X5J4G7_MOUSE Loading...

IgG1 heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4G7, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 107 aa.

						>X5J4G7_MOUSE|X5J4G7
PELVKPGAPVKISCKASGYAFSSSWMNWVKQRPGKGLEWIGRIYPGDGDTNYNGKFKGKATLTADKSSSTAYMQLSSLTSEDSAVYFCARELPRGYWGQGTTLTVSS
					

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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	P	63.5	Low	85.2	Confident	143 Å²	143	81.5 Å²	81.5	93%	0.929	47%	0.469	S	S	*	.				0	118.1	0	-13	30.1	0	0	0	109.7	T102	P1-T102 CarbonylContact C-O 3.56Å; P1-T102 VanDerWaalsContact CA-O 3.26Å; P1-T102 WeakPolarHBondContact CA-O 3.45Å; P1-T102 HydrophobicContact CB-CG2 4.34Å
2	E	77.6	Confident	86	Confident	84 Å²	84	75 Å²	75	39%	0.393	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	119.3	178	-164.8	175	176.8	0	0	108.9	V4 V10 T102 L103 T104	E2-V4 HydrophobicContact CG-CG1 3.94Å; E2-V10 WeakPolarHBondContact OE1-CG2 3.42Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.29Å; E2-T102 PolarHBondContact N-O 3.27Å; E2-L103 HydrophobicContact CB-CD1 4.09Å; E2-L103 HydrophobicContact CG-CD1 4.46Å; E2-T104 PolarHBondContact O-N 3.23Å
3	L	83.5	Confident	86.8	Confident	133 Å²	133	74.8 Å²	74.8	70%	0.696	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	118.9	176.2	-177.6	68.6	0	0	0	108.5	T104	L3-T104 WeakPolarHBondContact CA-O 3.37Å; L3-T104 HydrophobicContact CD1-CG2 4.11Å
4	V	87.4	Confident	87.4	Confident	17 Å²	17	70.5 Å²	70.5	10%	0.103	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	147.9	-175.3	-62	0	0	0	0	111.4	E2 V10 L78 L103 T104 V105 S106	E2-V4 HydrophobicContact CG-CG1 3.94Å; V4-V10 HydrophobicContact CG1-CB 4.38Å; V4-V10 HydrophobicContact CG1-CG2 4.14Å; V4-L78 HydrophobicContact CB-CD1 4.31Å; V4-L78 HydrophobicContact CG2-CD1 3.63Å; V4-L103 HydrophobicContact CB-CD1 4.38Å; V4-L103 HydrophobicContact CG1-CD1 3.72Å; V4-L103 HydrophobicContact CG2-CD1 3.7Å; V4-L103 HydrophobicContact CG2-CG 4.18Å; V4-T104 PolarHBondContact N-O 2.91Å; V4-V105 HydrophobicContact CG2-CB 4.15Å; V4-V105 HydrophobicContact CG2-CG1 4.28Å; V4-V105 HydrophobicContact CG2-CG2 3.68Å; V4-V105 WeakPolarHBondContact O-CA 3.45Å; V4-S106 PolarHBondContact O-N 2.63Å
5	K	86.4	Confident	87.9	Confident	162 Å²	162	76.5 Å²	76.5	70%	0.704	43%	0.432	S	S	*	.			trans	-75.6	144.3	174.7	-64.9	-177.5	-178.7	-179.3	0	109.9	A8	K5-A8 HydrophobicContact CB-CB 4.47Å; K5-A8 WeakPolarHBondContact O-CB 3.3Å; K5-A8 PolarHBondContact O-N 3.24Å
6	P	87.5	Confident	88.1	Confident	64 Å²	64	72.4 Å²	72.4	42%	0.416	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	144.2	172.4	14.7	-21.6	0	0	0	110.9	A8 L78 V105 S106	P6-A8 PolarHBondContact O-N 3Å; P6-L78 WeakPolarHBondContact CA-O 3.18Å; P6-V105 HydrophobicContact CB-CG1 4.2Å; P6-S106 WeakPolarHBondContact CD-O 3.33Å; P6-S106 VanDerWaalsContact CD-OG 3.3Å; P6-S106 WeakPolarHBondContact CD-OG 3.39Å; P6-S106 VanDerWaalsContact CG-O 3.27Å; P6-S106 WeakPolarHBondContact CG-O 3.45Å
7	G	86.3	Confident	88.1	Confident	51 Å²	51	74.1 Å²	74.1	53%	0.526	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	-19.1	-176.3	0	0	0	0	0	115.5	L78	G7-L78 PolarHBondContact N-O 3.03Å
8	A	86.1	Confident	88	Confident	37 Å²	37	74.9 Å²	74.9	31%	0.306	46%	0.455	S	S	.	.			trans	-71.4	142.5	177	0	0	0	0	0	111	K5 P6 L78	K5-A8 HydrophobicContact CB-CB 4.47Å; K5-A8 WeakPolarHBondContact O-CB 3.3Å; K5-A8 PolarHBondContact O-N 3.24Å; P6-A8 PolarHBondContact O-N 3Å; A8-L78 VanDerWaalsContact O-CD1 3.23Å; A8-L78 WeakPolarHBondContact O-CD1 3.22Å; A8-L78 WeakPolarHBondContact O-CG 3.27Å
9	P	90.8	Very high	87.7	Confident	85 Å²	85	74.1 Å²	74.1	55%	0.552	44%	0.443	S	S	*	.			trans	-75.1	146.5	169.8	31.2	-33.2	0	0	0	110.6	L75	P9-L75 CarbonylContact C-O 3.35Å; P9-L75 WeakPolarHBondContact CA-O 3.44Å
10	V	93.4	Very high	87.8	Confident	5 Å²	5	73.3 Å²	73.3	3%	0.03	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	144	170	72.7	0	0	0	0	110	E2 V4 I12 Q74 L75 L78 L103	E2-V10 WeakPolarHBondContact OE1-CG2 3.42Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.29Å; V4-V10 HydrophobicContact CG1-CB 4.38Å; V4-V10 HydrophobicContact CG1-CG2 4.14Å; V10-I12 HydrophobicContact CG1-CG1 4.46Å; V10-Q74 CarbonylContact O-C 3.53Å; V10-Q74 VanDerWaalsContact O-CA 3.27Å; V10-Q74 WeakPolarHBondContact O-CA 3.41Å; V10-L75 HydrophobicContact CG1-CB 4.02Å; V10-L75 HydrophobicContact CG1-CD1 4.18Å; V10-L75 HydrophobicContact CG1-CG 4.5Å; V10-L75 PolarHBondContact N-O 3.04Å; V10-L75 PolarHBondContact O-N 2.84Å; V10-L78 HydrophobicContact CB-CD1 3.89Å; V10-L78 HydrophobicContact CG1-CD1 3.67Å; V10-L78 HydrophobicContact CG1-CD2 4.38Å; V10-L103 HydrophobicContact CB-CD1 4.38Å; V10-L103 HydrophobicContact CG1-CD1 4.13Å; V10-L103 HydrophobicContact CG1-CD2 3.84Å; V10-L103 HydrophobicContact CG2-CD1 3.99Å
11	K	94.9	Very high	87.9	Confident	115 Å²	115	70.1 Å²	70.1	50%	0.5	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	110.9	177.4	-174.5	175.8	178.7	178.6	0	109.7	Y72	K11-Y72 HydrophobicContact CD-CD1 4.32Å; K11-Y72 VanDerWaalsContact CE-CB 3.5Å; K11-Y72 HydrophobicContact CG-CD1 4.29Å
12	I	95.2	Very high	89.2	Confident	4 Å²	4	66.2 Å²	66.2	2%	0.021	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	133.1	177.1	-51.3	-175	0	0	0	108.3	V10 W28 Y72 M73 L75 Y86 T101	V10-I12 HydrophobicContact CG1-CG1 4.46Å; I12-W28 HydrophobicContact CB-CH2 4.34Å; I12-W28 HydrophobicContact CB-CZ3 4.1Å; I12-W28 HydrophobicContact CG2-CH2 4.09Å; I12-W28 HydrophobicContact CG2-CZ3 3.71Å; I12-Y72 CarbonylContact O-C 3.55Å; I12-Y72 VanDerWaalsContact O-CA 3.23Å; I12-Y72 WeakPolarHBondContact O-CA 3.33Å; I12-M73 HydrophobicContact CB-CE 4.43Å; I12-M73 HydrophobicContact CD1-CE 3.72Å; I12-M73 HydrophobicContact CG1-CE 4.34Å; I12-M73 PolarHBondContact N-O 2.83Å; I12-M73 PolarHBondContact O-N 2.91Å; I12-L75 HydrophobicContact CD1-CD1 4.47Å; I12-Y86 HydrophobicContact CD1-CD1 4.4Å; I12-Y86 HydrophobicContact CD1-CD2 3.79Å; I12-Y86 HydrophobicContact CD1-CG 3.67Å; I12-T101 HydrophobicContact CG2-CG2 4.34Å
13	S	95.8	Very high	89.8	Confident	73 Å²	73	65.3 Å²	65.3	51%	0.51	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	150	177.8	63.4	0	0	0	0	111.6	A71 Y72	S13-A71 CarbonylContact C-O 3.55Å; S13-A71 WeakPolarHBondContact CA-O 3.28Å; S13-Y72 VanDerWaalsContact CB-CD1 3.5Å
14	C	95.1	Very high	90.1	Very high	14 Å²	14	60.1 Å²	60.1	10%	0.095	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	108.2	172.9	176.6	0	0	0	0	109.2	W28 T70 A71 C88	C14-W28 HydrophobicContact CB-CH2 3.72Å; C14-W28 HydrophobicContact CB-CZ2 3.99Å; C14-W28 HydrophobicContact CB-CZ3 4.49Å; C14-T70 WeakPolarHBondContact O-CA 3.28Å; C14-A71 PolarHBondContact N-O 3.25Å; C14-A71 PolarHBondContact O-N 2.89Å; C14-C88 HydrophobicContact CB-CB 3.44Å; C14-C88 VanDerWaalsContact CB-CB 3.44Å; C14-C88 WeakPolarHBondContact CB-SG 3.31Å; C14-C88 WeakPolarHBondContact SG-CB 3.22Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.83Å
15	K	94.5	Very high	90.4	Very high	160 Å²	160	62.7 Å²	62.7	70%	0.696	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.5	177.7	-172.3	173	-177.3	177	0	109.8
16	A	91.4	Very high	90.8	Very high	11 Å²	11	55.2 Å²	55.2	9%	0.091	36%	0.355	C	S	.	.			trans	-80.2	146	174	0	0	0	0	0	111.2	Y19 F21 M26 S69	A16-Y19 HydrophobicContact CB-CE1 3.81Å; A16-Y19 HydrophobicContact CB-CE2 4.27Å; A16-Y19 VanDerWaalsContact CB-OH 3.22Å; A16-Y19 WeakPolarHBondContact CB-OH 3.31Å; A16-F21 HydrophobicContact CB-CB 4.08Å; A16-F21 HydrophobicContact CB-CD2 3.36Å; A16-F21 HydrophobicContact CB-CE2 4.07Å; A16-F21 HydrophobicContact CB-CG 4Å; A16-M26 HydrophobicContact CB-CE 4.29Å; A16-S69 WeakPolarHBondContact CB-O 3.41Å; A16-S69 PolarHBondContact N-O 2.81Å
