X5J4U2_MOUSE Loading...

IgG1 heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J4U2, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 108 aa.

						>X5J4U2_MOUSE|X5J4U2
AELVKPGASVKLSCTGSGFNIKDTFIHWVKQRPEQGLEWIGGIDPANGNTNYDPKFQGKATITADTSSNTAYLQLSSLTSEDTAVYYCARKDEYFDYWGQGTTLTVSS
					

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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	77.9	Confident	93.4	Very high	116 Å²	116	75.6 Å²	75.6	96%	0.959	46%	0.459	S	S	*	.				0	141.1	0	0	0	0	0	0	108.2	T103	A1-T103 CarbonylContact C-O 3.56Å; A1-T103 WeakPolarHBondContact CA-O 3.5Å
2	E	86.8	Confident	93.7	Very high	72 Å²	72	69.9 Å²	69.9	34%	0.336	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	131.4	-175.7	-163.5	173.1	161	0	0	110	V4 V10 T103 L104 T105	E2-V4 HydrophobicContact CG-CG1 3.96Å; E2-V10 WeakPolarHBondContact OE1-CG2 3.26Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.45Å; E2-T103 PolarHBondContact N-O 3.46Å; E2-L104 HydrophobicContact CB-CD1 3.98Å; E2-L104 HydrophobicContact CG-CD1 4.37Å; E2-L104 WeakPolarHBondContact O-CA 3.4Å; E2-T105 PolarHBondContact O-N 2.92Å
3	L	93.5	Very high	94	Very high	126 Å²	126	70.2 Å²	70.2	66%	0.66	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	119.9	179	179.5	65.5	0	0	0	108.7	T105 S107	L3-T105 WeakPolarHBondContact CA-O 3.29Å; L3-T105 HydrophobicContact CD1-CG2 3.69Å; L3-S107 WeakPolarHBondContact CD1-OG 3.38Å
4	V	95.2	Very high	94.1	Very high	20 Å²	20	66.6 Å²	66.6	12%	0.121	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	156.1	-174.8	-59.8	0	0	0	0	111.6	E2 A8 L78 L104 T105 V106 S107	E2-V4 HydrophobicContact CG-CG1 3.96Å; V4-A8 HydrophobicContact CB-CB 4.24Å; V4-L78 HydrophobicContact CG2-CD1 3.49Å; V4-L78 VanDerWaalsContact CG2-CD1 3.49Å; V4-L104 HydrophobicContact CG1-CD1 4.35Å; V4-L104 HydrophobicContact CG2-CD1 3.88Å; V4-T105 PolarHBondContact N-O 3.3Å; V4-V106 HydrophobicContact CG2-CB 4.42Å; V4-V106 HydrophobicContact CG2-CG1 4.43Å; V4-V106 HydrophobicContact CG2-CG2 3.86Å; V4-V106 WeakPolarHBondContact O-CA 3.47Å; V4-S107 PolarHBondContact O-N 2.63Å
5	K	95.2	Very high	94.2	Very high	146 Å²	146	68.2 Å²	68.2	64%	0.635	42%	0.419	S	S	*	.			trans	-81.8	152.4	175.7	-64.6	-174	178.6	-175.4	0	110.9	A8	K5-A8 WeakPolarHBondContact O-CB 3.29Å; K5-A8 PolarHBondContact O-N 3.31Å
6	P	96.6	Very high	94.1	Very high	75 Å²	75	64.5 Å²	64.5	49%	0.487	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	141.9	170.2	-25.2	34	0	0	0	112.2	A8 L78 V106	P6-A8 VanDerWaalsContact C-N 3.25Å; P6-A8 PolarHBondContact O-N 3.06Å; P6-L78 CarbonylContact C-O 3.57Å; P6-L78 WeakPolarHBondContact CA-O 3.41Å; P6-V106 HydrophobicContact CB-CG1 4.46Å; P6-V106 HydrophobicContact CG-CG1 4.18Å
7	G	95.1	Very high	93.9	Very high	55 Å²	55	67.1 Å²	67.1	57%	0.567	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-10.6	-176.5	0	0	0	0	0	114.9	L78	G7-L78 PolarHBondContact N-O 2.94Å
8	A	96.1	Very high	93.7	Very high	34 Å²	34	68.3 Å²	68.3	28%	0.281	45%	0.448	S	S	.	.			trans	-68	166.1	174.9	0	0	0	0	0	112	V4 K5 P6 S77 L78	V4-A8 HydrophobicContact CB-CB 4.24Å; K5-A8 WeakPolarHBondContact O-CB 3.29Å; K5-A8 PolarHBondContact O-N 3.31Å; P6-A8 VanDerWaalsContact C-N 3.25Å; P6-A8 PolarHBondContact O-N 3.06Å; A8-S77 PolarHBondContact O-N 3.23Å; A8-L78 WeakPolarHBondContact O-CB 3.49Å; A8-L78 WeakPolarHBondContact O-CG 3.17Å; A8-L78 PolarHBondContact O-N 2.81Å
9	S	96.6	Very high	93.4	Very high	67 Å²	67	67.7 Å²	67.7	47%	0.469	44%	0.437	S	S	.	.			trans	-118.8	144.9	169	-57.9	0	0	0	0	109.6	L75 S76	S9-L75 CarbonylContact C-O 3.59Å; S9-L75 WeakPolarHBondContact CA-O 3.36Å; S9-L75 WeakPolarHBondContact CB-O 3.13Å; S9-S76 WeakPolarHBondContact OG-CA 3.26Å
10	V	96.9	Very high	93.4	Very high	5 Å²	5	67.9 Å²	67.9	3%	0.03	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	149	178.8	62.1	0	0	0	0	110.2	E2 L12 Q74 L75 L78 L104	E2-V10 WeakPolarHBondContact OE1-CG2 3.26Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.45Å; V10-L12 HydrophobicContact CG2-CD2 3.77Å; V10-L12 HydrophobicContact CG2-CG 4.27Å; V10-Q74 CarbonylContact O-C 3.55Å; V10-Q74 VanDerWaalsContact O-CA 3.26Å; V10-Q74 WeakPolarHBondContact O-CA 3.13Å; V10-L75 HydrophobicContact CG1-CB 3.86Å; V10-L75 HydrophobicContact CG1-CD1 4.17Å; V10-L75 HydrophobicContact CG1-CG 4.42Å; V10-L75 PolarHBondContact N-O 2.83Å; V10-L75 PolarHBondContact O-N 2.89Å; V10-L78 HydrophobicContact CB-CD1 4.2Å; V10-L78 HydrophobicContact CG1-CD1 3.79Å; V10-L78 HydrophobicContact CG1-CD2 4.46Å; V10-L104 HydrophobicContact CB-CD1 4.49Å; V10-L104 HydrophobicContact CG1-CD1 4.26Å; V10-L104 HydrophobicContact CG1-CD2 3.91Å; V10-L104 HydrophobicContact CG2-CD1 4.39Å
11	K	97.5	Very high	93.3	Very high	116 Å²	116	64.7 Å²	64.7	50%	0.504	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	107.7	170.9	-174.5	177.5	177.6	-179.1	0	109.7	Y72 L73	K11-Y72 HydrophobicContact CD-CD1 4.37Å; K11-Y72 HydrophobicContact CG-CD1 4.32Å; K11-L73 WeakPolarHBondContact CA-O 2.97Å
12	L	97.6	Very high	94.1	Very high	7 Å²	7	63.7 Å²	63.7	4%	0.037	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	146.8	174.3	-55.3	-179.6	0	0	0	110	V10 W28 Y72 L73 Y86 T102	V10-L12 HydrophobicContact CG2-CD2 3.77Å; V10-L12 HydrophobicContact CG2-CG 4.27Å; L12-W28 HydrophobicContact CB-CH2 4.01Å; L12-W28 HydrophobicContact CB-CZ3 4.05Å; L12-Y72 WeakPolarHBondContact O-CA 3.23Å; L12-L73 HydrophobicContact CB-CB 4.49Å; L12-L73 HydrophobicContact CD1-CD2 4.38Å; L12-L73 PolarHBondContact N-O 3.07Å; L12-L73 PolarHBondContact O-N 3.1Å; L12-Y86 HydrophobicContact CD1-CD1 4.3Å; L12-Y86 HydrophobicContact CD1-CD2 4.19Å; L12-Y86 HydrophobicContact CD1-CG 3.75Å; L12-T102 HydrophobicContact CD2-CG2 4.01Å
13	S	97	Very high	94.3	Very high	73 Å²	73	66 Å²	66	51%	0.51	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	149.9	177.2	59.4	0	0	0	0	111.9	A71	S13-A71 CarbonylContact C-O 3.53Å; S13-A71 WeakPolarHBondContact CA-O 2.96Å
14	C	95.8	Very high	94.1	Very high	20 Å²	20	60.4 Å²	60.4	14%	0.135	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	106.3	173.5	178.1	0	0	0	0	109.1	W28 T70 A71 C88	C14-W28 HydrophobicContact CB-CH2 3.79Å; C14-W28 HydrophobicContact CB-CZ2 3.83Å; C14-T70 CarbonylContact O-C 3.48Å; C14-T70 WeakPolarHBondContact O-CA 3.38Å; C14-A71 PolarHBondContact N-O 2.81Å; C14-A71 PolarHBondContact O-N 3.05Å; C14-C88 HydrophobicContact CB-CB 3.42Å; C14-C88 VanDerWaalsContact CB-CB 3.42Å; C14-C88 WeakPolarHBondContact CB-SG 3.36Å; C14-C88 WeakPolarHBondContact SG-CB 3.22Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.89Å
15	T	95.9	Very high	94	Very high	91 Å²	91	63.2 Å²	63.2	56%	0.558	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	123.3	-178.8	-56.4	0	0	0	0	110	T70	T15-T70 PolarHBondContact OG1-OG1 3.21Å
16	G	91.9	Very high	94	Very high	9 Å²	9	56.4 Å²	56.4	9%	0.093	36%	0.355	C	S	.	.			trans	-68.1	137.9	173.7	0	0	0	0	0	111.1	N69	G16-N69 VanDerWaalsContact C-ND2 3.3Å; G16-N69 PolarHBondContact N-O 3.17Å; G16-N69 PolarHBondContact O-ND2 3.27Å
17	S	91.3	Very high	94	Very high	109 Å²	109	53.8 Å²	53.8	76%	0.762	34%	0.336	S	S	*	.			trans	-131.2	129.7	176.5	-177.9	0	0	0	0	109.4	F19	S17-F19 VanDerWaalsContact C-N 3.28Å; S17-F19 VanDerWaalsContact O-CD1 3.3Å; S17-F19 WeakPolarHBondContact O-CD1 3.4Å; S17-F19 PolarHBondContact O-N 3.48Å
18	G	89.7	Confident	94.1	Very high	89 Å²	89	51.4 Å²	51.4	92%	0.918	31%	0.31	S	S	*	.	S	Bend	trans	76.5	8.8	-177.5	0	0	0	0	0	115.2
