X5J5K9_MOUSE Loading...

IgM heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J5K9, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 109 aa.

						>X5J5K9_MOUSE|X5J5K9
AELVKPGASVKLSCTASGFNIKDYYMHWVKQRTEQGLEWIGRIDPEDGETKYAPKFQGKATMTADTSSNTAYLQLNSLTSEGSAVYYCARWGGYYFDYWGQGTTLTVSS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	A	74.8	Confident	90.8	Very high	117 Å²	117	76.3 Å²	76.3	97%	0.967	46%	0.459	S	S	*	.				0	137.9	0	0	0	0	0	0	108	T104	A1-T104 CarbonylContact C-O 3.48Å; A1-T104 WeakPolarHBondContact CA-O 3.46Å; A1-T104 HydrophobicContact CB-CG2 4.5Å
2	E	85.4	Confident	91.4	Very high	82 Å²	82	70.5 Å²	70.5	38%	0.383	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132.8	-177.2	-169.5	-176.3	166.3	0	0	109.4	V4 V10 T104 L105 T106	E2-V4 HydrophobicContact CG-CG1 3.87Å; E2-V10 WeakPolarHBondContact OE2-CG1 3.44Å; E2-T104 PolarHBondContact N-O 2.94Å; E2-L105 HydrophobicContact CB-CD2 3.57Å; E2-L105 HydrophobicContact CG-CD2 4.36Å; E2-T106 PolarHBondContact O-N 3.08Å
3	L	90.4	Very high	91.8	Very high	124 Å²	124	70.7 Å²	70.7	65%	0.649	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.6	122.9	178	-173.2	69.2	0	0	0	108.7	T106 S108	L3-T106 WeakPolarHBondContact CA-O 3.36Å; L3-T106 HydrophobicContact CD1-CG2 3.71Å; L3-S108 VanDerWaalsContact CD1-OG 3.28Å; L3-S108 WeakPolarHBondContact CD1-OG 3.46Å
4	V	92.4	Very high	92.2	Very high	14 Å²	14	66.7 Å²	66.7	9%	0.085	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	151.9	-174.6	-57.5	0	0	0	0	112	E2 A8 V10 L78 T106 V107 S108	E2-V4 HydrophobicContact CG-CG1 3.87Å; V4-A8 HydrophobicContact CB-CB 4.43Å; V4-V10 HydrophobicContact CB-CG2 4.33Å; V4-V10 HydrophobicContact CG1-CG2 3.63Å; V4-V10 HydrophobicContact CG2-CG2 4.33Å; V4-L78 HydrophobicContact CG2-CD1 3.91Å; V4-T106 PolarHBondContact N-O 2.93Å; V4-V107 HydrophobicContact CG2-CB 4.32Å; V4-V107 HydrophobicContact CG2-CG1 4.38Å; V4-V107 HydrophobicContact CG2-CG2 3.76Å; V4-V107 VanDerWaalsContact O-CA 3.3Å; V4-V107 WeakPolarHBondContact O-CA 3.11Å; V4-S108 PolarHBondContact O-N 2.64Å
5	K	92.1	Very high	92.6	Very high	154 Å²	154	68.4 Å²	68.4	67%	0.67	42%	0.418	S	S	*	.			trans	-79.6	150	176.6	-65.4	-175.7	179.3	-176.6	0	110.7	G7 A8	K5-G7 PolarHBondContact O-N 3.36Å; K5-A8 WeakPolarHBondContact O-CB 3.19Å; K5-A8 PolarHBondContact O-N 3.23Å; K5-A8 VanDerWaalsContact O-N 3.16Å
6	P	93.4	Very high	92.7	Very high	76 Å²	76	64.7 Å²	64.7	49%	0.494	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	139.1	170.1	-25.1	33.6	0	0	0	111.9	A8 L78 V107 S108	P6-A8 VanDerWaalsContact C-N 3.28Å; P6-A8 PolarHBondContact O-N 2.76Å; P6-L78 CarbonylContact C-O 3.56Å; P6-L78 WeakPolarHBondContact CA-O 3.46Å; P6-V107 HydrophobicContact CB-CG1 4.41Å; P6-V107 HydrophobicContact CG-CG1 4.14Å; P6-S108 WeakPolarHBondContact CD-O 2.94Å
7	G	91.5	Very high	92.8	Very high	51 Å²	51	67.3 Å²	67.3	53%	0.526	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	-10	-177.7	0	0	0	0	0	114.9	K5 L78	K5-G7 PolarHBondContact O-N 3.36Å; G7-L78 PolarHBondContact N-O 3.46Å
8	A	92.6	Very high	92.7	Very high	35 Å²	35	68.3 Å²	68.3	29%	0.289	44%	0.444	S	S	.	.			trans	-68.9	156.5	175.3	0	0	0	0	0	112.1	V4 K5 P6 S77 L78	V4-A8 HydrophobicContact CB-CB 4.43Å; K5-A8 WeakPolarHBondContact O-CB 3.19Å; K5-A8 PolarHBondContact O-N 3.23Å; K5-A8 VanDerWaalsContact O-N 3.16Å; P6-A8 VanDerWaalsContact C-N 3.28Å; P6-A8 PolarHBondContact O-N 2.76Å; A8-S77 PolarHBondContact O-N 3.3Å; A8-L78 WeakPolarHBondContact O-CB 3.32Å; A8-L78 PolarHBondContact O-N 2.67Å
9	S	94.6	Very high	92.7	Very high	66 Å²	66	66.9 Å²	66.9	46%	0.462	43%	0.43	S	S	.	.			trans	-111.3	138.4	171.3	-60.6	0	0	0	0	109.5	L75	S9-L75 CarbonylContact C-O 3.47Å; S9-L75 WeakPolarHBondContact CA-O 3.33Å; S9-L75 WeakPolarHBondContact CB-O 3.33Å
10	V	95.5	Very high	92.8	Very high	5 Å²	5	67 Å²	67	3%	0.03	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	139.8	-176.3	174	0	0	0	0	109.8	E2 V4 L12 Q74 L75 L78 L105	E2-V10 WeakPolarHBondContact OE2-CG1 3.44Å; V4-V10 HydrophobicContact CB-CG2 4.33Å; V4-V10 HydrophobicContact CG1-CG2 3.63Å; V4-V10 HydrophobicContact CG2-CG2 4.33Å; V10-L12 HydrophobicContact CG1-CD2 4Å; V10-L12 HydrophobicContact CG1-CG 4.39Å; V10-Q74 CarbonylContact O-C 3.58Å; V10-Q74 WeakPolarHBondContact O-CA 3.35Å; V10-Q74 PolarHBondContact O-NE2 3.07Å; V10-L75 PolarHBondContact N-O 2.94Å; V10-L75 PolarHBondContact O-N 2.81Å; V10-L78 HydrophobicContact CB-CD1 4.02Å; V10-L78 HydrophobicContact CG2-CD1 3.59Å; V10-L105 HydrophobicContact CB-CD1 4.45Å; V10-L105 HydrophobicContact CG1-CD1 4.06Å; V10-L105 HydrophobicContact CG1-CD2 4.14Å
11	K	96.7	Very high	92.9	Very high	115 Å²	115	63.8 Å²	63.8	50%	0.5	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	111.1	174.1	-163.6	179.7	175.8	-174.7	0	110	Y72 Q74	K11-Y72 HydrophobicContact CD-CD1 4.41Å; K11-Y72 VanDerWaalsContact CE-CD1 3.46Å; K11-Y72 VanDerWaalsContact CE-CG 3.47Å; K11-Q74 VanDerWaalsContact CB-OE1 3.25Å
12	L	97.3	Very high	93.9	Very high	7 Å²	7	62.3 Å²	62.3	4%	0.037	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	147.5	171.3	-59.5	-178.7	0	0	0	110.2	V10 W28 Y72 L73 L75 Y86 T103 L105	V10-L12 HydrophobicContact CG1-CD2 4Å; V10-L12 HydrophobicContact CG1-CG 4.39Å; L12-W28 HydrophobicContact CB-CH2 4.02Å; L12-W28 HydrophobicContact CB-CZ3 4.04Å; L12-W28 HydrophobicContact CD1-CZ3 4.4Å; L12-Y72 CarbonylContact O-C 3.54Å; L12-Y72 WeakPolarHBondContact O-CA 3.26Å; L12-L73 HydrophobicContact CB-CB 4.39Å; L12-L73 HydrophobicContact CD1-CD2 4.41Å; L12-L73 PolarHBondContact N-O 3.27Å; L12-L73 PolarHBondContact O-N 2.86Å; L12-L75 HydrophobicContact CD1-CD1 4.43Å; L12-Y86 VanDerWaalsContact CD1-CB 3.4Å; L12-Y86 HydrophobicContact CD1-CD1 4.17Å; L12-Y86 HydrophobicContact CD1-CD2 4.32Å; L12-Y86 HydrophobicContact CD1-CG 3.73Å; L12-T103 HydrophobicContact CD2-CG2 3.88Å; L12-L105 HydrophobicContact CD1-CD1 4.09Å; L12-L105 HydrophobicContact CD2-CD1 4.14Å; L12-L105 HydrophobicContact CD2-CD2 4.06Å; L12-L105 HydrophobicContact CD2-CG 4.33Å; L12-L105 HydrophobicContact CG-CD1 4.34Å
13	S	97.3	Very high	94.3	Very high	73 Å²	73	63.5 Å²	63.5	51%	0.51	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	150	173.6	59.8	0	0	0	0	111.1	A71	S13-A71 CarbonylContact C-O 3.52Å; S13-A71 WeakPolarHBondContact CA-O 3.43Å
14	C	97.2	Very high	94.5	Very high	15 Å²	15	61.2 Å²	61.2	10%	0.101	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	105.2	174.1	176.6	0	0	0	0	109.1	W28 T70 A71 C88	C14-W28 HydrophobicContact CB-CH2 3.73Å; C14-W28 HydrophobicContact CB-CZ2 3.92Å; C14-T70 CarbonylContact O-C 3.58Å; C14-T70 WeakPolarHBondContact O-CA 3.36Å; C14-A71 PolarHBondContact N-O 2.78Å; C14-A71 PolarHBondContact O-N 3.16Å; C14-C88 HydrophobicContact CB-CB 3.43Å; C14-C88 VanDerWaalsContact CB-CB 3.43Å; C14-C88 WeakPolarHBondContact CB-SG 3.21Å; C14-C88 WeakPolarHBondContact SG-CB 3.37Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.87Å
15	T	97.2	Very high	94.6	Very high	92 Å²	92	63.7 Å²	63.7	56%	0.564	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	121.7	178.9	-55.8	0	0	0	0	109.6	T70	T15-T70 WeakPolarHBondContact CB-OG1 3.47Å; T15-T70 WeakPolarHBondContact CG2-OG1 3.3Å; T15-T70 PolarHBondContact OG1-OG1 2.65Å
16	A	94.7	Very high	94.8	Very high	9 Å²	9	56.6 Å²	56.6	7%	0.074	35%	0.348	C	S	.	.			trans	-74.4	140.3	175.7	0	0	0	0	0	110.4	F19 I21 N69	A16-F19 HydrophobicContact CB-CD1 4.44Å; A16-F19 HydrophobicContact CB-CD2 4.12Å; A16-F19 HydrophobicContact CB-CE1 3.88Å; A16-F19 HydrophobicContact CB-CE2 3.51Å; A16-F19 HydrophobicContact CB-CZ 3.37Å; A16-I21 HydrophobicContact CB-CB 4.07Å; A16-I21 HydrophobicContact CB-CD1 4.14Å; A16-I21 HydrophobicContact CB-CG1 4.11Å; A16-N69 WeakPolarHBondContact CB-ND2 3.38Å; A16-N69 PolarHBondContact N-O 3.18Å; A16-N69 PolarHBondContact O-ND2 2.97Å