17	S	88.9	Confident	91.2	Very high	101 Å²	101	52.7 Å²	52.7	71%	0.706	34%	0.338	S	S	*	.			trans	-146.4	151.6	173.8	60.4	0	0	0	0	110.2	Y19	S17-Y19 WeakPolarHBondContact O-CD1 3.18Å; S17-Y19 PolarHBondContact O-N 3.45Å
18	G	85.4	Confident	91.7	Very high	89 Å²	89	50.4 Å²	50.4	92%	0.918	31%	0.314	S	S	*	.	S	Bend	trans	77.4	11.4	174.6	0	0	0	0	0	116.2
19	Y	83.6	Confident	92.1	Very high	59 Å²	59	48.8 Å²	48.8	23%	0.231	30%	0.3	C	S	.	.	S	Bend	trans	-156.5	167.9	173.2	65.3	-83.3	0	0	0	111.8	A16 S17 F21 M26 R90	A16-Y19 HydrophobicContact CB-CE1 3.81Å; A16-Y19 HydrophobicContact CB-CE2 4.27Å; A16-Y19 VanDerWaalsContact CB-OH 3.22Å; A16-Y19 WeakPolarHBondContact CB-OH 3.31Å; S17-Y19 WeakPolarHBondContact O-CD1 3.18Å; S17-Y19 PolarHBondContact O-N 3.45Å; Y19-F21 PolarHBondContact O-N 2.81Å; Y19-M26 VanDerWaalsContact OH-CE 3.25Å; Y19-M26 WeakPolarHBondContact OH-CE 3.42Å; Y19-R90 HydrophobicContact CE2-CG 4.19Å
20	A	88.6	Confident	92.4	Very high	59 Å²	59	44.8 Å²	44.8	49%	0.488	27%	0.274	S	S	.	.			trans	-71.7	97.5	173.1	0	0	0	0	0	110.5	S22 S23	A20-S22 VanDerWaalsContact C-N 3.26Å; A20-S22 PolarHBondContact O-N 2.9Å; A20-S23 VanDerWaalsContact CB-OG 3.31Å; A20-S23 WeakPolarHBondContact CB-OG 3.36Å; A20-S23 PolarHBondContact O-N 3.01Å; A20-S23 VanDerWaalsContact O-N 3.14Å; A20-S23 PolarHBondContact O-OG 2.8Å; A20-S23 VanDerWaalsContact O-OG 3.1Å
21	F	90.4	Very high	92.4	Very high	7 Å²	7	48.1 Å²	48.1	3%	0.031	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-57.9	-37	-177.4	175.9	-113.7	0	0	0	113.2	A16 Y19 S23 M26 P45 A64 S69 A71	A16-F21 HydrophobicContact CB-CB 4.08Å; A16-F21 HydrophobicContact CB-CD2 3.36Å; A16-F21 HydrophobicContact CB-CE2 4.07Å; A16-F21 HydrophobicContact CB-CG 4Å; Y19-F21 PolarHBondContact O-N 2.81Å; F21-S23 PolarHBondContact O-N 2.79Å; F21-M26 HydrophobicContact CD2-CE 4.28Å; F21-M26 HydrophobicContact CE2-CE 3.82Å; F21-P45 HydrophobicContact CD1-CB 3.8Å; F21-P45 HydrophobicContact CD1-CG 4.04Å; F21-P45 HydrophobicContact CD2-CG 4.02Å; F21-P45 HydrophobicContact CE1-CB 3.46Å; F21-P45 VanDerWaalsContact CE1-CB 3.46Å; F21-P45 HydrophobicContact CE1-CG 3.63Å; F21-P45 HydrophobicContact CE2-CB 4.36Å; F21-P45 HydrophobicContact CE2-CG 3.59Å; F21-P45 HydrophobicContact CG-CB 4.41Å; F21-P45 HydrophobicContact CG-CG 4.25Å; F21-P45 HydrophobicContact CZ-CB 3.77Å; F21-P45 HydrophobicContact CZ-CG 3.38Å; F21-P45 WeakPolarHBondContact O-CG 3.2Å; F21-A64 HydrophobicContact CE1-CB 4.04Å; F21-A64 HydrophobicContact CZ-CB 3.93Å; F21-S69 VanDerWaalsContact CD1-CA 3.49Å; F21-A71 HydrophobicContact CE2-CB 4.1Å; F21-A71 HydrophobicContact CZ-CB 3.91Å
22	S	91	Very high	92.3	Very high	61 Å²	61	45 Å²	45	43%	0.427	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-71	-9.8	179.8	52.9	0	0	0	0	114.8	A20 G46	A20-S22 VanDerWaalsContact C-N 3.26Å; A20-S22 PolarHBondContact O-N 2.9Å; S22-G46 WeakPolarHBondContact O-CA 3.32Å; S22-G46 PolarHBondContact O-N 3.44Å; S22-G46 VanDerWaalsContact O-N 3.14Å
23	S	90.3	Very high	91.9	Very high	65 Å²	65	50.5 Å²	50.5	46%	0.455	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-114.5	14.9	-179.3	65.8	0	0	0	0	113.8	A20 F21 Y44	A20-S23 VanDerWaalsContact CB-OG 3.31Å; A20-S23 WeakPolarHBondContact CB-OG 3.36Å; A20-S23 PolarHBondContact O-N 3.01Å; A20-S23 VanDerWaalsContact O-N 3.14Å; A20-S23 PolarHBondContact O-OG 2.8Å; A20-S23 VanDerWaalsContact O-OG 3.1Å; F21-S23 PolarHBondContact O-N 2.79Å; S23-Y44 VanDerWaalsContact C-CE2 3.44Å; S23-Y44 WeakPolarHBondContact CA-OH 3.45Å
24	S	89.8	Confident	91.6	Very high	24 Å²	24	51.5 Å²	51.5	17%	0.168	33%	0.331	C	S	.	.	S	Bend	trans	-135.8	140.3	-175.3	-63.7	0	0	0	0	111.9	P45	S24-P45 WeakPolarHBondContact O-CD 3.36Å
25	W	92.8	Very high	91.3	Very high	71 Å²	71	57.1 Å²	57.1	27%	0.269	35%	0.354	S	S	.	.			trans	-67.1	138.5	171.7	-72.2	96.2	0	0	0	110.9	R42 Y44 D49 R90	W25-R42 HydrophobicContact CD2-CG 4.25Å; W25-R42 HydrophobicContact CE3-CB 3.99Å; W25-R42 HydrophobicContact CE3-CG 3.44Å; W25-R42 VanDerWaalsContact CE3-CG 3.44Å; W25-R42 HydrophobicContact CZ3-CG 3.76Å; W25-Y44 AromaticContact CD1-CD2 3.92Å; W25-Y44 AromaticContact CD2-CD2 3.91Å; W25-Y44 HydrophobicContact CD2-CD2 3.91Å; W25-Y44 HydrophobicContact CD2-CG 4.31Å; W25-Y44 AromaticContact CE2-CD2 3.8Å; W25-Y44 VanDerWaalsContact CE3-N 3.27Å; W25-Y44 AromaticContact CG-CD2 4Å; W25-Y44 HydrophobicContact CG-CD2 4Å; W25-Y44 HydrophobicContact CZ2-CD2 4.36Å; W25-Y44 HydrophobicContact CZ2-CG 4.24Å; W25-Y44 AromaticContact NE1-CD2 3.78Å; W25-D49 HydrophobicContact CH2-CB 3.94Å; W25-D49 WeakPolarHBondContact CH2-OD2 3.21Å; W25-D49 WeakPolarHBondContact CZ3-O 3.35Å; W25-R90 WeakPolarHBondContact O-CA 2.99Å; W25-R90 VanDerWaalsContact O-O 3.05Å
26	M	94.8	Very high	91.1	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.02	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.2	168.3	-174.7	67.6	73.2	0	0	109.1	A16 Y19 F21 R42 I43 A71 C88	A16-M26 HydrophobicContact CB-CE 4.29Å; Y19-M26 VanDerWaalsContact OH-CE 3.25Å; Y19-M26 WeakPolarHBondContact OH-CE 3.42Å; F21-M26 HydrophobicContact CD2-CE 4.28Å; F21-M26 HydrophobicContact CE2-CE 3.82Å; M26-R42 CarbonylContact O-C 3.55Å; M26-R42 WeakPolarHBondContact O-CA 3.22Å; M26-R42 WeakPolarHBondContact O-CB 3.27Å; M26-I43 HydrophobicContact CB-CG2 4.04Å; M26-I43 PolarHBondContact N-O 2.98Å; M26-I43 PolarHBondContact O-N 3.4Å; M26-A71 HydrophobicContact CB-CB 4.18Å; M26-A71 HydrophobicContact CE-CB 4.43Å; M26-A71 HydrophobicContact CG-CB 3.7Å; M26-C88 HydrophobicContact CG-CB 4.39Å; M26-C88 HydrophobicContact SD-CB 3.75Å
27	N	95.8	Very high	91.2	Very high	12 Å²	12	56.2 Å²	56.2	6%	0.064	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	149.1	176.8	-59.2	-91.2	0	0	0	110.5	W39 G41 R42 C88 A89 R90 L92	N27-W39 PolarHBondContact OD1-NE1 2.98Å; N27-W39 VanDerWaalsContact OD1-NE1 3.16Å; N27-G41 CarbonylContact C-O 3.5Å; N27-G41 WeakPolarHBondContact CA-O 3.38Å; N27-R42 HydrophobicContact CB-CB 4.44Å; N27-R42 WeakPolarHBondContact OD1-CB 3.46Å; N27-C88 CarbonylContact O-C 3.53Å; N27-C88 WeakPolarHBondContact O-CA 3.26Å; N27-A89 WeakPolarHBondContact CA-O 3.48Å; N27-A89 HydrophobicContact CB-CB 4.47Å; N27-A89 VanDerWaalsContact CB-O 3.26Å; N27-A89 WeakPolarHBondContact CB-O 3.41Å; N27-A89 PolarHBondContact N-O 3.34Å; N27-A89 PolarHBondContact ND2-O 3.01Å; N27-A89 PolarHBondContact O-N 2.86Å; N27-R90 PolarHBondContact ND2-O 3.26Å; N27-R90 VanDerWaalsContact ND2-O 3.14Å; N27-L92 HydrophobicContact CB-CD1 3.76Å; N27-L92 HydrophobicContact CB-CG 4.16Å
28	W	96.8	Very high	91.4	Very high	3 Å²	3	53 Å²	53	1%	0.011	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134.4	172.6	-69.7	91.7	0	0	0	109.9	I12 C14 I40 G41 L62 A71 M73 F87 C88	I12-W28 HydrophobicContact CB-CH2 4.34Å; I12-W28 HydrophobicContact CB-CZ3 4.1Å; I12-W28 HydrophobicContact CG2-CH2 4.09Å; I12-W28 HydrophobicContact CG2-CZ3 3.71Å; C14-W28 HydrophobicContact CB-CH2 3.72Å; C14-W28 HydrophobicContact CB-CZ2 3.99Å; C14-W28 HydrophobicContact CB-CZ3 4.49Å; W28-I40 HydrophobicContact CB-CB 4.14Å; W28-I40 HydrophobicContact CB-CD1 4.32Å; W28-I40 WeakPolarHBondContact O-CB 3.07Å; W28-I40 PolarHBondContact O-N 2.6Å; W28-G41 PolarHBondContact N-O 3.5Å; W28-L62 VanDerWaalsContact CD1-CD2 3.47Å; W28-L62 HydrophobicContact CG-CD2 3.98Å; W28-A71 HydrophobicContact CZ2-CB 4.11Å; W28-M73 HydrophobicContact CB-SD 3.95Å; W28-M73 HydrophobicContact CD2-CB 3.61Å; W28-M73 HydrophobicContact CD2-CG 4.42Å; W28-M73 HydrophobicContact CD2-SD 4.13Å; W28-M73 HydrophobicContact CE3-CB 3.81Å; W28-M73 HydrophobicContact CE3-CE 3.9Å; W28-M73 HydrophobicContact CE3-SD 4.08Å; W28-M73 HydrophobicContact CG-CB 4.15Å; W28-M73 HydrophobicContact CG-SD 4.1Å; W28-M73 HydrophobicContact CH2-CB 4.05Å; W28-M73 HydrophobicContact CZ2-CB 3.88Å; W28-M73 HydrophobicContact CZ3-CB 4.02Å; W28-M73 HydrophobicContact CZ3-CE 4.34Å; W28-F87 CarbonylContact C-O 3.51Å; W28-F87 WeakPolarHBondContact CA-O 3.36Å; W28-C88 HydrophobicContact CD2-CB 4.5Å; W28-C88 HydrophobicContact CE3-CB 4.29Å; W28-C88 HydrophobicContact CH2-CB 4.4Å; W28-C88 HydrophobicContact CZ3-CB 4.24Å
