X5J4D6_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4D6, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 108 aa.

						>X5J4D6_MOUSE|X5J4D6
TELVKPGASVKLSCKASGYTFTSNWMHWVKQRPGQGLEWIGNINPSNGSTNYNEKFKSKATLTVDKSSSTAYMQLSSLTSEDSAVYYCARNDSPYFDYWGQGTTLTVS
					

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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	T	77.1	Confident	93.8	Very high	137 Å²	137	79 Å²	79	84%	0.84	46%	0.455	S	S	*	.				0	134.5	0	-52.7	0	0	0	0	108.8	T104	T1-T104 CarbonylContact C-O 3.43Å; T1-T104 WeakPolarHBondContact CA-O 3.33Å; T1-T104 HydrophobicContact CG2-CG2 3.97Å
2	E	87.1	Confident	94.1	Very high	71 Å²	71	72.9 Å²	72.9	33%	0.332	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124.6	-179.6	-166.1	166.9	-174.9	0	0	109	V4 V10 T104 L105 T106	E2-V4 HydrophobicContact CG-CG1 4.05Å; E2-V10 HydrophobicContact CG-CG2 4.32Å; E2-V10 WeakPolarHBondContact OE1-CG2 3.45Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.45Å; E2-T104 PolarHBondContact N-O 2.94Å; E2-L105 HydrophobicContact CB-CD1 4.01Å; E2-L105 HydrophobicContact CG-CD1 4.28Å; E2-L105 WeakPolarHBondContact O-CA 3.4Å; E2-T106 PolarHBondContact O-N 3.26Å
3	L	94.6	Very high	94.3	Very high	122 Å²	122	73 Å²	73	64%	0.639	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	121.3	-179.9	-178.3	65.5	0	0	0	108.5	T106 S108	L3-T106 WeakPolarHBondContact CA-O 3.28Å; L3-T106 HydrophobicContact CD1-CG2 3.75Å; L3-S108 WeakPolarHBondContact CD1-OG 3.49Å
4	V	95.8	Very high	94.4	Very high	20 Å²	20	68.8 Å²	68.8	12%	0.121	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	155.1	-175.6	-60.3	0	0	0	0	111	E2 A8 L78 L105 T106 V107 S108	E2-V4 HydrophobicContact CG-CG1 4.05Å; V4-A8 HydrophobicContact CB-CB 4.34Å; V4-L78 HydrophobicContact CG2-CD1 3.53Å; V4-L105 HydrophobicContact CG1-CD1 4.24Å; V4-L105 HydrophobicContact CG2-CD1 3.84Å; V4-T106 PolarHBondContact N-O 3.02Å; V4-V107 HydrophobicContact CG2-CB 4.41Å; V4-V107 HydrophobicContact CG2-CG1 4.42Å; V4-V107 HydrophobicContact CG2-CG2 3.83Å; V4-V107 VanDerWaalsContact O-CA 3.32Å; V4-V107 WeakPolarHBondContact O-CA 3.12Å; V4-S108 PolarHBondContact O-N 2.71Å; V4-S108 VanDerWaalsContact O-N 3.15Å
5	K	96	Very high	94.5	Very high	162 Å²	162	74.5 Å²	74.5	70%	0.704	42%	0.421	S	S	*	.			trans	-80.7	151.9	176.7	-64	-177.8	-179.2	-179.1	0	110.8	A8	K5-A8 WeakPolarHBondContact O-CB 3.28Å; K5-A8 PolarHBondContact O-N 3.25Å; K5-A8 VanDerWaalsContact O-N 3.15Å
6	P	97.1	Very high	94.4	Very high	80 Å²	80	70.5 Å²	70.5	52%	0.519	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	141.9	168.1	-25.2	33.9	0	0	0	112.2	A8 L78 V107	P6-A8 PolarHBondContact O-N 2.87Å; P6-L78 CarbonylContact C-O 3.59Å; P6-L78 WeakPolarHBondContact CA-O 3.38Å; P6-V107 HydrophobicContact CB-CG1 4.41Å; P6-V107 HydrophobicContact CG-CG1 4.14Å
7	G	95.9	Very high	94.2	Very high	55 Å²	55	72.2 Å²	72.2	57%	0.567	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-12.2	-175.9	0	0	0	0	0	114.9	L78	G7-L78 PolarHBondContact N-O 2.93Å
8	A	96.6	Very high	93.9	Very high	33 Å²	33	73.2 Å²	73.2	27%	0.273	45%	0.446	S	S	.	.			trans	-68.2	165.8	176.5	0	0	0	0	0	112.1	V4 K5 P6 S77 L78	V4-A8 HydrophobicContact CB-CB 4.34Å; K5-A8 WeakPolarHBondContact O-CB 3.28Å; K5-A8 PolarHBondContact O-N 3.25Å; K5-A8 VanDerWaalsContact O-N 3.15Å; P6-A8 PolarHBondContact O-N 2.87Å; A8-S77 PolarHBondContact O-N 3.05Å; A8-L78 WeakPolarHBondContact O-CB 3.28Å; A8-L78 WeakPolarHBondContact O-CG 3.05Å; A8-L78 PolarHBondContact O-N 2.87Å
9	S	96.9	Very high	93.5	Very high	67 Å²	67	72.5 Å²	72.5	47%	0.469	44%	0.435	S	S	.	.			trans	-116.3	146.7	168.4	-58.6	0	0	0	0	109.7	L75 S76	S9-L75 CarbonylContact C-O 3.5Å; S9-L75 WeakPolarHBondContact CA-O 3.34Å; S9-L75 WeakPolarHBondContact CB-O 3.23Å; S9-S76 WeakPolarHBondContact OG-CA 3.3Å
10	V	96.9	Very high	93.4	Very high	6 Å²	6	73.4 Å²	73.4	4%	0.036	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.7	178.7	69.7	0	0	0	0	110.5	E2 L12 Q74 L75 L78 L105	E2-V10 HydrophobicContact CG-CG2 4.32Å; E2-V10 WeakPolarHBondContact OE1-CG2 3.45Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.45Å; V10-L12 HydrophobicContact CG2-CD2 4.05Å; V10-Q74 CarbonylContact O-C 3.43Å; V10-Q74 VanDerWaalsContact O-CA 3.25Å; V10-Q74 WeakPolarHBondContact O-CA 3.34Å; V10-L75 HydrophobicContact CG1-CB 3.97Å; V10-L75 HydrophobicContact CG1-CD1 4.22Å; V10-L75 PolarHBondContact N-O 2.92Å; V10-L75 PolarHBondContact O-N 2.89Å; V10-L78 HydrophobicContact CB-CD1 4.12Å; V10-L78 HydrophobicContact CG1-CD1 3.8Å; V10-L105 HydrophobicContact CG1-CD1 4.2Å; V10-L105 HydrophobicContact CG1-CD2 3.91Å; V10-L105 HydrophobicContact CG2-CD1 4.34Å
11	K	97.4	Very high	93.3	Very high	116 Å²	116	70.2 Å²	70.2	50%	0.504	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	106.1	175	-172.4	178.7	-177.9	-178.9	0	109.9	Y72	K11-Y72 HydrophobicContact CD-CD1 4.28Å; K11-Y72 VanDerWaalsContact CE-CB 3.48Å; K11-Y72 VanDerWaalsContact CE-CD1 3.44Å; K11-Y72 VanDerWaalsContact CE-CG 3.4Å; K11-Y72 HydrophobicContact CG-CD1 4.24Å
12	L	97.4	Very high	94.1	Very high	6 Å²	6	66.4 Å²	66.4	3%	0.031	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	144.9	174.6	-55.8	-177.2	0	0	0	109.9	V10 W28 Y72 M73 Y86 T103	V10-L12 HydrophobicContact CG2-CD2 4.05Å; L12-W28 HydrophobicContact CB-CH2 4.11Å; L12-W28 HydrophobicContact CB-CZ3 3.98Å; L12-Y72 CarbonylContact O-C 3.51Å; L12-Y72 WeakPolarHBondContact O-CA 3.14Å; L12-M73 HydrophobicContact CD1-CE 3.77Å; L12-M73 PolarHBondContact N-O 3.06Å; L12-M73 PolarHBondContact O-N 2.94Å; L12-Y86 HydrophobicContact CD1-CD1 4.36Å; L12-Y86 HydrophobicContact CD1-CD2 4.15Å; L12-Y86 HydrophobicContact CD1-CG 3.77Å; L12-T103 HydrophobicContact CD2-CG2 3.99Å
13	S	97.1	Very high	94.2	Very high	74 Å²	74	67.1 Å²	67.1	52%	0.517	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	149	178.6	65.7	0	0	0	0	111.3	A71 Y72	S13-A71 CarbonylContact C-O 3.51Å; S13-A71 WeakPolarHBondContact CA-O 3.47Å; S13-Y72 VanDerWaalsContact CB-CD1 3.49Å; S13-Y72 VanDerWaalsContact CB-CE1 3.44Å
14	C	96.3	Very high	94	Very high	14 Å²	14	62.2 Å²	62.2	10%	0.095	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	106.2	173.8	179.4	0	0	0	0	108.9	W28 T70 A71 C88	C14-W28 HydrophobicContact CB-CH2 3.76Å; C14-W28 HydrophobicContact CB-CZ2 3.92Å; C14-T70 WeakPolarHBondContact O-CA 3.37Å; C14-A71 PolarHBondContact N-O 3Å; C14-A71 PolarHBondContact O-N 2.82Å; C14-C88 HydrophobicContact CB-CB 3.43Å; C14-C88 VanDerWaalsContact CB-CB 3.43Å; C14-C88 WeakPolarHBondContact CB-SG 2.89Å; C14-C88 WeakPolarHBondContact SG-CB 3.45Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.6Å
15	K	95.8	Very high	93.8	Very high	155 Å²	155	64.9 Å²	64.9	67%	0.674	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	123.3	-179.7	-173.7	174.4	-177.4	179.6	0	110.1	T70	K15-T70 HydrophobicContact CB-CG2 4.49Å
16	A	92.8	Very high	93.8	Very high	10 Å²	10	57.4 Å²	57.4	8%	0.083	36%	0.361	C	S	.	.			trans	-74.5	145.3	174.3	0	0	0	0	0	111.2	Y19 F21 S69	A16-Y19 HydrophobicContact CB-CE1 3.83Å; A16-Y19 HydrophobicContact CB-CE2 4.09Å; A16-Y19 VanDerWaalsContact CB-CZ 3.45Å; A16-Y19 VanDerWaalsContact CB-OH 3.25Å; A16-Y19 WeakPolarHBondContact CB-OH 3.4Å; A16-F21 HydrophobicContact CB-CB 4.01Å; A16-F21 HydrophobicContact CB-CD2 3.39Å; A16-F21 HydrophobicContact CB-CE2 4.11Å; A16-F21 HydrophobicContact CB-CG 3.95Å; A16-S69 WeakPolarHBondContact CB-O 3.25Å; A16-S69 PolarHBondContact N-O 2.02Å
17	S	90.6	Very high	93.8	Very high	100 Å²	100	54.2 Å²	54.2	70%	0.699	34%	0.339	S	S	*	.			trans	-148.2	144.8	174	62.8	0	0	0	0	110.2	Y19	S17-Y19 WeakPolarHBondContact O-CD1 3.24Å; S17-Y19 PolarHBondContact O-N 3.07Å
18	G	88.5	Confident	93.8	Very high	90 Å²	90	51.8 Å²	51.8	93%	0.928	31%	0.313	S	S	*	.	S	Bend	trans	77.9	12.3	176	0	0	0	0	0	116.1
