A0A3Q0KER3_SCHMA Loading...

Cadherin domain-containing protein

Required to protect lysosomal transporter MFSD1 from lysosomal proteolysis and for MFSD1 lysosomal localization.

AlphaFold DB , UniProt , Accession A0A3Q0KER3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 455 aa.

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(Predicted Aligned Error values between residue pairs)

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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	M	55	Low	62.8	Low	207 Å²	207	113 Å²	113	100%	1.02	59%	0.591	S	S	*	*				0	-46.6	0	-83.2	-174	168.3	0	0	113.2	N3 F4 I5	M1-N3 PolarHBondContact O-N 3.16Å; M1-F4 PolarHBondContact O-N 3.01Å; M1-F4 VanDerWaalsContact O-N 3.07Å; M1-I5 PolarHBondContact O-N 3.05Å
2	S	67.9	Low	62	Low	85 Å²	85	107.8 Å²	107.8	59%	0.594	58%	0.577	S	S	*	*	H	α-helix	trans	-53.4	-45.8	-178.8	-164.4	0	0	0	0	114.7	F4 I5 I6	S2-F4 VanDerWaalsContact C-N 3.28Å; S2-F4 PolarHBondContact O-N 2.8Å; S2-I5 PolarHBondContact O-N 3.12Å; S2-I6 WeakPolarHBondContact O-CG1 3.26Å; S2-I6 PolarHBondContact O-N 3.2Å
3	N	64.4	Low	60.9	Low	131 Å²	131	111.1 Å²	111.1	70%	0.701	58%	0.583	S	S	*	*	H	α-helix	trans	-67.8	-27.6	-180	-67.8	-3.4	0	0	0	113.2	M1 V7	M1-N3 PolarHBondContact O-N 3.16Å; N3-V7 VanDerWaalsContact O-CG2 3.27Å; N3-V7 WeakPolarHBondContact O-CG2 3.39Å; N3-V7 PolarHBondContact O-N 3.32Å; N3-V7 VanDerWaalsContact O-N 3.14Å
4	F	62.3	Low	60.1	Low	154 Å²	154	109.3 Å²	109.3	68%	0.675	58%	0.579	S	S	*	*	H	α-helix	trans	-75	-38.7	-179.7	-150.4	-96.1	0	0	0	111.3	M1 S2 V7 I8	M1-F4 PolarHBondContact O-N 3.01Å; M1-F4 VanDerWaalsContact O-N 3.07Å; S2-F4 VanDerWaalsContact C-N 3.28Å; S2-F4 PolarHBondContact O-N 2.8Å; F4-V7 PolarHBondContact O-N 3.21Å; F4-I8 HydrophobicContact CD1-CD1 3.64Å; F4-I8 HydrophobicContact CD1-CG1 4.34Å; F4-I8 HydrophobicContact CE1-CD1 3.79Å; F4-I8 HydrophobicContact CE1-CG1 4.44Å; F4-I8 WeakPolarHBondContact O-CG1 3.34Å; F4-I8 PolarHBondContact O-N 3.46Å
5	I	68.1	Low	59.5	Low	106 Å²	106	114.9 Å²	114.9	54%	0.544	59%	0.591	S	S	.	*	H	α-helix	trans	-65.9	-41.9	175.1	-63.7	173.5	0	0	0	110.4	M1 S2 V7 I8 C9	M1-I5 PolarHBondContact O-N 3.05Å; S2-I5 PolarHBondContact O-N 3.12Å; I5-V7 PolarHBondContact O-N 3.1Å; I5-I8 PolarHBondContact O-N 3.18Å; I5-C9 WeakPolarHBondContact O-CB 3.25Å; I5-C9 PolarHBondContact O-N 3.48Å; I5-C9 PolarHBondContact O-SG 2.95Å; I5-C9 VanDerWaalsContact O-SG 3.34Å
6	I	69.7	Low	58.6	Low	87 Å²	87	115.1 Å²	115.1	45%	0.446	60%	0.599	S	S	.	*	H	α-helix	trans	-62	-43.7	177.4	-66.9	166.9	0	0	0	110.9	S2 C9 I10	S2-I6 WeakPolarHBondContact O-CG1 3.26Å; S2-I6 PolarHBondContact O-N 3.2Å; I6-C9 PolarHBondContact O-N 3.29Å; I6-I10 HydrophobicContact CG2-CD1 3.69Å; I6-I10 HydrophobicContact CG2-CG1 4.33Å; I6-I10 WeakPolarHBondContact O-CB 3.43Å; I6-I10 VanDerWaalsContact O-CG1 3.24Å; I6-I10 WeakPolarHBondContact O-CG1 3.36Å; I6-I10 PolarHBondContact O-N 3.12Å
7	V	67.7	Low	57.7	Low	73 Å²	73	113.9 Å²	113.9	44%	0.442	60%	0.597	S	S	.	*	H	α-helix	trans	-63.3	-44.3	177.1	172.2	0	0	0	0	111.1	N3 F4 I5 C9 I10 F11	N3-V7 VanDerWaalsContact O-CG2 3.27Å; N3-V7 WeakPolarHBondContact O-CG2 3.39Å; N3-V7 PolarHBondContact O-N 3.32Å; N3-V7 VanDerWaalsContact O-N 3.14Å; F4-V7 PolarHBondContact O-N 3.21Å; I5-V7 PolarHBondContact O-N 3.1Å; V7-C9 PolarHBondContact O-N 3Å; V7-I10 PolarHBondContact O-N 2.78Å; V7-F11 HydrophobicContact CG1-CD2 3.64Å; V7-F11 HydrophobicContact CG1-CE2 3.76Å; V7-F11 WeakPolarHBondContact O-CD2 3.37Å; V7-F11 PolarHBondContact O-N 3.36Å
8	I	65	Low	57.5	Low	96 Å²	96	114.9 Å²	114.9	49%	0.492	60%	0.599	S	S	.	*	H	α-helix	trans	-62.5	-42.5	175.8	-68.1	168.5	0	0	0	111.2	F4 I5 F11 A12	F4-I8 HydrophobicContact CD1-CD1 3.64Å; F4-I8 HydrophobicContact CD1-CG1 4.34Å; F4-I8 HydrophobicContact CE1-CD1 3.79Å; F4-I8 HydrophobicContact CE1-CG1 4.44Å; F4-I8 WeakPolarHBondContact O-CG1 3.34Å; F4-I8 PolarHBondContact O-N 3.46Å; I5-I8 PolarHBondContact O-N 3.18Å; I8-F11 PolarHBondContact O-N 3.08Å; I8-A12 WeakPolarHBondContact O-CB 3.46Å; I8-A12 PolarHBondContact O-N 2.75Å
9	C	58.8	Low	57.4	Low	75 Å²	75	110.9 Å²	110.9	51%	0.507	59%	0.588	S	S	.	*	H	α-helix	trans	-63.9	-40.8	176.4	-73.7	0	0	0	0	111.5	I5 I6 V7 F13	I5-C9 WeakPolarHBondContact O-CB 3.25Å; I5-C9 PolarHBondContact O-N 3.48Å; I5-C9 PolarHBondContact O-SG 2.95Å; I5-C9 VanDerWaalsContact O-SG 3.34Å; I6-C9 PolarHBondContact O-N 3.29Å; V7-C9 PolarHBondContact O-N 3Å; C9-F13 WeakPolarHBondContact O-CB 3.44Å; C9-F13 PolarHBondContact O-N 3.25Å
10	I	59	Low	58.3	Low	100 Å²	100	111.1 Å²	111.1	51%	0.513	60%	0.598	S	S	.	*	H	α-helix	trans	-63.9	-47.5	175.3	-68.2	166	0	0	0	109.9	I6 V7 F13 T14	I6-I10 HydrophobicContact CG2-CD1 3.69Å; I6-I10 HydrophobicContact CG2-CG1 4.33Å; I6-I10 WeakPolarHBondContact O-CB 3.43Å; I6-I10 VanDerWaalsContact O-CG1 3.24Å; I6-I10 WeakPolarHBondContact O-CG1 3.36Å; I6-I10 PolarHBondContact O-N 3.12Å; V7-I10 PolarHBondContact O-N 2.78Å; I10-F13 PolarHBondContact O-N 3.45Å; I10-T14 HydrophobicContact CG2-CG2 4.41Å; I10-T14 WeakPolarHBondContact O-CG2 3.29Å; I10-T14 PolarHBondContact O-N 3Å; I10-T14 PolarHBondContact O-OG1 2.91Å; I10-T14 VanDerWaalsContact O-OG1 3.1Å
11	F	52.6	Low	59.7	Low	129 Å²	129	107.9 Å²	107.9	57%	0.566	58%	0.578	S	S	*	*	H	α-helix	trans	-62.4	-45.1	177.8	-90.7	-77.3	0	0	0	112.4	V7 I8 F13 T14 Y15	V7-F11 HydrophobicContact CG1-CD2 3.64Å; V7-F11 HydrophobicContact CG1-CE2 3.76Å; V7-F11 WeakPolarHBondContact O-CD2 3.37Å; V7-F11 PolarHBondContact O-N 3.36Å; I8-F11 PolarHBondContact O-N 3.08Å; F11-F13 VanDerWaalsContact C-N 3.34Å; F11-F13 PolarHBondContact O-N 3.26Å; F11-T14 WeakPolarHBondContact CA-OG1 3.3Å; F11-T14 PolarHBondContact O-N 2.99Å; F11-T14 PolarHBondContact O-OG1 3.43Å; F11-Y15 WeakPolarHBondContact O-CB 3.32Å; F11-Y15 WeakPolarHBondContact O-CD2 3.36Å; F11-Y15 PolarHBondContact O-N 3.42Å
12	A	53.7	Low	61.5	Low	51 Å²	51	103.2 Å²	103.2	42%	0.421	56%	0.557	S	S	.	*	H	α-helix	trans	-62.9	-41	175.8	0	0	0	0	0	111.2	I8 Y15 V16	I8-A12 WeakPolarHBondContact O-CB 3.46Å; I8-A12 PolarHBondContact O-N 2.75Å; A12-Y15 PolarHBondContact O-N 2.95Å; A12-V16 WeakPolarHBondContact O-CB 3.3Å; A12-V16 WeakPolarHBondContact O-CG2 3.48Å; A12-V16 PolarHBondContact O-N 3.35Å
13	F	47.3	Very low	62.8	Low	150 Å²	150	99.8 Å²	99.8	66%	0.658	53%	0.533	S	S	*	.	H	α-helix	trans	-70	-36.8	177.8	-154.5	-93.2	0	0	0	111.9	C9 I10 F11 Y15 V16 V17	C9-F13 WeakPolarHBondContact O-CB 3.44Å; C9-F13 PolarHBondContact O-N 3.25Å; I10-F13 PolarHBondContact O-N 3.45Å; F11-F13 VanDerWaalsContact C-N 3.34Å; F11-F13 PolarHBondContact O-N 3.26Å; F13-Y15 VanDerWaalsContact C-N 3.31Å; F13-Y15 PolarHBondContact O-N 3.28Å; F13-V16 PolarHBondContact O-N 2.94Å; F13-V17 HydrophobicContact CD1-CG2 4.06Å; F13-V17 HydrophobicContact CE1-CG2 3.89Å; F13-V17 HydrophobicContact CZ-CG2 4.35Å; F13-V17 WeakPolarHBondContact O-CG2 3.35Å; F13-V17 PolarHBondContact O-N 3.44Å
14	T	50	Low	64.1	Low	86 Å²	86	96 Å²	96	53%	0.528	51%	0.514	S	S	.	.	H	α-helix	trans	-66.2	-33.7	172.2	52.2	0	0	0	0	112.2	I10 F11	I10-T14 HydrophobicContact CG2-CG2 4.41Å; I10-T14 WeakPolarHBondContact O-CG2 3.29Å; I10-T14 PolarHBondContact O-N 3Å; I10-T14 PolarHBondContact O-OG1 2.91Å; I10-T14 VanDerWaalsContact O-OG1 3.1Å; F11-T14 WeakPolarHBondContact CA-OG1 3.3Å; F11-T14 PolarHBondContact O-N 2.99Å; F11-T14 PolarHBondContact O-OG1 3.43Å
15	Y	50.2	Low	65.6	Low	194 Å²	194	89.3 Å²	89.3	76%	0.761	49%	0.485	S	S	*	.	H	α-helix	trans	-74.4	-29.2	175.8	-98.9	-82.7	0	0	0	113.3	F11 A12 F13	F11-Y15 WeakPolarHBondContact O-CB 3.32Å; F11-Y15 WeakPolarHBondContact O-CD2 3.36Å; F11-Y15 PolarHBondContact O-N 3.42Å; A12-Y15 PolarHBondContact O-N 2.95Å; F13-Y15 VanDerWaalsContact C-N 3.31Å; F13-Y15 PolarHBondContact O-N 3.28Å
16	V	45.8	Very low	66.8	Low	117 Å²	117	87.9 Å²	87.9	71%	0.709	48%	0.479	S	S	*	.	H	α-helix	trans	-84.1	-15.1	-175.4	171.3	0	0	0	0	113.1	A12 F13	A12-V16 WeakPolarHBondContact O-CB 3.3Å; A12-V16 WeakPolarHBondContact O-CG2 3.48Å; A12-V16 PolarHBondContact O-N 3.35Å; F13-V16 PolarHBondContact O-N 2.94Å
17	V	44	Very low	67.9	Low	95 Å²	95	86.2 Å²	86.2	58%	0.576	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	10	-173.5	-170.9	0	0	0	0	114	F13 G19	F13-V17 HydrophobicContact CD1-CG2 4.06Å; F13-V17 HydrophobicContact CE1-CG2 3.89Å; F13-V17 HydrophobicContact CZ-CG2 4.35Å; F13-V17 WeakPolarHBondContact O-CG2 3.35Å; F13-V17 PolarHBondContact O-N 3.44Å; V17-G19 PolarHBondContact O-N 2.93Å
18	E	52.7	Low	69.1	Low	133 Å²	133	83.2 Å²	83.2	62%	0.621	45%	0.451	S	S	*	.	S	Bend	trans	-70.9	84.4	153.5	-86.2	-166.9	159.5	0	0	107.2	S20 K201	E18-S20 PolarHBondContact O-N 3.28Å; E18-K201 IonicContact OE1-NZ 3.74Å
19	G	57.1	Low	70.5	Confident	39 Å²	39	79.2 Å²	79.2	40%	0.402	43%	0.431	S	S	.	.			trans	-49.3	119.5	178.1	0	0	0	0	0	109.2	V17 W21	V17-G19 PolarHBondContact O-N 2.93Å; G19-W21 PolarHBondContact O-N 3.5Å
20	S	75.3	Confident	72.1	Confident	113 Å²	113	82.2 Å²	82.2	79%	0.79	44%	0.442	S	S	*	.			trans	-58.1	114.8	-175.2	56.4	0	0	0	0	109.7	E18	E18-S20 PolarHBondContact O-N 3.28Å
21	W	88	Confident	73.7	Confident	45 Å²	45	78.9 Å²	78.9	17%	0.17	43%	0.427	C	S	.	.			trans	-75.9	124.5	175.9	-75.1	78.5	0	0	0	109.5	G19 V23 G47 R48 N49 V54 P202 W204	G19-W21 PolarHBondContact O-N 3.5Å; W21-V23 HydrophobicContact CB-CG2 4.49Å; W21-G47 WeakPolarHBondContact CZ3-O 3.43Å; W21-R48 WeakPolarHBondContact CA-O 3.31Å; W21-N49 HydrophobicContact CD2-CB 4.26Å; W21-N49 HydrophobicContact CH2-CB 4.36Å; W21-N49 HydrophobicContact CZ2-CB 4.06Å; W21-N49 WeakPolarHBondContact CZ2-ND2 3.26Å; W21-V54 HydrophobicContact CH2-CG2 4.02Å; W21-V54 HydrophobicContact CZ3-CB 4.32Å; W21-V54 HydrophobicContact CZ3-CG2 3.83Å; W21-P202 HydrophobicContact CB-CB 4.18Å; W21-P202 HydrophobicContact CB-CG 4.24Å; W21-W204 AromaticContact CD2-CD1 3.85Å; W21-W204 AromaticContact CD2-NE1 3.23Å; W21-W204 AromaticContact CE2-CD1 3.95Å; W21-W204 AromaticContact CE2-CE2 3.72Å; W21-W204 AromaticContact CE2-NE1 2.97Å; W21-W204 AromaticContact CE3-CD1 3.99Å; W21-W204 AromaticContact CE3-NE1 3.4Å; W21-W204 AromaticContact CH2-CE2 3.63Å; W21-W204 AromaticContact CH2-CZ2 3.53Å; W21-W204 HydrophobicContact CH2-CZ2 3.53Å; W21-W204 AromaticContact CH2-NE1 3.18Å; W21-W204 AromaticContact CZ2-CE2 3.37Å; W21-W204 AromaticContact CZ2-CZ2 3.23Å; W21-W204 HydrophobicContact CZ2-CZ2 3.23Å; W21-W204 AromaticContact CZ2-NE1 2.99Å; W21-W204 HydrophobicContact CZ3-CZ2 4.5Å; W21-W204 AromaticContact CZ3-NE1 3.36Å; W21-W204 AromaticContact NE1-NE1 3.59Å
22	N	92.2	Very high	75.2	Confident	109 Å²	109	78.5 Å²	78.5	58%	0.583	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	121.9	168.2	-174.9	10.8	0	0	0	108.7	G47 R48	N22-G47 CarbonylContact O-C 3.6Å; N22-G47 WeakPolarHBondContact O-CA 3.44Å; N22-R48 PolarHBondContact N-O 3.23Å; N22-R48 PolarHBondContact O-N 3.49Å
23	V	94.1	Very high	76.6	Confident	13 Å²	13	77.6 Å²	77.6	8%	0.079	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	120.8	-176.1	-169.5	0	0	0	0	109.5	W21 I45 N46 F156 N187 P202	W21-V23 HydrophobicContact CB-CG2 4.49Å; V23-I45 HydrophobicContact CG1-CG2 3.5Å; V23-N46 WeakPolarHBondContact CA-O 3.42Å; V23-F156 HydrophobicContact CB-CE2 4.49Å; V23-F156 HydrophobicContact CB-CZ 4.11Å; V23-F156 HydrophobicContact CG1-CE2 4.42Å; V23-F156 HydrophobicContact CG1-CZ 3.73Å; V23-N187 HydrophobicContact CB-CB 4.3Å; V23-N187 HydrophobicContact CG2-CB 4.47Å; V23-P202 HydrophobicContact CG2-CB 4.26Å
24	T	93.1	Very high	78.1	Confident	51 Å²	51	75.8 Å²	75.8	31%	0.313	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	151.8	178.7	67.5	0	0	0	0	111.1	I45 N46	T24-I45 WeakPolarHBondContact O-CA 3.29Å; T24-N46 PolarHBondContact N-O 3.37Å; T24-N46 PolarHBondContact O-N 3.47Å
25	I	93.6	Very high	79.2	Confident	14 Å²	14	80.7 Å²	80.7	7%	0.072	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132.5	-177.3	-51.2	-177.3	0	0	0	109.2	I43 Y44 I45 L154 F156 F161	I25-I43 HydrophobicContact CG2-CG2 3.97Å; I25-Y44 CarbonylContact C-O 3.57Å; I25-Y44 WeakPolarHBondContact CA-O 3.3Å; I25-I45 HydrophobicContact CG1-CG1 4.1Å; I25-I45 HydrophobicContact CG1-CG2 4.42Å; I25-I45 HydrophobicContact CG2-CG1 4.27Å; I25-L154 HydrophobicContact CG2-CB 4.37Å; I25-L154 HydrophobicContact CG2-CD2 4.13Å; I25-F156 HydrophobicContact CD1-CD2 4.35Å; I25-F156 HydrophobicContact CD1-CE1 4.13Å; I25-F156 HydrophobicContact CD1-CE2 3.72Å; I25-F156 HydrophobicContact CD1-CZ 3.59Å; I25-F156 HydrophobicContact CG1-CE2 3.92Å; I25-F156 HydrophobicContact CG1-CZ 3.96Å; I25-F161 HydrophobicContact CD1-CB 3.41Å; I25-F161 VanDerWaalsContact CD1-CB 3.41Å; I25-F161 HydrophobicContact CD1-CD1 3.56Å; I25-F161 HydrophobicContact CD1-CD2 3.54Å; I25-F161 HydrophobicContact CD1-CE1 4.17Å; I25-F161 HydrophobicContact CD1-CE2 4.16Å; I25-F161 HydrophobicContact CD1-CG 3.19Å; I25-F161 HydrophobicContact CD1-CZ 4.44Å; I25-F161 HydrophobicContact CG2-CE1 4.24Å; I25-F161 HydrophobicContact CG2-CE2 4.41Å; I25-F161 HydrophobicContact CG2-CZ 4.13Å
26	N	93.1	Very high	80.7	Confident	75 Å²	75	75.9 Å²	75.9	40%	0.401	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	143.6	175.1	-68.3	-41.5	0	0	0	109.9	P29 Y44	N26-P29 HydrophobicContact CB-CB 4.37Å; N26-Y44 HydrophobicContact CB-CD1 4.17Å; N26-Y44 PolarHBondContact N-O 3.07Å; N26-Y44 PolarHBondContact O-N 3.31Å
27	H	93	Very high	82.6	Confident	52 Å²	52	70.9 Å²	70.9	24%	0.241	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	130.5	171.3	175.6	-133.5	0	0	0	109.3	D41 I43 R146 L154	H27-D41 IonicContact NE2-OD1 3.66Å; H27-D41 PolarHBondContact NE2-OD1 3.28Å; H27-I43 HydrophobicContact CB-CD1 4.27Å; H27-R146 PolarHBondContact CD2-NH2 3Å; H27-R146 PolarHBondContact CE1-NH2 3.03Å; H27-R146 PolarHBondContact NE2-NH2 3.48Å; H27-L154 HydrophobicContact CB-CD1 3.66Å; H27-L154 HydrophobicContact CB-CD2 4.19Å
28	N	93.5	Very high	84.5	Confident	11 Å²	11	71.8 Å²	71.8	6%	0.059	40%	0.395	C	S	.	.	S	Bend	trans	45.3	63.3	-178.2	-63.8	-31.4	0	0	0	112.4	N30 C31 C37 V42 W85	N28-N30 PolarHBondContact O-N 3.49Å; N28-C31 HydrophobicContact CB-CB 3.84Å; N28-C31 VanDerWaalsContact O-CB 3.29Å; N28-C31 WeakPolarHBondContact O-CB 3.5Å; N28-C31 PolarHBondContact O-N 3.44Å; N28-C37 HydrophobicContact CB-CB 4.39Å; N28-C37 PolarHBondContact ND2-O 3.49Å; N28-V42 PolarHBondContact N-O 3.05Å; N28-V42 PolarHBondContact OD1-N 2.95Å; N28-W85 HydrophobicContact CB-CH2 4.06Å; N28-W85 HydrophobicContact CB-CZ2 4.37Å
29	P	93.9	Very high	86.2	Confident	11 Å²	11	68 Å²	68	7%	0.071	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	124.9	-168.4	25.6	-36.5	0	0	0	111.9	N26 C31 Y44 I83 W85	N26-P29 HydrophobicContact CB-CB 4.37Å; P29-C31 PolarHBondContact O-N 3.33Å; P29-Y44 HydrophobicContact CB-CD1 3.77Å; P29-Y44 HydrophobicContact CB-CG 4.4Å; P29-Y44 HydrophobicContact CG-CD1 3.87Å; P29-Y44 HydrophobicContact CG-CG 4Å; P29-I83 HydrophobicContact CG-CD1 4.08Å; P29-W85 HydrophobicContact CG-CZ2 4.28Å; P29-W85 WeakPolarHBondContact O-CZ2 3.31Å; P29-W85 PolarHBondContact O-NE1 2.92Å
30	N	91.3	Very high	87.9	Confident	139 Å²	139	66.2 Å²	66.2	74%	0.743	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	23.9	-179.8	-53.6	-38.5	0	0	0	114.6	N28 N32	N28-N30 PolarHBondContact O-N 3.49Å; N30-N32 PolarHBondContact O-N 3.33Å