29	V	95.9	Very high	91.9	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.018	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	134.9	-172.8	-175.8	0	0	0	0	109.4	L37 E38 Y86 F87 L92 W97	V29-L37 HydrophobicContact CG1-CB 3.79Å; V29-L37 HydrophobicContact CG1-CD2 3.95Å; V29-L37 HydrophobicContact CG1-CG 4.36Å; V29-E38 CarbonylContact C-O 3.58Å; V29-E38 WeakPolarHBondContact CA-O 3.42Å; V29-Y86 CarbonylContact O-C 3.6Å; V29-Y86 WeakPolarHBondContact O-CA 3.4Å; V29-F87 HydrophobicContact CB-CB 4.5Å; V29-F87 PolarHBondContact N-O 2.84Å; V29-F87 PolarHBondContact O-N 3.28Å; V29-L92 HydrophobicContact CG2-CD1 4.14Å; V29-L92 HydrophobicContact CG2-CD2 4.4Å; V29-W97 HydrophobicContact CB-CH2 4.31Å; V29-W97 HydrophobicContact CB-CZ3 3.91Å; V29-W97 HydrophobicContact CG1-CH2 4.24Å; V29-W97 HydrophobicContact CG1-CZ3 4.14Å; V29-W97 HydrophobicContact CG2-CH2 3.93Å; V29-W97 HydrophobicContact CG2-CZ3 3.84Å
30	K	95.4	Very high	92.5	Very high	1 Å²	1	49.3 Å²	49.3	0%	0.004	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	135.3	174	-178.5	179	-179.6	178.5	0	109.5	E38 I40 F56 E81 D82 A84 Y86	K30-E38 HydrophobicContact CB-CB 4.32Å; K30-E38 PolarHBondContact N-O 2.92Å; K30-E38 PolarHBondContact O-N 3.19Å; K30-I40 HydrophobicContact CB-CD1 3.97Å; K30-I40 HydrophobicContact CB-CG1 4.13Å; K30-F56 HydrophobicContact CB-CZ 4.44Å; K30-F56 HydrophobicContact CD-CE1 3.96Å; K30-F56 HydrophobicContact CD-CZ 4.07Å; K30-E81 PolarHBondContact NZ-O 2.74Å; K30-D82 IonicContact NZ-OD1 2.74Å; K30-D82 PolarHBondContact NZ-OD1 2.88Å; K30-A84 HydrophobicContact CD-CB 4.17Å; K30-A84 HydrophobicContact CG-CB 3.54Å; K30-Y86 HydrophobicContact CB-CD1 4.08Å; K30-Y86 HydrophobicContact CB-CE1 3.84Å; K30-Y86 HydrophobicContact CD-CE1 3.89Å; K30-Y86 WeakPolarHBondContact CE-OH 3.47Å; K30-Y86 HydrophobicContact CG-CD1 4.26Å; K30-Y86 HydrophobicContact CG-CE1 3.7Å
31	Q	95	Very high	92.9	Very high	74 Å²	74	46.5 Å²	46.5	35%	0.346	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	118.1	170.6	-168.3	-179	33.9	0	0	109.9	L37 A84 V85 F87	Q31-L37 HydrophobicContact CB-CD2 3.84Å; Q31-L37 HydrophobicContact CG-CD2 3.89Å; Q31-A84 WeakPolarHBondContact O-CA 3.4Å; Q31-A84 VanDerWaalsContact O-CB 3.3Å; Q31-A84 WeakPolarHBondContact O-CB 3.34Å; Q31-V85 PolarHBondContact N-O 2.83Å; Q31-V85 PolarHBondContact O-N 3.16Å; Q31-F87 HydrophobicContact CB-CD2 4.33Å; Q31-F87 HydrophobicContact CB-CE2 3.75Å
32	R	92.4	Very high	93.2	Very high	51 Å²	51	50.5 Å²	50.5	19%	0.192	29%	0.292	C	S	.	.			trans	-91	147.5	172.2	-56.4	-173.8	-146.7	-162.7	0.8	110.1	G34 K35 E38 E81 A84	R32-G34 PolarHBondContact O-N 3.07Å; R32-K35 HydrophobicContact CB-CB 4.07Å; R32-K35 HydrophobicContact CB-CD 4.37Å; R32-K35 HydrophobicContact CB-CG 4.13Å; R32-K35 PolarHBondContact O-N 3.16Å; R32-E38 IonicContact CZ-OE2 3.01Å; R32-E38 IonicContact NE-OE2 2.89Å; R32-E38 PolarHBondContact NE-OE2 3.25Å; R32-E38 IonicContact NH2-OE1 3.37Å; R32-E38 IonicContact NH2-OE2 3.28Å; R32-E38 PolarHBondContact NH2-OE2 3.47Å; R32-E81 PolarHBondContact NH1-O 2.87Å; R32-A84 HydrophobicContact CG-CB 4.22Å
33	P	87.3	Confident	93.4	Very high	119 Å²	119	47.8 Å²	47.8	77%	0.773	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	128.1	171.6	-25.2	34.3	0	0	0	111.1	K35	P33-K35 PolarHBondContact O-N 3.06Å
34	G	88.4	Confident	93.7	Very high	93 Å²	93	47.6 Å²	47.6	96%	0.959	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	6	-179.4	0	0	0	0	0	115.8	R32	R32-G34 PolarHBondContact O-N 3.07Å
35	K	89.8	Confident	93.9	Very high	133 Å²	133	46.5 Å²	46.5	58%	0.578	26%	0.255	S	S	*	.	S	Bend	trans	-118.5	161.2	173.8	-54.1	-157.7	-178.7	-171.3	0	111.8	R32 P33	R32-K35 HydrophobicContact CB-CB 4.07Å; R32-K35 HydrophobicContact CB-CD 4.37Å; R32-K35 HydrophobicContact CB-CG 4.13Å; R32-K35 PolarHBondContact O-N 3.16Å; P33-K35 PolarHBondContact O-N 3.06Å
36	G	89.8	Confident	94	Very high	56 Å²	56	44.4 Å²	44.4	58%	0.577	26%	0.255	S	S	*	.			trans	-67.8	174.9	173.7	0	0	0	0	0	113.4
37	L	92.8	Very high	94	Very high	95 Å²	95	49.7 Å²	49.7	50%	0.497	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	127.6	174.5	-63.6	173.5	0	0	0	110.5	V29 Q31 W97	V29-L37 HydrophobicContact CG1-CB 3.79Å; V29-L37 HydrophobicContact CG1-CD2 3.95Å; V29-L37 HydrophobicContact CG1-CG 4.36Å; Q31-L37 HydrophobicContact CB-CD2 3.84Å; Q31-L37 HydrophobicContact CG-CD2 3.89Å; L37-W97 HydrophobicContact CD1-CH2 3.86Å; L37-W97 HydrophobicContact CD1-CZ2 4.35Å
38	E	94.6	Very high	93.9	Very high	35 Å²	35	51 Å²	51	16%	0.164	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	110.7	174.8	-59.5	-170.7	90.5	0	0	109.1	V29 K30 R32 I40 K55 F56	V29-E38 CarbonylContact C-O 3.58Å; V29-E38 WeakPolarHBondContact CA-O 3.42Å; K30-E38 HydrophobicContact CB-CB 4.32Å; K30-E38 PolarHBondContact N-O 2.92Å; K30-E38 PolarHBondContact O-N 3.19Å; R32-E38 IonicContact CZ-OE2 3.01Å; R32-E38 IonicContact NE-OE2 2.89Å; R32-E38 PolarHBondContact NE-OE2 3.25Å; R32-E38 IonicContact NH2-OE1 3.37Å; R32-E38 IonicContact NH2-OE2 3.28Å; R32-E38 PolarHBondContact NH2-OE2 3.47Å; E38-I40 PolarHBondContact O-N 2.88Å; E38-K55 IonicContact OE1-NZ 3.93Å; E38-F56 HydrophobicContact CB-CE2 4.33Å; E38-F56 HydrophobicContact CB-CZ 4.24Å
39	W	95.2	Very high	93.8	Very high	70 Å²	70	55 Å²	55	27%	0.265	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	127.8	174.6	-177.7	78.5	0	0	0	110.6	N27 G41 R42 N51 N53 L92	N27-W39 PolarHBondContact OD1-NE1 2.98Å; N27-W39 VanDerWaalsContact OD1-NE1 3.16Å; W39-G41 VanDerWaalsContact CZ2-CA 3.4Å; W39-G41 PolarHBondContact NE1-O 3.28Å; W39-R42 HydrophobicContact CZ2-CB 4.03Å; W39-R42 HydrophobicContact CZ2-CG 3.85Å; W39-N51 HydrophobicContact CH2-CB 4.38Å; W39-N51 WeakPolarHBondContact CH2-OD1 2.97Å; W39-N53 HydrophobicContact CE3-CB 3.75Å; W39-N53 HydrophobicContact CZ3-CB 3.94Å; W39-N53 WeakPolarHBondContact O-CB 3.35Å; W39-N53 PolarHBondContact O-ND2 3.44Å; W39-L92 VanDerWaalsContact CD1-CD1 3.45Å
40	I	96.4	Very high	93.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-48	-176.6	-59.2	175	0	0	0	110.2	W28 K30 E38 N53 F56 A60 M73 Y86	W28-I40 HydrophobicContact CB-CB 4.14Å; W28-I40 HydrophobicContact CB-CD1 4.32Å; W28-I40 WeakPolarHBondContact O-CB 3.07Å; W28-I40 PolarHBondContact O-N 2.6Å; K30-I40 HydrophobicContact CB-CD1 3.97Å; K30-I40 HydrophobicContact CB-CG1 4.13Å; E38-I40 PolarHBondContact O-N 2.88Å; I40-N53 WeakPolarHBondContact O-CB 3.47Å; I40-N53 PolarHBondContact O-N 2.9Å; I40-F56 HydrophobicContact CB-CD2 4.29Å; I40-F56 HydrophobicContact CB-CG 4.21Å; I40-F56 HydrophobicContact CG1-CD1 4.15Å; I40-F56 HydrophobicContact CG1-CD2 4.28Å; I40-F56 HydrophobicContact CG1-CE1 4.07Å; I40-F56 HydrophobicContact CG1-CE2 4.19Å; I40-F56 HydrophobicContact CG1-CG 4.25Å; I40-F56 HydrophobicContact CG1-CZ 4.08Å; I40-F56 HydrophobicContact CG2-CB 3.71Å; I40-F56 HydrophobicContact CG2-CD1 4.04Å; I40-F56 HydrophobicContact CG2-CD2 4.34Å; I40-F56 HydrophobicContact CG2-CG 3.78Å; I40-A60 HydrophobicContact CG2-CB 3.7Å; I40-M73 HydrophobicContact CD1-CE 4.07Å; I40-M73 HydrophobicContact CD1-SD 3.52Å; I40-M73 VanDerWaalsContact CD1-SD 3.52Å; I40-M73 HydrophobicContact CG2-SD 4.01Å; I40-Y86 HydrophobicContact CD1-CD1 3.72Å; I40-Y86 HydrophobicContact CD1-CE1 3.86Å
