-P45 HydrophobicContact CZ-CG 4.18Å; F21-P45 WeakPolarHBondContact O-CB 3.1Å; F21-P45 WeakPolarHBondContact O-CG 3.41Å; Y24-P45 VanDerWaalsContact O-CD 3.28Å; Y24-P45 WeakPolarHBondContact O-CD 3.25Å; F43-P45 HydrophobicContact CD1-CB 4.45Å; F43-P45 HydrophobicContact CD1-CG 3.75Å; F43-P45 VanDerWaalsContact CE1-CA 3.43Å; F43-P45 HydrophobicContact CE1-CB 3.86Å; F43-P45 HydrophobicContact CE1-CG 3.65Å; F43-P45 WeakPolarHBondContact O-CD 3.44Å
46	Y	84.6	Confident	93	Very high	192 Å²	192	65 Å²	65	75%	0.753	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-39.3	-179.5	177.5	-106.4	0	0	0	113.9	T22 H44	T22-Y46 PolarHBondContact O-N 2.81Å; H44-Y46 VanDerWaalsContact C-N 3.29Å; H44-Y46 VanDerWaalsContact CE1-CB 3.45Å; H44-Y46 WeakPolarHBondContact CE1-CB 3.15Å; H44-Y46 WeakPolarHBondContact ND1-CB 3.44Å; H44-Y46 PolarHBondContact ND1-N 2.76Å; H44-Y46 PolarHBondContact O-N 2.86Å
47	N	89.3	Confident	93.1	Very high	91 Å²	91	66.5 Å²	66.5	49%	0.487	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	9.7	-174.5	64.3	-14.7	0	0	0	113	H44 D49	H44-N47 WeakPolarHBondContact CB-OD1 3.17Å; H44-N47 PolarHBondContact O-N 2.02Å; H44-N47 PolarHBondContact O-OD1 2.8Å; N47-D49 PolarHBondContact O-N 2.93Å; N47-D49 VanDerWaalsContact O-N 3.16Å; N47-D49 VanDerWaalsContact OD1-CB 3.3Å; N47-D49 WeakPolarHBondContact OD1-CB 3.46Å; N47-D49 PolarHBondContact OD1-N 3.26Å
48	D	88.8	Confident	93	Very high	87 Å²	87	65.6 Å²	65.6	47%	0.465	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	27.5	-177.2	-68.2	-41.9	0	0	0	114.4	F43 H44 K66	F43-D48 WeakPolarHBondContact CZ-OD1 3.18Å; H44-D48 PolarHBondContact O-N 2.86Å; H44-D48 VanDerWaalsContact O-N 3.07Å; D48-K66 WeakPolarHBondContact OD1-CE 3.23Å; D48-K66 IonicContact OD1-NZ 3.14Å; D48-K66 PolarHBondContact OD1-NZ 3.38Å; D48-K66 IonicContact OD2-NZ 2.76Å; D48-K66 PolarHBondContact OD2-NZ 2.98Å
49	D	91.3	Very high	93	Very high	60 Å²	60	65.5 Å²	65.5	32%	0.321	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	140.1	-179.9	-171.2	28	0	0	0	110.9	H44 N47 K51	H44-D49 HydrophobicContact CB-CB 4.47Å; H44-D49 PolarHBondContact N-O 3.4Å; H44-D49 PolarHBondContact O-N 2.56Å; N47-D49 PolarHBondContact O-N 2.93Å; N47-D49 VanDerWaalsContact O-N 3.16Å; N47-D49 VanDerWaalsContact OD1-CB 3.3Å; N47-D49 WeakPolarHBondContact OD1-CB 3.46Å; N47-D49 PolarHBondContact OD1-N 3.26Å; D49-K51 WeakPolarHBondContact OD2-CE 3.35Å; D49-K51 IonicContact OD2-NZ 2.64Å
50	T	93.8	Very high	93	Very high	49 Å²	49	62.3 Å²	62.3	30%	0.301	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123	176.1	-52.4	0	0	0	0	109.2	N42 F43 Y52 L62	N42-T50 WeakPolarHBondContact O-CA 3.3Å; N42-T50 WeakPolarHBondContact O-CG2 3.32Å; F43-T50 WeakPolarHBondContact CD2-OG1 3.49Å; T50-Y52 HydrophobicContact CG2-CD2 4.18Å; T50-Y52 HydrophobicContact CG2-CE2 3.41Å; T50-Y52 VanDerWaalsContact CG2-CE2 3.41Å; T50-L62 HydrophobicContact CG2-CB 3.96Å; T50-L62 HydrophobicContact CG2-CD1 3.91Å; T50-L62 HydrophobicContact CG2-CG 4.46Å
51	K	95.1	Very high	93	Very high	112 Å²	112	65.4 Å²	65.4	49%	0.487	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	145	177.2	-62.7	-174.4	-176.7	179.4	0	110.1	W39 G41 N42 D49	W39-K51 HydrophobicContact CH2-CB 4.01Å; W39-K51 HydrophobicContact CZ2-CB 4.34Å; G41-K51 CarbonylContact C-O 3.43Å; G41-K51 WeakPolarHBondContact CA-O 3.32Å; N42-K51 PolarHBondContact N-O 2.79Å; N42-K51 PolarHBondContact O-N 2.96Å; D49-K51 WeakPolarHBondContact OD2-CE 3.35Å; D49-K51 IonicContact OD2-NZ 2.64Å
52	Y	96.3	Very high	93	Very high	69 Å²	69	66 Å²	66	27%	0.271	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	148.4	178	-67.2	-87.1	0	0	0	110.2	T50 A60 L62	T50-Y52 HydrophobicContact CG2-CD2 4.18Å; T50-Y52 HydrophobicContact CG2-CE2 3.41Å; T50-Y52 VanDerWaalsContact CG2-CE2 3.41Å; Y52-A60 HydrophobicContact CE1-CB 4.49Å; Y52-A60 WeakPolarHBondContact CE1-O 3.43Å; Y52-L62 HydrophobicContact CE1-CB 4.31Å; Y52-L62 HydrophobicContact CE1-CD1 4.05Å; Y52-L62 HydrophobicContact CE1-CG 3.81Å; Y52-L62 PolarHBondContact OH-N 3.14Å
53	N	96.4	Very high	93	Very high	40 Å²	40	67.6 Å²	67.6	21%	0.214	34%	0.336	C	S	.	.			trans	-73.3	133.2	158.9	-175.3	-27.7	0	0	0	108.7	W39 I40 K55 F56 K57	W39-N53 HydrophobicContact CE3-CB 3.62Å; W39-N53 HydrophobicContact CZ3-CB 3.8Å; W39-N53 VanDerWaalsContact CZ3-N 3.34Å; W39-N53 VanDerWaalsContact O-CB 3.24Å; W39-N53 WeakPolarHBondContact O-CB 3.26Å; W39-N53 PolarHBondContact O-ND2 2.97Å; I40-N53 WeakPolarHBondContact O-CB 3.38Å; I40-N53 PolarHBondContact O-N 3.31Å; N53-K55 PolarHBondContact O-N 2.97Å; N53-K55 VanDerWaalsContact O-N 3.1Å; N53-K55 PolarHBondContact OD1-N 3.18Å; N53-F56 HydrophobicContact CB-CD2 3.99Å; N53-F56 PolarHBondContact O-N 2.81Å; N53-K57 PolarHBondContact O-N 3.25Å