31	C	92.3	Very high	88.7	Confident	29 Å²	29	61.6 Å²	61.6	20%	0.196	32%	0.324	C	S	.	.			trans	-72.1	121.6	174.6	-171.3	0	0	0	0	110.6	N28 P29 C37 W85	N28-C31 HydrophobicContact CB-CB 3.84Å; N28-C31 VanDerWaalsContact O-CB 3.29Å; N28-C31 WeakPolarHBondContact O-CB 3.5Å; N28-C31 PolarHBondContact O-N 3.44Å; P29-C31 PolarHBondContact O-N 3.33Å; C31-C37 HydrophobicContact CB-CB 3.87Å; C31-C37 WeakPolarHBondContact CB-SG 3.19Å; C31-C37 VanDerWaalsContact SG-CA 3.54Å; C31-C37 WeakPolarHBondContact SG-CB 3.48Å; C31-C37 CovalentContact SG-SG 2.03Å; C31-C37 PolarHBondContact SG-SG 2.88Å; C31-W85 HydrophobicContact CB-CD2 3.75Å; C31-W85 HydrophobicContact CB-CE3 4.26Å; C31-W85 HydrophobicContact CB-CG 4.06Å; C31-W85 HydrophobicContact CB-CZ2 4.01Å
32	N	85.9	Confident	89	Confident	122 Å²	122	59.4 Å²	59.4	65%	0.652	32%	0.316	S	S	*	.			trans	-104.8	0.7	-179.1	62.3	-15	0	0	0	112.8	N30 S34	N30-N32 PolarHBondContact O-N 3.33Å; N32-S34 VanDerWaalsContact C-N 3.26Å; N32-S34 PolarHBondContact O-N 2.88Å
33	L	82.9	Confident	89.2	Confident	31 Å²	31	54.2 Å²	54.2	16%	0.162	29%	0.288	C	S	.	.			trans	-78.4	67.6	179.4	-71.5	178.9	0	0	0	111.9	K35 E36 C37 Y40 W85 D86	L33-K35 PolarHBondContact O-N 2.87Å; L33-E36 HydrophobicContact CB-CB 4.13Å; L33-E36 PolarHBondContact O-N 3.27Å; L33-C37 VanDerWaalsContact C-SG 3.58Å; L33-C37 PolarHBondContact N-SG 3.26Å; L33-C37 PolarHBondContact O-N 2.9Å; L33-C37 VanDerWaalsContact O-N 3.12Å; L33-C37 PolarHBondContact O-SG 2.96Å; L33-Y40 HydrophobicContact CD1-CE2 4.14Å; L33-W85 HydrophobicContact CD1-CB 3.78Å; L33-W85 HydrophobicContact CG-CB 4.17Å; L33-D86 WeakPolarHBondContact CD2-OD1 3.11Å; L33-D86 VanDerWaalsContact CG-OD1 3.23Å; L33-D86 WeakPolarHBondContact CG-OD1 3.33Å
34	S	77.6	Confident	89.3	Confident	113 Å²	113	53.9 Å²	53.9	79%	0.79	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	13.6	-94.9	174.1	62	0	0	0	0	116.1	N32	N32-S34 VanDerWaalsContact C-N 3.26Å; N32-S34 PolarHBondContact O-N 2.88Å
35	K	73.4	Confident	89.4	Confident	188 Å²	188	51.5 Å²	51.5	82%	0.817	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-8.1	-179.5	-67.4	-174.3	177.3	-178	0	114.7	L33	L33-K35 PolarHBondContact O-N 2.87Å
36	E	81.5	Confident	89.5	Confident	93 Å²	93	51.4 Å²	51.4	44%	0.435	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-16.1	-178.2	-61.9	-170	-161.5	0	0	112.8	L33 D38 K39	L33-E36 HydrophobicContact CB-CB 4.13Å; L33-E36 PolarHBondContact O-N 3.27Å; E36-D38 PolarHBondContact O-N 3.4Å; E36-K39 HydrophobicContact CB-CD 4.2Å; E36-K39 VanDerWaalsContact O-CD 3.32Å; E36-K39 WeakPolarHBondContact O-CD 3.36Å; E36-K39 WeakPolarHBondContact O-CG 3.47Å; E36-K39 PolarHBondContact O-N 2.88Å; E36-K39 IonicContact OE2-NZ 3.82Å; E36-K39 PolarHBondContact OE2-NZ 2.91Å
37	C	86	Confident	89.6	Confident	12 Å²	12	47.9 Å²	47.9	8%	0.081	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-56.2	-39	177.7	-64.1	0	0	0	0	112.3	N28 C31 L33 K39 Y40	N28-C37 HydrophobicContact CB-CB 4.39Å; N28-C37 PolarHBondContact ND2-O 3.49Å; C31-C37 HydrophobicContact CB-CB 3.87Å; C31-C37 WeakPolarHBondContact CB-SG 3.19Å; C31-C37 VanDerWaalsContact SG-CA 3.54Å; C31-C37 WeakPolarHBondContact SG-CB 3.48Å; C31-C37 CovalentContact SG-SG 2.03Å; C31-C37 PolarHBondContact SG-SG 2.88Å; L33-C37 VanDerWaalsContact C-SG 3.58Å; L33-C37 PolarHBondContact N-SG 3.26Å; L33-C37 PolarHBondContact O-N 2.9Å; L33-C37 VanDerWaalsContact O-N 3.12Å; L33-C37 PolarHBondContact O-SG 2.96Å; C37-K39 PolarHBondContact O-N 3.44Å; C37-K39 VanDerWaalsContact O-N 3.11Å; C37-Y40 PolarHBondContact O-N 3.37Å; C37-Y40 VanDerWaalsContact O-N 3.1Å
38	D	84.2	Confident	89.7	Confident	114 Å²	114	47.6 Å²	47.6	61%	0.61	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-62.7	-22.3	-175.7	-65.5	-22.2	0	0	0	113.5	E36 Y40	E36-D38 PolarHBondContact O-N 3.4Å; D38-Y40 PolarHBondContact O-N 3.48Å
39	K	88.1	Confident	89.6	Confident	54 Å²	54	49 Å²	49	24%	0.235	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-72.4	-16.2	178.9	85.2	-159.4	171.8	176.6	0	113.5	E36 C37 S61 N89	E36-K39 HydrophobicContact CB-CD 4.2Å; E36-K39 VanDerWaalsContact O-CD 3.32Å; E36-K39 WeakPolarHBondContact O-CD 3.36Å; E36-K39 WeakPolarHBondContact O-CG 3.47Å; E36-K39 PolarHBondContact O-N 2.88Å; E36-K39 IonicContact OE2-NZ 3.82Å; E36-K39 PolarHBondContact OE2-NZ 2.91Å; C37-K39 PolarHBondContact O-N 3.44Å; C37-K39 VanDerWaalsContact O-N 3.11Å; K39-S61 WeakPolarHBondContact O-CB 3.37Å; K39-S61 PolarHBondContact O-OG 2.94Å; K39-N89 PolarHBondContact NZ-OD1 3.49Å; K39-N89 VanDerWaalsContact NZ-OD1 3.16Å
40	Y	92.1	Very high	89.4	Confident	1 Å²	1	56.8 Å²	56.8	0%	0.004	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-34.9	-179.1	-58.1	-66.6	0	0	0	112.5	L33 C37 D38 V42 T59 S61 R63 F64 W85 L88 N89	L33-Y40 HydrophobicContact CD1-CE2 4.14Å; C37-Y40 PolarHBondContact O-N 3.37Å; C37-Y40 VanDerWaalsContact O-N 3.1Å; D38-Y40 PolarHBondContact O-N 3.48Å; Y40-V42 PolarHBondContact O-N 2.9Å; Y40-T59 PolarHBondContact O-OG1 3.15Å; Y40-S61 WeakPolarHBondContact O-CB 3.38Å; Y40-S61 PolarHBondContact O-OG 3.43Å; Y40-R63 HydrophobicContact CD1-CB 3.9Å; Y40-R63 HydrophobicContact CD1-CG 3.9Å; Y40-R63 HydrophobicContact CE1-CB 4.15Å; Y40-R63 HydrophobicContact CE1-CG 3.89Å; Y40-F64 HydrophobicContact CD1-CD2 4.44Å; Y40-F64 AromaticContact CD1-CE2 3.81Å; Y40-F64 HydrophobicContact CD1-CE2 3.81Å; Y40-W85 AromaticContact CD2-CE3 3.67Å; Y40-W85 HydrophobicContact CD2-CE3 3.67Å; Y40-W85 AromaticContact CD2-CZ3 3.77Å; Y40-W85 HydrophobicContact CD2-CZ3 3.77Å; Y40-W85 HydrophobicContact CE2-CE3 4.01Å; Y40-W85 HydrophobicContact CG-CE3 4.21Å; Y40-W85 AromaticContact CG-CZ3 3.94Å; Y40-W85 HydrophobicContact CG-CZ3 3.94Å; Y40-W85 PolarHBondContact OH-O 2.98Å; Y40-L88 HydrophobicContact CD1-CB 4.38Å; Y40-L88 HydrophobicContact CD1-CD1 3.9Å; Y40-L88 HydrophobicContact CD2-CD1 4.46Å; Y40-L88 HydrophobicContact CE1-CB 3.53Å; Y40-L88 HydrophobicContact CE1-CD1 3.77Å; Y40-L88 HydrophobicContact CE1-CG 4.3Å; Y40-L88 HydrophobicContact CE2-CD1 4.35Å; Y40-L88 HydrophobicContact CG-CD1 4.25Å; Y40-N89 PolarHBondContact OH-OD1 3.44Å; Y40-N89 VanDerWaalsContact OH-OD1 3.13Å
41	D	92.9	Very high	89.4	Confident	16 Å²	16	54.8 Å²	54.8	9%	0.086	29%	0.289	C	S	.	.			trans	43.5	57.8	178.9	-161.8	66.1	0	0	0	113.2	H27 T59 R146 Y165	H27-D41 IonicContact NE2-OD1 3.66Å; H27-D41 PolarHBondContact NE2-OD1 3.28Å; D41-T59 WeakPolarHBondContact O-CB 3.37Å; D41-T59 PolarHBondContact O-OG1 3.49Å; D41-R146 IonicContact OD1-CZ 3.85Å; D41-R146 IonicContact OD1-NE 3.4Å; D41-R146 PolarHBondContact OD1-NE 3.42Å; D41-R146 IonicContact OD1-NH2 2.98Å; D41-R146 PolarHBondContact OD1-NH2 3.09Å; D41-R146 WeakPolarHBondContact OD2-CD 3.48Å; D41-R146 IonicContact OD2-NE 2.84Å; D41-R146 PolarHBondContact OD2-NE 3.39Å; D41-Y165 PolarHBondContact O-OH 3.4Å; D41-Y165 WeakPolarHBondContact OD2-CE1 3.22Å; D41-Y165 VanDerWaalsContact OD2-CZ 3.25Å; D41-Y165 PolarHBondContact OD2-OH 2.91Å
42	V	95.4	Very high	89.5	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.283	C	S	.	.			trans	-96	114.3	-178.6	-179.2	0	0	0	0	109.2	N28 Y40 F57 W85 F340	N28-V42 PolarHBondContact N-O 3.05Å; N28-V42 PolarHBondContact OD1-N 2.95Å; Y40-V42 PolarHBondContact O-N 2.9Å; V42-F57 HydrophobicContact CG1-CB 4.44Å; V42-F57 HydrophobicContact CG1-CD1 4.03Å; V42-W85 HydrophobicContact CB-CH2 4.16Å; V42-W85 HydrophobicContact CG2-CH2 4.15Å; V42-W85 HydrophobicContact CG2-CZ3 4.31Å; V42-F340 HydrophobicContact CB-CE2 4.49Å; V42-F340 HydrophobicContact CG1-CE1 4.45Å; V42-F340 HydrophobicContact CG1-CE2 4Å; V42-F340 HydrophobicContact CG1-CZ 3.88Å; V42-F340 HydrophobicContact CG2-CD2 4.01Å; V42-F340 HydrophobicContact CG2-CE2 3.63Å; V42-F340 HydrophobicContact CG2-CZ 4.35Å
43	I	95.2	Very high	89.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	122.8	167.1	-57.6	-49.8	0	0	0	108.9	I25 H27 I45 F57 I58 L154 F161 I163	I25-I43 HydrophobicContact CG2-CG2 3.97Å; H27-I43 HydrophobicContact CB-CD1 4.27Å; I43-I45 HydrophobicContact CG2-CD1 4.13Å; I43-I45 HydrophobicContact CG2-CG1 4.1Å; I43-F57 CarbonylContact O-C 3.59Å; I43-F57 VanDerWaalsContact O-CA 3.31Å; I43-F57 WeakPolarHBondContact O-CA 3.33Å; I43-I58 HydrophobicContact CB-CB 4.4Å; I43-I58 PolarHBondContact N-O 3.41Å; I43-I58 PolarHBondContact O-N 2.7Å; I43-L154 HydrophobicContact CD1-CD2 4.4Å; I43-F161 HydrophobicContact CG2-CE1 3.99Å; I43-F161 HydrophobicContact CG2-CZ 4.4Å; I43-I163 HydrophobicContact CD1-CD1 3.9Å; I43-I163 HydrophobicContact CG1-CD1 3.26Å
44	Y	96.5	Very high	90.5	Very high	6 Å²	6	46.7 Å²	46.7	2%	0.024	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117.8	174.9	167.9	-128	0	0	0	109.7	I25 N26 P29 N46 H55 V56 F57 P81	I25-Y44 CarbonylContact C-O 3.57Å; I25-Y44 WeakPolarHBondContact CA-O 3.3Å; N26-Y44 HydrophobicContact CB-CD1 4.17Å; N26-Y44 PolarHBondContact N-O 3.07Å; N26-Y44 PolarHBondContact O-N 3.31Å; P29-Y44 HydrophobicContact CB-CD1 3.77Å; P29-Y44 HydrophobicContact CB-CG 4.4Å; P29-Y44 HydrophobicContact CG-CD1 3.87Å; P29-Y44 HydrophobicContact CG-CG 4Å; Y44-N46 HydrophobicContact CE1-CB 4.05Å; Y44-N46 HydrophobicContact CE2-CB 4.07Å; Y44-N46 WeakPolarHBondContact OH-CB 3.49Å; Y44-N46 VanDerWaalsContact OH-CG 3.26Å; Y44-N46 PolarHBondContact OH-OD1 2.97Å; Y44-H55 HydrophobicContact CE2-CB 3.88Å; Y44-H55 AromaticContact CE2-ND1 3.65Å; Y44-H55 AromaticContact CZ-ND1 3.65Å; Y44-H55 PolarHBondContact OH-CE1 3.4Å; Y44-H55 PolarHBondContact OH-ND1 3.28Å; Y44-V56 CarbonylContact C-O 3.12Å; Y44-V56 WeakPolarHBondContact CA-O 3.44Å; Y44-F57 AromaticContact CD2-CD1 3.89Å; Y44-F57 HydrophobicContact CD2-CD1 3.89Å; Y44-F57 AromaticContact CD2-CE1 3.38Å; Y44-F57 HydrophobicContact CD2-CE1 3.38Å; Y44-F57 HydrophobicContact CD2-CE2 4.29Å; Y44-F57 AromaticContact CD2-CZ 3.6Å; Y44-F57 HydrophobicContact CD2-CZ 3.6Å; Y44-F57 HydrophobicContact CE2-CE1 4.03Å; Y44-F57 HydrophobicContact CE2-CE2 4.44Å; Y44-F57 AromaticContact CE2-CZ 3.79Å; Y44-F57 HydrophobicContact CE2-CZ 3.79Å; Y44-F57 HydrophobicContact CG-CD1 4.32Å; Y44-F57 AromaticContact CG-CE1 3.86Å; Y44-F57 HydrophobicContact CG-CE1 3.86Å; Y44-F57 HydrophobicContact CG-CZ 4.46Å; Y44-P81 HydrophobicContact CD1-CG 4.29Å; Y44-P81 HydrophobicContact CD2-CG 4.45Å; Y44-P81 HydrophobicContact CE1-CG 3.78Å; Y44-P81 HydrophobicContact CE2-CG 3.98Å; Y44-P81 VanDerWaalsContact OH-CD 3.28Å; Y44-P81 WeakPolarHBondContact OH-CD 3.34Å
45	I	95.8	Very high	91.5	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.6	172.7	-55.4	134.7	0	0	0	108.5	V23 T24 I25 I43 V56 I58 I185	V23-I45 HydrophobicContact CG1-CG2 3.5Å; T24-I45 WeakPolarHBondContact O-CA 3.29Å; I25-I45 HydrophobicContact CG1-CG1 4.1Å; I25-I45 HydrophobicContact CG1-CG2 4.42Å; I25-I45 HydrophobicContact CG2-CG1 4.27Å; I43-I45 HydrophobicContact CG2-CD1 4.13Å; I43-I45 HydrophobicContact CG2-CG1 4.1Å; I45-V56 HydrophobicContact CB-CB 4.2Å; I45-V56 HydrophobicContact CD1-CG1 4.33Å; I45-V56 PolarHBondContact N-O 3.48Å; I45-V56 PolarHBondContact O-N 2.92Å; I45-I58 HydrophobicContact CD1-CD1 3.91Å; I45-I185 HydrophobicContact CB-CD1 4.45Å; I45-I185 HydrophobicContact CD1-CB 4.46Å; I45-I185 HydrophobicContact CD1-CD1 4.34Å; I45-I185 HydrophobicContact CD1-CG2 3.85Å; I45-I185 HydrophobicContact CG1-CG2 4.22Å; I45-I185 HydrophobicContact CG2-CD1 3.79Å; I45-I185 HydrophobicContact CG2-CG2 4.41Å
46	N	95.6	Very high	92.6	Very high	11 Å²	11	32.4 Å²	32.4	6%	0.059	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	110.4	-176.3	179.3	35.2	0	0	0	109	V23 T24 Y44 R48 V54	V23-N46 WeakPolarHBondContact CA-O 3.42Å; T24-N46 PolarHBondContact N-O 3.37Å; T24-N46 PolarHBondContact O-N 3.47Å; Y44-N46 HydrophobicContact CE1-CB 4.05Å; Y44-N46 HydrophobicContact CE2-CB 4.07Å; Y44-N46 WeakPolarHBondContact OH-CB 3.49Å; Y44-N46 VanDerWaalsContact OH-CG 3.26Å; Y44-N46 PolarHBondContact OH-OD1 2.97Å; N46-R48 PolarHBondContact ND2-NE 3.29Å; N46-R48 PolarHBondContact OD1-NE 3.41Å; N46-V54 WeakPolarHBondContact CA-O 3.25Å
47	G	95	Very high	93.4	Very high	1 Å²	1	28 Å²	28	1%	0.01	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	127	169.8	0	0	0	0	0	109.8	W21 N22 S53 V54	W21-G47 WeakPolarHBondContact CZ3-O 3.43Å; N22-G47 CarbonylContact O-C 3.6Å; N22-G47 WeakPolarHBondContact O-CA 3.44Å; G47-S53 CarbonylContact O-C 3.5Å; G47-S53 VanDerWaalsContact O-CA 3.3Å; G47-S53 WeakPolarHBondContact O-CA 3.32Å; G47-V54 PolarHBondContact N-O 2.66Å; G47-V54 PolarHBondContact O-N 2.9Å
48	R	93.9	Very high	94	Very high	46 Å²	46	27.5 Å²	27.5	17%	0.174	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143.2	178.2	-66.4	-175.7	171.8	-175.8	2.3	112.1	W21 N22 N46 A77 E78 A79 N80	W21-R48 WeakPolarHBondContact CA-O 3.31Å; N22-R48 PolarHBondContact N-O 3.23Å; N22-R48 PolarHBondContact O-N 3.49Å; N46-R48 PolarHBondContact ND2-NE 3.29Å; N46-R48 PolarHBondContact OD1-NE 3.41Å; R48-A77 WeakPolarHBondContact CD-O 3.26Å; R48-A77 PolarHBondContact NE-O 3.11Å; R48-E78 IonicContact NH1-OE2 3.37Å; R48-E78 PolarHBondContact NH1-OE2 3.26Å; R48-A79 PolarHBondContact NH2-O 2.72Å; R48-N80 VanDerWaalsContact NH2-CG 3.33Å; R48-N80 PolarHBondContact NH2-OD1 2.94Å
49	N	91.3	Very high	94.6	Very high	40 Å²	40	22.1 Å²	22.1	21%	0.214	12%	0.115	C	C	.	.			trans	-124.5	-167.2	162.3	74.5	12.2	0	0	0	109.4	W21 T51 S52 A77	W21-N49 HydrophobicContact CD2-CB 4.26Å; W21-N49 HydrophobicContact CH2-CB 4.36Å; W21-N49 HydrophobicContact CZ2-CB 4.06Å; W21-N49 WeakPolarHBondContact CZ2-ND2 3.26Å; N49-T51 PolarHBondContact O-N 2.9Å; N49-T51 PolarHBondContact OD1-N 3.38Å; N49-T51 PolarHBondContact OD1-OG1 3.43Å; N49-S52 PolarHBondContact N-O 2.84Å; N49-S52 VanDerWaalsContact N-O 3.08Å; N49-S52 PolarHBondContact OD1-N 2.89Å; N49-S52 PolarHBondContact OD1-O 3.38Å; N49-S52 PolarHBondContact OD1-OG 3.06Å; N49-A77 WeakPolarHBondContact O-CB 3.5Å
50	L	90.7	Very high	95	Very high	175 Å²	175	19.6 Å²	19.6	92%	0.916	11%	0.105	S	C	*	.	S	Bend	trans	-68.8	-17.5	-177.9	-63.6	175.4	0	0	0	114.6
51	T	91.7	Very high	95.1	Very high	98 Å²	98	19.8 Å²	19.8	60%	0.601	11%	0.106	S	C	*	.	S	Bend	trans	-121.6	-26.1	-168.9	55.6	0	0	0	0	114.1	N49 S75	N49-T51 PolarHBondContact O-N 2.9Å; N49-T51 PolarHBondContact OD1-N 3.38Å; N49-T51 PolarHBondContact OD1-OG1 3.43Å; T51-S75 CarbonylContact O-C 3.48Å
52	S	93.6	Very high	95	Very high	11 Å²	11	27.1 Å²	27.1	8%	0.077	14%	0.14	C	C	.	.			trans	-151.5	165.4	-170.6	57.6	0	0	0	0	111.8	N49 S74	N49-S52 PolarHBondContact N-O 2.84Å; N49-S52 VanDerWaalsContact N-O 3.08Å; N49-S52 PolarHBondContact OD1-N 2.89Å; N49-S52 PolarHBondContact OD1-O 3.38Å; N49-S52 PolarHBondContact OD1-OG 3.06Å; S52-S74 WeakPolarHBondContact CA-O 3.29Å; S52-S74 WeakPolarHBondContact CB-O 3.4Å
53	S	95.2	Very high	94.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	150.2	174	61.8	0	0	0	0	111.3	G47 H55 S74 S76	G47-S53 CarbonylContact O-C 3.5Å; G47-S53 VanDerWaalsContact O-CA 3.3Å; G47-S53 WeakPolarHBondContact O-CA 3.32Å; S53-H55 PolarHBondContact OG-CE1 2.88Å; S53-H55 PolarHBondContact OG-NE2 3.31Å; S53-S74 PolarHBondContact N-O 3.08Å; S53-S74 VanDerWaalsContact N-O 3.12Å; S53-S74 PolarHBondContact O-N 2.89Å; S53-S74 WeakPolarHBondContact OG-CB 3.49Å; S53-S76 PolarHBondContact OG-O 3.19Å