41	G	96.5	Very high	93.9	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.1	-178.9	-173	0	0	0	0	0	111.6	N27 W28 W39 N51	N27-G41 CarbonylContact C-O 3.5Å; N27-G41 WeakPolarHBondContact CA-O 3.38Å; W28-G41 PolarHBondContact N-O 3.5Å; W39-G41 VanDerWaalsContact CZ2-CA 3.4Å; W39-G41 PolarHBondContact NE1-O 3.28Å; G41-N51 CarbonylContact C-O 3.47Å; G41-N51 WeakPolarHBondContact CA-O 3.39Å
42	R	96.1	Very high	94	Very high	90 Å²	90	60 Å²	60	34%	0.34	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	155.1	174	67.4	-177.1	-173.7	-168.7	-0.1	111.5	W25 M26 N27 W39 T50 N51	W25-R42 HydrophobicContact CD2-CG 4.25Å; W25-R42 HydrophobicContact CE3-CB 3.99Å; W25-R42 HydrophobicContact CE3-CG 3.44Å; W25-R42 VanDerWaalsContact CE3-CG 3.44Å; W25-R42 HydrophobicContact CZ3-CG 3.76Å; M26-R42 CarbonylContact O-C 3.55Å; M26-R42 WeakPolarHBondContact O-CA 3.22Å; M26-R42 WeakPolarHBondContact O-CB 3.27Å; N27-R42 HydrophobicContact CB-CB 4.44Å; N27-R42 WeakPolarHBondContact OD1-CB 3.46Å; W39-R42 HydrophobicContact CZ2-CB 4.03Å; W39-R42 HydrophobicContact CZ2-CG 3.85Å; R42-T50 WeakPolarHBondContact O-CA 3.04Å; R42-N51 HydrophobicContact CG-CB 4.12Å; R42-N51 PolarHBondContact N-O 2.86Å; R42-N51 PolarHBondContact O-N 2.88Å
43	I	96.8	Very high	94.1	Very high	5 Å²	5	59.9 Å²	59.9	3%	0.026	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.1	174	-177	165.5	0	0	0	110	M26 P45 D49 T50 L62 T63 A64	M26-I43 HydrophobicContact CB-CG2 4.04Å; M26-I43 PolarHBondContact N-O 2.98Å; M26-I43 PolarHBondContact O-N 3.4Å; I43-P45 WeakPolarHBondContact O-CD 3.36Å; I43-D49 CarbonylContact C-O 3.53Å; I43-D49 VanDerWaalsContact CA-O 3.31Å; I43-D49 WeakPolarHBondContact CA-O 3.42Å; I43-T50 HydrophobicContact CB-CG2 3.98Å; I43-T50 HydrophobicContact CD1-CG2 3.97Å; I43-T50 HydrophobicContact CG1-CG2 3.81Å; I43-L62 HydrophobicContact CB-CB 4.08Å; I43-L62 HydrophobicContact CB-CD1 4.45Å; I43-L62 HydrophobicContact CD1-CB 4.38Å; I43-L62 HydrophobicContact CG2-CB 4.4Å; I43-T63 VanDerWaalsContact CD1-C 3.49Å; I43-A64 HydrophobicContact CD1-CB 3.92Å
44	Y	95.5	Very high	94.4	Very high	60 Å²	60	57.2 Å²	57.2	24%	0.235	35%	0.345	C	S	.	.			trans	-98.8	107.5	168.3	-168.1	-109	0	0	0	108.5	S23 W25 G46 D47 G48 D49	S23-Y44 VanDerWaalsContact C-CE2 3.44Å; S23-Y44 WeakPolarHBondContact CA-OH 3.45Å; W25-Y44 AromaticContact CD1-CD2 3.92Å; W25-Y44 AromaticContact CD2-CD2 3.91Å; W25-Y44 HydrophobicContact CD2-CD2 3.91Å; W25-Y44 HydrophobicContact CD2-CG 4.31Å; W25-Y44 AromaticContact CE2-CD2 3.8Å; W25-Y44 VanDerWaalsContact CE3-N 3.27Å; W25-Y44 AromaticContact CG-CD2 4Å; W25-Y44 HydrophobicContact CG-CD2 4Å; W25-Y44 HydrophobicContact CZ2-CD2 4.36Å; W25-Y44 HydrophobicContact CZ2-CG 4.24Å; W25-Y44 AromaticContact NE1-CD2 3.78Å; Y44-G46 PolarHBondContact O-N 2.91Å; Y44-G46 VanDerWaalsContact O-N 3.1Å; Y44-D47 WeakPolarHBondContact CD1-OD1 3.23Å; Y44-G48 VanDerWaalsContact O-CA 3.26Å; Y44-G48 WeakPolarHBondContact O-CA 3.32Å; Y44-G48 PolarHBondContact O-N 2.86Å; Y44-D49 PolarHBondContact N-O 2.79Å
45	P	94.9	Very high	94.5	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.013	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.5	-174.5	-22.8	35.6	0	0	0	114.1	F21 S24 I43 A64 K66	F21-P45 HydrophobicContact CD1-CB 3.8Å; F21-P45 HydrophobicContact CD1-CG 4.04Å; F21-P45 HydrophobicContact CD2-CG 4.02Å; F21-P45 HydrophobicContact CE1-CB 3.46Å; F21-P45 VanDerWaalsContact CE1-CB 3.46Å; F21-P45 HydrophobicContact CE1-CG 3.63Å; F21-P45 HydrophobicContact CE2-CB 4.36Å; F21-P45 HydrophobicContact CE2-CG 3.59Å; F21-P45 HydrophobicContact CG-CB 4.41Å; F21-P45 HydrophobicContact CG-CG 4.25Å; F21-P45 HydrophobicContact CZ-CB 3.77Å; F21-P45 HydrophobicContact CZ-CG 3.38Å; F21-P45 WeakPolarHBondContact O-CG 3.2Å; S24-P45 WeakPolarHBondContact O-CD 3.36Å; I43-P45 WeakPolarHBondContact O-CD 3.36Å; P45-A64 HydrophobicContact CB-CB 3.75Å; P45-A64 HydrophobicContact CG-CB 4.04Å; P45-K66 WeakPolarHBondContact O-CD 3.3Å; P45-K66 WeakPolarHBondContact O-CE 3.46Å
46	G	93.5	Very high	94.6	Very high	26 Å²	26	54.3 Å²	54.3	27%	0.268	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-50.3	-179.2	0	0	0	0	0	113.2	S22 Y44 K66	S22-G46 WeakPolarHBondContact O-CA 3.32Å; S22-G46 PolarHBondContact O-N 3.44Å; S22-G46 VanDerWaalsContact O-N 3.14Å; Y44-G46 PolarHBondContact O-N 2.91Å; Y44-G46 VanDerWaalsContact O-N 3.1Å; G46-K66 PolarHBondContact O-NZ 3.46Å
47	D	94.3	Very high	94.7	Very high	115 Å²	115	59.4 Å²	59.4	62%	0.615	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	-9.7	-178.2	55.4	20.7	0	0	0	113.2	Y44 D49	Y44-D47 WeakPolarHBondContact CD1-OD1 3.23Å; D47-D49 VanDerWaalsContact OD1-CB 3.28Å; D47-D49 WeakPolarHBondContact OD1-CB 3.45Å; D47-D49 PolarHBondContact OD1-N 3.16Å
48	G	93.9	Very high	94.6	Very high	41 Å²	41	58.2 Å²	58.2	42%	0.423	32%	0.323	S	S	.	.			trans	84.7	11.1	-177.8	0	0	0	0	0	114	Y44	Y44-G48 VanDerWaalsContact O-CA 3.26Å; Y44-G48 WeakPolarHBondContact O-CA 3.32Å; Y44-G48 PolarHBondContact O-N 2.86Å
49	D	95.9	Very high	94.5	Very high	87 Å²	87	58.9 Å²	58.9	47%	0.465	33%	0.326	S	S	.	.			trans	-60.4	140.1	176.9	-172.1	23.3	0	0	0	110.8	W25 I43 Y44 D47	W25-D49 HydrophobicContact CH2-CB 3.94Å; W25-D49 WeakPolarHBondContact CH2-OD2 3.21Å; W25-D49 WeakPolarHBondContact CZ3-O 3.35Å; I43-D49 CarbonylContact C-O 3.53Å; I43-D49 VanDerWaalsContact CA-O 3.31Å; I43-D49 WeakPolarHBondContact CA-O 3.42Å; Y44-D49 PolarHBondContact N-O 2.79Å; D47-D49 VanDerWaalsContact OD1-CB 3.28Å; D47-D49 WeakPolarHBondContact OD1-CB 3.45Å; D47-D49 PolarHBondContact OD1-N 3.16Å
50	T	96.9	Very high	94.5	Very high	46 Å²	46	55.7 Å²	55.7	28%	0.282	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139.6	-176	54.5	0	0	0	0	111.6	R42 I43 Y52 L62	R42-T50 WeakPolarHBondContact O-CA 3.04Å; I43-T50 HydrophobicContact CB-CG2 3.98Å; I43-T50 HydrophobicContact CD1-CG2 3.97Å; I43-T50 HydrophobicContact CG1-CG2 3.81Å; T50-Y52 HydrophobicContact CG2-CE2 4.5Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.26Å; T50-L62 HydrophobicContact CG2-CB 4.12Å
51	N	95.9	Very high	94.6	Very high	78 Å²	78	59.1 Å²	59.1	42%	0.417	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136.5	171.8	-172.4	-125.5	0	0	0	109.8	W39 G41 R42	W39-N51 HydrophobicContact CH2-CB 4.38Å; W39-N51 WeakPolarHBondContact CH2-OD1 2.97Å; G41-N51 CarbonylContact C-O 3.47Å; G41-N51 WeakPolarHBondContact CA-O 3.39Å; R42-N51 HydrophobicContact CG-CB 4.12Å; R42-N51 PolarHBondContact N-O 2.86Å; R42-N51 PolarHBondContact O-N 2.88Å
52	Y	96.6	Very high	94.6	Very high	58 Å²	58	59.5 Å²	59.5	23%	0.227	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	146.8	-174	-66	-90.2	0	0	0	110.6	T50 A60 L62	T50-Y52 HydrophobicContact CG2-CE2 4.5Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.26Å; Y52-A60 HydrophobicContact CE1-CB 4.41Å; Y52-A60 WeakPolarHBondContact CE1-O 3.26Å; Y52-L62 HydrophobicContact CE1-CD1 4.06Å; Y52-L62 HydrophobicContact CE1-CG 3.71Å; Y52-L62 PolarHBondContact OH-N 3.26Å
53	N	95.1	Very high	94.7	Very high	49 Å²	49	58.2 Å²	58.2	26%	0.262	34%	0.339	S	S	.	.			trans	-70.2	135.3	159.1	-177.1	-23.7	0	0	0	108.8	W39 I40 K55 F56 K57	W39-N53 HydrophobicContact CE3-CB 3.75Å; W39-N53 HydrophobicContact CZ3-CB 3.94Å; W39-N53 WeakPolarHBondContact O-CB 3.35Å; W39-N53 PolarHBondContact O-ND2 3.44Å; I40-N53 WeakPolarHBondContact O-CB 3.47Å; I40-N53 PolarHBondContact O-N 2.9Å; N53-K55 PolarHBondContact O-N 3.12Å; N53-K55 PolarHBondContact OD1-N 2.96Å; N53-K55 VanDerWaalsContact OD1-N 3.16Å; N53-F56 HydrophobicContact CB-CD2 4.04Å; N53-F56 PolarHBondContact O-N 2.88Å; N53-K57 PolarHBondContact O-N 3.05Å