19	F	88.6	Confident	94.1	Very high	57 Å²	57	50 Å²	50	25%	0.25	30%	0.298	C	S	.	.	S	Bend	trans	-153.1	161.7	173.4	69.3	-81.9	0	0	0	110.8	S17 I21 T24 I26 N69 R90	S17-F19 VanDerWaalsContact C-N 3.28Å; S17-F19 VanDerWaalsContact O-CD1 3.3Å; S17-F19 WeakPolarHBondContact O-CD1 3.4Å; S17-F19 PolarHBondContact O-N 3.48Å; F19-I21 HydrophobicContact CE2-CB 4.37Å; F19-I21 HydrophobicContact CE2-CG1 4.22Å; F19-T24 HydrophobicContact CD2-CG2 4.08Å; F19-T24 HydrophobicContact CE2-CG2 3.82Å; F19-I26 HydrophobicContact CE2-CD1 4.3Å; F19-N69 PolarHBondContact O-ND2 3.06Å; F19-R90 VanDerWaalsContact CE2-CD 3.46Å; F19-R90 HydrophobicContact CE2-CG 4.28Å; F19-R90 VanDerWaalsContact CG-NH1 3.25Å; F19-R90 HydrophobicContact CZ-CG 4.46Å
20	N	92.1	Very high	94.1	Very high	71 Å²	71	46.9 Å²	46.9	38%	0.38	28%	0.276	S	S	.	.			trans	-91.3	123.5	171.5	176.2	4.8	0	0	0	109.5	K22 D23	N20-K22 PolarHBondContact O-N 2.97Å; N20-K22 VanDerWaalsContact O-N 3.15Å; N20-K22 WeakPolarHBondContact OD1-CB 3.43Å; N20-K22 PolarHBondContact OD1-N 3.12Å; N20-K22 VanDerWaalsContact OD1-N 3.1Å; N20-D23 WeakPolarHBondContact CB-OD2 3.32Å; N20-D23 PolarHBondContact O-N 2.82Å; N20-D23 VanDerWaalsContact O-N 3.11Å
21	I	92.6	Very high	94.1	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-64.9	-19.8	-174.9	-149.9	177.7	0	0	0	112.6	F19 D23 T24 I26 P45 T66 N69 A71	F19-I21 HydrophobicContact CE2-CB 4.37Å; F19-I21 HydrophobicContact CE2-CG1 4.22Å; I21-D23 PolarHBondContact O-N 2.79Å; I21-T24 WeakPolarHBondContact O-CG2 3.43Å; I21-I26 HydrophobicContact CD1-CD1 4.2Å; I21-I26 HydrophobicContact CD1-CG1 3.78Å; I21-I26 HydrophobicContact CG1-CD1 3.67Å; I21-I26 HydrophobicContact CG1-CG1 3.48Å; I21-I26 VanDerWaalsContact CG1-CG1 3.48Å; I21-P45 HydrophobicContact CG1-CG 4.14Å; I21-P45 HydrophobicContact CG2-CB 4.07Å; I21-P45 HydrophobicContact CG2-CG 4.4Å; I21-P45 WeakPolarHBondContact O-CD 3.47Å; I21-P45 WeakPolarHBondContact O-CG 3.27Å; I21-T66 HydrophobicContact CG2-CG2 4.32Å; I21-N69 VanDerWaalsContact CB-OD1 3.25Å; I21-N69 WeakPolarHBondContact CB-OD1 3.49Å; I21-N69 WeakPolarHBondContact CG2-OD1 3.21Å; I21-N69 PolarHBondContact N-OD1 3.4Å; I21-A71 HydrophobicContact CD1-CB 3.79Å
22	K	93.3	Very high	93.8	Very high	94 Å²	94	46.9 Å²	46.9	41%	0.409	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-66.5	-22.7	174.7	-70.6	-170.4	179	-172.4	0	113.7	N20 T24 T66	N20-K22 PolarHBondContact O-N 2.97Å; N20-K22 VanDerWaalsContact O-N 3.15Å; N20-K22 WeakPolarHBondContact OD1-CB 3.43Å; N20-K22 PolarHBondContact OD1-N 3.12Å; N20-K22 VanDerWaalsContact OD1-N 3.1Å; K22-T24 VanDerWaalsContact C-N 3.25Å; K22-T24 PolarHBondContact O-N 2.86Å; K22-T66 HydrophobicContact CD-CG2 4.13Å; K22-T66 VanDerWaalsContact CE-CG2 3.48Å; K22-T66 WeakPolarHBondContact CE-OG1 3.27Å; K22-T66 HydrophobicContact CG-CG2 3.52Å
23	D	91.1	Very high	93.1	Very high	120 Å²	120	51.4 Å²	51.4	64%	0.642	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-88.4	5.1	-170	-57.4	-29.1	0	0	0	112.6	N20 I21	N20-D23 WeakPolarHBondContact CB-OD2 3.32Å; N20-D23 PolarHBondContact O-N 2.82Å; N20-D23 VanDerWaalsContact O-N 3.11Å; I21-D23 PolarHBondContact O-N 2.79Å
24	T	90.4	Very high	92.5	Very high	9 Å²	9	57.8 Å²	57.8	6%	0.055	33%	0.327	C	S	.	.	S	Bend	trans	-151	158.5	-168.5	176.4	0	0	0	0	111.8	F19 I21 K22 I26 P45 R90 K91	F19-T24 HydrophobicContact CD2-CG2 4.08Å; F19-T24 HydrophobicContact CE2-CG2 3.82Å; I21-T24 WeakPolarHBondContact O-CG2 3.43Å; K22-T24 VanDerWaalsContact C-N 3.25Å; K22-T24 PolarHBondContact O-N 2.86Å; T24-I26 HydrophobicContact CG2-CD1 3.87Å; T24-P45 WeakPolarHBondContact O-CD 3.04Å; T24-R90 HydrophobicContact CG2-CG 3.66Å; T24-R90 WeakPolarHBondContact OG1-CG 3.49Å; T24-K91 PolarHBondContact OG1-O 2.81Å; T24-K91 VanDerWaalsContact OG1-O 3.06Å
25	F	92.8	Very high	91.9	Very high	79 Å²	79	61.9 Å²	61.9	35%	0.346	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	141.6	162.6	-81.3	-101.5	0	0	0	111.4	I43 D44 K91	F25-I43 WeakPolarHBondContact CA-O 3.41Å; F25-D44 HydrophobicContact CD1-CB 4.12Å; F25-D44 HydrophobicContact CE1-CB 3.59Å; F25-D44 HydrophobicContact CE2-CB 4.15Å; F25-D44 HydrophobicContact CZ-CB 3.6Å; F25-K91 PolarHBondContact O-N 2.86Å
26	I	95.4	Very high	91.6	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.015	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.3	170.9	-54.2	-62.3	0	0	0	108.9	F19 I21 T24 G42 I43 P45 A71 C88 R90	F19-I26 HydrophobicContact CE2-CD1 4.3Å; I21-I26 HydrophobicContact CD1-CD1 4.2Å; I21-I26 HydrophobicContact CD1-CG1 3.78Å; I21-I26 HydrophobicContact CG1-CD1 3.67Å; I21-I26 HydrophobicContact CG1-CG1 3.48Å; I21-I26 VanDerWaalsContact CG1-CG1 3.48Å; T24-I26 HydrophobicContact CG2-CD1 3.87Å; I26-G42 CarbonylContact O-C 3.6Å; I26-G42 WeakPolarHBondContact O-CA 3.38Å; I26-I43 HydrophobicContact CB-CG2 4.12Å; I26-I43 PolarHBondContact N-O 2.93Å; I26-I43 PolarHBondContact O-N 2.88Å; I26-P45 HydrophobicContact CG1-CG 4.12Å; I26-A71 HydrophobicContact CB-CB 4.19Å; I26-A71 HydrophobicContact CG1-CB 4.43Å; I26-A71 HydrophobicContact CG2-CB 3.73Å; I26-C88 HydrophobicContact CG2-CB 4.4Å; I26-R90 HydrophobicContact CD1-CB 4.31Å; I26-R90 HydrophobicContact CD1-CG 4.15Å
27	H	95.9	Very high	91.6	Very high	20 Å²	20	64.4 Å²	64.4	9%	0.093	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	153	-178	-65.4	-78.4	0	0	0	111.3	W39 G41 C88 A89 F95	H27-W39 AromaticContact CG-NE1 3.74Å; H27-W39 AromaticContact ND1-CE2 3.79Å; H27-W39 AromaticContact ND1-CZ2 3.83Å; H27-W39 AromaticContact ND1-NE1 3.15Å; H27-W39 PolarHBondContact ND1-NE1 2.79Å; H27-W39 VanDerWaalsContact ND1-NE1 3.15Å; H27-G41 CarbonylContact C-O 3.53Å; H27-G41 WeakPolarHBondContact CA-O 3.31Å; H27-C88 CarbonylContact O-C 3.57Å; H27-C88 WeakPolarHBondContact O-CA 3.5Å; H27-A89 PolarHBondContact N-O 3.26Å; H27-A89 PolarHBondContact O-N 3.46Å; H27-F95 HydrophobicContact CB-CD1 4.41Å; H27-F95 HydrophobicContact CB-CE1 3.54Å; H27-F95 HydrophobicContact CB-CZ 4.39Å; H27-F95 AromaticContact CD2-CE1 3.31Å; H27-F95 WeakPolarHBondContact CD2-CE1 3.18Å; H27-F95 AromaticContact CD2-CZ 3.95Å; H27-F95 AromaticContact CG-CE1 3.43Å; H27-F95 VanDerWaalsContact CG-CE1 3.43Å
28	W	97.4	Very high	91.9	Very high	5 Å²	5	60.9 Å²	60.9	2%	0.019	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.7	175.2	-71.6	95.1	0	0	0	110.3	L12 C14 I40 G41 L73 Y87 C88	L12-W28 HydrophobicContact CB-CH2 4.01Å; L12-W28 HydrophobicContact CB-CZ3 4.05Å; C14-W28 HydrophobicContact CB-CH2 3.79Å; C14-W28 HydrophobicContact CB-CZ2 3.83Å; W28-I40 HydrophobicContact CB-CB 4.17Å; W28-I40 HydrophobicContact CB-CD1 4.26Å; W28-I40 WeakPolarHBondContact O-CB 3.33Å; W28-I40 PolarHBondContact O-N 2.79Å; W28-G41 PolarHBondContact N-O 2.94Å; W28-L73 HydrophobicContact CB-CD2 4.09Å; W28-L73 HydrophobicContact CD2-CB 3.45Å; W28-L73 VanDerWaalsContact CD2-CB 3.45Å; W28-L73 HydrophobicContact CD2-CD2 3.89Å; W28-L73 HydrophobicContact CD2-CG 4.23Å; W28-L73 VanDerWaalsContact CE2-CB 3.45Å; W28-L73 HydrophobicContact CE3-CB 3.75Å; W28-L73 HydrophobicContact CE3-CD2 3.7Å; W28-L73 HydrophobicContact CE3-CG 4.37Å; W28-L73 HydrophobicContact CG-CB 3.9Å; W28-L73 HydrophobicContact CG-CD1 4.49Å; W28-L73 HydrophobicContact CG-CD2 4.07Å; W28-L73 HydrophobicContact CG-CG 4.38Å; W28-L73 HydrophobicContact CH2-CB 4.03Å; W28-L73 HydrophobicContact CZ2-CB 3.77Å; W28-L73 HydrophobicContact CZ3-CB 4.02Å; W28-L73 HydrophobicContact CZ3-CD2 4.38Å; W28-Y87 WeakPolarHBondContact CA-O 3.22Å; W28-C88 HydrophobicContact CD2-CB 4.35Å; W28-C88 HydrophobicContact CE3-CB 4.19Å; W28-C88 HydrophobicContact CH2-CB 4.24Å; W28-C88 HydrophobicContact CZ2-CB 4.36Å; W28-C88 HydrophobicContact CZ3-CB 4.15Å