19	Y	86.7	Confident	93.9	Very high	60 Å²	60	50.4 Å²	50.4	24%	0.235	30%	0.301	C	S	.	.	S	Bend	trans	-157.6	166.1	174.7	64.8	-84.4	0	0	0	112.2	A16 S17 F21 N24 M26 R90	A16-Y19 HydrophobicContact CB-CE1 3.83Å; A16-Y19 HydrophobicContact CB-CE2 4.09Å; A16-Y19 VanDerWaalsContact CB-CZ 3.45Å; A16-Y19 VanDerWaalsContact CB-OH 3.25Å; A16-Y19 WeakPolarHBondContact CB-OH 3.4Å; S17-Y19 WeakPolarHBondContact O-CD1 3.24Å; S17-Y19 PolarHBondContact O-N 3.07Å; Y19-F21 PolarHBondContact O-N 2.93Å; Y19-F21 VanDerWaalsContact O-N 3.1Å; Y19-N24 HydrophobicContact CE2-CB 4.26Å; Y19-M26 WeakPolarHBondContact OH-CE 3.43Å; Y19-R90 HydrophobicContact CE2-CG 4.05Å; Y19-R90 VanDerWaalsContact CG-NH1 3.32Å; Y19-R90 VanDerWaalsContact CZ-CD 3.42Å
20	T	91.2	Very high	93.9	Very high	89 Å²	89	47.2 Å²	47.2	55%	0.546	28%	0.278	S	S	.	.			trans	-70.8	102.1	172.7	-54.4	0	0	0	0	110.3	T22 S23 N24	T20-T22 VanDerWaalsContact C-N 3.25Å; T20-T22 PolarHBondContact O-N 2.8Å; T20-S23 VanDerWaalsContact CG2-OG 3.32Å; T20-S23 WeakPolarHBondContact CG2-OG 3.32Å; T20-S23 PolarHBondContact O-N 3.41Å; T20-N24 PolarHBondContact O-ND2 2.93Å
21	F	92.3	Very high	93.9	Very high	7 Å²	7	50 Å²	50	3%	0.031	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-54.7	-38.8	-174.9	177.3	-126	0	0	0	113.4	A16 Y19 S23 M26 P45 V64 S69 A71	A16-F21 HydrophobicContact CB-CB 4.01Å; A16-F21 HydrophobicContact CB-CD2 3.39Å; A16-F21 HydrophobicContact CB-CE2 4.11Å; A16-F21 HydrophobicContact CB-CG 3.95Å; Y19-F21 PolarHBondContact O-N 2.93Å; Y19-F21 VanDerWaalsContact O-N 3.1Å; F21-S23 VanDerWaalsContact C-N 3.27Å; F21-S23 PolarHBondContact O-N 3.22Å; F21-M26 HydrophobicContact CE2-CE 3.96Å; F21-P45 HydrophobicContact CD1-CB 3.8Å; F21-P45 HydrophobicContact CD1-CG 4.41Å; F21-P45 HydrophobicContact CD2-CB 4.37Å; F21-P45 HydrophobicContact CD2-CG 4.11Å; F21-P45 HydrophobicContact CE1-CB 3.51Å; F21-P45 HydrophobicContact CE1-CG 4.06Å; F21-P45 HydrophobicContact CE2-CB 4.11Å; F21-P45 HydrophobicContact CE2-CG 3.71Å; F21-P45 HydrophobicContact CG-CB 4.25Å; F21-P45 HydrophobicContact CG-CG 4.46Å; F21-P45 HydrophobicContact CZ-CB 3.68Å; F21-P45 HydrophobicContact CZ-CG 3.69Å; F21-P45 WeakPolarHBondContact O-CG 3.44Å; F21-V64 HydrophobicContact CE1-CB 4.39Å; F21-V64 HydrophobicContact CE1-CG1 4.41Å; F21-V64 HydrophobicContact CZ-CB 4.48Å; F21-V64 HydrophobicContact CZ-CG1 4.07Å; F21-S69 VanDerWaalsContact CD1-CA 3.48Å; F21-A71 HydrophobicContact CE2-CB 4.36Å; F21-A71 HydrophobicContact CZ-CB 4.04Å
22	T	93.3	Very high	93.8	Very high	57 Å²	57	47.2 Å²	47.2	35%	0.35	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-73.5	-12.6	-178.4	51	0	0	0	0	114.6	T20 S46	T20-T22 VanDerWaalsContact C-N 3.25Å; T20-T22 PolarHBondContact O-N 2.8Å; T22-S46 WeakPolarHBondContact O-CB 3.37Å
23	S	90.3	Very high	93.5	Very high	87 Å²	87	52.6 Å²	52.6	61%	0.608	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-86.5	-6.8	-179.1	-59	0	0	0	0	113.8	T20 F21	T20-S23 VanDerWaalsContact CG2-OG 3.32Å; T20-S23 WeakPolarHBondContact CG2-OG 3.32Å; T20-S23 PolarHBondContact O-N 3.41Å; F21-S23 VanDerWaalsContact C-N 3.27Å; F21-S23 PolarHBondContact O-N 3.22Å
24	N	88.8	Confident	93.2	Very high	18 Å²	18	53.5 Å²	53.5	10%	0.096	33%	0.333	C	S	.	.	S	Bend	trans	-132.8	144.4	-170.3	-65.2	-95	0	0	0	111.3	Y19 T20 P45 R90 N91	Y19-N24 HydrophobicContact CE2-CB 4.26Å; T20-N24 PolarHBondContact O-ND2 2.93Å; N24-P45 WeakPolarHBondContact O-CD 3.41Å; N24-P45 WeakPolarHBondContact O-CG 3.19Å; N24-R90 HydrophobicContact CB-CG 3.64Å; N24-N91 PolarHBondContact OD1-O 3.1Å
25	W	93.1	Very high	93	Very high	77 Å²	77	57.5 Å²	57.5	29%	0.292	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	140.2	170.5	-71.9	76.8	0	0	0	110.5	N42 I43 N44 N51 N91	W25-N42 HydrophobicContact CE3-CB 3.98Å; W25-N42 WeakPolarHBondContact CZ3-OD1 3.4Å; W25-I43 VanDerWaalsContact CE3-C 3.5Å; W25-N44 HydrophobicContact CD2-CB 3.82Å; W25-N44 HydrophobicContact CE3-CB 3.8Å; W25-N44 HydrophobicContact CH2-CB 3.75Å; W25-N44 HydrophobicContact CZ2-CB 3.75Å; W25-N44 HydrophobicContact CZ3-CB 3.76Å; W25-N51 WeakPolarHBondContact CH2-ND2 3.47Å; W25-N51 VanDerWaalsContact CZ3-ND2 3.28Å; W25-N51 WeakPolarHBondContact CZ3-ND2 3.01Å; W25-N91 PolarHBondContact O-N 3.38Å
26	M	95.2	Very high	92.9	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.02	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	119.2	170.5	-173.5	62.2	69.3	0	0	109.4	Y19 F21 N42 I43 A71 C88	Y19-M26 WeakPolarHBondContact OH-CE 3.43Å; F21-M26 HydrophobicContact CE2-CE 3.96Å; M26-N42 CarbonylContact O-C 3.55Å; M26-N42 WeakPolarHBondContact O-CA 3.4Å; M26-N42 WeakPolarHBondContact O-CB 3.43Å; M26-I43 HydrophobicContact CB-CG2 4.07Å; M26-I43 PolarHBondContact N-O 2.77Å; M26-I43 PolarHBondContact O-N 2.81Å; M26-A71 HydrophobicContact CB-CB 4.04Å; M26-A71 HydrophobicContact CG-CB 3.6Å; M26-C88 HydrophobicContact CG-CB 4.48Å; M26-C88 HydrophobicContact SD-CB 3.76Å
27	H	96.2	Very high	93	Very high	13 Å²	13	56.9 Å²	56.9	6%	0.06	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	148.9	179.4	-65.1	-115.2	0	0	0	110.7	W39 G41 N42 C88 A89 N91 F96	H27-W39 AromaticContact CG-NE1 3.94Å; H27-W39 AromaticContact ND1-NE1 3.2Å; H27-W39 PolarHBondContact ND1-NE1 2.84Å; H27-G41 WeakPolarHBondContact CA-O 3.01Å; H27-N42 HydrophobicContact CB-CB 4.34Å; H27-N42 PolarHBondContact CE1-ND2 2.93Å; H27-C88 CarbonylContact O-C 3.5Å; H27-C88 WeakPolarHBondContact O-CA 3.31Å; H27-A89 PolarHBondContact N-O 3.49Å; H27-A89 PolarHBondContact O-N 3.49Å; H27-N91 WeakPolarHBondContact NE2-CB 3.33Å; H27-F96 HydrophobicContact CB-CD1 4.44Å; H27-F96 HydrophobicContact CB-CE1 3.65Å; H27-F96 HydrophobicContact CB-CZ 4.26Å; H27-F96 AromaticContact CD2-CE1 3.7Å; H27-F96 AromaticContact CE1-CE1 3.77Å; H27-F96 AromaticContact CG-CE1 3.37Å; H27-F96 AromaticContact ND1-CE1 3.43Å; H27-F96 WeakPolarHBondContact ND1-CE1 3.48Å; H27-F96 AromaticContact ND1-CZ 3.79Å; H27-F96 AromaticContact NE2-CE1 3.97Å
28	W	97.6	Very high	93.3	Very high	5 Å²	5	53.8 Å²	53.8	2%	0.019	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136	174.5	-69.1	92	0	0	0	110.1	L12 C14 I40 G41 L62 A71 M73 Y87 C88	L12-W28 HydrophobicContact CB-CH2 4.11Å; L12-W28 HydrophobicContact CB-CZ3 3.98Å; C14-W28 HydrophobicContact CB-CH2 3.76Å; C14-W28 HydrophobicContact CB-CZ2 3.92Å; W28-I40 HydrophobicContact CB-CB 4.18Å; W28-I40 HydrophobicContact CB-CD1 4.31Å; W28-I40 WeakPolarHBondContact O-CB 3.33Å; W28-I40 PolarHBondContact O-N 2.97Å; W28-G41 PolarHBondContact N-O 2.77Å; W28-L62 HydrophobicContact CG-CD2 4.11Å; W28-A71 HydrophobicContact CZ2-CB 4.34Å; W28-M73 HydrophobicContact CB-SD 3.89Å; W28-M73 HydrophobicContact CD2-CB 3.67Å; W28-M73 HydrophobicContact CD2-CE 4.34Å; W28-M73 HydrophobicContact CD2-CG 4.5Å; W28-M73 HydrophobicContact CD2-SD 4.15Å; W28-M73 HydrophobicContact CE3-CB 3.96Å; W28-M73 HydrophobicContact CE3-CE 3.85Å; W28-M73 HydrophobicContact CE3-SD 4.26Å; W28-M73 HydrophobicContact CG-CB 4.14Å; W28-M73 HydrophobicContact CG-SD 4.01Å; W28-M73 HydrophobicContact CH2-CB 4.17Å; W28-M73 HydrophobicContact CZ2-CB 3.91Å; W28-M73 HydrophobicContact CZ3-CB 4.2Å; W28-M73 HydrophobicContact CZ3-CE 4.38Å; W28-Y87 WeakPolarHBondContact CA-O 3.38Å; W28-C88 HydrophobicContact CD2-CB 4.42Å; W28-C88 HydrophobicContact CE3-CB 4.22Å; W28-C88 HydrophobicContact CH2-CB 4.35Å; W28-C88 HydrophobicContact CZ3-CB 4.19Å
29	V	97.3	Very high	93.6	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.018	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	136.7	-172.9	-177.6	0	0	0	0	109.4	L37 E38 Y86 Y87 W99	V29-L37 HydrophobicContact CG1-CB 3.8Å; V29-L37 HydrophobicContact CG1-CD2 3.95Å; V29-L37 HydrophobicContact CG1-CG 4.35Å; V29-E38 CarbonylContact C-O 3.49Å; V29-E38 WeakPolarHBondContact CA-O 3.37Å; V29-Y86 CarbonylContact O-C 3.58Å; V29-Y86 WeakPolarHBondContact O-CA 3.42Å; V29-Y87 PolarHBondContact N-O 3.33Å; V29-Y87 PolarHBondContact O-N 3.09Å; V29-W99 HydrophobicContact CB-CH2 4.13Å; V29-W99 HydrophobicContact CB-CZ3 3.82Å; V29-W99 HydrophobicContact CG1-CH2 4.07Å; V29-W99 HydrophobicContact CG1-CZ3 4Å; V29-W99 HydrophobicContact CG2-CH2 3.77Å; V29-W99 HydrophobicContact CG2-CZ3 3.85Å