54	G	93.1	Very high	94.7	Very high	62 Å²	62	59.6 Å²	59.6	64%	0.639	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-51.3	-33.6	-179.8	0	0	0	0	0	113.9	F56 K57	G54-F56 PolarHBondContact O-N 2.78Å; G54-K57 PolarHBondContact O-N 2.86Å
55	K	90.8	Very high	94.7	Very high	156 Å²	156	59.4 Å²	59.4	68%	0.678	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-63.4	-26.4	177.4	-68	-175.8	179.1	-179.6	0	114.5	E38 N53	E38-K55 IonicContact OE1-NZ 3.93Å; N53-K55 PolarHBondContact O-N 3.12Å; N53-K55 PolarHBondContact OD1-N 2.96Å; N53-K55 VanDerWaalsContact OD1-N 3.16Å
56	F	92.7	Very high	94.6	Very high	9 Å²	9	65 Å²	65	4%	0.039	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-111.7	-2.8	-174.2	-62.8	-86.4	0	0	0	112.7	K30 E38 I40 N53 G54 G58 K59 A60	K30-F56 HydrophobicContact CB-CZ 4.44Å; K30-F56 HydrophobicContact CD-CE1 3.96Å; K30-F56 HydrophobicContact CD-CZ 4.07Å; E38-F56 HydrophobicContact CB-CE2 4.33Å; E38-F56 HydrophobicContact CB-CZ 4.24Å; I40-F56 HydrophobicContact CB-CD2 4.29Å; I40-F56 HydrophobicContact CB-CG 4.21Å; I40-F56 HydrophobicContact CG1-CD1 4.15Å; I40-F56 HydrophobicContact CG1-CD2 4.28Å; I40-F56 HydrophobicContact CG1-CE1 4.07Å; I40-F56 HydrophobicContact CG1-CE2 4.19Å; I40-F56 HydrophobicContact CG1-CG 4.25Å; I40-F56 HydrophobicContact CG1-CZ 4.08Å; I40-F56 HydrophobicContact CG2-CB 3.71Å; I40-F56 HydrophobicContact CG2-CD1 4.04Å; I40-F56 HydrophobicContact CG2-CD2 4.34Å; I40-F56 HydrophobicContact CG2-CG 3.78Å; N53-F56 HydrophobicContact CB-CD2 4.04Å; N53-F56 PolarHBondContact O-N 2.88Å; G54-F56 PolarHBondContact O-N 2.78Å; F56-G58 PolarHBondContact O-N 3.4Å; F56-K59 PolarHBondContact O-N 2.81Å; F56-A60 HydrophobicContact CB-CB 4.42Å; F56-A60 PolarHBondContact O-N 3.01Å
57	K	91.1	Very high	94.5	Very high	164 Å²	164	69 Å²	69	71%	0.713	40%	0.403	S	S	*	.	B	Isolated β-bridge	trans	-61.5	124.4	175.6	-166.8	174.8	-176.6	179.5	0	109.3	N53 G54 K59	N53-K57 PolarHBondContact O-N 3.05Å; G54-K57 PolarHBondContact O-N 2.86Å; K57-K59 VanDerWaalsContact C-N 3.26Å; K57-K59 PolarHBondContact O-N 2.68Å
58	G	90.4	Very high	94.5	Very high	69 Å²	69	65.4 Å²	65.4	71%	0.711	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	-16.6	-175.7	0	0	0	0	0	115	F56 S76	F56-G58 PolarHBondContact O-N 3.4Å; G58-S76 PolarHBondContact O-OG 3.03Å
59	K	93.1	Very high	94.6	Very high	50 Å²	50	65.3 Å²	65.3	22%	0.217	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-37.4	173.9	-168.7	167.3	-164.9	171.3	0	112.7	F56 K57 L75 S76 D82	F56-K59 PolarHBondContact O-N 2.81Å; K57-K59 VanDerWaalsContact C-N 3.26Å; K57-K59 PolarHBondContact O-N 2.68Å; K59-L75 WeakPolarHBondContact O-CA 3.26Å; K59-S76 PolarHBondContact O-N 2.85Å; K59-S76 PolarHBondContact O-OG 2.94Å; K59-D82 VanDerWaalsContact CE-OD1 3.31Å; K59-D82 WeakPolarHBondContact CE-OD1 3.47Å; K59-D82 WeakPolarHBondContact CE-OD2 3.46Å; K59-D82 IonicContact NZ-OD1 2.6Å; K59-D82 PolarHBondContact NZ-OD1 2.77Å; K59-D82 IonicContact NZ-OD2 3.83Å; K59-D82 PolarHBondContact NZ-OD2 2.98Å
60	A	95.9	Very high	94.6	Very high	3 Å²	3	61.6 Å²	61.6	3%	0.025	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	137.1	177.6	0	0	0	0	0	110.7	I40 Y52 F56 M73 Q74 L75	I40-A60 HydrophobicContact CG2-CB 3.7Å; Y52-A60 HydrophobicContact CE1-CB 4.41Å; Y52-A60 WeakPolarHBondContact CE1-O 3.26Å; F56-A60 HydrophobicContact CB-CB 4.42Å; F56-A60 PolarHBondContact O-N 3.01Å; A60-M73 HydrophobicContact CB-CG 4.34Å; A60-M73 HydrophobicContact CB-SD 4.48Å; A60-Q74 CarbonylContact C-O 3.59Å; A60-Q74 WeakPolarHBondContact CA-O 2.98Å; A60-L75 HydrophobicContact CB-CD2 3.9Å
61	T	97	Very high	94.5	Very high	71 Å²	71	59.4 Å²	59.4	44%	0.436	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	120.5	168.9	-60	0	0	0	0	108.5	T63 M73 Q74	T61-T63 HydrophobicContact CG2-CG2 4.39Å; T61-M73 WeakPolarHBondContact O-CA 3.31Å; T61-Q74 PolarHBondContact N-O 3.28Å; T61-Q74 PolarHBondContact O-N 2.82Å
62	L	97.5	Very high	94.6	Very high	9 Å²	9	58.1 Å²	58.1	5%	0.047	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	133.3	178.8	-53.3	-175.8	0	0	0	110.3	W28 I43 T50 Y52 Y72 M73	W28-L62 VanDerWaalsContact CD1-CD2 3.47Å; W28-L62 HydrophobicContact CG-CD2 3.98Å; I43-L62 HydrophobicContact CB-CB 4.08Å; I43-L62 HydrophobicContact CB-CD1 4.45Å; I43-L62 HydrophobicContact CD1-CB 4.38Å; I43-L62 HydrophobicContact CG2-CB 4.4Å; T50-L62 HydrophobicContact CG2-CB 4.12Å; Y52-L62 HydrophobicContact CE1-CD1 4.06Å; Y52-L62 HydrophobicContact CE1-CG 3.71Å; Y52-L62 PolarHBondContact OH-N 3.26Å; L62-Y72 WeakPolarHBondContact CA-O 3.18Å; L62-M73 HydrophobicContact CD2-CB 3.72Å; L62-M73 HydrophobicContact CD2-CG 3.64Å; L62-M73 HydrophobicContact CD2-SD 4.35Å
63	T	97.1	Very high	94.6	Very high	62 Å²	62	55.3 Å²	55.3	38%	0.38	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	162.2	175.4	55.6	0	0	0	0	110.1	I43 T61 A71 Y72	I43-T63 VanDerWaalsContact CD1-C 3.49Å; T61-T63 HydrophobicContact CG2-CG2 4.39Å; T63-A71 CarbonylContact O-C 3.6Å; T63-Y72 PolarHBondContact N-O 2.94Å; T63-Y72 PolarHBondContact O-N 2.88Å
64	A	96.6	Very high	94.7	Very high	34 Å²	34	57.1 Å²	57.1	28%	0.281	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	140	177.1	0	0	0	0	0	110.7	F21 I43 P45 T70	F21-A64 HydrophobicContact CE1-CB 4.04Å; F21-A64 HydrophobicContact CZ-CB 3.93Å; I43-A64 HydrophobicContact CD1-CB 3.92Å; P45-A64 HydrophobicContact CB-CB 3.75Å; P45-A64 HydrophobicContact CG-CB 4.04Å; A64-T70 WeakPolarHBondContact CA-O 3.41Å
65	D	95.4	Very high	94.8	Very high	56 Å²	56	54.2 Å²	54.2	30%	0.299	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	111.3	170.3	174.3	10.2	0	0	0	108.8	S67 S68 S69 T70 Y72	D65-S67 VanDerWaalsContact C-N 3.31Å; D65-S67 VanDerWaalsContact CG-OG 3.31Å; D65-S67 PolarHBondContact O-N 3.19Å; D65-S67 WeakPolarHBondContact OD1-CB 3.39Å; D65-S67 PolarHBondContact OD1-N 3.23Å; D65-S67 PolarHBondContact OD1-OG 3.45Å; D65-S67 PolarHBondContact OD2-OG 2.99Å; D65-S68 WeakPolarHBondContact CB-OG 3.1Å; D65-S68 WeakPolarHBondContact OD2-CB 3.38Å; D65-S68 PolarHBondContact OD2-OG 3.14Å; D65-S69 WeakPolarHBondContact O-CA 3.47Å; D65-S69 PolarHBondContact O-N 2.85Å; D65-S69 VanDerWaalsContact O-N 3.08Å; D65-T70 PolarHBondContact N-O 3.04Å; D65-T70 PolarHBondContact O-N 3.14Å; D65-Y72 HydrophobicContact CB-CE2 3.99Å
66	K	93.2	Very high	94.9	Very high	121 Å²	121	48.5 Å²	48.5	53%	0.526	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-32.7	-178.3	-52.6	-177.9	-145.6	-170.9	0	111.5	P45 G46 S69	P45-K66 WeakPolarHBondContact O-CD 3.3Å; P45-K66 WeakPolarHBondContact O-CE 3.46Å; G46-K66 PolarHBondContact O-NZ 3.46Å; K66-S69 PolarHBondContact O-N 3.18Å
67	S	92.1	Very high	94.8	Very high	110 Å²	110	52.1 Å²	52.1	77%	0.769	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-40.5	-176	72	0	0	0	0	111.7	D65	D65-S67 VanDerWaalsContact C-N 3.31Å; D65-S67 VanDerWaalsContact CG-OG 3.31Å; D65-S67 PolarHBondContact O-N 3.19Å; D65-S67 WeakPolarHBondContact OD1-CB 3.39Å; D65-S67 PolarHBondContact OD1-N 3.23Å; D65-S67 PolarHBondContact OD1-OG 3.45Å; D65-S67 PolarHBondContact OD2-OG 2.99Å
68	S	94.4	Very high	94.8	Very high	38 Å²	38	44.4 Å²	44.4	27%	0.266	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	0.3	177.1	65.2	0	0	0	0	113.7	D65 T70	D65-S68 WeakPolarHBondContact CB-OG 3.1Å; D65-S68 WeakPolarHBondContact OD2-CB 3.38Å; D65-S68 PolarHBondContact OD2-OG 3.14Å; S68-T70 PolarHBondContact O-N 2.85Å; S68-T70 PolarHBondContact O-OG1 2.76Å; S68-T70 WeakPolarHBondContact OG-CB 3.34Å; S68-T70 PolarHBondContact OG-OG1 2.87Å