54	E	95.6	Very high	92.9	Very high	130 Å²	130	69.4 Å²	69.4	61%	0.607	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-54.9	-31.8	-179.7	-68.8	-60.9	141	0	0	112.7	F56 K57	E54-F56 PolarHBondContact O-N 2.85Å; E54-K57 WeakPolarHBondContact O-CB 3.42Å; E54-K57 PolarHBondContact O-N 2.94Å; E54-K57 IonicContact OE1-NZ 2.56Å; E54-K57 PolarHBondContact OE1-NZ 3.32Å; E54-K57 WeakPolarHBondContact OE2-CD 3.43Å; E54-K57 IonicContact OE2-NZ 2.81Å; E54-K57 PolarHBondContact OE2-NZ 3.22Å; E54-K57 VanDerWaalsContact OE2-NZ 3.14Å
55	K	93.9	Very high	92.9	Very high	147 Å²	147	70.7 Å²	70.7	64%	0.639	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-59.7	-29.9	174.9	-73.4	179.9	170.5	178.6	0	114.1	E38 N53	E38-K55 IonicContact OE2-NZ 2.81Å; E38-K55 PolarHBondContact OE2-NZ 2.79Å; N53-K55 PolarHBondContact O-N 2.97Å; N53-K55 VanDerWaalsContact O-N 3.1Å; N53-K55 PolarHBondContact OD1-N 3.18Å
56	F	95.3	Very high	92.9	Very high	12 Å²	12	75 Å²	75	5%	0.053	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-104.9	-5.4	-174.5	-67.7	-86.5	0	0	0	112.6	K30 E38 I40 N53 E54 G58 K59 A60	K30-F56 HydrophobicContact CB-CZ 4.3Å; K30-F56 HydrophobicContact CD-CE1 3.9Å; K30-F56 HydrophobicContact CD-CZ 3.89Å; E38-F56 HydrophobicContact CB-CE2 4.49Å; I40-F56 HydrophobicContact CB-CD2 4.38Å; I40-F56 HydrophobicContact CB-CG 4.32Å; I40-F56 HydrophobicContact CG1-CD1 4.23Å; I40-F56 HydrophobicContact CG1-CD2 4.36Å; I40-F56 HydrophobicContact CG1-CE1 4.06Å; I40-F56 HydrophobicContact CG1-CE2 4.17Å; I40-F56 HydrophobicContact CG1-CG 4.37Å; I40-F56 HydrophobicContact CG1-CZ 4.02Å; I40-F56 HydrophobicContact CG2-CB 3.92Å; I40-F56 HydrophobicContact CG2-CD1 4.04Å; I40-F56 HydrophobicContact CG2-CD2 4.39Å; I40-F56 HydrophobicContact CG2-CG 3.86Å; N53-F56 HydrophobicContact CB-CD2 3.99Å; N53-F56 PolarHBondContact O-N 2.81Å; E54-F56 PolarHBondContact O-N 2.85Å; F56-G58 PolarHBondContact O-N 2.8Å; F56-K59 PolarHBondContact O-N 2.62Å; F56-A60 HydrophobicContact CB-CB 4.05Å; F56-A60 PolarHBondContact O-N 2.88Å
57	K	93	Very high	92.9	Very high	126 Å²	126	71.1 Å²	71.1	55%	0.548	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-61.8	127.3	178.5	-157.6	173.5	-172	172.5	0	110.1	N53 E54 K59	N53-K57 PolarHBondContact O-N 3.25Å; E54-K57 WeakPolarHBondContact O-CB 3.42Å; E54-K57 PolarHBondContact O-N 2.94Å; E54-K57 IonicContact OE1-NZ 2.56Å; E54-K57 PolarHBondContact OE1-NZ 3.32Å; E54-K57 WeakPolarHBondContact OE2-CD 3.43Å; E54-K57 IonicContact OE2-NZ 2.81Å; E54-K57 PolarHBondContact OE2-NZ 3.22Å; E54-K57 VanDerWaalsContact OE2-NZ 3.14Å; K57-K59 PolarHBondContact O-N 2.86Å
58	G	92.4	Very high	92.8	Very high	53 Å²	53	68.3 Å²	68.3	55%	0.546	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	-4.4	-175.2	0	0	0	0	0	115.1	F56 R77	F56-G58 PolarHBondContact O-N 2.8Å; G58-R77 PolarHBondContact O-NH2 3.19Å
59	K	95.6	Very high	92.8	Very high	46 Å²	46	65.9 Å²	65.9	20%	0.2	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-44.9	170.9	-166.6	169	-164.4	172	0	112	F56 K57 L75 S76 D82	F56-K59 PolarHBondContact O-N 2.62Å; K57-K59 PolarHBondContact O-N 2.86Å; K59-L75 WeakPolarHBondContact O-CA 3.27Å; K59-S76 WeakPolarHBondContact CG-O 3.24Å; K59-S76 PolarHBondContact O-N 2.95Å; K59-S76 PolarHBondContact O-OG 2.86Å; K59-D82 VanDerWaalsContact CE-CG 3.5Å; K59-D82 VanDerWaalsContact CE-OD1 3.32Å; K59-D82 WeakPolarHBondContact CE-OD1 3.3Å; K59-D82 WeakPolarHBondContact CE-OD2 3.26Å; K59-D82 IonicContact NZ-OD1 2.75Å; K59-D82 PolarHBondContact NZ-OD1 2.81Å; K59-D82 IonicContact NZ-OD2 3.95Å; K59-D82 PolarHBondContact NZ-OD2 3.37Å
60	A	97.2	Very high	92.8	Very high	4 Å²	4	63.5 Å²	63.5	3%	0.033	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	137.8	177	0	0	0	0	0	111.3	I40 Y52 F56 L73 E74 L75	I40-A60 HydrophobicContact CG2-CB 3.76Å; Y52-A60 HydrophobicContact CE1-CB 4.49Å; Y52-A60 WeakPolarHBondContact CE1-O 3.43Å; F56-A60 HydrophobicContact CB-CB 4.05Å; F56-A60 PolarHBondContact O-N 2.88Å; A60-L73 HydrophobicContact CB-CD1 3.7Å; A60-E74 CarbonylContact C-O 3.5Å; A60-E74 WeakPolarHBondContact CA-O 3.31Å; A60-L75 HydrophobicContact CB-CD2 3.95Å
61	T	97.1	Very high	92.7	Very high	65 Å²	65	61.1 Å²	61.1	40%	0.399	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	120.2	170.3	-60.8	0	0	0	0	108.5	T63 E74	T61-T63 HydrophobicContact CG2-CG2 4.19Å; T61-E74 PolarHBondContact N-O 2.84Å; T61-E74 PolarHBondContact O-N 2.79Å