30	K	97.1	Very high	94.2	Very high	1 Å²	1	50.4 Å²	50.4	0%	0.004	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	140.5	175	-176.2	-179.8	-179.1	-178.7	0	109.8	R32 E38 I40 F56 E81 D82 A84 Y86	K30-R32 VanDerWaalsContact NZ-NH2 3.18Å; K30-E38 HydrophobicContact CB-CB 4.42Å; K30-E38 PolarHBondContact N-O 2.88Å; K30-E38 PolarHBondContact O-N 3.44Å; K30-I40 HydrophobicContact CB-CD1 4.03Å; K30-I40 HydrophobicContact CB-CG1 4.19Å; K30-F56 HydrophobicContact CD-CE1 3.97Å; K30-F56 HydrophobicContact CD-CZ 4.2Å; K30-E81 PolarHBondContact NZ-O 3.02Å; K30-D82 IonicContact NZ-OD1 3.63Å; K30-A84 HydrophobicContact CD-CB 4.19Å; K30-A84 HydrophobicContact CG-CB 3.55Å; K30-Y86 HydrophobicContact CB-CD1 4.17Å; K30-Y86 HydrophobicContact CB-CE1 3.94Å; K30-Y86 HydrophobicContact CD-CE1 4.01Å; K30-Y86 HydrophobicContact CG-CD1 4.31Å; K30-Y86 HydrophobicContact CG-CE1 3.8Å
31	Q	97.3	Very high	94.4	Very high	64 Å²	64	46.1 Å²	46.1	30%	0.299	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	114.2	170.5	-169	-177.8	29.3	0	0	110.1	L37 A84 V85 Y87	Q31-L37 HydrophobicContact CB-CD2 3.87Å; Q31-L37 HydrophobicContact CG-CD2 3.96Å; Q31-A84 WeakPolarHBondContact O-CA 3.5Å; Q31-A84 VanDerWaalsContact O-CB 3.3Å; Q31-A84 WeakPolarHBondContact O-CB 3.43Å; Q31-V85 PolarHBondContact N-O 2.92Å; Q31-V85 PolarHBondContact O-N 3.1Å; Q31-Y87 HydrophobicContact CB-CD2 4.43Å; Q31-Y87 HydrophobicContact CB-CE2 3.74Å; Q31-Y87 PolarHBondContact OE1-OH 2.97Å
32	R	94.9	Very high	94.6	Very high	57 Å²	57	46.6 Å²	46.6	22%	0.215	28%	0.276	C	S	.	.			trans	-83.1	150.8	169.9	-61.4	-164.2	-172.3	90.9	-2.4	110.4	K30 G34 Q35 E38 E81 A84	K30-R32 VanDerWaalsContact NZ-NH2 3.18Å; R32-G34 PolarHBondContact O-N 2.88Å; R32-Q35 HydrophobicContact CB-CB 4.01Å; R32-Q35 HydrophobicContact CB-CG 4.01Å; R32-Q35 PolarHBondContact O-N 3.15Å; R32-E38 IonicContact CZ-OE1 3.6Å; R32-E38 IonicContact NH1-OE1 2.77Å; R32-E38 PolarHBondContact NH1-OE1 2.83Å; R32-E81 PolarHBondContact NE-O 3.48Å; R32-E81 PolarHBondContact NH2-O 2.87Å; R32-A84 HydrophobicContact CG-CB 4.31Å
33	P	90.7	Very high	94.8	Very high	119 Å²	119	44 Å²	44	77%	0.773	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	127.3	172.7	-25.3	34.5	0	0	0	111.4	Q35	P33-Q35 PolarHBondContact O-N 2.82Å
34	G	91.6	Very high	95.1	Very high	93 Å²	93	40.9 Å²	40.9	96%	0.959	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.9	5.1	-179.6	0	0	0	0	0	115.7	R32	R32-G34 PolarHBondContact O-N 2.88Å
35	Q	92.9	Very high	95.4	Very high	98 Å²	98	40 Å²	40	46%	0.458	23%	0.232	S	C	.	.	S	Bend	trans	-113	161.9	176	-58.9	-171.7	-4.1	0	0	111.7	R32 P33	R32-Q35 HydrophobicContact CB-CB 4.01Å; R32-Q35 HydrophobicContact CB-CG 4.01Å; R32-Q35 PolarHBondContact O-N 3.15Å; P33-Q35 PolarHBondContact O-N 2.82Å
36	G	92.9	Very high	95.5	Very high	55 Å²	55	38.8 Å²	38.8	57%	0.567	24%	0.235	S	C	*	.			trans	-68.4	174.7	173.1	0	0	0	0	0	113.2
37	L	94.8	Very high	95.5	Very high	97 Å²	97	43.7 Å²	43.7	51%	0.508	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	128.4	174.1	-64.1	175.2	0	0	0	110.4	V29 Q31 W99	V29-L37 HydrophobicContact CG1-CB 3.8Å; V29-L37 HydrophobicContact CG1-CD2 3.95Å; V29-L37 HydrophobicContact CG1-CG 4.35Å; Q31-L37 HydrophobicContact CB-CD2 3.87Å; Q31-L37 HydrophobicContact CG-CD2 3.96Å; L37-W99 HydrophobicContact CD1-CH2 3.86Å; L37-W99 HydrophobicContact CD1-CZ2 4.4Å; L37-W99 HydrophobicContact CD1-CZ3 4.43Å
38	E	96.3	Very high	95.5	Very high	35 Å²	35	44.8 Å²	44.8	16%	0.164	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	114.5	174.5	-63.7	-168.8	-91.2	0	0	109.7	V29 K30 R32 I40 K55 F56	V29-E38 CarbonylContact C-O 3.49Å; V29-E38 WeakPolarHBondContact CA-O 3.37Å; K30-E38 HydrophobicContact CB-CB 4.42Å; K30-E38 PolarHBondContact N-O 2.88Å; K30-E38 PolarHBondContact O-N 3.44Å; R32-E38 IonicContact CZ-OE1 3.6Å; R32-E38 IonicContact NH1-OE1 2.77Å; R32-E38 PolarHBondContact NH1-OE1 2.83Å; E38-I40 PolarHBondContact O-N 2.81Å; E38-K55 IonicContact OE2-NZ 3.66Å; E38-F56 HydrophobicContact CB-CE2 4.4Å; E38-F56 HydrophobicContact CB-CZ 4.27Å
39	W	96.1	Very high	95.4	Very high	79 Å²	79	47 Å²	47	30%	0.299	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	127.2	174.6	-179.2	72.8	0	0	0	110.7	H27 G41 N42 N51 N53	H27-W39 AromaticContact CG-NE1 3.94Å; H27-W39 AromaticContact ND1-NE1 3.2Å; H27-W39 PolarHBondContact ND1-NE1 2.84Å; W39-G41 VanDerWaalsContact CE2-C 3.46Å; W39-G41 PolarHBondContact NE1-O 3.49Å; W39-N42 HydrophobicContact CZ2-CB 4.04Å; W39-N51 HydrophobicContact CH2-CB 4.03Å; W39-N53 HydrophobicContact CE3-CB 3.89Å; W39-N53 HydrophobicContact CZ3-CB 4.08Å; W39-N53 WeakPolarHBondContact O-CB 3.29Å; W39-N53 PolarHBondContact O-ND2 2.88Å
40	I	97.7	Very high	95.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-48.8	-177.9	-61.2	174.9	0	0	0	110.3	W28 K30 E38 N53 F56 A60 M73 Y86	W28-I40 HydrophobicContact CB-CB 4.18Å; W28-I40 HydrophobicContact CB-CD1 4.31Å; W28-I40 WeakPolarHBondContact O-CB 3.33Å; W28-I40 PolarHBondContact O-N 2.97Å; K30-I40 HydrophobicContact CB-CD1 4.03Å; K30-I40 HydrophobicContact CB-CG1 4.19Å; E38-I40 PolarHBondContact O-N 2.81Å; I40-N53 PolarHBondContact O-N 3.18Å; I40-F56 HydrophobicContact CB-CD2 4.33Å; I40-F56 HydrophobicContact CB-CG 4.28Å; I40-F56 HydrophobicContact CG1-CD1 4.22Å; I40-F56 HydrophobicContact CG1-CD2 4.27Å; I40-F56 HydrophobicContact CG1-CE1 4.26Å; I40-F56 HydrophobicContact CG1-CE2 4.29Å; I40-F56 HydrophobicContact CG1-CG 4.22Å; I40-F56 HydrophobicContact CG1-CZ 4.29Å; I40-F56 HydrophobicContact CG2-CB 3.71Å; I40-F56 HydrophobicContact CG2-CD1 4.31Å; I40-F56 HydrophobicContact CG2-CD2 4.4Å; I40-F56 HydrophobicContact CG2-CG 3.9Å; I40-A60 HydrophobicContact CG2-CB 3.79Å; I40-M73 HydrophobicContact CD1-CE 3.9Å; I40-M73 HydrophobicContact CD1-SD 3.63Å; I40-M73 HydrophobicContact CG2-SD 3.91Å; I40-Y86 HydrophobicContact CD1-CD1 3.75Å; I40-Y86 HydrophobicContact CD1-CE1 3.77Å
41	G	97	Very high	95.4	Very high	0 Å²	0	53 Å²	53	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.8	178	-170.7	0	0	0	0	0	112.1	H27 W28 W39 N51	H27-G41 WeakPolarHBondContact CA-O 3.01Å; W28-G41 PolarHBondContact N-O 2.77Å; W39-G41 VanDerWaalsContact CE2-C 3.46Å; W39-G41 PolarHBondContact NE1-O 3.49Å; G41-N51 CarbonylContact C-O 3.56Å; G41-N51 WeakPolarHBondContact CA-O 3.48Å
42	N	96.5	Very high	95.5	Very high	16 Å²	16	52.4 Å²	52.4	9%	0.086	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	160.6	171.7	64.7	24.5	0	0	0	111.6	W25 M26 H27 W39 T50 N51 L62	W25-N42 HydrophobicContact CE3-CB 3.98Å; W25-N42 WeakPolarHBondContact CZ3-OD1 3.4Å; M26-N42 CarbonylContact O-C 3.55Å; M26-N42 WeakPolarHBondContact O-CA 3.4Å; M26-N42 WeakPolarHBondContact O-CB 3.43Å; H27-N42 HydrophobicContact CB-CB 4.34Å; H27-N42 PolarHBondContact CE1-ND2 2.93Å; W39-N42 HydrophobicContact CZ2-CB 4.04Å; N42-T50 VanDerWaalsContact O-CA 3.25Å; N42-T50 WeakPolarHBondContact O-CA 3.35Å; N42-N51 PolarHBondContact N-O 2.55Å; N42-N51 PolarHBondContact O-N 2.81Å; N42-N51 WeakPolarHBondContact OD1-CB 3.21Å; N42-N51 PolarHBondContact OD1-N 2.77Å; N42-N51 PolarHBondContact OD1-ND2 3.15Å; N42-L62 WeakPolarHBondContact O-CD1 3.46Å