54	V	95.8	Very high	94.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	123.4	174.4	176.7	0	0	0	0	107.8	W21 N46 G47 V56 I71 I72 G203 L394	W21-V54 HydrophobicContact CH2-CG2 4.02Å; W21-V54 HydrophobicContact CZ3-CB 4.32Å; W21-V54 HydrophobicContact CZ3-CG2 3.83Å; N46-V54 WeakPolarHBondContact CA-O 3.25Å; G47-V54 PolarHBondContact N-O 2.66Å; G47-V54 PolarHBondContact O-N 2.9Å; V54-V56 HydrophobicContact CG1-CG2 4.08Å; V54-I71 HydrophobicContact CG1-CG2 3.85Å; V54-I72 WeakPolarHBondContact CA-O 3.31Å; V54-G203 WeakPolarHBondContact CG1-O 3.42Å; V54-L394 HydrophobicContact CB-CD1 4.45Å; V54-L394 HydrophobicContact CG1-CD1 3.71Å; V54-L394 HydrophobicContact CG2-CD1 3.85Å
55	H	97.2	Very high	94.6	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	114.6	-178.7	-53.9	-77.6	0	0	0	108.7	Y44 S53 F57 I71 I72 A79	Y44-H55 HydrophobicContact CE2-CB 3.88Å; Y44-H55 AromaticContact CE2-ND1 3.65Å; Y44-H55 AromaticContact CZ-ND1 3.65Å; Y44-H55 PolarHBondContact OH-CE1 3.4Å; Y44-H55 PolarHBondContact OH-ND1 3.28Å; S53-H55 PolarHBondContact OG-CE1 2.88Å; S53-H55 PolarHBondContact OG-NE2 3.31Å; H55-F57 HydrophobicContact CB-CE2 3.74Å; H55-F57 HydrophobicContact CB-CZ 4.19Å; H55-I71 CarbonylContact O-C 3.56Å; H55-I71 WeakPolarHBondContact O-CA 3.15Å; H55-I72 HydrophobicContact CB-CB 4.28Å; H55-I72 PolarHBondContact N-O 3.14Å; H55-I72 PolarHBondContact O-N 2.88Å; H55-A79 PolarHBondContact CE1-O 2.71Å
56	V	97.6	Very high	94.7	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	126.8	178.1	-179.5	0	0	0	0	108.4	Y44 I45 V54 I58 I69 L70 I71 V206	Y44-V56 CarbonylContact C-O 3.12Å; Y44-V56 WeakPolarHBondContact CA-O 3.44Å; I45-V56 HydrophobicContact CB-CB 4.2Å; I45-V56 HydrophobicContact CD1-CG1 4.33Å; I45-V56 PolarHBondContact N-O 3.48Å; I45-V56 PolarHBondContact O-N 2.92Å; V54-V56 HydrophobicContact CG1-CG2 4.08Å; V56-I58 HydrophobicContact CG1-CD1 4.27Å; V56-I58 HydrophobicContact CG1-CG1 4.04Å; V56-I69 HydrophobicContact CG1-CG2 4.02Å; V56-L70 CarbonylContact C-O 3.57Å; V56-L70 VanDerWaalsContact CA-O 3.31Å; V56-L70 WeakPolarHBondContact CA-O 3.35Å; V56-I71 HydrophobicContact CG1-CG1 4.45Å; V56-I71 HydrophobicContact CG2-CG1 4.21Å; V56-I71 HydrophobicContact CG2-CG2 4.28Å; V56-V206 HydrophobicContact CG1-CG2 3.54Å
57	F	98.1	Very high	94.8	Very high	1 Å²	1	28.4 Å²	28.4	0%	0.004	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.5	173.8	-55.2	-94	0	0	0	109.1	V42 I43 Y44 H55 I69 L70 I72 P81 I83 L96 F340	V42-F57 HydrophobicContact CG1-CB 4.44Å; V42-F57 HydrophobicContact CG1-CD1 4.03Å; I43-F57 CarbonylContact O-C 3.59Å; I43-F57 VanDerWaalsContact O-CA 3.31Å; I43-F57 WeakPolarHBondContact O-CA 3.33Å; Y44-F57 AromaticContact CD2-CD1 3.89Å; Y44-F57 HydrophobicContact CD2-CD1 3.89Å; Y44-F57 AromaticContact CD2-CE1 3.38Å; Y44-F57 HydrophobicContact CD2-CE1 3.38Å; Y44-F57 HydrophobicContact CD2-CE2 4.29Å; Y44-F57 AromaticContact CD2-CZ 3.6Å; Y44-F57 HydrophobicContact CD2-CZ 3.6Å; Y44-F57 HydrophobicContact CE2-CE1 4.03Å; Y44-F57 HydrophobicContact CE2-CE2 4.44Å; Y44-F57 AromaticContact CE2-CZ 3.79Å; Y44-F57 HydrophobicContact CE2-CZ 3.79Å; Y44-F57 HydrophobicContact CG-CD1 4.32Å; Y44-F57 AromaticContact CG-CE1 3.86Å; Y44-F57 HydrophobicContact CG-CE1 3.86Å; Y44-F57 HydrophobicContact CG-CZ 4.46Å; H55-F57 HydrophobicContact CB-CE2 3.74Å; H55-F57 HydrophobicContact CB-CZ 4.19Å; F57-I69 CarbonylContact O-C 3.44Å; F57-I69 VanDerWaalsContact O-CA 3.29Å; F57-I69 WeakPolarHBondContact O-CA 3.4Å; F57-L70 HydrophobicContact CB-CB 4.27Å; F57-L70 HydrophobicContact CD2-CB 4.39Å; F57-L70 HydrophobicContact CD2-CD2 4.14Å; F57-L70 HydrophobicContact CD2-CG 4.31Å; F57-L70 PolarHBondContact N-O 3.41Å; F57-L70 PolarHBondContact O-N 3.09Å; F57-I72 HydrophobicContact CE2-CD1 4.09Å; F57-P81 HydrophobicContact CE1-CB 4.17Å; F57-P81 HydrophobicContact CE1-CG 4.21Å; F57-P81 HydrophobicContact CZ-CB 3.7Å; F57-P81 HydrophobicContact CZ-CG 3.96Å; F57-I83 HydrophobicContact CE1-CD1 4.31Å; F57-L96 HydrophobicContact CD2-CD2 4.2Å; F57-L96 HydrophobicContact CE1-CD1 4.44Å; F57-L96 HydrophobicContact CE2-CD2 3.99Å; F57-L96 HydrophobicContact CZ-CD1 4.07Å; F57-L96 HydrophobicContact CZ-CD2 4.17Å; F57-F340 HydrophobicContact CB-CD1 3.81Å; F57-F340 HydrophobicContact CB-CE1 3.45Å; F57-F340 VanDerWaalsContact CB-CE1 3.45Å; F57-F340 HydrophobicContact CB-CZ 4.34Å; F57-F340 AromaticContact CD1-CE1 3.79Å; F57-F340 HydrophobicContact CD1-CE1 3.79Å; F57-F340 HydrophobicContact CD1-CZ 4.04Å; F57-F340 HydrophobicContact CD2-CE1 4.26Å; F57-F340 HydrophobicContact CG-CD1 4.37Å; F57-F340 AromaticContact CG-CE1 3.57Å; F57-F340 HydrophobicContact CG-CE1 3.57Å; F57-F340 HydrophobicContact CG-CZ 4.29Å
58	I	97.8	Very high	95	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	131.1	178.7	-56.2	178.9	0	0	0	107.5	I43 I45 V56 S68 I69 Y165 F183 V206	I43-I58 HydrophobicContact CB-CB 4.4Å; I43-I58 PolarHBondContact N-O 3.41Å; I43-I58 PolarHBondContact O-N 2.7Å; I45-I58 HydrophobicContact CD1-CD1 3.91Å; V56-I58 HydrophobicContact CG1-CD1 4.27Å; V56-I58 HydrophobicContact CG1-CG1 4.04Å; I58-S68 WeakPolarHBondContact CA-O 3.36Å; I58-I69 HydrophobicContact CG1-CG1 4.38Å; I58-I69 HydrophobicContact CG1-CG2 4.27Å; I58-Y165 HydrophobicContact CG2-CE2 4.32Å; I58-F183 HydrophobicContact CD1-CB 3.81Å; I58-F183 HydrophobicContact CD1-CD1 4.41Å; I58-F183 HydrophobicContact CD1-CG 4.17Å; I58-F183 HydrophobicContact CG2-CB 4.13Å; I58-F183 HydrophobicContact CG2-CD1 4.03Å; I58-F183 HydrophobicContact CG2-CD2 3.37Å; I58-F183 HydrophobicContact CG2-CE1 4.27Å; I58-F183 HydrophobicContact CG2-CE2 3.63Å; I58-F183 HydrophobicContact CG2-CG 3.57Å; I58-F183 HydrophobicContact CG2-CZ 4.07Å; I58-V206 HydrophobicContact CD1-CG1 3.81Å; I58-V206 HydrophobicContact CD1-CG2 4.31Å
59	T	97	Very high	95.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	148.8	175.5	-175.3	0	0	0	0	111.8	Y40 D41 F64 P67 S68 F340	Y40-T59 PolarHBondContact O-OG1 3.15Å; D41-T59 WeakPolarHBondContact O-CB 3.37Å; D41-T59 PolarHBondContact O-OG1 3.49Å; T59-F64 HydrophobicContact CG2-CB 3.85Å; T59-F64 HydrophobicContact CG2-CD2 4.22Å; T59-F64 HydrophobicContact CG2-CG 4.22Å; T59-P67 WeakPolarHBondContact O-CA 3.32Å; T59-S68 PolarHBondContact N-O 2.99Å; T59-S68 PolarHBondContact O-N 3.14Å; T59-F340 HydrophobicContact CG2-CB 3.47Å; T59-F340 VanDerWaalsContact CG2-CB 3.47Å; T59-F340 HydrophobicContact CG2-CD2 4.04Å; T59-F340 HydrophobicContact CG2-CG 3.88Å
60	A	96.6	Very high	95.5	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.008	13%	0.126	C	C	.	.			trans	-146.8	108	160.7	0	0	0	0	0	108.1	P67 W144 Y165	A60-P67 HydrophobicContact CB-CB 3.78Å; A60-P67 HydrophobicContact CB-CG 3.73Å; A60-W144 HydrophobicContact CB-CB 3.89Å; A60-W144 HydrophobicContact CB-CD2 4.23Å; A60-W144 HydrophobicContact CB-CG 3.94Å; A60-Y165 HydrophobicContact CB-CD1 3.66Å; A60-Y165 HydrophobicContact CB-CD2 4.17Å; A60-Y165 HydrophobicContact CB-CE1 3.95Å; A60-Y165 HydrophobicContact CB-CE2 4.43Å; A60-Y165 HydrophobicContact CB-CG 3.76Å; A60-Y165 WeakPolarHBondContact O-CD1 3.34Å; A60-Y165 WeakPolarHBondContact O-CE1 3.13Å
61	S	93.9	Very high	95.9	Very high	5 Å²	5	16 Å²	16	4%	0.035	8%	0.083	C	C	.	.	S	Bend	trans	-145.2	177.2	-170	64.1	0	0	0	0	112	K39 Y40 R63 F64 S65	K39-S61 WeakPolarHBondContact O-CB 3.37Å; K39-S61 PolarHBondContact O-OG 2.94Å; Y40-S61 WeakPolarHBondContact O-CB 3.38Å; Y40-S61 PolarHBondContact O-OG 3.43Å; S61-R63 VanDerWaalsContact C-N 3.28Å; S61-R63 PolarHBondContact O-N 3.31Å; S61-F64 PolarHBondContact N-O 3.14Å; S61-F64 CarbonylContact O-C 3.27Å; S61-F64 PolarHBondContact O-N 3.1Å; S61-F64 PolarHBondContact OG-N 2.89Å; S61-S65 WeakPolarHBondContact O-CA 3.32Å; S61-S65 PolarHBondContact O-N 3.46Å
62	E	90.2	Very high	96.1	Very high	170 Å²	170	11.3 Å²	11.3	79%	0.794	5%	0.054	S	C	*	.	S	Bend	trans	-59.3	-41.1	177.4	-173.9	178.8	176	0	0	111.7
63	R	90.9	Very high	96.2	Very high	37 Å²	37	11.5 Å²	11.5	14%	0.14	5%	0.054	C	C	.	.	S	Bend	trans	-74.7	-43.6	176.8	173.2	59.4	-175.1	84.9	-0.9	112.4	Y40 S61 L88 N337	Y40-R63 HydrophobicContact CD1-CB 3.9Å; Y40-R63 HydrophobicContact CD1-CG 3.9Å; Y40-R63 HydrophobicContact CE1-CB 4.15Å; Y40-R63 HydrophobicContact CE1-CG 3.89Å; S61-R63 VanDerWaalsContact C-N 3.28Å; S61-R63 PolarHBondContact O-N 3.31Å; R63-L88 PolarHBondContact NE-O 3.26Å; R63-L88 PolarHBondContact NH2-O 3.36Å; R63-L88 VanDerWaalsContact NH2-O 3.16Å; R63-N337 PolarHBondContact NH1-O 2.91Å
64	F	94.6	Very high	96.2	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	5%	0.054	C	C	.	.	S	Bend	trans	-108.2	67.7	-179	-58.3	-66	0	0	0	108.9	Y40 T59 S61 L66 L88 Y338 F340 I343	Y40-F64 HydrophobicContact CD1-CD2 4.44Å; Y40-F64 AromaticContact CD1-CE2 3.81Å; Y40-F64 HydrophobicContact CD1-CE2 3.81Å; T59-F64 HydrophobicContact CG2-CB 3.85Å; T59-F64 HydrophobicContact CG2-CD2 4.22Å; T59-F64 HydrophobicContact CG2-CG 4.22Å; S61-F64 PolarHBondContact N-O 3.14Å; S61-F64 CarbonylContact O-C 3.27Å; S61-F64 PolarHBondContact O-N 3.1Å; S61-F64 PolarHBondContact OG-N 2.89Å; F64-L66 PolarHBondContact O-N 3.07Å; F64-L88 HydrophobicContact CE2-CD1 4.38Å; F64-L88 HydrophobicContact CZ-CD1 4.32Å; F64-Y338 CarbonylContact C-O 3.59Å; F64-Y338 VanDerWaalsContact C-O 3.27Å; F64-Y338 WeakPolarHBondContact CA-O 3.23Å; F64-F340 HydrophobicContact CD1-CB 4.16Å; F64-F340 HydrophobicContact CD1-CD2 4.33Å; F64-F340 AromaticContact CD2-CD2 3.83Å; F64-F340 HydrophobicContact CD2-CD2 3.83Å; F64-F340 HydrophobicContact CE1-CD2 4.08Å; F64-F340 AromaticContact CE2-CD2 3.56Å; F64-F340 HydrophobicContact CE2-CD2 3.56Å; F64-F340 HydrophobicContact CE2-CE2 4.06Å; F64-F340 HydrophobicContact CG-CB 4.21Å; F64-F340 HydrophobicContact CG-CD2 4.21Å; F64-F340 AromaticContact CZ-CD2 3.69Å; F64-F340 HydrophobicContact CZ-CD2 3.69Å; F64-F340 HydrophobicContact CZ-CE2 4.23Å; F64-I343 HydrophobicContact CE1-CG2 4.27Å
65	S	94.8	Very high	96.2	Very high	8 Å²	8	14.6 Å²	14.6	6%	0.056	8%	0.075	C	C	.	.			trans	-74.4	-6.6	-170.3	62.8	0	0	0	0	114.2	S61 P67 N140 W144 Y338	S61-S65 WeakPolarHBondContact O-CA 3.32Å; S61-S65 PolarHBondContact O-N 3.46Å; S65-P67 WeakPolarHBondContact O-CD 3.36Å; S65-N140 WeakPolarHBondContact CB-O 3.46Å; S65-N140 WeakPolarHBondContact O-CA 3.43Å; S65-N140 WeakPolarHBondContact OG-CA 3.01Å; S65-N140 WeakPolarHBondContact OG-CB 3.11Å; S65-N140 PolarHBondContact OG-O 2.72Å; S65-N140 VanDerWaalsContact OG-O 3.05Å; S65-W144 PolarHBondContact O-NE1 3.17Å; S65-Y338 PolarHBondContact N-O 2.92Å
66	L	96.8	Very high	96.1	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.088	C	C	.	.	S	Bend	trans	-94.3	109.9	163.3	-70.4	175.2	0	0	0	109	F64 S68 V108 Y110 L139 N140 L335 Y338 T339	F64-L66 PolarHBondContact O-N 3.07Å; L66-S68 PolarHBondContact O-N 3.48Å; L66-S68 PolarHBondContact O-OG 2.92Å; L66-V108 HydrophobicContact CB-CG1 3.8Å; L66-V108 HydrophobicContact CD1-CG1 4.24Å; L66-Y110 HydrophobicContact CD1-CD2 4.22Å; L66-Y110 WeakPolarHBondContact CD2-O 3Å; L66-L139 HydrophobicContact CD2-CB 4.04Å; L66-N140 HydrophobicContact CD2-CB 3.77Å; L66-N140 HydrophobicContact CG-CB 3.82Å; L66-L335 VanDerWaalsContact CD1-O 3.31Å; L66-L335 WeakPolarHBondContact CD1-O 3.36Å; L66-Y338 PolarHBondContact N-O 3.15Å; L66-T339 HydrophobicContact CB-CG2 3.91Å; L66-T339 HydrophobicContact CD1-CG2 3.54Å; L66-T339 HydrophobicContact CG-CG2 4.35Å
67	P	98.4	Very high	96	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.094	C	C	.	.			trans	-50.9	133.8	174	-23.3	31.5	0	0	0	109.8	T59 A60 S65 F109 W144 I181	T59-P67 WeakPolarHBondContact O-CA 3.32Å; A60-P67 HydrophobicContact CB-CB 3.78Å; A60-P67 HydrophobicContact CB-CG 3.73Å; S65-P67 WeakPolarHBondContact O-CD 3.36Å; P67-F109 HydrophobicContact CB-CB 4.07Å; P67-F109 HydrophobicContact CB-CD2 3.92Å; P67-F109 HydrophobicContact CB-CG 4.23Å; P67-F109 HydrophobicContact CG-CB 4.38Å; P67-F109 WeakPolarHBondContact O-CD2 3.34Å; P67-F109 PolarHBondContact O-N 3.15Å; P67-W144 HydrophobicContact CG-CD2 3.83Å; P67-W144 VanDerWaalsContact CG-CE2 3.41Å; P67-W144 HydrophobicContact CG-CE3 4.26Å; P67-W144 HydrophobicContact CG-CG 4.41Å; P67-W144 HydrophobicContact CG-CH2 3.97Å; P67-W144 HydrophobicContact CG-CZ2 3.5Å; P67-W144 VanDerWaalsContact CG-CZ2 3.5Å; P67-W144 HydrophobicContact CG-CZ3 4.32Å; P67-I181 HydrophobicContact CB-CD1 3.78Å; P67-I181 HydrophobicContact CG-CD1 3.7Å
68	S	98.4	Very high	95.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	151	-173.9	54.7	0	0	0	0	113.1	I58 T59 L66 L107 F340 P341	I58-S68 WeakPolarHBondContact CA-O 3.36Å; T59-S68 PolarHBondContact N-O 2.99Å; T59-S68 PolarHBondContact O-N 3.14Å; L66-S68 PolarHBondContact O-N 3.48Å; L66-S68 PolarHBondContact O-OG 2.92Å; S68-L107 CarbonylContact C-O 3.5Å; S68-L107 VanDerWaalsContact CA-O 3.32Å; S68-L107 WeakPolarHBondContact CA-O 3.49Å; S68-F340 PolarHBondContact OG-N 2.65Å; S68-P341 WeakPolarHBondContact OG-CD 3.34Å
69	I	98.5	Very high	95.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.4	169.7	-50.7	166.3	0	0	0	107.3	V56 F57 I58 I71 A106 L107 F183 V206 F208 F392	V56-I69 HydrophobicContact CG1-CG2 4.02Å; F57-I69 CarbonylContact O-C 3.44Å; F57-I69 VanDerWaalsContact O-CA 3.29Å; F57-I69 WeakPolarHBondContact O-CA 3.4Å; I58-I69 HydrophobicContact CG1-CG1 4.38Å; I58-I69 HydrophobicContact CG1-CG2 4.27Å; I69-I71 HydrophobicContact CG2-CG1 4.04Å; I69-A106 CarbonylContact O-C 3.56Å; I69-A106 WeakPolarHBondContact O-CA 3.34Å; I69-A106 VanDerWaalsContact O-CB 3.28Å; I69-A106 WeakPolarHBondContact O-CB 3.27Å; I69-L107 PolarHBondContact N-O 3.48Å; I69-L107 PolarHBondContact O-N 3.07Å; I69-F183 HydrophobicContact CD1-CD1 3.79Å; I69-F183 HydrophobicContact CD1-CE1 3.66Å; I69-F183 HydrophobicContact CG1-CD1 3.91Å; I69-F183 HydrophobicContact CG1-CE1 3.59Å; I69-F183 HydrophobicContact CG1-CZ 4.47Å; I69-V206 HydrophobicContact CD1-CB 4.29Å; I69-V206 HydrophobicContact CD1-CG1 3.83Å; I69-V206 HydrophobicContact CG2-CG2 4.26Å; I69-F208 HydrophobicContact CD1-CD1 4.21Å; I69-F392 HydrophobicContact CB-CD1 3.97Å; I69-F392 HydrophobicContact CB-CE1 4.19Å; I69-F392 HydrophobicContact CD1-CB 4.45Å; I69-F392 HydrophobicContact CD1-CD1 4.07Å; I69-F392 HydrophobicContact CG2-CD1 3.8Å; I69-F392 HydrophobicContact CG2-CE1 4.02Å
70	L	98.4	Very high	95.8	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.6	169.8	174.6	65	0	0	0	108.7	V56 F57 I72 L96 A106 F340 P341 F344 Y345	V56-L70 CarbonylContact C-O 3.57Å; V56-L70 VanDerWaalsContact CA-O 3.31Å; V56-L70 WeakPolarHBondContact CA-O 3.35Å; F57-L70 HydrophobicContact CB-CB 4.27Å; F57-L70 HydrophobicContact CD2-CB 4.39Å; F57-L70 HydrophobicContact CD2-CD2 4.14Å; F57-L70 HydrophobicContact CD2-CG 4.31Å; F57-L70 PolarHBondContact N-O 3.41Å; F57-L70 PolarHBondContact O-N 3.09Å; L70-I72 HydrophobicContact CD1-CG1 4.26Å; L70-I72 HydrophobicContact CD2-CD1 3.98Å; L70-I72 HydrophobicContact CD2-CG1 4.38Å; L70-I72 HydrophobicContact CG-CD1 4.22Å; L70-I72 HydrophobicContact CG-CG1 4.07Å; L70-L96 HydrophobicContact CD2-CD2 3.6Å; L70-A106 HydrophobicContact CD1-CB 4.01Å; L70-F340 HydrophobicContact CB-CD1 4.43Å; L70-F340 HydrophobicContact CD2-CD1 4.13Å; L70-F340 HydrophobicContact CD2-CE1 4.18Å; L70-P341 HydrophobicContact CB-CG 4.27Å; L70-P341 HydrophobicContact CD1-CB 4.38Å; L70-F344 HydrophobicContact CD1-CD1 4.21Å; L70-F344 HydrophobicContact CD2-CB 3.86Å; L70-F344 HydrophobicContact CD2-CD1 4.49Å; L70-F344 HydrophobicContact CD2-CG 4.17Å; L70-Y345 HydrophobicContact CD1-CE2 4.04Å
