X5J540_MOUSE Loading...

IgG1 heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J540, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 109 aa.

						>X5J540_MOUSE|X5J540
AELVKPGASVKLSCTASGFNIKDYYMHWVKQRTEQGLEWIGRIDPEDGETKYAPKFQGKATITADTSSNTAYLQLSSLTSEDTAVYYCARFITTVVAYWGQGTLVTVSA
					

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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	82.4	Confident	94.1	Very high	109 Å²	109	75.1 Å²	75.1	90%	0.901	46%	0.456	S	S	*	.				0	143.8	0	0	0	0	0	0	108	L104	A1-L104 CarbonylContact C-O 3.57Å; A1-L104 WeakPolarHBondContact CA-O 3.14Å; A1-L104 HydrophobicContact CB-CB 4.03Å; A1-L104 WeakPolarHBondContact CB-O 3.32Å
2	E	90	Very high	94.4	Very high	63 Å²	63	69.2 Å²	69.2	29%	0.294	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.4	-176.8	-68.2	176.7	143.9	0	0	109.7	V10 L12 L104 V105 T106	E2-V10 HydrophobicContact CB-CG2 4.35Å; E2-V10 VanDerWaalsContact CD-CG2 3.41Å; E2-V10 HydrophobicContact CG-CG2 4.46Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.48Å; E2-L12 WeakPolarHBondContact OE2-CD2 3.41Å; E2-L104 PolarHBondContact N-O 2.91Å; E2-V105 HydrophobicContact CB-CG2 4.5Å; E2-V105 CarbonylContact O-C 3.59Å; E2-V105 WeakPolarHBondContact O-CA 3.21Å; E2-T106 PolarHBondContact O-N 3.47Å
3	L	94	Very high	94.7	Very high	128 Å²	128	69.5 Å²	69.5	67%	0.67	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.9	174.9	-177.1	66.5	0	0	0	108.3	T106 S108	L3-T106 WeakPolarHBondContact CA-O 3.39Å; L3-T106 HydrophobicContact CD1-CG2 3.76Å; L3-S108 WeakPolarHBondContact CD1-OG 3.44Å
4	V	95.3	Very high	94.8	Very high	23 Å²	23	65.8 Å²	65.8	14%	0.139	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	153.8	-174.1	-62	0	0	0	0	111.1	A8 V10 L78 V105 T106 V107 S108	V4-A8 HydrophobicContact CB-CB 4.33Å; V4-V10 HydrophobicContact CG1-CB 4.48Å; V4-V10 HydrophobicContact CG1-CG2 4.16Å; V4-L78 HydrophobicContact CG2-CD1 3.6Å; V4-V105 HydrophobicContact CG2-CG1 4.15Å; V4-T106 PolarHBondContact N-O 3.31Å; V4-V107 HydrophobicContact CG2-CB 4.41Å; V4-V107 HydrophobicContact CG2-CG1 4.5Å; V4-V107 HydrophobicContact CG2-CG2 3.84Å; V4-V107 WeakPolarHBondContact O-CA 3.26Å; V4-S108 PolarHBondContact O-N 2.92Å; V4-S108 VanDerWaalsContact O-N 3.09Å
5	K	95.2	Very high	94.9	Very high	146 Å²	146	67.5 Å²	67.5	64%	0.635	42%	0.415	S	S	*	.			trans	-82	153	176.5	-65.8	-176.1	178.2	-176	0	111.1	G7 A8	K5-G7 PolarHBondContact O-N 2.91Å; K5-A8 WeakPolarHBondContact O-CB 3.48Å; K5-A8 PolarHBondContact O-N 3.27Å; K5-A8 VanDerWaalsContact O-N 3.11Å
6	P	96.2	Very high	94.7	Very high	78 Å²	78	63.9 Å²	63.9	51%	0.506	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	139.4	169.9	-25.2	34	0	0	0	111.9	A8 L78 V107 S108	P6-A8 PolarHBondContact O-N 2.76Å; P6-L78 CarbonylContact C-O 3.59Å; P6-L78 WeakPolarHBondContact CA-O 3.49Å; P6-V107 HydrophobicContact CB-CG1 4.46Å; P6-V107 HydrophobicContact CG-CG1 4.21Å; P6-S108 WeakPolarHBondContact CD-O 3.02Å
7	G	94.8	Very high	94.5	Very high	55 Å²	55	66.7 Å²	66.7	57%	0.567	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	-11.7	-176.2	0	0	0	0	0	114.8	K5 L78	K5-G7 PolarHBondContact O-N 2.91Å; G7-L78 PolarHBondContact N-O 3.34Å
8	A	96	Very high	94.3	Very high	33 Å²	33	67.8 Å²	67.8	27%	0.273	44%	0.443	S	S	.	.			trans	-69.2	164.9	175.6	0	0	0	0	0	111.9	V4 K5 P6 S77 L78	V4-A8 HydrophobicContact CB-CB 4.33Å; K5-A8 WeakPolarHBondContact O-CB 3.48Å; K5-A8 PolarHBondContact O-N 3.27Å; K5-A8 VanDerWaalsContact O-N 3.11Å; P6-A8 PolarHBondContact O-N 2.76Å; A8-S77 PolarHBondContact O-N 2.87Å; A8-L78 WeakPolarHBondContact O-CB 3.32Å; A8-L78 WeakPolarHBondContact O-CG 3.34Å; A8-L78 PolarHBondContact O-N 2.91Å
9	S	96.8	Very high	94	Very high	66 Å²	66	66.5 Å²	66.5	46%	0.462	43%	0.43	S	S	.	.			trans	-111	152.5	169.3	-57.8	0	0	0	0	109.9	L75 S76	S9-L75 CarbonylContact C-O 3.52Å; S9-L75 WeakPolarHBondContact CA-O 3.44Å; S9-L75 WeakPolarHBondContact CB-O 3.37Å; S9-S76 WeakPolarHBondContact OG-CA 3.29Å
10	V	97.1	Very high	93.9	Very high	12 Å²	12	66.8 Å²	66.8	7%	0.073	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	148.3	176.8	83.3	0	0	0	0	110.6	E2 V4 Q74 L75 L78 V105	E2-V10 HydrophobicContact CB-CG2 4.35Å; E2-V10 VanDerWaalsContact CD-CG2 3.41Å; E2-V10 HydrophobicContact CG-CG2 4.46Å; E2-V10 WeakPolarHBondContact OE2-CG2 3.48Å; V4-V10 HydrophobicContact CG1-CB 4.48Å; V4-V10 HydrophobicContact CG1-CG2 4.16Å; V10-Q74 CarbonylContact O-C 3.53Å; V10-Q74 VanDerWaalsContact O-CA 3.29Å; V10-Q74 WeakPolarHBondContact O-CA 3.41Å; V10-L75 HydrophobicContact CG1-CB 4.24Å; V10-L75 HydrophobicContact CG1-CD1 4.37Å; V10-L75 PolarHBondContact N-O 3.3Å; V10-L75 PolarHBondContact O-N 3.4Å; V10-L78 HydrophobicContact CB-CD1 3.9Å; V10-L78 HydrophobicContact CG1-CD1 3.79Å; V10-V105 HydrophobicContact CG1-CG1 4.39Å; V10-V105 HydrophobicContact CG1-CG2 4.49Å
11	K	97.7	Very high	93.9	Very high	113 Å²	113	63.6 Å²	63.6	49%	0.491	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	108.9	179.1	-175.4	179.6	178	-178.2	0	109.9	Y72 L73	K11-Y72 VanDerWaalsContact CE-CD1 3.45Å; K11-L73 CarbonylContact C-O 3.5Å; K11-L73 WeakPolarHBondContact CA-O 3.47Å
12	L	97.9	Very high	94.4	Very high	4 Å²	4	62.3 Å²	62.3	2%	0.021	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	148.3	175.6	-59.5	176	0	0	0	110.3	E2 W28 Y72 L73 Y86 T103 V105	E2-L12 WeakPolarHBondContact OE2-CD2 3.41Å; L12-W28 HydrophobicContact CB-CH2 3.89Å; L12-W28 HydrophobicContact CB-CZ3 3.97Å; L12-W28 HydrophobicContact CD1-CZ3 4.31Å; L12-Y72 WeakPolarHBondContact O-CA 3.43Å; L12-L73 HydrophobicContact CB-CB 4.42Å; L12-L73 HydrophobicContact CD1-CD2 4.26Å; L12-L73 PolarHBondContact N-O 2.91Å; L12-L73 PolarHBondContact O-N 2.66Å; L12-Y86 VanDerWaalsContact CD1-CB 3.41Å; L12-Y86 HydrophobicContact CD1-CD1 4.28Å; L12-Y86 HydrophobicContact CD1-CD2 4.27Å; L12-Y86 HydrophobicContact CD1-CG 3.73Å; L12-T103 HydrophobicContact CD2-CG2 3.69Å; L12-V105 HydrophobicContact CD1-CG2 4.26Å; L12-V105 HydrophobicContact CD2-CG2 4.04Å
13	S	97.3	Very high	94.5	Very high	74 Å²	74	64.4 Å²	64.4	52%	0.517	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	151.4	174.4	61.5	0	0	0	0	111.4	A71	S13-A71 CarbonylContact C-O 3.48Å; S13-A71 WeakPolarHBondContact CA-O 3.03Å
14	C	96.3	Very high	94.3	Very high	17 Å²	17	61.1 Å²	61.1	12%	0.115	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	104.3	174.6	177.4	0	0	0	0	109.4	W28 T70 A71 C88	C14-W28 HydrophobicContact CB-CH2 3.86Å; C14-W28 HydrophobicContact CB-CZ2 3.94Å; C14-T70 CarbonylContact O-C 3.59Å; C14-T70 WeakPolarHBondContact O-CA 3.27Å; C14-A71 PolarHBondContact N-O 3.29Å; C14-A71 PolarHBondContact O-N 2.02Å; C14-C88 HydrophobicContact CB-CB 3.4Å; C14-C88 VanDerWaalsContact CB-CB 3.4Å; C14-C88 WeakPolarHBondContact CB-SG 3.22Å; C14-C88 WeakPolarHBondContact SG-CB 3.49Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.85Å
15	T	96.2	Very high	94.2	Very high	92 Å²	92	64.1 Å²	64.1	56%	0.564	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	122.1	179.3	-55.4	0	0	0	0	109.8	T70	T15-T70 PolarHBondContact OG1-OG1 2.88Å
16	A	92.6	Very high	94.2	Very high	9 Å²	9	57.4 Å²	57.4	7%	0.074	35%	0.354	C	S	.	.			trans	-72.7	137.9	174.8	0	0	0	0	0	110.4	F19 I21 N69	A16-F19 HydrophobicContact CB-CD1 4.32Å; A16-F19 HydrophobicContact CB-CD2 4.15Å; A16-F19 HydrophobicContact CB-CE1 3.72Å; A16-F19 HydrophobicContact CB-CE2 3.53Å; A16-F19 HydrophobicContact CB-CZ 3.28Å; A16-I21 HydrophobicContact CB-CB 4.11Å; A16-I21 HydrophobicContact CB-CD1 4.22Å; A16-I21 HydrophobicContact CB-CG1 4.18Å; A16-N69 VanDerWaalsContact CB-ND2 3.34Å; A16-N69 WeakPolarHBondContact CB-ND2 3.28Å; A16-N69 PolarHBondContact N-O 2.78Å; A16-N69 PolarHBondContact O-ND2 3.28Å
17	S	91.6	Very high	94.2	Very high	112 Å²	112	54.8 Å²	54.8	78%	0.783	34%	0.335	S	S	*	.			trans	-129.6	135.9	175.7	-177.9	0	0	0	0	109.4	F19	S17-F19 VanDerWaalsContact C-N 3.32Å; S17-F19 WeakPolarHBondContact O-CD1 3.5Å; S17-F19 PolarHBondContact O-N 3.11Å