29	V	96.6	Very high	92.1	Very high	5 Å²	5	60.5 Å²	60.5	3%	0.03	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	134	-174.7	-176.8	0	0	0	0	109.3	L37 E38 Y86 Y87 W98	V29-L37 HydrophobicContact CG1-CB 3.82Å; V29-L37 HydrophobicContact CG1-CD2 3.91Å; V29-L37 HydrophobicContact CG1-CG 4.36Å; V29-E38 CarbonylContact C-O 3.48Å; V29-E38 WeakPolarHBondContact CA-O 3.34Å; V29-E38 WeakPolarHBondContact CG1-O 3.25Å; V29-Y86 CarbonylContact O-C 3.53Å; V29-Y86 WeakPolarHBondContact O-CA 3.45Å; V29-Y87 PolarHBondContact N-O 3.1Å; V29-Y87 PolarHBondContact O-N 2.78Å; V29-W98 HydrophobicContact CB-CH2 3.99Å; V29-W98 HydrophobicContact CB-CZ3 3.73Å; V29-W98 HydrophobicContact CG1-CH2 3.92Å; V29-W98 HydrophobicContact CG1-CZ3 3.88Å; V29-W98 HydrophobicContact CG2-CH2 3.69Å; V29-W98 HydrophobicContact CG2-CZ3 3.85Å
30	K	96.3	Very high	92.5	Very high	1 Å²	1	57.8 Å²	57.8	0%	0.004	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.7	175.1	-177.4	179.1	179.2	177.4	0	109.6	E38 I40 F56 E81 D82 A84 Y86	K30-E38 HydrophobicContact CB-CB 4.38Å; K30-E38 PolarHBondContact N-O 2.81Å; K30-E38 PolarHBondContact O-N 3.41Å; K30-I40 HydrophobicContact CB-CD1 4.06Å; K30-I40 HydrophobicContact CB-CG1 4.18Å; K30-F56 HydrophobicContact CD-CE1 3.93Å; K30-F56 HydrophobicContact CD-CZ 4.06Å; K30-E81 PolarHBondContact NZ-O 3.44Å; K30-D82 IonicContact NZ-OD1 3.64Å; K30-D82 PolarHBondContact NZ-OD1 3.05Å; K30-A84 HydrophobicContact CD-CB 4.25Å; K30-A84 HydrophobicContact CG-CB 3.56Å; K30-Y86 HydrophobicContact CB-CD1 4.29Å; K30-Y86 HydrophobicContact CB-CE1 4.02Å; K30-Y86 HydrophobicContact CD-CE1 4.05Å; K30-Y86 WeakPolarHBondContact CE-OH 3.36Å; K30-Y86 HydrophobicContact CG-CD1 4.44Å; K30-Y86 HydrophobicContact CG-CE1 3.86Å
31	Q	96.1	Very high	92.8	Very high	68 Å²	68	54.4 Å²	54.4	32%	0.318	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	113.9	171.1	-169.9	-176.9	30.4	0	0	109.6	L37 A84 V85 Y87	Q31-L37 HydrophobicContact CB-CD2 3.79Å; Q31-L37 HydrophobicContact CG-CD2 3.89Å; Q31-A84 WeakPolarHBondContact O-CA 3.43Å; Q31-A84 VanDerWaalsContact O-CB 3.23Å; Q31-A84 WeakPolarHBondContact O-CB 3.03Å; Q31-V85 PolarHBondContact N-O 3.1Å; Q31-V85 PolarHBondContact O-N 3.37Å; Q31-Y87 HydrophobicContact CB-CD2 4.32Å; Q31-Y87 HydrophobicContact CB-CE2 3.68Å; Q31-Y87 VanDerWaalsContact OE1-CE2 3.26Å; Q31-Y87 PolarHBondContact OE1-OH 2.93Å
32	R	91.9	Very high	92.9	Very high	54 Å²	54	54.4 Å²	54.4	20%	0.204	28%	0.278	C	S	.	.			trans	-87.2	150.5	171.4	-80	166.9	178	153.2	2.2	110.1	E34 Q35 E38 E81 A84	R32-E34 PolarHBondContact O-N 2.87Å; R32-Q35 HydrophobicContact CB-CB 3.96Å; R32-Q35 HydrophobicContact CB-CG 4.47Å; R32-Q35 PolarHBondContact O-N 2.98Å; R32-E38 IonicContact CZ-OE2 2.59Å; R32-E38 IonicContact NH1-OE2 2.75Å; R32-E38 PolarHBondContact NH1-OE2 2.59Å; R32-E81 PolarHBondContact NE-O 2.69Å; R32-E81 PolarHBondContact NH2-O 3.05Å; R32-A84 HydrophobicContact CG-CB 4.07Å
33	P	83.6	Confident	93.1	Very high	102 Å²	102	50.2 Å²	50.2	66%	0.662	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	132.3	167.3	-22.1	33	0	0	0	109.6	Q35	P33-Q35 PolarHBondContact O-N 3.48Å
34	E	83.9	Confident	93.3	Very high	206 Å²	206	45.7 Å²	45.7	96%	0.963	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.2	1.8	177	-49.4	-179.2	172.3	0	0	116.4	R32	R32-E34 PolarHBondContact O-N 2.87Å
35	Q	83.8	Confident	93.6	Very high	107 Å²	107	45.7 Å²	45.7	50%	0.5	24%	0.236	S	C	.	.	S	Bend	trans	-113.8	159.3	172.7	-70.8	177	7.6	0	0	111	R32 P33	R32-Q35 HydrophobicContact CB-CB 3.96Å; R32-Q35 HydrophobicContact CB-CG 4.47Å; R32-Q35 PolarHBondContact O-N 2.98Å; P33-Q35 PolarHBondContact O-N 3.48Å
36	G	88.1	Confident	93.7	Very high	56 Å²	56	45 Å²	45	58%	0.577	24%	0.244	S	C	*	.			trans	-66.7	177.9	175.7	0	0	0	0	0	113.3
37	L	93.6	Very high	93.6	Very high	97 Å²	97	49.1 Å²	49.1	51%	0.508	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	128.1	172.3	-65.1	171.6	0	0	0	110	V29 Q31 W98	V29-L37 HydrophobicContact CG1-CB 3.82Å; V29-L37 HydrophobicContact CG1-CD2 3.91Å; V29-L37 HydrophobicContact CG1-CG 4.36Å; Q31-L37 HydrophobicContact CB-CD2 3.79Å; Q31-L37 HydrophobicContact CG-CD2 3.89Å; L37-W98 HydrophobicContact CD1-CH2 3.93Å; L37-W98 HydrophobicContact CD1-CZ3 4.42Å; L37-W98 HydrophobicContact CD2-CZ3 4.47Å
38	E	95.5	Very high	93.6	Very high	34 Å²	34	50.2 Å²	50.2	16%	0.159	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.3	173.3	-62.9	-170.8	97.3	0	0	109.4	V29 K30 R32 I40 K55 F56	V29-E38 CarbonylContact C-O 3.48Å; V29-E38 WeakPolarHBondContact CA-O 3.34Å; V29-E38 WeakPolarHBondContact CG1-O 3.25Å; K30-E38 HydrophobicContact CB-CB 4.38Å; K30-E38 PolarHBondContact N-O 2.81Å; K30-E38 PolarHBondContact O-N 3.41Å; R32-E38 IonicContact CZ-OE2 2.59Å; R32-E38 IonicContact NH1-OE2 2.75Å; R32-E38 PolarHBondContact NH1-OE2 2.59Å; E38-I40 PolarHBondContact O-N 2.75Å; E38-K55 IonicContact OE1-NZ 3.04Å; E38-K55 PolarHBondContact OE1-NZ 3.48Å; E38-F56 HydrophobicContact CB-CE2 4.34Å; E38-F56 HydrophobicContact CB-CZ 4.22Å
39	W	95.5	Very high	93.5	Very high	81 Å²	81	54.9 Å²	54.9	31%	0.307	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	127.5	174.7	-177.2	77.9	0	0	0	109.9	H27 G41 N51 D53	H27-W39 AromaticContact CG-NE1 3.74Å; H27-W39 AromaticContact ND1-CE2 3.79Å; H27-W39 AromaticContact ND1-CZ2 3.83Å; H27-W39 AromaticContact ND1-NE1 3.15Å; H27-W39 PolarHBondContact ND1-NE1 2.79Å; H27-W39 VanDerWaalsContact ND1-NE1 3.15Å; W39-G41 PolarHBondContact NE1-O 2.79Å; W39-N51 HydrophobicContact CH2-CB 3.98Å; W39-D53 HydrophobicContact CE3-CB 3.88Å; W39-D53 HydrophobicContact CZ3-CB 4.16Å; W39-D53 VanDerWaalsContact O-CB 3.25Å; W39-D53 WeakPolarHBondContact O-CB 3.33Å
40	I	97.3	Very high	93.5	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-46.4	179.8	-62.6	172.8	0	0	0	110	W28 K30 E38 Y52 D53 F56 A60 L73 Y86	W28-I40 HydrophobicContact CB-CB 4.17Å; W28-I40 HydrophobicContact CB-CD1 4.26Å; W28-I40 WeakPolarHBondContact O-CB 3.33Å; W28-I40 PolarHBondContact O-N 2.79Å; K30-I40 HydrophobicContact CB-CD1 4.06Å; K30-I40 HydrophobicContact CB-CG1 4.18Å; E38-I40 PolarHBondContact O-N 2.75Å; I40-Y52 WeakPolarHBondContact O-CA 3.34Å; I40-D53 PolarHBondContact O-N 2.9Å; I40-F56 HydrophobicContact CB-CD2 4.35Å; I40-F56 HydrophobicContact CB-CG 4.27Å; I40-F56 HydrophobicContact CG1-CD1 4.08Å; I40-F56 HydrophobicContact CG1-CD2 4.28Å; I40-F56 HydrophobicContact CG1-CE1 4Å; I40-F56 HydrophobicContact CG1-CE2 4.18Å; I40-F56 HydrophobicContact CG1-CG 4.21Å; I40-F56 HydrophobicContact CG1-CZ 4.05Å; I40-F56 HydrophobicContact CG2-CB 3.86Å; I40-F56 HydrophobicContact CG2-CD1 4.2Å; I40-F56 HydrophobicContact CG2-CD2 4.44Å; I40-F56 HydrophobicContact CG2-CG 3.92Å; I40-A60 HydrophobicContact CG2-CB 3.64Å; I40-L73 HydrophobicContact CD1-CD2 3.72Å; I40-L73 HydrophobicContact CG2-CD1 4.19Å; I40-Y86 HydrophobicContact CD1-CD1 3.75Å; I40-Y86 HydrophobicContact CD1-CE1 3.84Å
41	G	96.7	Very high	93.5	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.3	-179	-170.9	0	0	0	0	0	112.3	H27 W28 W39 N51	H27-G41 CarbonylContact C-O 3.53Å; H27-G41 WeakPolarHBondContact CA-O 3.31Å; W28-G41 PolarHBondContact N-O 2.94Å; W39-G41 PolarHBondContact NE1-O 2.79Å; G41-N51 CarbonylContact C-O 3.59Å; G41-N51 WeakPolarHBondContact CA-O 3.4Å
42	G	95.9	Very high	93.6	Very high	2 Å²	2	61.5 Å²	61.5	2%	0.021	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	163.5	172.1	0	0	0	0	0	112.7	I26 T50 N51	I26-G42 CarbonylContact O-C 3.6Å; I26-G42 WeakPolarHBondContact O-CA 3.38Å; G42-T50 VanDerWaalsContact O-CA 3.28Å; G42-T50 WeakPolarHBondContact O-CA 3.39Å; G42-N51 PolarHBondContact N-O 2.84Å; G42-N51 PolarHBondContact O-N 2.82Å