43	I	96.9	Very high	95.5	Very high	3 Å²	3	52 Å²	52	2%	0.015	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	135.4	174.7	-174.2	157.4	0	0	0	109.5	W25 M26 P45 S49 T50 L62 V64 A71	W25-I43 VanDerWaalsContact CE3-C 3.5Å; M26-I43 HydrophobicContact CB-CG2 4.07Å; M26-I43 PolarHBondContact N-O 2.77Å; M26-I43 PolarHBondContact O-N 2.81Å; I43-P45 VanDerWaalsContact O-CD 3.31Å; I43-P45 WeakPolarHBondContact O-CD 3.35Å; I43-S49 CarbonylContact C-O 3.56Å; I43-S49 WeakPolarHBondContact CA-O 3.06Å; I43-T50 HydrophobicContact CB-CG2 3.93Å; I43-T50 HydrophobicContact CD1-CG2 3.68Å; I43-T50 HydrophobicContact CG1-CG2 3.75Å; I43-L62 HydrophobicContact CB-CB 4.1Å; I43-L62 HydrophobicContact CB-CD1 4.38Å; I43-L62 HydrophobicContact CD1-CB 4.11Å; I43-L62 HydrophobicContact CG2-CB 4.42Å; I43-V64 HydrophobicContact CB-CG1 4.49Å; I43-V64 HydrophobicContact CD1-CB 4.49Å; I43-V64 HydrophobicContact CD1-CG1 3.78Å; I43-V64 HydrophobicContact CD1-CG2 4.26Å; I43-V64 HydrophobicContact CG1-CG1 3.89Å; I43-V64 HydrophobicContact CG2-CG1 3.78Å; I43-A71 HydrophobicContact CG2-CB 4.48Å
44	N	95.5	Very high	95.8	Very high	21 Å²	21	52.6 Å²	52.6	11%	0.112	32%	0.316	C	S	.	.			trans	-86.2	111.8	171	-175.3	-24.8	0	0	0	108.8	W25 S46 N47 G48 S49	W25-N44 HydrophobicContact CD2-CB 3.82Å; W25-N44 HydrophobicContact CE3-CB 3.8Å; W25-N44 HydrophobicContact CH2-CB 3.75Å; W25-N44 HydrophobicContact CZ2-CB 3.75Å; W25-N44 HydrophobicContact CZ3-CB 3.76Å; N44-S46 VanDerWaalsContact CG-OG 3.26Å; N44-S46 PolarHBondContact ND2-OG 3.16Å; N44-S46 PolarHBondContact O-N 2.82Å; N44-S46 WeakPolarHBondContact OD1-CB 3.34Å; N44-S46 PolarHBondContact OD1-N 3Å; N44-S46 PolarHBondContact OD1-OG 3.05Å; N44-N47 WeakPolarHBondContact CB-OD1 3.09Å; N44-N47 PolarHBondContact O-N 3.05Å; N44-G48 VanDerWaalsContact O-CA 3.31Å; N44-G48 WeakPolarHBondContact O-CA 3.24Å; N44-G48 PolarHBondContact O-N 3.45Å; N44-S49 PolarHBondContact N-O 3.37Å
45	P	95.4	Very high	95.9	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-14.7	-177.6	-16.7	32.4	0	0	0	113.7	F21 N24 I43 V64 K66	F21-P45 HydrophobicContact CD1-CB 3.8Å; F21-P45 HydrophobicContact CD1-CG 4.41Å; F21-P45 HydrophobicContact CD2-CB 4.37Å; F21-P45 HydrophobicContact CD2-CG 4.11Å; F21-P45 HydrophobicContact CE1-CB 3.51Å; F21-P45 HydrophobicContact CE1-CG 4.06Å; F21-P45 HydrophobicContact CE2-CB 4.11Å; F21-P45 HydrophobicContact CE2-CG 3.71Å; F21-P45 HydrophobicContact CG-CB 4.25Å; F21-P45 HydrophobicContact CG-CG 4.46Å; F21-P45 HydrophobicContact CZ-CB 3.68Å; F21-P45 HydrophobicContact CZ-CG 3.69Å; F21-P45 WeakPolarHBondContact O-CG 3.44Å; N24-P45 WeakPolarHBondContact O-CD 3.41Å; N24-P45 WeakPolarHBondContact O-CG 3.19Å; I43-P45 VanDerWaalsContact O-CD 3.31Å; I43-P45 WeakPolarHBondContact O-CD 3.35Å; P45-V64 HydrophobicContact CB-CG1 4.06Å; P45-V64 HydrophobicContact CG-CG1 4.28Å; P45-K66 WeakPolarHBondContact O-CE 3.14Å
46	S	95.1	Very high	96.1	Very high	51 Å²	51	51.1 Å²	51.1	36%	0.357	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-43.4	175.7	67.8	0	0	0	0	112.8	T22 N44 K66	T22-S46 WeakPolarHBondContact O-CB 3.37Å; N44-S46 VanDerWaalsContact CG-OG 3.26Å; N44-S46 PolarHBondContact ND2-OG 3.16Å; N44-S46 PolarHBondContact O-N 2.82Å; N44-S46 WeakPolarHBondContact OD1-CB 3.34Å; N44-S46 PolarHBondContact OD1-N 3Å; N44-S46 PolarHBondContact OD1-OG 3.05Å; S46-K66 WeakPolarHBondContact O-CE 3.44Å; S46-K66 PolarHBondContact O-NZ 2.9Å
47	N	95.6	Very high	96.1	Very high	108 Å²	108	53.9 Å²	53.9	58%	0.578	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.2	-2.9	-169.8	65.6	11.9	0	0	0	114.2	N44 S49	N44-N47 WeakPolarHBondContact CB-OD1 3.09Å; N44-N47 PolarHBondContact O-N 3.05Å; N47-S49 PolarHBondContact O-N 2.84Å; N47-S49 WeakPolarHBondContact OD1-CB 3.43Å; N47-S49 PolarHBondContact OD1-N 2.88Å
48	G	95.7	Very high	96.1	Very high	35 Å²	35	54.7 Å²	54.7	36%	0.361	29%	0.292	S	S	.	.			trans	75.8	7.5	179.6	0	0	0	0	0	114.5	N44 T50	N44-G48 VanDerWaalsContact O-CA 3.31Å; N44-G48 WeakPolarHBondContact O-CA 3.24Å; N44-G48 PolarHBondContact O-N 3.45Å; G48-T50 PolarHBondContact O-N 2.83Å
49	S	96.8	Very high	96.1	Very high	53 Å²	53	55 Å²	55	37%	0.371	29%	0.293	S	S	.	.			trans	-60	137.4	175.2	-178.7	0	0	0	0	110.4	I43 N44 N47	I43-S49 CarbonylContact C-O 3.56Å; I43-S49 WeakPolarHBondContact CA-O 3.06Å; N44-S49 PolarHBondContact N-O 3.37Å; N47-S49 PolarHBondContact O-N 2.84Å; N47-S49 WeakPolarHBondContact OD1-CB 3.43Å; N47-S49 PolarHBondContact OD1-N 2.88Å
50	T	97.6	Very high	96.2	Very high	51 Å²	51	51.4 Å²	51.4	31%	0.313	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	143.2	-177.7	50.6	0	0	0	0	111.3	N42 I43 G48 Y52 L62	N42-T50 VanDerWaalsContact O-CA 3.25Å; N42-T50 WeakPolarHBondContact O-CA 3.35Å; I43-T50 HydrophobicContact CB-CG2 3.93Å; I43-T50 HydrophobicContact CD1-CG2 3.68Å; I43-T50 HydrophobicContact CG1-CG2 3.75Å; G48-T50 PolarHBondContact O-N 2.83Å; T50-Y52 HydrophobicContact CG2-CE2 4.44Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.4Å; T50-L62 HydrophobicContact CG2-CB 3.96Å
51	N	97	Very high	96.2	Very high	77 Å²	77	54.9 Å²	54.9	41%	0.412	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	147.9	165.7	-55.3	-73.5	0	0	0	109	W25 W39 G41 N42	W25-N51 WeakPolarHBondContact CH2-ND2 3.47Å; W25-N51 VanDerWaalsContact CZ3-ND2 3.28Å; W25-N51 WeakPolarHBondContact CZ3-ND2 3.01Å; W39-N51 HydrophobicContact CH2-CB 4.03Å; G41-N51 CarbonylContact C-O 3.56Å; G41-N51 WeakPolarHBondContact CA-O 3.48Å; N42-N51 PolarHBondContact N-O 2.55Å; N42-N51 PolarHBondContact O-N 2.81Å; N42-N51 WeakPolarHBondContact OD1-CB 3.21Å; N42-N51 PolarHBondContact OD1-N 2.77Å; N42-N51 PolarHBondContact OD1-ND2 3.15Å
52	Y	97.7	Very high	96.3	Very high	53 Å²	53	55.4 Å²	55.4	21%	0.208	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	149.9	-178.9	-66.6	-88.1	0	0	0	110.6	T50 K57 A60 L62	T50-Y52 HydrophobicContact CG2-CE2 4.44Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.4Å; Y52-K57 HydrophobicContact CD2-CG 4.43Å; Y52-K57 HydrophobicContact CG-CB 4.47Å; Y52-K57 HydrophobicContact CG-CG 4.31Å; Y52-A60 HydrophobicContact CE1-CB 4.32Å; Y52-A60 VanDerWaalsContact CE1-O 3.23Å; Y52-A60 WeakPolarHBondContact CE1-O 2.98Å; Y52-L62 HydrophobicContact CE1-CD1 3.98Å; Y52-L62 HydrophobicContact CE1-CG 3.7Å; Y52-L62 PolarHBondContact OH-N 3Å
53	N	96.7	Very high	96.4	Very high	49 Å²	49	57.4 Å²	57.4	26%	0.262	32%	0.317	S	S	.	.			trans	-74.1	131.7	154.6	179.7	-23.1	0	0	0	108.2	W39 I40 K55 F56 K57	W39-N53 HydrophobicContact CE3-CB 3.89Å; W39-N53 HydrophobicContact CZ3-CB 4.08Å; W39-N53 WeakPolarHBondContact O-CB 3.29Å; W39-N53 PolarHBondContact O-ND2 2.88Å; I40-N53 PolarHBondContact O-N 3.18Å; N53-K55 PolarHBondContact O-N 3.26Å; N53-K55 PolarHBondContact OD1-N 3.36Å; N53-K55 VanDerWaalsContact OD1-N 3.16Å; N53-F56 HydrophobicContact CB-CD2 4.05Å; N53-F56 PolarHBondContact O-N 3.05Å; N53-K57 PolarHBondContact O-N 3.25Å
54	E	96	Very high	96.4	Very high	131 Å²	131	59 Å²	59	61%	0.612	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-30.7	-175.7	-70.1	-61	147.9	0	0	112.9	F56 K57	E54-F56 PolarHBondContact O-N 3.23Å; E54-K57 PolarHBondContact O-N 3.2Å; E54-K57 IonicContact OE1-NZ 2.82Å; E54-K57 PolarHBondContact OE1-NZ 2.89Å; E54-K57 VanDerWaalsContact OE2-CD 3.24Å; E54-K57 WeakPolarHBondContact OE2-CD 3.42Å; E54-K57 IonicContact OE2-NZ 3.36Å; E54-K57 PolarHBondContact OE2-NZ 2.99Å
55	K	94.1	Very high	96.5	Very high	148 Å²	148	60.6 Å²	60.6	64%	0.643	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-28.6	175.3	-68	-174.4	-178.2	-178.6	0	114.3	E38 N53	E38-K55 IonicContact OE2-NZ 3.66Å; N53-K55 PolarHBondContact O-N 3.26Å; N53-K55 PolarHBondContact OD1-N 3.36Å; N53-K55 VanDerWaalsContact OD1-N 3.16Å