71	I	97.5	Very high	95.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	128.6	175	-52.5	-179.9	0	0	0	109.1	V54 H55 V56 I69 S104 Y105 F392 L394	V54-I71 HydrophobicContact CG1-CG2 3.85Å; H55-I71 CarbonylContact O-C 3.56Å; H55-I71 WeakPolarHBondContact O-CA 3.15Å; V56-I71 HydrophobicContact CG1-CG1 4.45Å; V56-I71 HydrophobicContact CG2-CG1 4.21Å; V56-I71 HydrophobicContact CG2-CG2 4.28Å; I69-I71 HydrophobicContact CG2-CG1 4.04Å; I71-S104 CarbonylContact O-C 3.52Å; I71-S104 VanDerWaalsContact O-CA 3.26Å; I71-S104 WeakPolarHBondContact O-CA 3.41Å; I71-Y105 PolarHBondContact N-O 3.42Å; I71-Y105 PolarHBondContact O-N 2.81Å; I71-F392 HydrophobicContact CD1-CD1 3.62Å; I71-F392 HydrophobicContact CD1-CE1 3.51Å; I71-F392 HydrophobicContact CD1-CG 4.26Å; I71-F392 HydrophobicContact CD1-CZ 4.05Å; I71-F392 HydrophobicContact CG1-CD1 4.18Å; I71-F392 HydrophobicContact CG1-CE1 3.71Å; I71-F392 HydrophobicContact CG1-CZ 4.36Å; I71-L394 HydrophobicContact CG2-CD1 3.48Å; I71-L394 VanDerWaalsContact CG2-CD1 3.48Å; I71-L394 HydrophobicContact CG2-CD2 4.33Å; I71-L394 HydrophobicContact CG2-CG 3.69Å
72	I	97	Very high	96	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	125.4	177.9	-55.8	170.1	0	0	0	108.5	V54 H55 F57 L70 L96 V98 V101 F344	V54-I72 WeakPolarHBondContact CA-O 3.31Å; H55-I72 HydrophobicContact CB-CB 4.28Å; H55-I72 PolarHBondContact N-O 3.14Å; H55-I72 PolarHBondContact O-N 2.88Å; F57-I72 HydrophobicContact CE2-CD1 4.09Å; L70-I72 HydrophobicContact CD1-CG1 4.26Å; L70-I72 HydrophobicContact CD2-CD1 3.98Å; L70-I72 HydrophobicContact CD2-CG1 4.38Å; L70-I72 HydrophobicContact CG-CD1 4.22Å; L70-I72 HydrophobicContact CG-CG1 4.07Å; I72-L96 HydrophobicContact CD1-CD2 4.2Å; I72-V98 HydrophobicContact CD1-CG2 3.85Å; I72-V98 HydrophobicContact CG2-CB 4.26Å; I72-V98 HydrophobicContact CG2-CG1 4.24Å; I72-V98 HydrophobicContact CG2-CG2 4.41Å; I72-V101 HydrophobicContact CG2-CB 4.24Å; I72-V101 HydrophobicContact CG2-CG1 3.75Å; I72-V101 HydrophobicContact CG2-CG2 3.55Å; I72-F344 HydrophobicContact CD1-CD1 4.37Å; I72-F344 HydrophobicContact CD1-CD2 3.67Å; I72-F344 HydrophobicContact CD1-CE1 4.25Å; I72-F344 HydrophobicContact CD1-CE2 3.53Å; I72-F344 HydrophobicContact CD1-CG 4.1Å; I72-F344 HydrophobicContact CD1-CZ 3.84Å; I72-F344 HydrophobicContact CG1-CE1 4.32Å; I72-F344 HydrophobicContact CG1-CE2 4.32Å; I72-F344 HydrophobicContact CG1-CZ 4.12Å; I72-F344 HydrophobicContact CG2-CZ 4.39Å
73	H	95.7	Very high	96.2	Very high	15 Å²	15	24.9 Å²	24.9	7%	0.069	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.7	170.9	179.7	-81.5	0	0	0	110.1	V101 T102 Q103 L394	H73-V101 WeakPolarHBondContact O-CA 3.4Å; H73-T102 PolarHBondContact ND1-OG1 2.82Å; H73-T102 PolarHBondContact O-N 3.02Å; H73-T102 PolarHBondContact O-OG1 3.14Å; H73-Q103 HydrophobicContact CB-CB 4.44Å; H73-Q103 PolarHBondContact N-O 3.46Å; H73-L394 HydrophobicContact CB-CD1 4Å
74	S	95.8	Very high	96.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141.3	173.5	-178.6	0	0	0	0	111.1	S52 S53 S76 A79 G99 N100	S52-S74 WeakPolarHBondContact CA-O 3.29Å; S52-S74 WeakPolarHBondContact CB-O 3.4Å; S53-S74 PolarHBondContact N-O 3.08Å; S53-S74 VanDerWaalsContact N-O 3.12Å; S53-S74 PolarHBondContact O-N 2.89Å; S53-S74 WeakPolarHBondContact OG-CB 3.49Å; S74-S76 PolarHBondContact O-N 3.18Å; S74-S76 PolarHBondContact OG-N 2.85Å; S74-S76 VanDerWaalsContact OG-N 3.12Å; S74-A79 WeakPolarHBondContact OG-CB 3.45Å; S74-G99 WeakPolarHBondContact CB-O 3.25Å; S74-G99 PolarHBondContact OG-O 3.15Å; S74-N100 WeakPolarHBondContact CA-O 3.29Å; S74-N100 PolarHBondContact OG-O 3.41Å
75	S	95.2	Very high	96.3	Very high	65 Å²	65	27.7 Å²	27.7	46%	0.455	16%	0.155	S	C	.	.	S	Bend	trans	-78.6	8	170.2	58.9	0	0	0	0	113.7	T51 N100	T51-S75 CarbonylContact O-C 3.48Å; S75-N100 PolarHBondContact N-O 3.33Å; S75-N100 PolarHBondContact OG-O 3.26Å
76	S	96	Very high	96.1	Very high	37 Å²	37	31.7 Å²	31.7	26%	0.259	18%	0.176	S	C	.	.			trans	-116.6	116.3	173.4	176.9	0	0	0	0	109.7	S53 S74 E78 A79	S53-S76 PolarHBondContact OG-O 3.19Å; S74-S76 PolarHBondContact O-N 3.18Å; S74-S76 PolarHBondContact OG-N 2.85Å; S74-S76 VanDerWaalsContact OG-N 3.12Å; S76-E78 PolarHBondContact O-N 3.23Å; S76-E78 VanDerWaalsContact O-N 3.16Å; S76-E78 PolarHBondContact OG-N 3.17Å; S76-A79 WeakPolarHBondContact O-CB 3.23Å; S76-A79 PolarHBondContact O-N 3.05Å; S76-A79 VanDerWaalsContact O-N 3.08Å; S76-A79 PolarHBondContact OG-N 3.42Å
77	A	94.3	Very high	95.8	Very high	17 Å²	17	36.2 Å²	36.2	14%	0.14	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-29.6	174.2	0	0	0	0	0	113.1	R48 N49	R48-A77 WeakPolarHBondContact CD-O 3.26Å; R48-A77 PolarHBondContact NE-O 3.11Å; N49-A77 WeakPolarHBondContact O-CB 3.5Å
78	E	95.5	Very high	95.3	Very high	132 Å²	132	36.2 Å²	36.2	62%	0.617	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	7	-178.6	-62.7	-55.3	152	0	0	114	R48 S76 N80	R48-E78 IonicContact NH1-OE2 3.37Å; R48-E78 PolarHBondContact NH1-OE2 3.26Å; S76-E78 PolarHBondContact O-N 3.23Å; S76-E78 VanDerWaalsContact O-N 3.16Å; S76-E78 PolarHBondContact OG-N 3.17Å; E78-N80 PolarHBondContact O-N 3.41Å; E78-N80 PolarHBondContact O-ND2 3.16Å
79	A	96.9	Very high	94.5	Very high	7 Å²	7	41 Å²	41	6%	0.058	22%	0.222	C	C	.	.			trans	-59	135.5	173.8	0	0	0	0	0	110.2	R48 H55 S74 S76 V98	R48-A79 PolarHBondContact NH2-O 2.72Å; H55-A79 PolarHBondContact CE1-O 2.71Å; S74-A79 WeakPolarHBondContact OG-CB 3.45Å; S76-A79 WeakPolarHBondContact O-CB 3.23Å; S76-A79 PolarHBondContact O-N 3.05Å; S76-A79 VanDerWaalsContact O-N 3.08Å; S76-A79 PolarHBondContact OG-N 3.42Å; A79-V98 HydrophobicContact CB-CG1 4.16Å
80	N	96.5	Very high	93.6	Very high	91 Å²	91	44.1 Å²	44.1	49%	0.487	24%	0.242	S	C	.	.			trans	-127.4	144.4	174.4	-72.5	-70.9	0	0	0	108.7	R48 E78	R48-N80 VanDerWaalsContact NH2-CG 3.33Å; R48-N80 PolarHBondContact NH2-OD1 2.94Å; E78-N80 PolarHBondContact O-N 3.41Å; E78-N80 PolarHBondContact O-ND2 3.16Å
81	P	97.2	Very high	92.4	Very high	7 Å²	7	47.5 Å²	47.5	5%	0.045	27%	0.265	C	S	.	.			trans	-75	140.3	175.5	30.8	-34.2	0	0	0	111.2	Y44 F57 L96 T97 V98	Y44-P81 HydrophobicContact CD1-CG 4.29Å; Y44-P81 HydrophobicContact CD2-CG 4.45Å; Y44-P81 HydrophobicContact CE1-CG 3.78Å; Y44-P81 HydrophobicContact CE2-CG 3.98Å; Y44-P81 VanDerWaalsContact OH-CD 3.28Å; Y44-P81 WeakPolarHBondContact OH-CD 3.34Å; F57-P81 HydrophobicContact CE1-CB 4.17Å; F57-P81 HydrophobicContact CE1-CG 4.21Å; F57-P81 HydrophobicContact CZ-CB 3.7Å; F57-P81 HydrophobicContact CZ-CG 3.96Å; P81-L96 HydrophobicContact CB-CD1 3.76Å; P81-T97 WeakPolarHBondContact CA-O 3.31Å; P81-V98 HydrophobicContact CB-CG2 4.15Å
82	V	96.9	Very high	91.2	Very high	90 Å²	90	51.2 Å²	51.2	55%	0.545	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	119.8	167.5	-178.6	0	0	0	0	107.4	L96 T97	V82-L96 WeakPolarHBondContact O-CA 3.43Å; V82-T97 PolarHBondContact N-O 3.18Å; V82-T97 PolarHBondContact O-N 3.07Å
83	I	95.9	Very high	90.6	Very high	16 Å²	16	52.7 Å²	52.7	8%	0.082	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	123	178	-60.6	171.5	0	0	0	108.7	P29 F57 W85 L88 R95 L96 F340	P29-I83 HydrophobicContact CG-CD1 4.08Å; F57-I83 HydrophobicContact CE1-CD1 4.31Å; I83-W85 VanDerWaalsContact C-N 3.28Å; I83-W85 HydrophobicContact CB-CD2 4.28Å; I83-W85 HydrophobicContact CB-CZ2 4.08Å; I83-W85 HydrophobicContact CD1-CH2 4.04Å; I83-W85 HydrophobicContact CD1-CZ2 3.61Å; I83-W85 HydrophobicContact CG1-CZ2 4.43Å; I83-W85 HydrophobicContact CG2-CD2 3.69Å; I83-W85 HydrophobicContact CG2-CE3 4.08Å; I83-W85 HydrophobicContact CG2-CG 4.07Å; I83-W85 HydrophobicContact CG2-CH2 4.34Å; I83-W85 HydrophobicContact CG2-CZ2 4Å; I83-W85 HydrophobicContact CG2-CZ3 4.38Å; I83-W85 PolarHBondContact O-N 3.31Å; I83-L88 HydrophobicContact CG2-CD1 4.02Å; I83-L88 HydrophobicContact CG2-CD2 4.3Å; I83-L88 HydrophobicContact CG2-CG 4.47Å; I83-R95 CarbonylContact C-O 3.54Å; I83-R95 VanDerWaalsContact CA-O 3.27Å; I83-R95 WeakPolarHBondContact CA-O 3.31Å; I83-L96 HydrophobicContact CD1-CD1 4.31Å; I83-L96 HydrophobicContact CG1-CD1 3.66Å; I83-F340 HydrophobicContact CD1-CZ 4.23Å
84	E	94.4	Very high	90.4	Very high	87 Å²	87	55.8 Å²	55.8	41%	0.407	32%	0.319	S	S	.	.			trans	-80.6	73.9	173.4	-71.9	178.5	-153.2	0	0	110.6	D86 H87 L88 R95	E84-D86 VanDerWaalsContact C-N 3.34Å; E84-D86 PolarHBondContact O-N 3.07Å; E84-H87 PolarHBondContact O-N 3.07Å; E84-H87 VanDerWaalsContact O-N 3.13Å; E84-H87 IonicContact OE2-CD2 2.74Å; E84-L88 PolarHBondContact O-N 3.4Å; E84-R95 HydrophobicContact CB-CB 4.14Å; E84-R95 HydrophobicContact CB-CG 4.47Å; E84-R95 PolarHBondContact N-O 3.2Å; E84-R95 WeakPolarHBondContact OE2-CD 3.21Å; E84-R95 IonicContact OE2-NE 3.05Å; E84-R95 PolarHBondContact OE2-NE 3.37Å
85	W	93.3	Very high	90.4	Very high	8 Å²	8	57.2 Å²	57.2	3%	0.03	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-52.5	-46.8	-174.1	-67.1	104.3	0	0	0	113.3	N28 P29 C31 L33 Y40 V42 I83 H87 L88	N28-W85 HydrophobicContact CB-CH2 4.06Å; N28-W85 HydrophobicContact CB-CZ2 4.37Å; P29-W85 HydrophobicContact CG-CZ2 4.28Å; P29-W85 WeakPolarHBondContact O-CZ2 3.31Å; P29-W85 PolarHBondContact O-NE1 2.92Å; C31-W85 HydrophobicContact CB-CD2 3.75Å; C31-W85 HydrophobicContact CB-CE3 4.26Å; C31-W85 HydrophobicContact CB-CG 4.06Å; C31-W85 HydrophobicContact CB-CZ2 4.01Å; L33-W85 HydrophobicContact CD1-CB 3.78Å; L33-W85 HydrophobicContact CG-CB 4.17Å; Y40-W85 AromaticContact CD2-CE3 3.67Å; Y40-W85 HydrophobicContact CD2-CE3 3.67Å; Y40-W85 AromaticContact CD2-CZ3 3.77Å; Y40-W85 HydrophobicContact CD2-CZ3 3.77Å; Y40-W85 HydrophobicContact CE2-CE3 4.01Å; Y40-W85 HydrophobicContact CG-CE3 4.21Å; Y40-W85 AromaticContact CG-CZ3 3.94Å; Y40-W85 HydrophobicContact CG-CZ3 3.94Å; Y40-W85 PolarHBondContact OH-O 2.98Å; V42-W85 HydrophobicContact CB-CH2 4.16Å; V42-W85 HydrophobicContact CG2-CH2 4.15Å; V42-W85 HydrophobicContact CG2-CZ3 4.31Å; I83-W85 VanDerWaalsContact C-N 3.28Å; I83-W85 HydrophobicContact CB-CD2 4.28Å; I83-W85 HydrophobicContact CB-CZ2 4.08Å; I83-W85 HydrophobicContact CD1-CH2 4.04Å; I83-W85 HydrophobicContact CD1-CZ2 3.61Å; I83-W85 HydrophobicContact CG1-CZ2 4.43Å; I83-W85 HydrophobicContact CG2-CD2 3.69Å; I83-W85 HydrophobicContact CG2-CE3 4.08Å; I83-W85 HydrophobicContact CG2-CG 4.07Å; I83-W85 HydrophobicContact CG2-CH2 4.34Å; I83-W85 HydrophobicContact CG2-CZ2 4Å; I83-W85 HydrophobicContact CG2-CZ3 4.38Å; I83-W85 PolarHBondContact O-N 3.31Å; W85-H87 PolarHBondContact O-N 2.94Å; W85-L88 HydrophobicContact CD2-CD1 4.33Å; W85-L88 HydrophobicContact CE3-CD1 3.51Å; W85-L88 HydrophobicContact CZ3-CD1 3.88Å; W85-L88 PolarHBondContact O-N 3.19Å; W85-L88 VanDerWaalsContact O-N 3.11Å
86	D	90.2	Very high	90.4	Very high	93 Å²	93	54.1 Å²	54.1	50%	0.497	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-59.1	-21.3	-177.4	-58.2	-4.6	0	0	0	113.3	L33 E84	L33-D86 WeakPolarHBondContact CD2-OD1 3.11Å; L33-D86 VanDerWaalsContact CG-OD1 3.23Å; L33-D86 WeakPolarHBondContact CG-OD1 3.33Å; E84-D86 VanDerWaalsContact C-N 3.34Å; E84-D86 PolarHBondContact O-N 3.07Å
87	H	89	Confident	90.5	Very high	94 Å²	94	55 Å²	55	44%	0.435	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-106.4	-4.3	-176.1	-61.1	-57.4	0	0	0	113.4	E84 W85 N89 V90 R95	E84-H87 PolarHBondContact O-N 3.07Å; E84-H87 VanDerWaalsContact O-N 3.13Å; E84-H87 IonicContact OE2-CD2 2.74Å; W85-H87 PolarHBondContact O-N 2.94Å; H87-N89 PolarHBondContact O-N 3.05Å; H87-V90 WeakPolarHBondContact O-CB 3.5Å; H87-V90 PolarHBondContact O-N 2.89Å; H87-R95 PolarHBondContact O-NH1 2.89Å
88	L	89.5	Confident	90.6	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.5	-176.7	-66	-175.1	0	0	0	114.4	Y40 R63 F64 I83 E84 W85 V90 R95 I343	Y40-L88 HydrophobicContact CD1-CB 4.38Å; Y40-L88 HydrophobicContact CD1-CD1 3.9Å; Y40-L88 HydrophobicContact CD2-CD1 4.46Å; Y40-L88 HydrophobicContact CE1-CB 3.53Å; Y40-L88 HydrophobicContact CE1-CD1 3.77Å; Y40-L88 HydrophobicContact CE1-CG 4.3Å; Y40-L88 HydrophobicContact CE2-CD1 4.35Å; Y40-L88 HydrophobicContact CG-CD1 4.25Å; R63-L88 PolarHBondContact NE-O 3.26Å; R63-L88 PolarHBondContact NH2-O 3.36Å; R63-L88 VanDerWaalsContact NH2-O 3.16Å; F64-L88 HydrophobicContact CE2-CD1 4.38Å; F64-L88 HydrophobicContact CZ-CD1 4.32Å; I83-L88 HydrophobicContact CG2-CD1 4.02Å; I83-L88 HydrophobicContact CG2-CD2 4.3Å; I83-L88 HydrophobicContact CG2-CG 4.47Å; E84-L88 PolarHBondContact O-N 3.4Å; W85-L88 HydrophobicContact CD2-CD1 4.33Å; W85-L88 HydrophobicContact CE3-CD1 3.51Å; W85-L88 HydrophobicContact CZ3-CD1 3.88Å; W85-L88 PolarHBondContact O-N 3.19Å; W85-L88 VanDerWaalsContact O-N 3.11Å; L88-V90 PolarHBondContact O-N 3.39Å; L88-R95 HydrophobicContact CD2-CB 3.65Å; L88-R95 HydrophobicContact CD2-CG 4.11Å; L88-I343 HydrophobicContact CD2-CD1 3.59Å; L88-I343 HydrophobicContact CD2-CG2 4.25Å
89	N	81.6	Confident	90.7	Very high	100 Å²	100	50.4 Å²	50.4	54%	0.535	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-22	173.8	-65.1	-9.4	0	0	0	112.8	K39 Y40 H87	K39-N89 PolarHBondContact NZ-OD1 3.49Å; K39-N89 VanDerWaalsContact NZ-OD1 3.16Å; Y40-N89 PolarHBondContact OH-OD1 3.44Å; Y40-N89 VanDerWaalsContact OH-OD1 3.13Å; H87-N89 PolarHBondContact O-N 3.05Å
90	V	79.6	Confident	90.6	Very high	67 Å²	67	55.1 Å²	55.1	41%	0.406	32%	0.317	S	S	.	.	S	Bend	trans	-76.3	129.4	174.3	-176.1	0	0	0	0	108.4	H87 L88 S92	H87-V90 WeakPolarHBondContact O-CB 3.5Å; H87-V90 PolarHBondContact O-N 2.89Å; L88-V90 PolarHBondContact O-N 3.39Å; V90-S92 PolarHBondContact O-N 2.82Å
91	S	72.8	Confident	90.6	Very high	72 Å²	72	53.3 Å²	53.3	50%	0.503	31%	0.31	S	S	.	.	S	Bend	trans	-69.8	-17.6	-174.6	53.4	0	0	0	0	114.1	N337	S91-N337 PolarHBondContact O-OD1 3.13Å
92	S	72.2	Confident	90.4	Very high	77 Å²	77	54.4 Å²	54.4	54%	0.538	32%	0.316	S	S	.	.	S	Bend	trans	-125.8	156.7	-175.6	64.9	0	0	0	0	113	V90 R95	V90-S92 PolarHBondContact O-N 2.82Å; S92-R95 PolarHBondContact O-NH2 2.61Å
93	G	84.5	Confident	90.2	Very high	31 Å²	31	50.6 Å²	50.6	32%	0.32	29%	0.293	S	S	.	.	S	Bend	trans	101.9	149.1	176.1	0	0	0	0	0	113.2	R95 A346	G93-R95 PolarHBondContact O-N 3.17Å; G93-A346 WeakPolarHBondContact O-CB 3Å
94	K	91.6	Very high	90.2	Very high	80 Å²	80	50 Å²	50	35%	0.348	29%	0.289	S	S	.	.			trans	-71.4	127.3	176.5	-172.3	173.8	-175.2	-177.2	0	109.6	T97 I343 A346 D347	K94-T97 HydrophobicContact CD-CG2 4.45Å; K94-T97 HydrophobicContact CG-CG2 4.5Å; K94-I343 CarbonylContact C-O 3.46Å; K94-I343 WeakPolarHBondContact CA-O 3.47Å; K94-A346 HydrophobicContact CB-CB 4.22Å; K94-A346 VanDerWaalsContact N-CB 3.33Å; K94-D347 VanDerWaalsContact CD-OD2 3.25Å; K94-D347 WeakPolarHBondContact CD-OD2 3.22Å
95	R	94.8	Very high	90.3	Very high	31 Å²	31	45.8 Å²	45.8	12%	0.117	27%	0.27	C	S	.	.			trans	-132.5	-7.8	-179.4	-56.7	-68.7	170.9	38.6	3.1	114.4	I83 E84 H87 L88 S92 G93 I343	I83-R95 CarbonylContact C-O 3.54Å; I83-R95 VanDerWaalsContact CA-O 3.27Å; I83-R95 WeakPolarHBondContact CA-O 3.31Å; E84-R95 HydrophobicContact CB-CB 4.14Å; E84-R95 HydrophobicContact CB-CG 4.47Å; E84-R95 PolarHBondContact N-O 3.2Å; E84-R95 WeakPolarHBondContact OE2-CD 3.21Å; E84-R95 IonicContact OE2-NE 3.05Å; E84-R95 PolarHBondContact OE2-NE 3.37Å; H87-R95 PolarHBondContact O-NH1 2.89Å; L88-R95 HydrophobicContact CD2-CB 3.65Å; L88-R95 HydrophobicContact CD2-CG 4.11Å; S92-R95 PolarHBondContact O-NH2 2.61Å; G93-R95 PolarHBondContact O-N 3.17Å; R95-I343 HydrophobicContact CB-CB 4.08Å; R95-I343 HydrophobicContact CB-CD1 4.28Å; R95-I343 PolarHBondContact N-O 2.91Å