18	G	89.8	Confident	94.3	Very high	86 Å²	86	52.4 Å²	52.4	89%	0.887	31%	0.309	S	S	*	.	S	Bend	trans	79.1	6.5	-179	0	0	0	0	0	115.6
19	F	88.4	Confident	94.3	Very high	44 Å²	44	51.2 Å²	51.2	19%	0.193	30%	0.298	C	S	.	.	S	Bend	trans	-155.4	160.1	172.3	65.7	-84.1	0	0	0	111	A16 S17 Y24 M26 N69 R90	A16-F19 HydrophobicContact CB-CD1 4.32Å; A16-F19 HydrophobicContact CB-CD2 4.15Å; A16-F19 HydrophobicContact CB-CE1 3.72Å; A16-F19 HydrophobicContact CB-CE2 3.53Å; A16-F19 HydrophobicContact CB-CZ 3.28Å; S17-F19 VanDerWaalsContact C-N 3.32Å; S17-F19 WeakPolarHBondContact O-CD1 3.5Å; S17-F19 PolarHBondContact O-N 3.11Å; F19-Y24 HydrophobicContact CB-CE2 4.04Å; F19-Y24 AromaticContact CD2-CD2 3.47Å; F19-Y24 HydrophobicContact CD2-CD2 3.47Å; F19-Y24 VanDerWaalsContact CD2-CD2 3.47Å; F19-Y24 AromaticContact CD2-CE2 3.78Å; F19-Y24 HydrophobicContact CD2-CE2 3.78Å; F19-Y24 HydrophobicContact CD2-CG 4.48Å; F19-Y24 AromaticContact CE2-CD2 3.95Å; F19-Y24 HydrophobicContact CE2-CD2 3.95Å; F19-Y24 HydrophobicContact CG-CD2 4.32Å; F19-Y24 HydrophobicContact CG-CE2 4.2Å; F19-M26 HydrophobicContact CE2-SD 4.3Å; F19-M26 HydrophobicContact CZ-SD 4.41Å; F19-N69 PolarHBondContact O-ND2 2.97Å; F19-R90 VanDerWaalsContact CD1-NH1 3.3Å; F19-R90 HydrophobicContact CE2-CG 4.32Å; F19-R90 HydrophobicContact CZ-CG 4.32Å
20	N	92.3	Very high	94.2	Very high	71 Å²	71	48.1 Å²	48.1	38%	0.38	28%	0.276	S	S	.	.			trans	-83.1	124.3	170.7	-177.7	-5.7	0	0	0	109.4	K22 D23	N20-K22 PolarHBondContact O-N 2.83Å; N20-K22 PolarHBondContact OD1-N 2.99Å; N20-K22 VanDerWaalsContact OD1-N 3.11Å; N20-D23 PolarHBondContact O-N 2.82Å; N20-D23 VanDerWaalsContact O-N 3.15Å
21	I	93.5	Very high	94.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-63.6	-24.2	-175.8	-156.2	169.9	0	0	0	112.2	A16 D23 Y24 M26 P45 T66 N69 A71	A16-I21 HydrophobicContact CB-CB 4.11Å; A16-I21 HydrophobicContact CB-CD1 4.22Å; A16-I21 HydrophobicContact CB-CG1 4.18Å; I21-D23 PolarHBondContact O-N 3.2Å; I21-Y24 PolarHBondContact O-N 2.77Å; I21-M26 HydrophobicContact CD1-CE 4.44Å; I21-M26 HydrophobicContact CD1-CG 3.9Å; I21-M26 HydrophobicContact CD1-SD 4.34Å; I21-M26 HydrophobicContact CG1-CG 3.58Å; I21-M26 HydrophobicContact CG1-SD 3.89Å; I21-P45 HydrophobicContact CG1-CG 4.09Å; I21-P45 HydrophobicContact CG2-CB 4.19Å; I21-P45 VanDerWaalsContact O-CG 3.26Å; I21-P45 WeakPolarHBondContact O-CG 3.33Å; I21-T66 HydrophobicContact CG2-CG2 4.21Å; I21-N69 WeakPolarHBondContact CB-OD1 3.44Å; I21-N69 WeakPolarHBondContact CG2-OD1 3.06Å; I21-N69 PolarHBondContact N-OD1 3.21Å; I21-A71 HydrophobicContact CD1-CB 3.9Å
22	K	93.7	Very high	93.8	Very high	83 Å²	83	47.1 Å²	47.1	36%	0.361	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-61.5	-28.1	175.4	-71	-168.7	177.2	-167.2	0	113.6	N20 Y24 T66	N20-K22 PolarHBondContact O-N 2.83Å; N20-K22 PolarHBondContact OD1-N 2.99Å; N20-K22 VanDerWaalsContact OD1-N 3.11Å; K22-Y24 PolarHBondContact O-N 3.1Å; K22-T66 HydrophobicContact CD-CG2 4.06Å; K22-T66 VanDerWaalsContact CE-CG2 3.44Å; K22-T66 WeakPolarHBondContact CE-OG1 3.49Å; K22-T66 HydrophobicContact CG-CG2 3.42Å; K22-T66 VanDerWaalsContact CG-CG2 3.42Å
23	D	91.3	Very high	92.8	Very high	107 Å²	107	53.8 Å²	53.8	57%	0.572	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-82.2	0.2	-172.2	-52.7	-25.5	0	0	0	112.7	N20 I21	N20-D23 PolarHBondContact O-N 2.82Å; N20-D23 VanDerWaalsContact O-N 3.15Å; I21-D23 PolarHBondContact O-N 3.2Å
24	Y	90.9	Very high	92	Very high	58 Å²	58	59 Å²	59	23%	0.227	33%	0.328	C	S	.	.	S	Bend	trans	-146.2	145.4	-170.9	-59	-81.7	0	0	0	113.9	F19 I21 K22 M26 P45 R90 I92	F19-Y24 HydrophobicContact CB-CE2 4.04Å; F19-Y24 AromaticContact CD2-CD2 3.47Å; F19-Y24 HydrophobicContact CD2-CD2 3.47Å; F19-Y24 VanDerWaalsContact CD2-CD2 3.47Å; F19-Y24 AromaticContact CD2-CE2 3.78Å; F19-Y24 HydrophobicContact CD2-CE2 3.78Å; F19-Y24 HydrophobicContact CD2-CG 4.48Å; F19-Y24 AromaticContact CE2-CD2 3.95Å; F19-Y24 HydrophobicContact CE2-CD2 3.95Å; F19-Y24 HydrophobicContact CG-CD2 4.32Å; F19-Y24 HydrophobicContact CG-CE2 4.2Å; I21-Y24 PolarHBondContact O-N 2.77Å; K22-Y24 PolarHBondContact O-N 3.1Å; Y24-M26 PolarHBondContact O-N 3.11Å; Y24-P45 WeakPolarHBondContact O-CD 3.4Å; Y24-R90 HydrophobicContact CD1-CG 3.98Å; Y24-R90 HydrophobicContact CD2-CG 4.44Å; Y24-R90 HydrophobicContact CG-CG 3.76Å; Y24-I92 HydrophobicContact CD1-CB 4.43Å; Y24-I92 HydrophobicContact CD1-CD1 4.31Å; Y24-I92 HydrophobicContact CD1-CG1 3.75Å; Y24-I92 HydrophobicContact CD1-CG2 4.34Å; Y24-I92 HydrophobicContact CE1-CB 4.4Å; Y24-I92 HydrophobicContact CE1-CD1 3.7Å; Y24-I92 HydrophobicContact CE1-CG1 3.64Å; Y24-I92 HydrophobicContact CE1-CG2 4.06Å
25	Y	93.2	Very high	91.1	Very high	86 Å²	86	64 Å²	64	34%	0.337	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	129.7	165.4	-63.3	-64.4	0	0	0	111.2	H27 R42 I43 D44 F91	Y25-H27 WeakPolarHBondContact CB-NE2 3.16Å; Y25-R42 VanDerWaalsContact CD1-NH1 3.31Å; Y25-R42 VanDerWaalsContact CE1-CZ 3.41Å; Y25-I43 WeakPolarHBondContact CA-O 3.34Å; Y25-D44 HydrophobicContact CD1-CB 3.84Å; Y25-D44 HydrophobicContact CE1-CB 3.55Å; Y25-D44 WeakPolarHBondContact CE1-OD2 3.35Å; Y25-D44 PolarHBondContact OH-OD2 3.08Å; Y25-F91 PolarHBondContact O-N 3.15Å
26	M	94.7	Very high	90.6	Very high	5 Å²	5	61.4 Å²	61.4	3%	0.025	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	114.6	175.2	-63.3	-56.9	-60.9	0	0	109.3	F19 I21 Y24 R42 I43 P45 A71 R90	F19-M26 HydrophobicContact CE2-SD 4.3Å; F19-M26 HydrophobicContact CZ-SD 4.41Å; I21-M26 HydrophobicContact CD1-CE 4.44Å; I21-M26 HydrophobicContact CD1-CG 3.9Å; I21-M26 HydrophobicContact CD1-SD 4.34Å; I21-M26 HydrophobicContact CG1-CG 3.58Å; I21-M26 HydrophobicContact CG1-SD 3.89Å; Y24-M26 PolarHBondContact O-N 3.11Å; M26-R42 CarbonylContact O-C 3.59Å; M26-R42 WeakPolarHBondContact O-CA 3.45Å; M26-I43 HydrophobicContact CB-CG2 3.93Å; M26-I43 PolarHBondContact N-O 2.92Å; M26-I43 PolarHBondContact O-N 3.27Å; M26-P45 HydrophobicContact CG-CG 3.94Å; M26-A71 HydrophobicContact CB-CB 4.08Å; M26-A71 HydrophobicContact CG-CB 4.29Å; M26-R90 HydrophobicContact SD-CB 4.45Å; M26-R90 HydrophobicContact SD-CG 4.47Å
27	H	95.4	Very high	90.6	Very high	24 Å²	24	65.6 Å²	65.6	11%	0.111	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	147.6	-177.9	-68.7	-114.9	0	0	0	110.5	Y25 W39 G41 C88 A89 F91	Y25-H27 WeakPolarHBondContact CB-NE2 3.16Å; H27-W39 AromaticContact CG-NE1 3.84Å; H27-W39 AromaticContact ND1-CD1 3.86Å; H27-W39 AromaticContact ND1-CE2 3.87Å; H27-W39 AromaticContact ND1-NE1 3.05Å; H27-W39 PolarHBondContact ND1-NE1 2.8Å; H27-G41 WeakPolarHBondContact CA-O 3.27Å; H27-C88 CarbonylContact O-C 3.55Å; H27-C88 VanDerWaalsContact O-CA 3.23Å; H27-C88 WeakPolarHBondContact O-CA 3.43Å; H27-A89 PolarHBondContact N-O 2.85Å; H27-A89 PolarHBondContact O-N 2.83Å; H27-F91 HydrophobicContact CB-CD2 3.85Å; H27-F91 HydrophobicContact CB-CE2 3.99Å; H27-F91 AromaticContact CD2-CD2 3.43Å; H27-F91 VanDerWaalsContact CD2-CD2 3.43Å; H27-F91 WeakPolarHBondContact CD2-CD2 3.32Å; H27-F91 AromaticContact CD2-CG 3.84Å; H27-F91 AromaticContact CG-CD2 3.48Å; H27-F91 VanDerWaalsContact CG-CD2 3.48Å; H27-F91 AromaticContact CG-CE2 3.95Å; H27-F91 AromaticContact ND1-CD2 3.98Å; H27-F91 AromaticContact NE2-CD2 3.95Å; H27-F91 AromaticContact NE2-CG 3.91Å