56	F	95.8	Very high	96.5	Very high	12 Å²	12	66 Å²	66	5%	0.053	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-7.1	-172.3	-61.2	-83	0	0	0	113.5	K30 E38 I40 N53 E54 S58 K59 A60	K30-F56 HydrophobicContact CD-CE1 3.97Å; K30-F56 HydrophobicContact CD-CZ 4.2Å; E38-F56 HydrophobicContact CB-CE2 4.4Å; E38-F56 HydrophobicContact CB-CZ 4.27Å; I40-F56 HydrophobicContact CB-CD2 4.33Å; I40-F56 HydrophobicContact CB-CG 4.28Å; I40-F56 HydrophobicContact CG1-CD1 4.22Å; I40-F56 HydrophobicContact CG1-CD2 4.27Å; I40-F56 HydrophobicContact CG1-CE1 4.26Å; I40-F56 HydrophobicContact CG1-CE2 4.29Å; I40-F56 HydrophobicContact CG1-CG 4.22Å; I40-F56 HydrophobicContact CG1-CZ 4.29Å; I40-F56 HydrophobicContact CG2-CB 3.71Å; I40-F56 HydrophobicContact CG2-CD1 4.31Å; I40-F56 HydrophobicContact CG2-CD2 4.4Å; I40-F56 HydrophobicContact CG2-CG 3.9Å; N53-F56 HydrophobicContact CB-CD2 4.05Å; N53-F56 PolarHBondContact O-N 3.05Å; E54-F56 PolarHBondContact O-N 3.23Å; F56-S58 VanDerWaalsContact C-N 3.25Å; F56-S58 PolarHBondContact O-N 3.05Å; F56-K59 PolarHBondContact O-N 2.89Å; F56-A60 HydrophobicContact CB-CB 4.44Å; F56-A60 PolarHBondContact O-N 3.33Å
57	K	94.4	Very high	96.5	Very high	112 Å²	112	69 Å²	69	49%	0.487	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-32.1	-172.8	-168.1	177.6	-171.3	174.3	0	114.1	Y52 N53 E54	Y52-K57 HydrophobicContact CD2-CG 4.43Å; Y52-K57 HydrophobicContact CG-CB 4.47Å; Y52-K57 HydrophobicContact CG-CG 4.31Å; N53-K57 PolarHBondContact O-N 3.25Å; E54-K57 PolarHBondContact O-N 3.2Å; E54-K57 IonicContact OE1-NZ 2.82Å; E54-K57 PolarHBondContact OE1-NZ 2.89Å; E54-K57 VanDerWaalsContact OE2-CD 3.24Å; E54-K57 WeakPolarHBondContact OE2-CD 3.42Å; E54-K57 IonicContact OE2-NZ 3.36Å; E54-K57 PolarHBondContact OE2-NZ 2.99Å
58	S	95.1	Very high	96.5	Very high	114 Å²	114	65.5 Å²	65.5	80%	0.797	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-11.9	175.7	58.1	0	0	0	0	113.9	F56	F56-S58 VanDerWaalsContact C-N 3.25Å; F56-S58 PolarHBondContact O-N 3.05Å
59	K	95.9	Very high	96.5	Very high	42 Å²	42	65.9 Å²	65.9	18%	0.183	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-31.5	-168.3	-161.3	165.1	-164.2	171.1	0	113.6	F56 L75 S76 D82	F56-K59 PolarHBondContact O-N 2.89Å; K59-L75 WeakPolarHBondContact O-CA 3.43Å; K59-S76 WeakPolarHBondContact CE-O 3Å; K59-S76 WeakPolarHBondContact CG-O 3.24Å; K59-S76 PolarHBondContact O-N 2.9Å; K59-S76 PolarHBondContact O-OG 2.84Å; K59-D82 WeakPolarHBondContact CE-OD1 3.25Å; K59-D82 WeakPolarHBondContact CE-OD2 3.42Å; K59-D82 IonicContact NZ-OD1 2.82Å; K59-D82 PolarHBondContact NZ-OD1 3.09Å; K59-D82 IonicContact NZ-OD2 2.55Å; K59-D82 PolarHBondContact NZ-OD2 2.81Å
60	A	97.9	Very high	96.6	Very high	3 Å²	3	63.7 Å²	63.7	3%	0.025	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.7	-177	0	0	0	0	0	110.8	I40 Y52 F56 M73 Q74 L75	I40-A60 HydrophobicContact CG2-CB 3.79Å; Y52-A60 HydrophobicContact CE1-CB 4.32Å; Y52-A60 VanDerWaalsContact CE1-O 3.23Å; Y52-A60 WeakPolarHBondContact CE1-O 2.98Å; F56-A60 HydrophobicContact CB-CB 4.44Å; F56-A60 PolarHBondContact O-N 3.33Å; A60-M73 HydrophobicContact CB-CG 4.27Å; A60-M73 HydrophobicContact CB-SD 4.27Å; A60-Q74 CarbonylContact C-O 3.58Å; A60-Q74 WeakPolarHBondContact CA-O 3.13Å; A60-L75 HydrophobicContact CB-CD2 3.95Å
61	T	98.4	Very high	96.6	Very high	74 Å²	74	61.3 Å²	61.3	45%	0.454	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	119.8	168.8	-58.8	0	0	0	0	109	T63 M73 Q74	T61-T63 HydrophobicContact CG2-CG2 4.35Å; T61-M73 WeakPolarHBondContact O-CA 3.45Å; T61-Q74 PolarHBondContact N-O 2.76Å; T61-Q74 PolarHBondContact O-N 2.9Å
62	L	98.4	Very high	96.6	Very high	10 Å²	10	60 Å²	60	5%	0.052	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133	178.8	-52.9	-176.3	0	0	0	110.8	W28 N42 I43 T50 Y52 Y72 M73	W28-L62 HydrophobicContact CG-CD2 4.11Å; N42-L62 WeakPolarHBondContact O-CD1 3.46Å; I43-L62 HydrophobicContact CB-CB 4.1Å; I43-L62 HydrophobicContact CB-CD1 4.38Å; I43-L62 HydrophobicContact CD1-CB 4.11Å; I43-L62 HydrophobicContact CG2-CB 4.42Å; T50-L62 HydrophobicContact CG2-CB 3.96Å; Y52-L62 HydrophobicContact CE1-CD1 3.98Å; Y52-L62 HydrophobicContact CE1-CG 3.7Å; Y52-L62 PolarHBondContact OH-N 3Å; L62-Y72 WeakPolarHBondContact CA-O 3.29Å; L62-M73 HydrophobicContact CD2-CB 3.7Å; L62-M73 HydrophobicContact CD2-CG 3.62Å; L62-M73 HydrophobicContact CD2-SD 4.19Å
63	T	98.3	Very high	96.6	Very high	58 Å²	58	57.5 Å²	57.5	36%	0.356	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	163.2	176.5	56.9	0	0	0	0	110.8	T61 Y72	T61-T63 HydrophobicContact CG2-CG2 4.35Å; T63-Y72 PolarHBondContact N-O 2.87Å; T63-Y72 PolarHBondContact O-N 2.85Å
64	V	97.6	Very high	96.7	Very high	38 Å²	38	59.2 Å²	59.2	23%	0.23	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	144.5	176.9	-70.6	0	0	0	0	110.7	F21 I43 P45 A71	F21-V64 HydrophobicContact CE1-CB 4.39Å; F21-V64 HydrophobicContact CE1-CG1 4.41Å; F21-V64 HydrophobicContact CZ-CB 4.48Å; F21-V64 HydrophobicContact CZ-CG1 4.07Å; I43-V64 HydrophobicContact CB-CG1 4.49Å; I43-V64 HydrophobicContact CD1-CB 4.49Å; I43-V64 HydrophobicContact CD1-CG1 3.78Å; I43-V64 HydrophobicContact CD1-CG2 4.26Å; I43-V64 HydrophobicContact CG1-CG1 3.89Å; I43-V64 HydrophobicContact CG2-CG1 3.78Å; P45-V64 HydrophobicContact CB-CG1 4.06Å; P45-V64 HydrophobicContact CG-CG1 4.28Å; V64-A71 HydrophobicContact CG1-CB 4.2Å
65	D	97.1	Very high	96.8	Very high	53 Å²	53	53 Å²	53	28%	0.283	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	108.5	164.6	174.5	8.8	0	0	0	108.4	S67 S68 S69 T70 Y72	D65-S67 VanDerWaalsContact C-N 3.31Å; D65-S67 WeakPolarHBondContact OD1-CB 3.19Å; D65-S67 PolarHBondContact OD1-N 3.19Å; D65-S67 PolarHBondContact OD1-OG 3.27Å; D65-S67 PolarHBondContact OD2-OG 2.89Å; D65-S68 WeakPolarHBondContact CB-OG 3.3Å; D65-S68 PolarHBondContact OD1-N 2.89Å; D65-S68 WeakPolarHBondContact OD2-CB 3.05Å; D65-S68 PolarHBondContact OD2-OG 3.5Å; D65-S69 WeakPolarHBondContact O-CA 3.48Å; D65-S69 PolarHBondContact O-N 3.36Å; D65-S69 VanDerWaalsContact O-N 3.09Å; D65-T70 PolarHBondContact N-O 2.83Å; D65-T70 PolarHBondContact O-N 2.8Å; D65-Y72 HydrophobicContact CB-CE2 3.89Å
66	K	95.2	Very high	96.9	Very high	115 Å²	115	47.6 Å²	47.6	50%	0.5	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-32.1	-178.6	-59.1	-179.1	-172.7	-174.3	0	111.8	P45 S46 S68 S69	P45-K66 WeakPolarHBondContact O-CE 3.14Å; S46-K66 WeakPolarHBondContact O-CE 3.44Å; S46-K66 PolarHBondContact O-NZ 2.9Å; K66-S68 VanDerWaalsContact C-N 3.35Å; K66-S68 PolarHBondContact O-N 3.19Å; K66-S69 PolarHBondContact O-N 2.82Å
67	S	94.7	Very high	97	Very high	112 Å²	112	51 Å²	51	78%	0.783	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-38.9	-176.1	72.1	0	0	0	0	111.6	D65	D65-S67 VanDerWaalsContact C-N 3.31Å; D65-S67 WeakPolarHBondContact OD1-CB 3.19Å; D65-S67 PolarHBondContact OD1-N 3.19Å; D65-S67 PolarHBondContact OD1-OG 3.27Å; D65-S67 PolarHBondContact OD2-OG 2.89Å
68	S	96.4	Very high	97.1	Very high	36 Å²	36	45.7 Å²	45.7	25%	0.252	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	0.6	176.8	65.9	0	0	0	0	113.8	D65 K66 T70	D65-S68 WeakPolarHBondContact CB-OG 3.3Å; D65-S68 PolarHBondContact OD1-N 2.89Å; D65-S68 WeakPolarHBondContact OD2-CB 3.05Å; D65-S68 PolarHBondContact OD2-OG 3.5Å; K66-S68 VanDerWaalsContact C-N 3.35Å; K66-S68 PolarHBondContact O-N 3.19Å; S68-T70 PolarHBondContact O-N 2.95Å; S68-T70 PolarHBondContact O-OG1 2.77Å; S68-T70 VanDerWaalsContact O-OG1 3.09Å; S68-T70 WeakPolarHBondContact OG-CB 3.15Å; S68-T70 PolarHBondContact OG-OG1 3.48Å
69	S	96.3	Very high	97.1	Very high	42 Å²	42	43 Å²	43	29%	0.294	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	43.4	-173	-63.4	0	0	0	0	113	A16 F21 D65 K66	A16-S69 WeakPolarHBondContact CB-O 3.25Å; A16-S69 PolarHBondContact N-O 2.02Å; F21-S69 VanDerWaalsContact CD1-CA 3.48Å; D65-S69 WeakPolarHBondContact O-CA 3.48Å; D65-S69 PolarHBondContact O-N 3.36Å; D65-S69 VanDerWaalsContact O-N 3.09Å; K66-S69 PolarHBondContact O-N 2.82Å
70	T	97.5	Very high	97.1	Very high	8 Å²	8	45 Å²	45	5%	0.049	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.5	-174.4	-54.5	0	0	0	0	111	C14 K15 D65 S68 Y72	C14-T70 WeakPolarHBondContact O-CA 3.37Å; K15-T70 HydrophobicContact CB-CG2 4.49Å; D65-T70 PolarHBondContact N-O 2.83Å; D65-T70 PolarHBondContact O-N 2.8Å; S68-T70 PolarHBondContact O-N 2.95Å; S68-T70 PolarHBondContact O-OG1 2.77Å; S68-T70 VanDerWaalsContact O-OG1 3.09Å; S68-T70 WeakPolarHBondContact OG-CB 3.15Å; S68-T70 PolarHBondContact OG-OG1 3.48Å; T70-Y72 HydrophobicContact CG2-CD1 4.23Å; T70-Y72 HydrophobicContact CG2-CD2 4.31Å; T70-Y72 HydrophobicContact CG2-CE1 3.65Å; T70-Y72 HydrophobicContact CG2-CE2 3.71Å; T70-Y72 WeakPolarHBondContact CG2-OH 3.45Å