17	S	93.8	Very high	95	Very high	109 Å²	109	53.7 Å²	53.7	76%	0.762	33%	0.328	S	S	*	.			trans	-133.7	137.2	175	-172.7	0	0	0	0	109.3	F19	S17-F19 VanDerWaalsContact C-N 3.31Å; S17-F19 WeakPolarHBondContact O-CD1 3.45Å; S17-F19 PolarHBondContact O-N 3.16Å
18	G	92.3	Very high	95.3	Very high	86 Å²	86	51.5 Å²	51.5	89%	0.887	30%	0.304	S	S	*	.	S	Bend	trans	81.4	1.4	-177.1	0	0	0	0	0	115.6
19	F	91.8	Very high	95.5	Very high	41 Å²	41	49.9 Å²	49.9	18%	0.18	29%	0.291	C	S	.	.	S	Bend	trans	-152.5	158.5	171.8	63.6	-84.7	0	0	0	110.8	A16 S17 Y24 M26 N69 R90	A16-F19 HydrophobicContact CB-CD1 4.44Å; A16-F19 HydrophobicContact CB-CD2 4.12Å; A16-F19 HydrophobicContact CB-CE1 3.88Å; A16-F19 HydrophobicContact CB-CE2 3.51Å; A16-F19 HydrophobicContact CB-CZ 3.37Å; S17-F19 VanDerWaalsContact C-N 3.31Å; S17-F19 WeakPolarHBondContact O-CD1 3.45Å; S17-F19 PolarHBondContact O-N 3.16Å; F19-Y24 HydrophobicContact CB-CE2 4.05Å; F19-Y24 AromaticContact CD2-CD2 3.6Å; F19-Y24 HydrophobicContact CD2-CD2 3.6Å; F19-Y24 AromaticContact CD2-CE2 3.92Å; F19-Y24 HydrophobicContact CD2-CE2 3.92Å; F19-Y24 HydrophobicContact CD2-CG 4.5Å; F19-Y24 HydrophobicContact CE2-CD2 4.18Å; F19-Y24 HydrophobicContact CG-CD2 4.41Å; F19-Y24 HydrophobicContact CG-CE2 4.31Å; F19-M26 HydrophobicContact CE2-SD 4.15Å; F19-M26 HydrophobicContact CZ-SD 4.35Å; F19-N69 PolarHBondContact O-ND2 3.2Å; F19-R90 HydrophobicContact CE2-CG 4.24Å; F19-R90 HydrophobicContact CZ-CB 4.33Å; F19-R90 HydrophobicContact CZ-CG 4.31Å
20	N	95.1	Very high	95.5	Very high	68 Å²	68	47 Å²	47	36%	0.364	27%	0.27	S	S	.	.			trans	-82.5	123	171.7	174.7	14	0	0	0	109.2	K22 D23	N20-K22 PolarHBondContact O-N 2.83Å; N20-K22 PolarHBondContact OD1-N 2.8Å; N20-D23 WeakPolarHBondContact CB-OD2 3.49Å; N20-D23 PolarHBondContact ND2-OD1 3.26Å; N20-D23 PolarHBondContact O-N 2.99Å
21	I	95.4	Very high	95.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-65.1	-24.7	-174.4	-155.2	170.8	0	0	0	112.1	A16 D23 Y24 M26 P45 T66 N69 A71	A16-I21 HydrophobicContact CB-CB 4.07Å; A16-I21 HydrophobicContact CB-CD1 4.14Å; A16-I21 HydrophobicContact CB-CG1 4.11Å; I21-D23 PolarHBondContact O-N 2.86Å; I21-Y24 PolarHBondContact O-N 3.42Å; I21-M26 HydrophobicContact CD1-CG 3.93Å; I21-M26 HydrophobicContact CD1-SD 4.43Å; I21-M26 HydrophobicContact CG1-CG 3.6Å; I21-M26 HydrophobicContact CG1-SD 3.94Å; I21-P45 HydrophobicContact CG1-CB 4.43Å; I21-P45 HydrophobicContact CG1-CG 4.03Å; I21-P45 HydrophobicContact CG2-CB 4.13Å; I21-P45 WeakPolarHBondContact O-CB 3.22Å; I21-P45 VanDerWaalsContact O-CG 3.25Å; I21-P45 WeakPolarHBondContact O-CG 3.33Å; I21-T66 HydrophobicContact CG2-CG2 4.35Å; I21-N69 WeakPolarHBondContact CB-OD1 3.35Å; I21-N69 VanDerWaalsContact CG2-OD1 3.27Å; I21-N69 WeakPolarHBondContact CG2-OD1 3.37Å; I21-N69 PolarHBondContact N-OD1 2.93Å; I21-A71 HydrophobicContact CD1-CB 3.88Å
22	K	95.6	Very high	95.2	Very high	86 Å²	86	46.8 Å²	46.8	37%	0.374	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-61.3	-28.5	176.2	-70.7	-169.4	178.3	-168.1	0	113.4	N20 Y24 T66	N20-K22 PolarHBondContact O-N 2.83Å; N20-K22 PolarHBondContact OD1-N 2.8Å; K22-Y24 PolarHBondContact O-N 3.04Å; K22-T66 HydrophobicContact CD-CG2 4.06Å; K22-T66 VanDerWaalsContact CE-CG2 3.49Å; K22-T66 WeakPolarHBondContact CE-OG1 3.47Å; K22-T66 HydrophobicContact CG-CG2 3.41Å; K22-T66 VanDerWaalsContact CG-CG2 3.41Å
23	D	93.8	Very high	94.3	Very high	108 Å²	108	53.9 Å²	53.9	58%	0.578	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-84.7	0.9	-170.4	-51.9	-24.2	0	0	0	112.4	N20 I21	N20-D23 WeakPolarHBondContact CB-OD2 3.49Å; N20-D23 PolarHBondContact ND2-OD1 3.26Å; N20-D23 PolarHBondContact O-N 2.99Å; I21-D23 PolarHBondContact O-N 2.86Å
24	Y	93.8	Very high	93.5	Very high	75 Å²	75	59.5 Å²	59.5	29%	0.294	33%	0.33	S	S	.	.	S	Bend	trans	-144.4	143.5	-172	-58.6	-86.9	0	0	0	113.2	F19 I21 K22 M26 P45 R90 W91	F19-Y24 HydrophobicContact CB-CE2 4.05Å; F19-Y24 AromaticContact CD2-CD2 3.6Å; F19-Y24 HydrophobicContact CD2-CD2 3.6Å; F19-Y24 AromaticContact CD2-CE2 3.92Å; F19-Y24 HydrophobicContact CD2-CE2 3.92Å; F19-Y24 HydrophobicContact CD2-CG 4.5Å; F19-Y24 HydrophobicContact CE2-CD2 4.18Å; F19-Y24 HydrophobicContact CG-CD2 4.41Å; F19-Y24 HydrophobicContact CG-CE2 4.31Å; I21-Y24 PolarHBondContact O-N 3.42Å; K22-Y24 PolarHBondContact O-N 3.04Å; Y24-M26 PolarHBondContact O-N 2.92Å; Y24-P45 WeakPolarHBondContact O-CD 3.15Å; Y24-R90 HydrophobicContact CD1-CG 3.87Å; Y24-R90 HydrophobicContact CD2-CG 4.5Å; Y24-R90 HydrophobicContact CG-CG 3.77Å; Y24-W91 WeakPolarHBondContact CD1-O 3.07Å
25	Y	95.1	Very high	92.5	Very high	66 Å²	66	63.5 Å²	63.5	26%	0.259	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-65.4	131.5	163.7	-65	-59.7	0	0	0	111	R42 I43 D44 W91	Y25-R42 VanDerWaalsContact CE1-CZ 3.48Å; Y25-I43 WeakPolarHBondContact CA-O 3.45Å; Y25-D44 HydrophobicContact CD1-CB 3.77Å; Y25-D44 HydrophobicContact CE1-CB 3.51Å; Y25-D44 VanDerWaalsContact CE1-CG 3.46Å; Y25-D44 WeakPolarHBondContact CE1-OD2 3.25Å; Y25-D44 PolarHBondContact OH-OD2 2.9Å; Y25-W91 HydrophobicContact CD2-CD2 4.46Å; Y25-W91 AromaticContact CD2-CE3 3.49Å; Y25-W91 HydrophobicContact CD2-CE3 3.49Å; Y25-W91 VanDerWaalsContact CD2-CE3 3.49Å; Y25-W91 AromaticContact CD2-CZ3 3.67Å; Y25-W91 HydrophobicContact CD2-CZ3 3.67Å; Y25-W91 HydrophobicContact CE2-CE3 4.15Å; Y25-W91 AromaticContact CE2-CZ3 3.85Å; Y25-W91 HydrophobicContact CE2-CZ3 3.85Å; Y25-W91 PolarHBondContact O-N 2.83Å; Y25-W91 VanDerWaalsContact O-N 3.16Å
26	M	96.6	Very high	92	Very high	5 Å²	5	61.9 Å²	61.9	3%	0.025	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	121.8	174	-63	-57.3	-58.4	0	0	109.4	F19 I21 Y24 R42 I43 P45 A71 R90	F19-M26 HydrophobicContact CE2-SD 4.15Å; F19-M26 HydrophobicContact CZ-SD 4.35Å; I21-M26 HydrophobicContact CD1-CG 3.93Å; I21-M26 HydrophobicContact CD1-SD 4.43Å; I21-M26 HydrophobicContact CG1-CG 3.6Å; I21-M26 HydrophobicContact CG1-SD 3.94Å; Y24-M26 PolarHBondContact O-N 2.92Å; M26-R42 CarbonylContact O-C 3.41Å; M26-R42 VanDerWaalsContact O-CA 3.24Å; M26-R42 WeakPolarHBondContact O-CA 3.49Å; M26-I43 HydrophobicContact CB-CG2 3.97Å; M26-I43 PolarHBondContact N-O 2.86Å; M26-I43 PolarHBondContact O-N 3.41Å; M26-P45 HydrophobicContact CB-CG 4.5Å; M26-P45 HydrophobicContact CG-CG 3.89Å; M26-A71 HydrophobicContact CB-CB 4.17Å; M26-A71 HydrophobicContact CG-CB 4.35Å; M26-R90 HydrophobicContact SD-CB 4.35Å; M26-R90 HydrophobicContact SD-CG 4.46Å
27	H	97.1	Very high	91.9	Very high	15 Å²	15	66.2 Å²	66.2	7%	0.069	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	147	-177.8	-69.3	-114.4	0	0	0	110.5	W39 G41 C88 A89 F96	H27-W39 AromaticContact CG-NE1 3.85Å; H27-W39 AromaticContact ND1-CD1 3.93Å; H27-W39 AromaticContact ND1-CE2 3.77Å; H27-W39 AromaticContact ND1-NE1 3.04Å; H27-W39 PolarHBondContact ND1-NE1 2.91Å; H27-G41 WeakPolarHBondContact CA-O 3.41Å; H27-C88 CarbonylContact O-C 3.52Å; H27-C88 WeakPolarHBondContact O-CA 3.07Å; H27-A89 PolarHBondContact N-O 2.89Å; H27-A89 PolarHBondContact O-N 2.86Å; H27-F96 HydrophobicContact CB-CD1 4.45Å; H27-F96 HydrophobicContact CB-CE1 3.73Å; H27-F96 HydrophobicContact CB-CZ 4.05Å; H27-F96 AromaticContact CD2-CE1 3.64Å; H27-F96 AromaticContact CE1-CE1 3.69Å; H27-F96 AromaticContact CG-CE1 3.29Å; H27-F96 AromaticContact CG-CZ 3.79Å; H27-F96 AromaticContact ND1-CE1 3.33Å; H27-F96 VanDerWaalsContact ND1-CE1 3.33Å; H27-F96 WeakPolarHBondContact ND1-CE1 3.31Å; H27-F96 AromaticContact ND1-CZ 3.48Å; H27-F96 WeakPolarHBondContact ND1-CZ 3.12Å; H27-F96 AromaticContact NE2-CE1 3.9Å