28	W	97	Very high	90.8	Very high	5 Å²	5	62.1 Å²	62.1	2%	0.019	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.4	171	-73.1	95.5	0	0	0	110.4	L12 C14 I40 G41 L73 Y87 C88	L12-W28 HydrophobicContact CB-CH2 3.89Å; L12-W28 HydrophobicContact CB-CZ3 3.97Å; L12-W28 HydrophobicContact CD1-CZ3 4.31Å; C14-W28 HydrophobicContact CB-CH2 3.86Å; C14-W28 HydrophobicContact CB-CZ2 3.94Å; W28-I40 HydrophobicContact CB-CB 4.14Å; W28-I40 HydrophobicContact CB-CD1 4.31Å; W28-I40 WeakPolarHBondContact O-CB 3.45Å; W28-I40 PolarHBondContact O-N 3.18Å; W28-G41 PolarHBondContact N-O 2.88Å; W28-L73 HydrophobicContact CB-CD2 4.1Å; W28-L73 HydrophobicContact CD2-CB 3.47Å; W28-L73 VanDerWaalsContact CD2-CB 3.47Å; W28-L73 HydrophobicContact CD2-CD2 3.86Å; W28-L73 HydrophobicContact CD2-CG 4.24Å; W28-L73 VanDerWaalsContact CE2-CB 3.46Å; W28-L73 HydrophobicContact CE3-CB 3.77Å; W28-L73 HydrophobicContact CE3-CD2 3.66Å; W28-L73 HydrophobicContact CE3-CG 4.36Å; W28-L73 HydrophobicContact CG-CB 3.94Å; W28-L73 HydrophobicContact CG-CD2 4.06Å; W28-L73 HydrophobicContact CG-CG 4.43Å; W28-L73 HydrophobicContact CH2-CB 4.03Å; W28-L73 HydrophobicContact CZ2-CB 3.76Å; W28-L73 HydrophobicContact CZ3-CB 4.03Å; W28-L73 HydrophobicContact CZ3-CD2 4.33Å; W28-Y87 WeakPolarHBondContact CA-O 3.48Å; W28-C88 HydrophobicContact CD2-CB 4.36Å; W28-C88 HydrophobicContact CE3-CB 4.22Å; W28-C88 HydrophobicContact CH2-CB 4.18Å; W28-C88 HydrophobicContact CZ2-CB 4.3Å; W28-C88 HydrophobicContact CZ3-CB 4.14Å
29	V	95.9	Very high	91	Very high	7 Å²	7	62.6 Å²	62.6	4%	0.042	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	134.9	-175.1	-175.3	0	0	0	0	109.2	L37 E38 Y86 Y87 W99	V29-L37 HydrophobicContact CG1-CB 3.87Å; V29-L37 HydrophobicContact CG1-CD2 3.84Å; V29-L37 HydrophobicContact CG1-CG 4.37Å; V29-E38 CarbonylContact C-O 3.37Å; V29-E38 WeakPolarHBondContact CA-O 3.38Å; V29-E38 WeakPolarHBondContact CG1-O 3.36Å; V29-Y86 WeakPolarHBondContact O-CA 3.16Å; V29-Y87 PolarHBondContact N-O 2.87Å; V29-Y87 PolarHBondContact O-N 2.67Å; V29-W99 HydrophobicContact CB-CH2 4.04Å; V29-W99 HydrophobicContact CB-CZ3 3.81Å; V29-W99 HydrophobicContact CG1-CH2 3.98Å; V29-W99 HydrophobicContact CG1-CZ3 4.04Å; V29-W99 HydrophobicContact CG2-CH2 3.84Å; V29-W99 HydrophobicContact CG2-CZ3 3.96Å
30	K	95.7	Very high	91.4	Very high	1 Å²	1	60.5 Å²	60.5	0%	0.004	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	129.8	173.5	-179.9	-179.5	-177.8	174.5	0	109.1	E38 I40 F56 E81 D82 A84 Y86	K30-E38 HydrophobicContact CB-CB 4.34Å; K30-E38 PolarHBondContact N-O 2.97Å; K30-E38 PolarHBondContact O-N 2.87Å; K30-I40 HydrophobicContact CB-CD1 4.02Å; K30-I40 HydrophobicContact CB-CG1 4.14Å; K30-F56 HydrophobicContact CB-CZ 4.43Å; K30-F56 HydrophobicContact CD-CE1 4.09Å; K30-F56 HydrophobicContact CD-CZ 3.96Å; K30-E81 WeakPolarHBondContact CE-O 3.34Å; K30-E81 PolarHBondContact NZ-O 3.01Å; K30-D82 IonicContact NZ-OD1 3.69Å; K30-D82 PolarHBondContact NZ-OD1 3.48Å; K30-A84 HydrophobicContact CD-CB 4.17Å; K30-A84 HydrophobicContact CG-CB 3.51Å; K30-Y86 HydrophobicContact CB-CD1 4.21Å; K30-Y86 HydrophobicContact CB-CE1 3.95Å; K30-Y86 HydrophobicContact CD-CE1 3.99Å; K30-Y86 WeakPolarHBondContact CE-OH 3.38Å; K30-Y86 HydrophobicContact CG-CD1 4.39Å; K30-Y86 HydrophobicContact CG-CE1 3.81Å
31	Q	95.2	Very high	91.6	Very high	70 Å²	70	57.1 Å²	57.1	33%	0.327	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	113.5	171.1	-168.4	-178	23.2	0	0	109.7	G36 L37 A84 V85 Y87	Q31-G36 WeakPolarHBondContact CA-O 3.45Å; Q31-L37 HydrophobicContact CB-CD2 3.72Å; Q31-L37 HydrophobicContact CG-CD2 3.79Å; Q31-A84 WeakPolarHBondContact O-CA 3.35Å; Q31-A84 VanDerWaalsContact O-CB 3.27Å; Q31-A84 WeakPolarHBondContact O-CB 3.33Å; Q31-V85 PolarHBondContact N-O 2.77Å; Q31-V85 PolarHBondContact O-N 3Å; Q31-Y87 HydrophobicContact CB-CD2 4.23Å; Q31-Y87 HydrophobicContact CB-CE2 3.64Å; Q31-Y87 HydrophobicContact CG-CE2 4.49Å; Q31-Y87 PolarHBondContact OE1-OH 3.34Å
32	R	90.3	Very high	91.8	Very high	34 Å²	34	58.3 Å²	58.3	13%	0.128	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	140.6	168.2	-69.1	178.5	-173.4	-157.3	-21.1	108.3	E34 Q35 G36 E38 E81 A84	R32-E34 PolarHBondContact O-N 3.16Å; R32-Q35 HydrophobicContact CB-CB 3.92Å; R32-Q35 PolarHBondContact O-N 3.09Å; R32-G36 PolarHBondContact N-O 3.44Å; R32-E38 WeakPolarHBondContact CD-OE2 3.44Å; R32-E38 IonicContact CZ-OE2 2.56Å; R32-E38 IonicContact NE-OE2 2.66Å; R32-E38 PolarHBondContact NE-OE2 3.47Å; R32-E81 PolarHBondContact NH2-O 2.82Å; R32-E81 IonicContact NH2-OE2 2.91Å; R32-A84 HydrophobicContact CG-CB 4.31Å
33	T	77.8	Confident	91.9	Very high	144 Å²	144	54.7 Å²	54.7	88%	0.883	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-19.9	-174.6	-22.9	0	0	0	0	113.5
34	E	80	Confident	92.1	Very high	184 Å²	184	50.3 Å²	50.3	86%	0.86	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-129	-6.7	-177.3	-59.8	-177	175.5	0	0	115	R32	R32-E34 PolarHBondContact O-N 3.16Å
35	Q	77.8	Confident	92.4	Very high	121 Å²	121	48 Å²	48	57%	0.565	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.9	12.7	-169.9	-70.9	171.5	-5.2	0	0	113.9	R32	R32-Q35 HydrophobicContact CB-CB 3.92Å; R32-Q35 PolarHBondContact O-N 3.09Å
36	G	86.8	Confident	92.4	Very high	38 Å²	38	50.9 Å²	50.9	39%	0.392	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	73.5	-159.6	176.6	0	0	0	0	0	113.6	Q31 R32	Q31-G36 WeakPolarHBondContact CA-O 3.45Å; R32-G36 PolarHBondContact N-O 3.44Å
37	L	92.3	Very high	92.4	Very high	98 Å²	98	56 Å²	56	51%	0.513	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	123.9	-178	-65.2	172	0	0	0	110.6	V29 Q31 W99	V29-L37 HydrophobicContact CG1-CB 3.87Å; V29-L37 HydrophobicContact CG1-CD2 3.84Å; V29-L37 HydrophobicContact CG1-CG 4.37Å; Q31-L37 HydrophobicContact CB-CD2 3.72Å; Q31-L37 HydrophobicContact CG-CD2 3.79Å; L37-W99 HydrophobicContact CD1-CH2 3.9Å; L37-W99 HydrophobicContact CD1-CZ2 4.31Å; L37-W99 HydrophobicContact CD2-CH2 4.33Å; L37-W99 HydrophobicContact CD2-CZ3 4.38Å
38	E	94.6	Very high	92.4	Very high	39 Å²	39	57 Å²	57	18%	0.182	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.3	174.1	-56.9	-174.6	87.1	0	0	109.4	V29 K30 R32 I40 K55 F56	V29-E38 CarbonylContact C-O 3.37Å; V29-E38 WeakPolarHBondContact CA-O 3.38Å; V29-E38 WeakPolarHBondContact CG1-O 3.36Å; K30-E38 HydrophobicContact CB-CB 4.34Å; K30-E38 PolarHBondContact N-O 2.97Å; K30-E38 PolarHBondContact O-N 2.87Å; R32-E38 WeakPolarHBondContact CD-OE2 3.44Å; R32-E38 IonicContact CZ-OE2 2.56Å; R32-E38 IonicContact NE-OE2 2.66Å; R32-E38 PolarHBondContact NE-OE2 3.47Å; E38-I40 PolarHBondContact O-N 2.96Å; E38-K55 IonicContact OE1-NZ 3.18Å; E38-K55 PolarHBondContact OE1-NZ 2.56Å; E38-K55 IonicContact OE2-NZ 3.69Å; E38-F56 HydrophobicContact CB-CE2 4.39Å; E38-F56 HydrophobicContact CB-CZ 4.43Å
39	W	95	Very high	92.4	Very high	96 Å²	96	60.2 Å²	60.2	36%	0.364	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	126.8	174.5	-178.7	69.9	0	0	0	110.4	H27 G41 R42 K51 A53	H27-W39 AromaticContact CG-NE1 3.84Å; H27-W39 AromaticContact ND1-CD1 3.86Å; H27-W39 AromaticContact ND1-CE2 3.87Å; H27-W39 AromaticContact ND1-NE1 3.05Å; H27-W39 PolarHBondContact ND1-NE1 2.8Å; W39-G41 VanDerWaalsContact CE2-C 3.42Å; W39-G41 VanDerWaalsContact CE2-CA 3.49Å; W39-G41 PolarHBondContact NE1-O 2.9Å; W39-R42 HydrophobicContact CZ2-CB 4.02Å; W39-R42 HydrophobicContact CZ2-CG 4.09Å; W39-K51 HydrophobicContact CH2-CB 4.08Å; W39-A53 HydrophobicContact CE3-CB 3.88Å; W39-A53 HydrophobicContact CZ3-CB 4.16Å; W39-A53 WeakPolarHBondContact O-CB 3.28Å
40	I	97	Very high	92.5	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-49	-179.4	-60.6	176	0	0	0	109.9	W28 K30 E38 Y52 A53 F56 A60 L73 Y86	W28-I40 HydrophobicContact CB-CB 4.14Å; W28-I40 HydrophobicContact CB-CD1 4.31Å; W28-I40 WeakPolarHBondContact O-CB 3.45Å; W28-I40 PolarHBondContact O-N 3.18Å; K30-I40 HydrophobicContact CB-CD1 4.02Å; K30-I40 HydrophobicContact CB-CG1 4.14Å; E38-I40 PolarHBondContact O-N 2.96Å; I40-Y52 WeakPolarHBondContact O-CA 3.43Å; I40-A53 PolarHBondContact O-N 2.93Å; I40-F56 HydrophobicContact CB-CD2 4.26Å; I40-F56 HydrophobicContact CB-CG 4.25Å; I40-F56 HydrophobicContact CD1-CE1 4.49Å; I40-F56 HydrophobicContact CG1-CD1 4.17Å; I40-F56 HydrophobicContact CG1-CD2 4.24Å; I40-F56 HydrophobicContact CG1-CE1 3.99Å; I40-F56 HydrophobicContact CG1-CE2 4.05Å; I40-F56 HydrophobicContact CG1-CG 4.29Å; I40-F56 HydrophobicContact CG1-CZ 3.92Å; I40-F56 HydrophobicContact CG2-CB 3.88Å; I40-F56 HydrophobicContact CG2-CD1 4.04Å; I40-F56 HydrophobicContact CG2-CD2 4.31Å; I40-F56 HydrophobicContact CG2-CG 3.82Å; I40-A60 HydrophobicContact CG2-CB 3.7Å; I40-L73 HydrophobicContact CD1-CD2 3.68Å; I40-L73 HydrophobicContact CG2-CD1 4.17Å; I40-Y86 HydrophobicContact CD1-CD1 3.71Å; I40-Y86 HydrophobicContact CD1-CE1 3.86Å