71	A	97.6	Very high	96.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	149.5	166.5	0	0	0	0	0	109.9	S13 C14 F21 M26 W28 I43 V64	S13-A71 CarbonylContact C-O 3.51Å; S13-A71 WeakPolarHBondContact CA-O 3.47Å; C14-A71 PolarHBondContact N-O 3Å; C14-A71 PolarHBondContact O-N 2.82Å; F21-A71 HydrophobicContact CE2-CB 4.36Å; F21-A71 HydrophobicContact CZ-CB 4.04Å; M26-A71 HydrophobicContact CB-CB 4.04Å; M26-A71 HydrophobicContact CG-CB 3.6Å; W28-A71 HydrophobicContact CZ2-CB 4.34Å; I43-A71 HydrophobicContact CG2-CB 4.48Å; V64-A71 HydrophobicContact CG1-CB 4.2Å
72	Y	98.3	Very high	96.8	Very high	50 Å²	50	47.8 Å²	47.8	20%	0.196	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	146.3	177	-55.9	-89.7	0	0	0	111	K11 L12 S13 L62 T63 D65 T70	K11-Y72 HydrophobicContact CD-CD1 4.28Å; K11-Y72 VanDerWaalsContact CE-CB 3.48Å; K11-Y72 VanDerWaalsContact CE-CD1 3.44Å; K11-Y72 VanDerWaalsContact CE-CG 3.4Å; K11-Y72 HydrophobicContact CG-CD1 4.24Å; L12-Y72 CarbonylContact O-C 3.51Å; L12-Y72 WeakPolarHBondContact O-CA 3.14Å; S13-Y72 VanDerWaalsContact CB-CD1 3.49Å; S13-Y72 VanDerWaalsContact CB-CE1 3.44Å; L62-Y72 WeakPolarHBondContact CA-O 3.29Å; T63-Y72 PolarHBondContact N-O 2.87Å; T63-Y72 PolarHBondContact O-N 2.85Å; D65-Y72 HydrophobicContact CB-CE2 3.89Å; T70-Y72 HydrophobicContact CG2-CD1 4.23Å; T70-Y72 HydrophobicContact CG2-CD2 4.31Å; T70-Y72 HydrophobicContact CG2-CE1 3.65Å; T70-Y72 HydrophobicContact CG2-CE2 3.71Å; T70-Y72 WeakPolarHBondContact CG2-OH 3.45Å
73	M	98.3	Very high	96.7	Very high	0 Å²	0	49 Å²	49	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	119.2	166.8	178.3	177.5	68.7	0	0	108.5	L12 W28 I40 A60 T61 L62 L75 Y86	L12-M73 HydrophobicContact CD1-CE 3.77Å; L12-M73 PolarHBondContact N-O 3.06Å; L12-M73 PolarHBondContact O-N 2.94Å; W28-M73 HydrophobicContact CB-SD 3.89Å; W28-M73 HydrophobicContact CD2-CB 3.67Å; W28-M73 HydrophobicContact CD2-CE 4.34Å; W28-M73 HydrophobicContact CD2-CG 4.5Å; W28-M73 HydrophobicContact CD2-SD 4.15Å; W28-M73 HydrophobicContact CE3-CB 3.96Å; W28-M73 HydrophobicContact CE3-CE 3.85Å; W28-M73 HydrophobicContact CE3-SD 4.26Å; W28-M73 HydrophobicContact CG-CB 4.14Å; W28-M73 HydrophobicContact CG-SD 4.01Å; W28-M73 HydrophobicContact CH2-CB 4.17Å; W28-M73 HydrophobicContact CZ2-CB 3.91Å; W28-M73 HydrophobicContact CZ3-CB 4.2Å; W28-M73 HydrophobicContact CZ3-CE 4.38Å; I40-M73 HydrophobicContact CD1-CE 3.9Å; I40-M73 HydrophobicContact CD1-SD 3.63Å; I40-M73 HydrophobicContact CG2-SD 3.91Å; A60-M73 HydrophobicContact CB-CG 4.27Å; A60-M73 HydrophobicContact CB-SD 4.27Å; T61-M73 WeakPolarHBondContact O-CA 3.45Å; L62-M73 HydrophobicContact CD2-CB 3.7Å; L62-M73 HydrophobicContact CD2-CG 3.62Å; L62-M73 HydrophobicContact CD2-SD 4.19Å; M73-L75 HydrophobicContact CE-CD1 3.85Å; M73-L75 HydrophobicContact CE-CD2 4.09Å; M73-L75 HydrophobicContact CE-CG 3.94Å; M73-L75 HydrophobicContact CG-CD2 4.3Å; M73-L75 HydrophobicContact CG-CG 4.33Å; M73-L75 HydrophobicContact SD-CD2 4.01Å; M73-L75 HydrophobicContact SD-CG 4.37Å; M73-Y86 HydrophobicContact CE-CD1 3.58Å; M73-Y86 HydrophobicContact CE-CE1 4.06Å; M73-Y86 HydrophobicContact CE-CG 4.28Å
74	Q	98.2	Very high	96.7	Very high	86 Å²	86	46.5 Å²	46.5	40%	0.402	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	123.8	169.1	-176.7	172.8	-3.9	0	0	109.1	V10 A60 T61	V10-Q74 CarbonylContact O-C 3.43Å; V10-Q74 VanDerWaalsContact O-CA 3.25Å; V10-Q74 WeakPolarHBondContact O-CA 3.34Å; A60-Q74 CarbonylContact C-O 3.58Å; A60-Q74 WeakPolarHBondContact CA-O 3.13Å; T61-Q74 PolarHBondContact N-O 2.76Å; T61-Q74 PolarHBondContact O-N 2.9Å
75	L	97.7	Very high	96.7	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	129.9	171.1	-62.8	166.9	0	0	0	108.7	S9 V10 K59 A60 M73 L78 Y86 L105	S9-L75 CarbonylContact C-O 3.5Å; S9-L75 WeakPolarHBondContact CA-O 3.34Å; S9-L75 WeakPolarHBondContact CB-O 3.23Å; V10-L75 HydrophobicContact CG1-CB 3.97Å; V10-L75 HydrophobicContact CG1-CD1 4.22Å; V10-L75 PolarHBondContact N-O 2.92Å; V10-L75 PolarHBondContact O-N 2.89Å; K59-L75 WeakPolarHBondContact O-CA 3.43Å; A60-L75 HydrophobicContact CB-CD2 3.95Å; M73-L75 HydrophobicContact CE-CD1 3.85Å; M73-L75 HydrophobicContact CE-CD2 4.09Å; M73-L75 HydrophobicContact CE-CG 3.94Å; M73-L75 HydrophobicContact CG-CD2 4.3Å; M73-L75 HydrophobicContact CG-CG 4.33Å; M73-L75 HydrophobicContact SD-CD2 4.01Å; M73-L75 HydrophobicContact SD-CG 4.37Å; L75-L78 HydrophobicContact CB-CD2 3.75Å; L75-L78 HydrophobicContact CD1-CD2 4.32Å; L75-Y86 HydrophobicContact CD1-CD1 4.23Å; L75-Y86 HydrophobicContact CD1-CE1 3.59Å; L75-Y86 HydrophobicContact CD1-CE2 4.19Å; L75-L105 HydrophobicContact CD1-CD2 4.16Å
76	S	96.9	Very high	96.7	Very high	33 Å²	33	43.9 Å²	43.9	23%	0.231	26%	0.256	C	S	.	.			trans	-108.4	159.4	179.9	58.7	0	0	0	0	112.3	S9 K59 L78	S9-S76 WeakPolarHBondContact OG-CA 3.3Å; K59-S76 WeakPolarHBondContact CE-O 3Å; K59-S76 WeakPolarHBondContact CG-O 3.24Å; K59-S76 PolarHBondContact O-N 2.9Å; K59-S76 PolarHBondContact O-OG 2.84Å; S76-L78 VanDerWaalsContact C-N 3.33Å; S76-L78 PolarHBondContact O-N 2.86Å
77	S	96.3	Very high	96.8	Very high	83 Å²	83	40.5 Å²	40.5	58%	0.58	24%	0.241	S	C	*	.	S	Bend	trans	49.3	52.5	172.2	-56.8	0	0	0	0	112.7	A8	A8-S77 PolarHBondContact O-N 3.05Å
78	L	96.8	Very high	96.9	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	21%	0.208	C	C	.	.			trans	-64	141.9	-172.5	-70.2	172.8	0	0	0	112.3	V4 P6 G7 A8 V10 L75 S76 D82 L105 V107	V4-L78 HydrophobicContact CG2-CD1 3.53Å; P6-L78 CarbonylContact C-O 3.59Å; P6-L78 WeakPolarHBondContact CA-O 3.38Å; G7-L78 PolarHBondContact N-O 2.93Å; A8-L78 WeakPolarHBondContact O-CB 3.28Å; A8-L78 WeakPolarHBondContact O-CG 3.05Å; A8-L78 PolarHBondContact O-N 2.87Å; V10-L78 HydrophobicContact CB-CD1 4.12Å; V10-L78 HydrophobicContact CG1-CD1 3.8Å; L75-L78 HydrophobicContact CB-CD2 3.75Å; L75-L78 HydrophobicContact CD1-CD2 4.32Å; S76-L78 VanDerWaalsContact C-N 3.33Å; S76-L78 PolarHBondContact O-N 2.86Å; L78-D82 VanDerWaalsContact CA-OD2 3.29Å; L78-D82 WeakPolarHBondContact CA-OD2 3.17Å; L78-D82 HydrophobicContact CD2-CB 3.71Å; L78-D82 WeakPolarHBondContact CD2-OD2 3.43Å; L78-L105 HydrophobicContact CD1-CD2 4.11Å; L78-L105 HydrophobicContact CD2-CD2 4.09Å; L78-V107 HydrophobicContact CB-CG1 4.18Å; L78-V107 HydrophobicContact CB-CG2 4.08Å; L78-V107 HydrophobicContact CD1-CG2 4.37Å
79	T	96.3	Very high	96.8	Very high	57 Å²	57	34.2 Å²	34.2	35%	0.35	20%	0.197	S	C	.	.			trans	-122.6	167.6	174.2	65.4	0	0	0	0	109.6	E81 D82 V107	T79-E81 PolarHBondContact O-N 3.42Å; T79-E81 VanDerWaalsContact O-N 3.1Å; T79-D82 PolarHBondContact N-OD2 3.24Å; T79-D82 WeakPolarHBondContact O-CB 3.33Å; T79-D82 PolarHBondContact O-N 2.87Å; T79-D82 PolarHBondContact OG1-OD2 3.36Å; T79-V107 WeakPolarHBondContact O-CB 3.31Å; T79-V107 WeakPolarHBondContact O-CG2 3.41Å
80	S	95.2	Very high	96.5	Very high	84 Å²	84	33.9 Å²	33.9	59%	0.587	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-53.6	-31.6	176.4	52.3	0	0	0	0	112.7	D82 S83	S80-D82 PolarHBondContact O-N 3.17Å; S80-S83 VanDerWaalsContact O-CB 3.28Å; S80-S83 WeakPolarHBondContact O-CB 3.46Å; S80-S83 PolarHBondContact O-N 3.33Å; S80-S83 PolarHBondContact O-OG 2.93Å
81	E	93.5	Very high	95.5	Very high	133 Å²	133	35.5 Å²	35.5	62%	0.621	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-67.1	-13.5	177.1	-59.8	-175.8	173.1	0	0	114.6	K30 R32 T79 S83	K30-E81 PolarHBondContact NZ-O 3.02Å; R32-E81 PolarHBondContact NE-O 3.48Å; R32-E81 PolarHBondContact NH2-O 2.87Å; T79-E81 PolarHBondContact O-N 3.42Å; T79-E81 VanDerWaalsContact O-N 3.1Å; E81-S83 VanDerWaalsContact C-N 3.32Å