28	W	97.8	Very high	92	Very high	5 Å²	5	62.8 Å²	62.8	2%	0.019	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.8	171.4	-71.4	94.5	0	0	0	110.1	L12 C14 I40 G41 M62 A71 L73 Y87 C88	L12-W28 HydrophobicContact CB-CH2 4.02Å; L12-W28 HydrophobicContact CB-CZ3 4.04Å; L12-W28 HydrophobicContact CD1-CZ3 4.4Å; C14-W28 HydrophobicContact CB-CH2 3.73Å; C14-W28 HydrophobicContact CB-CZ2 3.92Å; W28-I40 HydrophobicContact CB-CB 4.11Å; W28-I40 HydrophobicContact CB-CD1 4.25Å; W28-I40 WeakPolarHBondContact O-CB 3.21Å; W28-I40 PolarHBondContact O-N 2.88Å; W28-G41 PolarHBondContact N-O 3.18Å; W28-G41 PolarHBondContact O-N 3.46Å; W28-M62 VanDerWaalsContact CD1-SD 3.58Å; W28-M62 HydrophobicContact CG-SD 4.4Å; W28-A71 HydrophobicContact CZ2-CB 4.47Å; W28-L73 HydrophobicContact CB-CD2 4.1Å; W28-L73 HydrophobicContact CD2-CB 3.54Å; W28-L73 HydrophobicContact CD2-CD2 3.87Å; W28-L73 HydrophobicContact CD2-CG 4.22Å; W28-L73 HydrophobicContact CE3-CB 3.83Å; W28-L73 HydrophobicContact CE3-CD2 3.73Å; W28-L73 HydrophobicContact CE3-CG 4.41Å; W28-L73 HydrophobicContact CG-CB 4.04Å; W28-L73 HydrophobicContact CG-CD1 4.3Å; W28-L73 HydrophobicContact CG-CD2 4.05Å; W28-L73 HydrophobicContact CG-CG 4.37Å; W28-L73 HydrophobicContact CH2-CB 4.02Å; W28-L73 HydrophobicContact CZ2-CB 3.77Å; W28-L73 HydrophobicContact CZ3-CB 4.05Å; W28-L73 HydrophobicContact CZ3-CD2 4.41Å; W28-Y87 WeakPolarHBondContact CA-O 3.44Å; W28-C88 HydrophobicContact CD2-CB 4.36Å; W28-C88 HydrophobicContact CE3-CB 4.14Å; W28-C88 HydrophobicContact CH2-CB 4.17Å; W28-C88 HydrophobicContact CZ2-CB 4.35Å; W28-C88 HydrophobicContact CZ3-CB 4.05Å
29	V	96.8	Very high	92.2	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.012	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	138.3	-174.7	-176.4	0	0	0	0	109	L37 E38 Y86 Y87 W99	V29-L37 HydrophobicContact CG1-CB 3.8Å; V29-L37 HydrophobicContact CG1-CD2 3.87Å; V29-L37 HydrophobicContact CG1-CG 4.32Å; V29-E38 WeakPolarHBondContact CA-O 3.28Å; V29-Y86 WeakPolarHBondContact O-CA 3.44Å; V29-Y87 PolarHBondContact N-O 2.95Å; V29-Y87 PolarHBondContact O-N 2.86Å; V29-W99 HydrophobicContact CB-CH2 4.19Å; V29-W99 HydrophobicContact CB-CZ3 3.85Å; V29-W99 HydrophobicContact CG1-CH2 4.13Å; V29-W99 HydrophobicContact CG1-CZ3 4.06Å; V29-W99 HydrophobicContact CG2-CH2 3.86Å; V29-W99 HydrophobicContact CG2-CZ3 3.88Å
30	K	95.5	Very high	92.4	Very high	6 Å²	6	61.2 Å²	61.2	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	134.6	175.8	179.4	-178.8	179.4	166.7	0	109.4	E38 I40 F56 E81 A84 Y86	K30-E38 HydrophobicContact CB-CB 4.35Å; K30-E38 PolarHBondContact N-O 2.99Å; K30-E38 PolarHBondContact O-N 3.42Å; K30-I40 HydrophobicContact CB-CD1 4.02Å; K30-I40 HydrophobicContact CB-CG1 4.11Å; K30-F56 HydrophobicContact CD-CE1 4.23Å; K30-F56 HydrophobicContact CD-CZ 4.19Å; K30-E81 PolarHBondContact NZ-O 2.8Å; K30-A84 HydrophobicContact CD-CB 4.04Å; K30-A84 HydrophobicContact CG-CB 3.49Å; K30-A84 VanDerWaalsContact CG-CB 3.49Å; K30-Y86 HydrophobicContact CB-CD1 4.31Å; K30-Y86 HydrophobicContact CB-CE1 4.11Å; K30-Y86 HydrophobicContact CD-CE1 4.08Å; K30-Y86 HydrophobicContact CG-CD1 4.46Å; K30-Y86 HydrophobicContact CG-CE1 4Å
31	Q	95.5	Very high	92.5	Very high	74 Å²	74	58 Å²	58	35%	0.346	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.6	172.1	-167.5	179.8	16.9	0	0	110.1	L37 A84 V85 Y87	Q31-L37 HydrophobicContact CB-CD2 3.76Å; Q31-L37 HydrophobicContact CG-CD2 3.85Å; Q31-A84 WeakPolarHBondContact O-CA 3.48Å; Q31-A84 WeakPolarHBondContact O-CB 3.33Å; Q31-V85 PolarHBondContact N-O 2.78Å; Q31-V85 PolarHBondContact O-N 3.29Å; Q31-Y87 HydrophobicContact CB-CD2 4.34Å; Q31-Y87 HydrophobicContact CB-CE2 3.76Å; Q31-Y87 PolarHBondContact OE1-OH 3.02Å
32	R	90.3	Very high	92.6	Very high	41 Å²	41	59.3 Å²	59.3	16%	0.155	30%	0.296	C	S	.	.			trans	-97.5	154.6	169.7	-49.2	-170.1	-161.9	-163.2	-9.7	109.1	E34 Q35 E38 A84	R32-E34 PolarHBondContact O-N 2.87Å; R32-E34 VanDerWaalsContact O-N 3.08Å; R32-Q35 CarbonylContact C-O 3.5Å; R32-Q35 HydrophobicContact CB-CB 4.03Å; R32-Q35 VanDerWaalsContact CD-OE1 3.23Å; R32-Q35 HydrophobicContact CG-CB 4.44Å; R32-Q35 PolarHBondContact N-O 2.8Å; R32-Q35 PolarHBondContact O-N 3.42Å; R32-E38 IonicContact CZ-OE2 3.34Å; R32-E38 IonicContact NE-OE2 2.62Å; R32-E38 PolarHBondContact NE-OE2 3.02Å; R32-E38 IonicContact NH2-OE2 3.44Å; R32-E38 PolarHBondContact NH2-OE2 3.38Å; R32-A84 HydrophobicContact CG-CB 4.33Å
33	T	77.3	Confident	92.7	Very high	155 Å²	155	55.3 Å²	55.3	95%	0.951	28%	0.279	S	S	*	.	S	Bend	trans	-61.6	-22.5	-176.1	-16.3	0	0	0	0	113.1
34	E	81.2	Confident	92.8	Very high	191 Å²	191	50.9 Å²	50.9	89%	0.893	26%	0.255	S	S	*	.	S	Bend	trans	-122.5	-3.7	-178.3	-60.3	-177.5	177.1	0	0	113.8	R32	R32-E34 PolarHBondContact O-N 2.87Å; R32-E34 VanDerWaalsContact O-N 3.08Å
35	Q	75.1	Confident	93	Very high	100 Å²	100	47.7 Å²	47.7	47%	0.467	24%	0.244	S	C	.	.	S	Bend	trans	-124.9	135.6	178.9	-61.3	173.8	-11.8	0	0	107.6	R32	R32-Q35 CarbonylContact C-O 3.5Å; R32-Q35 HydrophobicContact CB-CB 4.03Å; R32-Q35 VanDerWaalsContact CD-OE1 3.23Å; R32-Q35 HydrophobicContact CG-CB 4.44Å; R32-Q35 PolarHBondContact N-O 2.8Å; R32-Q35 PolarHBondContact O-N 3.42Å
36	G	87.8	Confident	93	Very high	58 Å²	58	51.5 Å²	51.5	60%	0.598	26%	0.264	S	S	*	.			trans	-58.8	-170.2	-178	0	0	0	0	0	114	E38	G36-E38 PolarHBondContact O-N 2.79Å
37	L	93.4	Very high	93	Very high	100 Å²	100	56.9 Å²	56.9	52%	0.524	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	121	179.3	-63.1	173.8	0	0	0	110.9	V29 Q31 W99	V29-L37 HydrophobicContact CG1-CB 3.8Å; V29-L37 HydrophobicContact CG1-CD2 3.87Å; V29-L37 HydrophobicContact CG1-CG 4.32Å; Q31-L37 HydrophobicContact CB-CD2 3.76Å; Q31-L37 HydrophobicContact CG-CD2 3.85Å; L37-W99 HydrophobicContact CD1-CH2 3.93Å; L37-W99 HydrophobicContact CD1-CZ2 4.49Å
38	E	95.1	Very high	93	Very high	36 Å²	36	58.2 Å²	58.2	17%	0.168	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	115	172.4	-58.1	-171.6	87.3	0	0	109	V29 K30 R32 G36 I40 K55 F56	V29-E38 WeakPolarHBondContact CA-O 3.28Å; K30-E38 HydrophobicContact CB-CB 4.35Å; K30-E38 PolarHBondContact N-O 2.99Å; K30-E38 PolarHBondContact O-N 3.42Å; R32-E38 IonicContact CZ-OE2 3.34Å; R32-E38 IonicContact NE-OE2 2.62Å; R32-E38 PolarHBondContact NE-OE2 3.02Å; R32-E38 IonicContact NH2-OE2 3.44Å; R32-E38 PolarHBondContact NH2-OE2 3.38Å; G36-E38 PolarHBondContact O-N 2.79Å; E38-I40 PolarHBondContact O-N 3.26Å; E38-K55 IonicContact OE1-NZ 2.67Å; E38-K55 PolarHBondContact OE1-NZ 2.91Å; E38-K55 IonicContact OE2-NZ 3.83Å; E38-F56 HydrophobicContact CB-CE2 4.47Å; E38-F56 HydrophobicContact CB-CZ 4.41Å
39	W	95.5	Very high	92.9	Very high	94 Å²	94	61 Å²	61	36%	0.356	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	126	174.2	-177.9	65.7	0	0	0	110.5	H27 G41 R42 K51 A53	H27-W39 AromaticContact CG-NE1 3.85Å; H27-W39 AromaticContact ND1-CD1 3.93Å; H27-W39 AromaticContact ND1-CE2 3.77Å; H27-W39 AromaticContact ND1-NE1 3.04Å; H27-W39 PolarHBondContact ND1-NE1 2.91Å; W39-G41 VanDerWaalsContact CE2-C 3.4Å; W39-G41 VanDerWaalsContact CE2-CA 3.47Å; W39-G41 PolarHBondContact NE1-O 3.37Å; W39-R42 HydrophobicContact CZ2-CB 4.03Å; W39-R42 HydrophobicContact CZ2-CG 4.1Å; W39-K51 HydrophobicContact CH2-CB 4.25Å; W39-A53 HydrophobicContact CE3-CB 3.91Å; W39-A53 HydrophobicContact CZ3-CB 4.2Å; W39-A53 VanDerWaalsContact O-CB 3.22Å; W39-A53 WeakPolarHBondContact O-CB 3.36Å
40	I	97.1	Very high	93	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-47.4	179.6	-58.1	178.4	0	0	0	110	W28 K30 E38 A53 F56 A60 L73 Y86	W28-I40 HydrophobicContact CB-CB 4.11Å; W28-I40 HydrophobicContact CB-CD1 4.25Å; W28-I40 WeakPolarHBondContact O-CB 3.21Å; W28-I40 PolarHBondContact O-N 2.88Å; K30-I40 HydrophobicContact CB-CD1 4.02Å; K30-I40 HydrophobicContact CB-CG1 4.11Å; E38-I40 PolarHBondContact O-N 3.26Å; I40-A53 PolarHBondContact O-N 2.87Å; I40-F56 HydrophobicContact CB-CD2 4.27Å; I40-F56 HydrophobicContact CB-CE2 4.49Å; I40-F56 HydrophobicContact CB-CG 4.28Å; I40-F56 HydrophobicContact CG1-CD1 4.26Å; I40-F56 HydrophobicContact CG1-CD2 4.34Å; I40-F56 HydrophobicContact CG1-CE1 4.04Å; I40-F56 HydrophobicContact CG1-CE2 4.12Å; I40-F56 HydrophobicContact CG1-CG 4.4Å; I40-F56 HydrophobicContact CG1-CZ 3.96Å; I40-F56 HydrophobicContact CG2-CB 3.87Å; I40-F56 HydrophobicContact CG2-CD1 4.01Å; I40-F56 HydrophobicContact CG2-CD2 4.26Å; I40-F56 HydrophobicContact CG2-CG 3.79Å; I40-A60 HydrophobicContact CG2-CB 4.02Å; I40-L73 HydrophobicContact CD1-CD2 3.75Å; I40-L73 HydrophobicContact CG2-CD1 4.26Å; I40-Y86 HydrophobicContact CD1-CD1 3.75Å; I40-Y86 HydrophobicContact CD1-CE1 3.78Å