96	L	96.7	Very high	90.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.8	169.3	171.2	58.7	0	0	0	108.4	F57 L70 I72 P81 V82 I83 V98 F340 I343 F344	F57-L96 HydrophobicContact CD2-CD2 4.2Å; F57-L96 HydrophobicContact CE1-CD1 4.44Å; F57-L96 HydrophobicContact CE2-CD2 3.99Å; F57-L96 HydrophobicContact CZ-CD1 4.07Å; F57-L96 HydrophobicContact CZ-CD2 4.17Å; L70-L96 HydrophobicContact CD2-CD2 3.6Å; I72-L96 HydrophobicContact CD1-CD2 4.2Å; P81-L96 HydrophobicContact CB-CD1 3.76Å; V82-L96 WeakPolarHBondContact O-CA 3.43Å; I83-L96 HydrophobicContact CD1-CD1 4.31Å; I83-L96 HydrophobicContact CG1-CD1 3.66Å; L96-V98 HydrophobicContact CD1-CG2 4.34Å; L96-F340 HydrophobicContact CD2-CE1 3.72Å; L96-F340 HydrophobicContact CD2-CZ 4.13Å; L96-I343 HydrophobicContact CB-CD1 3.92Å; L96-I343 HydrophobicContact CB-CG1 4.1Å; L96-I343 PolarHBondContact N-O 3.27Å; L96-F344 HydrophobicContact CB-CB 4.28Å; L96-F344 HydrophobicContact CB-CD2 4.49Å; L96-F344 HydrophobicContact CD2-CB 4.17Å; L96-F344 HydrophobicContact CD2-CD2 4.35Å; L96-F344 HydrophobicContact CG-CB 4.4Å; L96-F344 HydrophobicContact CG-CD2 4.08Å
97	T	97	Very high	91	Very high	55 Å²	55	41 Å²	41	34%	0.337	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	143.7	173.8	62.8	0	0	0	0	110.2	P81 V82 K94	P81-T97 WeakPolarHBondContact CA-O 3.31Å; V82-T97 PolarHBondContact N-O 3.18Å; V82-T97 PolarHBondContact O-N 3.07Å; K94-T97 HydrophobicContact CD-CG2 4.45Å; K94-T97 HydrophobicContact CG-CG2 4.5Å
98	V	97.4	Very high	91.4	Very high	18 Å²	18	36.5 Å²	36.5	11%	0.109	22%	0.224	C	C	.	.			trans	-135.5	137.5	174.8	177.9	0	0	0	0	106.5	I72 A79 P81 L96 V101	I72-V98 HydrophobicContact CD1-CG2 3.85Å; I72-V98 HydrophobicContact CG2-CB 4.26Å; I72-V98 HydrophobicContact CG2-CG1 4.24Å; I72-V98 HydrophobicContact CG2-CG2 4.41Å; A79-V98 HydrophobicContact CB-CG1 4.16Å; P81-V98 HydrophobicContact CB-CG2 4.15Å; L96-V98 HydrophobicContact CD1-CG2 4.34Å; V98-V101 HydrophobicContact CB-CG2 3.77Å; V98-V101 HydrophobicContact CG1-CG2 4.05Å; V98-V101 WeakPolarHBondContact O-CG2 3.42Å
99	G	96.7	Very high	91.8	Very high	35 Å²	35	36.5 Å²	36.5	36%	0.361	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	148.3	177.4	0	0	0	0	0	112.1	S74 V101	S74-G99 WeakPolarHBondContact CB-O 3.25Å; S74-G99 PolarHBondContact OG-O 3.15Å; G99-V101 VanDerWaalsContact C-N 3.27Å; G99-V101 PolarHBondContact O-N 3.43Å; G99-V101 VanDerWaalsContact O-N 3.15Å
100	N	95.8	Very high	92.5	Very high	105 Å²	105	32 Å²	32	56%	0.561	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	38.1	170.8	-61.4	23.7	0	0	0	115	S74 S75 T102	S74-N100 WeakPolarHBondContact CA-O 3.29Å; S74-N100 PolarHBondContact OG-O 3.41Å; S75-N100 PolarHBondContact N-O 3.33Å; S75-N100 PolarHBondContact OG-O 3.26Å; N100-T102 PolarHBondContact O-N 3.07Å
101	V	95	Very high	93.2	Very high	54 Å²	54	30 Å²	30	33%	0.327	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	126.3	177.7	177.5	0	0	0	0	110.2	I72 H73 V98 G99 F344	I72-V101 HydrophobicContact CG2-CB 4.24Å; I72-V101 HydrophobicContact CG2-CG1 3.75Å; I72-V101 HydrophobicContact CG2-CG2 3.55Å; H73-V101 WeakPolarHBondContact O-CA 3.4Å; V98-V101 HydrophobicContact CB-CG2 3.77Å; V98-V101 HydrophobicContact CG1-CG2 4.05Å; V98-V101 WeakPolarHBondContact O-CG2 3.42Å; G99-V101 VanDerWaalsContact C-N 3.27Å; G99-V101 PolarHBondContact O-N 3.43Å; G99-V101 VanDerWaalsContact O-N 3.15Å; V101-F344 HydrophobicContact CG1-CZ 4.33Å; V101-F344 HydrophobicContact CG2-CZ 4.41Å
102	T	93.5	Very high	94.3	Very high	29 Å²	29	26.7 Å²	26.7	18%	0.178	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-33.2	174.7	66.5	0	0	0	0	112.3	H73 N100	H73-T102 PolarHBondContact ND1-OG1 2.82Å; H73-T102 PolarHBondContact O-N 3.02Å; H73-T102 PolarHBondContact O-OG1 3.14Å; N100-T102 PolarHBondContact O-N 3.07Å
103	Q	93.1	Very high	95.4	Very high	11 Å²	11	23.1 Å²	23.1	5%	0.051	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	152.4	178.9	-69.5	-58.9	-15.4	0	0	110.7	H73 Y105 N233 S286 N288	H73-Q103 HydrophobicContact CB-CB 4.44Å; H73-Q103 PolarHBondContact N-O 3.46Å; Q103-Y105 HydrophobicContact CB-CE2 3.72Å; Q103-Y105 HydrophobicContact CG-CE2 4.39Å; Q103-Y105 PolarHBondContact OE1-OH 3.3Å; Q103-N233 PolarHBondContact OE1-ND2 3.31Å; Q103-S286 VanDerWaalsContact NE2-CB 3.26Å; Q103-S286 PolarHBondContact NE2-OG 3.03Å; Q103-N288 HydrophobicContact CG-CB 3.56Å
104	S	95.8	Very high	95.9	Very high	2 Å²	2	21.6 Å²	21.6	1%	0.014	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	143.8	176.8	61.5	0	0	0	0	110.9	I71 N233 F344 Y345	I71-S104 CarbonylContact O-C 3.52Å; I71-S104 VanDerWaalsContact O-CA 3.26Å; I71-S104 WeakPolarHBondContact O-CA 3.41Å; S104-N233 WeakPolarHBondContact O-CB 3.41Å; S104-N233 PolarHBondContact O-N 2.84Å; S104-F344 WeakPolarHBondContact OG-CE1 3.41Å; S104-Y345 VanDerWaalsContact CB-OH 3.23Å; S104-Y345 WeakPolarHBondContact CB-OH 3.46Å; S104-Y345 PolarHBondContact O-OH 3.16Å; S104-Y345 VanDerWaalsContact OG-CE1 3.28Å; S104-Y345 WeakPolarHBondContact OG-CE1 3.39Å; S104-Y345 PolarHBondContact OG-OH 2.61Å
105	Y	97.5	Very high	96.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	150.4	-176.9	-54	-84	0	0	0	110	I71 Q103 M231 S232 L266 A291 Y345 L394	I71-Y105 PolarHBondContact N-O 3.42Å; I71-Y105 PolarHBondContact O-N 2.81Å; Q103-Y105 HydrophobicContact CB-CE2 3.72Å; Q103-Y105 HydrophobicContact CG-CE2 4.39Å; Q103-Y105 PolarHBondContact OE1-OH 3.3Å; Y105-M231 CarbonylContact C-O 3.52Å; Y105-M231 VanDerWaalsContact CA-O 3.31Å; Y105-M231 WeakPolarHBondContact CA-O 3Å; Y105-S232 VanDerWaalsContact CE1-OG 3.31Å; Y105-S232 WeakPolarHBondContact CE1-OG 3.29Å; Y105-L266 HydrophobicContact CD1-CB 3.63Å; Y105-L266 HydrophobicContact CD1-CD1 4.22Å; Y105-L266 HydrophobicContact CE1-CB 3.9Å; Y105-A291 HydrophobicContact CD1-CB 3.75Å; Y105-A291 HydrophobicContact CD2-CB 3.23Å; Y105-A291 HydrophobicContact CE1-CB 4.21Å; Y105-A291 HydrophobicContact CE2-CB 3.7Å; Y105-A291 HydrophobicContact CG-CB 3.23Å; Y105-Y345 PolarHBondContact N-OH 3.12Å; Y105-L394 HydrophobicContact CD2-CD2 3.7Å; Y105-L394 HydrophobicContact CE2-CD2 3.71Å
106	A	98.3	Very high	96.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	153.2	173.4	0	0	0	0	0	112.7	I69 L70 M231 P341 Y345	I69-A106 CarbonylContact O-C 3.56Å; I69-A106 WeakPolarHBondContact O-CA 3.34Å; I69-A106 VanDerWaalsContact O-CB 3.28Å; I69-A106 WeakPolarHBondContact O-CB 3.27Å; L70-A106 HydrophobicContact CD1-CB 4.01Å; A106-M231 HydrophobicContact CB-CB 4.02Å; A106-M231 HydrophobicContact CB-CG 4.42Å; A106-M231 HydrophobicContact CB-SD 4.2Å; A106-M231 PolarHBondContact N-O 2.82Å; A106-M231 PolarHBondContact O-N 2.86Å; A106-P341 HydrophobicContact CB-CB 3.71Å; A106-P341 HydrophobicContact CB-CG 3.33Å; A106-Y345 HydrophobicContact CB-CE2 4.42Å
107	L	98.5	Very high	96.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	124	173.5	-173.6	63.3	0	0	0	108.4	S68 I69 F208 L228 M230 I293 F392	S68-L107 CarbonylContact C-O 3.5Å; S68-L107 VanDerWaalsContact CA-O 3.32Å; S68-L107 WeakPolarHBondContact CA-O 3.49Å; I69-L107 PolarHBondContact N-O 3.48Å; I69-L107 PolarHBondContact O-N 3.07Å; L107-F208 HydrophobicContact CD2-CD1 4.38Å; L107-F208 HydrophobicContact CD2-CE1 3.53Å; L107-F208 HydrophobicContact CD2-CZ 3.74Å; L107-L228 HydrophobicContact CD1-CB 3.95Å; L107-L228 HydrophobicContact CD1-CD1 4.29Å; L107-L228 HydrophobicContact CD1-CG 4.49Å; L107-M230 HydrophobicContact CD1-CG 4.09Å; L107-I293 HydrophobicContact CD1-CD1 3.64Å; L107-I293 HydrophobicContact CD2-CD1 4.47Å; L107-F392 HydrophobicContact CB-CD1 3.85Å; L107-F392 HydrophobicContact CB-CE1 3.87Å; L107-F392 HydrophobicContact CB-CG 4.2Å; L107-F392 HydrophobicContact CB-CZ 4.27Å; L107-F392 HydrophobicContact CD2-CB 4.07Å; L107-F392 HydrophobicContact CD2-CD1 4.48Å; L107-F392 HydrophobicContact CD2-CG 4.18Å
108	V	98.4	Very high	95.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.1	-178.2	178.3	0	0	0	0	109.4	L66 Y110 L228 M229 M231 T339 P341	L66-V108 HydrophobicContact CB-CG1 3.8Å; L66-V108 HydrophobicContact CD1-CG1 4.24Å; V108-Y110 PolarHBondContact O-N 2.63Å; V108-L228 WeakPolarHBondContact O-CA 3.4Å; V108-M229 HydrophobicContact CB-CB 4.1Å; V108-M229 HydrophobicContact CB-CE 3.78Å; V108-M229 HydrophobicContact CG1-CE 3.72Å; V108-M229 HydrophobicContact CG2-CE 3.97Å; V108-M229 PolarHBondContact N-O 3.27Å; V108-M229 PolarHBondContact O-N 3.36Å; V108-M231 HydrophobicContact CG2-CE 4.19Å; V108-T339 HydrophobicContact CB-CG2 4.43Å; V108-T339 HydrophobicContact CG1-CG2 3.62Å; V108-T339 HydrophobicContact CG2-CG2 4Å; V108-P341 HydrophobicContact CG2-CG 4.12Å
109	F	98.2	Very high	95.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	95.3	174.5	-61.3	-102.4	0	0	0	107.4	P67 L139 I181 F183 F208 V210 L226 L228	P67-F109 HydrophobicContact CB-CB 4.07Å; P67-F109 HydrophobicContact CB-CD2 3.92Å; P67-F109 HydrophobicContact CB-CG 4.23Å; P67-F109 HydrophobicContact CG-CB 4.38Å; P67-F109 WeakPolarHBondContact O-CD2 3.34Å; P67-F109 PolarHBondContact O-N 3.15Å; F109-L139 HydrophobicContact CB-CD1 3.9Å; F109-L139 WeakPolarHBondContact O-CD1 3.24Å; F109-I181 HydrophobicContact CB-CD1 4Å; F109-I181 HydrophobicContact CD1-CD1 3.76Å; F109-I181 HydrophobicContact CD2-CD1 4.38Å; F109-I181 HydrophobicContact CE1-CD1 4.37Å; F109-I181 HydrophobicContact CE1-CG2 4.11Å; F109-I181 HydrophobicContact CE2-CG2 4.45Å; F109-I181 HydrophobicContact CG-CD1 3.78Å; F109-I181 HydrophobicContact CZ-CG2 4.07Å; F109-F183 HydrophobicContact CD2-CZ 4.34Å; F109-F183 AromaticContact CE2-CE1 3.54Å; F109-F183 HydrophobicContact CE2-CE1 3.54Å; F109-F183 AromaticContact CE2-CZ 3.71Å; F109-F183 HydrophobicContact CE2-CZ 3.71Å; F109-F183 AromaticContact CZ-CE1 3.8Å; F109-F183 HydrophobicContact CZ-CE1 3.8Å; F109-F183 HydrophobicContact CZ-CZ 4.19Å; F109-F208 AromaticContact CE1-CD2 3.73Å; F109-F208 HydrophobicContact CE1-CD2 3.73Å; F109-F208 AromaticContact CE1-CE2 3.92Å; F109-F208 HydrophobicContact CE1-CE2 3.92Å; F109-F208 HydrophobicContact CE1-CG 4.39Å; F109-F208 HydrophobicContact CZ-CB 4.25Å; F109-F208 HydrophobicContact CZ-CD1 4.36Å; F109-F208 AromaticContact CZ-CD2 3.62Å; F109-F208 HydrophobicContact CZ-CD2 3.62Å; F109-F208 AromaticContact CZ-CE2 3.98Å; F109-F208 HydrophobicContact CZ-CE2 3.98Å; F109-F208 AromaticContact CZ-CG 3.82Å; F109-F208 HydrophobicContact CZ-CG 3.82Å; F109-F208 HydrophobicContact CZ-CZ 4.49Å; F109-V210 HydrophobicContact CD1-CG2 3.94Å; F109-V210 HydrophobicContact CE1-CG2 3.5Å; F109-V210 VanDerWaalsContact CE1-CG2 3.5Å; F109-L226 HydrophobicContact CD1-CD2 4.13Å; F109-L228 HydrophobicContact CD1-CD2 3.71Å; F109-L228 HydrophobicContact CE1-CD2 4Å; F109-L228 HydrophobicContact CG-CD2 4.14Å
110	Y	95.8	Very high	95.6	Very high	4 Å²	4	21.2 Å²	21.2	2%	0.016	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-58.2	-162.2	177.9	-134.4	0	0	0	112.9	L66 V108 L139 Q227 L335 L367	L66-Y110 HydrophobicContact CD1-CD2 4.22Å; L66-Y110 WeakPolarHBondContact CD2-O 3Å; V108-Y110 PolarHBondContact O-N 2.63Å; Y110-L139 PolarHBondContact O-N 3.24Å; Y110-Q227 WeakPolarHBondContact CB-O 3.24Å; Y110-Q227 HydrophobicContact CD1-CG 4.24Å; Y110-Q227 PolarHBondContact N-O 3.21Å; Y110-Q227 VanDerWaalsContact N-O 3.11Å; Y110-L335 HydrophobicContact CE2-CB 4Å; Y110-L335 HydrophobicContact CE2-CD1 3.69Å; Y110-L335 HydrophobicContact CE2-CG 4.48Å; Y110-L335 WeakPolarHBondContact OH-CD1 3.43Å; Y110-L367 HydrophobicContact CD1-CD2 3.94Å; Y110-L367 HydrophobicContact CE1-CD1 4.41Å; Y110-L367 HydrophobicContact CE1-CD2 4.29Å
111	K	94.3	Very high	95.5	Very high	27 Å²	27	19.5 Å²	19.5	12%	0.117	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	151.8	179.8	61.1	-176.2	-157	-137.7	0	111.6	L113 I136 H137 Q227	K111-L113 HydrophobicContact CD-CD1 4.26Å; K111-L113 HydrophobicContact CG-CD1 3.81Å; K111-I136 HydrophobicContact CB-CG2 4.43Å; K111-I136 HydrophobicContact CD-CG2 3.92Å; K111-H137 WeakPolarHBondContact CA-O 3.34Å; K111-Q227 HydrophobicContact CG-CB 3.74Å; K111-Q227 PolarHBondContact N-O 3.17Å; K111-Q227 PolarHBondContact O-N 2.82Å
112	M	95.5	Very high	95.5	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.005	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	143.1	168.9	177	-173.5	74.9	0	0	108.5	H137 L139 Y142 V179 F212 L215 F224 G225	M112-H137 HydrophobicContact CB-CB 4.15Å; M112-H137 HydrophobicContact CE-CB 3.69Å; M112-H137 VanDerWaalsContact CE-CG 3.47Å; M112-H137 PolarHBondContact N-O 3.34Å; M112-H137 WeakPolarHBondContact O-CA 3.46Å; M112-H137 WeakPolarHBondContact O-CB 3.25Å; M112-H137 PolarHBondContact O-N 2.85Å; M112-L139 HydrophobicContact CB-CD2 4.4Å; M112-Y142 WeakPolarHBondContact CE-OH 3.41Å; M112-V179 HydrophobicContact CE-CG2 4.44Å; M112-V179 HydrophobicContact SD-CG2 4.1Å; M112-F212 HydrophobicContact CG-CE1 4.13Å; M112-F212 HydrophobicContact CG-CE2 4.35Å; M112-F212 HydrophobicContact CG-CZ 3.81Å; M112-F212 HydrophobicContact SD-CD1 3.81Å; M112-F212 HydrophobicContact SD-CD2 4.46Å; M112-F212 HydrophobicContact SD-CE1 3.52Å; M112-F212 VanDerWaalsContact SD-CE1 3.52Å; M112-F212 HydrophobicContact SD-CE2 4.19Å; M112-F212 HydrophobicContact SD-CG 4.29Å; M112-F212 HydrophobicContact SD-CZ 3.72Å; M112-L215 HydrophobicContact CE-CD1 3.82Å; M112-L215 HydrophobicContact SD-CD1 3.65Å; M112-F224 HydrophobicContact CE-CD1 3.98Å; M112-F224 HydrophobicContact CE-CE1 3.93Å; M112-F224 HydrophobicContact CG-CD1 4.04Å; M112-F224 HydrophobicContact SD-CD1 3.71Å; M112-F224 HydrophobicContact SD-CE1 4.23Å; M112-G225 CarbonylContact C-O 3.5Å; M112-G225 WeakPolarHBondContact CA-O 3.49Å; M112-G225 WeakPolarHBondContact CG-O 3.39Å
113	L	94.5	Very high	95.4	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.01	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	130.6	177.9	-60.2	77.1	0	0	0	108.3	K111 M124 I134 R135 I136 F224 G225 Q227	K111-L113 HydrophobicContact CD-CD1 4.26Å; K111-L113 HydrophobicContact CG-CD1 3.81Å; L113-M124 HydrophobicContact CB-CE 4.19Å; L113-M124 HydrophobicContact CD1-CE 3.37Å; L113-M124 HydrophobicContact CD2-CE 3.78Å; L113-M124 HydrophobicContact CG-CE 3.95Å; L113-I134 HydrophobicContact CB-CD1 4.39Å; L113-I134 HydrophobicContact CB-CG1 4.43Å; L113-I134 HydrophobicContact CD2-CD1 3.52Å; L113-I134 HydrophobicContact CD2-CG1 4.31Å; L113-I134 HydrophobicContact CG-CD1 4.47Å; L113-R135 WeakPolarHBondContact CA-O 3.37Å; L113-I136 HydrophobicContact CD2-CG1 4.42Å; L113-I136 HydrophobicContact CG-CG1 4.48Å; L113-F224 CarbonylContact O-C 3.52Å; L113-F224 VanDerWaalsContact O-CA 3.28Å; L113-F224 WeakPolarHBondContact O-CA 3.45Å; L113-G225 PolarHBondContact N-O 3.27Å; L113-G225 PolarHBondContact O-N 3.43Å; L113-Q227 HydrophobicContact CD1-CB 4.24Å