82	D	95.8	Very high	93.9	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.021	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-83.4	-9.2	172.7	-58.4	-48.8	0	0	0	113.4	K30 K59 L78 T79 S80 A84 Y86 V107	K30-D82 IonicContact NZ-OD1 3.63Å; K59-D82 WeakPolarHBondContact CE-OD1 3.25Å; K59-D82 WeakPolarHBondContact CE-OD2 3.42Å; K59-D82 IonicContact NZ-OD1 2.82Å; K59-D82 PolarHBondContact NZ-OD1 3.09Å; K59-D82 IonicContact NZ-OD2 2.55Å; K59-D82 PolarHBondContact NZ-OD2 2.81Å; L78-D82 VanDerWaalsContact CA-OD2 3.29Å; L78-D82 WeakPolarHBondContact CA-OD2 3.17Å; L78-D82 HydrophobicContact CD2-CB 3.71Å; L78-D82 WeakPolarHBondContact CD2-OD2 3.43Å; T79-D82 PolarHBondContact N-OD2 3.24Å; T79-D82 WeakPolarHBondContact O-CB 3.33Å; T79-D82 PolarHBondContact O-N 2.87Å; T79-D82 PolarHBondContact OG1-OD2 3.36Å; S80-D82 PolarHBondContact O-N 3.17Å; D82-A84 PolarHBondContact O-N 2.84Å; D82-Y86 WeakPolarHBondContact O-CE2 3.48Å; D82-Y86 PolarHBondContact O-OH 3.29Å; D82-V107 HydrophobicContact CB-CG2 4.23Å
83	S	97.2	Very high	92.1	Very high	34 Å²	34	43.1 Å²	43.1	24%	0.238	25%	0.249	C	C	.	.			trans	-60.9	114.6	174	-58	0	0	0	0	110.2	S80 E81 L105 V107	S80-S83 VanDerWaalsContact O-CB 3.28Å; S80-S83 WeakPolarHBondContact O-CB 3.46Å; S80-S83 PolarHBondContact O-N 3.33Å; S80-S83 PolarHBondContact O-OG 2.93Å; E81-S83 VanDerWaalsContact C-N 3.32Å; S83-L105 VanDerWaalsContact CA-O 3.28Å; S83-L105 WeakPolarHBondContact CA-O 3.25Å; S83-V107 PolarHBondContact OG-N 2.8Å
84	A	97.4	Very high	90.3	Very high	6 Å²	6	47.8 Å²	47.8	5%	0.05	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.9	171.9	-170.5	0	0	0	0	0	110.8	K30 Q31 R32 D82 Y86 L105	K30-A84 HydrophobicContact CD-CB 4.19Å; K30-A84 HydrophobicContact CG-CB 3.55Å; Q31-A84 WeakPolarHBondContact O-CA 3.5Å; Q31-A84 VanDerWaalsContact O-CB 3.3Å; Q31-A84 WeakPolarHBondContact O-CB 3.43Å; R32-A84 HydrophobicContact CG-CB 4.31Å; D82-A84 PolarHBondContact O-N 2.84Å; A84-Y86 HydrophobicContact CB-CD2 4.32Å; A84-Y86 HydrophobicContact CB-CE2 3.83Å; A84-L105 PolarHBondContact N-O 3.04Å; A84-L105 PolarHBondContact O-N 3.5Å
85	V	98.1	Very high	88.7	Confident	33 Å²	33	52 Å²	52	20%	0.2	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	130.3	160.6	-169.5	0	0	0	0	108.5	Q31 Y87	Q31-V85 PolarHBondContact N-O 2.92Å; Q31-V85 PolarHBondContact O-N 3.1Å; V85-Y87 HydrophobicContact CB-CE2 3.84Å; V85-Y87 HydrophobicContact CG1-CD1 4.41Å; V85-Y87 HydrophobicContact CG1-CD2 4.33Å; V85-Y87 HydrophobicContact CG1-CE1 3.74Å; V85-Y87 HydrophobicContact CG1-CE2 3.66Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.42Å
86	Y	97.9	Very high	87.5	Confident	3 Å²	3	55.6 Å²	55.6	1%	0.012	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126	178.4	-71.5	-90.5	0	0	0	109.8	L12 V29 K30 I40 M73 L75 D82 A84 G102 T103 L105	L12-Y86 HydrophobicContact CD1-CD1 4.36Å; L12-Y86 HydrophobicContact CD1-CD2 4.15Å; L12-Y86 HydrophobicContact CD1-CG 3.77Å; V29-Y86 CarbonylContact O-C 3.58Å; V29-Y86 WeakPolarHBondContact O-CA 3.42Å; K30-Y86 HydrophobicContact CB-CD1 4.17Å; K30-Y86 HydrophobicContact CB-CE1 3.94Å; K30-Y86 HydrophobicContact CD-CE1 4.01Å; K30-Y86 HydrophobicContact CG-CD1 4.31Å; K30-Y86 HydrophobicContact CG-CE1 3.8Å; I40-Y86 HydrophobicContact CD1-CD1 3.75Å; I40-Y86 HydrophobicContact CD1-CE1 3.77Å; M73-Y86 HydrophobicContact CE-CD1 3.58Å; M73-Y86 HydrophobicContact CE-CE1 4.06Å; M73-Y86 HydrophobicContact CE-CG 4.28Å; L75-Y86 HydrophobicContact CD1-CD1 4.23Å; L75-Y86 HydrophobicContact CD1-CE1 3.59Å; L75-Y86 HydrophobicContact CD1-CE2 4.19Å; D82-Y86 WeakPolarHBondContact O-CE2 3.48Å; D82-Y86 PolarHBondContact O-OH 3.29Å; A84-Y86 HydrophobicContact CB-CD2 4.32Å; A84-Y86 HydrophobicContact CB-CE2 3.83Å; Y86-G102 CarbonylContact O-C 3.56Å; Y86-G102 VanDerWaalsContact O-CA 3.24Å; Y86-G102 WeakPolarHBondContact O-CA 3.41Å; Y86-T103 PolarHBondContact N-O 3.4Å; Y86-T103 PolarHBondContact O-N 2.96Å; Y86-L105 HydrophobicContact CD2-CB 3.9Å; Y86-L105 HydrophobicContact CD2-CD2 4.35Å; Y86-L105 HydrophobicContact CE2-CB 3.81Å; Y86-L105 HydrophobicContact CE2-CD2 3.71Å; Y86-L105 HydrophobicContact CE2-CG 4.39Å
87	Y	97.4	Very high	86.5	Confident	45 Å²	45	57.1 Å²	57.1	18%	0.176	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	148	-180	-55.1	-87.8	0	0	0	110.3	W28 V29 Q31 V85 W99	W28-Y87 WeakPolarHBondContact CA-O 3.38Å; V29-Y87 PolarHBondContact N-O 3.33Å; V29-Y87 PolarHBondContact O-N 3.09Å; Q31-Y87 HydrophobicContact CB-CD2 4.43Å; Q31-Y87 HydrophobicContact CB-CE2 3.74Å; Q31-Y87 PolarHBondContact OE1-OH 2.97Å; V85-Y87 HydrophobicContact CB-CE2 3.84Å; V85-Y87 HydrophobicContact CG1-CD1 4.41Å; V85-Y87 HydrophobicContact CG1-CD2 4.33Å; V85-Y87 HydrophobicContact CG1-CE1 3.74Å; V85-Y87 HydrophobicContact CG1-CE2 3.66Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.42Å; Y87-W99 HydrophobicContact CG-CE3 4.07Å; Y87-W99 HydrophobicContact CG-CZ3 4.27Å
88	C	95.9	Very high	86	Confident	15 Å²	15	60.3 Å²	60.3	10%	0.101	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	147.4	158.4	62.2	0	0	0	0	109.5	C14 M26 H27 W28 G100	C14-C88 HydrophobicContact CB-CB 3.43Å; C14-C88 VanDerWaalsContact CB-CB 3.43Å; C14-C88 WeakPolarHBondContact CB-SG 2.89Å; C14-C88 WeakPolarHBondContact SG-CB 3.45Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.6Å; M26-C88 HydrophobicContact CG-CB 4.48Å; M26-C88 HydrophobicContact SD-CB 3.76Å; H27-C88 CarbonylContact O-C 3.5Å; H27-C88 WeakPolarHBondContact O-CA 3.31Å; W28-C88 HydrophobicContact CD2-CB 4.42Å; W28-C88 HydrophobicContact CE3-CB 4.22Å; W28-C88 HydrophobicContact CH2-CB 4.35Å; W28-C88 HydrophobicContact CZ3-CB 4.19Å; C88-G100 PolarHBondContact O-N 3.19Å
89	A	94.1	Very high	85.8	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.008	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	141.9	176.4	0	0	0	0	0	111	H27 F96 Y98 W99	H27-A89 PolarHBondContact N-O 3.49Å; H27-A89 PolarHBondContact O-N 3.49Å; A89-F96 HydrophobicContact CB-CB 4.21Å; A89-F96 HydrophobicContact CB-CD1 3.75Å; A89-F96 HydrophobicContact CB-CE1 4.4Å; A89-F96 HydrophobicContact CB-CG 4.08Å; A89-Y98 CarbonylContact C-O 3.56Å; A89-Y98 VanDerWaalsContact CA-O 3.24Å; A89-Y98 WeakPolarHBondContact CA-O 3.32Å; A89-W99 HydrophobicContact CB-CD2 3.8Å; A89-W99 HydrophobicContact CB-CE3 4.03Å; A89-W99 HydrophobicContact CB-CG 4.23Å; A89-W99 HydrophobicContact CB-CH2 4.45Å; A89-W99 HydrophobicContact CB-CZ2 4.26Å; A89-W99 HydrophobicContact CB-CZ3 4.35Å
90	R	89.4	Confident	85.7	Confident	35 Å²	35	63.5 Å²	63.5	13%	0.132	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	147.1	170.4	-168.5	-170.9	79.5	-172.9	9.6	109.5	Y19 N24 F96 D97 Y98	Y19-R90 HydrophobicContact CE2-CG 4.05Å; Y19-R90 VanDerWaalsContact CG-NH1 3.32Å; Y19-R90 VanDerWaalsContact CZ-CD 3.42Å; N24-R90 HydrophobicContact CB-CG 3.64Å; R90-F96 WeakPolarHBondContact O-CA 3.18Å; R90-D97 PolarHBondContact O-N 3.41Å; R90-Y98 VanDerWaalsContact CZ-CD2 3.42Å; R90-Y98 PolarHBondContact N-O 2.9Å
91	N	77.9	Confident	85.6	Confident	42 Å²	42	68.5 Å²	68.5	23%	0.225	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	125.4	171.9	-174.8	-1.7	0	0	0	110.3	N24 W25 H27 S93 Y95 F96	N24-N91 PolarHBondContact OD1-O 3.1Å; W25-N91 PolarHBondContact O-N 3.38Å; H27-N91 WeakPolarHBondContact NE2-CB 3.33Å; N91-S93 VanDerWaalsContact OD1-CA 3.29Å; N91-S93 WeakPolarHBondContact OD1-CA 3.36Å; N91-S93 PolarHBondContact OD1-N 3.07Å; N91-Y95 PolarHBondContact OD1-O 3.2Å; N91-Y95 VanDerWaalsContact OD1-O 3.05Å; N91-F96 HydrophobicContact CB-CD1 4.41Å
92	D	63.7	Low	85.7	Confident	107 Å²	107	63.5 Å²	63.5	57%	0.572	33%	0.327	S	S	*	.	S	Bend	trans	-119.5	58.5	163.4	-165.9	15.4	0	0	0	109	D97	D92-D97 VanDerWaalsContact CA-OD2 3.3Å; D92-D97 WeakPolarHBondContact CA-OD2 3.49Å; D92-D97 WeakPolarHBondContact CB-OD2 3.33Å; D92-D97 PolarHBondContact N-OD2 3.39Å