41	G	97.3	Very high	93.1	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.7	179.7	-173.1	0	0	0	0	0	113.1	H27 W28 W39 K51	H27-G41 WeakPolarHBondContact CA-O 3.41Å; W28-G41 PolarHBondContact N-O 3.18Å; W28-G41 PolarHBondContact O-N 3.46Å; W39-G41 VanDerWaalsContact CE2-C 3.4Å; W39-G41 VanDerWaalsContact CE2-CA 3.47Å; W39-G41 PolarHBondContact NE1-O 3.37Å; G41-K51 CarbonylContact C-O 3.53Å; G41-K51 WeakPolarHBondContact CA-O 3.28Å
42	R	96.8	Very high	93.2	Very high	28 Å²	28	67.5 Å²	67.5	11%	0.106	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	154.4	169.6	70.6	166.5	-174.1	68.6	-0.7	111.4	Y25 M26 W39 E49 T50 K51 M62	Y25-R42 VanDerWaalsContact CE1-CZ 3.48Å; M26-R42 CarbonylContact O-C 3.41Å; M26-R42 VanDerWaalsContact O-CA 3.24Å; M26-R42 WeakPolarHBondContact O-CA 3.49Å; W39-R42 HydrophobicContact CZ2-CB 4.03Å; W39-R42 HydrophobicContact CZ2-CG 4.1Å; R42-E49 IonicContact CZ-OE2 2.75Å; R42-E49 IonicContact NH1-OE2 3.58Å; R42-E49 PolarHBondContact NH1-OE2 2.89Å; R42-E49 IonicContact NH2-OE1 2.86Å; R42-E49 IonicContact NH2-OE2 2.66Å; R42-E49 PolarHBondContact NH2-OE2 2.91Å; R42-T50 WeakPolarHBondContact O-CA 3.29Å; R42-K51 HydrophobicContact CG-CB 4.19Å; R42-K51 PolarHBondContact N-O 2.84Å; R42-K51 PolarHBondContact O-N 3.02Å; R42-M62 WeakPolarHBondContact O-CE 2.87Å
43	I	97.6	Very high	93.5	Very high	3 Å²	3	66.3 Å²	66.3	2%	0.015	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	140.3	167.1	-176.2	163.5	0	0	0	109.5	Y25 M26 P45 E49 T50 M62 T63 A64	Y25-I43 WeakPolarHBondContact CA-O 3.45Å; M26-I43 HydrophobicContact CB-CG2 3.97Å; M26-I43 PolarHBondContact N-O 2.86Å; M26-I43 PolarHBondContact O-N 3.41Å; I43-P45 WeakPolarHBondContact O-CD 3.39Å; I43-E49 CarbonylContact C-O 3.53Å; I43-E49 WeakPolarHBondContact CA-O 2.94Å; I43-T50 HydrophobicContact CB-CG2 3.92Å; I43-T50 HydrophobicContact CD1-CG2 3.91Å; I43-T50 HydrophobicContact CG1-CG2 3.77Å; I43-M62 HydrophobicContact CB-CB 4.13Å; I43-M62 HydrophobicContact CD1-CB 4.34Å; I43-M62 HydrophobicContact CG2-CB 4.49Å; I43-T63 VanDerWaalsContact CD1-C 3.42Å; I43-T63 VanDerWaalsContact CD1-CA 3.45Å; I43-A64 HydrophobicContact CD1-CB 4.04Å
44	D	97	Very high	94.4	Very high	14 Å²	14	64.3 Å²	64.3	8%	0.075	34%	0.342	C	S	.	.			trans	-85.7	111.5	158.8	-159.7	-34.5	0	0	0	109.2	Y25 E46 D47 G48 E49	Y25-D44 HydrophobicContact CD1-CB 3.77Å; Y25-D44 HydrophobicContact CE1-CB 3.51Å; Y25-D44 VanDerWaalsContact CE1-CG 3.46Å; Y25-D44 WeakPolarHBondContact CE1-OD2 3.25Å; Y25-D44 PolarHBondContact OH-OD2 2.9Å; D44-E46 PolarHBondContact O-N 3.12Å; D44-E46 VanDerWaalsContact OD1-CB 3.31Å; D44-E46 WeakPolarHBondContact OD1-CB 3.37Å; D44-E46 PolarHBondContact OD1-N 2.85Å; D44-D47 VanDerWaalsContact CB-OD1 3.3Å; D44-D47 WeakPolarHBondContact CB-OD1 3.45Å; D44-G48 WeakPolarHBondContact O-CA 3.34Å; D44-G48 PolarHBondContact O-N 3.42Å; D44-E49 HydrophobicContact CB-CB 4.11Å; D44-E49 PolarHBondContact N-O 2.85Å
45	P	96.9	Very high	94.9	Very high	8 Å²	8	59.8 Å²	59.8	5%	0.052	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-17.1	178.2	-21.6	38.3	0	0	0	113.2	I21 Y24 M26 I43 A64 T66	I21-P45 HydrophobicContact CG1-CB 4.43Å; I21-P45 HydrophobicContact CG1-CG 4.03Å; I21-P45 HydrophobicContact CG2-CB 4.13Å; I21-P45 WeakPolarHBondContact O-CB 3.22Å; I21-P45 VanDerWaalsContact O-CG 3.25Å; I21-P45 WeakPolarHBondContact O-CG 3.33Å; Y24-P45 WeakPolarHBondContact O-CD 3.15Å; M26-P45 HydrophobicContact CB-CG 4.5Å; M26-P45 HydrophobicContact CG-CG 3.89Å; I43-P45 WeakPolarHBondContact O-CD 3.39Å; P45-A64 HydrophobicContact CB-CB 3.76Å; P45-A64 HydrophobicContact CG-CB 4.24Å; P45-T66 HydrophobicContact CB-CG2 4.13Å; P45-T66 WeakPolarHBondContact O-CG2 3.39Å
46	E	96.1	Very high	95.8	Very high	147 Å²	147	55.7 Å²	55.7	69%	0.687	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-50	179.2	-174.8	173.6	-156.6	0	0	111.7	D44	D44-E46 PolarHBondContact O-N 3.12Å; D44-E46 VanDerWaalsContact OD1-CB 3.31Å; D44-E46 WeakPolarHBondContact OD1-CB 3.37Å; D44-E46 PolarHBondContact OD1-N 2.85Å
47	D	96.1	Very high	96.1	Very high	117 Å²	117	59.8 Å²	59.8	63%	0.626	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	-6.8	-174.2	70.3	6.6	0	0	0	114.3	D44 E49	D44-D47 VanDerWaalsContact CB-OD1 3.3Å; D44-D47 WeakPolarHBondContact CB-OD1 3.45Å; D47-E49 VanDerWaalsContact OD1-CB 3.23Å; D47-E49 WeakPolarHBondContact OD1-CB 3.2Å; D47-E49 PolarHBondContact OD1-N 2.84Å
48	G	96.2	Very high	96	Very high	43 Å²	43	58.6 Å²	58.6	44%	0.443	32%	0.316	S	S	.	.			trans	82.7	8.7	179.7	0	0	0	0	0	114.7	D44 T50	D44-G48 WeakPolarHBondContact O-CA 3.34Å; D44-G48 PolarHBondContact O-N 3.42Å; G48-T50 PolarHBondContact O-N 2.99Å
49	E	97.3	Very high	95.9	Very high	63 Å²	63	62.9 Å²	62.9	29%	0.294	33%	0.334	S	S	.	.			trans	-61	133.2	178	-170.5	-107.4	158.9	0	0	110.9	R42 I43 D44 D47 K51	R42-E49 IonicContact CZ-OE2 2.75Å; R42-E49 IonicContact NH1-OE2 3.58Å; R42-E49 PolarHBondContact NH1-OE2 2.89Å; R42-E49 IonicContact NH2-OE1 2.86Å; R42-E49 IonicContact NH2-OE2 2.66Å; R42-E49 PolarHBondContact NH2-OE2 2.91Å; I43-E49 CarbonylContact C-O 3.53Å; I43-E49 WeakPolarHBondContact CA-O 2.94Å; D44-E49 HydrophobicContact CB-CB 4.11Å; D44-E49 PolarHBondContact N-O 2.85Å; D47-E49 VanDerWaalsContact OD1-CB 3.23Å; D47-E49 WeakPolarHBondContact OD1-CB 3.2Å; D47-E49 PolarHBondContact OD1-N 2.84Å; E49-K51 VanDerWaalsContact OE1-CE 3.26Å; E49-K51 WeakPolarHBondContact OE1-CE 3.28Å; E49-K51 WeakPolarHBondContact OE1-CG 3.43Å
50	T	97.9	Very high	96	Very high	48 Å²	48	58.6 Å²	58.6	29%	0.294	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	140	-178.9	51.5	0	0	0	0	112	R42 I43 G48 Y52 M62	R42-T50 WeakPolarHBondContact O-CA 3.29Å; I43-T50 HydrophobicContact CB-CG2 3.92Å; I43-T50 HydrophobicContact CD1-CG2 3.91Å; I43-T50 HydrophobicContact CG1-CG2 3.77Å; G48-T50 PolarHBondContact O-N 2.99Å; T50-Y52 VanDerWaalsContact OG1-CE2 3.32Å; T50-Y52 WeakPolarHBondContact OG1-CE2 2.98Å; T50-M62 HydrophobicContact CG2-CB 4.04Å; T50-M62 HydrophobicContact CG2-CE 4.37Å
51	K	97.3	Very high	96	Very high	110 Å²	110	61.8 Å²	61.8	48%	0.478	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.6	168.4	-76.3	-179.1	179.6	165.7	0	110	W39 G41 R42 E49 M62	W39-K51 HydrophobicContact CH2-CB 4.25Å; G41-K51 CarbonylContact C-O 3.53Å; G41-K51 WeakPolarHBondContact CA-O 3.28Å; R42-K51 HydrophobicContact CG-CB 4.19Å; R42-K51 PolarHBondContact N-O 2.84Å; R42-K51 PolarHBondContact O-N 3.02Å; E49-K51 VanDerWaalsContact OE1-CE 3.26Å; E49-K51 WeakPolarHBondContact OE1-CE 3.28Å; E49-K51 WeakPolarHBondContact OE1-CG 3.43Å; K51-M62 WeakPolarHBondContact O-CE 3.26Å
52	Y	97.8	Very high	96	Very high	61 Å²	61	62.1 Å²	62.1	24%	0.239	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.4	-179.9	-59.1	-94.5	0	0	0	109.7	T50 A60 M62	T50-Y52 VanDerWaalsContact OG1-CE2 3.32Å; T50-Y52 WeakPolarHBondContact OG1-CE2 2.98Å; Y52-A60 HydrophobicContact CD1-CB 4.39Å; Y52-A60 HydrophobicContact CE1-CB 4.29Å; Y52-A60 VanDerWaalsContact CE1-O 3.29Å; Y52-A60 WeakPolarHBondContact CE1-O 2.99Å; Y52-M62 HydrophobicContact CD1-CE 3.51Å; Y52-M62 HydrophobicContact CD2-CE 4.37Å; Y52-M62 HydrophobicContact CE1-CE 3.22Å; Y52-M62 HydrophobicContact CE1-CG 4.24Å; Y52-M62 HydrophobicContact CE2-CE 4.13Å; Y52-M62 HydrophobicContact CG-CE 4.07Å; Y52-M62 PolarHBondContact OH-N 3.16Å; Y52-M62 VanDerWaalsContact OH-N 3.13Å
53	A	96.7	Very high	96.1	Very high	16 Å²	16	63.8 Å²	63.8	13%	0.132	35%	0.353	C	S	.	.			trans	-67.7	144.2	161.3	0	0	0	0	0	109.5	W39 I40 K55 F56 Q57	W39-A53 HydrophobicContact CE3-CB 3.91Å; W39-A53 HydrophobicContact CZ3-CB 4.2Å; W39-A53 VanDerWaalsContact O-CB 3.22Å; W39-A53 WeakPolarHBondContact O-CB 3.36Å; I40-A53 PolarHBondContact O-N 2.87Å; A53-K55 PolarHBondContact O-N 2.8Å; A53-F56 HydrophobicContact CB-CD2 4.11Å; A53-F56 PolarHBondContact O-N 2.88Å; A53-Q57 PolarHBondContact O-N 3.25Å