41	G	96.7	Very high	92.5	Very high	0 Å²	0	67 Å²	67	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.8	178.8	-173.3	0	0	0	0	0	112.9	H27 W28 W39 K51	H27-G41 WeakPolarHBondContact CA-O 3.27Å; W28-G41 PolarHBondContact N-O 2.88Å; W39-G41 VanDerWaalsContact CE2-C 3.42Å; W39-G41 VanDerWaalsContact CE2-CA 3.49Å; W39-G41 PolarHBondContact NE1-O 2.9Å; G41-K51 CarbonylContact C-O 3.56Å; G41-K51 WeakPolarHBondContact CA-O 3.49Å
42	R	96.1	Very high	92.6	Very high	25 Å²	25	66.4 Å²	66.4	9%	0.094	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	159.5	170.9	71.9	161.3	179.8	78.6	-7.6	111.1	Y25 M26 W39 E49 T50 K51	Y25-R42 VanDerWaalsContact CD1-NH1 3.31Å; Y25-R42 VanDerWaalsContact CE1-CZ 3.41Å; M26-R42 CarbonylContact O-C 3.59Å; M26-R42 WeakPolarHBondContact O-CA 3.45Å; W39-R42 HydrophobicContact CZ2-CB 4.02Å; W39-R42 HydrophobicContact CZ2-CG 4.09Å; R42-E49 IonicContact CZ-OE2 2.78Å; R42-E49 VanDerWaalsContact CZ-OE2 3.29Å; R42-E49 IonicContact NH1-OE2 3.85Å; R42-E49 PolarHBondContact NH1-OE2 2.92Å; R42-E49 IonicContact NH2-OE1 3.59Å; R42-E49 IonicContact NH2-OE2 2.86Å; R42-E49 PolarHBondContact NH2-OE2 3.15Å; R42-T50 WeakPolarHBondContact O-CA 3.41Å; R42-K51 HydrophobicContact CG-CB 4.16Å; R42-K51 PolarHBondContact N-O 2.84Å; R42-K51 PolarHBondContact O-N 2.84Å
43	I	96.7	Very high	92.9	Very high	7 Å²	7	65.6 Å²	65.6	4%	0.036	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	141.6	162.7	-174.5	161.7	0	0	0	109.6	Y25 M26 P45 E49 T50 I62 A64	Y25-I43 WeakPolarHBondContact CA-O 3.34Å; M26-I43 HydrophobicContact CB-CG2 3.93Å; M26-I43 PolarHBondContact N-O 2.92Å; M26-I43 PolarHBondContact O-N 3.27Å; I43-P45 HydrophobicContact CG2-CG 4.38Å; I43-P45 WeakPolarHBondContact O-CD 3.02Å; I43-E49 CarbonylContact C-O 3.56Å; I43-E49 WeakPolarHBondContact CA-O 3.23Å; I43-T50 HydrophobicContact CB-CG2 3.95Å; I43-T50 HydrophobicContact CD1-CG2 3.92Å; I43-T50 HydrophobicContact CG1-CG2 3.84Å; I43-I62 HydrophobicContact CB-CG2 3.63Å; I43-I62 HydrophobicContact CD1-CG2 4.49Å; I43-I62 HydrophobicContact CG2-CG2 3.54Å; I43-A64 HydrophobicContact CD1-CB 3.93Å; I43-A64 HydrophobicContact CG2-CB 4.4Å
44	D	95.8	Very high	93.8	Very high	14 Å²	14	64.2 Å²	64.2	8%	0.075	34%	0.337	C	S	.	.			trans	-87.2	109.3	157.1	-162.9	-32.1	0	0	0	108.8	Y25 E46 D47 G48 E49	Y25-D44 HydrophobicContact CD1-CB 3.84Å; Y25-D44 HydrophobicContact CE1-CB 3.55Å; Y25-D44 WeakPolarHBondContact CE1-OD2 3.35Å; Y25-D44 PolarHBondContact OH-OD2 3.08Å; D44-E46 PolarHBondContact O-N 3.04Å; D44-E46 WeakPolarHBondContact OD1-CB 3.4Å; D44-E46 PolarHBondContact OD1-N 2.78Å; D44-D47 VanDerWaalsContact CB-OD1 3.32Å; D44-D47 WeakPolarHBondContact CB-OD1 3.43Å; D44-G48 WeakPolarHBondContact O-CA 3.46Å; D44-G48 PolarHBondContact O-N 3.38Å; D44-E49 HydrophobicContact CB-CB 4.14Å; D44-E49 PolarHBondContact N-O 3.08Å
45	P	95.6	Very high	94.4	Very high	9 Å²	9	60.8 Å²	60.8	6%	0.058	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-12.9	-179.2	-19.7	36.7	0	0	0	113.4	I21 Y24 M26 I43 A64 T66	I21-P45 HydrophobicContact CG1-CG 4.09Å; I21-P45 HydrophobicContact CG2-CB 4.19Å; I21-P45 VanDerWaalsContact O-CG 3.26Å; I21-P45 WeakPolarHBondContact O-CG 3.33Å; Y24-P45 WeakPolarHBondContact O-CD 3.4Å; M26-P45 HydrophobicContact CG-CG 3.94Å; I43-P45 HydrophobicContact CG2-CG 4.38Å; I43-P45 WeakPolarHBondContact O-CD 3.02Å; P45-A64 HydrophobicContact CB-CB 3.81Å; P45-A64 HydrophobicContact CG-CB 4.14Å; P45-T66 HydrophobicContact CB-CG2 4.04Å; P45-T66 VanDerWaalsContact O-CG2 3.26Å; P45-T66 WeakPolarHBondContact O-CG2 2.95Å
46	E	94.8	Very high	95.3	Very high	147 Å²	147	55.2 Å²	55.2	69%	0.687	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-49.4	177.1	-173.9	174.8	-162.9	0	0	111.5	D44	D44-E46 PolarHBondContact O-N 3.04Å; D44-E46 WeakPolarHBondContact OD1-CB 3.4Å; D44-E46 PolarHBondContact OD1-N 2.78Å
47	D	94.9	Very high	95.7	Very high	114 Å²	114	60.2 Å²	60.2	61%	0.61	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	-7.5	-174.6	69.7	5.5	0	0	0	114.4	D44 E49	D44-D47 VanDerWaalsContact CB-OD1 3.32Å; D44-D47 WeakPolarHBondContact CB-OD1 3.43Å; D47-E49 VanDerWaalsContact OD1-CB 3.26Å; D47-E49 WeakPolarHBondContact OD1-CB 3.39Å; D47-E49 PolarHBondContact OD1-N 3.39Å
48	G	95.1	Very high	95.7	Very high	43 Å²	43	59.1 Å²	59.1	44%	0.443	32%	0.319	S	S	.	.			trans	82.8	8.3	-179.9	0	0	0	0	0	114.7	D44 T50	D44-G48 WeakPolarHBondContact O-CA 3.46Å; D44-G48 PolarHBondContact O-N 3.38Å; G48-T50 PolarHBondContact O-N 3.07Å
49	E	96.3	Very high	95.8	Very high	73 Å²	73	59.5 Å²	59.5	34%	0.341	32%	0.32	S	S	.	.			trans	-61.3	127.6	178.4	-167.6	-143.2	-176.3	0	0	110.5	R42 I43 D44 D47 K51	R42-E49 IonicContact CZ-OE2 2.78Å; R42-E49 VanDerWaalsContact CZ-OE2 3.29Å; R42-E49 IonicContact NH1-OE2 3.85Å; R42-E49 PolarHBondContact NH1-OE2 2.92Å; R42-E49 IonicContact NH2-OE1 3.59Å; R42-E49 IonicContact NH2-OE2 2.86Å; R42-E49 PolarHBondContact NH2-OE2 3.15Å; I43-E49 CarbonylContact C-O 3.56Å; I43-E49 WeakPolarHBondContact CA-O 3.23Å; D44-E49 HydrophobicContact CB-CB 4.14Å; D44-E49 PolarHBondContact N-O 3.08Å; D47-E49 VanDerWaalsContact OD1-CB 3.26Å; D47-E49 WeakPolarHBondContact OD1-CB 3.39Å; D47-E49 PolarHBondContact OD1-N 3.39Å; E49-K51 WeakPolarHBondContact OE1-CE 3.49Å; E49-K51 IonicContact OE1-NZ 3.67Å
50	T	97.4	Very high	95.9	Very high	52 Å²	52	55.1 Å²	55.1	32%	0.319	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.9	177.4	52.6	0	0	0	0	111.9	R42 I43 G48 Y52 I62	R42-T50 WeakPolarHBondContact O-CA 3.41Å; I43-T50 HydrophobicContact CB-CG2 3.95Å; I43-T50 HydrophobicContact CD1-CG2 3.92Å; I43-T50 HydrophobicContact CG1-CG2 3.84Å; G48-T50 PolarHBondContact O-N 3.07Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.37Å; T50-I62 HydrophobicContact CG2-CB 4.43Å
51	K	96.9	Very high	96	Very high	99 Å²	99	58.5 Å²	58.5	43%	0.43	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	141.2	169.8	-67.3	-174.1	179.3	169.9	0	109.4	W39 G41 R42 E49	W39-K51 HydrophobicContact CH2-CB 4.08Å; G41-K51 CarbonylContact C-O 3.56Å; G41-K51 WeakPolarHBondContact CA-O 3.49Å; R42-K51 HydrophobicContact CG-CB 4.16Å; R42-K51 PolarHBondContact N-O 2.84Å; R42-K51 PolarHBondContact O-N 2.84Å; E49-K51 WeakPolarHBondContact OE1-CE 3.49Å; E49-K51 IonicContact OE1-NZ 3.67Å
52	Y	97.8	Very high	96	Very high	58 Å²	58	58.8 Å²	58.8	23%	0.227	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	147.9	-177.6	-61.2	-88.6	0	0	0	110.2	I40 T50 A60 I62	I40-Y52 WeakPolarHBondContact O-CA 3.43Å; T50-Y52 WeakPolarHBondContact OG1-CE2 3.37Å; Y52-A60 HydrophobicContact CD1-CB 4.31Å; Y52-A60 HydrophobicContact CE1-CB 4.25Å; Y52-A60 WeakPolarHBondContact CE1-O 3.42Å; Y52-I62 HydrophobicContact CD1-CD1 4.18Å; Y52-I62 HydrophobicContact CE1-CB 4.32Å; Y52-I62 HydrophobicContact CE1-CD1 3.75Å; Y52-I62 HydrophobicContact CE1-CG1 3.83Å; Y52-I62 PolarHBondContact OH-N 3.34Å
53	A	96.6	Very high	96.1	Very high	17 Å²	17	60.5 Å²	60.5	14%	0.14	34%	0.34	C	S	.	.			trans	-69.1	142.4	161	0	0	0	0	0	109.3	W39 I40 K55 F56 Q57	W39-A53 HydrophobicContact CE3-CB 3.88Å; W39-A53 HydrophobicContact CZ3-CB 4.16Å; W39-A53 WeakPolarHBondContact O-CB 3.28Å; I40-A53 PolarHBondContact O-N 2.93Å; A53-K55 PolarHBondContact O-N 2.84Å; A53-F56 HydrophobicContact CB-CD2 4.1Å; A53-F56 PolarHBondContact O-N 2.87Å; A53-Q57 PolarHBondContact O-N 2.81Å
54	P	96.1	Very high	96.2	Very high	114 Å²	114	61.8 Å²	61.8	74%	0.74	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-52.2	-35.5	-176.6	-29.9	35.4	0	0	0	114.2	F56 Q57	P54-F56 PolarHBondContact O-N 2.81Å; P54-Q57 PolarHBondContact O-N 2.86Å
55	K	93.3	Very high	96.2	Very high	112 Å²	112	63.8 Å²	63.8	49%	0.487	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-62.1	-27.7	178.6	-177.6	176.1	177.6	-179.9	0	114.1	E38 A53	E38-K55 IonicContact OE1-NZ 3.18Å; E38-K55 PolarHBondContact OE1-NZ 2.56Å; E38-K55 IonicContact OE2-NZ 3.69Å; A53-K55 PolarHBondContact O-N 2.84Å