43	I	96.6	Very high	93.8	Very high	5 Å²	5	60.9 Å²	60.9	3%	0.026	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	140.3	177.7	-174.1	163.3	0	0	0	109.9	F25 I26 P45 N49 T50 I62 A64	F25-I43 WeakPolarHBondContact CA-O 3.41Å; I26-I43 HydrophobicContact CB-CG2 4.12Å; I26-I43 PolarHBondContact N-O 2.93Å; I26-I43 PolarHBondContact O-N 2.88Å; I43-P45 HydrophobicContact CG2-CG 4.37Å; I43-P45 WeakPolarHBondContact O-CD 3.27Å; I43-N49 CarbonylContact C-O 3.59Å; I43-N49 WeakPolarHBondContact CA-O 3.31Å; I43-T50 HydrophobicContact CB-CG2 3.94Å; I43-T50 HydrophobicContact CD1-CG2 3.9Å; I43-T50 HydrophobicContact CG1-CG2 3.82Å; I43-I62 HydrophobicContact CB-CG2 3.65Å; I43-I62 HydrophobicContact CD1-CG2 4.38Å; I43-I62 HydrophobicContact CG2-CG2 3.56Å; I43-A64 HydrophobicContact CD1-CB 3.91Å
44	D	95.9	Very high	94.4	Very high	25 Å²	25	61 Å²	61	13%	0.134	35%	0.345	C	S	.	.			trans	-90.3	105.8	159.6	-178.4	-18.1	0	0	0	108.3	F25 A46 N47 G48 N49	F25-D44 HydrophobicContact CD1-CB 4.12Å; F25-D44 HydrophobicContact CE1-CB 3.59Å; F25-D44 HydrophobicContact CE2-CB 4.15Å; F25-D44 HydrophobicContact CZ-CB 3.6Å; D44-A46 PolarHBondContact O-N 3.32Å; D44-A46 WeakPolarHBondContact OD1-CB 3.48Å; D44-A46 PolarHBondContact OD1-N 2.86Å; D44-N47 WeakPolarHBondContact CB-OD1 3.44Å; D44-N47 PolarHBondContact O-N 2.94Å; D44-N47 PolarHBondContact OD2-ND2 3.4Å; D44-N47 PolarHBondContact OD2-OD1 3.38Å; D44-G48 VanDerWaalsContact O-CA 3.27Å; D44-G48 WeakPolarHBondContact O-CA 3.5Å; D44-G48 PolarHBondContact O-N 3.11Å; D44-N49 HydrophobicContact CB-CB 4.41Å; D44-N49 PolarHBondContact N-O 3.4Å
45	P	95.8	Very high	94.9	Very high	10 Å²	10	58.2 Å²	58.2	7%	0.065	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-14.2	-177.8	-22.4	38.9	0	0	0	113.7	I21 T24 I26 I43 A64 T66	I21-P45 HydrophobicContact CG1-CG 4.14Å; I21-P45 HydrophobicContact CG2-CB 4.07Å; I21-P45 HydrophobicContact CG2-CG 4.4Å; I21-P45 WeakPolarHBondContact O-CD 3.47Å; I21-P45 WeakPolarHBondContact O-CG 3.27Å; T24-P45 WeakPolarHBondContact O-CD 3.04Å; I26-P45 HydrophobicContact CG1-CG 4.12Å; I43-P45 HydrophobicContact CG2-CG 4.37Å; I43-P45 WeakPolarHBondContact O-CD 3.27Å; P45-A64 HydrophobicContact CB-CB 3.82Å; P45-A64 HydrophobicContact CG-CB 4.11Å; P45-T66 HydrophobicContact CB-CG2 3.99Å; P45-T66 WeakPolarHBondContact O-CG2 3.16Å
46	A	94.7	Very high	95.4	Very high	63 Å²	63	53.7 Å²	53.7	52%	0.521	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-35.8	178.2	0	0	0	0	0	112.3	D44	D44-A46 PolarHBondContact O-N 3.32Å; D44-A46 WeakPolarHBondContact OD1-CB 3.48Å; D44-A46 PolarHBondContact OD1-N 2.86Å
47	N	95.1	Very high	95.7	Very high	91 Å²	91	57.8 Å²	57.8	49%	0.487	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.6	-6.2	-175.6	58.4	37.2	0	0	0	114.1	D44 N49	D44-N47 WeakPolarHBondContact CB-OD1 3.44Å; D44-N47 PolarHBondContact O-N 2.94Å; D44-N47 PolarHBondContact OD2-ND2 3.4Å; D44-N47 PolarHBondContact OD2-OD1 3.38Å; N47-N49 VanDerWaalsContact C-N 3.31Å; N47-N49 VanDerWaalsContact CG-ND2 3.31Å; N47-N49 PolarHBondContact ND2-ND2 3.02Å; N47-N49 WeakPolarHBondContact OD1-CB 3.45Å; N47-N49 PolarHBondContact OD1-N 2.74Å; N47-N49 PolarHBondContact OD1-ND2 3.36Å; N47-N49 VanDerWaalsContact OD1-ND2 3.1Å
48	G	95.1	Very high	95.6	Very high	43 Å²	43	56.7 Å²	56.7	44%	0.443	32%	0.324	S	S	.	.			trans	79.2	7.7	179.1	0	0	0	0	0	114.7	D44 T50	D44-G48 VanDerWaalsContact O-CA 3.27Å; D44-G48 WeakPolarHBondContact O-CA 3.5Å; D44-G48 PolarHBondContact O-N 3.11Å; G48-T50 PolarHBondContact O-N 3.05Å
49	N	95.9	Very high	95.6	Very high	102 Å²	102	57.3 Å²	57.3	55%	0.545	33%	0.327	S	S	.	.			trans	-65.5	134.4	178.4	-72.3	-29.8	0	0	0	110.5	I43 D44 N47	I43-N49 CarbonylContact C-O 3.59Å; I43-N49 WeakPolarHBondContact CA-O 3.31Å; D44-N49 HydrophobicContact CB-CB 4.41Å; D44-N49 PolarHBondContact N-O 3.4Å; N47-N49 VanDerWaalsContact C-N 3.31Å; N47-N49 VanDerWaalsContact CG-ND2 3.31Å; N47-N49 PolarHBondContact ND2-ND2 3.02Å; N47-N49 WeakPolarHBondContact OD1-CB 3.45Å; N47-N49 PolarHBondContact OD1-N 2.74Å; N47-N49 PolarHBondContact OD1-ND2 3.36Å; N47-N49 VanDerWaalsContact OD1-ND2 3.1Å
50	T	96.9	Very high	95.7	Very high	50 Å²	50	53.7 Å²	53.7	31%	0.307	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	141.6	-178.2	50.3	0	0	0	0	111.5	G42 I43 G48 Y52 I62	G42-T50 VanDerWaalsContact O-CA 3.28Å; G42-T50 WeakPolarHBondContact O-CA 3.39Å; I43-T50 HydrophobicContact CB-CG2 3.94Å; I43-T50 HydrophobicContact CD1-CG2 3.9Å; I43-T50 HydrophobicContact CG1-CG2 3.82Å; G48-T50 PolarHBondContact O-N 3.05Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.43Å; T50-I62 HydrophobicContact CG2-CB 4.35Å
51	N	95.4	Very high	95.8	Very high	102 Å²	102	56.9 Å²	56.9	55%	0.545	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	143.5	171.8	-66.6	-24.5	0	0	0	108.7	W39 G41 G42	W39-N51 HydrophobicContact CH2-CB 3.98Å; G41-N51 CarbonylContact C-O 3.59Å; G41-N51 WeakPolarHBondContact CA-O 3.4Å; G42-N51 PolarHBondContact N-O 2.84Å; G42-N51 PolarHBondContact O-N 2.82Å
52	Y	97.3	Very high	95.8	Very high	61 Å²	61	57.1 Å²	57.1	24%	0.239	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	149.6	-178.4	-64	-90.3	0	0	0	110.5	I40 T50 A60 I62	I40-Y52 WeakPolarHBondContact O-CA 3.34Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.43Å; Y52-A60 HydrophobicContact CD1-CB 4.45Å; Y52-A60 HydrophobicContact CE1-CB 4.31Å; Y52-A60 WeakPolarHBondContact CE1-O 3.41Å; Y52-I62 HydrophobicContact CD1-CD1 4.19Å; Y52-I62 HydrophobicContact CE1-CB 4.34Å; Y52-I62 HydrophobicContact CE1-CD1 3.73Å; Y52-I62 HydrophobicContact CE1-CG1 3.82Å; Y52-I62 PolarHBondContact OH-N 3.41Å
53	D	96.6	Very high	95.9	Very high	42 Å²	42	60 Å²	60	23%	0.225	35%	0.352	C	S	.	.			trans	-72.2	133.9	158.5	-177.8	-60.5	0	0	0	108.5	W39 I40 K55 F56 Q57	W39-D53 HydrophobicContact CE3-CB 3.88Å; W39-D53 HydrophobicContact CZ3-CB 4.16Å; W39-D53 VanDerWaalsContact O-CB 3.25Å; W39-D53 WeakPolarHBondContact O-CB 3.33Å; I40-D53 PolarHBondContact O-N 2.9Å; D53-K55 PolarHBondContact O-N 2.82Å; D53-K55 VanDerWaalsContact OD1-CB 3.26Å; D53-K55 WeakPolarHBondContact OD1-CB 3.35Å; D53-K55 VanDerWaalsContact OD1-CG 3.29Å; D53-K55 WeakPolarHBondContact OD1-CG 3.42Å; D53-K55 PolarHBondContact OD1-N 3.38Å; D53-F56 HydrophobicContact CB-CD2 4.06Å; D53-F56 PolarHBondContact O-N 2.81Å; D53-Q57 PolarHBondContact O-N 3.15Å
54	P	96.5	Very high	96	Very high	103 Å²	103	61.4 Å²	61.4	67%	0.669	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-51.9	-29.2	-178.6	-29	35.6	0	0	0	114.7	F56 Q57	P54-F56 PolarHBondContact O-N 2.88Å; P54-Q57 PolarHBondContact O-N 3.33Å
55	K	93.8	Very high	96	Very high	149 Å²	149	62.9 Å²	62.9	65%	0.648	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-63.7	-28.1	177.8	-66.4	172.9	177.3	177	0	113.5	E38 D53	E38-K55 IonicContact OE1-NZ 3.04Å; E38-K55 PolarHBondContact OE1-NZ 3.48Å; D53-K55 PolarHBondContact O-N 2.82Å; D53-K55 VanDerWaalsContact OD1-CB 3.26Å; D53-K55 WeakPolarHBondContact OD1-CB 3.35Å; D53-K55 VanDerWaalsContact OD1-CG 3.29Å; D53-K55 WeakPolarHBondContact OD1-CG 3.42Å; D53-K55 PolarHBondContact OD1-N 3.38Å