54	P	95.7	Very high	96.1	Very high	114 Å²	114	65.4 Å²	65.4	74%	0.74	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-52.4	-34.9	-174.6	-30.1	35.3	0	0	0	114.5	F56 Q57	P54-F56 PolarHBondContact O-N 3.04Å; P54-Q57 PolarHBondContact O-N 2.96Å
55	K	91.9	Very high	96.1	Very high	95 Å²	95	67.5 Å²	67.5	41%	0.413	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-62.9	-26.2	179	-175	175.1	-179.1	176.6	0	114.1	E38 A53	E38-K55 IonicContact OE1-NZ 2.67Å; E38-K55 PolarHBondContact OE1-NZ 2.91Å; E38-K55 IonicContact OE2-NZ 3.83Å; A53-K55 PolarHBondContact O-N 2.8Å
56	F	93.8	Very high	96.1	Very high	15 Å²	15	69.2 Å²	69.2	7%	0.066	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-108.1	-3.4	-173.5	-63.1	-82.2	0	0	0	113.5	K30 E38 I40 A53 P54 G58 K59 A60	K30-F56 HydrophobicContact CD-CE1 4.23Å; K30-F56 HydrophobicContact CD-CZ 4.19Å; E38-F56 HydrophobicContact CB-CE2 4.47Å; E38-F56 HydrophobicContact CB-CZ 4.41Å; I40-F56 HydrophobicContact CB-CD2 4.27Å; I40-F56 HydrophobicContact CB-CE2 4.49Å; I40-F56 HydrophobicContact CB-CG 4.28Å; I40-F56 HydrophobicContact CG1-CD1 4.26Å; I40-F56 HydrophobicContact CG1-CD2 4.34Å; I40-F56 HydrophobicContact CG1-CE1 4.04Å; I40-F56 HydrophobicContact CG1-CE2 4.12Å; I40-F56 HydrophobicContact CG1-CG 4.4Å; I40-F56 HydrophobicContact CG1-CZ 3.96Å; I40-F56 HydrophobicContact CG2-CB 3.87Å; I40-F56 HydrophobicContact CG2-CD1 4.01Å; I40-F56 HydrophobicContact CG2-CD2 4.26Å; I40-F56 HydrophobicContact CG2-CG 3.79Å; A53-F56 HydrophobicContact CB-CD2 4.11Å; A53-F56 PolarHBondContact O-N 2.88Å; P54-F56 PolarHBondContact O-N 3.04Å; F56-G58 PolarHBondContact O-N 3.5Å; F56-K59 PolarHBondContact O-N 2.93Å; F56-A60 HydrophobicContact CB-CB 4.38Å; F56-A60 PolarHBondContact O-N 3.45Å; F56-A60 VanDerWaalsContact O-N 3.1Å
57	Q	93.7	Very high	96.2	Very high	143 Å²	143	67.4 Å²	67.4	67%	0.668	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	128.5	175.8	-162.6	167.2	9.5	0	0	110.3	A53 P54 K59	A53-Q57 PolarHBondContact O-N 3.25Å; P54-Q57 PolarHBondContact O-N 2.96Å; Q57-K59 PolarHBondContact O-N 3.48Å
58	G	91.6	Very high	96.2	Very high	75 Å²	75	64 Å²	64	77%	0.773	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	-9.6	-175.9	0	0	0	0	0	115.6	F56	F56-G58 PolarHBondContact O-N 3.5Å
59	K	94.2	Very high	96.3	Very high	126 Å²	126	63.6 Å²	63.6	55%	0.548	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-23	177.1	-61.4	-177.5	-178.1	176.5	0	113.1	F56 Q57 N76	F56-K59 PolarHBondContact O-N 2.93Å; Q57-K59 PolarHBondContact O-N 3.48Å; K59-N76 PolarHBondContact O-N 2.82Å
60	A	96.3	Very high	96.3	Very high	5 Å²	5	61 Å²	61	4%	0.041	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	145.3	178.6	0	0	0	0	0	110.8	I40 Y52 F56 L73 Q74 L75	I40-A60 HydrophobicContact CG2-CB 4.02Å; Y52-A60 HydrophobicContact CD1-CB 4.39Å; Y52-A60 HydrophobicContact CE1-CB 4.29Å; Y52-A60 VanDerWaalsContact CE1-O 3.29Å; Y52-A60 WeakPolarHBondContact CE1-O 2.99Å; F56-A60 HydrophobicContact CB-CB 4.38Å; F56-A60 PolarHBondContact O-N 3.45Å; F56-A60 VanDerWaalsContact O-N 3.1Å; A60-L73 HydrophobicContact CB-CD1 3.88Å; A60-Q74 CarbonylContact C-O 3.38Å; A60-Q74 VanDerWaalsContact CA-O 3.28Å; A60-Q74 WeakPolarHBondContact CA-O 3.49Å; A60-L75 HydrophobicContact CB-CD2 4.28Å
61	T	97.8	Very high	96.3	Very high	66 Å²	66	58.7 Å²	58.7	41%	0.405	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	126.4	167.4	-53.2	0	0	0	0	108.2	T63 Q74	T61-T63 HydrophobicContact CG2-CG2 4.41Å; T61-Q74 PolarHBondContact N-O 3.41Å; T61-Q74 PolarHBondContact O-N 2.88Å
62	M	98.2	Very high	96.4	Very high	7 Å²	7	55.7 Å²	55.7	3%	0.034	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	137.5	174.8	-65.5	174.2	-75.7	0	0	109.9	W28 R42 I43 T50 K51 Y52 Y72 L73	W28-M62 VanDerWaalsContact CD1-SD 3.58Å; W28-M62 HydrophobicContact CG-SD 4.4Å; R42-M62 WeakPolarHBondContact O-CE 2.87Å; I43-M62 HydrophobicContact CB-CB 4.13Å; I43-M62 HydrophobicContact CD1-CB 4.34Å; I43-M62 HydrophobicContact CG2-CB 4.49Å; T50-M62 HydrophobicContact CG2-CB 4.04Å; T50-M62 HydrophobicContact CG2-CE 4.37Å; K51-M62 WeakPolarHBondContact O-CE 3.26Å; Y52-M62 HydrophobicContact CD1-CE 3.51Å; Y52-M62 HydrophobicContact CD2-CE 4.37Å; Y52-M62 HydrophobicContact CE1-CE 3.22Å; Y52-M62 HydrophobicContact CE1-CG 4.24Å; Y52-M62 HydrophobicContact CE2-CE 4.13Å; Y52-M62 HydrophobicContact CG-CE 4.07Å; Y52-M62 PolarHBondContact OH-N 3.16Å; Y52-M62 VanDerWaalsContact OH-N 3.13Å; M62-Y72 WeakPolarHBondContact CA-O 2.99Å; M62-L73 HydrophobicContact CG-CD1 3.79Å
63	T	98.1	Very high	96.4	Very high	64 Å²	64	52.8 Å²	52.8	39%	0.393	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	164.5	172.3	63.1	0	0	0	0	110.1	I43 T61 Y72	I43-T63 VanDerWaalsContact CD1-C 3.42Å; I43-T63 VanDerWaalsContact CD1-CA 3.45Å; T61-T63 HydrophobicContact CG2-CG2 4.41Å; T63-Y72 PolarHBondContact N-O 2.93Å; T63-Y72 PolarHBondContact O-N 2.82Å
64	A	97.9	Very high	96.4	Very high	37 Å²	37	54.6 Å²	54.6	31%	0.306	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144.5	174.5	0	0	0	0	0	110.6	I43 P45 T70	I43-A64 HydrophobicContact CD1-CB 4.04Å; P45-A64 HydrophobicContact CB-CB 3.76Å; P45-A64 HydrophobicContact CG-CB 4.24Å; A64-T70 WeakPolarHBondContact CA-O 3.16Å
65	D	97.6	Very high	96.4	Very high	58 Å²	58	49.5 Å²	49.5	31%	0.31	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	111.6	167.2	174.7	9.1	0	0	0	108.3	S67 S68 N69 T70 Y72	D65-S67 WeakPolarHBondContact OD1-CB 3.45Å; D65-S67 PolarHBondContact OD1-N 3.47Å; D65-S67 PolarHBondContact OD1-OG 2.85Å; D65-S67 PolarHBondContact OD2-OG 3.1Å; D65-S68 WeakPolarHBondContact CB-OG 3.24Å; D65-S68 PolarHBondContact OD1-N 3.04Å; D65-S68 WeakPolarHBondContact OD2-CB 3.39Å; D65-S68 PolarHBondContact OD2-OG 3.33Å; D65-N69 PolarHBondContact O-N 3.37Å; D65-N69 VanDerWaalsContact O-N 3.12Å; D65-T70 PolarHBondContact N-O 2.97Å; D65-T70 PolarHBondContact O-N 2.62Å; D65-Y72 HydrophobicContact CB-CE2 3.97Å
66	T	96.9	Very high	96.6	Very high	43 Å²	43	47.5 Å²	47.5	26%	0.264	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-17.3	-174.4	59.9	0	0	0	0	112.7	I21 K22 P45	I21-T66 HydrophobicContact CG2-CG2 4.35Å; K22-T66 HydrophobicContact CD-CG2 4.06Å; K22-T66 VanDerWaalsContact CE-CG2 3.49Å; K22-T66 WeakPolarHBondContact CE-OG1 3.47Å; K22-T66 HydrophobicContact CG-CG2 3.41Å; K22-T66 VanDerWaalsContact CG-CG2 3.41Å; P45-T66 HydrophobicContact CB-CG2 4.13Å; P45-T66 WeakPolarHBondContact O-CG2 3.39Å
67	S	96.4	Very high	96.5	Very high	109 Å²	109	50.8 Å²	50.8	76%	0.762	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-36.7	173.4	72.9	0	0	0	0	111.4	D65	D65-S67 WeakPolarHBondContact OD1-CB 3.45Å; D65-S67 PolarHBondContact OD1-N 3.47Å; D65-S67 PolarHBondContact OD1-OG 2.85Å; D65-S67 PolarHBondContact OD2-OG 3.1Å
68	S	97.5	Very high	96.4	Very high	46 Å²	46	44.5 Å²	44.5	32%	0.322	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	7.5	175.7	66	0	0	0	0	113.6	D65 T70	D65-S68 WeakPolarHBondContact CB-OG 3.24Å; D65-S68 PolarHBondContact OD1-N 3.04Å; D65-S68 WeakPolarHBondContact OD2-CB 3.39Å; D65-S68 PolarHBondContact OD2-OG 3.33Å; S68-T70 PolarHBondContact O-N 3.29Å; S68-T70 PolarHBondContact O-OG1 2.02Å
69	N	97.3	Very high	96.4	Very high	35 Å²	35	44.7 Å²	44.7	19%	0.187	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	38.7	179.1	-149.4	41.5	0	0	0	113.4	A16 F19 I21 D65	A16-N69 WeakPolarHBondContact CB-ND2 3.38Å; A16-N69 PolarHBondContact N-O 3.18Å; A16-N69 PolarHBondContact O-ND2 2.97Å; F19-N69 PolarHBondContact O-ND2 3.2Å; I21-N69 WeakPolarHBondContact CB-OD1 3.35Å; I21-N69 VanDerWaalsContact CG2-OD1 3.27Å; I21-N69 WeakPolarHBondContact CG2-OD1 3.37Å; I21-N69 PolarHBondContact N-OD1 2.93Å; D65-N69 PolarHBondContact O-N 3.37Å; D65-N69 VanDerWaalsContact O-N 3.12Å