56	F	95.4	Very high	96.2	Very high	4 Å²	4	65.6 Å²	65.6	2%	0.018	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-105.8	-1.9	-175	-64.6	-83.1	0	0	0	113	K30 E38 I40 A53 P54 G58 K59 A60	K30-F56 HydrophobicContact CB-CZ 4.43Å; K30-F56 HydrophobicContact CD-CE1 4.09Å; K30-F56 HydrophobicContact CD-CZ 3.96Å; E38-F56 HydrophobicContact CB-CE2 4.39Å; E38-F56 HydrophobicContact CB-CZ 4.43Å; I40-F56 HydrophobicContact CB-CD2 4.26Å; I40-F56 HydrophobicContact CB-CG 4.25Å; I40-F56 HydrophobicContact CD1-CE1 4.49Å; I40-F56 HydrophobicContact CG1-CD1 4.17Å; I40-F56 HydrophobicContact CG1-CD2 4.24Å; I40-F56 HydrophobicContact CG1-CE1 3.99Å; I40-F56 HydrophobicContact CG1-CE2 4.05Å; I40-F56 HydrophobicContact CG1-CG 4.29Å; I40-F56 HydrophobicContact CG1-CZ 3.92Å; I40-F56 HydrophobicContact CG2-CB 3.88Å; I40-F56 HydrophobicContact CG2-CD1 4.04Å; I40-F56 HydrophobicContact CG2-CD2 4.31Å; I40-F56 HydrophobicContact CG2-CG 3.82Å; A53-F56 HydrophobicContact CB-CD2 4.1Å; A53-F56 PolarHBondContact O-N 2.87Å; P54-F56 PolarHBondContact O-N 2.81Å; F56-G58 PolarHBondContact O-N 2.91Å; F56-K59 PolarHBondContact O-N 2.8Å; F56-K59 VanDerWaalsContact O-N 3.08Å; F56-A60 HydrophobicContact CB-CB 4.08Å; F56-A60 PolarHBondContact O-N 3.05Å
57	Q	94.7	Very high	96.3	Very high	144 Å²	144	63.7 Å²	63.7	67%	0.673	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	128	177.7	-163.2	165	4.1	0	0	110.1	A53 P54 K59	A53-Q57 PolarHBondContact O-N 2.81Å; P54-Q57 PolarHBondContact O-N 2.86Å; Q57-K59 PolarHBondContact O-N 3.03Å
58	G	93	Very high	96.4	Very high	75 Å²	75	60.4 Å²	60.4	77%	0.773	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	-15	-175.4	0	0	0	0	0	115.2	F56	F56-G58 PolarHBondContact O-N 2.91Å
59	K	95.9	Very high	96.4	Very high	46 Å²	46	60 Å²	60	20%	0.2	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-37.1	175.3	-171	169.7	-169.1	169.8	0	113	F56 Q57 L75 S76 D82	F56-K59 PolarHBondContact O-N 2.8Å; F56-K59 VanDerWaalsContact O-N 3.08Å; Q57-K59 PolarHBondContact O-N 3.03Å; K59-L75 WeakPolarHBondContact O-CA 3.21Å; K59-S76 WeakPolarHBondContact CE-O 3.4Å; K59-S76 WeakPolarHBondContact CG-O 3.01Å; K59-S76 PolarHBondContact O-N 2.83Å; K59-S76 PolarHBondContact O-OG 2.89Å; K59-D82 WeakPolarHBondContact CE-OD2 3.14Å; K59-D82 IonicContact NZ-OD1 3.29Å; K59-D82 PolarHBondContact NZ-OD1 2.84Å; K59-D82 IonicContact NZ-OD2 2.96Å; K59-D82 PolarHBondContact NZ-OD2 3.44Å
60	A	97.8	Very high	96.5	Very high	5 Å²	5	56.9 Å²	56.9	4%	0.041	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	137.6	179.1	0	0	0	0	0	110.9	I40 Y52 F56 L73 Q74 L75	I40-A60 HydrophobicContact CG2-CB 3.7Å; Y52-A60 HydrophobicContact CD1-CB 4.31Å; Y52-A60 HydrophobicContact CE1-CB 4.25Å; Y52-A60 WeakPolarHBondContact CE1-O 3.42Å; F56-A60 HydrophobicContact CB-CB 4.08Å; F56-A60 PolarHBondContact O-N 3.05Å; A60-L73 HydrophobicContact CB-CD1 3.82Å; A60-Q74 CarbonylContact C-O 3.36Å; A60-Q74 WeakPolarHBondContact CA-O 3.14Å; A60-L75 HydrophobicContact CB-CD2 3.98Å
61	T	98.3	Very high	96.5	Very high	71 Å²	71	54.4 Å²	54.4	44%	0.436	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	118.3	167	-57.7	0	0	0	0	108	T63 Q74	T61-T63 HydrophobicContact CG2-CG2 4.22Å; T61-Q74 PolarHBondContact N-O 2.94Å; T61-Q74 PolarHBondContact O-N 2.96Å
62	I	98.3	Very high	96.5	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.026	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	131.6	177.8	-58.9	166	0	0	0	108.5	I43 T50 Y52 Y72 L73	I43-I62 HydrophobicContact CB-CG2 3.63Å; I43-I62 HydrophobicContact CD1-CG2 4.49Å; I43-I62 HydrophobicContact CG2-CG2 3.54Å; T50-I62 HydrophobicContact CG2-CB 4.43Å; Y52-I62 HydrophobicContact CD1-CD1 4.18Å; Y52-I62 HydrophobicContact CE1-CB 4.32Å; Y52-I62 HydrophobicContact CE1-CD1 3.75Å; Y52-I62 HydrophobicContact CE1-CG1 3.83Å; Y52-I62 PolarHBondContact OH-N 3.34Å; I62-Y72 WeakPolarHBondContact CA-O 2.87Å; I62-L73 HydrophobicContact CG1-CD1 3.9Å
63	T	98	Very high	96.6	Very high	62 Å²	62	49.3 Å²	49.3	38%	0.38	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	166.5	175.3	62	0	0	0	0	110.7	T61 A71 Y72	T61-T63 HydrophobicContact CG2-CG2 4.22Å; T63-A71 CarbonylContact O-C 3.58Å; T63-A71 WeakPolarHBondContact O-CA 2.98Å; T63-Y72 PolarHBondContact N-O 2.8Å; T63-Y72 PolarHBondContact O-N 2.83Å
64	A	97.5	Very high	96.7	Very high	33 Å²	33	52.8 Å²	52.8	27%	0.273	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	143.3	173.9	0	0	0	0	0	110.2	I43 P45 T70	I43-A64 HydrophobicContact CD1-CB 3.93Å; I43-A64 HydrophobicContact CG2-CB 4.4Å; P45-A64 HydrophobicContact CB-CB 3.81Å; P45-A64 HydrophobicContact CG-CB 4.14Å; A64-T70 WeakPolarHBondContact CA-O 2.99Å
65	D	97	Very high	96.7	Very high	56 Å²	56	47.4 Å²	47.4	30%	0.299	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	110.9	168.1	174.8	9.4	0	0	0	108.2	S67 S68 N69 T70 Y72	D65-S67 VanDerWaalsContact C-N 3.33Å; D65-S67 WeakPolarHBondContact OD1-CB 3.37Å; D65-S67 PolarHBondContact OD1-N 3.11Å; D65-S67 PolarHBondContact OD1-OG 3.49Å; D65-S67 PolarHBondContact OD2-OG 2.82Å; D65-S68 WeakPolarHBondContact CB-OG 3.47Å; D65-S68 PolarHBondContact OD1-N 2.92Å; D65-S68 WeakPolarHBondContact OD2-CB 3.47Å; D65-S68 PolarHBondContact OD2-OG 3.08Å; D65-N69 PolarHBondContact O-N 3.35Å; D65-T70 PolarHBondContact N-O 3.37Å; D65-T70 PolarHBondContact O-N 2.97Å; D65-Y72 HydrophobicContact CB-CE2 4Å
66	T	96	Very high	96.9	Very high	47 Å²	47	43.7 Å²	43.7	29%	0.288	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-17.5	-175.3	60.8	0	0	0	0	112.5	I21 K22 P45	I21-T66 HydrophobicContact CG2-CG2 4.21Å; K22-T66 HydrophobicContact CD-CG2 4.06Å; K22-T66 VanDerWaalsContact CE-CG2 3.44Å; K22-T66 WeakPolarHBondContact CE-OG1 3.49Å; K22-T66 HydrophobicContact CG-CG2 3.42Å; K22-T66 VanDerWaalsContact CG-CG2 3.42Å; P45-T66 HydrophobicContact CB-CG2 4.04Å; P45-T66 VanDerWaalsContact O-CG2 3.26Å; P45-T66 WeakPolarHBondContact O-CG2 2.95Å
67	S	95.6	Very high	96.9	Very high	107 Å²	107	47.3 Å²	47.3	75%	0.748	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-37.2	173.9	73.4	0	0	0	0	111.6	D65	D65-S67 VanDerWaalsContact C-N 3.33Å; D65-S67 WeakPolarHBondContact OD1-CB 3.37Å; D65-S67 PolarHBondContact OD1-N 3.11Å; D65-S67 PolarHBondContact OD1-OG 3.49Å; D65-S67 PolarHBondContact OD2-OG 2.82Å
68	S	96.9	Very high	97	Very high	46 Å²	46	40.5 Å²	40.5	32%	0.322	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	6.7	175.7	65.2	0	0	0	0	113.6	D65 T70	D65-S68 WeakPolarHBondContact CB-OG 3.47Å; D65-S68 PolarHBondContact OD1-N 2.92Å; D65-S68 WeakPolarHBondContact OD2-CB 3.47Å; D65-S68 PolarHBondContact OD2-OG 3.08Å; S68-T70 PolarHBondContact O-N 3.41Å; S68-T70 PolarHBondContact O-OG1 3.27Å
69	N	96.2	Very high	97.1	Very high	34 Å²	34	39.7 Å²	39.7	18%	0.182	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	38.1	179.6	-149.5	40.9	0	0	0	113.2	A16 F19 I21 D65	A16-N69 VanDerWaalsContact CB-ND2 3.34Å; A16-N69 WeakPolarHBondContact CB-ND2 3.28Å; A16-N69 PolarHBondContact N-O 2.78Å; A16-N69 PolarHBondContact O-ND2 3.28Å; F19-N69 PolarHBondContact O-ND2 2.97Å; I21-N69 WeakPolarHBondContact CB-OD1 3.44Å; I21-N69 WeakPolarHBondContact CG2-OD1 3.06Å; I21-N69 PolarHBondContact N-OD1 3.21Å; D65-N69 PolarHBondContact O-N 3.35Å
70	T	97.6	Very high	96.9	Very high	7 Å²	7	41.7 Å²	41.7	4%	0.043	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	129.8	-168	-61.3	0	0	0	0	112	C14 T15 A64 D65 S68 Y72	C14-T70 CarbonylContact O-C 3.59Å; C14-T70 WeakPolarHBondContact O-CA 3.27Å; T15-T70 PolarHBondContact OG1-OG1 2.88Å; A64-T70 WeakPolarHBondContact CA-O 2.99Å; D65-T70 PolarHBondContact N-O 3.37Å; D65-T70 PolarHBondContact O-N 2.97Å; S68-T70 PolarHBondContact O-N 3.41Å; S68-T70 PolarHBondContact O-OG1 3.27Å; T70-Y72 HydrophobicContact CG2-CD1 4.22Å; T70-Y72 HydrophobicContact CG2-CD2 4.49Å; T70-Y72 HydrophobicContact CG2-CE1 3.6Å; T70-Y72 HydrophobicContact CG2-CE2 3.9Å