69	S	94.9	Very high	94.8	Very high	39 Å²	39	44 Å²	44	27%	0.273	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	41.2	-172.7	-63.5	0	0	0	0	112.8	A16 F21 D65 K66	A16-S69 WeakPolarHBondContact CB-O 3.41Å; A16-S69 PolarHBondContact N-O 2.81Å; F21-S69 VanDerWaalsContact CD1-CA 3.49Å; D65-S69 WeakPolarHBondContact O-CA 3.47Å; D65-S69 PolarHBondContact O-N 2.85Å; D65-S69 VanDerWaalsContact O-N 3.08Å; K66-S69 PolarHBondContact O-N 3.18Å
70	T	96.3	Very high	94.6	Very high	10 Å²	10	45.1 Å²	45.1	6%	0.061	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.5	-173.6	-56.9	0	0	0	0	110.8	C14 A64 D65 S68 Y72	C14-T70 WeakPolarHBondContact O-CA 3.28Å; A64-T70 WeakPolarHBondContact CA-O 3.41Å; D65-T70 PolarHBondContact N-O 3.04Å; D65-T70 PolarHBondContact O-N 3.14Å; S68-T70 PolarHBondContact O-N 2.85Å; S68-T70 PolarHBondContact O-OG1 2.76Å; S68-T70 WeakPolarHBondContact OG-CB 3.34Å; S68-T70 PolarHBondContact OG-OG1 2.87Å; T70-Y72 HydrophobicContact CG2-CD1 4.17Å; T70-Y72 HydrophobicContact CG2-CD2 4.46Å; T70-Y72 HydrophobicContact CG2-CE1 3.55Å; T70-Y72 HydrophobicContact CG2-CE2 3.87Å
71	A	96.4	Very high	94.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	149.9	167.8	0	0	0	0	0	109.9	S13 C14 F21 M26 W28 T63	S13-A71 CarbonylContact C-O 3.55Å; S13-A71 WeakPolarHBondContact CA-O 3.28Å; C14-A71 PolarHBondContact N-O 3.25Å; C14-A71 PolarHBondContact O-N 2.89Å; F21-A71 HydrophobicContact CE2-CB 4.1Å; F21-A71 HydrophobicContact CZ-CB 3.91Å; M26-A71 HydrophobicContact CB-CB 4.18Å; M26-A71 HydrophobicContact CE-CB 4.43Å; M26-A71 HydrophobicContact CG-CB 3.7Å; W28-A71 HydrophobicContact CZ2-CB 4.11Å; T63-A71 CarbonylContact O-C 3.6Å
72	Y	97	Very high	94.1	Very high	50 Å²	50	47.9 Å²	47.9	20%	0.196	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143	176.2	-52.6	-87.2	0	0	0	110.9	K11 I12 S13 L62 T63 D65 T70	K11-Y72 HydrophobicContact CD-CD1 4.32Å; K11-Y72 VanDerWaalsContact CE-CB 3.5Å; K11-Y72 HydrophobicContact CG-CD1 4.29Å; I12-Y72 CarbonylContact O-C 3.55Å; I12-Y72 VanDerWaalsContact O-CA 3.23Å; I12-Y72 WeakPolarHBondContact O-CA 3.33Å; S13-Y72 VanDerWaalsContact CB-CD1 3.5Å; L62-Y72 WeakPolarHBondContact CA-O 3.18Å; T63-Y72 PolarHBondContact N-O 2.94Å; T63-Y72 PolarHBondContact O-N 2.88Å; D65-Y72 HydrophobicContact CB-CE2 3.99Å; T70-Y72 HydrophobicContact CG2-CD1 4.17Å; T70-Y72 HydrophobicContact CG2-CD2 4.46Å; T70-Y72 HydrophobicContact CG2-CE1 3.55Å; T70-Y72 HydrophobicContact CG2-CE2 3.87Å
73	M	97.2	Very high	93.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120.2	166.8	176.8	-177.5	68.9	0	0	108.3	I12 W28 I40 A60 T61 L62 L75 Y86	I12-M73 HydrophobicContact CB-CE 4.43Å; I12-M73 HydrophobicContact CD1-CE 3.72Å; I12-M73 HydrophobicContact CG1-CE 4.34Å; I12-M73 PolarHBondContact N-O 2.83Å; I12-M73 PolarHBondContact O-N 2.91Å; W28-M73 HydrophobicContact CB-SD 3.95Å; W28-M73 HydrophobicContact CD2-CB 3.61Å; W28-M73 HydrophobicContact CD2-CG 4.42Å; W28-M73 HydrophobicContact CD2-SD 4.13Å; W28-M73 HydrophobicContact CE3-CB 3.81Å; W28-M73 HydrophobicContact CE3-CE 3.9Å; W28-M73 HydrophobicContact CE3-SD 4.08Å; W28-M73 HydrophobicContact CG-CB 4.15Å; W28-M73 HydrophobicContact CG-SD 4.1Å; W28-M73 HydrophobicContact CH2-CB 4.05Å; W28-M73 HydrophobicContact CZ2-CB 3.88Å; W28-M73 HydrophobicContact CZ3-CB 4.02Å; W28-M73 HydrophobicContact CZ3-CE 4.34Å; I40-M73 HydrophobicContact CD1-CE 4.07Å; I40-M73 HydrophobicContact CD1-SD 3.52Å; I40-M73 VanDerWaalsContact CD1-SD 3.52Å; I40-M73 HydrophobicContact CG2-SD 4.01Å; A60-M73 HydrophobicContact CB-CG 4.34Å; A60-M73 HydrophobicContact CB-SD 4.48Å; T61-M73 WeakPolarHBondContact O-CA 3.31Å; L62-M73 HydrophobicContact CD2-CB 3.72Å; L62-M73 HydrophobicContact CD2-CG 3.64Å; L62-M73 HydrophobicContact CD2-SD 4.35Å; M73-L75 HydrophobicContact CE-CD1 3.91Å; M73-L75 HydrophobicContact CE-CD2 4.22Å; M73-L75 HydrophobicContact CE-CG 4Å; M73-L75 HydrophobicContact CG-CD2 4.33Å; M73-L75 HydrophobicContact CG-CG 4.4Å; M73-L75 HydrophobicContact SD-CD2 4.06Å; M73-L75 HydrophobicContact SD-CG 4.39Å; M73-Y86 HydrophobicContact CE-CD1 3.56Å; M73-Y86 HydrophobicContact CE-CE1 4.14Å; M73-Y86 HydrophobicContact CE-CG 4.07Å
74	Q	96.2	Very high	93.8	Very high	86 Å²	86	46.4 Å²	46.4	40%	0.402	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	124.2	170.8	-176.6	173.8	-24.6	0	0	109.1	V10 A60 T61	V10-Q74 CarbonylContact O-C 3.53Å; V10-Q74 VanDerWaalsContact O-CA 3.27Å; V10-Q74 WeakPolarHBondContact O-CA 3.41Å; A60-Q74 CarbonylContact C-O 3.59Å; A60-Q74 WeakPolarHBondContact CA-O 2.98Å; T61-Q74 PolarHBondContact N-O 3.28Å; T61-Q74 PolarHBondContact O-N 2.82Å
75	L	94.8	Very high	93.8	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.5	172.5	-62.7	167.7	0	0	0	108.8	P9 V10 I12 K59 A60 M73 L78 Y86 L103	P9-L75 CarbonylContact C-O 3.35Å; P9-L75 WeakPolarHBondContact CA-O 3.44Å; V10-L75 HydrophobicContact CG1-CB 4.02Å; V10-L75 HydrophobicContact CG1-CD1 4.18Å; V10-L75 HydrophobicContact CG1-CG 4.5Å; V10-L75 PolarHBondContact N-O 3.04Å; V10-L75 PolarHBondContact O-N 2.84Å; I12-L75 HydrophobicContact CD1-CD1 4.47Å; K59-L75 WeakPolarHBondContact O-CA 3.26Å; A60-L75 HydrophobicContact CB-CD2 3.9Å; M73-L75 HydrophobicContact CE-CD1 3.91Å; M73-L75 HydrophobicContact CE-CD2 4.22Å; M73-L75 HydrophobicContact CE-CG 4Å; M73-L75 HydrophobicContact CG-CD2 4.33Å; M73-L75 HydrophobicContact CG-CG 4.4Å; M73-L75 HydrophobicContact SD-CD2 4.06Å; M73-L75 HydrophobicContact SD-CG 4.39Å; L75-L78 HydrophobicContact CB-CD2 3.68Å; L75-L78 HydrophobicContact CD1-CD2 4.16Å; L75-Y86 HydrophobicContact CD1-CD1 4.3Å; L75-Y86 HydrophobicContact CD1-CE1 3.65Å; L75-Y86 HydrophobicContact CD1-CE2 4.2Å; L75-L103 HydrophobicContact CD1-CD2 4.27Å
76	S	93.4	Very high	93.8	Very high	36 Å²	36	44 Å²	44	25%	0.252	26%	0.256	S	S	.	.			trans	-104.6	159	176.2	56.2	0	0	0	0	111.4	G58 K59 L78	G58-S76 PolarHBondContact O-OG 3.03Å; K59-S76 PolarHBondContact O-N 2.85Å; K59-S76 PolarHBondContact O-OG 2.94Å; S76-L78 VanDerWaalsContact C-N 3.33Å; S76-L78 PolarHBondContact O-N 2.83Å
77	S	90.6	Very high	93.9	Very high	86 Å²	86	39.6 Å²	39.6	60%	0.601	24%	0.237	S	C	*	.	S	Bend	trans	50.6	50.4	172.1	-57.8	0	0	0	0	113
78	L	90.9	Very high	94.1	Very high	2 Å²	2	35 Å²	35	1%	0.01	21%	0.205	C	C	.	.			trans	-61.9	137.1	-176.2	-69.8	176.5	0	0	0	111.8	V4 P6 G7 A8 V10 L75 S76 D82 L103 V105	V4-L78 HydrophobicContact CB-CD1 4.31Å; V4-L78 HydrophobicContact CG2-CD1 3.63Å; P6-L78 WeakPolarHBondContact CA-O 3.18Å; G7-L78 PolarHBondContact N-O 3.03Å; A8-L78 VanDerWaalsContact O-CD1 3.23Å; A8-L78 WeakPolarHBondContact O-CD1 3.22Å; A8-L78 WeakPolarHBondContact O-CG 3.27Å; V10-L78 HydrophobicContact CB-CD1 3.89Å; V10-L78 HydrophobicContact CG1-CD1 3.67Å; V10-L78 HydrophobicContact CG1-CD2 4.38Å; L75-L78 HydrophobicContact CB-CD2 3.68Å; L75-L78 HydrophobicContact CD1-CD2 4.16Å; S76-L78 VanDerWaalsContact C-N 3.33Å; S76-L78 PolarHBondContact O-N 2.83Å; L78-D82 WeakPolarHBondContact CA-OD2 3.01Å; L78-D82 HydrophobicContact CD2-CB 3.74Å; L78-L103 HydrophobicContact CD1-CD2 4.24Å; L78-L103 HydrophobicContact CD2-CD2 4.16Å; L78-V105 HydrophobicContact CB-CG1 4.19Å; L78-V105 HydrophobicContact CB-CG2 4.11Å; L78-V105 HydrophobicContact CD1-CG2 4.4Å
79	T	91.4	Very high	94	Very high	60 Å²	60	33.2 Å²	33.2	37%	0.368	19%	0.192	S	C	.	.			trans	-121.4	168.7	172.8	68.2	0	0	0	0	110.1	E81 D82 V105	T79-E81 PolarHBondContact O-N 2.87Å; T79-E81 VanDerWaalsContact O-N 3.07Å; T79-D82 PolarHBondContact N-OD2 2.85Å; T79-D82 WeakPolarHBondContact O-CB 3.25Å; T79-D82 PolarHBondContact O-N 2.02Å; T79-D82 PolarHBondContact OG1-OD2 2.85Å; T79-V105 WeakPolarHBondContact O-CB 3.01Å; T79-V105 WeakPolarHBondContact O-CG2 3.37Å