70	T	98.1	Very high	96.1	Very high	7 Å²	7	43 Å²	43	4%	0.043	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	129.3	-168.1	-61.2	0	0	0	0	112.3	C14 T15 A64 D65 S68 Y72	C14-T70 CarbonylContact O-C 3.58Å; C14-T70 WeakPolarHBondContact O-CA 3.36Å; T15-T70 WeakPolarHBondContact CB-OG1 3.47Å; T15-T70 WeakPolarHBondContact CG2-OG1 3.3Å; T15-T70 PolarHBondContact OG1-OG1 2.65Å; A64-T70 WeakPolarHBondContact CA-O 3.16Å; D65-T70 PolarHBondContact N-O 2.97Å; D65-T70 PolarHBondContact O-N 2.62Å; S68-T70 PolarHBondContact O-N 3.29Å; S68-T70 PolarHBondContact O-OG1 2.02Å; T70-Y72 HydrophobicContact CG2-CD1 4.21Å; T70-Y72 HydrophobicContact CG2-CD2 4.49Å; T70-Y72 HydrophobicContact CG2-CE1 3.58Å; T70-Y72 HydrophobicContact CG2-CE2 3.9Å
71	A	97.9	Very high	95.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	151.5	168.6	0	0	0	0	0	110.6	S13 C14 I21 M26 W28	S13-A71 CarbonylContact C-O 3.52Å; S13-A71 WeakPolarHBondContact CA-O 3.43Å; C14-A71 PolarHBondContact N-O 2.78Å; C14-A71 PolarHBondContact O-N 3.16Å; I21-A71 HydrophobicContact CD1-CB 3.88Å; M26-A71 HydrophobicContact CB-CB 4.17Å; M26-A71 HydrophobicContact CG-CB 4.35Å; W28-A71 HydrophobicContact CZ2-CB 4.47Å
72	Y	98.3	Very high	95.3	Very high	48 Å²	48	45.3 Å²	45.3	19%	0.188	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	146.5	-178.9	-56.3	-82.9	0	0	0	111.7	K11 L12 M62 T63 D65 T70	K11-Y72 HydrophobicContact CD-CD1 4.41Å; K11-Y72 VanDerWaalsContact CE-CD1 3.46Å; K11-Y72 VanDerWaalsContact CE-CG 3.47Å; L12-Y72 CarbonylContact O-C 3.54Å; L12-Y72 WeakPolarHBondContact O-CA 3.26Å; M62-Y72 WeakPolarHBondContact CA-O 2.99Å; T63-Y72 PolarHBondContact N-O 2.93Å; T63-Y72 PolarHBondContact O-N 2.82Å; D65-Y72 HydrophobicContact CB-CE2 3.97Å; T70-Y72 HydrophobicContact CG2-CD1 4.21Å; T70-Y72 HydrophobicContact CG2-CD2 4.49Å; T70-Y72 HydrophobicContact CG2-CE1 3.58Å; T70-Y72 HydrophobicContact CG2-CE2 3.9Å
73	L	98.3	Very high	95.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	112	170.4	176	70.6	0	0	0	108.9	L12 W28 I40 A60 M62 L75 Y86	L12-L73 HydrophobicContact CB-CB 4.39Å; L12-L73 HydrophobicContact CD1-CD2 4.41Å; L12-L73 PolarHBondContact N-O 3.27Å; L12-L73 PolarHBondContact O-N 2.86Å; W28-L73 HydrophobicContact CB-CD2 4.1Å; W28-L73 HydrophobicContact CD2-CB 3.54Å; W28-L73 HydrophobicContact CD2-CD2 3.87Å; W28-L73 HydrophobicContact CD2-CG 4.22Å; W28-L73 HydrophobicContact CE3-CB 3.83Å; W28-L73 HydrophobicContact CE3-CD2 3.73Å; W28-L73 HydrophobicContact CE3-CG 4.41Å; W28-L73 HydrophobicContact CG-CB 4.04Å; W28-L73 HydrophobicContact CG-CD1 4.3Å; W28-L73 HydrophobicContact CG-CD2 4.05Å; W28-L73 HydrophobicContact CG-CG 4.37Å; W28-L73 HydrophobicContact CH2-CB 4.02Å; W28-L73 HydrophobicContact CZ2-CB 3.77Å; W28-L73 HydrophobicContact CZ3-CB 4.05Å; W28-L73 HydrophobicContact CZ3-CD2 4.41Å; I40-L73 HydrophobicContact CD1-CD2 3.75Å; I40-L73 HydrophobicContact CG2-CD1 4.26Å; A60-L73 HydrophobicContact CB-CD1 3.88Å; M62-L73 HydrophobicContact CG-CD1 3.79Å; L73-L75 HydrophobicContact CD1-CD2 4.44Å; L73-L75 HydrophobicContact CD2-CD1 4.42Å; L73-L75 HydrophobicContact CD2-CD2 4.06Å; L73-L75 HydrophobicContact CD2-CG 4.19Å; L73-L75 HydrophobicContact CG-CD2 4.18Å; L73-L75 HydrophobicContact CG-CG 4.18Å; L73-Y86 HydrophobicContact CD2-CD1 4.13Å
74	Q	97.6	Very high	95	Very high	54 Å²	54	44.2 Å²	44.2	25%	0.252	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	120.5	169.2	-175.8	70.4	48	0	0	108.8	V10 K11 A60 T61 N76	V10-Q74 CarbonylContact O-C 3.58Å; V10-Q74 WeakPolarHBondContact O-CA 3.35Å; V10-Q74 PolarHBondContact O-NE2 3.07Å; K11-Q74 VanDerWaalsContact CB-OE1 3.25Å; A60-Q74 CarbonylContact C-O 3.38Å; A60-Q74 VanDerWaalsContact CA-O 3.28Å; A60-Q74 WeakPolarHBondContact CA-O 3.49Å; T61-Q74 PolarHBondContact N-O 3.41Å; T61-Q74 PolarHBondContact O-N 2.88Å; Q74-N76 WeakPolarHBondContact CG-OD1 3.43Å
75	L	96.2	Very high	94.9	Very high	6 Å²	6	44.1 Å²	44.1	3%	0.031	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	130.4	170.8	-63.5	167.3	0	0	0	108.4	S9 V10 L12 A60 L73 L78 Y86 L105	S9-L75 CarbonylContact C-O 3.47Å; S9-L75 WeakPolarHBondContact CA-O 3.33Å; S9-L75 WeakPolarHBondContact CB-O 3.33Å; V10-L75 PolarHBondContact N-O 2.94Å; V10-L75 PolarHBondContact O-N 2.81Å; L12-L75 HydrophobicContact CD1-CD1 4.43Å; A60-L75 HydrophobicContact CB-CD2 4.28Å; L73-L75 HydrophobicContact CD1-CD2 4.44Å; L73-L75 HydrophobicContact CD2-CD1 4.42Å; L73-L75 HydrophobicContact CD2-CD2 4.06Å; L73-L75 HydrophobicContact CD2-CG 4.19Å; L73-L75 HydrophobicContact CG-CD2 4.18Å; L73-L75 HydrophobicContact CG-CG 4.18Å; L75-L78 HydrophobicContact CB-CD1 4.48Å; L75-L78 HydrophobicContact CB-CD2 3.93Å; L75-L78 HydrophobicContact CB-CG 4.25Å; L75-L78 HydrophobicContact CD1-CD2 4.22Å; L75-Y86 HydrophobicContact CD1-CD1 3.99Å; L75-Y86 HydrophobicContact CD1-CE1 3.44Å; L75-Y86 VanDerWaalsContact CD1-CE1 3.44Å; L75-Y86 HydrophobicContact CD1-CE2 4.18Å; L75-Y86 HydrophobicContact CD2-CE1 4.18Å; L75-Y86 HydrophobicContact CG-CE1 4.44Å; L75-L105 HydrophobicContact CD1-CD1 3.81Å
76	N	94.1	Very high	94.9	Very high	54 Å²	54	41.6 Å²	41.6	29%	0.289	25%	0.251	S	S	.	.			trans	-109.8	143.4	-176	-61.4	-45.4	0	0	0	111.2	K59 Q74 L78	K59-N76 PolarHBondContact O-N 2.82Å; Q74-N76 WeakPolarHBondContact CG-OD1 3.43Å; N76-L78 PolarHBondContact O-N 3.18Å
77	S	91.8	Very high	94.9	Very high	84 Å²	84	41.6 Å²	41.6	59%	0.587	25%	0.246	S	C	*	.	S	Bend	trans	50.4	54.5	172.5	-55.7	0	0	0	0	113	A8 T79	A8-S77 PolarHBondContact O-N 3.3Å; S77-T79 PolarHBondContact O-N 2.75Å
78	L	91.8	Very high	94.9	Very high	11 Å²	11	37.1 Å²	37.1	6%	0.058	22%	0.215	C	C	.	.			trans	-60	132.5	-175.6	-76.7	170	0	0	0	111.9	V4 P6 G7 A8 V10 L75 N76 V107	V4-L78 HydrophobicContact CG2-CD1 3.91Å; P6-L78 CarbonylContact C-O 3.56Å; P6-L78 WeakPolarHBondContact CA-O 3.46Å; G7-L78 PolarHBondContact N-O 3.46Å; A8-L78 WeakPolarHBondContact O-CB 3.32Å; A8-L78 PolarHBondContact O-N 2.67Å; V10-L78 HydrophobicContact CB-CD1 4.02Å; V10-L78 HydrophobicContact CG2-CD1 3.59Å; L75-L78 HydrophobicContact CB-CD1 4.48Å; L75-L78 HydrophobicContact CB-CD2 3.93Å; L75-L78 HydrophobicContact CB-CG 4.25Å; L75-L78 HydrophobicContact CD1-CD2 4.22Å; N76-L78 PolarHBondContact O-N 3.18Å; L78-V107 HydrophobicContact CB-CG2 4.06Å; L78-V107 HydrophobicContact CD1-CG2 4.48Å
79	T	91.4	Very high	94.9	Very high	78 Å²	78	35 Å²	35	48%	0.479	20%	0.2	S	C	.	.			trans	-105.5	175.3	171.1	63.7	0	0	0	0	110.1	S77 E81 G82 V107	S77-T79 PolarHBondContact O-N 2.75Å; T79-E81 PolarHBondContact O-N 2.95Å; T79-G82 WeakPolarHBondContact O-CA 3.38Å; T79-G82 PolarHBondContact O-N 3.13Å; T79-V107 WeakPolarHBondContact O-CB 3.35Å; T79-V107 WeakPolarHBondContact O-CG2 3.4Å
80	S	88.9	Confident	94.7	Very high	90 Å²	90	34.7 Å²	34.7	63%	0.629	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-53.3	-35.7	174.4	52.8	0	0	0	0	112.6	G82 S83	S80-G82 PolarHBondContact O-N 2.66Å; S80-G82 VanDerWaalsContact O-N 3.16Å; S80-S83 WeakPolarHBondContact O-CB 3.5Å; S80-S83 PolarHBondContact O-N 3.45Å; S80-S83 PolarHBondContact O-OG 2.86Å
81	E	87.7	Confident	94.1	Very high	114 Å²	114	39.3 Å²	39.3	53%	0.533	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-62	-19.6	174	-64.3	-173.9	-164.7	0	0	113.5	K30 T79 S83	K30-E81 PolarHBondContact NZ-O 2.8Å; T79-E81 PolarHBondContact O-N 2.95Å; E81-S83 PolarHBondContact O-N 3.5Å
82	G	90.1	Very high	93	Very high	6 Å²	6	40.8 Å²	40.8	6%	0.062	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-65.8	-18.9	172.9	0	0	0	0	0	113.6	T79 S80 A84 Y86	T79-G82 WeakPolarHBondContact O-CA 3.38Å; T79-G82 PolarHBondContact O-N 3.13Å; S80-G82 PolarHBondContact O-N 2.66Å; S80-G82 VanDerWaalsContact O-N 3.16Å; G82-A84 PolarHBondContact O-N 3.46Å; G82-Y86 WeakPolarHBondContact O-CE2 3.25Å; G82-Y86 PolarHBondContact O-OH 2.87Å