56	F	95.4	Very high	96	Very high	12 Å²	12	64.7 Å²	64.7	5%	0.053	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-104.7	-4.1	-176.1	-63	-85.1	0	0	0	112.7	K30 E38 I40 D53 P54 G58 K59 A60	K30-F56 HydrophobicContact CD-CE1 3.93Å; K30-F56 HydrophobicContact CD-CZ 4.06Å; E38-F56 HydrophobicContact CB-CE2 4.34Å; E38-F56 HydrophobicContact CB-CZ 4.22Å; I40-F56 HydrophobicContact CB-CD2 4.35Å; I40-F56 HydrophobicContact CB-CG 4.27Å; I40-F56 HydrophobicContact CG1-CD1 4.08Å; I40-F56 HydrophobicContact CG1-CD2 4.28Å; I40-F56 HydrophobicContact CG1-CE1 4Å; I40-F56 HydrophobicContact CG1-CE2 4.18Å; I40-F56 HydrophobicContact CG1-CG 4.21Å; I40-F56 HydrophobicContact CG1-CZ 4.05Å; I40-F56 HydrophobicContact CG2-CB 3.86Å; I40-F56 HydrophobicContact CG2-CD1 4.2Å; I40-F56 HydrophobicContact CG2-CD2 4.44Å; I40-F56 HydrophobicContact CG2-CG 3.92Å; D53-F56 HydrophobicContact CB-CD2 4.06Å; D53-F56 PolarHBondContact O-N 2.81Å; P54-F56 PolarHBondContact O-N 2.88Å; F56-G58 PolarHBondContact O-N 2.82Å; F56-K59 PolarHBondContact O-N 2.94Å; F56-A60 HydrophobicContact CB-CB 4.15Å; F56-A60 PolarHBondContact O-N 3.18Å
57	Q	93.5	Very high	96.1	Very high	142 Å²	142	67 Å²	67	66%	0.664	40%	0.395	S	S	*	.	B	Isolated β-bridge	trans	-62.7	127.1	177.9	-163.6	166.3	-0.4	0	0	110.2	D53 P54 K59	D53-Q57 PolarHBondContact O-N 3.15Å; P54-Q57 PolarHBondContact O-N 3.33Å; Q57-K59 VanDerWaalsContact C-N 3.27Å; Q57-K59 PolarHBondContact O-N 2.87Å
58	G	92.3	Very high	96.2	Very high	73 Å²	73	64.9 Å²	64.9	75%	0.753	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-17.5	-174.6	0	0	0	0	0	115	F56	F56-G58 PolarHBondContact O-N 2.82Å
59	K	95.6	Very high	96.2	Very high	48 Å²	48	64.3 Å²	64.3	21%	0.209	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-37.8	174.3	-168.1	168.6	-164.3	170.9	0	112.9	F56 Q57 L75 S76 D82	F56-K59 PolarHBondContact O-N 2.94Å; Q57-K59 VanDerWaalsContact C-N 3.27Å; Q57-K59 PolarHBondContact O-N 2.87Å; K59-L75 WeakPolarHBondContact O-CA 3.44Å; K59-S76 PolarHBondContact O-N 3.01Å; K59-S76 PolarHBondContact O-OG 3.38Å; K59-D82 VanDerWaalsContact CE-CG 3.49Å; K59-D82 VanDerWaalsContact CE-OD1 3.31Å; K59-D82 WeakPolarHBondContact CE-OD1 3.4Å; K59-D82 WeakPolarHBondContact CE-OD2 3.3Å; K59-D82 IonicContact NZ-OD1 2.72Å; K59-D82 PolarHBondContact NZ-OD1 2.8Å; K59-D82 IonicContact NZ-OD2 3.23Å; K59-D82 PolarHBondContact NZ-OD2 2.84Å
60	A	97.7	Very high	96.3	Very high	5 Å²	5	59.8 Å²	59.8	4%	0.041	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	137.1	179.9	0	0	0	0	0	111.3	I40 Y52 F56 L73 Q74 L75	I40-A60 HydrophobicContact CG2-CB 3.64Å; Y52-A60 HydrophobicContact CD1-CB 4.45Å; Y52-A60 HydrophobicContact CE1-CB 4.31Å; Y52-A60 WeakPolarHBondContact CE1-O 3.41Å; F56-A60 HydrophobicContact CB-CB 4.15Å; F56-A60 PolarHBondContact O-N 3.18Å; A60-L73 HydrophobicContact CB-CD1 3.79Å; A60-Q74 CarbonylContact C-O 3.39Å; A60-Q74 WeakPolarHBondContact CA-O 3.46Å; A60-L75 HydrophobicContact CB-CD2 4.03Å
61	T	98.2	Very high	96.3	Very high	67 Å²	67	57.4 Å²	57.4	41%	0.411	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.1	167.5	-58.1	0	0	0	0	108.4	T63 Q74	T61-T63 HydrophobicContact CG2-CG2 4.27Å; T61-Q74 PolarHBondContact N-O 2.84Å; T61-Q74 PolarHBondContact O-N 2.93Å
62	I	98.3	Very high	96.5	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.026	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130.9	179	-58.2	166.8	0	0	0	108.9	I43 T50 Y52 Y72 L73	I43-I62 HydrophobicContact CB-CG2 3.65Å; I43-I62 HydrophobicContact CD1-CG2 4.38Å; I43-I62 HydrophobicContact CG2-CG2 3.56Å; T50-I62 HydrophobicContact CG2-CB 4.35Å; Y52-I62 HydrophobicContact CD1-CD1 4.19Å; Y52-I62 HydrophobicContact CE1-CB 4.34Å; Y52-I62 HydrophobicContact CE1-CD1 3.73Å; Y52-I62 HydrophobicContact CE1-CG1 3.82Å; Y52-I62 PolarHBondContact OH-N 3.41Å; I62-Y72 WeakPolarHBondContact CA-O 3.19Å; I62-L73 HydrophobicContact CG1-CD1 3.92Å
63	T	98	Very high	96.5	Very high	61 Å²	61	51.9 Å²	51.9	37%	0.374	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	166.9	176.4	55.5	0	0	0	0	110.6	T61 A71 Y72	T61-T63 HydrophobicContact CG2-CG2 4.27Å; T63-A71 CarbonylContact O-C 3.57Å; T63-A71 WeakPolarHBondContact O-CA 2.94Å; T63-Y72 PolarHBondContact N-O 2.81Å; T63-Y72 PolarHBondContact O-N 2.85Å
64	A	97.6	Very high	96.6	Very high	35 Å²	35	54.1 Å²	54.1	29%	0.289	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	142.2	174	0	0	0	0	0	110.7	I43 P45 T70	I43-A64 HydrophobicContact CD1-CB 3.91Å; P45-A64 HydrophobicContact CB-CB 3.82Å; P45-A64 HydrophobicContact CG-CB 4.11Å; A64-T70 WeakPolarHBondContact CA-O 2.99Å
65	D	97.1	Very high	96.7	Very high	57 Å²	57	49.2 Å²	49.2	31%	0.305	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	108.7	167.7	174.9	11	0	0	0	108.5	S67 S68 N69 T70 Y72	D65-S67 VanDerWaalsContact C-N 3.31Å; D65-S67 WeakPolarHBondContact OD1-CB 3.49Å; D65-S67 PolarHBondContact OD1-N 2.84Å; D65-S67 PolarHBondContact OD1-OG 2.92Å; D65-S67 PolarHBondContact OD2-OG 3.28Å; D65-S68 WeakPolarHBondContact CB-OG 3.38Å; D65-S68 PolarHBondContact O-OG 3Å; D65-S68 WeakPolarHBondContact OD2-CB 2.97Å; D65-S68 PolarHBondContact OD2-OG 3.02Å; D65-N69 PolarHBondContact O-N 3.33Å; D65-N69 VanDerWaalsContact O-N 3.11Å; D65-T70 PolarHBondContact N-O 2.02Å; D65-T70 PolarHBondContact O-N 3.04Å; D65-Y72 HydrophobicContact CB-CE2 3.94Å
66	T	95.9	Very high	96.8	Very high	48 Å²	48	43.9 Å²	43.9	29%	0.294	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-16.1	-176.3	63.1	0	0	0	0	112.9	I21 K22 P45	I21-T66 HydrophobicContact CG2-CG2 4.32Å; K22-T66 HydrophobicContact CD-CG2 4.13Å; K22-T66 VanDerWaalsContact CE-CG2 3.48Å; K22-T66 WeakPolarHBondContact CE-OG1 3.27Å; K22-T66 HydrophobicContact CG-CG2 3.52Å; P45-T66 HydrophobicContact CB-CG2 3.99Å; P45-T66 WeakPolarHBondContact O-CG2 3.16Å
67	S	95.7	Very high	96.8	Very high	111 Å²	111	47.2 Å²	47.2	78%	0.776	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-34.8	174.1	72.9	0	0	0	0	111.6	D65	D65-S67 VanDerWaalsContact C-N 3.31Å; D65-S67 WeakPolarHBondContact OD1-CB 3.49Å; D65-S67 PolarHBondContact OD1-N 2.84Å; D65-S67 PolarHBondContact OD1-OG 2.92Å; D65-S67 PolarHBondContact OD2-OG 3.28Å
68	S	96.9	Very high	96.9	Very high	46 Å²	46	40.5 Å²	40.5	32%	0.322	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	8	175.7	64.1	0	0	0	0	113.5	D65 T70	D65-S68 WeakPolarHBondContact CB-OG 3.38Å; D65-S68 PolarHBondContact O-OG 3Å; D65-S68 WeakPolarHBondContact OD2-CB 2.97Å; D65-S68 PolarHBondContact OD2-OG 3.02Å; S68-T70 PolarHBondContact O-N 2.9Å; S68-T70 PolarHBondContact O-OG1 3.06Å
69	N	96.3	Very high	97.1	Very high	32 Å²	32	39.6 Å²	39.6	17%	0.171	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	37.2	-179.2	-153.6	43.7	0	0	0	113.5	G16 F19 I21 D65	G16-N69 VanDerWaalsContact C-ND2 3.3Å; G16-N69 PolarHBondContact N-O 3.17Å; G16-N69 PolarHBondContact O-ND2 3.27Å; F19-N69 PolarHBondContact O-ND2 3.06Å; I21-N69 VanDerWaalsContact CB-OD1 3.25Å; I21-N69 WeakPolarHBondContact CB-OD1 3.49Å; I21-N69 WeakPolarHBondContact CG2-OD1 3.21Å; I21-N69 PolarHBondContact N-OD1 3.4Å; D65-N69 PolarHBondContact O-N 3.33Å; D65-N69 VanDerWaalsContact O-N 3.11Å
70	T	97.6	Very high	97	Very high	7 Å²	7	41.4 Å²	41.4	4%	0.043	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	128.9	-168.6	-60.6	0	0	0	0	112	C14 T15 A64 D65 S68 Y72	C14-T70 CarbonylContact O-C 3.48Å; C14-T70 WeakPolarHBondContact O-CA 3.38Å; T15-T70 PolarHBondContact OG1-OG1 3.21Å; A64-T70 WeakPolarHBondContact CA-O 2.99Å; D65-T70 PolarHBondContact N-O 2.02Å; D65-T70 PolarHBondContact O-N 3.04Å; S68-T70 PolarHBondContact O-N 2.9Å; S68-T70 PolarHBondContact O-OG1 3.06Å; T70-Y72 HydrophobicContact CG2-CD1 4.12Å; T70-Y72 HydrophobicContact CG2-CE1 3.49Å; T70-Y72 VanDerWaalsContact CG2-CE1 3.49Å; T70-Y72 HydrophobicContact CG2-CE2 3.99Å; T70-Y72 VanDerWaalsContact CG2-CZ 3.41Å