71	A	97.4	Very high	96.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	149.9	168.4	0	0	0	0	0	110.6	S13 C14 I21 M26 T63	S13-A71 CarbonylContact C-O 3.48Å; S13-A71 WeakPolarHBondContact CA-O 3.03Å; C14-A71 PolarHBondContact N-O 3.29Å; C14-A71 PolarHBondContact O-N 2.02Å; I21-A71 HydrophobicContact CD1-CB 3.9Å; M26-A71 HydrophobicContact CB-CB 4.08Å; M26-A71 HydrophobicContact CG-CB 4.29Å; T63-A71 CarbonylContact O-C 3.58Å; T63-A71 WeakPolarHBondContact O-CA 2.98Å
72	Y	98.3	Very high	96.4	Very high	51 Å²	51	44 Å²	44	20%	0.2	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	147.1	179.9	-56.3	-83	0	0	0	111.4	K11 L12 I62 T63 D65 T70	K11-Y72 VanDerWaalsContact CE-CD1 3.45Å; L12-Y72 WeakPolarHBondContact O-CA 3.43Å; I62-Y72 WeakPolarHBondContact CA-O 2.87Å; T63-Y72 PolarHBondContact N-O 2.8Å; T63-Y72 PolarHBondContact O-N 2.83Å; D65-Y72 HydrophobicContact CB-CE2 4Å; T70-Y72 HydrophobicContact CG2-CD1 4.22Å; T70-Y72 HydrophobicContact CG2-CD2 4.49Å; T70-Y72 HydrophobicContact CG2-CE1 3.6Å; T70-Y72 HydrophobicContact CG2-CE2 3.9Å
73	L	98.5	Very high	96.3	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	-125.3	117	168.6	168.3	67	0	0	0	108.2	K11 L12 W28 I40 A60 I62 L75 Y86	K11-L73 CarbonylContact C-O 3.5Å; K11-L73 WeakPolarHBondContact CA-O 3.47Å; L12-L73 HydrophobicContact CB-CB 4.42Å; L12-L73 HydrophobicContact CD1-CD2 4.26Å; L12-L73 PolarHBondContact N-O 2.91Å; L12-L73 PolarHBondContact O-N 2.66Å; W28-L73 HydrophobicContact CB-CD2 4.1Å; W28-L73 HydrophobicContact CD2-CB 3.47Å; W28-L73 VanDerWaalsContact CD2-CB 3.47Å; W28-L73 HydrophobicContact CD2-CD2 3.86Å; W28-L73 HydrophobicContact CD2-CG 4.24Å; W28-L73 VanDerWaalsContact CE2-CB 3.46Å; W28-L73 HydrophobicContact CE3-CB 3.77Å; W28-L73 HydrophobicContact CE3-CD2 3.66Å; W28-L73 HydrophobicContact CE3-CG 4.36Å; W28-L73 HydrophobicContact CG-CB 3.94Å; W28-L73 HydrophobicContact CG-CD2 4.06Å; W28-L73 HydrophobicContact CG-CG 4.43Å; W28-L73 HydrophobicContact CH2-CB 4.03Å; W28-L73 HydrophobicContact CZ2-CB 3.76Å; W28-L73 HydrophobicContact CZ3-CB 4.03Å; W28-L73 HydrophobicContact CZ3-CD2 4.33Å; I40-L73 HydrophobicContact CD1-CD2 3.68Å; I40-L73 HydrophobicContact CG2-CD1 4.17Å; A60-L73 HydrophobicContact CB-CD1 3.82Å; I62-L73 HydrophobicContact CG1-CD1 3.9Å; L73-L75 HydrophobicContact CD1-CD2 4.08Å; L73-L75 HydrophobicContact CD1-CG 4.36Å; L73-L75 HydrophobicContact CD2-CD1 4.3Å; L73-L75 HydrophobicContact CD2-CD2 4.34Å; L73-L75 HydrophobicContact CD2-CG 4.25Å; L73-L75 HydrophobicContact CG-CD2 4.31Å; L73-L75 HydrophobicContact CG-CG 4.11Å; L73-Y86 HydrophobicContact CD2-CD1 4.1Å
74	Q	98.3	Very high	96.2	Very high	89 Å²	89	43.4 Å²	43.4	42%	0.416	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	126.2	169.5	-176.2	171.1	-1.6	0	0	109.4	V10 A60 T61	V10-Q74 CarbonylContact O-C 3.53Å; V10-Q74 VanDerWaalsContact O-CA 3.29Å; V10-Q74 WeakPolarHBondContact O-CA 3.41Å; A60-Q74 CarbonylContact C-O 3.36Å; A60-Q74 WeakPolarHBondContact CA-O 3.14Å; T61-Q74 PolarHBondContact N-O 2.94Å; T61-Q74 PolarHBondContact O-N 2.96Å
75	L	97.7	Very high	96.2	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	-110.7	129.6	173.2	-62.7	165.6	0	0	0	108.6	S9 V10 K59 A60 L73 L78 Y86	S9-L75 CarbonylContact C-O 3.52Å; S9-L75 WeakPolarHBondContact CA-O 3.44Å; S9-L75 WeakPolarHBondContact CB-O 3.37Å; V10-L75 HydrophobicContact CG1-CB 4.24Å; V10-L75 HydrophobicContact CG1-CD1 4.37Å; V10-L75 PolarHBondContact N-O 3.3Å; V10-L75 PolarHBondContact O-N 3.4Å; K59-L75 WeakPolarHBondContact O-CA 3.21Å; A60-L75 HydrophobicContact CB-CD2 3.98Å; L73-L75 HydrophobicContact CD1-CD2 4.08Å; L73-L75 HydrophobicContact CD1-CG 4.36Å; L73-L75 HydrophobicContact CD2-CD1 4.3Å; L73-L75 HydrophobicContact CD2-CD2 4.34Å; L73-L75 HydrophobicContact CD2-CG 4.25Å; L73-L75 HydrophobicContact CG-CD2 4.31Å; L73-L75 HydrophobicContact CG-CG 4.11Å; L75-L78 HydrophobicContact CB-CD2 3.71Å; L75-L78 HydrophobicContact CB-CG 4.47Å; L75-L78 HydrophobicContact CD1-CD2 4.26Å; L75-Y86 HydrophobicContact CD1-CD1 3.95Å; L75-Y86 HydrophobicContact CD1-CE1 3.38Å; L75-Y86 HydrophobicContact CD1-CE2 4.4Å
76	S	96.9	Very high	96.2	Very high	34 Å²	34	40.9 Å²	40.9	24%	0.238	24%	0.244	C	C	.	.			trans	-105	158.9	178.2	61.2	0	0	0	0	112	S9 K59 L78	S9-S76 WeakPolarHBondContact OG-CA 3.29Å; K59-S76 WeakPolarHBondContact CE-O 3.4Å; K59-S76 WeakPolarHBondContact CG-O 3.01Å; K59-S76 PolarHBondContact O-N 2.83Å; K59-S76 PolarHBondContact O-OG 2.89Å; S76-L78 VanDerWaalsContact C-N 3.35Å; S76-L78 PolarHBondContact O-N 3.03Å
77	S	95.7	Very high	96.3	Very high	80 Å²	80	40.8 Å²	40.8	56%	0.559	24%	0.238	S	C	*	.	S	Bend	trans	49.8	52.5	172	-57.4	0	0	0	0	113.1	A8	A8-S77 PolarHBondContact O-N 2.87Å
78	L	95.9	Very high	96.2	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	21%	0.207	C	C	.	.			trans	-64.4	140.1	-173.7	-70.6	173.6	0	0	0	112.2	V4 P6 G7 A8 V10 L75 S76 D82 V105 V107	V4-L78 HydrophobicContact CG2-CD1 3.6Å; P6-L78 CarbonylContact C-O 3.59Å; P6-L78 WeakPolarHBondContact CA-O 3.49Å; G7-L78 PolarHBondContact N-O 3.34Å; A8-L78 WeakPolarHBondContact O-CB 3.32Å; A8-L78 WeakPolarHBondContact O-CG 3.34Å; A8-L78 PolarHBondContact O-N 2.91Å; V10-L78 HydrophobicContact CB-CD1 3.9Å; V10-L78 HydrophobicContact CG1-CD1 3.79Å; L75-L78 HydrophobicContact CB-CD2 3.71Å; L75-L78 HydrophobicContact CB-CG 4.47Å; L75-L78 HydrophobicContact CD1-CD2 4.26Å; S76-L78 VanDerWaalsContact C-N 3.35Å; S76-L78 PolarHBondContact O-N 3.03Å; L78-D82 WeakPolarHBondContact CA-OD2 3.39Å; L78-D82 HydrophobicContact CD2-CB 3.59Å; L78-V105 HydrophobicContact CD1-CG1 4.49Å; L78-V107 HydrophobicContact CB-CG1 4.28Å; L78-V107 HydrophobicContact CB-CG2 3.98Å; L78-V107 HydrophobicContact CD1-CG2 4.41Å
79	T	95	Very high	96.1	Very high	59 Å²	59	34.1 Å²	34.1	36%	0.362	19%	0.192	S	C	.	.			trans	-120	169.7	175.4	68.5	0	0	0	0	110.1	E81 D82 V107	T79-E81 PolarHBondContact O-N 2.86Å; T79-E81 VanDerWaalsContact O-N 3.11Å; T79-D82 PolarHBondContact N-OD2 3.27Å; T79-D82 WeakPolarHBondContact O-CB 3.34Å; T79-D82 PolarHBondContact O-N 3.06Å; T79-D82 PolarHBondContact OG1-OD2 3.31Å; T79-V107 WeakPolarHBondContact O-CB 3.35Å; T79-V107 WeakPolarHBondContact O-CG2 3.39Å
80	S	93	Very high	95.7	Very high	88 Å²	88	34 Å²	34	62%	0.615	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-53.9	-32	176.3	50.4	0	0	0	0	112.6	D82 T83	S80-D82 PolarHBondContact O-N 2.78Å; S80-T83 WeakPolarHBondContact O-CB 3.38Å; S80-T83 PolarHBondContact O-N 2.79Å; S80-T83 VanDerWaalsContact O-N 3.11Å; S80-T83 PolarHBondContact O-OG1 2.87Å
81	E	91.6	Very high	94.7	Very high	121 Å²	121	35.8 Å²	35.8	57%	0.565	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-67.6	-9.9	175.7	-61.3	-170.6	-166.3	0	0	114.8	K30 R32 T79 T83	K30-E81 WeakPolarHBondContact CE-O 3.34Å; K30-E81 PolarHBondContact NZ-O 3.01Å; R32-E81 PolarHBondContact NH2-O 2.82Å; R32-E81 IonicContact NH2-OE2 2.91Å; T79-E81 PolarHBondContact O-N 2.86Å; T79-E81 VanDerWaalsContact O-N 3.11Å; E81-T83 VanDerWaalsContact C-N 3.35Å
82	D	94.1	Very high	93.1	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-89.6	-2.7	173.5	-58.1	-49.6	0	0	0	113.7	K30 K59 L78 T79 S80 A84 Y86 V107	K30-D82 IonicContact NZ-OD1 3.69Å; K30-D82 PolarHBondContact NZ-OD1 3.48Å; K59-D82 WeakPolarHBondContact CE-OD2 3.14Å; K59-D82 IonicContact NZ-OD1 3.29Å; K59-D82 PolarHBondContact NZ-OD1 2.84Å; K59-D82 IonicContact NZ-OD2 2.96Å; K59-D82 PolarHBondContact NZ-OD2 3.44Å; L78-D82 WeakPolarHBondContact CA-OD2 3.39Å; L78-D82 HydrophobicContact CD2-CB 3.59Å; T79-D82 PolarHBondContact N-OD2 3.27Å; T79-D82 WeakPolarHBondContact O-CB 3.34Å; T79-D82 PolarHBondContact O-N 3.06Å; T79-D82 PolarHBondContact OG1-OD2 3.31Å; S80-D82 PolarHBondContact O-N 2.78Å; D82-A84 PolarHBondContact O-N 2.98Å; D82-A84 VanDerWaalsContact O-N 3.08Å; D82-Y86 WeakPolarHBondContact O-CE2 3.26Å; D82-Y86 PolarHBondContact O-OH 2.85Å; D82-V107 HydrophobicContact CB-CG2 4.15Å