62	L	95.4	Very high	92.7	Very high	14 Å²	14	58.4 Å²	58.4	7%	0.073	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	129.3	174	-63.5	177.6	0	0	0	109.5	W28 T50 Y52 Y72 L73	W28-L62 HydrophobicContact CG-CD2 4.04Å; T50-L62 HydrophobicContact CG2-CB 3.96Å; T50-L62 HydrophobicContact CG2-CD1 3.91Å; T50-L62 HydrophobicContact CG2-CG 4.46Å; Y52-L62 HydrophobicContact CE1-CB 4.31Å; Y52-L62 HydrophobicContact CE1-CD1 4.05Å; Y52-L62 HydrophobicContact CE1-CG 3.81Å; Y52-L62 PolarHBondContact OH-N 3.14Å; L62-Y72 WeakPolarHBondContact CA-O 3.35Å; L62-L73 HydrophobicContact CD2-CB 3.95Å; L62-L73 HydrophobicContact CD2-CD1 3.77Å; L62-L73 HydrophobicContact CD2-CG 4.45Å
63	T	93.6	Very high	92.8	Very high	52 Å²	52	55.1 Å²	55.1	32%	0.319	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	147.5	174.3	51.6	0	0	0	0	110.1	T61 Y72	T61-T63 HydrophobicContact CG2-CG2 4.19Å; T63-Y72 PolarHBondContact N-O 3.13Å; T63-Y72 PolarHBondContact O-N 2.85Å; T63-Y72 WeakPolarHBondContact OG1-CB 3.36Å
64	V	90.8	Very high	92.8	Very high	49 Å²	49	56.5 Å²	56.5	30%	0.297	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	142.2	-176.5	103.1	0	0	0	0	112	F21 F43 K66 V71	F21-V64 HydrophobicContact CE1-CG2 4.13Å; F21-V64 HydrophobicContact CZ-CG2 3.59Å; F43-V64 HydrophobicContact CD1-CB 4.09Å; F43-V64 HydrophobicContact CD1-CG2 3.41Å; F43-V64 VanDerWaalsContact CD1-CG2 3.41Å; F43-V64 HydrophobicContact CD2-CB 4.47Å; F43-V64 HydrophobicContact CE1-CB 3.85Å; F43-V64 HydrophobicContact CE1-CG1 3.87Å; F43-V64 HydrophobicContact CE1-CG2 3.34Å; F43-V64 HydrophobicContact CE2-CB 4.25Å; F43-V64 HydrophobicContact CE2-CG1 4.2Å; F43-V64 HydrophobicContact CG-CB 4.39Å; F43-V64 HydrophobicContact CG-CG2 4.07Å; F43-V64 HydrophobicContact CZ-CB 3.94Å; F43-V64 HydrophobicContact CZ-CG1 3.65Å; F43-V64 HydrophobicContact CZ-CG2 3.97Å; V64-K66 HydrophobicContact CG1-CG 3.99Å; V64-V71 HydrophobicContact CG2-CB 4.47Å; V64-V71 HydrophobicContact CG2-CG2 3.85Å
65	E	89.8	Confident	92.9	Very high	81 Å²	81	50.3 Å²	50.3	38%	0.379	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	92.8	170.3	-173.2	178.8	-145.5	0	0	108.7	S67 S68 S69 T70 Y72	E65-S67 VanDerWaalsContact C-N 3.32Å; E65-S67 PolarHBondContact O-N 2.88Å; E65-S68 VanDerWaalsContact CG-OG 3.3Å; E65-S68 WeakPolarHBondContact CG-OG 3.34Å; E65-S68 PolarHBondContact O-N 2.91Å; E65-S68 PolarHBondContact O-OG 3.34Å; E65-S68 PolarHBondContact OE2-OG 3.35Å; E65-S69 PolarHBondContact O-N 3.06Å; E65-T70 PolarHBondContact N-O 2.85Å; E65-T70 PolarHBondContact O-N 2.95Å; E65-Y72 HydrophobicContact CB-CE2 3.9Å; E65-Y72 PolarHBondContact OE2-OH 2.86Å
66	K	84.9	Confident	93.1	Very high	96 Å²	96	44.6 Å²	44.6	42%	0.417	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-62	-37.9	-174.7	-67.1	-175.4	-179.1	179.8	0	112.8	F21 D48 V64 S68 S69	F21-K66 HydrophobicContact CE1-CG 4.37Å; D48-K66 WeakPolarHBondContact OD1-CE 3.23Å; D48-K66 IonicContact OD1-NZ 3.14Å; D48-K66 PolarHBondContact OD1-NZ 3.38Å; D48-K66 IonicContact OD2-NZ 2.76Å; D48-K66 PolarHBondContact OD2-NZ 2.98Å; V64-K66 HydrophobicContact CG1-CG 3.99Å; K66-S68 VanDerWaalsContact C-N 3.25Å; K66-S68 PolarHBondContact O-N 3.23Å; K66-S69 PolarHBondContact O-N 3.44Å; K66-S69 VanDerWaalsContact O-N 3.08Å
67	S	85.3	Confident	93.1	Very high	111 Å²	111	52 Å²	52	78%	0.776	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-59.4	-36.6	-179.6	53.2	0	0	0	0	112.5	E65	E65-S67 VanDerWaalsContact C-N 3.32Å; E65-S67 PolarHBondContact O-N 2.88Å
68	S	87.6	Confident	93.3	Very high	31 Å²	31	46.1 Å²	46.1	22%	0.217	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-96.8	-3	177.9	72.6	0	0	0	0	113	K15 E65 K66 T70	K15-S68 WeakPolarHBondContact CE-O 2.92Å; E65-S68 VanDerWaalsContact CG-OG 3.3Å; E65-S68 WeakPolarHBondContact CG-OG 3.34Å; E65-S68 PolarHBondContact O-N 2.91Å; E65-S68 PolarHBondContact O-OG 3.34Å; E65-S68 PolarHBondContact OE2-OG 3.35Å; K66-S68 VanDerWaalsContact C-N 3.25Å; K66-S68 PolarHBondContact O-N 3.23Å; S68-T70 PolarHBondContact O-N 3.1Å; S68-T70 PolarHBondContact O-OG1 3.23Å; S68-T70 VanDerWaalsContact OG-CB 3.26Å; S68-T70 WeakPolarHBondContact OG-CB 3.45Å; S68-T70 PolarHBondContact OG-OG1 2.76Å
69	S	88	Confident	93.5	Very high	37 Å²	37	46.4 Å²	46.4	26%	0.259	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	40	-172.6	-62.3	0	0	0	0	112.4	A16 F21 E65 K66	A16-S69 PolarHBondContact N-O 2.99Å; F21-S69 WeakPolarHBondContact CB-OG 3.49Å; F21-S69 WeakPolarHBondContact CD2-O 3.16Å; F21-S69 WeakPolarHBondContact CE2-O 3.42Å; E65-S69 PolarHBondContact O-N 3.06Å; K66-S69 PolarHBondContact O-N 3.44Å; K66-S69 VanDerWaalsContact O-N 3.08Å