93	S	59.3	Low	85.7	Confident	102 Å²	102	65.7 Å²	65.7	71%	0.713	34%	0.341	S	S	*	.	S	Bend	trans	30.8	120.1	171.3	-171.6	0	0	0	0	118.5	N91	N91-S93 VanDerWaalsContact OD1-CA 3.29Å; N91-S93 WeakPolarHBondContact OD1-CA 3.36Å; N91-S93 PolarHBondContact OD1-N 3.07Å
94	P	60.4	Low	85.8	Confident	99 Å²	99	66.7 Å²	66.7	64%	0.643	35%	0.346	S	S	*	.	S	Bend	cis	-104.3	11.5	6.7	38.4	-33.2	0	0	0	114.6
95	Y	65.4	Low	85.7	Confident	173 Å²	173	66.4 Å²	66.4	68%	0.678	34%	0.343	S	S	*	.	S	Bend	trans	-117.7	160.9	-173.9	-59.7	-70.7	0	0	0	112.9	N91 D97	N91-Y95 PolarHBondContact OD1-O 3.2Å; N91-Y95 VanDerWaalsContact OD1-O 3.05Å; Y95-D97 PolarHBondContact O-N 2.6Å
96	F	72.6	Confident	85.7	Confident	77 Å²	77	67.3 Å²	67.3	34%	0.338	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	101.1	167.3	-65.8	-57.2	0	0	0	109.4	H27 A89 R90 N91 W99	H27-F96 HydrophobicContact CB-CD1 4.44Å; H27-F96 HydrophobicContact CB-CE1 3.65Å; H27-F96 HydrophobicContact CB-CZ 4.26Å; H27-F96 AromaticContact CD2-CE1 3.7Å; H27-F96 AromaticContact CE1-CE1 3.77Å; H27-F96 AromaticContact CG-CE1 3.37Å; H27-F96 AromaticContact ND1-CE1 3.43Å; H27-F96 WeakPolarHBondContact ND1-CE1 3.48Å; H27-F96 AromaticContact ND1-CZ 3.79Å; H27-F96 AromaticContact NE2-CE1 3.97Å; A89-F96 HydrophobicContact CB-CB 4.21Å; A89-F96 HydrophobicContact CB-CD1 3.75Å; A89-F96 HydrophobicContact CB-CE1 4.4Å; A89-F96 HydrophobicContact CB-CG 4.08Å; R90-F96 WeakPolarHBondContact O-CA 3.18Å; N91-F96 HydrophobicContact CB-CD1 4.41Å; F96-W99 HydrophobicContact CB-CZ2 3.84Å; F96-W99 VanDerWaalsContact CB-NE1 3.31Å; F96-W99 HydrophobicContact CD2-CH2 4.25Å; F96-W99 AromaticContact CD2-CZ2 3.52Å; F96-W99 HydrophobicContact CD2-CZ2 3.52Å; F96-W99 HydrophobicContact CE2-CZ2 4.28Å; F96-W99 AromaticContact CG-CZ2 3.8Å; F96-W99 HydrophobicContact CG-CZ2 3.8Å
97	D	75.8	Confident	85.6	Confident	66 Å²	66	67.4 Å²	67.4	35%	0.353	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-34.3	-173.4	-49.2	-58.3	0	0	0	112.8	R90 D92 Y95	R90-D97 PolarHBondContact O-N 3.41Å; D92-D97 VanDerWaalsContact CA-OD2 3.3Å; D92-D97 WeakPolarHBondContact CA-OD2 3.49Å; D92-D97 WeakPolarHBondContact CB-OD2 3.33Å; D92-D97 PolarHBondContact N-OD2 3.39Å; Y95-D97 PolarHBondContact O-N 2.6Å
98	Y	86.2	Confident	85.4	Confident	150 Å²	150	70.7 Å²	70.7	59%	0.588	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.7	130.8	-175.8	-66.7	-85.2	0	0	0	111.3	A89 R90	A89-Y98 CarbonylContact C-O 3.56Å; A89-Y98 VanDerWaalsContact CA-O 3.24Å; A89-Y98 WeakPolarHBondContact CA-O 3.32Å; R90-Y98 VanDerWaalsContact CZ-CD2 3.42Å; R90-Y98 PolarHBondContact N-O 2.9Å
99	W	92.6	Very high	84.9	Confident	96 Å²	96	73.5 Å²	73.5	36%	0.364	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	139.6	177.3	-68.5	73.2	0	0	0	110.2	V29 L37 Y87 A89 F96	V29-W99 HydrophobicContact CB-CH2 4.13Å; V29-W99 HydrophobicContact CB-CZ3 3.82Å; V29-W99 HydrophobicContact CG1-CH2 4.07Å; V29-W99 HydrophobicContact CG1-CZ3 4Å; V29-W99 HydrophobicContact CG2-CH2 3.77Å; V29-W99 HydrophobicContact CG2-CZ3 3.85Å; L37-W99 HydrophobicContact CD1-CH2 3.86Å; L37-W99 HydrophobicContact CD1-CZ2 4.4Å; L37-W99 HydrophobicContact CD1-CZ3 4.43Å; Y87-W99 HydrophobicContact CG-CE3 4.07Å; Y87-W99 HydrophobicContact CG-CZ3 4.27Å; A89-W99 HydrophobicContact CB-CD2 3.8Å; A89-W99 HydrophobicContact CB-CE3 4.03Å; A89-W99 HydrophobicContact CB-CG 4.23Å; A89-W99 HydrophobicContact CB-CH2 4.45Å; A89-W99 HydrophobicContact CB-CZ2 4.26Å; A89-W99 HydrophobicContact CB-CZ3 4.35Å; F96-W99 HydrophobicContact CB-CZ2 3.84Å; F96-W99 VanDerWaalsContact CB-NE1 3.31Å; F96-W99 HydrophobicContact CD2-CH2 4.25Å; F96-W99 AromaticContact CD2-CZ2 3.52Å; F96-W99 HydrophobicContact CD2-CZ2 3.52Å; F96-W99 HydrophobicContact CE2-CZ2 4.28Å; F96-W99 AromaticContact CG-CZ2 3.8Å; F96-W99 HydrophobicContact CG-CZ2 3.8Å
100	G	93.1	Very high	84.4	Confident	28 Å²	28	77.3 Å²	77.3	29%	0.289	41%	0.414	S	S	.	.			trans	-66.4	162.1	164.9	0	0	0	0	0	111.1	C88 G102	C88-G100 PolarHBondContact O-N 3.19Å; G100-G102 PolarHBondContact O-N 2.8Å
101	Q	94.2	Very high	84.1	Confident	189 Å²	189	79.7 Å²	79.7	88%	0.883	43%	0.43	S	S	*	.			trans	-62.5	-15.2	179.5	-64	-61.7	-44.3	0	0	113.8
102	G	95.3	Very high	84.5	Confident	28 Å²	28	81.9 Å²	81.9	29%	0.289	44%	0.442	S	S	.	.			trans	84.1	150.3	-177.3	0	0	0	0	0	112.7	Y86 G100	Y86-G102 CarbonylContact O-C 3.56Å; Y86-G102 VanDerWaalsContact O-CA 3.24Å; Y86-G102 WeakPolarHBondContact O-CA 3.41Å; G100-G102 PolarHBondContact O-N 2.8Å
103	T	96.8	Very high	85.8	Confident	51 Å²	51	80.3 Å²	80.3	31%	0.313	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	118.5	174.7	-59.7	0	0	0	0	108.7	L12 Y86 L105	L12-T103 HydrophobicContact CD2-CG2 3.99Å; Y86-T103 PolarHBondContact N-O 3.4Å; Y86-T103 PolarHBondContact O-N 2.96Å; T103-L105 PolarHBondContact O-N 2.64Å
104	T	97.4	Very high	87.5	Confident	54 Å²	54	78.9 Å²	78.9	33%	0.331	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	121.3	171.6	-48.2	0	0	0	0	109.6	T1 E2	T1-T104 CarbonylContact C-O 3.43Å; T1-T104 WeakPolarHBondContact CA-O 3.33Å; T1-T104 HydrophobicContact CG2-CG2 3.97Å; E2-T104 PolarHBondContact N-O 2.94Å
105	L	96.9	Very high	89.5	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.8	171.4	-178.6	67.2	0	0	0	108.5	E2 V4 V10 L75 L78 S83 A84 Y86 T103 V107	E2-L105 HydrophobicContact CB-CD1 4.01Å; E2-L105 HydrophobicContact CG-CD1 4.28Å; E2-L105 WeakPolarHBondContact O-CA 3.4Å; V4-L105 HydrophobicContact CG1-CD1 4.24Å; V4-L105 HydrophobicContact CG2-CD1 3.84Å; V10-L105 HydrophobicContact CG1-CD1 4.2Å; V10-L105 HydrophobicContact CG1-CD2 3.91Å; V10-L105 HydrophobicContact CG2-CD1 4.34Å; L75-L105 HydrophobicContact CD1-CD2 4.16Å; L78-L105 HydrophobicContact CD1-CD2 4.11Å; L78-L105 HydrophobicContact CD2-CD2 4.09Å; S83-L105 VanDerWaalsContact CA-O 3.28Å; S83-L105 WeakPolarHBondContact CA-O 3.25Å; A84-L105 PolarHBondContact N-O 3.04Å; A84-L105 PolarHBondContact O-N 3.5Å; Y86-L105 HydrophobicContact CD2-CB 3.9Å; Y86-L105 HydrophobicContact CD2-CD2 4.35Å; Y86-L105 HydrophobicContact CE2-CB 3.81Å; Y86-L105 HydrophobicContact CE2-CD2 3.71Å; Y86-L105 HydrophobicContact CE2-CG 4.39Å; T103-L105 PolarHBondContact O-N 2.64Å; L105-V107 HydrophobicContact CG-CG2 4.4Å
106	T	97.1	Very high	91.3	Very high	52 Å²	52	70.1 Å²	70.1	32%	0.319	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.3	175.9	-56.8	0	0	0	0	109	E2 L3 V4	E2-T106 PolarHBondContact O-N 3.26Å; L3-T106 WeakPolarHBondContact CA-O 3.28Å; L3-T106 HydrophobicContact CD1-CG2 3.75Å; V4-T106 PolarHBondContact N-O 3.02Å
107	V	96.5	Very high	92.9	Very high	6 Å²	6	69.5 Å²	69.5	4%	0.036	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	109.5	179.5	-169.5	0	0	0	0	108.8	V4 P6 L78 T79 D82 S83 L105	V4-V107 HydrophobicContact CG2-CB 4.41Å; V4-V107 HydrophobicContact CG2-CG1 4.42Å; V4-V107 HydrophobicContact CG2-CG2 3.83Å; V4-V107 VanDerWaalsContact O-CA 3.32Å; V4-V107 WeakPolarHBondContact O-CA 3.12Å; P6-V107 HydrophobicContact CB-CG1 4.41Å; P6-V107 HydrophobicContact CG-CG1 4.14Å; L78-V107 HydrophobicContact CB-CG1 4.18Å; L78-V107 HydrophobicContact CB-CG2 4.08Å; L78-V107 HydrophobicContact CD1-CG2 4.37Å; T79-V107 WeakPolarHBondContact O-CB 3.31Å; T79-V107 WeakPolarHBondContact O-CG2 3.41Å; D82-V107 HydrophobicContact CB-CG2 4.23Å; S83-V107 PolarHBondContact OG-N 2.8Å; L105-V107 HydrophobicContact CG-CG2 4.4Å
108	S	92.8	Very high	94.4	Very high	114 Å²	114	69.8 Å²	69.8	80%	0.797	38%	0.383	S	S	*	.			trans	-147.2	0	-177.4	67.5	0	0	0	0	112.5	L3 V4	L3-S108 WeakPolarHBondContact CD1-OG 3.49Å; V4-S108 PolarHBondContact O-N 2.71Å; V4-S108 VanDerWaalsContact O-N 3.15Å

Retrieved 108 of 108 residues in 22.5 ms (Link to these results)

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