114	E	95.7	Very high	95.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130.9	163.6	-179.1	-170.7	-161.6	0	0	107.6	I134 R135 S217 H218 F219 S222 R223 F224	E114-I134 CarbonylContact O-C 3.46Å; E114-I134 WeakPolarHBondContact O-CA 3.33Å; E114-I134 WeakPolarHBondContact O-CG1 3.43Å; E114-R135 HydrophobicContact CB-CB 4.24Å; E114-R135 PolarHBondContact N-O 3.44Å; E114-R135 PolarHBondContact O-N 3.42Å; E114-R135 WeakPolarHBondContact OE2-CD 3.31Å; E114-S217 WeakPolarHBondContact OE1-CA 3.49Å; E114-H218 IonicContact OE1-CG 3.99Å; E114-H218 PolarHBondContact OE1-N 3.09Å; E114-H218 IonicContact OE1-ND1 3.82Å; E114-H218 PolarHBondContact OE1-ND1 2.96Å; E114-H218 IonicContact OE2-CE1 2.79Å; E114-H218 IonicContact OE2-CG 3.58Å; E114-H218 IonicContact OE2-ND1 2.65Å; E114-H218 PolarHBondContact OE2-ND1 3.17Å; E114-F219 HydrophobicContact CG-CD2 3.96Å; E114-F219 HydrophobicContact CG-CE2 4.04Å; E114-S222 PolarHBondContact OE1-OG 3.39Å; E114-S222 VanDerWaalsContact OE1-OG 3.14Å; E114-R223 CarbonylContact C-O 3.58Å; E114-R223 VanDerWaalsContact CA-O 3.3Å; E114-R223 WeakPolarHBondContact CA-O 3.36Å; E114-F224 HydrophobicContact CB-CD1 3.98Å; E114-F224 HydrophobicContact CB-CE1 3.66Å; E114-F224 HydrophobicContact CB-CZ 4.16Å; E114-F224 HydrophobicContact CG-CD1 4.45Å; E114-F224 HydrophobicContact CG-CE1 3.96Å; E114-F224 HydrophobicContact CG-CE2 4.41Å; E114-F224 HydrophobicContact CG-CZ 3.92Å
115	Y	95.8	Very high	95	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.9	179.7	63.4	-80.5	0	0	0	111.5	D117 M124 Y127 Q133 S222 R223	Y115-D117 HydrophobicContact CD2-CB 4.15Å; Y115-D117 HydrophobicContact CE2-CB 3.78Å; Y115-D117 PolarHBondContact O-N 3Å; Y115-M124 HydrophobicContact CD1-CB 3.83Å; Y115-M124 HydrophobicContact CE1-CB 3.52Å; Y115-M124 HydrophobicContact CG-CB 4.48Å; Y115-Y127 AromaticContact CD2-CD2 3.43Å; Y115-Y127 HydrophobicContact CD2-CD2 3.43Å; Y115-Y127 VanDerWaalsContact CD2-CD2 3.43Å; Y115-Y127 AromaticContact CD2-CE2 3.47Å; Y115-Y127 HydrophobicContact CD2-CE2 3.47Å; Y115-Y127 VanDerWaalsContact CD2-CE2 3.47Å; Y115-Y127 HydrophobicContact CD2-CG 4.07Å; Y115-Y127 HydrophobicContact CE2-CD2 4.04Å; Y115-Y127 AromaticContact CE2-CE2 3.85Å; Y115-Y127 HydrophobicContact CE2-CE2 3.85Å; Y115-Y127 HydrophobicContact CG-CD2 4.05Å; Y115-Y127 HydrophobicContact CG-CE2 4.48Å; Y115-Y127 HydrophobicContact CG-CG 4.36Å; Y115-Q133 CarbonylContact C-O 3.49Å; Y115-Q133 VanDerWaalsContact CA-O 3.26Å; Y115-Q133 WeakPolarHBondContact CA-O 2.97Å; Y115-S222 WeakPolarHBondContact O-CA 3.39Å; Y115-R223 HydrophobicContact CD1-CB 4.34Å; Y115-R223 WeakPolarHBondContact CD1-O 3.48Å; Y115-R223 HydrophobicContact CE1-CB 3.71Å; Y115-R223 HydrophobicContact CE2-CB 3.95Å; Y115-R223 VanDerWaalsContact CZ-CB 3.49Å; Y115-R223 PolarHBondContact N-O 3.48Å; Y115-R223 PolarHBondContact O-N 3Å
116	N	95.8	Very high	94.4	Very high	27 Å²	27	21 Å²	21	14%	0.144	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	96.2	177.7	-166.1	14.8	0	0	0	110	L118 Y127 Q133 F219 Q221	N116-L118 VanDerWaalsContact C-N 3.26Å; N116-L118 WeakPolarHBondContact ND2-CD2 3.26Å; N116-L118 PolarHBondContact O-N 3.48Å; N116-Y127 WeakPolarHBondContact O-CE1 2.91Å; N116-Y127 PolarHBondContact O-OH 2.95Å; N116-Q133 HydrophobicContact CB-CB 4.33Å; N116-Q133 PolarHBondContact N-O 2.97Å; N116-F219 HydrophobicContact CB-CB 3.78Å; N116-F219 HydrophobicContact CB-CD1 3.91Å; N116-F219 HydrophobicContact CB-CD2 4.1Å; N116-F219 HydrophobicContact CB-CE1 4.48Å; N116-F219 HydrophobicContact CB-CG 3.67Å; N116-Q221 WeakPolarHBondContact OD1-CB 3.35Å; N116-Q221 PolarHBondContact OD1-N 3.3Å
117	D	95.3	Very high	93.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.119	C	C	.	.			trans	-77.3	74.3	-177.6	-173	8	0	0	0	111.7	Y115 S119 D120 D121 V122 Q221 R223 F379	Y115-D117 HydrophobicContact CD2-CB 4.15Å; Y115-D117 HydrophobicContact CE2-CB 3.78Å; Y115-D117 PolarHBondContact O-N 3Å; D117-S119 VanDerWaalsContact C-N 3.27Å; D117-S119 PolarHBondContact O-N 3.01Å; D117-D120 VanDerWaalsContact CG-CA 3.48Å; D117-D120 PolarHBondContact O-N 3.27Å; D117-D120 WeakPolarHBondContact OD1-CA 3.39Å; D117-D120 PolarHBondContact OD1-N 3.12Å; D117-D120 VanDerWaalsContact OD2-CA 3.31Å; D117-D120 WeakPolarHBondContact OD2-CA 3.31Å; D117-D121 PolarHBondContact OD1-N 3.17Å; D117-D121 VanDerWaalsContact OD1-N 3.07Å; D117-D121 PolarHBondContact OD2-N 2.89Å; D117-V122 PolarHBondContact OD2-N 3.02Å; D117-Q221 PolarHBondContact N-O 2.96Å; D117-Q221 WeakPolarHBondContact O-CB 3.28Å; D117-Q221 PolarHBondContact O-NE2 3.33Å; D117-R223 HydrophobicContact CB-CB 4.44Å; D117-R223 HydrophobicContact CB-CG 3.87Å; D117-R223 WeakPolarHBondContact OD2-CD 3.42Å; D117-R223 IonicContact OD2-CZ 3.77Å; D117-R223 IonicContact OD2-NE 3.89Å; D117-R223 PolarHBondContact OD2-NE 2.8Å; D117-F379 HydrophobicContact CB-CE1 4.32Å
118	L	93	Very high	92.3	Very high	88 Å²	88	24.8 Å²	24.8	46%	0.461	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-34.9	-178.5	-64.3	-178	0	0	0	112.9	N116 Y127 Q221	N116-L118 VanDerWaalsContact C-N 3.26Å; N116-L118 WeakPolarHBondContact ND2-CD2 3.26Å; N116-L118 PolarHBondContact O-N 3.48Å; L118-Y127 PolarHBondContact N-OH 2.91Å; L118-Q221 PolarHBondContact O-NE2 3.29Å
119	S	92.6	Very high	91	Very high	69 Å²	69	33.8 Å²	33.8	48%	0.483	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-11.6	-179.8	33.8	0	0	0	0	113.9	D117 D121	D117-S119 VanDerWaalsContact C-N 3.27Å; D117-S119 PolarHBondContact O-N 3.01Å; S119-D121 VanDerWaalsContact C-N 3.25Å; S119-D121 PolarHBondContact O-N 3.04Å
120	D	95	Very high	89.8	Confident	27 Å²	27	37.7 Å²	37.7	14%	0.144	20%	0.196	C	C	.	.	S	Bend	trans	55.6	40.3	-174.3	-167.8	38.2	0	0	0	112.6	D117 R223 S375 T376 F379	D117-D120 VanDerWaalsContact CG-CA 3.48Å; D117-D120 PolarHBondContact O-N 3.27Å; D117-D120 WeakPolarHBondContact OD1-CA 3.39Å; D117-D120 PolarHBondContact OD1-N 3.12Å; D117-D120 VanDerWaalsContact OD2-CA 3.31Å; D117-D120 WeakPolarHBondContact OD2-CA 3.31Å; D120-R223 IonicContact OD1-CZ 3.96Å; D120-R223 IonicContact OD1-NE 3.73Å; D120-R223 IonicContact OD1-NH2 3.63Å; D120-R223 PolarHBondContact OD1-NH2 2.68Å; D120-S375 WeakPolarHBondContact O-CB 3.29Å; D120-S375 VanDerWaalsContact OD2-CA 3.25Å; D120-S375 WeakPolarHBondContact OD2-CA 3.43Å; D120-S375 WeakPolarHBondContact OD2-CB 3.36Å; D120-S375 PolarHBondContact OD2-OG 2.68Å; D120-T376 PolarHBondContact OD2-N 2.64Å; D120-F379 HydrophobicContact CB-CE1 4.28Å; D120-F379 HydrophobicContact CB-CZ 4.27Å; D120-F379 VanDerWaalsContact OD1-CE1 3.29Å; D120-F379 WeakPolarHBondContact OD1-CE1 3.3Å
121	D	93.6	Very high	88.8	Confident	69 Å²	69	41.4 Å²	41.4	37%	0.369	23%	0.228	S	C	.	.			trans	-106.1	-5.2	-175.4	77	-6.7	0	0	0	113.7	D117 S119 N123	D117-D121 PolarHBondContact OD1-N 3.17Å; D117-D121 VanDerWaalsContact OD1-N 3.07Å; D117-D121 PolarHBondContact OD2-N 2.89Å; S119-D121 VanDerWaalsContact C-N 3.25Å; S119-D121 PolarHBondContact O-N 3.04Å; D121-N123 PolarHBondContact O-N 2.75Å; D121-N123 WeakPolarHBondContact OD1-CB 3.28Å; D121-N123 PolarHBondContact OD1-N 2.78Å
122	V	94.4	Very high	88.5	Confident	10 Å²	10	47.5 Å²	47.5	6%	0.061	26%	0.262	C	S	.	.			trans	59.7	28.7	178	-157.8	0	0	0	0	112.6	D117 Y315 S371 F372	D117-V122 PolarHBondContact OD2-N 3.02Å; V122-Y315 WeakPolarHBondContact O-CB 3.23Å; V122-S371 WeakPolarHBondContact O-CB 3.32Å; V122-S371 PolarHBondContact O-OG 2.86Å; V122-F372 VanDerWaalsContact CG1-C 3.47Å
123	N	93.2	Very high	88.3	Confident	24 Å²	24	49.6 Å²	49.6	13%	0.128	27%	0.271	C	S	.	.			trans	-109.4	93.2	-177.6	-176.2	1.9	0	0	0	112.1	D121 S125 I126 Y127 Y315	D121-N123 PolarHBondContact O-N 2.75Å; D121-N123 WeakPolarHBondContact OD1-CB 3.28Å; D121-N123 PolarHBondContact OD1-N 2.78Å; N123-S125 PolarHBondContact O-N 3.16Å; N123-S125 VanDerWaalsContact O-N 3.09Å; N123-S125 VanDerWaalsContact OD1-CB 3.31Å; N123-S125 WeakPolarHBondContact OD1-CB 3.37Å; N123-S125 PolarHBondContact OD1-N 2.85Å; N123-S125 VanDerWaalsContact OD1-N 3.07Å; N123-S125 PolarHBondContact OD1-OG 2.8Å; N123-I126 WeakPolarHBondContact O-CG1 3.49Å; N123-Y127 WeakPolarHBondContact O-CD2 3.33Å; N123-Y127 WeakPolarHBondContact O-CE2 3.4Å; N123-Y315 HydrophobicContact CB-CD1 4.33Å; N123-Y315 HydrophobicContact CB-CE1 4.01Å; N123-Y315 VanDerWaalsContact OD1-CE1 3.23Å; N123-Y315 WeakPolarHBondContact OD1-CE1 3.28Å
124	M	92.6	Very high	88.3	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-62.7	-20.8	177.6	75.9	-174.4	-92.1	0	0	113.7	L113 Y115 I126 Y127 P128 N369 V370 S371	L113-M124 HydrophobicContact CB-CE 4.19Å; L113-M124 HydrophobicContact CD1-CE 3.37Å; L113-M124 HydrophobicContact CD2-CE 3.78Å; L113-M124 HydrophobicContact CG-CE 3.95Å; Y115-M124 HydrophobicContact CD1-CB 3.83Å; Y115-M124 HydrophobicContact CE1-CB 3.52Å; Y115-M124 HydrophobicContact CG-CB 4.48Å; M124-I126 PolarHBondContact O-N 2.78Å; M124-I126 VanDerWaalsContact O-N 3.17Å; M124-Y127 PolarHBondContact O-N 3.36Å; M124-P128 WeakPolarHBondContact O-CD 3.38Å; M124-N369 HydrophobicContact CE-CB 4Å; M124-N369 HydrophobicContact CG-CB 3.93Å; M124-N369 HydrophobicContact SD-CB 3.78Å; M124-V370 VanDerWaalsContact SD-O 3.4Å; M124-S371 WeakPolarHBondContact CB-OG 3.32Å; M124-S371 WeakPolarHBondContact CG-OG 3.38Å; M124-S371 PolarHBondContact N-OG 3.44Å; M124-S371 PolarHBondContact SD-OG 2.99Å
125	S	87	Confident	88.1	Confident	31 Å²	31	56 Å²	56	22%	0.217	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-71.4	-15.1	-166.2	-51.4	0	0	0	0	113.4	N123 P128 S317	N123-S125 PolarHBondContact O-N 3.16Å; N123-S125 VanDerWaalsContact O-N 3.09Å; N123-S125 VanDerWaalsContact OD1-CB 3.31Å; N123-S125 WeakPolarHBondContact OD1-CB 3.37Å; N123-S125 PolarHBondContact OD1-N 2.85Å; N123-S125 VanDerWaalsContact OD1-N 3.07Å; N123-S125 PolarHBondContact OD1-OG 2.8Å; S125-P128 WeakPolarHBondContact O-CD 3.3Å; S125-S317 VanDerWaalsContact OG-CB 3.3Å; S125-S317 WeakPolarHBondContact OG-CB 3.28Å
126	I	83.9	Confident	87.9	Confident	61 Å²	61	59.5 Å²	59.5	31%	0.313	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-87.3	-19.5	178.7	65.3	177	0	0	0	113.1	N123 M124	N123-I126 WeakPolarHBondContact O-CG1 3.49Å; M124-I126 PolarHBondContact O-N 2.78Å; M124-I126 VanDerWaalsContact O-N 3.17Å
127	Y	82.8	Confident	87.8	Confident	9 Å²	9	59.6 Å²	59.6	4%	0.035	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-85.5	-18.8	-171.9	-68.4	-80.8	0	0	0	117.8	Y115 N116 L118 N123 M124 R129 N130 Q133	Y115-Y127 AromaticContact CD2-CD2 3.43Å; Y115-Y127 HydrophobicContact CD2-CD2 3.43Å; Y115-Y127 VanDerWaalsContact CD2-CD2 3.43Å; Y115-Y127 AromaticContact CD2-CE2 3.47Å; Y115-Y127 HydrophobicContact CD2-CE2 3.47Å; Y115-Y127 VanDerWaalsContact CD2-CE2 3.47Å; Y115-Y127 HydrophobicContact CD2-CG 4.07Å; Y115-Y127 HydrophobicContact CE2-CD2 4.04Å; Y115-Y127 AromaticContact CE2-CE2 3.85Å; Y115-Y127 HydrophobicContact CE2-CE2 3.85Å; Y115-Y127 HydrophobicContact CG-CD2 4.05Å; Y115-Y127 HydrophobicContact CG-CE2 4.48Å; Y115-Y127 HydrophobicContact CG-CG 4.36Å; N116-Y127 WeakPolarHBondContact O-CE1 2.91Å; N116-Y127 PolarHBondContact O-OH 2.95Å; L118-Y127 PolarHBondContact N-OH 2.91Å; N123-Y127 WeakPolarHBondContact O-CD2 3.33Å; N123-Y127 WeakPolarHBondContact O-CE2 3.4Å; M124-Y127 PolarHBondContact O-N 3.36Å; Y127-R129 PolarHBondContact O-N 2.98Å; Y127-N130 PolarHBondContact O-N 3.27Å; Y127-Q133 HydrophobicContact CD1-CB 3.98Å; Y127-Q133 HydrophobicContact CE1-CB 4.36Å
128	P	70.9	Confident	87.6	Confident	71 Å²	71	62.3 Å²	62.3	46%	0.461	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-58.5	-14.9	177.8	-25.6	34.4	0	0	0	114.1	M124 S125	M124-P128 WeakPolarHBondContact O-CD 3.38Å; S125-P128 WeakPolarHBondContact O-CD 3.3Å
129	R	70.2	Confident	87.7	Confident	189 Å²	189	58.1 Å²	58.1	71%	0.713	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-85.5	-17.9	176.6	-64.6	-173.1	-67.3	-92	-1.3	114.2	Y127	Y127-R129 PolarHBondContact O-N 2.98Å
130	N	73.8	Confident	87.8	Confident	82 Å²	82	56.2 Å²	56.2	44%	0.439	29%	0.289	S	S	.	.			trans	-113.9	88.4	-175.2	-72.9	-4.7	0	0	0	110.6	Y127 D132 Q133 I134	Y127-N130 PolarHBondContact O-N 3.27Å; N130-D132 PolarHBondContact O-N 3.19Å; N130-D132 VanDerWaalsContact O-N 3.13Å; N130-Q133 HydrophobicContact CB-CB 4.22Å; N130-Q133 HydrophobicContact CB-CG 4.42Å; N130-Q133 PolarHBondContact ND2-OE1 3.29Å; N130-Q133 PolarHBondContact O-N 3.07Å; N130-I134 WeakPolarHBondContact O-CG2 3.46Å
131	A	75.4	Confident	87.7	Confident	82 Å²	82	58.7 Å²	58.7	68%	0.678	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-55.4	-32.8	-175.1	0	0	0	0	0	114.1	Q133	A131-Q133 PolarHBondContact O-N 2.79Å
132	D	87.6	Confident	87.8	Confident	156 Å²	156	56 Å²	56	83%	0.834	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-75.3	-11.6	-178.8	-59.9	-32.4	0	0	0	114	N130	N130-D132 PolarHBondContact O-N 3.19Å; N130-D132 VanDerWaalsContact O-N 3.13Å
133	Q	91.4	Very high	87.8	Confident	45 Å²	45	59.5 Å²	59.5	21%	0.21	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-111.7	7.6	-176.3	-65.6	-178.6	-22.2	0	0	112.8	Y115 N116 Y127 N130 A131	Y115-Q133 CarbonylContact C-O 3.49Å; Y115-Q133 VanDerWaalsContact CA-O 3.26Å; Y115-Q133 WeakPolarHBondContact CA-O 2.97Å; N116-Q133 HydrophobicContact CB-CB 4.33Å; N116-Q133 PolarHBondContact N-O 2.97Å; Y127-Q133 HydrophobicContact CD1-CB 3.98Å; Y127-Q133 HydrophobicContact CE1-CB 4.36Å; N130-Q133 HydrophobicContact CB-CB 4.22Å; N130-Q133 HydrophobicContact CB-CG 4.42Å; N130-Q133 PolarHBondContact ND2-OE1 3.29Å; N130-Q133 PolarHBondContact O-N 3.07Å; A131-Q133 PolarHBondContact O-N 2.79Å
134	I	93.6	Very high	88	Confident	19 Å²	19	58.8 Å²	58.8	10%	0.097	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	141.7	-173.9	-160.9	167.1	0	0	0	111.6	L113 E114 N130	L113-I134 HydrophobicContact CB-CD1 4.39Å; L113-I134 HydrophobicContact CB-CG1 4.43Å; L113-I134 HydrophobicContact CD2-CD1 3.52Å; L113-I134 HydrophobicContact CD2-CG1 4.31Å; L113-I134 HydrophobicContact CG-CD1 4.47Å; E114-I134 CarbonylContact O-C 3.46Å; E114-I134 WeakPolarHBondContact O-CA 3.33Å; E114-I134 WeakPolarHBondContact O-CG1 3.43Å; N130-I134 WeakPolarHBondContact O-CG2 3.46Å
135	R	92.6	Very high	88	Confident	118 Å²	118	65.2 Å²	65.2	45%	0.445	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	125.6	169.7	-72	177.5	168.5	-128.2	-4.6	108.5	L113 E114 H218 F219	L113-R135 WeakPolarHBondContact CA-O 3.37Å; E114-R135 HydrophobicContact CB-CB 4.24Å; E114-R135 PolarHBondContact N-O 3.44Å; E114-R135 PolarHBondContact O-N 3.42Å; E114-R135 WeakPolarHBondContact OE2-CD 3.31Å; R135-H218 PolarHBondContact NH1-CD2 3.49Å; R135-H218 PolarHBondContact NH1-NE2 2.72Å; R135-F219 HydrophobicContact CG-CE2 4.19Å; R135-F219 HydrophobicContact CG-CZ 3.99Å
136	I	91.8	Very high	88.2	Confident	72 Å²	72	66 Å²	66	37%	0.369	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	126.2	-178.7	-58	176	0	0	0	108.9	K111 L113	K111-I136 HydrophobicContact CB-CG2 4.43Å; K111-I136 HydrophobicContact CD-CG2 3.92Å; L113-I136 HydrophobicContact CD2-CG1 4.42Å; L113-I136 HydrophobicContact CG-CG1 4.48Å
137	H	92.5	Very high	88.4	Confident	30 Å²	30	65.6 Å²	65.6	14%	0.139	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	102.7	174.2	-62.4	-97.7	0	0	0	108.8	K111 M112 L139 Y142	K111-H137 WeakPolarHBondContact CA-O 3.34Å; M112-H137 HydrophobicContact CB-CB 4.15Å; M112-H137 HydrophobicContact CE-CB 3.69Å; M112-H137 VanDerWaalsContact CE-CG 3.47Å; M112-H137 PolarHBondContact N-O 3.34Å; M112-H137 WeakPolarHBondContact O-CA 3.46Å; M112-H137 WeakPolarHBondContact O-CB 3.25Å; M112-H137 PolarHBondContact O-N 2.85Å; H137-L139 PolarHBondContact O-N 2.84Å; H137-Y142 HydrophobicContact CB-CE2 4.2Å
138	H	92.4	Very high	87.9	Confident	56 Å²	56	69.5 Å²	69.5	26%	0.259	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	117.7	178.2	-67.2	-83.8	0	0	0	109.9	N140 E141 Y142	H138-N140 WeakPolarHBondContact CB-OD1 3.37Å; H138-N140 PolarHBondContact O-N 2.83Å; H138-E141 HydrophobicContact CB-CG 3.98Å; H138-E141 WeakPolarHBondContact O-CB 3.36Å; H138-E141 PolarHBondContact O-N 3.49Å; H138-E141 VanDerWaalsContact O-N 3.1Å; H138-Y142 WeakPolarHBondContact O-CD2 3.34Å