70	T	91.1	Very high	93.4	Very high	9 Å²	9	48 Å²	48	6%	0.055	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	132	-175.8	-50.2	0	0	0	0	110.6	C14 E65 S68 Y72	C14-T70 CarbonylContact O-C 3.59Å; C14-T70 WeakPolarHBondContact O-CA 3.36Å; E65-T70 PolarHBondContact N-O 2.85Å; E65-T70 PolarHBondContact O-N 2.95Å; S68-T70 PolarHBondContact O-N 3.1Å; S68-T70 PolarHBondContact O-OG1 3.23Å; S68-T70 VanDerWaalsContact OG-CB 3.26Å; S68-T70 WeakPolarHBondContact OG-CB 3.45Å; S68-T70 PolarHBondContact OG-OG1 2.76Å; T70-Y72 HydrophobicContact CG2-CD1 4.38Å; T70-Y72 HydrophobicContact CG2-CD2 4.22Å; T70-Y72 HydrophobicContact CG2-CE1 3.86Å; T70-Y72 HydrophobicContact CG2-CE2 3.68Å; T70-Y72 VanDerWaalsContact CG2-CZ 3.47Å
71	V	92.2	Very high	93.2	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.2	169.3	-168.4	0	0	0	0	108.1	S13 C14 F21 I26 F43 V64	S13-V71 CarbonylContact C-O 3.56Å; C14-V71 PolarHBondContact N-O 2.9Å; C14-V71 PolarHBondContact O-N 3.02Å; F21-V71 HydrophobicContact CE2-CG2 3.74Å; F21-V71 HydrophobicContact CZ-CG2 3.79Å; I26-V71 HydrophobicContact CB-CG2 3.88Å; I26-V71 HydrophobicContact CD1-CG2 3.41Å; I26-V71 VanDerWaalsContact CD1-CG2 3.41Å; I26-V71 HydrophobicContact CG1-CG2 4.23Å; I26-V71 HydrophobicContact CG2-CB 4.16Å; I26-V71 HydrophobicContact CG2-CG2 3.81Å; F43-V71 HydrophobicContact CB-CG1 4.33Å; V64-V71 HydrophobicContact CG2-CB 4.47Å; V64-V71 HydrophobicContact CG2-CG2 3.85Å
72	Y	95.5	Very high	93.1	Very high	54 Å²	54	50.5 Å²	50.5	21%	0.212	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.7	177.1	-54.8	-96.4	0	0	0	110.2	K11 M12 S13 L62 T63 E65 T70	K11-Y72 VanDerWaalsContact CE-CB 3.48Å; K11-Y72 HydrophobicContact CG-CD1 4.41Å; M12-Y72 CarbonylContact O-C 3.56Å; M12-Y72 WeakPolarHBondContact O-CA 3.09Å; S13-Y72 VanDerWaalsContact CB-CD1 3.49Å; S13-Y72 VanDerWaalsContact CB-CE1 3.46Å; L62-Y72 WeakPolarHBondContact CA-O 3.35Å; T63-Y72 PolarHBondContact N-O 3.13Å; T63-Y72 PolarHBondContact O-N 2.85Å; T63-Y72 WeakPolarHBondContact OG1-CB 3.36Å; E65-Y72 HydrophobicContact CB-CE2 3.9Å; E65-Y72 PolarHBondContact OE2-OH 2.86Å; T70-Y72 HydrophobicContact CG2-CD1 4.38Å; T70-Y72 HydrophobicContact CG2-CD2 4.22Å; T70-Y72 HydrophobicContact CG2-CE1 3.86Å; T70-Y72 HydrophobicContact CG2-CE2 3.68Å; T70-Y72 VanDerWaalsContact CG2-CZ 3.47Å
73	L	97.4	Very high	93.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	120.5	166.3	167.7	65	0	0	0	108	K11 M12 W28 I40 A60 L62 L75 Y86	K11-L73 WeakPolarHBondContact CA-O 3.44Å; M12-L73 HydrophobicContact CG-CB 3.76Å; M12-L73 HydrophobicContact CG-CD2 4.33Å; M12-L73 HydrophobicContact CG-CG 4.2Å; M12-L73 VanDerWaalsContact CG-O 3.3Å; M12-L73 WeakPolarHBondContact CG-O 3.29Å; M12-L73 PolarHBondContact N-O 2.98Å; M12-L73 PolarHBondContact O-N 2.8Å; M12-L73 HydrophobicContact SD-CB 4.31Å; M12-L73 HydrophobicContact SD-CD2 3.78Å; M12-L73 HydrophobicContact SD-CG 4.28Å; W28-L73 HydrophobicContact CB-CD2 4.22Å; W28-L73 HydrophobicContact CD2-CB 3.63Å; W28-L73 HydrophobicContact CD2-CD2 3.8Å; W28-L73 HydrophobicContact CD2-CG 4.34Å; W28-L73 VanDerWaalsContact CE2-CB 3.49Å; W28-L73 HydrophobicContact CE3-CB 4.1Å; W28-L73 HydrophobicContact CE3-CD2 3.71Å; W28-L73 HydrophobicContact CG-CB 4.03Å; W28-L73 HydrophobicContact CG-CD2 4.05Å; W28-L73 HydrophobicContact CH2-CB 4.3Å; W28-L73 HydrophobicContact CZ2-CB 3.83Å; W28-L73 HydrophobicContact CZ3-CB 4.42Å; W28-L73 HydrophobicContact CZ3-CD2 4.38Å; I40-L73 HydrophobicContact CD1-CD2 3.69Å; I40-L73 HydrophobicContact CG2-CD1 4.23Å; A60-L73 HydrophobicContact CB-CD1 3.7Å; L62-L73 HydrophobicContact CD2-CB 3.95Å; L62-L73 HydrophobicContact CD2-CD1 3.77Å; L62-L73 HydrophobicContact CD2-CG 4.45Å; L73-L75 HydrophobicContact CD1-CD2 4.01Å; L73-L75 HydrophobicContact CD1-CG 4.32Å; L73-L75 HydrophobicContact CD2-CD1 4.44Å; L73-L75 HydrophobicContact CD2-CD2 4.34Å; L73-L75 HydrophobicContact CD2-CG 4.31Å; L73-L75 HydrophobicContact CG-CD2 4.3Å; L73-L75 HydrophobicContact CG-CG 4.14Å; L73-Y86 HydrophobicContact CD2-CD1 4.08Å
74	E	97.9	Very high	93.3	Very high	70 Å²	70	49.2 Å²	49.2	33%	0.327	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125	169	-175.4	175.1	177.1	0	0	109.2	V10 K11 A60 T61	V10-E74 CarbonylContact O-C 3.49Å; V10-E74 WeakPolarHBondContact O-CA 3.27Å; K11-E74 HydrophobicContact CB-CB 4.44Å; K11-E74 HydrophobicContact CB-CG 4.44Å; K11-E74 HydrophobicContact CG-CB 4.35Å; A60-E74 CarbonylContact C-O 3.5Å; A60-E74 WeakPolarHBondContact CA-O 3.31Å; T61-E74 PolarHBondContact N-O 2.84Å; T61-E74 PolarHBondContact O-N 2.79Å