83	S	93.8	Very high	91.8	Very high	41 Å²	41	40.4 Å²	40.4	29%	0.287	24%	0.239	S	C	.	.			trans	-66.8	119.4	-179.4	-52.4	0	0	0	0	111.3	S80 E81 L105 V107	S80-S83 WeakPolarHBondContact O-CB 3.5Å; S80-S83 PolarHBondContact O-N 3.45Å; S80-S83 PolarHBondContact O-OG 2.86Å; E81-S83 PolarHBondContact O-N 3.5Å; S83-L105 CarbonylContact C-O 3.55Å; S83-L105 VanDerWaalsContact CA-O 3.26Å; S83-L105 WeakPolarHBondContact CA-O 3.4Å; S83-V107 PolarHBondContact OG-N 3.36Å
84	A	95.3	Very high	90.5	Very high	8 Å²	8	50.4 Å²	50.4	7%	0.066	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174	172.9	-173.6	0	0	0	0	0	111.4	K30 Q31 R32 G82 Y86 L105	K30-A84 HydrophobicContact CD-CB 4.04Å; K30-A84 HydrophobicContact CG-CB 3.49Å; K30-A84 VanDerWaalsContact CG-CB 3.49Å; Q31-A84 WeakPolarHBondContact O-CA 3.48Å; Q31-A84 WeakPolarHBondContact O-CB 3.33Å; R32-A84 HydrophobicContact CG-CB 4.33Å; G82-A84 PolarHBondContact O-N 3.46Å; A84-Y86 HydrophobicContact CB-CD2 4.27Å; A84-Y86 HydrophobicContact CB-CE2 3.78Å; A84-L105 PolarHBondContact N-O 3.45Å; A84-L105 PolarHBondContact O-N 3.31Å
85	V	96.6	Very high	89.5	Confident	34 Å²	34	56.7 Å²	56.7	21%	0.206	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.4	161.2	-167.3	0	0	0	0	109.1	Q31 Y87 T104	Q31-V85 PolarHBondContact N-O 2.78Å; Q31-V85 PolarHBondContact O-N 3.29Å; V85-Y87 HydrophobicContact CB-CE2 3.73Å; V85-Y87 HydrophobicContact CG1-CD2 4.29Å; V85-Y87 HydrophobicContact CG1-CE1 4.01Å; V85-Y87 HydrophobicContact CG1-CE2 3.54Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.36Å; V85-T104 HydrophobicContact CG2-CG2 4.48Å
86	Y	97.2	Very high	88.9	Confident	5 Å²	5	59.8 Å²	59.8	2%	0.02	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.2	180	-72.2	-96.8	0	0	0	110	L12 V29 K30 I40 L73 L75 G82 A84 G102 T103 L105	L12-Y86 VanDerWaalsContact CD1-CB 3.4Å; L12-Y86 HydrophobicContact CD1-CD1 4.17Å; L12-Y86 HydrophobicContact CD1-CD2 4.32Å; L12-Y86 HydrophobicContact CD1-CG 3.73Å; V29-Y86 WeakPolarHBondContact O-CA 3.44Å; K30-Y86 HydrophobicContact CB-CD1 4.31Å; K30-Y86 HydrophobicContact CB-CE1 4.11Å; K30-Y86 HydrophobicContact CD-CE1 4.08Å; K30-Y86 HydrophobicContact CG-CD1 4.46Å; K30-Y86 HydrophobicContact CG-CE1 4Å; I40-Y86 HydrophobicContact CD1-CD1 3.75Å; I40-Y86 HydrophobicContact CD1-CE1 3.78Å; L73-Y86 HydrophobicContact CD2-CD1 4.13Å; L75-Y86 HydrophobicContact CD1-CD1 3.99Å; L75-Y86 HydrophobicContact CD1-CE1 3.44Å; L75-Y86 VanDerWaalsContact CD1-CE1 3.44Å; L75-Y86 HydrophobicContact CD1-CE2 4.18Å; L75-Y86 HydrophobicContact CD2-CE1 4.18Å; L75-Y86 HydrophobicContact CG-CE1 4.44Å; G82-Y86 WeakPolarHBondContact O-CE2 3.25Å; G82-Y86 PolarHBondContact O-OH 2.87Å; A84-Y86 HydrophobicContact CB-CD2 4.27Å; A84-Y86 HydrophobicContact CB-CE2 3.78Å; Y86-G102 CarbonylContact O-C 3.59Å; Y86-G102 VanDerWaalsContact O-CA 3.25Å; Y86-G102 WeakPolarHBondContact O-CA 3.2Å; Y86-T103 PolarHBondContact N-O 2.64Å; Y86-T103 PolarHBondContact O-N 3.12Å; Y86-L105 HydrophobicContact CD2-CB 4.11Å; Y86-L105 HydrophobicContact CD2-CD1 3.8Å; Y86-L105 HydrophobicContact CD2-CG 3.88Å; Y86-L105 HydrophobicContact CE2-CB 3.97Å; Y86-L105 HydrophobicContact CE2-CD1 3.76Å; Y86-L105 HydrophobicContact CE2-CG 4.08Å
87	Y	97.2	Very high	88.4	Confident	44 Å²	44	60.4 Å²	60.4	17%	0.173	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	144.4	-178.8	-60.1	-87.3	0	0	0	110.2	W28 V29 Q31 V85 W99 G100 G102	W28-Y87 WeakPolarHBondContact CA-O 3.44Å; V29-Y87 PolarHBondContact N-O 2.95Å; V29-Y87 PolarHBondContact O-N 2.86Å; Q31-Y87 HydrophobicContact CB-CD2 4.34Å; Q31-Y87 HydrophobicContact CB-CE2 3.76Å; Q31-Y87 PolarHBondContact OE1-OH 3.02Å; V85-Y87 HydrophobicContact CB-CE2 3.73Å; V85-Y87 HydrophobicContact CG1-CD2 4.29Å; V85-Y87 HydrophobicContact CG1-CE1 4.01Å; V85-Y87 HydrophobicContact CG1-CE2 3.54Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.36Å; Y87-W99 HydrophobicContact CD1-CE3 4.47Å; Y87-W99 HydrophobicContact CG-CE3 4.16Å; Y87-W99 HydrophobicContact CG-CZ3 4.34Å; Y87-G100 WeakPolarHBondContact CD1-O 3.27Å; Y87-G102 VanDerWaalsContact CD1-CA 3.41Å; Y87-G102 VanDerWaalsContact CE1-CA 3.49Å
88	C	96.8	Very high	88.3	Confident	14 Å²	14	63 Å²	63	10%	0.095	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	149.1	156.7	59.2	0	0	0	0	109.3	C14 H27 W28 G100	C14-C88 HydrophobicContact CB-CB 3.43Å; C14-C88 VanDerWaalsContact CB-CB 3.43Å; C14-C88 WeakPolarHBondContact CB-SG 3.21Å; C14-C88 WeakPolarHBondContact SG-CB 3.37Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.87Å; H27-C88 CarbonylContact O-C 3.52Å; H27-C88 WeakPolarHBondContact O-CA 3.07Å; W28-C88 HydrophobicContact CD2-CB 4.36Å; W28-C88 HydrophobicContact CE3-CB 4.14Å; W28-C88 HydrophobicContact CH2-CB 4.17Å; W28-C88 HydrophobicContact CZ2-CB 4.35Å; W28-C88 HydrophobicContact CZ3-CB 4.05Å; C88-G100 PolarHBondContact O-N 2.75Å
89	A	95.9	Very high	88.5	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.008	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	146.8	175	0	0	0	0	0	111	H27 F96 Y98 W99	H27-A89 PolarHBondContact N-O 2.89Å; H27-A89 PolarHBondContact O-N 2.86Å; A89-F96 HydrophobicContact CB-CB 4.2Å; A89-F96 HydrophobicContact CB-CD1 4.14Å; A89-F96 HydrophobicContact CB-CG 4.11Å; A89-Y98 CarbonylContact C-O 3.59Å; A89-Y98 WeakPolarHBondContact CA-O 3.49Å; A89-Y98 WeakPolarHBondContact CB-O 3.43Å; A89-W99 HydrophobicContact CB-CD2 3.84Å; A89-W99 HydrophobicContact CB-CE3 3.98Å; A89-W99 HydrophobicContact CB-CG 4.28Å; A89-W99 HydrophobicContact CB-CZ2 4.41Å; A89-W99 HydrophobicContact CB-CZ3 4.31Å
90	R	93.9	Very high	88.6	Confident	30 Å²	30	64.9 Å²	64.9	11%	0.113	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	144.2	170.2	-172.4	-175.8	82	170.1	14.9	109.6	F19 Y24 M26 F96 D97 Y98	F19-R90 HydrophobicContact CE2-CG 4.24Å; F19-R90 HydrophobicContact CZ-CB 4.33Å; F19-R90 HydrophobicContact CZ-CG 4.31Å; Y24-R90 HydrophobicContact CD1-CG 3.87Å; Y24-R90 HydrophobicContact CD2-CG 4.5Å; Y24-R90 HydrophobicContact CG-CG 3.77Å; M26-R90 HydrophobicContact SD-CB 4.35Å; M26-R90 HydrophobicContact SD-CG 4.46Å; R90-F96 WeakPolarHBondContact O-CA 3.23Å; R90-D97 IonicContact CZ-OD1 2.97Å; R90-D97 IonicContact CZ-OD2 3.76Å; R90-D97 IonicContact NE-OD1 3.14Å; R90-D97 PolarHBondContact NE-OD1 2.78Å; R90-D97 IonicContact NE-OD2 3.74Å; R90-D97 PolarHBondContact NE-OD2 2.82Å; R90-D97 IonicContact NH2-OD1 3.27Å; R90-D97 IonicContact NH2-OD2 3.29Å; R90-D97 PolarHBondContact NH2-OD2 2.8Å; R90-D97 PolarHBondContact O-N 3.2Å; R90-Y98 VanDerWaalsContact CZ-CE2 3.44Å; R90-Y98 PolarHBondContact N-O 3.21Å
91	W	85.4	Confident	88.9	Confident	103 Å²	103	69.6 Å²	69.6	39%	0.39	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	120.5	168.6	-172.7	57	0	0	0	111.9	Y24 Y25 G93	Y24-W91 WeakPolarHBondContact CD1-O 3.07Å; Y25-W91 HydrophobicContact CD2-CD2 4.46Å; Y25-W91 AromaticContact CD2-CE3 3.49Å; Y25-W91 HydrophobicContact CD2-CE3 3.49Å; Y25-W91 VanDerWaalsContact CD2-CE3 3.49Å; Y25-W91 AromaticContact CD2-CZ3 3.67Å; Y25-W91 HydrophobicContact CD2-CZ3 3.67Å; Y25-W91 HydrophobicContact CE2-CE3 4.15Å; Y25-W91 AromaticContact CE2-CZ3 3.85Å; Y25-W91 HydrophobicContact CE2-CZ3 3.85Å; Y25-W91 PolarHBondContact O-N 2.83Å; Y25-W91 VanDerWaalsContact O-N 3.16Å; W91-G93 WeakPolarHBondContact CZ2-O 3.3Å; W91-G93 PolarHBondContact NE1-O 2.83Å
92	G	73.9	Confident	89.2	Confident	31 Å²	31	65.5 Å²	65.5	32%	0.32	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	70.2	178.4	0	0	0	0	0	112.2	Y94 Y95 D97	G92-Y94 PolarHBondContact O-N 3.34Å; G92-Y95 PolarHBondContact N-O 3.19Å; G92-D97 VanDerWaalsContact CA-OD2 3.28Å; G92-D97 WeakPolarHBondContact CA-OD2 3.5Å
93	G	73.4	Confident	89.5	Confident	41 Å²	41	67.7 Å²	67.7	42%	0.423	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	-77.9	177.3	0	0	0	0	0	114	W91	W91-G93 WeakPolarHBondContact CZ2-O 3.3Å; W91-G93 PolarHBondContact NE1-O 2.83Å
94	Y	72.4	Confident	89.5	Confident	209 Å²	209	68.5 Å²	68.5	82%	0.82	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-13.8	-175.7	-64.6	-72.4	0	0	0	114.6	G92	G92-Y94 PolarHBondContact O-N 3.34Å