139	L	95.5	Very high	87.5	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-71.1	-16.8	-172.4	-66.6	177.1	0	0	0	113	L66 F109 Y110 M112 H137 E141 Y142 W144 L226	L66-L139 HydrophobicContact CD2-CB 4.04Å; F109-L139 HydrophobicContact CB-CD1 3.9Å; F109-L139 WeakPolarHBondContact O-CD1 3.24Å; Y110-L139 PolarHBondContact O-N 3.24Å; M112-L139 HydrophobicContact CB-CD2 4.4Å; H137-L139 PolarHBondContact O-N 2.84Å; L139-E141 PolarHBondContact O-N 3.05Å; L139-Y142 HydrophobicContact CD2-CD1 4.49Å; L139-Y142 HydrophobicContact CD2-CD2 4.2Å; L139-Y142 HydrophobicContact CD2-CE1 4.36Å; L139-Y142 HydrophobicContact CD2-CE2 4.07Å; L139-Y142 HydrophobicContact CD2-CG 4.43Å; L139-Y142 WeakPolarHBondContact O-CB 3.3Å; L139-Y142 PolarHBondContact O-N 2.79Å; L139-W144 HydrophobicContact CB-CZ2 4.22Å; L139-W144 HydrophobicContact CD2-CZ2 4.03Å; L139-W144 PolarHBondContact O-NE1 2.93Å; L139-L226 HydrophobicContact CD1-CD1 4.15Å
140	N	93.9	Very high	86.7	Confident	29 Å²	29	68.8 Å²	68.8	16%	0.155	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-71	-16.4	172.7	69.4	-67.9	0	0	0	113.3	S65 L66 H138 Y142 Y338	S65-N140 WeakPolarHBondContact CB-O 3.46Å; S65-N140 WeakPolarHBondContact O-CA 3.43Å; S65-N140 WeakPolarHBondContact OG-CA 3.01Å; S65-N140 WeakPolarHBondContact OG-CB 3.11Å; S65-N140 PolarHBondContact OG-O 2.72Å; S65-N140 VanDerWaalsContact OG-O 3.05Å; L66-N140 HydrophobicContact CD2-CB 3.77Å; L66-N140 HydrophobicContact CG-CB 3.82Å; H138-N140 WeakPolarHBondContact CB-OD1 3.37Å; H138-N140 PolarHBondContact O-N 2.83Å; N140-Y142 VanDerWaalsContact C-N 3.29Å; N140-Y338 HydrophobicContact CB-CG 4.45Å
141	E	93.3	Very high	85.7	Confident	79 Å²	79	65.6 Å²	65.6	37%	0.369	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-88.4	0.8	175.2	-57.1	178	164.3	0	0	112.3	H138 L139 K171	H138-E141 HydrophobicContact CB-CG 3.98Å; H138-E141 WeakPolarHBondContact O-CB 3.36Å; H138-E141 PolarHBondContact O-N 3.49Å; H138-E141 VanDerWaalsContact O-N 3.1Å; L139-E141 PolarHBondContact O-N 3.05Å; E141-K171 IonicContact OE1-NZ 3.9Å; E141-K171 WeakPolarHBondContact OE2-CE 3.5Å; E141-K171 IonicContact OE2-NZ 2.85Å; E141-K171 PolarHBondContact OE2-NZ 3.34Å
142	Y	95.3	Very high	84.9	Confident	11 Å²	11	68 Å²	68	4%	0.043	35%	0.353	C	S	.	.	S	Bend	trans	-89.8	142.1	178.4	-76.1	-127	0	0	0	109.8	M112 H137 H138 L139 N140 W144 T168 M172 V179	M112-Y142 WeakPolarHBondContact CE-OH 3.41Å; H137-Y142 HydrophobicContact CB-CE2 4.2Å; H138-Y142 WeakPolarHBondContact O-CD2 3.34Å; L139-Y142 HydrophobicContact CD2-CD1 4.49Å; L139-Y142 HydrophobicContact CD2-CD2 4.2Å; L139-Y142 HydrophobicContact CD2-CE1 4.36Å; L139-Y142 HydrophobicContact CD2-CE2 4.07Å; L139-Y142 HydrophobicContact CD2-CG 4.43Å; L139-Y142 WeakPolarHBondContact O-CB 3.3Å; L139-Y142 PolarHBondContact O-N 2.79Å; N140-Y142 VanDerWaalsContact C-N 3.29Å; Y142-W144 HydrophobicContact CD1-CZ2 4.47Å; Y142-W144 HydrophobicContact CG-CZ2 4.46Å; Y142-W144 PolarHBondContact O-N 3Å; Y142-T168 CarbonylContact C-O 3.6Å; Y142-T168 WeakPolarHBondContact CA-O 3.39Å; Y142-M172 HydrophobicContact CD1-CE 4.38Å; Y142-M172 HydrophobicContact CE1-CE 3.47Å; Y142-M172 VanDerWaalsContact CE1-CE 3.47Å; Y142-V179 HydrophobicContact CE1-CB 4.14Å; Y142-V179 HydrophobicContact CE1-CG2 3.71Å
143	N	95	Very high	83.9	Confident	84 Å²	84	62.8 Å²	62.8	45%	0.449	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	97.7	169.3	-172.7	1.7	0	0	0	108.8	T168	N143-T168 PolarHBondContact N-O 3.02Å; N143-T168 PolarHBondContact O-N 3.13Å
144	W	95.5	Very high	83.4	Confident	10 Å²	10	63.9 Å²	63.9	4%	0.038	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	127.5	177.8	-64.9	100.2	0	0	0	110.9	A60 S65 P67 L139 Y142 N166 G167 V179 I181	A60-W144 HydrophobicContact CB-CB 3.89Å; A60-W144 HydrophobicContact CB-CD2 4.23Å; A60-W144 HydrophobicContact CB-CG 3.94Å; S65-W144 PolarHBondContact O-NE1 3.17Å; P67-W144 HydrophobicContact CG-CD2 3.83Å; P67-W144 VanDerWaalsContact CG-CE2 3.41Å; P67-W144 HydrophobicContact CG-CE3 4.26Å; P67-W144 HydrophobicContact CG-CG 4.41Å; P67-W144 HydrophobicContact CG-CH2 3.97Å; P67-W144 HydrophobicContact CG-CZ2 3.5Å; P67-W144 VanDerWaalsContact CG-CZ2 3.5Å; P67-W144 HydrophobicContact CG-CZ3 4.32Å; L139-W144 HydrophobicContact CB-CZ2 4.22Å; L139-W144 HydrophobicContact CD2-CZ2 4.03Å; L139-W144 PolarHBondContact O-NE1 2.93Å; Y142-W144 HydrophobicContact CD1-CZ2 4.47Å; Y142-W144 HydrophobicContact CG-CZ2 4.46Å; Y142-W144 PolarHBondContact O-N 3Å; W144-N166 WeakPolarHBondContact CA-O 3.47Å; W144-G167 VanDerWaalsContact CE3-N 3.32Å; W144-V179 HydrophobicContact CH2-CB 4.25Å; W144-V179 HydrophobicContact CH2-CG1 3.89Å; W144-I181 HydrophobicContact CH2-CD1 3.6Å; W144-I181 HydrophobicContact CH2-CG1 3.98Å; W144-I181 HydrophobicContact CZ2-CD1 4.29Å; W144-I181 HydrophobicContact CZ3-CD1 3.99Å; W144-I181 HydrophobicContact CZ3-CG1 4.04Å
145	K	93	Very high	83.1	Confident	134 Å²	134	65.5 Å²	65.5	58%	0.583	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.3	132	173.8	-64.1	-170.3	178.6	-175.1	0	110.5	N166	K145-N166 PolarHBondContact N-O 3.1Å; K145-N166 PolarHBondContact O-N 2.82Å
146	R	92.1	Very high	82.8	Confident	49 Å²	49	62.1 Å²	62.1	19%	0.185	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	134.7	171.3	-174.4	159.7	61.6	142	-19.2	110.4	H27 D41 S148 D151 I163 T164 Y165	H27-R146 PolarHBondContact CD2-NH2 3Å; H27-R146 PolarHBondContact CE1-NH2 3.03Å; H27-R146 PolarHBondContact NE2-NH2 3.48Å; D41-R146 IonicContact OD1-CZ 3.85Å; D41-R146 IonicContact OD1-NE 3.4Å; D41-R146 PolarHBondContact OD1-NE 3.42Å; D41-R146 IonicContact OD1-NH2 2.98Å; D41-R146 PolarHBondContact OD1-NH2 3.09Å; D41-R146 WeakPolarHBondContact OD2-CD 3.48Å; D41-R146 IonicContact OD2-NE 2.84Å; D41-R146 PolarHBondContact OD2-NE 3.39Å; R146-S148 PolarHBondContact O-N 3.37Å; R146-D151 WeakPolarHBondContact CD-OD2 3.42Å; R146-D151 WeakPolarHBondContact CG-OD2 3.38Å; R146-D151 IonicContact CZ-OD1 3.24Å; R146-D151 IonicContact NE-OD2 2.81Å; R146-D151 IonicContact NH1-OD1 3.39Å; R146-D151 PolarHBondContact NH1-OD1 2.83Å; R146-D151 IonicContact NH1-OD2 2.7Å; R146-I163 HydrophobicContact CG-CD1 4.13Å; R146-I163 HydrophobicContact CG-CG1 4.11Å; R146-T164 CarbonylContact C-O 3.59Å; R146-T164 WeakPolarHBondContact CA-O 3.46Å; R146-Y165 HydrophobicContact CB-CD1 4.19Å; R146-Y165 HydrophobicContact CB-CE1 3.97Å
147	N	87.7	Confident	82.6	Confident	51 Å²	51	64.6 Å²	64.6	27%	0.273	35%	0.347	S	S	.	.			trans	-80.5	98.6	177.4	-177.7	8.7	0	0	0	110.2	N149 T164	N147-N149 PolarHBondContact O-N 3.3Å; N147-N149 VanDerWaalsContact O-N 3.11Å; N147-N149 PolarHBondContact OD1-N 2.93Å; N147-T164 HydrophobicContact CB-CG2 4.09Å; N147-T164 PolarHBondContact N-O 2.93Å
148	S	72.1	Confident	82.4	Confident	92 Å²	92	70.3 Å²	70.3	64%	0.643	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-66.6	-10.2	-174	-48.8	0	0	0	0	115.8	R146 N150 D151	R146-S148 PolarHBondContact O-N 3.37Å; S148-N150 PolarHBondContact O-N 3.36Å; S148-N150 VanDerWaalsContact O-N 3.16Å; S148-D151 PolarHBondContact O-N 3.38Å
149	N	63.3	Low	82.4	Confident	141 Å²	141	71 Å²	71	75%	0.754	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-63.3	-23.9	-173.5	-73.1	-7.2	0	0	0	113.8	N147	N147-N149 PolarHBondContact O-N 3.3Å; N147-N149 VanDerWaalsContact O-N 3.11Å; N147-N149 PolarHBondContact OD1-N 2.93Å
150	N	52.3	Low	82.2	Confident	103 Å²	103	72.6 Å²	72.6	55%	0.551	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-113.7	-1.8	179.7	-69.6	11.3	0	0	0	113.3	S148	S148-N150 PolarHBondContact O-N 3.36Å; S148-N150 VanDerWaalsContact O-N 3.16Å
151	D	54.3	Low	82.2	Confident	16 Å²	16	71.6 Å²	71.6	9%	0.086	39%	0.387	C	S	.	.			trans	-106.4	0.5	-153.1	-122.2	-50.5	0	0	0	114.7	R146 S148 S153	R146-D151 WeakPolarHBondContact CD-OD2 3.42Å; R146-D151 WeakPolarHBondContact CG-OD2 3.38Å; R146-D151 IonicContact CZ-OD1 3.24Å; R146-D151 IonicContact NE-OD2 2.81Å; R146-D151 IonicContact NH1-OD1 3.39Å; R146-D151 PolarHBondContact NH1-OD1 2.83Å; R146-D151 IonicContact NH1-OD2 2.7Å; S148-D151 PolarHBondContact O-N 3.38Å; D151-S153 VanDerWaalsContact C-N 3.25Å; D151-S153 PolarHBondContact O-N 2.87Å
152	S	57.4	Low	82.2	Confident	131 Å²	131	70.3 Å²	70.3	92%	0.916	38%	0.381	S	S	*	.	S	Bend	trans	-70.9	-22.8	-175.3	64.7	0	0	0	0	113.1
153	S	66.7	Low	82.2	Confident	48 Å²	48	69.8 Å²	69.8	34%	0.336	38%	0.379	S	S	.	.	S	Bend	trans	-109.9	117	173.2	85.6	0	0	0	0	109.8	D151 S155	D151-S153 VanDerWaalsContact C-N 3.25Å; D151-S153 PolarHBondContact O-N 2.87Å; S153-S155 PolarHBondContact O-N 2.93Å; S153-S155 PolarHBondContact OG-OG 2.85Å
154	L	81.7	Confident	82.2	Confident	68 Å²	68	66.3 Å²	66.3	36%	0.356	36%	0.361	S	S	.	.			trans	-73.7	61.6	167.3	-64.2	170.1	0	0	0	109	I25 H27 I43 F161	I25-L154 HydrophobicContact CG2-CB 4.37Å; I25-L154 HydrophobicContact CG2-CD2 4.13Å; H27-L154 HydrophobicContact CB-CD1 3.66Å; H27-L154 HydrophobicContact CB-CD2 4.19Å; I43-L154 HydrophobicContact CD1-CD2 4.4Å; L154-F161 HydrophobicContact CD2-CE2 4.29Å; L154-F161 HydrophobicContact CD2-CZ 4.24Å
155	S	85.8	Confident	82.3	Confident	53 Å²	53	65.9 Å²	65.9	37%	0.371	36%	0.359	S	S	.	.	S	Bend	trans	-131.4	156.5	-173.3	81.8	0	0	0	0	111.5	S153	S153-S155 PolarHBondContact O-N 2.93Å; S153-S155 PolarHBondContact OG-OG 2.85Å
156	F	88.1	Confident	82.4	Confident	47 Å²	47	61.3 Å²	61.3	21%	0.206	34%	0.341	C	S	.	.			trans	-85.5	118.7	175.3	-69.5	-89.8	0	0	0	109.1	V23 I25 L160 F161 I185 N187	V23-F156 HydrophobicContact CB-CE2 4.49Å; V23-F156 HydrophobicContact CB-CZ 4.11Å; V23-F156 HydrophobicContact CG1-CE2 4.42Å; V23-F156 HydrophobicContact CG1-CZ 3.73Å; I25-F156 HydrophobicContact CD1-CD2 4.35Å; I25-F156 HydrophobicContact CD1-CE1 4.13Å; I25-F156 HydrophobicContact CD1-CE2 3.72Å; I25-F156 HydrophobicContact CD1-CZ 3.59Å; I25-F156 HydrophobicContact CG1-CE2 3.92Å; I25-F156 HydrophobicContact CG1-CZ 3.96Å; F156-L160 WeakPolarHBondContact CA-O 3.41Å; F156-F161 HydrophobicContact CD1-CB 3.84Å; F156-F161 HydrophobicContact CE1-CB 3.84Å; F156-F161 HydrophobicContact CG-CB 4.49Å; F156-F161 HydrophobicContact CZ-CB 4.49Å; F156-I185 HydrophobicContact CE1-CG2 4.13Å; F156-I185 HydrophobicContact CZ-CG2 4.49Å; F156-N187 HydrophobicContact CD1-CB 4.05Å; F156-N187 HydrophobicContact CD2-CB 4.29Å; F156-N187 HydrophobicContact CE1-CB 3.9Å; F156-N187 HydrophobicContact CE2-CB 4.15Å; F156-N187 HydrophobicContact CG-CB 4.25Å; F156-N187 HydrophobicContact CZ-CB 3.96Å
157	E	86.9	Confident	82.6	Confident	124 Å²	124	59 Å²	59	58%	0.579	33%	0.333	S	S	*	.	B	Isolated β-bridge	trans	-96.8	125.1	169.1	-65.6	-175.4	174.7	0	0	108.2	N159 L160	E157-N159 PolarHBondContact O-N 2.81Å; E157-L160 PolarHBondContact N-O 3.04Å; E157-L160 WeakPolarHBondContact O-CA 3.46Å; E157-L160 WeakPolarHBondContact O-CB 3.33Å; E157-L160 PolarHBondContact O-N 2.92Å
158	D	88.9	Confident	82.9	Confident	150 Å²	150	59.2 Å²	59.2	80%	0.802	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	44.8	-173.8	-61.1	-32.2	0	0	0	112.6	L160 Q190	D158-L160 PolarHBondContact O-N 2.79Å; D158-L160 VanDerWaalsContact O-N 3.12Å; D158-Q190 PolarHBondContact O-NE2 2.84Å
159	N	91.5	Very high	83.9	Confident	71 Å²	71	55.4 Å²	55.4	38%	0.38	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	12.5	-178.3	-60.7	-45.1	0	0	0	114.6	E157 S186 N187 T188 Q190	E157-N159 PolarHBondContact O-N 2.81Å; N159-S186 WeakPolarHBondContact O-CA 3.45Å; N159-S186 WeakPolarHBondContact O-CB 3.34Å; N159-S186 PolarHBondContact O-OG 2.97Å; N159-N187 WeakPolarHBondContact CA-OD1 3.36Å; N159-N187 WeakPolarHBondContact CB-OD1 3.39Å; N159-N187 PolarHBondContact O-N 2.91Å; N159-N187 VanDerWaalsContact O-N 3.16Å; N159-N187 PolarHBondContact O-OD1 2.83Å; N159-N187 VanDerWaalsContact O-OD1 3.05Å; N159-N187 PolarHBondContact OD1-OD1 2.74Å; N159-T188 HydrophobicContact CB-CG2 3.98Å; N159-T188 WeakPolarHBondContact CB-OG1 3.07Å; N159-Q190 PolarHBondContact O-NE2 2.89Å
160	L	92.4	Very high	85.1	Confident	34 Å²	34	54.7 Å²	54.7	18%	0.178	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.7	-177	-168	73.4	0	0	0	110	F156 E157 D158 R184 F200	F156-L160 WeakPolarHBondContact CA-O 3.41Å; E157-L160 PolarHBondContact N-O 3.04Å; E157-L160 WeakPolarHBondContact O-CA 3.46Å; E157-L160 WeakPolarHBondContact O-CB 3.33Å; E157-L160 PolarHBondContact O-N 2.92Å; D158-L160 PolarHBondContact O-N 2.79Å; D158-L160 VanDerWaalsContact O-N 3.12Å; L160-R184 HydrophobicContact CD1-CB 4.13Å; L160-F200 HydrophobicContact CD1-CD2 4.37Å; L160-F200 HydrophobicContact CD1-CE1 4.26Å; L160-F200 HydrophobicContact CD1-CE2 3.73Å; L160-F200 HydrophobicContact CD1-CZ 3.67Å
161	F	93.2	Very high	86.8	Confident	7 Å²	7	56 Å²	56	3%	0.031	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.1	165.2	174.6	-100.8	0	0	0	107.9	I25 I43 L154 F156 I163 R184 I185	I25-F161 HydrophobicContact CD1-CB 3.41Å; I25-F161 VanDerWaalsContact CD1-CB 3.41Å; I25-F161 HydrophobicContact CD1-CD1 3.56Å; I25-F161 HydrophobicContact CD1-CD2 3.54Å; I25-F161 HydrophobicContact CD1-CE1 4.17Å; I25-F161 HydrophobicContact CD1-CE2 4.16Å; I25-F161 HydrophobicContact CD1-CG 3.19Å; I25-F161 HydrophobicContact CD1-CZ 4.44Å; I25-F161 HydrophobicContact CG2-CE1 4.24Å; I25-F161 HydrophobicContact CG2-CE2 4.41Å; I25-F161 HydrophobicContact CG2-CZ 4.13Å; I43-F161 HydrophobicContact CG2-CE1 3.99Å; I43-F161 HydrophobicContact CG2-CZ 4.4Å; L154-F161 HydrophobicContact CD2-CE2 4.29Å; L154-F161 HydrophobicContact CD2-CZ 4.24Å; F156-F161 HydrophobicContact CD1-CB 3.84Å; F156-F161 HydrophobicContact CE1-CB 3.84Å; F156-F161 HydrophobicContact CG-CB 4.49Å; F156-F161 HydrophobicContact CZ-CB 4.49Å; F161-I163 HydrophobicContact CE1-CB 4.13Å; F161-I163 HydrophobicContact CE1-CG2 4.21Å; F161-I163 HydrophobicContact CZ-CB 4.36Å; F161-R184 VanDerWaalsContact O-CA 3.25Å; F161-R184 WeakPolarHBondContact O-CA 3.18Å; F161-I185 HydrophobicContact CB-CG2 4.01Å; F161-I185 HydrophobicContact CD1-CG2 4.13Å; F161-I185 PolarHBondContact N-O 2.85Å; F161-I185 PolarHBondContact O-N 2.87Å
162	E	93.8	Very high	88.3	Confident	52 Å²	52	56.7 Å²	56.7	24%	0.243	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	132.3	176.8	-178.2	175.9	109.9	0	0	109.5	F183 R184	E162-F183 WeakPolarHBondContact CA-O 3.31Å; E162-R184 HydrophobicContact CB-CG 4.12Å; E162-R184 HydrophobicContact CG-CG 3.96Å; E162-R184 IonicContact OE2-CZ 2.88Å; E162-R184 VanDerWaalsContact OE2-CZ 3.26Å; E162-R184 IonicContact OE2-NE 3.67Å; E162-R184 PolarHBondContact OE2-NE 3.2Å; E162-R184 IonicContact OE2-NH2 3.08Å; E162-R184 PolarHBondContact OE2-NH2 3.23Å
163	I	94.2	Very high	89.6	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	139.9	168.5	179	169.9	0	0	0	109	I43 R146 F161 Y165 K182 F183	I43-I163 HydrophobicContact CD1-CD1 3.9Å; I43-I163 HydrophobicContact CG1-CD1 3.26Å; R146-I163 HydrophobicContact CG-CD1 4.13Å; R146-I163 HydrophobicContact CG-CG1 4.11Å; F161-I163 HydrophobicContact CE1-CB 4.13Å; F161-I163 HydrophobicContact CE1-CG2 4.21Å; F161-I163 HydrophobicContact CZ-CB 4.36Å; I163-Y165 HydrophobicContact CD1-CD2 4.46Å; I163-Y165 HydrophobicContact CD1-CE1 4.5Å; I163-Y165 HydrophobicContact CD1-CE2 3.52Å; I163-Y165 WeakPolarHBondContact CD1-OH 3.33Å; I163-Y165 HydrophobicContact CG1-CD2 4.29Å; I163-Y165 HydrophobicContact CG1-CE2 3.79Å; I163-K182 CarbonylContact O-C 3.55Å; I163-K182 VanDerWaalsContact O-CA 3.32Å; I163-K182 WeakPolarHBondContact O-CA 3.26Å; I163-F183 HydrophobicContact CG2-CB 3.71Å; I163-F183 HydrophobicContact CG2-CD2 4.15Å; I163-F183 HydrophobicContact CG2-CG 4.41Å; I163-F183 PolarHBondContact N-O 2.86Å; I163-F183 PolarHBondContact O-N 3.41Å