75	L	97.6	Very high	93.7	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	127.1	173.6	-62.4	166.7	0	0	0	108.3	S9 V10 M12 K59 A60 L73 L78 Y86	S9-L75 CarbonylContact C-O 3.52Å; S9-L75 WeakPolarHBondContact CA-O 3.32Å; S9-L75 WeakPolarHBondContact CB-O 3.2Å; V10-L75 HydrophobicContact CG1-CB 4.15Å; V10-L75 HydrophobicContact CG1-CD1 4.28Å; V10-L75 PolarHBondContact N-O 2.95Å; V10-L75 PolarHBondContact O-N 3.06Å; M12-L75 HydrophobicContact CE-CD1 4.16Å; K59-L75 WeakPolarHBondContact O-CA 3.27Å; A60-L75 HydrophobicContact CB-CD2 3.95Å; L73-L75 HydrophobicContact CD1-CD2 4.01Å; L73-L75 HydrophobicContact CD1-CG 4.32Å; L73-L75 HydrophobicContact CD2-CD1 4.44Å; L73-L75 HydrophobicContact CD2-CD2 4.34Å; L73-L75 HydrophobicContact CD2-CG 4.31Å; L73-L75 HydrophobicContact CG-CD2 4.3Å; L73-L75 HydrophobicContact CG-CG 4.14Å; L75-L78 HydrophobicContact CB-CD2 3.71Å; L75-L78 HydrophobicContact CD1-CD2 4.32Å; L75-Y86 HydrophobicContact CD1-CD1 3.98Å; L75-Y86 HydrophobicContact CD1-CE1 3.35Å; L75-Y86 HydrophobicContact CD1-CE2 4.09Å
76	S	97.3	Very high	94	Very high	27 Å²	27	44.4 Å²	44.4	19%	0.189	24%	0.243	C	C	.	.			trans	-107.7	155.7	-179	62.7	0	0	0	0	112.2	S9 K59 L78	S9-S76 WeakPolarHBondContact OG-CA 3.49Å; K59-S76 WeakPolarHBondContact CG-O 3.24Å; K59-S76 PolarHBondContact O-N 2.95Å; K59-S76 PolarHBondContact O-OG 2.86Å; S76-L78 PolarHBondContact O-N 3.06Å
77	R	96.4	Very high	94.6	Very high	168 Å²	168	42.1 Å²	42.1	63%	0.634	23%	0.232	S	C	*	.	S	Bend	trans	53.8	51.8	173.4	-58.8	175.1	-71.9	176.1	-2.1	111.8	A8 G58	A8-R77 PolarHBondContact O-N 2.81Å; G58-R77 PolarHBondContact O-NH2 3.19Å
78	L	96.6	Very high	95.1	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.2	C	C	.	.			trans	-62.8	140.4	-174	-70.3	172	0	0	0	112.1	V4 P6 G7 A8 V10 L75 S76 D82 V104	V4-L78 HydrophobicContact CB-CD1 4.5Å; V4-L78 HydrophobicContact CG2-CD1 3.55Å; P6-L78 CarbonylContact C-O 3.39Å; P6-L78 WeakPolarHBondContact CA-O 3.48Å; G7-L78 PolarHBondContact N-O 2.93Å; A8-L78 WeakPolarHBondContact O-CB 3.03Å; A8-L78 WeakPolarHBondContact O-CG 3.5Å; A8-L78 PolarHBondContact O-N 3.05Å; V10-L78 HydrophobicContact CB-CD1 4.02Å; V10-L78 HydrophobicContact CG1-CD1 3.8Å; L75-L78 HydrophobicContact CB-CD2 3.71Å; L75-L78 HydrophobicContact CD1-CD2 4.32Å; S76-L78 PolarHBondContact O-N 3.06Å; L78-D82 VanDerWaalsContact CA-OD2 3.31Å; L78-D82 WeakPolarHBondContact CA-OD2 3.38Å; L78-D82 HydrophobicContact CD2-CB 3.59Å; L78-V104 HydrophobicContact CB-CG1 4.26Å; L78-V104 HydrophobicContact CB-CG2 3.96Å; L78-V104 HydrophobicContact CD1-CG2 4.39Å
79	T	95.8	Very high	95.3	Very high	59 Å²	59	36.1 Å²	36.1	36%	0.362	19%	0.191	S	C	.	.			trans	-120	169.2	173.7	64.8	0	0	0	0	109.7	D81 D82 V104	T79-D81 PolarHBondContact O-N 2.86Å; T79-D81 VanDerWaalsContact O-N 3.08Å; T79-D82 PolarHBondContact N-OD2 2.91Å; T79-D82 WeakPolarHBondContact O-CB 3.45Å; T79-D82 PolarHBondContact O-N 2.91Å; T79-D82 PolarHBondContact OG1-OD2 3.39Å; T79-V104 WeakPolarHBondContact O-CB 3.4Å; T79-V104 WeakPolarHBondContact O-CG2 3.14Å
80	S	94.4	Very high	95.4	Very high	80 Å²	80	34.5 Å²	34.5	56%	0.559	18%	0.179	S	C	*	.	G	3₁₀ helix	trans	-51.3	-33.9	175.8	52	0	0	0	0	112.9	D82 S83	S80-D82 PolarHBondContact O-N 2.81Å; S80-S83 VanDerWaalsContact O-CB 3.29Å; S80-S83 WeakPolarHBondContact O-CB 3.41Å; S80-S83 PolarHBondContact O-N 3.22Å; S80-S83 PolarHBondContact O-OG 2.92Å
81	D	92.8	Very high	95.2	Very high	117 Å²	117	35.1 Å²	35.1	63%	0.626	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-69.1	-12.7	-179.4	-61.3	-19.5	0	0	0	113.7	K30 T79 S83	K30-D81 PolarHBondContact NZ-O 2.95Å; T79-D81 PolarHBondContact O-N 2.86Å; T79-D81 VanDerWaalsContact O-N 3.08Å; D81-S83 VanDerWaalsContact C-N 3.31Å
82	D	95.1	Very high	94.8	Very high	5 Å²	5	44.8 Å²	44.8	3%	0.027	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-85.7	-3.7	172.4	-56.9	-50.3	0	0	0	113.4	K30 K59 L78 T79 S80 A84 Y86 V104	K30-D82 IonicContact NZ-OD1 3.59Å; K59-D82 VanDerWaalsContact CE-CG 3.5Å; K59-D82 VanDerWaalsContact CE-OD1 3.32Å; K59-D82 WeakPolarHBondContact CE-OD1 3.3Å; K59-D82 WeakPolarHBondContact CE-OD2 3.26Å; K59-D82 IonicContact NZ-OD1 2.75Å; K59-D82 PolarHBondContact NZ-OD1 2.81Å; K59-D82 IonicContact NZ-OD2 3.95Å; K59-D82 PolarHBondContact NZ-OD2 3.37Å; L78-D82 VanDerWaalsContact CA-OD2 3.31Å; L78-D82 WeakPolarHBondContact CA-OD2 3.38Å; L78-D82 HydrophobicContact CD2-CB 3.59Å; T79-D82 PolarHBondContact N-OD2 2.91Å; T79-D82 WeakPolarHBondContact O-CB 3.45Å; T79-D82 PolarHBondContact O-N 2.91Å; T79-D82 PolarHBondContact OG1-OD2 3.39Å; S80-D82 PolarHBondContact O-N 2.81Å; D82-A84 PolarHBondContact O-N 2.84Å; D82-Y86 WeakPolarHBondContact O-CE2 3.43Å; D82-Y86 PolarHBondContact O-OH 3.14Å; D82-V104 HydrophobicContact CB-CG2 4.23Å