80	S	89.4	Confident	93.7	Very high	73 Å²	73	33.8 Å²	33.8	51%	0.51	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-53.1	-30.3	175.6	55.4	0	0	0	0	112.9	D82 S83	S80-D82 PolarHBondContact O-N 2.79Å; S80-S83 VanDerWaalsContact O-CB 3.29Å; S80-S83 WeakPolarHBondContact O-CB 3.23Å; S80-S83 PolarHBondContact O-N 3.1Å; S80-S83 VanDerWaalsContact O-N 3.16Å; S80-S83 PolarHBondContact O-OG 2.9Å
81	E	88.8	Confident	92.9	Very high	129 Å²	129	38 Å²	38	60%	0.603	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-68	-13.9	175.9	-59.6	-169.4	-178.6	0	0	114.8	K30 R32 T79 S83	K30-E81 PolarHBondContact NZ-O 2.74Å; R32-E81 PolarHBondContact NH1-O 2.87Å; T79-E81 PolarHBondContact O-N 2.87Å; T79-E81 VanDerWaalsContact O-N 3.07Å; E81-S83 VanDerWaalsContact C-N 3.29Å
82	D	91.8	Very high	91.9	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.021	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-84.2	-5.3	174.4	-60.5	-48.4	0	0	0	113.7	K30 K59 L78 T79 S80 A84 Y86 V105	K30-D82 IonicContact NZ-OD1 2.74Å; K30-D82 PolarHBondContact NZ-OD1 2.88Å; K59-D82 VanDerWaalsContact CE-OD1 3.31Å; K59-D82 WeakPolarHBondContact CE-OD1 3.47Å; K59-D82 WeakPolarHBondContact CE-OD2 3.46Å; K59-D82 IonicContact NZ-OD1 2.6Å; K59-D82 PolarHBondContact NZ-OD1 2.77Å; K59-D82 IonicContact NZ-OD2 3.83Å; K59-D82 PolarHBondContact NZ-OD2 2.98Å; L78-D82 WeakPolarHBondContact CA-OD2 3.01Å; L78-D82 HydrophobicContact CD2-CB 3.74Å; T79-D82 PolarHBondContact N-OD2 2.85Å; T79-D82 WeakPolarHBondContact O-CB 3.25Å; T79-D82 PolarHBondContact O-N 2.02Å; T79-D82 PolarHBondContact OG1-OD2 2.85Å; S80-D82 PolarHBondContact O-N 2.79Å; D82-A84 PolarHBondContact O-N 3.1Å; D82-A84 VanDerWaalsContact O-N 3.12Å; D82-Y86 WeakPolarHBondContact O-CE2 3.44Å; D82-Y86 PolarHBondContact O-OH 3.07Å; D82-V105 HydrophobicContact CB-CG2 4.11Å
83	S	93.9	Very high	90.1	Very high	36 Å²	36	44.2 Å²	44.2	25%	0.252	25%	0.25	S	S	.	.			trans	-62.8	113	170.9	-57	0	0	0	0	110.2	S80 E81 L103 V105	S80-S83 VanDerWaalsContact O-CB 3.29Å; S80-S83 WeakPolarHBondContact O-CB 3.23Å; S80-S83 PolarHBondContact O-N 3.1Å; S80-S83 VanDerWaalsContact O-N 3.16Å; S80-S83 PolarHBondContact O-OG 2.9Å; E81-S83 VanDerWaalsContact C-N 3.29Å; S83-L103 CarbonylContact C-O 3.57Å; S83-L103 VanDerWaalsContact CA-O 3.28Å; S83-L103 WeakPolarHBondContact CA-O 3.38Å; S83-V105 PolarHBondContact OG-N 3.44Å
84	A	95.3	Very high	88.8	Confident	4 Å²	4	56 Å²	56	3%	0.033	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	171.1	-170.9	0	0	0	0	0	110.7	K30 Q31 R32 D82 Y86 L103	K30-A84 HydrophobicContact CD-CB 4.17Å; K30-A84 HydrophobicContact CG-CB 3.54Å; Q31-A84 WeakPolarHBondContact O-CA 3.4Å; Q31-A84 VanDerWaalsContact O-CB 3.3Å; Q31-A84 WeakPolarHBondContact O-CB 3.34Å; R32-A84 HydrophobicContact CG-CB 4.22Å; D82-A84 PolarHBondContact O-N 3.1Å; D82-A84 VanDerWaalsContact O-N 3.12Å; A84-Y86 HydrophobicContact CB-CD2 4.41Å; A84-Y86 HydrophobicContact CB-CE2 3.84Å; A84-L103 PolarHBondContact N-O 2.64Å; A84-L103 PolarHBondContact O-N 3.14Å
85	V	96.1	Very high	87.9	Confident	36 Å²	36	52.7 Å²	52.7	22%	0.218	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	128.2	162.8	-169.2	0	0	0	0	108.5	Q31 F87	Q31-V85 PolarHBondContact N-O 2.83Å; Q31-V85 PolarHBondContact O-N 3.16Å; V85-F87 HydrophobicContact CB-CE2 3.74Å; V85-F87 HydrophobicContact CB-CZ 3.91Å; V85-F87 HydrophobicContact CG1-CD2 4.24Å; V85-F87 HydrophobicContact CG1-CE1 3.87Å; V85-F87 HydrophobicContact CG1-CE2 3.53Å; V85-F87 HydrophobicContact CG1-CZ 3.31Å
86	Y	96.3	Very high	87.6	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.008	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	127.1	179	-68.2	-88.8	0	0	0	110	I12 V29 K30 I40 M73 L75 D82 A84 G100 T101 L103	I12-Y86 HydrophobicContact CD1-CD1 4.4Å; I12-Y86 HydrophobicContact CD1-CD2 3.79Å; I12-Y86 HydrophobicContact CD1-CG 3.67Å; V29-Y86 CarbonylContact O-C 3.6Å; V29-Y86 WeakPolarHBondContact O-CA 3.4Å; K30-Y86 HydrophobicContact CB-CD1 4.08Å; K30-Y86 HydrophobicContact CB-CE1 3.84Å; K30-Y86 HydrophobicContact CD-CE1 3.89Å; K30-Y86 WeakPolarHBondContact CE-OH 3.47Å; K30-Y86 HydrophobicContact CG-CD1 4.26Å; K30-Y86 HydrophobicContact CG-CE1 3.7Å; I40-Y86 HydrophobicContact CD1-CD1 3.72Å; I40-Y86 HydrophobicContact CD1-CE1 3.86Å; M73-Y86 HydrophobicContact CE-CD1 3.56Å; M73-Y86 HydrophobicContact CE-CE1 4.14Å; M73-Y86 HydrophobicContact CE-CG 4.07Å; L75-Y86 HydrophobicContact CD1-CD1 4.3Å; L75-Y86 HydrophobicContact CD1-CE1 3.65Å; L75-Y86 HydrophobicContact CD1-CE2 4.2Å; D82-Y86 WeakPolarHBondContact O-CE2 3.44Å; D82-Y86 PolarHBondContact O-OH 3.07Å; A84-Y86 HydrophobicContact CB-CD2 4.41Å; A84-Y86 HydrophobicContact CB-CE2 3.84Å; Y86-G100 CarbonylContact O-C 3.59Å; Y86-G100 VanDerWaalsContact O-CA 3.26Å; Y86-G100 WeakPolarHBondContact O-CA 3.06Å; Y86-T101 PolarHBondContact N-O 3.29Å; Y86-T101 PolarHBondContact O-N 2.75Å; Y86-L103 HydrophobicContact CD2-CB 3.9Å; Y86-L103 HydrophobicContact CD2-CD2 4.35Å; Y86-L103 HydrophobicContact CE2-CB 3.75Å; Y86-L103 HydrophobicContact CE2-CD2 3.66Å; Y86-L103 HydrophobicContact CE2-CG 4.36Å
87	F	95.7	Very high	87.5	Confident	30 Å²	30	63 Å²	63	13%	0.132	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	147.3	-178.6	-59	-88	0	0	0	110.6	W28 V29 Q31 V85 W97	W28-F87 CarbonylContact C-O 3.51Å; W28-F87 WeakPolarHBondContact CA-O 3.36Å; V29-F87 HydrophobicContact CB-CB 4.5Å; V29-F87 PolarHBondContact N-O 2.84Å; V29-F87 PolarHBondContact O-N 3.28Å; Q31-F87 HydrophobicContact CB-CD2 4.33Å; Q31-F87 HydrophobicContact CB-CE2 3.75Å; V85-F87 HydrophobicContact CB-CE2 3.74Å; V85-F87 HydrophobicContact CB-CZ 3.91Å; V85-F87 HydrophobicContact CG1-CD2 4.24Å; V85-F87 HydrophobicContact CG1-CE1 3.87Å; V85-F87 HydrophobicContact CG1-CE2 3.53Å; V85-F87 HydrophobicContact CG1-CZ 3.31Å; F87-W97 HydrophobicContact CB-CE3 3.73Å; F87-W97 HydrophobicContact CB-CZ3 3.89Å; F87-W97 HydrophobicContact CG-CE3 4.21Å; F87-W97 HydrophobicContact CG-CZ3 4.39Å
88	C	95	Very high	87.5	Confident	13 Å²	13	60.2 Å²	60.2	9%	0.088	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	148.2	160.9	60.3	0	0	0	0	110	C14 M26 N27 W28 G98	C14-C88 HydrophobicContact CB-CB 3.44Å; C14-C88 VanDerWaalsContact CB-CB 3.44Å; C14-C88 WeakPolarHBondContact CB-SG 3.31Å; C14-C88 WeakPolarHBondContact SG-CB 3.22Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.83Å; M26-C88 HydrophobicContact CG-CB 4.39Å; M26-C88 HydrophobicContact SD-CB 3.75Å; N27-C88 CarbonylContact O-C 3.53Å; N27-C88 WeakPolarHBondContact O-CA 3.26Å; W28-C88 HydrophobicContact CD2-CB 4.5Å; W28-C88 HydrophobicContact CE3-CB 4.29Å; W28-C88 HydrophobicContact CH2-CB 4.4Å; W28-C88 HydrophobicContact CZ3-CB 4.24Å; C88-G98 PolarHBondContact O-N 3.08Å
89	A	93.8	Very high	87.6	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.008	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	138.9	178.3	0	0	0	0	0	112.5	N27 L92 Y96 W97	N27-A89 WeakPolarHBondContact CA-O 3.48Å; N27-A89 HydrophobicContact CB-CB 4.47Å; N27-A89 VanDerWaalsContact CB-O 3.26Å; N27-A89 WeakPolarHBondContact CB-O 3.41Å; N27-A89 PolarHBondContact N-O 3.34Å; N27-A89 PolarHBondContact ND2-O 3.01Å; N27-A89 PolarHBondContact O-N 2.86Å; A89-L92 HydrophobicContact CB-CD2 3.74Å; A89-L92 HydrophobicContact CB-CG 4.4Å; A89-Y96 CarbonylContact C-O 3.59Å; A89-Y96 WeakPolarHBondContact CA-O 3.44Å; A89-W97 HydrophobicContact CB-CD2 3.78Å; A89-W97 HydrophobicContact CB-CE3 3.85Å; A89-W97 HydrophobicContact CB-CG 4.24Å; A89-W97 HydrophobicContact CB-CH2 4.49Å; A89-W97 HydrophobicContact CB-CZ2 4.46Å; A89-W97 HydrophobicContact CB-CZ3 4.21Å