71	A	97.4	Very high	96.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	152.4	167.7	0	0	0	0	0	110.5	S13 C14 I21 I26 T63	S13-A71 CarbonylContact C-O 3.53Å; S13-A71 WeakPolarHBondContact CA-O 2.96Å; C14-A71 PolarHBondContact N-O 2.81Å; C14-A71 PolarHBondContact O-N 3.05Å; I21-A71 HydrophobicContact CD1-CB 3.79Å; I26-A71 HydrophobicContact CB-CB 4.19Å; I26-A71 HydrophobicContact CG1-CB 4.43Å; I26-A71 HydrophobicContact CG2-CB 3.73Å; T63-A71 CarbonylContact O-C 3.57Å; T63-A71 WeakPolarHBondContact O-CA 2.94Å
72	Y	98.2	Very high	96.6	Very high	47 Å²	47	44.3 Å²	44.3	18%	0.184	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	144.5	-178.8	-56	-80	0	0	0	111.6	K11 L12 I62 T63 D65 T70	K11-Y72 HydrophobicContact CD-CD1 4.37Å; K11-Y72 HydrophobicContact CG-CD1 4.32Å; L12-Y72 WeakPolarHBondContact O-CA 3.23Å; I62-Y72 WeakPolarHBondContact CA-O 3.19Å; T63-Y72 PolarHBondContact N-O 2.81Å; T63-Y72 PolarHBondContact O-N 2.85Å; D65-Y72 HydrophobicContact CB-CE2 3.94Å; T70-Y72 HydrophobicContact CG2-CD1 4.12Å; T70-Y72 HydrophobicContact CG2-CE1 3.49Å; T70-Y72 VanDerWaalsContact CG2-CE1 3.49Å; T70-Y72 HydrophobicContact CG2-CE2 3.99Å; T70-Y72 VanDerWaalsContact CG2-CZ 3.41Å
73	L	98.4	Very high	96.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	115.6	167.6	170	67.8	0	0	0	108.2	K11 L12 W28 I40 A60 I62 L75 Y86	K11-L73 WeakPolarHBondContact CA-O 2.97Å; L12-L73 HydrophobicContact CB-CB 4.49Å; L12-L73 HydrophobicContact CD1-CD2 4.38Å; L12-L73 PolarHBondContact N-O 3.07Å; L12-L73 PolarHBondContact O-N 3.1Å; W28-L73 HydrophobicContact CB-CD2 4.09Å; W28-L73 HydrophobicContact CD2-CB 3.45Å; W28-L73 VanDerWaalsContact CD2-CB 3.45Å; W28-L73 HydrophobicContact CD2-CD2 3.89Å; W28-L73 HydrophobicContact CD2-CG 4.23Å; W28-L73 VanDerWaalsContact CE2-CB 3.45Å; W28-L73 HydrophobicContact CE3-CB 3.75Å; W28-L73 HydrophobicContact CE3-CD2 3.7Å; W28-L73 HydrophobicContact CE3-CG 4.37Å; W28-L73 HydrophobicContact CG-CB 3.9Å; W28-L73 HydrophobicContact CG-CD1 4.49Å; W28-L73 HydrophobicContact CG-CD2 4.07Å; W28-L73 HydrophobicContact CG-CG 4.38Å; W28-L73 HydrophobicContact CH2-CB 4.03Å; W28-L73 HydrophobicContact CZ2-CB 3.77Å; W28-L73 HydrophobicContact CZ3-CB 4.02Å; W28-L73 HydrophobicContact CZ3-CD2 4.38Å; I40-L73 HydrophobicContact CD1-CD2 3.72Å; I40-L73 HydrophobicContact CG2-CD1 4.19Å; A60-L73 HydrophobicContact CB-CD1 3.79Å; I62-L73 HydrophobicContact CG1-CD1 3.92Å; L73-L75 HydrophobicContact CD1-CD2 4.08Å; L73-L75 HydrophobicContact CD1-CG 4.45Å; L73-L75 HydrophobicContact CD2-CD1 4.3Å; L73-L75 HydrophobicContact CD2-CD2 4.23Å; L73-L75 HydrophobicContact CD2-CG 4.21Å; L73-L75 HydrophobicContact CG-CD2 4.2Å; L73-L75 HydrophobicContact CG-CG 4.09Å; L73-Y86 HydrophobicContact CD2-CD1 4Å
74	Q	98.1	Very high	96.4	Very high	88 Å²	88	43.5 Å²	43.5	41%	0.411	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.9	169.8	-176.6	171.1	1.9	0	0	109.4	V10 A60 T61	V10-Q74 CarbonylContact O-C 3.55Å; V10-Q74 VanDerWaalsContact O-CA 3.26Å; V10-Q74 WeakPolarHBondContact O-CA 3.13Å; A60-Q74 CarbonylContact C-O 3.39Å; A60-Q74 WeakPolarHBondContact CA-O 3.46Å; T61-Q74 PolarHBondContact N-O 2.84Å; T61-Q74 PolarHBondContact O-N 2.93Å
75	L	97.8	Very high	96.4	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	130	173.9	-61.5	166.5	0	0	0	108.6	S9 V10 K59 A60 L73 L78 Y86 L104	S9-L75 CarbonylContact C-O 3.59Å; S9-L75 WeakPolarHBondContact CA-O 3.36Å; S9-L75 WeakPolarHBondContact CB-O 3.13Å; V10-L75 HydrophobicContact CG1-CB 3.86Å; V10-L75 HydrophobicContact CG1-CD1 4.17Å; V10-L75 HydrophobicContact CG1-CG 4.42Å; V10-L75 PolarHBondContact N-O 2.83Å; V10-L75 PolarHBondContact O-N 2.89Å; K59-L75 WeakPolarHBondContact O-CA 3.44Å; A60-L75 HydrophobicContact CB-CD2 4.03Å; L73-L75 HydrophobicContact CD1-CD2 4.08Å; L73-L75 HydrophobicContact CD1-CG 4.45Å; L73-L75 HydrophobicContact CD2-CD1 4.3Å; L73-L75 HydrophobicContact CD2-CD2 4.23Å; L73-L75 HydrophobicContact CD2-CG 4.21Å; L73-L75 HydrophobicContact CG-CD2 4.2Å; L73-L75 HydrophobicContact CG-CG 4.09Å; L75-L78 HydrophobicContact CB-CD2 3.74Å; L75-L78 HydrophobicContact CD1-CD2 4.33Å; L75-Y86 HydrophobicContact CD1-CD1 4.05Å; L75-Y86 HydrophobicContact CD1-CE1 3.46Å; L75-Y86 VanDerWaalsContact CD1-CE1 3.46Å; L75-Y86 HydrophobicContact CD1-CE2 4.35Å; L75-L104 HydrophobicContact CD1-CD2 4.1Å
76	S	96.8	Very high	96.4	Very high	36 Å²	36	40.9 Å²	40.9	25%	0.252	24%	0.244	S	C	.	.			trans	-108.7	159	-179.9	62	0	0	0	0	112.1	S9 K59 L78	S9-S76 WeakPolarHBondContact OG-CA 3.26Å; K59-S76 PolarHBondContact O-N 3.01Å; K59-S76 PolarHBondContact O-OG 3.38Å; S76-L78 VanDerWaalsContact C-N 3.33Å; S76-L78 PolarHBondContact O-N 2.93Å
77	S	95.9	Very high	96.5	Very high	82 Å²	82	40.8 Å²	40.8	57%	0.573	24%	0.239	S	C	*	.	S	Bend	trans	50.1	51	172.8	-58.2	0	0	0	0	113	A8	A8-S77 PolarHBondContact O-N 3.23Å
78	L	96.3	Very high	96.5	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	21%	0.206	C	C	.	.			trans	-62.3	141	-172.3	-70.4	173.6	0	0	0	112.7	V4 P6 G7 A8 V10 L75 S76 D82 L104 V106	V4-L78 HydrophobicContact CG2-CD1 3.49Å; V4-L78 VanDerWaalsContact CG2-CD1 3.49Å; P6-L78 CarbonylContact C-O 3.57Å; P6-L78 WeakPolarHBondContact CA-O 3.41Å; G7-L78 PolarHBondContact N-O 2.94Å; A8-L78 WeakPolarHBondContact O-CB 3.49Å; A8-L78 WeakPolarHBondContact O-CG 3.17Å; A8-L78 PolarHBondContact O-N 2.81Å; V10-L78 HydrophobicContact CB-CD1 4.2Å; V10-L78 HydrophobicContact CG1-CD1 3.79Å; V10-L78 HydrophobicContact CG1-CD2 4.46Å; L75-L78 HydrophobicContact CB-CD2 3.74Å; L75-L78 HydrophobicContact CD1-CD2 4.33Å; S76-L78 VanDerWaalsContact C-N 3.33Å; S76-L78 PolarHBondContact O-N 2.93Å; L78-D82 WeakPolarHBondContact CA-OD2 3.49Å; L78-D82 HydrophobicContact CD2-CB 3.71Å; L78-L104 HydrophobicContact CD1-CD2 4.16Å; L78-L104 HydrophobicContact CD2-CD2 4.06Å; L78-V106 HydrophobicContact CB-CG1 4.19Å; L78-V106 HydrophobicContact CB-CG2 4.04Å; L78-V106 HydrophobicContact CD1-CG2 4.28Å
79	T	95.3	Very high	96.3	Very high	55 Å²	55	34 Å²	34	34%	0.337	19%	0.192	S	C	.	.			trans	-121.6	168.8	174.6	67.2	0	0	0	0	110.2	E81 D82 V106	T79-E81 PolarHBondContact O-N 3.48Å; T79-E81 VanDerWaalsContact O-N 3.12Å; T79-D82 PolarHBondContact N-OD2 2.97Å; T79-D82 WeakPolarHBondContact O-CB 3.33Å; T79-D82 PolarHBondContact O-N 2.72Å; T79-D82 PolarHBondContact OG1-OD2 3.37Å; T79-V106 WeakPolarHBondContact O-CB 3.35Å; T79-V106 WeakPolarHBondContact O-CG2 3Å
80	S	93.7	Very high	96	Very high	86 Å²	86	34.7 Å²	34.7	60%	0.601	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-54.3	-31.1	175.8	50.3	0	0	0	0	112.8	D82 T83	S80-D82 PolarHBondContact O-N 2.9Å; S80-T83 VanDerWaalsContact O-CB 3.29Å; S80-T83 WeakPolarHBondContact O-CB 3.28Å; S80-T83 PolarHBondContact O-N 2.98Å; S80-T83 VanDerWaalsContact O-N 3.1Å; S80-T83 PolarHBondContact O-OG1 2.85Å; S80-T83 VanDerWaalsContact O-OG1 3.07Å
81	E	92.1	Very high	95.1	Very high	128 Å²	128	38.5 Å²	38.5	60%	0.598	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-67.7	-11.7	177	-59.4	-176.8	177.3	0	0	114.5	K30 R32 T79 T83	K30-E81 PolarHBondContact NZ-O 3.44Å; R32-E81 PolarHBondContact NE-O 2.69Å; R32-E81 PolarHBondContact NH2-O 3.05Å; T79-E81 PolarHBondContact O-N 3.48Å; T79-E81 VanDerWaalsContact O-N 3.12Å; E81-T83 VanDerWaalsContact C-N 3.33Å