83	S	96.4	Very high	94.4	Very high	39 Å²	39	46.3 Å²	46.3	27%	0.273	23%	0.228	S	C	.	.			trans	-65.4	109	172.7	-56.6	0	0	0	0	109.9	S80 D81 V102 V104	S80-S83 VanDerWaalsContact O-CB 3.29Å; S80-S83 WeakPolarHBondContact O-CB 3.41Å; S80-S83 PolarHBondContact O-N 3.22Å; S80-S83 PolarHBondContact O-OG 2.92Å; D81-S83 VanDerWaalsContact C-N 3.31Å; S83-V102 CarbonylContact C-O 3.59Å; S83-V102 VanDerWaalsContact CA-O 3.28Å; S83-V102 WeakPolarHBondContact CA-O 3.18Å; S83-V104 PolarHBondContact OG-N 2.75Å
84	A	97.3	Very high	94	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	168.1	-170.7	0	0	0	0	0	110.5	K30 Q31 D82 Y86 V102	K30-A84 HydrophobicContact CD-CB 4.23Å; K30-A84 HydrophobicContact CG-CB 3.62Å; Q31-A84 WeakPolarHBondContact O-CA 3.34Å; Q31-A84 VanDerWaalsContact O-CB 3.27Å; Q31-A84 WeakPolarHBondContact O-CB 3.46Å; D82-A84 PolarHBondContact O-N 2.84Å; A84-Y86 HydrophobicContact CB-CD2 4.34Å; A84-Y86 HydrophobicContact CB-CE2 3.79Å; A84-V102 PolarHBondContact N-O 3.16Å; A84-V102 PolarHBondContact O-N 2.67Å
85	V	97.6	Very high	93.5	Very high	28 Å²	28	53 Å²	53	17%	0.17	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128	164.2	-170.5	0	0	0	0	108.6	Q31 Y87 L101	Q31-V85 PolarHBondContact N-O 3.09Å; Q31-V85 PolarHBondContact O-N 3.29Å; V85-Y87 HydrophobicContact CB-CE2 3.72Å; V85-Y87 HydrophobicContact CG1-CD1 4.43Å; V85-Y87 HydrophobicContact CG1-CD2 4.2Å; V85-Y87 HydrophobicContact CG1-CE1 3.78Å; V85-Y87 HydrophobicContact CG1-CE2 3.52Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.41Å; V85-L101 HydrophobicContact CG2-CB 4.45Å; V85-L101 HydrophobicContact CG2-CD1 4.02Å
86	Y	97.7	Very high	93.3	Very high	1 Å²	1	58.4 Å²	58.4	0%	0.004	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123.2	179.4	-68.9	-96.4	0	0	0	109.8	M12 M29 K30 I40 L73 L75 D82 A84 G99 T100 V102	M12-Y86 HydrophobicContact CE-CD1 4.24Å; M12-Y86 HydrophobicContact CE-CD2 3.87Å; M12-Y86 HydrophobicContact CE-CG 3.67Å; M12-Y86 WeakPolarHBondContact SD-CB 3.39Å; M12-Y86 HydrophobicContact SD-CD1 4.31Å; M12-Y86 HydrophobicContact SD-CG 3.89Å; M29-Y86 CarbonylContact O-C 3.57Å; M29-Y86 WeakPolarHBondContact O-CA 3.34Å; K30-Y86 HydrophobicContact CB-CD1 4.24Å; K30-Y86 HydrophobicContact CB-CE1 4.01Å; K30-Y86 HydrophobicContact CD-CE1 3.97Å; K30-Y86 VanDerWaalsContact CE-OH 3.32Å; K30-Y86 WeakPolarHBondContact CE-OH 3.42Å; K30-Y86 HydrophobicContact CG-CD1 4.26Å; K30-Y86 HydrophobicContact CG-CE1 3.71Å; I40-Y86 HydrophobicContact CD1-CD1 3.61Å; I40-Y86 HydrophobicContact CD1-CE1 3.77Å; L73-Y86 HydrophobicContact CD2-CD1 4.08Å; L75-Y86 HydrophobicContact CD1-CD1 3.98Å; L75-Y86 HydrophobicContact CD1-CE1 3.35Å; L75-Y86 HydrophobicContact CD1-CE2 4.09Å; D82-Y86 WeakPolarHBondContact O-CE2 3.43Å; D82-Y86 PolarHBondContact O-OH 3.14Å; A84-Y86 HydrophobicContact CB-CD2 4.34Å; A84-Y86 HydrophobicContact CB-CE2 3.79Å; Y86-G99 CarbonylContact O-C 3.58Å; Y86-G99 VanDerWaalsContact O-CA 3.25Å; Y86-G99 WeakPolarHBondContact O-CA 3.41Å; Y86-T100 PolarHBondContact N-O 3.16Å; Y86-T100 PolarHBondContact O-N 3.41Å; Y86-V102 HydrophobicContact CD2-CB 4.03Å; Y86-V102 HydrophobicContact CD2-CG2 3.69Å; Y86-V102 HydrophobicContact CE2-CB 3.86Å; Y86-V102 HydrophobicContact CE2-CG2 3.93Å
87	Y	96.8	Very high	93.1	Very high	47 Å²	47	58.5 Å²	58.5	18%	0.184	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	147.9	-178.9	-57.5	-89.4	0	0	0	110.1	W28 M29 Q31 L37 V85 W96	W28-Y87 WeakPolarHBondContact CA-O 3.33Å; W28-Y87 VanDerWaalsContact CE3-O 3.27Å; M29-Y87 PolarHBondContact N-O 3.06Å; M29-Y87 PolarHBondContact O-N 3.07Å; Q31-Y87 HydrophobicContact CB-CD2 4.33Å; Q31-Y87 HydrophobicContact CB-CE2 3.74Å; Q31-Y87 VanDerWaalsContact OE1-CE2 3.3Å; Q31-Y87 PolarHBondContact OE1-OH 2.84Å; L37-Y87 HydrophobicContact CD2-CD2 4.02Å; L37-Y87 HydrophobicContact CD2-CE2 4.33Å; V85-Y87 HydrophobicContact CB-CE2 3.72Å; V85-Y87 HydrophobicContact CG1-CD1 4.43Å; V85-Y87 HydrophobicContact CG1-CD2 4.2Å; V85-Y87 HydrophobicContact CG1-CE1 3.78Å; V85-Y87 HydrophobicContact CG1-CE2 3.52Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.41Å; Y87-W96 HydrophobicContact CG-CE3 4.26Å; Y87-W96 HydrophobicContact CG-CZ3 4.42Å