90	R	88	Confident	87.6	Confident	50 Å²	50	68.3 Å²	68.3	19%	0.189	34%	0.344	C	S	.	.	S	Bend	trans	-75.6	-49.7	178.7	-168.2	-176.9	80.5	-165.5	6.5	112.2	Y19 W25 N27 Y96	Y19-R90 HydrophobicContact CE2-CG 4.19Å; W25-R90 WeakPolarHBondContact O-CA 2.99Å; W25-R90 VanDerWaalsContact O-O 3.05Å; N27-R90 PolarHBondContact ND2-O 3.26Å; N27-R90 VanDerWaalsContact ND2-O 3.14Å; R90-Y96 PolarHBondContact N-O 3Å
91	E	79.1	Confident	87.9	Confident	100 Å²	100	67.2 Å²	67.2	47%	0.467	33%	0.334	S	S	.	.	S	Bend	trans	-129.2	128.6	-176.5	-74.3	159.3	-141.8	0	0	108.7	G95	E91-G95 WeakPolarHBondContact O-CA 3.48Å; E91-G95 PolarHBondContact O-N 2.81Å
92	L	75.3	Confident	88.2	Confident	69 Å²	69	63.9 Å²	63.9	36%	0.361	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	145	175.8	-68.1	177.5	0	0	0	109.8	N27 V29 W39 A89 W97	N27-L92 HydrophobicContact CB-CD1 3.76Å; N27-L92 HydrophobicContact CB-CG 4.16Å; V29-L92 HydrophobicContact CG2-CD1 4.14Å; V29-L92 HydrophobicContact CG2-CD2 4.4Å; W39-L92 VanDerWaalsContact CD1-CD1 3.45Å; A89-L92 HydrophobicContact CB-CD2 3.74Å; A89-L92 HydrophobicContact CB-CG 4.4Å; L92-W97 HydrophobicContact CD2-CH2 3.35Å; L92-W97 HydrophobicContact CD2-CZ2 3.13Å; L92-W97 HydrophobicContact CD2-CZ3 4.25Å
93	P	60.1	Low	88.3	Confident	111 Å²	111	63.7 Å²	63.7	72%	0.721	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	cis	-94.6	-14.8	2	33.9	-32.3	0	0	0	115.2	W97	P93-W97 PolarHBondContact O-NE1 3.14Å
94	R	68.6	Low	88.2	Confident	247 Å²	247	64.9 Å²	64.9	93%	0.932	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	13.4	-172.9	-70.4	-174.2	177.2	162.4	-0.5	115
95	G	78	Confident	87.9	Confident	17 Å²	17	65 Å²	65	18%	0.175	33%	0.328	C	S	.	.	S	Bend	trans	-82.9	-160.8	-178.3	0	0	0	0	0	114.1	E91	E91-G95 WeakPolarHBondContact O-CA 3.48Å; E91-G95 PolarHBondContact O-N 2.81Å
96	Y	87.6	Confident	87.4	Confident	159 Å²	159	65.5 Å²	65.5	62%	0.624	33%	0.333	S	S	*	.			trans	-79.8	126.3	-178.8	-60.4	-85.9	0	0	0	111.4	A89 R90	A89-Y96 CarbonylContact C-O 3.59Å; A89-Y96 WeakPolarHBondContact CA-O 3.44Å; R90-Y96 PolarHBondContact N-O 3Å
97	W	91.6	Very high	86.3	Confident	94 Å²	94	73.2 Å²	73.2	36%	0.356	39%	0.387	S	S	.	.	B	Isolated β-bridge	trans	-110.7	143.5	178.3	-67	80.4	0	0	0	111	V29 L37 F87 A89 L92 P93	V29-W97 HydrophobicContact CB-CH2 4.31Å; V29-W97 HydrophobicContact CB-CZ3 3.91Å; V29-W97 HydrophobicContact CG1-CH2 4.24Å; V29-W97 HydrophobicContact CG1-CZ3 4.14Å; V29-W97 HydrophobicContact CG2-CH2 3.93Å; V29-W97 HydrophobicContact CG2-CZ3 3.84Å; L37-W97 HydrophobicContact CD1-CH2 3.86Å; L37-W97 HydrophobicContact CD1-CZ2 4.35Å; F87-W97 HydrophobicContact CB-CE3 3.73Å; F87-W97 HydrophobicContact CB-CZ3 3.89Å; F87-W97 HydrophobicContact CG-CE3 4.21Å; F87-W97 HydrophobicContact CG-CZ3 4.39Å; A89-W97 HydrophobicContact CB-CD2 3.78Å; A89-W97 HydrophobicContact CB-CE3 3.85Å; A89-W97 HydrophobicContact CB-CG 4.24Å; A89-W97 HydrophobicContact CB-CH2 4.49Å; A89-W97 HydrophobicContact CB-CZ2 4.46Å; A89-W97 HydrophobicContact CB-CZ3 4.21Å; L92-W97 HydrophobicContact CD2-CH2 3.35Å; L92-W97 HydrophobicContact CD2-CZ2 3.13Å; L92-W97 HydrophobicContact CD2-CZ3 4.25Å; P93-W97 PolarHBondContact O-NE1 3.14Å
98	G	91.6	Very high	85.8	Confident	28 Å²	28	75.4 Å²	75.4	29%	0.289	40%	0.4	S	S	.	.			trans	-70.8	164.7	165.2	0	0	0	0	0	111.6	C88 G100	C88-G98 PolarHBondContact O-N 3.08Å; G98-G100 PolarHBondContact O-N 3.5Å; G98-G100 VanDerWaalsContact O-N 3.14Å
99	Q	91.6	Very high	85.3	Confident	203 Å²	203	78.6 Å²	78.6	95%	0.949	42%	0.416	S	S	*	.			trans	-62.9	-20.1	179.2	-67	-177.8	-16.3	0	0	113.7
100	G	93.1	Very high	84.8	Confident	28 Å²	28	82.9 Å²	82.9	29%	0.289	44%	0.439	S	S	.	.			trans	87.4	148.1	-178	0	0	0	0	0	112.9	Y86 G98	Y86-G100 CarbonylContact O-C 3.59Å; Y86-G100 VanDerWaalsContact O-CA 3.26Å; Y86-G100 WeakPolarHBondContact O-CA 3.06Å; G98-G100 PolarHBondContact O-N 3.5Å; G98-G100 VanDerWaalsContact O-N 3.14Å
101	T	94.7	Very high	84.7	Confident	50 Å²	50	84.9 Å²	84.9	31%	0.307	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	115.4	177.6	-59.2	0	0	0	0	108.9	I12 Y86 L103	I12-T101 HydrophobicContact CG2-CG2 4.34Å; Y86-T101 PolarHBondContact N-O 3.29Å; Y86-T101 PolarHBondContact O-N 2.75Å; T101-L103 PolarHBondContact O-N 3.32Å
102	T	95.2	Very high	85	Confident	59 Å²	59	83.9 Å²	83.9	36%	0.362	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	119.3	172.9	-50	0	0	0	0	109.9	P1 E2	P1-T102 CarbonylContact C-O 3.56Å; P1-T102 VanDerWaalsContact CA-O 3.26Å; P1-T102 WeakPolarHBondContact CA-O 3.45Å; P1-T102 HydrophobicContact CB-CG2 4.34Å; E2-T102 PolarHBondContact N-O 3.27Å
103	L	93	Very high	85.7	Confident	1 Å²	1	84.9 Å²	84.9	1%	0.005	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.2	172.5	-175.3	70	0	0	0	109.2	E2 V4 V10 L75 L78 S83 A84 Y86 T101 V105	E2-L103 HydrophobicContact CB-CD1 4.09Å; E2-L103 HydrophobicContact CG-CD1 4.46Å; V4-L103 HydrophobicContact CB-CD1 4.38Å; V4-L103 HydrophobicContact CG1-CD1 3.72Å; V4-L103 HydrophobicContact CG2-CD1 3.7Å; V4-L103 HydrophobicContact CG2-CG 4.18Å; V10-L103 HydrophobicContact CB-CD1 4.38Å; V10-L103 HydrophobicContact CG1-CD1 4.13Å; V10-L103 HydrophobicContact CG1-CD2 3.84Å; V10-L103 HydrophobicContact CG2-CD1 3.99Å; L75-L103 HydrophobicContact CD1-CD2 4.27Å; L78-L103 HydrophobicContact CD1-CD2 4.24Å; L78-L103 HydrophobicContact CD2-CD2 4.16Å; S83-L103 CarbonylContact C-O 3.57Å; S83-L103 VanDerWaalsContact CA-O 3.28Å; S83-L103 WeakPolarHBondContact CA-O 3.38Å; A84-L103 PolarHBondContact N-O 2.64Å; A84-L103 PolarHBondContact O-N 3.14Å; Y86-L103 HydrophobicContact CD2-CB 3.9Å; Y86-L103 HydrophobicContact CD2-CD2 4.35Å; Y86-L103 HydrophobicContact CE2-CB 3.75Å; Y86-L103 HydrophobicContact CE2-CD2 3.66Å; Y86-L103 HydrophobicContact CE2-CG 4.36Å; T101-L103 PolarHBondContact O-N 3.32Å; L103-V105 HydrophobicContact CD2-CG2 4.45Å; L103-V105 HydrophobicContact CG-CG2 4.47Å
104	T	92.8	Very high	87.5	Confident	60 Å²	60	83.1 Å²	83.1	37%	0.368	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	118.7	173.7	-57	0	0	0	0	108.7	E2 L3 V4	E2-T104 PolarHBondContact O-N 3.23Å; L3-T104 WeakPolarHBondContact CA-O 3.37Å; L3-T104 HydrophobicContact CD1-CG2 4.11Å; V4-T104 PolarHBondContact N-O 2.91Å
105	V	89.8	Confident	88.9	Confident	7 Å²	7	70.5 Å²	70.5	4%	0.042	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	122.1	176.3	-170.3	0	0	0	0	108.1	V4 P6 L78 T79 D82 S83 L103	V4-V105 HydrophobicContact CG2-CB 4.15Å; V4-V105 HydrophobicContact CG2-CG1 4.28Å; V4-V105 HydrophobicContact CG2-CG2 3.68Å; V4-V105 WeakPolarHBondContact O-CA 3.45Å; P6-V105 HydrophobicContact CB-CG1 4.2Å; L78-V105 HydrophobicContact CB-CG1 4.19Å; L78-V105 HydrophobicContact CB-CG2 4.11Å; L78-V105 HydrophobicContact CD1-CG2 4.4Å; T79-V105 WeakPolarHBondContact O-CB 3.01Å; T79-V105 WeakPolarHBondContact O-CG2 3.37Å; D82-V105 HydrophobicContact CB-CG2 4.11Å; S83-V105 PolarHBondContact OG-N 3.44Å; L103-V105 HydrophobicContact CD2-CG2 4.45Å; L103-V105 HydrophobicContact CG-CG2 4.47Å
106	S	85.1	Confident	89.8	Confident	47 Å²	47	74.9 Å²	74.9	33%	0.329	42%	0.422	S	S	.	.			trans	-65.9	145.8	176.7	63.3	0	0	0	0	110.6	V4 P6	V4-S106 PolarHBondContact O-N 2.63Å; P6-S106 WeakPolarHBondContact CD-O 3.33Å; P6-S106 VanDerWaalsContact CD-OG 3.3Å; P6-S106 WeakPolarHBondContact CD-OG 3.39Å; P6-S106 VanDerWaalsContact CG-O 3.27Å; P6-S106 WeakPolarHBondContact CG-O 3.45Å
107	S	72.3	Confident	90.1	Very high	163 Å²	163	67.3 Å²	67.3	100%	1.14	40%	0.403	S	S	*	.			trans	-75.6	0	171	53.4	0	0	0	0	111.9

Retrieved 107 of 107 residues in 63.3 ms (Link to these results)

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