83	T	95.5	Very high	91.4	Very high	51 Å²	51	43.3 Å²	43.3	31%	0.313	24%	0.243	S	C	.	.			trans	-63.9	110.9	169.5	-61	0	0	0	0	109.7	S80 E81 V105 T106 V107	S80-T83 WeakPolarHBondContact O-CB 3.38Å; S80-T83 PolarHBondContact O-N 2.79Å; S80-T83 VanDerWaalsContact O-N 3.11Å; S80-T83 PolarHBondContact O-OG1 2.87Å; E81-T83 VanDerWaalsContact C-N 3.35Å; T83-V105 VanDerWaalsContact CA-O 3.28Å; T83-V105 WeakPolarHBondContact CA-O 3.44Å; T83-T106 HydrophobicContact CG2-CG2 4.34Å; T83-V107 PolarHBondContact OG1-N 2.63Å
84	A	96.4	Very high	89.2	Confident	2 Å²	2	49.5 Å²	49.5	2%	0.017	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	167	-173	0	0	0	0	0	110.6	K30 Q31 R32 D82 Y86 V105	K30-A84 HydrophobicContact CD-CB 4.17Å; K30-A84 HydrophobicContact CG-CB 3.51Å; Q31-A84 WeakPolarHBondContact O-CA 3.35Å; Q31-A84 VanDerWaalsContact O-CB 3.27Å; Q31-A84 WeakPolarHBondContact O-CB 3.33Å; R32-A84 HydrophobicContact CG-CB 4.31Å; D82-A84 PolarHBondContact O-N 2.98Å; D82-A84 VanDerWaalsContact O-N 3.08Å; A84-Y86 HydrophobicContact CB-CD2 4.41Å; A84-Y86 HydrophobicContact CB-CE2 3.8Å; A84-Y86 WeakPolarHBondContact O-CD2 3.34Å; A84-Y86 WeakPolarHBondContact O-CE2 3.43Å; A84-V105 PolarHBondContact N-O 3.38Å; A84-V105 VanDerWaalsContact N-O 3.1Å; A84-V105 PolarHBondContact O-N 3.06Å
85	V	97.1	Very high	87.3	Confident	36 Å²	36	50 Å²	50	22%	0.218	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	127.8	165.2	-171.2	0	0	0	0	108.8	Q31 Y87 L104	Q31-V85 PolarHBondContact N-O 2.77Å; Q31-V85 PolarHBondContact O-N 3Å; V85-Y87 HydrophobicContact CB-CE2 3.76Å; V85-Y87 HydrophobicContact CG1-CD2 4.19Å; V85-Y87 HydrophobicContact CG1-CE1 3.92Å; V85-Y87 HydrophobicContact CG1-CE2 3.5Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.37Å; V85-L104 HydrophobicContact CG2-CB 4.42Å; V85-L104 HydrophobicContact CG2-CD1 4.13Å
86	Y	97.4	Very high	85.5	Confident	1 Å²	1	52.5 Å²	52.5	0%	0.004	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	126	179.6	-68.4	-96	0	0	0	109.7	L12 V29 K30 I40 L73 L75 D82 A84 G102 T103 V105	L12-Y86 VanDerWaalsContact CD1-CB 3.41Å; L12-Y86 HydrophobicContact CD1-CD1 4.28Å; L12-Y86 HydrophobicContact CD1-CD2 4.27Å; L12-Y86 HydrophobicContact CD1-CG 3.73Å; V29-Y86 WeakPolarHBondContact O-CA 3.16Å; K30-Y86 HydrophobicContact CB-CD1 4.21Å; K30-Y86 HydrophobicContact CB-CE1 3.95Å; K30-Y86 HydrophobicContact CD-CE1 3.99Å; K30-Y86 WeakPolarHBondContact CE-OH 3.38Å; K30-Y86 HydrophobicContact CG-CD1 4.39Å; K30-Y86 HydrophobicContact CG-CE1 3.81Å; I40-Y86 HydrophobicContact CD1-CD1 3.71Å; I40-Y86 HydrophobicContact CD1-CE1 3.86Å; L73-Y86 HydrophobicContact CD2-CD1 4.1Å; L75-Y86 HydrophobicContact CD1-CD1 3.95Å; L75-Y86 HydrophobicContact CD1-CE1 3.38Å; L75-Y86 HydrophobicContact CD1-CE2 4.4Å; D82-Y86 WeakPolarHBondContact O-CE2 3.26Å; D82-Y86 PolarHBondContact O-OH 2.85Å; A84-Y86 HydrophobicContact CB-CD2 4.41Å; A84-Y86 HydrophobicContact CB-CE2 3.8Å; A84-Y86 WeakPolarHBondContact O-CD2 3.34Å; A84-Y86 WeakPolarHBondContact O-CE2 3.43Å; Y86-G102 CarbonylContact O-C 3.53Å; Y86-G102 VanDerWaalsContact O-CA 3.27Å; Y86-G102 WeakPolarHBondContact O-CA 3.26Å; Y86-T103 PolarHBondContact N-O 3.2Å; Y86-T103 PolarHBondContact O-N 2.8Å; Y86-V105 HydrophobicContact CD2-CB 3.92Å; Y86-V105 HydrophobicContact CD2-CG2 3.64Å; Y86-V105 HydrophobicContact CE2-CB 3.75Å; Y86-V105 HydrophobicContact CE2-CG2 3.92Å
87	Y	96.3	Very high	84.1	Confident	44 Å²	44	52.3 Å²	52.3	17%	0.173	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	143.2	-179.7	-59	-90	0	0	0	110.5	W28 V29 Q31 V85 W99 G100	W28-Y87 WeakPolarHBondContact CA-O 3.48Å; V29-Y87 PolarHBondContact N-O 2.87Å; V29-Y87 PolarHBondContact O-N 2.67Å; Q31-Y87 HydrophobicContact CB-CD2 4.23Å; Q31-Y87 HydrophobicContact CB-CE2 3.64Å; Q31-Y87 HydrophobicContact CG-CE2 4.49Å; Q31-Y87 PolarHBondContact OE1-OH 3.34Å; V85-Y87 HydrophobicContact CB-CE2 3.76Å; V85-Y87 HydrophobicContact CG1-CD2 4.19Å; V85-Y87 HydrophobicContact CG1-CE1 3.92Å; V85-Y87 HydrophobicContact CG1-CE2 3.5Å; V85-Y87 WeakPolarHBondContact CG1-OH 3.37Å; Y87-W99 HydrophobicContact CD1-CE3 4.22Å; Y87-W99 HydrophobicContact CD2-CE3 4.47Å; Y87-W99 HydrophobicContact CD2-CZ3 4.31Å; Y87-W99 AromaticContact CG-CE3 3.84Å; Y87-W99 HydrophobicContact CG-CE3 3.84Å; Y87-W99 HydrophobicContact CG-CZ3 4.07Å; Y87-G100 WeakPolarHBondContact CD1-O 3.32Å
88	C	95.4	Very high	83.6	Confident	13 Å²	13	55.9 Å²	55.9	9%	0.088	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	149.4	156.1	60.4	0	0	0	0	109.6	C14 H27 W28 G100	C14-C88 HydrophobicContact CB-CB 3.4Å; C14-C88 VanDerWaalsContact CB-CB 3.4Å; C14-C88 WeakPolarHBondContact CB-SG 3.22Å; C14-C88 WeakPolarHBondContact SG-CB 3.49Å; C14-C88 CovalentContact SG-SG 2.02Å; C14-C88 PolarHBondContact SG-SG 2.85Å; H27-C88 CarbonylContact O-C 3.55Å; H27-C88 VanDerWaalsContact O-CA 3.23Å; H27-C88 WeakPolarHBondContact O-CA 3.43Å; W28-C88 HydrophobicContact CD2-CB 4.36Å; W28-C88 HydrophobicContact CE3-CB 4.22Å; W28-C88 HydrophobicContact CH2-CB 4.18Å; W28-C88 HydrophobicContact CZ2-CB 4.3Å; W28-C88 HydrophobicContact CZ3-CB 4.14Å; C88-G100 PolarHBondContact O-N 2.83Å
89	A	92.8	Very high	83.4	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.008	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	145.7	176.4	0	0	0	0	0	111.1	H27 F91 V96 Y98 W99	H27-A89 PolarHBondContact N-O 2.85Å; H27-A89 PolarHBondContact O-N 2.83Å; A89-F91 HydrophobicContact CB-CD2 4.18Å; A89-F91 HydrophobicContact CB-CE2 3.78Å; A89-V96 HydrophobicContact CB-CG1 3.93Å; A89-Y98 CarbonylContact C-O 3.57Å; A89-Y98 VanDerWaalsContact CA-O 3.28Å; A89-Y98 WeakPolarHBondContact CA-O 3.08Å; A89-W99 HydrophobicContact CB-CD2 4.04Å; A89-W99 HydrophobicContact CB-CE3 4.18Å; A89-W99 HydrophobicContact CB-CG 4.42Å
90	R	89.3	Confident	83.3	Confident	30 Å²	30	59.2 Å²	59.2	11%	0.113	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	125.8	173.9	-170.9	-176.1	79.7	177.6	6.5	109.7	F19 Y24 M26 A97 Y98	F19-R90 VanDerWaalsContact CD1-NH1 3.3Å; F19-R90 HydrophobicContact CE2-CG 4.32Å; F19-R90 HydrophobicContact CZ-CG 4.32Å; Y24-R90 HydrophobicContact CD1-CG 3.98Å; Y24-R90 HydrophobicContact CD2-CG 4.44Å; Y24-R90 HydrophobicContact CG-CG 3.76Å; M26-R90 HydrophobicContact SD-CB 4.45Å; M26-R90 HydrophobicContact SD-CG 4.47Å; R90-A97 PolarHBondContact O-N 3.11Å; R90-A97 VanDerWaalsContact O-N 3.08Å; R90-Y98 PolarHBondContact N-O 2.78Å; R90-Y98 VanDerWaalsContact NH2-CD2 3.3Å
91	F	75.3	Confident	83.3	Confident	46 Å²	46	64.1 Å²	64.1	20%	0.202	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.4	174.4	-78.7	-103.6	0	0	0	110.4	Y25 H27 A89 V96	Y25-F91 PolarHBondContact O-N 3.15Å; H27-F91 HydrophobicContact CB-CD2 3.85Å; H27-F91 HydrophobicContact CB-CE2 3.99Å; H27-F91 AromaticContact CD2-CD2 3.43Å; H27-F91 VanDerWaalsContact CD2-CD2 3.43Å; H27-F91 WeakPolarHBondContact CD2-CD2 3.32Å; H27-F91 AromaticContact CD2-CG 3.84Å; H27-F91 AromaticContact CG-CD2 3.48Å; H27-F91 VanDerWaalsContact CG-CD2 3.48Å; H27-F91 AromaticContact CG-CE2 3.95Å; H27-F91 AromaticContact ND1-CD2 3.98Å; H27-F91 AromaticContact NE2-CD2 3.95Å; H27-F91 AromaticContact NE2-CG 3.91Å; A89-F91 HydrophobicContact CB-CD2 4.18Å; A89-F91 HydrophobicContact CB-CE2 3.78Å; F91-V96 HydrophobicContact CD1-CG2 4.43Å; F91-V96 HydrophobicContact CD2-CG1 4.09Å; F91-V96 HydrophobicContact CE1-CB 3.93Å; F91-V96 HydrophobicContact CE1-CG1 4.06Å; F91-V96 HydrophobicContact CE1-CG2 3.43Å; F91-V96 VanDerWaalsContact CE1-CG2 3.43Å; F91-V96 HydrophobicContact CE2-CB 4.25Å; F91-V96 HydrophobicContact CE2-CG1 3.46Å; F91-V96 VanDerWaalsContact CE2-CG1 3.46Å; F91-V96 HydrophobicContact CE2-CG2 4.23Å; F91-V96 HydrophobicContact CZ-CB 3.76Å; F91-V96 HydrophobicContact CZ-CG1 3.45Å; F91-V96 VanDerWaalsContact CZ-CG1 3.45Å; F91-V96 HydrophobicContact CZ-CG2 3.3Å