88	C	94.8	Very high	92.9	Very high	14 Å²	14	60 Å²	60	10%	0.095	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	149.7	157.6	64.5	0	0	0	0	110	C14 I26 E27 W28 G97	C14-C88 HydrophobicContact CB-CB 3.41Å; C14-C88 VanDerWaalsContact CB-CB 3.41Å; C14-C88 WeakPolarHBondContact CB-SG 3.45Å; C14-C88 WeakPolarHBondContact SG-CB 3.41Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 3.21Å; I26-C88 HydrophobicContact CG2-CB 4.46Å; E27-C88 CarbonylContact O-C 3.53Å; E27-C88 WeakPolarHBondContact O-CA 3.2Å; W28-C88 HydrophobicContact CD2-CB 4.24Å; W28-C88 HydrophobicContact CE3-CB 4.22Å; W28-C88 HydrophobicContact CH2-CB 4.25Å; W28-C88 HydrophobicContact CZ2-CB 4.27Å; W28-C88 HydrophobicContact CZ3-CB 4.21Å; C88-G97 PolarHBondContact O-N 3.07Å
89	A	93.3	Very high	92.9	Very high	3 Å²	3	61.3 Å²	61.3	3%	0.025	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	157.5	175.3	0	0	0	0	0	110.9	I26 E27 F93 Y95 W96	I26-A89 WeakPolarHBondContact CA-O 3.46Å; E27-A89 HydrophobicContact CB-CB 4.39Å; E27-A89 PolarHBondContact N-O 3.01Å; E27-A89 PolarHBondContact O-N 3.13Å; A89-F93 HydrophobicContact CB-CD1 3.68Å; A89-F93 HydrophobicContact CB-CE1 4.3Å; A89-Y95 CarbonylContact C-O 3.56Å; A89-Y95 WeakPolarHBondContact CA-O 3.49Å; A89-Y95 WeakPolarHBondContact CB-O 2.99Å; A89-W96 HydrophobicContact CB-CD2 3.81Å; A89-W96 HydrophobicContact CB-CE3 3.89Å; A89-W96 HydrophobicContact CB-CG 4.36Å; A89-W96 HydrophobicContact CB-CH2 4.21Å; A89-W96 HydrophobicContact CB-CZ2 4.16Å; A89-W96 HydrophobicContact CB-CZ3 4.09Å
90	S	89.9	Confident	92.9	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.021	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	177.4	176.1	-164.2	0	0	0	0	111.5	Y19 P25 F93 A94 Y95	Y19-S90 WeakPolarHBondContact OH-CB 3.28Å; Y19-S90 PolarHBondContact OH-OG 3.41Å; Y19-S90 VanDerWaalsContact OH-OG 3.13Å; P25-S90 PolarHBondContact O-OG 2.81Å; S90-F93 PolarHBondContact O-N 3.45Å; S90-A94 PolarHBondContact O-N 3.32Å; S90-Y95 PolarHBondContact N-O 3.31Å; S90-Y95 PolarHBondContact O-N 3.38Å
91	S	85.4	Confident	93	Very high	21 Å²	21	59.6 Å²	59.6	15%	0.147	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	61.2	-176.6	-159.1	0	0	0	0	111.8	F93 A94	S91-F93 PolarHBondContact O-N 3.32Å; S91-A94 WeakPolarHBondContact O-CB 3.4Å; S91-A94 PolarHBondContact O-N 3.08Å
92	W	84	Confident	93.2	Very high	204 Å²	204	54 Å²	54	77%	0.773	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	40.2	-178.6	-51.4	106.4	0	0	0	113.7	Y24 A94	Y24-W92 AromaticContact CE1-NE1 3.95Å; W92-A94 PolarHBondContact O-N 3.02Å
93	F	88.8	Confident	93.3	Very high	85 Å²	85	56.3 Å²	56.3	37%	0.373	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	18.7	-177	-50.1	-83.7	0	0	0	114.9	E27 M29 A89 S90 S91 Y95 W96	E27-F93 HydrophobicContact CB-CE1 3.79Å; E27-F93 HydrophobicContact CB-CZ 4.25Å; E27-F93 HydrophobicContact CG-CE1 3.77Å; E27-F93 HydrophobicContact CG-CZ 3.8Å; M29-F93 HydrophobicContact CG-CE1 4.36Å; M29-F93 HydrophobicContact SD-CE1 3.85Å; A89-F93 HydrophobicContact CB-CD1 3.68Å; A89-F93 HydrophobicContact CB-CE1 4.3Å; S90-F93 PolarHBondContact O-N 3.45Å; S91-F93 PolarHBondContact O-N 3.32Å; F93-Y95 VanDerWaalsContact C-N 3.32Å; F93-W96 HydrophobicContact CB-CZ2 3.88Å; F93-W96 AromaticContact CD1-CH2 3.94Å; F93-W96 HydrophobicContact CD1-CH2 3.94Å; F93-W96 AromaticContact CD1-CZ2 3.61Å; F93-W96 HydrophobicContact CD1-CZ2 3.61Å; F93-W96 HydrophobicContact CG-CZ2 4.15Å; F93-W96 PolarHBondContact O-NE1 3.2Å
94	A	88.4	Confident	93.4	Very high	70 Å²	70	55 Å²	55	58%	0.579	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-29.2	171.9	0	0	0	0	0	112.3	S90 S91 W92	S90-A94 PolarHBondContact O-N 3.32Å; S91-A94 WeakPolarHBondContact O-CB 3.4Å; S91-A94 PolarHBondContact O-N 3.08Å; W92-A94 PolarHBondContact O-N 3.02Å
95	Y	87.6	Confident	93.2	Very high	142 Å²	142	57.4 Å²	57.4	56%	0.557	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	135.6	179	-57.2	-74.4	0	0	0	111.1	A89 S90 F93	A89-Y95 CarbonylContact C-O 3.56Å; A89-Y95 WeakPolarHBondContact CA-O 3.49Å; A89-Y95 WeakPolarHBondContact CB-O 2.99Å; S90-Y95 PolarHBondContact N-O 3.31Å; S90-Y95 PolarHBondContact O-N 3.38Å; F93-Y95 VanDerWaalsContact C-N 3.32Å