82	D	94.6	Very high	93.5	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-87.2	-5	173.7	-58.8	-46.5	0	0	0	113.4	K30 K59 L78 T79 S80 A84 Y86 V106	K30-D82 IonicContact NZ-OD1 3.64Å; K30-D82 PolarHBondContact NZ-OD1 3.05Å; K59-D82 VanDerWaalsContact CE-CG 3.49Å; K59-D82 VanDerWaalsContact CE-OD1 3.31Å; K59-D82 WeakPolarHBondContact CE-OD1 3.4Å; K59-D82 WeakPolarHBondContact CE-OD2 3.3Å; K59-D82 IonicContact NZ-OD1 2.72Å; K59-D82 PolarHBondContact NZ-OD1 2.8Å; K59-D82 IonicContact NZ-OD2 3.23Å; K59-D82 PolarHBondContact NZ-OD2 2.84Å; L78-D82 WeakPolarHBondContact CA-OD2 3.49Å; L78-D82 HydrophobicContact CD2-CB 3.71Å; T79-D82 PolarHBondContact N-OD2 2.97Å; T79-D82 WeakPolarHBondContact O-CB 3.33Å; T79-D82 PolarHBondContact O-N 2.72Å; T79-D82 PolarHBondContact OG1-OD2 3.37Å; S80-D82 PolarHBondContact O-N 2.9Å; D82-A84 PolarHBondContact O-N 2.99Å; D82-A84 VanDerWaalsContact O-N 3.1Å; D82-Y86 VanDerWaalsContact O-CE2 3.32Å; D82-Y86 WeakPolarHBondContact O-CE2 3.41Å; D82-Y86 PolarHBondContact O-OH 2.85Å; D82-V106 HydrophobicContact CB-CG2 4.17Å
83	T	95.9	Very high	91.6	Very high	46 Å²	46	47.5 Å²	47.5	28%	0.282	25%	0.254	S	S	.	.			trans	-62.4	112.9	171.2	-61.7	0	0	0	0	109.6	S80 E81 L104 T105 V106	S80-T83 VanDerWaalsContact O-CB 3.29Å; S80-T83 WeakPolarHBondContact O-CB 3.28Å; S80-T83 PolarHBondContact O-N 2.98Å; S80-T83 VanDerWaalsContact O-N 3.1Å; S80-T83 PolarHBondContact O-OG1 2.85Å; S80-T83 VanDerWaalsContact O-OG1 3.07Å; E81-T83 VanDerWaalsContact C-N 3.33Å; T83-L104 VanDerWaalsContact CA-O 3.27Å; T83-L104 WeakPolarHBondContact CA-O 3.34Å; T83-T105 HydrophobicContact CG2-CG2 4.37Å; T83-V106 PolarHBondContact OG1-N 3.38Å
84	A	96.7	Very high	89.8	Confident	4 Å²	4	55.9 Å²	55.9	3%	0.033	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	170.1	-172	0	0	0	0	0	110.6	K30 Q31 R32 D82 Y86 L104	K30-A84 HydrophobicContact CD-CB 4.25Å; K30-A84 HydrophobicContact CG-CB 3.56Å; Q31-A84 WeakPolarHBondContact O-CA 3.43Å; Q31-A84 VanDerWaalsContact O-CB 3.23Å; Q31-A84 WeakPolarHBondContact O-CB 3.03Å; R32-A84 HydrophobicContact CG-CB 4.07Å; D82-A84 PolarHBondContact O-N 2.99Å; D82-A84 VanDerWaalsContact O-N 3.1Å; A84-Y86 HydrophobicContact CB-CD2 4.33Å; A84-Y86 HydrophobicContact CB-CE2 3.74Å; A84-L104 PolarHBondContact N-O 2.79Å; A84-L104 PolarHBondContact O-N 2.77Å
85	V	97.4	Very high	88.5	Confident	34 Å²	34	55.5 Å²	55.5	21%	0.206	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	129.4	161.8	-170.8	0	0	0	0	108.5	Q31 Y87	Q31-V85 PolarHBondContact N-O 3.1Å; Q31-V85 PolarHBondContact O-N 3.37Å; V85-Y87 HydrophobicContact CB-CE2 3.81Å; V85-Y87 HydrophobicContact CG1-CD1 4.49Å; V85-Y87 HydrophobicContact CG1-CD2 4.27Å; V85-Y87 HydrophobicContact CG1-CE1 3.84Å; V85-Y87 HydrophobicContact CG1-CE2 3.58Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.06Å
86	Y	97.6	Very high	87.3	Confident	2 Å²	2	59 Å²	59	1%	0.008	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.3	178.3	-68.9	-96.7	0	0	0	109.5	L12 V29 K30 I40 L73 L75 D82 A84 G101 T102 L104	L12-Y86 HydrophobicContact CD1-CD1 4.3Å; L12-Y86 HydrophobicContact CD1-CD2 4.19Å; L12-Y86 HydrophobicContact CD1-CG 3.75Å; V29-Y86 CarbonylContact O-C 3.53Å; V29-Y86 WeakPolarHBondContact O-CA 3.45Å; K30-Y86 HydrophobicContact CB-CD1 4.29Å; K30-Y86 HydrophobicContact CB-CE1 4.02Å; K30-Y86 HydrophobicContact CD-CE1 4.05Å; K30-Y86 WeakPolarHBondContact CE-OH 3.36Å; K30-Y86 HydrophobicContact CG-CD1 4.44Å; K30-Y86 HydrophobicContact CG-CE1 3.86Å; I40-Y86 HydrophobicContact CD1-CD1 3.75Å; I40-Y86 HydrophobicContact CD1-CE1 3.84Å; L73-Y86 HydrophobicContact CD2-CD1 4Å; L75-Y86 HydrophobicContact CD1-CD1 4.05Å; L75-Y86 HydrophobicContact CD1-CE1 3.46Å; L75-Y86 VanDerWaalsContact CD1-CE1 3.46Å; L75-Y86 HydrophobicContact CD1-CE2 4.35Å; D82-Y86 VanDerWaalsContact O-CE2 3.32Å; D82-Y86 WeakPolarHBondContact O-CE2 3.41Å; D82-Y86 PolarHBondContact O-OH 2.85Å; A84-Y86 HydrophobicContact CB-CD2 4.33Å; A84-Y86 HydrophobicContact CB-CE2 3.74Å; Y86-G101 CarbonylContact O-C 3.54Å; Y86-G101 VanDerWaalsContact O-CA 3.27Å; Y86-G101 WeakPolarHBondContact O-CA 3.41Å; Y86-T102 PolarHBondContact N-O 2.8Å; Y86-T102 PolarHBondContact O-N 2.78Å; Y86-L104 HydrophobicContact CD2-CB 3.85Å; Y86-L104 HydrophobicContact CD2-CD2 4.35Å; Y86-L104 HydrophobicContact CE2-CB 3.71Å; Y86-L104 HydrophobicContact CE2-CD2 3.7Å; Y86-L104 HydrophobicContact CE2-CG 4.31Å
87	Y	96.9	Very high	86.8	Confident	46 Å²	46	64.5 Å²	64.5	18%	0.18	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	145.4	178.9	-57.3	-88.2	0	0	0	110	W28 V29 Q31 V85 W98 G99	W28-Y87 WeakPolarHBondContact CA-O 3.22Å; V29-Y87 PolarHBondContact N-O 3.1Å; V29-Y87 PolarHBondContact O-N 2.78Å; Q31-Y87 HydrophobicContact CB-CD2 4.32Å; Q31-Y87 HydrophobicContact CB-CE2 3.68Å; Q31-Y87 VanDerWaalsContact OE1-CE2 3.26Å; Q31-Y87 PolarHBondContact OE1-OH 2.93Å; V85-Y87 HydrophobicContact CB-CE2 3.81Å; V85-Y87 HydrophobicContact CG1-CD1 4.49Å; V85-Y87 HydrophobicContact CG1-CD2 4.27Å; V85-Y87 HydrophobicContact CG1-CE1 3.84Å; V85-Y87 HydrophobicContact CG1-CE2 3.58Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.06Å; Y87-W98 HydrophobicContact CD1-CE3 4.43Å; Y87-W98 HydrophobicContact CD2-CZ3 4.44Å; Y87-W98 AromaticContact CG-CE3 3.98Å; Y87-W98 HydrophobicContact CG-CE3 3.98Å; Y87-W98 HydrophobicContact CG-CZ3 4.25Å; Y87-G99 WeakPolarHBondContact CD1-O 3.25Å
88	C	95.6	Very high	86.7	Confident	14 Å²	14	65.5 Å²	65.5	10%	0.095	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	147.5	156	61.5	0	0	0	0	109.4	C14 I26 H27 W28 G99	C14-C88 HydrophobicContact CB-CB 3.42Å; C14-C88 VanDerWaalsContact CB-CB 3.42Å; C14-C88 WeakPolarHBondContact CB-SG 3.36Å; C14-C88 WeakPolarHBondContact SG-CB 3.22Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.89Å; I26-C88 HydrophobicContact CG2-CB 4.4Å; H27-C88 CarbonylContact O-C 3.57Å; H27-C88 WeakPolarHBondContact O-CA 3.5Å; W28-C88 HydrophobicContact CD2-CB 4.35Å; W28-C88 HydrophobicContact CE3-CB 4.19Å; W28-C88 HydrophobicContact CH2-CB 4.24Å; W28-C88 HydrophobicContact CZ2-CB 4.36Å; W28-C88 HydrophobicContact CZ3-CB 4.15Å; C88-G99 PolarHBondContact O-N 3.41Å
89	A	93.9	Very high	86.5	Confident	2 Å²	2	66.9 Å²	66.9	2%	0.017	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	142.1	175.2	0	0	0	0	0	110.5	H27 F95 Y97 W98	H27-A89 PolarHBondContact N-O 3.26Å; H27-A89 PolarHBondContact O-N 3.46Å; A89-F95 HydrophobicContact CB-CD1 3.74Å; A89-F95 HydrophobicContact CB-CE1 4.42Å; A89-Y97 CarbonylContact C-O 3.37Å; A89-Y97 WeakPolarHBondContact CA-O 3.41Å; A89-W98 HydrophobicContact CB-CD2 3.8Å; A89-W98 HydrophobicContact CB-CE3 4.14Å; A89-W98 HydrophobicContact CB-CG 4.13Å; A89-W98 HydrophobicContact CB-CZ2 4.25Å
90	R	89.7	Confident	86.4	Confident	46 Å²	46	73.4 Å²	73.4	17%	0.174	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	139.6	175	-169.4	-179.3	94.6	-161.9	2.4	109.5	F19 T24 I26 D92 D96 Y97	F19-R90 VanDerWaalsContact CE2-CD 3.46Å; F19-R90 HydrophobicContact CE2-CG 4.28Å; F19-R90 VanDerWaalsContact CG-NH1 3.25Å; F19-R90 HydrophobicContact CZ-CG 4.46Å; T24-R90 HydrophobicContact CG2-CG 3.66Å; T24-R90 WeakPolarHBondContact OG1-CG 3.49Å; I26-R90 HydrophobicContact CD1-CB 4.31Å; I26-R90 HydrophobicContact CD1-CG 4.15Å; R90-D92 IonicContact CZ-OD2 3.48Å; R90-D92 VanDerWaalsContact CZ-OD2 3.23Å; R90-D92 IonicContact NE-OD2 3.17Å; R90-D92 PolarHBondContact NE-OD2 2.87Å; R90-D92 IonicContact NH2-OD2 3.41Å; R90-D92 PolarHBondContact NH2-OD2 2.83Å; R90-D96 PolarHBondContact O-N 3.1Å; R90-Y97 PolarHBondContact N-O 2.91Å
91	K	78.4	Confident	86.5	Confident	87 Å²	87	70.6 Å²	70.6	38%	0.378	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	110.7	172.1	-175.7	-177	177.4	-175.8	0	110.7	T24 F25 E93	T24-K91 PolarHBondContact OG1-O 2.81Å; T24-K91 VanDerWaalsContact OG1-O 3.06Å; F25-K91 PolarHBondContact O-N 2.86Å; K91-E93 WeakPolarHBondContact CE-O 3.36Å