95	Y	76.5	Confident	89.5	Confident	186 Å²	186	68.2 Å²	68.2	73%	0.729	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.3	166.9	-176	-56.2	-78.3	0	0	0	111.8	G92 D97	G92-Y95 PolarHBondContact N-O 3.19Å; Y95-D97 PolarHBondContact O-N 3.24Å
96	F	83.3	Confident	89.4	Confident	72 Å²	72	69.4 Å²	69.4	32%	0.316	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	111	165.1	-61.6	-44.9	0	0	0	109.2	H27 A89 R90 W99	H27-F96 HydrophobicContact CB-CD1 4.45Å; H27-F96 HydrophobicContact CB-CE1 3.73Å; H27-F96 HydrophobicContact CB-CZ 4.05Å; H27-F96 AromaticContact CD2-CE1 3.64Å; H27-F96 AromaticContact CE1-CE1 3.69Å; H27-F96 AromaticContact CG-CE1 3.29Å; H27-F96 AromaticContact CG-CZ 3.79Å; H27-F96 AromaticContact ND1-CE1 3.33Å; H27-F96 VanDerWaalsContact ND1-CE1 3.33Å; H27-F96 WeakPolarHBondContact ND1-CE1 3.31Å; H27-F96 AromaticContact ND1-CZ 3.48Å; H27-F96 WeakPolarHBondContact ND1-CZ 3.12Å; H27-F96 AromaticContact NE2-CE1 3.9Å; A89-F96 HydrophobicContact CB-CB 4.2Å; A89-F96 HydrophobicContact CB-CD1 4.14Å; A89-F96 HydrophobicContact CB-CG 4.11Å; R90-F96 WeakPolarHBondContact O-CA 3.23Å; F96-W99 HydrophobicContact CB-CZ2 3.83Å; F96-W99 HydrophobicContact CD2-CH2 4.06Å; F96-W99 AromaticContact CD2-CZ2 3.52Å; F96-W99 HydrophobicContact CD2-CZ2 3.52Å; F96-W99 HydrophobicContact CE2-CZ2 4.44Å; F96-W99 AromaticContact CG-CZ2 3.99Å; F96-W99 HydrophobicContact CG-CZ2 3.99Å
97	D	84.1	Confident	89.1	Confident	67 Å²	67	69.7 Å²	69.7	36%	0.358	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-27.6	-172.9	59.2	-6.2	0	0	0	113.2	R90 G92 Y95	R90-D97 IonicContact CZ-OD1 2.97Å; R90-D97 IonicContact CZ-OD2 3.76Å; R90-D97 IonicContact NE-OD1 3.14Å; R90-D97 PolarHBondContact NE-OD1 2.78Å; R90-D97 IonicContact NE-OD2 3.74Å; R90-D97 PolarHBondContact NE-OD2 2.82Å; R90-D97 IonicContact NH2-OD1 3.27Å; R90-D97 IonicContact NH2-OD2 3.29Å; R90-D97 PolarHBondContact NH2-OD2 2.8Å; R90-D97 PolarHBondContact O-N 3.2Å; G92-D97 VanDerWaalsContact CA-OD2 3.28Å; G92-D97 WeakPolarHBondContact CA-OD2 3.5Å; Y95-D97 PolarHBondContact O-N 3.24Å
98	Y	89.7	Confident	88.7	Confident	139 Å²	139	69.9 Å²	69.9	55%	0.545	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	133.5	173.4	-69.1	-88.2	0	0	0	111.9	A89 R90	A89-Y98 CarbonylContact C-O 3.59Å; A89-Y98 WeakPolarHBondContact CA-O 3.49Å; A89-Y98 WeakPolarHBondContact CB-O 3.43Å; R90-Y98 VanDerWaalsContact CZ-CE2 3.44Å; R90-Y98 PolarHBondContact N-O 3.21Å
99	W	94.4	Very high	87.8	Confident	102 Å²	102	76.8 Å²	76.8	39%	0.386	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.2	177	-69.8	76.8	0	0	0	110.5	V29 L37 Y87 A89 F96	V29-W99 HydrophobicContact CB-CH2 4.19Å; V29-W99 HydrophobicContact CB-CZ3 3.85Å; V29-W99 HydrophobicContact CG1-CH2 4.13Å; V29-W99 HydrophobicContact CG1-CZ3 4.06Å; V29-W99 HydrophobicContact CG2-CH2 3.86Å; V29-W99 HydrophobicContact CG2-CZ3 3.88Å; L37-W99 HydrophobicContact CD1-CH2 3.93Å; L37-W99 HydrophobicContact CD1-CZ2 4.49Å; Y87-W99 HydrophobicContact CD1-CE3 4.47Å; Y87-W99 HydrophobicContact CG-CE3 4.16Å; Y87-W99 HydrophobicContact CG-CZ3 4.34Å; A89-W99 HydrophobicContact CB-CD2 3.84Å; A89-W99 HydrophobicContact CB-CE3 3.98Å; A89-W99 HydrophobicContact CB-CG 4.28Å; A89-W99 HydrophobicContact CB-CZ2 4.41Å; A89-W99 HydrophobicContact CB-CZ3 4.31Å; F96-W99 HydrophobicContact CB-CZ2 3.83Å; F96-W99 HydrophobicContact CD2-CH2 4.06Å; F96-W99 AromaticContact CD2-CZ2 3.52Å; F96-W99 HydrophobicContact CD2-CZ2 3.52Å; F96-W99 HydrophobicContact CE2-CZ2 4.44Å; F96-W99 AromaticContact CG-CZ2 3.99Å; F96-W99 HydrophobicContact CG-CZ2 3.99Å
100	G	94.4	Very high	87.4	Confident	25 Å²	25	80.6 Å²	80.6	26%	0.258	42%	0.42	S	S	.	.			trans	-66.8	163.3	167.1	0	0	0	0	0	111.6	Y87 C88 G102	Y87-G100 WeakPolarHBondContact CD1-O 3.27Å; C88-G100 PolarHBondContact O-N 2.75Å; G100-G102 PolarHBondContact O-N 2.88Å; G100-G102 VanDerWaalsContact O-N 3.12Å
101	Q	94.1	Very high	87.1	Confident	190 Å²	190	83.3 Å²	83.3	89%	0.888	44%	0.436	S	S	*	.			trans	-64	-17.8	-179.9	-64.9	-61.3	-42.8	0	0	113.7
102	G	94.5	Very high	87.2	Confident	27 Å²	27	82.2 Å²	82.2	28%	0.278	44%	0.438	S	S	.	.			trans	85.5	146.7	-178	0	0	0	0	0	112.8	Y86 Y87 G100	Y86-G102 CarbonylContact O-C 3.59Å; Y86-G102 VanDerWaalsContact O-CA 3.25Å; Y86-G102 WeakPolarHBondContact O-CA 3.2Å; Y87-G102 VanDerWaalsContact CD1-CA 3.41Å; Y87-G102 VanDerWaalsContact CE1-CA 3.49Å; G100-G102 PolarHBondContact O-N 2.88Å; G100-G102 VanDerWaalsContact O-N 3.12Å
103	T	95.7	Very high	87.9	Confident	53 Å²	53	85.2 Å²	85.2	33%	0.325	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	116.2	176.3	-61.6	0	0	0	0	109.2	L12 Y86 L105	L12-T103 HydrophobicContact CD2-CG2 3.88Å; Y86-T103 PolarHBondContact N-O 2.64Å; Y86-T103 PolarHBondContact O-N 3.12Å; T103-L105 HydrophobicContact CG2-CD2 4.28Å; T103-L105 PolarHBondContact O-N 3.42Å
104	T	95.8	Very high	88.9	Confident	58 Å²	58	87.9 Å²	87.9	36%	0.356	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	121.6	171.9	-46.7	0	0	0	0	110.1	A1 E2 V85	A1-T104 CarbonylContact C-O 3.48Å; A1-T104 WeakPolarHBondContact CA-O 3.46Å; A1-T104 HydrophobicContact CB-CG2 4.5Å; E2-T104 PolarHBondContact N-O 2.94Å; V85-T104 HydrophobicContact CG2-CG2 4.48Å
105	L	93.9	Very high	89.9	Confident	1 Å²	1	79.9 Å²	79.9	1%	0.005	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.7	166.6	-64.4	-173.3	0	0	0	109.1	E2 V10 L12 L75 S83 A84 Y86 T103	E2-L105 HydrophobicContact CB-CD2 3.57Å; E2-L105 HydrophobicContact CG-CD2 4.36Å; V10-L105 HydrophobicContact CB-CD1 4.45Å; V10-L105 HydrophobicContact CG1-CD1 4.06Å; V10-L105 HydrophobicContact CG1-CD2 4.14Å; L12-L105 HydrophobicContact CD1-CD1 4.09Å; L12-L105 HydrophobicContact CD2-CD1 4.14Å; L12-L105 HydrophobicContact CD2-CD2 4.06Å; L12-L105 HydrophobicContact CD2-CG 4.33Å; L12-L105 HydrophobicContact CG-CD1 4.34Å; L75-L105 HydrophobicContact CD1-CD1 3.81Å; S83-L105 CarbonylContact C-O 3.55Å; S83-L105 VanDerWaalsContact CA-O 3.26Å; S83-L105 WeakPolarHBondContact CA-O 3.4Å; A84-L105 PolarHBondContact N-O 3.45Å; A84-L105 PolarHBondContact O-N 3.31Å; Y86-L105 HydrophobicContact CD2-CB 4.11Å; Y86-L105 HydrophobicContact CD2-CD1 3.8Å; Y86-L105 HydrophobicContact CD2-CG 3.88Å; Y86-L105 HydrophobicContact CE2-CB 3.97Å; Y86-L105 HydrophobicContact CE2-CD1 3.76Å; Y86-L105 HydrophobicContact CE2-CG 4.08Å; T103-L105 HydrophobicContact CG2-CD2 4.28Å; T103-L105 PolarHBondContact O-N 3.42Å
106	T	94.1	Very high	90.9	Very high	60 Å²	60	72.3 Å²	72.3	37%	0.368	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.3	174.5	-57.8	0	0	0	0	109.1	E2 L3 V4	E2-T106 PolarHBondContact O-N 3.08Å; L3-T106 WeakPolarHBondContact CA-O 3.36Å; L3-T106 HydrophobicContact CD1-CG2 3.71Å; V4-T106 PolarHBondContact N-O 2.93Å
107	V	91.5	Very high	91.5	Very high	11 Å²	11	72.3 Å²	72.3	7%	0.067	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	110.2	178.3	-169.7	0	0	0	0	109	V4 P6 L78 T79 S83	V4-V107 HydrophobicContact CG2-CB 4.32Å; V4-V107 HydrophobicContact CG2-CG1 4.38Å; V4-V107 HydrophobicContact CG2-CG2 3.76Å; V4-V107 VanDerWaalsContact O-CA 3.3Å; V4-V107 WeakPolarHBondContact O-CA 3.11Å; P6-V107 HydrophobicContact CB-CG1 4.41Å; P6-V107 HydrophobicContact CG-CG1 4.14Å; L78-V107 HydrophobicContact CB-CG2 4.06Å; L78-V107 HydrophobicContact CD1-CG2 4.48Å; T79-V107 WeakPolarHBondContact O-CB 3.35Å; T79-V107 WeakPolarHBondContact O-CG2 3.4Å; S83-V107 PolarHBondContact OG-N 3.36Å
108	S	89.2	Confident	92.1	Very high	48 Å²	48	72.8 Å²	72.8	34%	0.336	41%	0.41	S	S	.	.			trans	-139.3	146.9	-179.6	67.7	0	0	0	0	111.9	L3 V4 P6	L3-S108 VanDerWaalsContact CD1-OG 3.28Å; L3-S108 WeakPolarHBondContact CD1-OG 3.46Å; V4-S108 PolarHBondContact O-N 2.64Å; P6-S108 WeakPolarHBondContact CD-O 2.94Å
109	S	77.9	Confident	92.3	Very high	159 Å²	159	66.7 Å²	66.7	100%	1.112	40%	0.398	S	S	*	.			trans	-72.8	0	172.9	56.8	0	0	0	0	112.5

Retrieved 109 of 109 residues in 26.9 ms (Link to these results)

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