96	W	92.5	Very high	92.6	Very high	113 Å²	113	62.7 Å²	62.7	43%	0.428	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.4	-179.8	-69.5	78.6	0	0	0	110.5	M29 L37 Y87 A89 F93	M29-W96 HydrophobicContact CB-CZ3 4.11Å; M29-W96 HydrophobicContact CG-CH2 3.84Å; M29-W96 HydrophobicContact CG-CZ3 3.76Å; L37-W96 HydrophobicContact CD1-CH2 3.84Å; L37-W96 HydrophobicContact CD1-CZ3 4.23Å; L37-W96 HydrophobicContact CD2-CZ3 4.38Å; Y87-W96 HydrophobicContact CG-CE3 4.26Å; Y87-W96 HydrophobicContact CG-CZ3 4.42Å; A89-W96 HydrophobicContact CB-CD2 3.81Å; A89-W96 HydrophobicContact CB-CE3 3.89Å; A89-W96 HydrophobicContact CB-CG 4.36Å; A89-W96 HydrophobicContact CB-CH2 4.21Å; A89-W96 HydrophobicContact CB-CZ2 4.16Å; A89-W96 HydrophobicContact CB-CZ3 4.09Å; F93-W96 HydrophobicContact CB-CZ2 3.88Å; F93-W96 AromaticContact CD1-CH2 3.94Å; F93-W96 HydrophobicContact CD1-CH2 3.94Å; F93-W96 AromaticContact CD1-CZ2 3.61Å; F93-W96 HydrophobicContact CD1-CZ2 3.61Å; F93-W96 HydrophobicContact CG-CZ2 4.15Å; F93-W96 PolarHBondContact O-NE1 3.2Å
97	G	92.6	Very high	92.3	Very high	28 Å²	28	65.8 Å²	65.8	29%	0.289	36%	0.358	S	S	.	.			trans	-69.7	162.1	164.8	0	0	0	0	0	111.2	C88 G99	C88-G97 PolarHBondContact O-N 3.07Å; G97-G99 PolarHBondContact O-N 3.43Å; G97-G99 VanDerWaalsContact O-N 3.09Å
98	Q	93.7	Very high	92.1	Very high	200 Å²	200	66.7 Å²	66.7	94%	0.935	37%	0.367	S	S	*	.			trans	-62.5	-17.6	178.4	-68.5	-176.6	-26.1	0	0	113.7
99	G	95.3	Very high	91.9	Very high	28 Å²	28	69.7 Å²	69.7	29%	0.289	38%	0.382	S	S	.	.			trans	85.9	148.7	-176.3	0	0	0	0	0	112.5	Y86 G97	Y86-G99 CarbonylContact O-C 3.58Å; Y86-G99 VanDerWaalsContact O-CA 3.25Å; Y86-G99 WeakPolarHBondContact O-CA 3.41Å; G97-G99 PolarHBondContact O-N 3.43Å; G97-G99 VanDerWaalsContact O-N 3.09Å
100	T	97.1	Very high	91.8	Very high	37 Å²	37	73.6 Å²	73.6	23%	0.227	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	113.6	174.4	-60.7	0	0	0	0	108.6	E2 Y86 V102	E2-T100 HydrophobicContact CG-CG2 4.16Å; Y86-T100 PolarHBondContact N-O 3.16Å; Y86-T100 PolarHBondContact O-N 3.41Å; T100-V102 HydrophobicContact CG2-CG2 4.39Å; T100-V102 PolarHBondContact O-N 3.31Å
101	L	97	Very high	91.9	Very high	67 Å²	67	78 Å²	78	35%	0.351	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	121.9	168.5	176.3	64.4	0	0	0	108.9	A1 E2 V85	A1-L101 CarbonylContact C-O 3.48Å; A1-L101 WeakPolarHBondContact CA-O 3.38Å; A1-L101 HydrophobicContact CB-CB 4.02Å; E2-L101 PolarHBondContact N-O 3.13Å; V85-L101 HydrophobicContact CG2-CB 4.45Å; V85-L101 HydrophobicContact CG2-CD1 4.02Å
102	V	97.1	Very high	92.4	Very high	0 Å²	0	81.8 Å²	81.8	0%	0	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.2	168.1	179.1	0	0	0	0	107.4	E2 V4 V10 M12 S83 A84 Y86 T100 V104	E2-V102 HydrophobicContact CB-CG2 4.34Å; E2-V102 CarbonylContact O-C 3.57Å; E2-V102 WeakPolarHBondContact O-CA 3.42Å; V4-V102 HydrophobicContact CG2-CG1 4.21Å; V10-V102 HydrophobicContact CG1-CG1 4.35Å; V10-V102 HydrophobicContact CG1-CG2 4.34Å; M12-V102 HydrophobicContact CE-CG2 3.58Å; S83-V102 CarbonylContact C-O 3.59Å; S83-V102 VanDerWaalsContact CA-O 3.28Å; S83-V102 WeakPolarHBondContact CA-O 3.18Å; A84-V102 PolarHBondContact N-O 3.16Å; A84-V102 PolarHBondContact O-N 2.67Å; Y86-V102 HydrophobicContact CD2-CB 4.03Å; Y86-V102 HydrophobicContact CD2-CG2 3.69Å; Y86-V102 HydrophobicContact CE2-CB 3.86Å; Y86-V102 HydrophobicContact CE2-CG2 3.93Å; T100-V102 HydrophobicContact CG2-CG2 4.39Å; T100-V102 PolarHBondContact O-N 3.31Å; V102-V104 HydrophobicContact CG1-CG2 4.34Å
103	T	97.1	Very high	93	Very high	53 Å²	53	73.1 Å²	73.1	33%	0.325	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124.4	175.7	-59.4	0	0	0	0	108.9	E2 L3 V4	E2-T103 PolarHBondContact O-N 3.05Å; L3-T103 HydrophobicContact CD1-CG2 3.82Å; V4-T103 PolarHBondContact N-O 3.28Å
104	V	96.6	Very high	93.3	Very high	10 Å²	10	72.2 Å²	72.2	6%	0.061	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	107	179.3	-170.8	0	0	0	0	108.5	V4 P6 L78 T79 D82 S83 V102	V4-V104 HydrophobicContact CG2-CB 4.45Å; V4-V104 HydrophobicContact CG2-CG2 3.87Å; V4-V104 WeakPolarHBondContact O-CA 2.84Å; P6-V104 HydrophobicContact CB-CG1 4.42Å; P6-V104 HydrophobicContact CG-CG1 4.14Å; L78-V104 HydrophobicContact CB-CG1 4.26Å; L78-V104 HydrophobicContact CB-CG2 3.96Å; L78-V104 HydrophobicContact CD1-CG2 4.39Å; T79-V104 WeakPolarHBondContact O-CB 3.4Å; T79-V104 WeakPolarHBondContact O-CG2 3.14Å; D82-V104 HydrophobicContact CB-CG2 4.23Å; S83-V104 PolarHBondContact OG-N 2.75Å; V102-V104 HydrophobicContact CG1-CG2 4.34Å
105	S	94.3	Very high	93.7	Very high	52 Å²	52	72.3 Å²	72.3	36%	0.364	41%	0.414	S	S	.	.			trans	-139.2	150.6	-178.7	68	0	0	0	0	111.8	L3 V4 P6	L3-S105 WeakPolarHBondContact CD1-OG 3.28Å; V4-S105 PolarHBondContact O-N 2.64Å; P6-S105 WeakPolarHBondContact CD-O 3.3Å
106	A	83.8	Confident	94.3	Very high	138 Å²	138	66 Å²	66	100%	1.141	40%	0.401	S	S	*	.			trans	-71.6	0	176.6	0	0	0	0	0	112.2

Retrieved 106 of 106 residues in 30.3 ms (Link to these results)

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