92	D	64	Low	86.7	Confident	81 Å²	81	66.9 Å²	66.9	43%	0.433	32%	0.322	S	S	.	.	S	Bend	trans	-91.5	-53.5	161.8	-71.1	-42.1	0	0	0	109.4	R90	R90-D92 IonicContact CZ-OD2 3.48Å; R90-D92 VanDerWaalsContact CZ-OD2 3.23Å; R90-D92 IonicContact NE-OD2 3.17Å; R90-D92 PolarHBondContact NE-OD2 2.87Å; R90-D92 IonicContact NH2-OD2 3.41Å; R90-D92 PolarHBondContact NH2-OD2 2.83Å
93	E	57.5	Low	86.8	Confident	154 Å²	154	69.7 Å²	69.7	72%	0.72	34%	0.339	S	S	*	.	S	Bend	trans	-134.9	-35.5	173.8	-68.8	-170.8	164	0	0	113.7	K91	K91-E93 WeakPolarHBondContact CE-O 3.36Å
94	Y	61.6	Low	86.8	Confident	177 Å²	177	67.5 Å²	67.5	69%	0.694	33%	0.326	S	S	*	.	S	Bend	trans	-126.5	171.6	165.6	-60.4	-92.7	0	0	0	108.3	D96	Y94-D96 VanDerWaalsContact C-OD1 3.26Å; Y94-D96 WeakPolarHBondContact CA-OD1 3.21Å; Y94-D96 VanDerWaalsContact CB-OD1 3.27Å; Y94-D96 WeakPolarHBondContact CB-OD1 3.27Å; Y94-D96 PolarHBondContact O-N 3.15Å; Y94-D96 VanDerWaalsContact O-OD2 3.11Å
95	F	70.1	Confident	86.7	Confident	80 Å²	80	69.8 Å²	69.8	35%	0.351	34%	0.339	S	S	.	.			trans	-72.1	70.6	178	-74.6	-85.4	0	0	0	110.4	H27 A89 Y97 W98	H27-F95 HydrophobicContact CB-CD1 4.41Å; H27-F95 HydrophobicContact CB-CE1 3.54Å; H27-F95 HydrophobicContact CB-CZ 4.39Å; H27-F95 AromaticContact CD2-CE1 3.31Å; H27-F95 WeakPolarHBondContact CD2-CE1 3.18Å; H27-F95 AromaticContact CD2-CZ 3.95Å; H27-F95 AromaticContact CG-CE1 3.43Å; H27-F95 VanDerWaalsContact CG-CE1 3.43Å; A89-F95 HydrophobicContact CB-CD1 3.74Å; A89-F95 HydrophobicContact CB-CE1 4.42Å; F95-Y97 VanDerWaalsContact C-N 3.33Å; F95-Y97 PolarHBondContact O-N 3.11Å; F95-W98 HydrophobicContact CB-CZ2 4.16Å; F95-W98 HydrophobicContact CG-CZ2 4.43Å; F95-W98 PolarHBondContact O-NE1 3.18Å; F95-W98 VanDerWaalsContact O-NE1 3.11Å
96	D	74.1	Confident	86.6	Confident	75 Å²	75	68.5 Å²	68.5	40%	0.401	33%	0.331	S	S	.	.			trans	-74.7	-26.1	-160.6	-59.3	-35.9	0	0	0	112.4	R90 Y94	R90-D96 PolarHBondContact O-N 3.1Å; Y94-D96 VanDerWaalsContact C-OD1 3.26Å; Y94-D96 WeakPolarHBondContact CA-OD1 3.21Å; Y94-D96 VanDerWaalsContact CB-OD1 3.27Å; Y94-D96 WeakPolarHBondContact CB-OD1 3.27Å; Y94-D96 PolarHBondContact O-N 3.15Å; Y94-D96 VanDerWaalsContact O-OD2 3.11Å
97	Y	86.2	Confident	86.4	Confident	150 Å²	150	70.9 Å²	70.9	59%	0.588	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	131.3	-178	-64.3	-79.3	0	0	0	112	A89 R90 F95	A89-Y97 CarbonylContact C-O 3.37Å; A89-Y97 WeakPolarHBondContact CA-O 3.41Å; R90-Y97 PolarHBondContact N-O 2.91Å; F95-Y97 VanDerWaalsContact C-N 3.33Å; F95-Y97 PolarHBondContact O-N 3.11Å
98	W	92.2	Very high	85.8	Confident	104 Å²	104	76 Å²	76	39%	0.394	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	139.5	177.7	-68.4	67.8	0	0	0	110	V29 L37 Y87 A89 F95	V29-W98 HydrophobicContact CB-CH2 3.99Å; V29-W98 HydrophobicContact CB-CZ3 3.73Å; V29-W98 HydrophobicContact CG1-CH2 3.92Å; V29-W98 HydrophobicContact CG1-CZ3 3.88Å; V29-W98 HydrophobicContact CG2-CH2 3.69Å; V29-W98 HydrophobicContact CG2-CZ3 3.85Å; L37-W98 HydrophobicContact CD1-CH2 3.93Å; L37-W98 HydrophobicContact CD1-CZ3 4.42Å; L37-W98 HydrophobicContact CD2-CZ3 4.47Å; Y87-W98 HydrophobicContact CD1-CE3 4.43Å; Y87-W98 HydrophobicContact CD2-CZ3 4.44Å; Y87-W98 AromaticContact CG-CE3 3.98Å; Y87-W98 HydrophobicContact CG-CE3 3.98Å; Y87-W98 HydrophobicContact CG-CZ3 4.25Å; A89-W98 HydrophobicContact CB-CD2 3.8Å; A89-W98 HydrophobicContact CB-CE3 4.14Å; A89-W98 HydrophobicContact CB-CG 4.13Å; A89-W98 HydrophobicContact CB-CZ2 4.25Å; F95-W98 HydrophobicContact CB-CZ2 4.16Å; F95-W98 HydrophobicContact CG-CZ2 4.43Å; F95-W98 PolarHBondContact O-NE1 3.18Å; F95-W98 VanDerWaalsContact O-NE1 3.11Å
99	G	92.6	Very high	85.3	Confident	29 Å²	29	79.1 Å²	79.1	30%	0.299	41%	0.406	S	S	.	.			trans	-65.9	165.1	167.1	0	0	0	0	0	111.4	Y87 C88 G101	Y87-G99 WeakPolarHBondContact CD1-O 3.25Å; C88-G99 PolarHBondContact O-N 3.41Å; G99-G101 PolarHBondContact O-N 3.11Å
100	Q	93.6	Very high	84.8	Confident	193 Å²	193	83.1 Å²	83.1	90%	0.902	43%	0.426	S	S	*	.			trans	-62.5	-15.7	179.8	-66.2	-64.3	-42.3	0	0	113.9
101	G	94.7	Very high	84.5	Confident	27 Å²	27	85.2 Å²	85.2	28%	0.278	44%	0.44	S	S	.	.			trans	82.5	149.6	-176.4	0	0	0	0	0	112.7	Y86 G99	Y86-G101 CarbonylContact O-C 3.54Å; Y86-G101 VanDerWaalsContact O-CA 3.27Å; Y86-G101 WeakPolarHBondContact O-CA 3.41Å; G99-G101 PolarHBondContact O-N 3.11Å
102	T	96.4	Very high	84.9	Confident	50 Å²	50	85.1 Å²	85.1	31%	0.307	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	117	175.2	-62.3	0	0	0	0	109.1	L12 Y86 L104	L12-T102 HydrophobicContact CD2-CG2 4.01Å; Y86-T102 PolarHBondContact N-O 2.8Å; Y86-T102 PolarHBondContact O-N 2.78Å; T102-L104 PolarHBondContact O-N 2.63Å
103	T	96.8	Very high	86.2	Confident	63 Å²	63	85.3 Å²	85.3	39%	0.387	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	121.6	170.9	-47.5	0	0	0	0	109.8	A1 E2	A1-T103 CarbonylContact C-O 3.56Å; A1-T103 WeakPolarHBondContact CA-O 3.5Å; E2-T103 PolarHBondContact N-O 3.46Å
104	L	96	Very high	88.1	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	127.7	169.2	177.1	68.2	0	0	0	108	E2 V4 V10 L75 L78 T83 A84 Y86 T102 V106	E2-L104 HydrophobicContact CB-CD1 3.98Å; E2-L104 HydrophobicContact CG-CD1 4.37Å; E2-L104 WeakPolarHBondContact O-CA 3.4Å; V4-L104 HydrophobicContact CG1-CD1 4.35Å; V4-L104 HydrophobicContact CG2-CD1 3.88Å; V10-L104 HydrophobicContact CB-CD1 4.49Å; V10-L104 HydrophobicContact CG1-CD1 4.26Å; V10-L104 HydrophobicContact CG1-CD2 3.91Å; V10-L104 HydrophobicContact CG2-CD1 4.39Å; L75-L104 HydrophobicContact CD1-CD2 4.1Å; L78-L104 HydrophobicContact CD1-CD2 4.16Å; L78-L104 HydrophobicContact CD2-CD2 4.06Å; T83-L104 VanDerWaalsContact CA-O 3.27Å; T83-L104 WeakPolarHBondContact CA-O 3.34Å; A84-L104 PolarHBondContact N-O 2.79Å; A84-L104 PolarHBondContact O-N 2.77Å; Y86-L104 HydrophobicContact CD2-CB 3.85Å; Y86-L104 HydrophobicContact CD2-CD2 4.35Å; Y86-L104 HydrophobicContact CE2-CB 3.71Å; Y86-L104 HydrophobicContact CE2-CD2 3.7Å; Y86-L104 HydrophobicContact CE2-CG 4.31Å; T102-L104 PolarHBondContact O-N 2.63Å; L104-V106 HydrophobicContact CG-CG2 4.38Å
105	T	96.4	Very high	90	Very high	51 Å²	51	73.9 Å²	73.9	31%	0.313	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	126.1	176.2	-57.9	0	0	0	0	109.1	E2 L3 V4 T83	E2-T105 PolarHBondContact O-N 2.92Å; L3-T105 WeakPolarHBondContact CA-O 3.29Å; L3-T105 HydrophobicContact CD1-CG2 3.69Å; V4-T105 PolarHBondContact N-O 3.3Å; T83-T105 HydrophobicContact CG2-CG2 4.37Å
106	V	95.1	Very high	91.5	Very high	7 Å²	7	73.4 Å²	73.4	4%	0.042	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	106	177.7	-171	0	0	0	0	108.8	V4 P6 L78 T79 D82 T83 L104	V4-V106 HydrophobicContact CG2-CB 4.42Å; V4-V106 HydrophobicContact CG2-CG1 4.43Å; V4-V106 HydrophobicContact CG2-CG2 3.86Å; V4-V106 WeakPolarHBondContact O-CA 3.47Å; P6-V106 HydrophobicContact CB-CG1 4.46Å; P6-V106 HydrophobicContact CG-CG1 4.18Å; L78-V106 HydrophobicContact CB-CG1 4.19Å; L78-V106 HydrophobicContact CB-CG2 4.04Å; L78-V106 HydrophobicContact CD1-CG2 4.28Å; T79-V106 WeakPolarHBondContact O-CB 3.35Å; T79-V106 WeakPolarHBondContact O-CG2 3Å; D82-V106 HydrophobicContact CB-CG2 4.17Å; T83-V106 PolarHBondContact OG1-N 3.38Å; L104-V106 HydrophobicContact CG-CG2 4.38Å
107	S	92.8	Very high	93	Very high	53 Å²	53	73.3 Å²	73.3	37%	0.371	41%	0.412	S	S	.	.			trans	-144	152.1	-179.7	68.3	0	0	0	0	111.9	L3 V4	L3-S107 WeakPolarHBondContact CD1-OG 3.38Å; V4-S107 PolarHBondContact O-N 2.63Å
108	S	83.1	Confident	93.6	Very high	152 Å²	152	66.3 Å²	66.3	100%	1.063	40%	0.396	S	S	*	.			trans	-73.2	0	175.5	58.1	0	0	0	0	112.7

Retrieved 108 of 108 residues in 61.2 ms (Link to these results)

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