92	I	64.6	Low	83.4	Confident	85 Å²	85	59.6 Å²	59.6	44%	0.436	32%	0.322	S	S	.	.	S	Bend	trans	-100.3	-36.4	-179.8	-43.3	-178.4	0	0	0	110	Y24 A97	Y24-I92 HydrophobicContact CD1-CB 4.43Å; Y24-I92 HydrophobicContact CD1-CD1 4.31Å; Y24-I92 HydrophobicContact CD1-CG1 3.75Å; Y24-I92 HydrophobicContact CD1-CG2 4.34Å; Y24-I92 HydrophobicContact CE1-CB 4.4Å; Y24-I92 HydrophobicContact CE1-CD1 3.7Å; Y24-I92 HydrophobicContact CE1-CG1 3.64Å; Y24-I92 HydrophobicContact CE1-CG2 4.06Å; I92-A97 HydrophobicContact CD1-CB 3.96Å; I92-A97 HydrophobicContact CG1-CB 4.11Å
93	T	61.9	Low	83.6	Confident	123 Å²	123	61.5 Å²	61.5	76%	0.755	33%	0.333	S	S	*	.	S	Bend	trans	-165.7	-67.9	175	45.8	0	0	0	0	112.2
94	T	53.9	Low	83.6	Confident	130 Å²	130	62.6 Å²	62.6	80%	0.798	34%	0.337	S	S	*	.	S	Bend	trans	-128.2	-2	-175.1	50.8	0	0	0	0	114.3
95	V	57.3	Low	83.6	Confident	99 Å²	99	62.5 Å²	62.5	60%	0.6	34%	0.336	S	S	*	.	S	Bend	trans	-119.1	129.9	179.1	-174.8	0	0	0	0	108.8	A97	V95-A97 PolarHBondContact O-N 3.21Å
96	V	59.1	Low	83.6	Confident	54 Å²	54	62.9 Å²	62.9	33%	0.327	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	105.6	165.8	-155.4	0	0	0	0	106.9	A89 F91 W99	A89-V96 HydrophobicContact CB-CG1 3.93Å; F91-V96 HydrophobicContact CD1-CG2 4.43Å; F91-V96 HydrophobicContact CD2-CG1 4.09Å; F91-V96 HydrophobicContact CE1-CB 3.93Å; F91-V96 HydrophobicContact CE1-CG1 4.06Å; F91-V96 HydrophobicContact CE1-CG2 3.43Å; F91-V96 VanDerWaalsContact CE1-CG2 3.43Å; F91-V96 HydrophobicContact CE2-CB 4.25Å; F91-V96 HydrophobicContact CE2-CG1 3.46Å; F91-V96 VanDerWaalsContact CE2-CG1 3.46Å; F91-V96 HydrophobicContact CE2-CG2 4.23Å; F91-V96 HydrophobicContact CZ-CB 3.76Å; F91-V96 HydrophobicContact CZ-CG1 3.45Å; F91-V96 VanDerWaalsContact CZ-CG1 3.45Å; F91-V96 HydrophobicContact CZ-CG2 3.3Å; V96-W99 HydrophobicContact CG1-CD2 4.35Å; V96-W99 HydrophobicContact CG1-CG 4.4Å; V96-W99 HydrophobicContact CG1-CZ2 3.93Å; V96-W99 HydrophobicContact CG2-CZ2 4.34Å
97	A	69.4	Low	83.5	Confident	30 Å²	30	63.2 Å²	63.2	25%	0.248	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-43.3	-173	0	0	0	0	0	110.5	R90 I92 V95	R90-A97 PolarHBondContact O-N 3.11Å; R90-A97 VanDerWaalsContact O-N 3.08Å; I92-A97 HydrophobicContact CD1-CB 3.96Å; I92-A97 HydrophobicContact CG1-CB 4.11Å; V95-A97 PolarHBondContact O-N 3.21Å
98	Y	84.9	Confident	83.3	Confident	156 Å²	156	63.5 Å²	63.5	61%	0.612	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.2	140.4	-176.2	-65.2	-83.2	0	0	0	111.7	A89 R90	A89-Y98 CarbonylContact C-O 3.57Å; A89-Y98 VanDerWaalsContact CA-O 3.28Å; A89-Y98 WeakPolarHBondContact CA-O 3.08Å; R90-Y98 PolarHBondContact N-O 2.78Å; R90-Y98 VanDerWaalsContact NH2-CD2 3.3Å
99	W	90.7	Very high	82.6	Confident	104 Å²	104	69.3 Å²	69.3	39%	0.394	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	143.6	172.6	-69.1	77.3	0	0	0	109.9	V29 L37 Y87 A89 V96	V29-W99 HydrophobicContact CB-CH2 4.04Å; V29-W99 HydrophobicContact CB-CZ3 3.81Å; V29-W99 HydrophobicContact CG1-CH2 3.98Å; V29-W99 HydrophobicContact CG1-CZ3 4.04Å; V29-W99 HydrophobicContact CG2-CH2 3.84Å; V29-W99 HydrophobicContact CG2-CZ3 3.96Å; L37-W99 HydrophobicContact CD1-CH2 3.9Å; L37-W99 HydrophobicContact CD1-CZ2 4.31Å; L37-W99 HydrophobicContact CD2-CH2 4.33Å; L37-W99 HydrophobicContact CD2-CZ3 4.38Å; Y87-W99 HydrophobicContact CD1-CE3 4.22Å; Y87-W99 HydrophobicContact CD2-CE3 4.47Å; Y87-W99 HydrophobicContact CD2-CZ3 4.31Å; Y87-W99 AromaticContact CG-CE3 3.84Å; Y87-W99 HydrophobicContact CG-CE3 3.84Å; Y87-W99 HydrophobicContact CG-CZ3 4.07Å; A89-W99 HydrophobicContact CB-CD2 4.04Å; A89-W99 HydrophobicContact CB-CE3 4.18Å; A89-W99 HydrophobicContact CB-CG 4.42Å; V96-W99 HydrophobicContact CG1-CD2 4.35Å; V96-W99 HydrophobicContact CG1-CG 4.4Å; V96-W99 HydrophobicContact CG1-CZ2 3.93Å; V96-W99 HydrophobicContact CG2-CZ2 4.34Å
100	G	92.5	Very high	82.1	Confident	26 Å²	26	72.8 Å²	72.8	27%	0.268	42%	0.418	S	S	.	.			trans	-68.5	168.1	164.4	0	0	0	0	0	111.6	Y87 C88 G102	Y87-G100 WeakPolarHBondContact CD1-O 3.32Å; C88-G100 PolarHBondContact O-N 2.83Å; G100-G102 PolarHBondContact O-N 2.81Å; G100-G102 VanDerWaalsContact O-N 3.15Å
101	Q	93.4	Very high	81.7	Confident	190 Å²	190	75 Å²	75	89%	0.888	43%	0.434	S	S	*	.			trans	-64.3	-18.4	179.5	-66.8	-64.3	-41.4	0	0	113.7
102	G	94.7	Very high	82.1	Confident	27 Å²	27	76.6 Å²	76.6	28%	0.278	45%	0.447	S	S	.	.			trans	82.8	148	-176.7	0	0	0	0	0	112.9	Y86 G100	Y86-G102 CarbonylContact O-C 3.53Å; Y86-G102 VanDerWaalsContact O-CA 3.27Å; Y86-G102 WeakPolarHBondContact O-CA 3.26Å; G100-G102 PolarHBondContact O-N 2.81Å; G100-G102 VanDerWaalsContact O-N 3.15Å
103	T	96.8	Very high	83.1	Confident	43 Å²	43	76.1 Å²	76.1	26%	0.264	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	116.5	175.9	-60.7	0	0	0	0	109.1	L12 Y86 V105	L12-T103 HydrophobicContact CD2-CG2 3.69Å; Y86-T103 PolarHBondContact N-O 3.2Å; Y86-T103 PolarHBondContact O-N 2.8Å; T103-V105 PolarHBondContact O-N 2.65Å
104	L	96.7	Very high	84.4	Confident	75 Å²	75	73.2 Å²	73.2	39%	0.393	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	119.7	169.2	176.5	63.9	0	0	0	109.3	A1 E2 V85	A1-L104 CarbonylContact C-O 3.57Å; A1-L104 WeakPolarHBondContact CA-O 3.14Å; A1-L104 HydrophobicContact CB-CB 4.03Å; A1-L104 WeakPolarHBondContact CB-O 3.32Å; E2-L104 PolarHBondContact N-O 2.91Å; V85-L104 HydrophobicContact CG2-CB 4.42Å; V85-L104 HydrophobicContact CG2-CD1 4.13Å
105	V	96.6	Very high	86.4	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	127.7	167.1	179.2	0	0	0	0	107.2	E2 V4 V10 L12 L78 T83 A84 Y86 T103 V107	E2-V105 HydrophobicContact CB-CG2 4.5Å; E2-V105 CarbonylContact O-C 3.59Å; E2-V105 WeakPolarHBondContact O-CA 3.21Å; V4-V105 HydrophobicContact CG2-CG1 4.15Å; V10-V105 HydrophobicContact CG1-CG1 4.39Å; V10-V105 HydrophobicContact CG1-CG2 4.49Å; L12-V105 HydrophobicContact CD1-CG2 4.26Å; L12-V105 HydrophobicContact CD2-CG2 4.04Å; L78-V105 HydrophobicContact CD1-CG1 4.49Å; T83-V105 VanDerWaalsContact CA-O 3.28Å; T83-V105 WeakPolarHBondContact CA-O 3.44Å; A84-V105 PolarHBondContact N-O 3.38Å; A84-V105 VanDerWaalsContact N-O 3.1Å; A84-V105 PolarHBondContact O-N 3.06Å; Y86-V105 HydrophobicContact CD2-CB 3.92Å; Y86-V105 HydrophobicContact CD2-CG2 3.64Å; Y86-V105 HydrophobicContact CE2-CB 3.75Å; Y86-V105 HydrophobicContact CE2-CG2 3.92Å; T103-V105 PolarHBondContact O-N 2.65Å; V105-V107 HydrophobicContact CG1-CG2 4.45Å
106	T	96.4	Very high	88.5	Confident	43 Å²	43	67.3 Å²	67.3	26%	0.264	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.5	177.5	-56.3	0	0	0	0	109.3	E2 L3 V4 T83	E2-T106 PolarHBondContact O-N 3.47Å; L3-T106 WeakPolarHBondContact CA-O 3.39Å; L3-T106 HydrophobicContact CD1-CG2 3.76Å; V4-T106 PolarHBondContact N-O 3.31Å; T83-T106 HydrophobicContact CG2-CG2 4.34Å
107	V	95.1	Very high	90.8	Very high	8 Å²	8	68.3 Å²	68.3	5%	0.048	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	105.6	178.2	-169.8	0	0	0	0	108.6	V4 P6 L78 T79 D82 T83 V105	V4-V107 HydrophobicContact CG2-CB 4.41Å; V4-V107 HydrophobicContact CG2-CG1 4.5Å; V4-V107 HydrophobicContact CG2-CG2 3.84Å; V4-V107 WeakPolarHBondContact O-CA 3.26Å; P6-V107 HydrophobicContact CB-CG1 4.46Å; P6-V107 HydrophobicContact CG-CG1 4.21Å; L78-V107 HydrophobicContact CB-CG1 4.28Å; L78-V107 HydrophobicContact CB-CG2 3.98Å; L78-V107 HydrophobicContact CD1-CG2 4.41Å; T79-V107 WeakPolarHBondContact O-CB 3.35Å; T79-V107 WeakPolarHBondContact O-CG2 3.39Å; D82-V107 HydrophobicContact CB-CG2 4.15Å; T83-V107 PolarHBondContact OG1-N 2.63Å; V105-V107 HydrophobicContact CG1-CG2 4.45Å
108	S	92.4	Very high	92.6	Very high	51 Å²	51	71.5 Å²	71.5	36%	0.357	41%	0.407	S	S	.	.			trans	-137.6	149.4	-179.4	68.6	0	0	0	0	111.5	L3 V4 P6	L3-S108 WeakPolarHBondContact CD1-OG 3.44Å; V4-S108 PolarHBondContact O-N 2.92Å; V4-S108 VanDerWaalsContact O-N 3.09Å; P6-S108 WeakPolarHBondContact CD-O 3.02Å
109	A	80.6	Confident	93.3	Very high	135 Å²	135	63.8 Å²	63.8	100%	1.116	39%	0.388	S	S	*	.			trans	-69	0	175.3	0	0	0	0	0	112

Retrieved 109 of 109 residues in 73.5 ms (Link to these results)

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