164	T	95.8	Very high	90.6	Very high	11 Å²	11	54.5 Å²	54.5	7%	0.067	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	129.6	-178.4	-65.3	0	0	0	0	110.8	R146 N147 N166 I180 K182	R146-T164 CarbonylContact C-O 3.59Å; R146-T164 WeakPolarHBondContact CA-O 3.46Å; N147-T164 HydrophobicContact CB-CG2 4.09Å; N147-T164 PolarHBondContact N-O 2.93Å; T164-N166 WeakPolarHBondContact CG2-OD1 3.44Å; T164-I180 HydrophobicContact CG2-CG2 3.49Å; T164-I180 VanDerWaalsContact CG2-CG2 3.49Å; T164-K182 HydrophobicContact CG2-CG 4.07Å
165	Y	96.4	Very high	90.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.7	173.6	-70.3	-80.8	0	0	0	110.8	D41 I58 A60 R146 I163 I180 I181 F183	D41-Y165 PolarHBondContact O-OH 3.4Å; D41-Y165 WeakPolarHBondContact OD2-CE1 3.22Å; D41-Y165 VanDerWaalsContact OD2-CZ 3.25Å; D41-Y165 PolarHBondContact OD2-OH 2.91Å; I58-Y165 HydrophobicContact CG2-CE2 4.32Å; A60-Y165 HydrophobicContact CB-CD1 3.66Å; A60-Y165 HydrophobicContact CB-CD2 4.17Å; A60-Y165 HydrophobicContact CB-CE1 3.95Å; A60-Y165 HydrophobicContact CB-CE2 4.43Å; A60-Y165 HydrophobicContact CB-CG 3.76Å; A60-Y165 WeakPolarHBondContact O-CD1 3.34Å; A60-Y165 WeakPolarHBondContact O-CE1 3.13Å; R146-Y165 HydrophobicContact CB-CD1 4.19Å; R146-Y165 HydrophobicContact CB-CE1 3.97Å; I163-Y165 HydrophobicContact CD1-CD2 4.46Å; I163-Y165 HydrophobicContact CD1-CE1 4.5Å; I163-Y165 HydrophobicContact CD1-CE2 3.52Å; I163-Y165 WeakPolarHBondContact CD1-OH 3.33Å; I163-Y165 HydrophobicContact CG1-CD2 4.29Å; I163-Y165 HydrophobicContact CG1-CE2 3.79Å; Y165-I180 CarbonylContact O-C 3.52Å; Y165-I180 WeakPolarHBondContact O-CA 3.41Å; Y165-I181 PolarHBondContact N-O 2.72Å; Y165-I181 PolarHBondContact O-N 3.25Å; Y165-F183 AromaticContact CD2-CD2 3.88Å; Y165-F183 HydrophobicContact CD2-CD2 3.88Å; Y165-F183 AromaticContact CD2-CE2 3.68Å; Y165-F183 HydrophobicContact CD2-CE2 3.68Å; Y165-F183 HydrophobicContact CE2-CD2 4.06Å; Y165-F183 HydrophobicContact CE2-CE2 4.02Å
166	N	95.7	Very high	91	Very high	39 Å²	39	61.7 Å²	61.7	21%	0.209	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	119.8	175.4	-62.8	-5.9	0	0	0	108.7	W144 K145 T164 I180	W144-N166 WeakPolarHBondContact CA-O 3.47Å; K145-N166 PolarHBondContact N-O 3.1Å; K145-N166 PolarHBondContact O-N 2.82Å; T164-N166 WeakPolarHBondContact CG2-OD1 3.44Å; N166-I180 WeakPolarHBondContact OD1-CG2 3.49Å
167	G	96.5	Very high	91.3	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.2	176.3	0	0	0	0	0	111	W144 V179	W144-G167 VanDerWaalsContact CE3-N 3.32Å; G167-V179 WeakPolarHBondContact CA-O 3.37Å; G167-V179 PolarHBondContact N-O 3.27Å; G167-V179 PolarHBondContact O-N 2.79Å; G167-V179 VanDerWaalsContact O-N 3.07Å
168	T	94.8	Very high	91.7	Very high	55 Å²	55	56.5 Å²	56.5	34%	0.337	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	151.5	170.9	58	0	0	0	0	110.4	Y142 N143 Q178	Y142-T168 CarbonylContact C-O 3.6Å; Y142-T168 WeakPolarHBondContact CA-O 3.39Å; N143-T168 PolarHBondContact N-O 3.02Å; N143-T168 PolarHBondContact O-N 3.13Å; T168-Q178 HydrophobicContact CG2-CG 4.14Å
169	S	92.7	Very high	92.1	Very high	13 Å²	13	49.4 Å²	49.4	9%	0.091	27%	0.265	C	S	.	.			trans	-126.5	144.6	177.2	-177.9	0	0	0	0	110.5	K171 M172	S169-K171 PolarHBondContact O-N 3.33Å; S169-K171 VanDerWaalsContact O-N 3.07Å; S169-K171 PolarHBondContact OG-N 2.93Å; S169-M172 PolarHBondContact N-SD 2.79Å; S169-M172 WeakPolarHBondContact O-CB 3.19Å; S169-M172 PolarHBondContact O-N 2.83Å
170	P	88.4	Confident	92.4	Very high	126 Å²	126	47 Å²	47	82%	0.818	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-18.2	169.5	-22.8	33.6	0	0	0	113.8	M172	P170-M172 VanDerWaalsContact C-N 3.31Å
171	K	87.1	Confident	92.7	Very high	129 Å²	129	45.4 Å²	45.4	56%	0.561	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-12	176.1	-64.2	177.3	179.7	169.6	0	113.4	E141 S169	E141-K171 IonicContact OE1-NZ 3.9Å; E141-K171 WeakPolarHBondContact OE2-CE 3.5Å; E141-K171 IonicContact OE2-NZ 2.85Å; E141-K171 PolarHBondContact OE2-NZ 3.34Å; S169-K171 PolarHBondContact O-N 3.33Å; S169-K171 VanDerWaalsContact O-N 3.07Å; S169-K171 PolarHBondContact OG-N 2.93Å
172	M	86.5	Confident	92.9	Very high	31 Å²	31	46.6 Å²	46.6	15%	0.153	25%	0.249	C	C	.	.			trans	-75.6	140.1	177.6	-71.9	169.2	160.2	0	0	110.5	Y142 S169 P170 E177 V179 L215	Y142-M172 HydrophobicContact CD1-CE 4.38Å; Y142-M172 HydrophobicContact CE1-CE 3.47Å; Y142-M172 VanDerWaalsContact CE1-CE 3.47Å; S169-M172 PolarHBondContact N-SD 2.79Å; S169-M172 WeakPolarHBondContact O-CB 3.19Å; S169-M172 PolarHBondContact O-N 2.83Å; P170-M172 VanDerWaalsContact C-N 3.31Å; M172-E177 WeakPolarHBondContact CA-OE2 3.43Å; M172-E177 HydrophobicContact CB-CB 3.91Å; M172-E177 WeakPolarHBondContact CB-OE2 3.36Å; M172-E177 HydrophobicContact CE-CB 4.35Å; M172-E177 HydrophobicContact CG-CB 3.93Å; M172-E177 WeakPolarHBondContact CG-OE2 3.41Å; M172-E177 HydrophobicContact SD-CB 3.88Å; M172-V179 HydrophobicContact CE-CG2 4.18Å; M172-L215 HydrophobicContact CE-CD2 3.74Å
173	T	84.7	Confident	93	Very high	100 Å²	100	44.2 Å²	44.2	61%	0.613	24%	0.237	S	C	*	.	S	Bend	trans	-85.2	-18.5	-171.7	72.1	0	0	0	0	113.4	E177 T216	T173-E177 PolarHBondContact N-OE1 3.1Å; T173-E177 VanDerWaalsContact N-OE1 3.12Å; T173-E177 PolarHBondContact N-OE2 3.49Å; T173-E177 PolarHBondContact OG1-OE1 2.93Å; T173-T216 HydrophobicContact CG2-CG2 4.48Å; T173-T216 PolarHBondContact OG1-OG1 2.77Å
174	S	87.7	Confident	93.1	Very high	34 Å²	34	44.3 Å²	44.3	24%	0.238	24%	0.238	C	C	.	.	S	Bend	trans	-137.1	143.9	-172.2	168.2	0	0	0	0	111.1	Y176 E177	S174-Y176 PolarHBondContact O-N 3.36Å; S174-Y176 VanDerWaalsContact O-N 3.15Å; S174-Y176 WeakPolarHBondContact OG-CD2 3.26Å; S174-Y176 PolarHBondContact OG-N 2.81Å; S174-E177 PolarHBondContact N-OE1 3.36Å; S174-E177 WeakPolarHBondContact O-CB 3.47Å; S174-E177 PolarHBondContact O-N 2.82Å; S174-E177 VanDerWaalsContact O-N 3.14Å
175	P	86.5	Confident	93	Very high	106 Å²	106	43.9 Å²	43.9	69%	0.688	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.9	177.3	28.9	-36.5	0	0	0	113.8
176	Y	89.5	Confident	92.9	Very high	166 Å²	166	43.9 Å²	43.9	65%	0.651	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-11.4	177.1	-56.9	-69.7	0	0	0	113.1	S174	S174-Y176 PolarHBondContact O-N 3.36Å; S174-Y176 VanDerWaalsContact O-N 3.15Å; S174-Y176 WeakPolarHBondContact OG-CD2 3.26Å; S174-Y176 PolarHBondContact OG-N 2.81Å
177	E	94.6	Very high	92.7	Very high	11 Å²	11	44.4 Å²	44.4	5%	0.051	24%	0.238	C	C	.	.			trans	-75.3	122.2	176.1	-70.4	179.7	-142.4	0	0	110	M172 T173 S174 N213 N214 L215 T216	M172-E177 WeakPolarHBondContact CA-OE2 3.43Å; M172-E177 HydrophobicContact CB-CB 3.91Å; M172-E177 WeakPolarHBondContact CB-OE2 3.36Å; M172-E177 HydrophobicContact CE-CB 4.35Å; M172-E177 HydrophobicContact CG-CB 3.93Å; M172-E177 WeakPolarHBondContact CG-OE2 3.41Å; M172-E177 HydrophobicContact SD-CB 3.88Å; T173-E177 PolarHBondContact N-OE1 3.1Å; T173-E177 VanDerWaalsContact N-OE1 3.12Å; T173-E177 PolarHBondContact N-OE2 3.49Å; T173-E177 PolarHBondContact OG1-OE1 2.93Å; S174-E177 PolarHBondContact N-OE1 3.36Å; S174-E177 WeakPolarHBondContact O-CB 3.47Å; S174-E177 PolarHBondContact O-N 2.82Å; S174-E177 VanDerWaalsContact O-N 3.14Å; E177-N213 WeakPolarHBondContact CA-O 3.32Å; E177-N214 VanDerWaalsContact CG-O 3.3Å; E177-N214 WeakPolarHBondContact CG-O 3.26Å; E177-L215 HydrophobicContact CB-CD2 4.29Å; E177-T216 PolarHBondContact OE1-OG1 2.89Å
178	Q	95.5	Very high	92.5	Very high	50 Å²	50	46.6 Å²	46.6	23%	0.234	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	141.9	-179.4	-59.9	-175.5	-5	0	0	110.9	T168 I180 N213	T168-Q178 HydrophobicContact CG2-CG 4.14Å; Q178-I180 HydrophobicContact CB-CG1 4.16Å; Q178-N213 PolarHBondContact N-O 2.85Å; Q178-N213 VanDerWaalsContact N-O 3.1Å; Q178-N213 PolarHBondContact O-N 2.64Å
179	V	97.4	Very high	92.4	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.6	161.2	178.7	0	0	0	0	106.7	M112 Y142 W144 G167 M172 L211 F212 L215	M112-V179 HydrophobicContact CE-CG2 4.44Å; M112-V179 HydrophobicContact SD-CG2 4.1Å; Y142-V179 HydrophobicContact CE1-CB 4.14Å; Y142-V179 HydrophobicContact CE1-CG2 3.71Å; W144-V179 HydrophobicContact CH2-CB 4.25Å; W144-V179 HydrophobicContact CH2-CG1 3.89Å; G167-V179 WeakPolarHBondContact CA-O 3.37Å; G167-V179 PolarHBondContact N-O 3.27Å; G167-V179 PolarHBondContact O-N 2.79Å; G167-V179 VanDerWaalsContact O-N 3.07Å; M172-V179 HydrophobicContact CE-CG2 4.18Å; V179-L211 WeakPolarHBondContact CA-O 3.5Å; V179-F212 HydrophobicContact CG1-CD1 4.13Å; V179-F212 HydrophobicContact CG1-CE1 4.05Å; V179-F212 HydrophobicContact CG2-CD1 4.12Å; V179-F212 HydrophobicContact CG2-CE1 4.43Å; V179-L215 HydrophobicContact CG2-CD1 4.47Å; V179-L215 HydrophobicContact CG2-CD2 4.35Å
180	I	97.5	Very high	92.3	Very high	20 Å²	20	49.5 Å²	49.5	10%	0.103	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.9	-178.2	-55.3	168.6	0	0	0	108.1	T164 Y165 N166 Q178 K182 L211	T164-I180 HydrophobicContact CG2-CG2 3.49Å; T164-I180 VanDerWaalsContact CG2-CG2 3.49Å; Y165-I180 CarbonylContact O-C 3.52Å; Y165-I180 WeakPolarHBondContact O-CA 3.41Å; N166-I180 WeakPolarHBondContact OD1-CG2 3.49Å; Q178-I180 HydrophobicContact CB-CG1 4.16Å; I180-K182 HydrophobicContact CG2-CG 4.23Å; I180-L211 HydrophobicContact CB-CB 4.08Å; I180-L211 HydrophobicContact CB-CD1 4.29Å; I180-L211 HydrophobicContact CG2-CD1 4.34Å; I180-L211 PolarHBondContact N-O 2.93Å; I180-L211 PolarHBondContact O-N 2.89Å
181	I	98.1	Very high	92.6	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.9	173.9	-55.3	174.8	0	0	0	108.2	P67 F109 W144 Y165 F183 D209	P67-I181 HydrophobicContact CB-CD1 3.78Å; P67-I181 HydrophobicContact CG-CD1 3.7Å; F109-I181 HydrophobicContact CB-CD1 4Å; F109-I181 HydrophobicContact CD1-CD1 3.76Å; F109-I181 HydrophobicContact CD2-CD1 4.38Å; F109-I181 HydrophobicContact CE1-CD1 4.37Å; F109-I181 HydrophobicContact CE1-CG2 4.11Å; F109-I181 HydrophobicContact CE2-CG2 4.45Å; F109-I181 HydrophobicContact CG-CD1 3.78Å; F109-I181 HydrophobicContact CZ-CG2 4.07Å; W144-I181 HydrophobicContact CH2-CD1 3.6Å; W144-I181 HydrophobicContact CH2-CG1 3.98Å; W144-I181 HydrophobicContact CZ2-CD1 4.29Å; W144-I181 HydrophobicContact CZ3-CD1 3.99Å; W144-I181 HydrophobicContact CZ3-CG1 4.04Å; Y165-I181 PolarHBondContact N-O 2.72Å; Y165-I181 PolarHBondContact O-N 3.25Å; I181-F183 HydrophobicContact CB-CE2 4.38Å; I181-F183 HydrophobicContact CB-CZ 4.47Å; I181-F183 HydrophobicContact CG2-CD2 4.3Å; I181-F183 HydrophobicContact CG2-CE1 3.91Å; I181-F183 HydrophobicContact CG2-CE2 3.61Å; I181-F183 HydrophobicContact CG2-CZ 3.38Å; I181-D209 CarbonylContact C-O 3.42Å; I181-D209 VanDerWaalsContact CA-O 3.28Å; I181-D209 WeakPolarHBondContact CA-O 3.48Å
182	K	96.9	Very high	92.8	Very high	32 Å²	32	41.2 Å²	41.2	14%	0.139	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	140.1	175.6	-51.8	-172.8	173.5	-171.8	0	108.8	I163 T164 I180 F208 D209 L211	I163-K182 CarbonylContact O-C 3.55Å; I163-K182 VanDerWaalsContact O-CA 3.32Å; I163-K182 WeakPolarHBondContact O-CA 3.26Å; T164-K182 HydrophobicContact CG2-CG 4.07Å; I180-K182 HydrophobicContact CG2-CG 4.23Å; K182-F208 CarbonylContact O-C 3.53Å; K182-F208 WeakPolarHBondContact O-CA 3.28Å; K182-F208 VanDerWaalsContact O-CB 3.31Å; K182-F208 WeakPolarHBondContact O-CB 3.38Å; K182-D209 HydrophobicContact CB-CB 4.11Å; K182-D209 HydrophobicContact CG-CB 4.36Å; K182-D209 PolarHBondContact N-O 2.86Å; K182-D209 PolarHBondContact O-N 3.01Å; K182-L211 HydrophobicContact CD-CD1 4.36Å; K182-L211 HydrophobicContact CG-CD1 4.19Å
183	F	96.9	Very high	93.1	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.009	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	142.4	171.3	-55.2	-84.6	0	0	0	109.6	I58 I69 F109 E162 I163 Y165 I181 V206 Q207 F208	I58-F183 HydrophobicContact CD1-CB 3.81Å; I58-F183 HydrophobicContact CD1-CD1 4.41Å; I58-F183 HydrophobicContact CD1-CG 4.17Å; I58-F183 HydrophobicContact CG2-CB 4.13Å; I58-F183 HydrophobicContact CG2-CD1 4.03Å; I58-F183 HydrophobicContact CG2-CD2 3.37Å; I58-F183 HydrophobicContact CG2-CE1 4.27Å; I58-F183 HydrophobicContact CG2-CE2 3.63Å; I58-F183 HydrophobicContact CG2-CG 3.57Å; I58-F183 HydrophobicContact CG2-CZ 4.07Å; I69-F183 HydrophobicContact CD1-CD1 3.79Å; I69-F183 HydrophobicContact CD1-CE1 3.66Å; I69-F183 HydrophobicContact CG1-CD1 3.91Å; I69-F183 HydrophobicContact CG1-CE1 3.59Å; I69-F183 HydrophobicContact CG1-CZ 4.47Å; F109-F183 HydrophobicContact CD2-CZ 4.34Å; F109-F183 AromaticContact CE2-CE1 3.54Å; F109-F183 HydrophobicContact CE2-CE1 3.54Å; F109-F183 AromaticContact CE2-CZ 3.71Å; F109-F183 HydrophobicContact CE2-CZ 3.71Å; F109-F183 AromaticContact CZ-CE1 3.8Å; F109-F183 HydrophobicContact CZ-CE1 3.8Å; F109-F183 HydrophobicContact CZ-CZ 4.19Å; E162-F183 WeakPolarHBondContact CA-O 3.31Å; I163-F183 HydrophobicContact CG2-CB 3.71Å; I163-F183 HydrophobicContact CG2-CD2 4.15Å; I163-F183 HydrophobicContact CG2-CG 4.41Å; I163-F183 PolarHBondContact N-O 2.86Å; I163-F183 PolarHBondContact O-N 3.41Å; Y165-F183 AromaticContact CD2-CD2 3.88Å; Y165-F183 HydrophobicContact CD2-CD2 3.88Å; Y165-F183 AromaticContact CD2-CE2 3.68Å; Y165-F183 HydrophobicContact CD2-CE2 3.68Å; Y165-F183 HydrophobicContact CE2-CD2 4.06Å; Y165-F183 HydrophobicContact CE2-CE2 4.02Å; I181-F183 HydrophobicContact CB-CE2 4.38Å; I181-F183 HydrophobicContact CB-CZ 4.47Å; I181-F183 HydrophobicContact CG2-CD2 4.3Å; I181-F183 HydrophobicContact CG2-CE1 3.91Å; I181-F183 HydrophobicContact CG2-CE2 3.61Å; I181-F183 HydrophobicContact CG2-CZ 3.38Å; F183-V206 HydrophobicContact CB-CG1 4.26Å; F183-V206 HydrophobicContact CD1-CG1 4.19Å; F183-Q207 CarbonylContact C-O 3.55Å; F183-Q207 WeakPolarHBondContact CA-O 3.35Å; F183-F208 HydrophobicContact CD1-CB 3.82Å; F183-F208 HydrophobicContact CE1-CB 4.1Å
184	R	95.5	Very high	93.5	Very high	3 Å²	3	45.2 Å²	45.2	1%	0.011	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	141.8	-178	-63.4	176.3	-169.5	104	11.2	111	L160 F161 E162 F200 V206 Q207 D209	L160-R184 HydrophobicContact CD1-CB 4.13Å; F161-R184 VanDerWaalsContact O-CA 3.25Å; F161-R184 WeakPolarHBondContact O-CA 3.18Å; E162-R184 HydrophobicContact CB-CG 4.12Å; E162-R184 HydrophobicContact CG-CG 3.96Å; E162-R184 IonicContact OE2-CZ 2.88Å; E162-R184 VanDerWaalsContact OE2-CZ 3.26Å; E162-R184 IonicContact OE2-NE 3.67Å; E162-R184 PolarHBondContact OE2-NE 3.2Å; E162-R184 IonicContact OE2-NH2 3.08Å; E162-R184 PolarHBondContact OE2-NH2 3.23Å; R184-F200 HydrophobicContact CB-CE1 3.92Å; R184-F200 HydrophobicContact CB-CZ 3.68Å; R184-V206 CarbonylContact O-C 3.52Å; R184-V206 WeakPolarHBondContact O-CA 3.37Å; R184-Q207 HydrophobicContact CB-CB 4.33Å; R184-Q207 PolarHBondContact N-O 2.98Å; R184-Q207 PolarHBondContact O-N 2.81Å; R184-D209 IonicContact CZ-OD1 3.9Å; R184-D209 IonicContact CZ-OD2 3.26Å; R184-D209 VanDerWaalsContact CZ-OD2 3.3Å; R184-D209 IonicContact NH1-OD1 3.91Å; R184-D209 PolarHBondContact NH1-OD1 2.75Å; R184-D209 IonicContact NH1-OD2 3.81Å; R184-D209 PolarHBondContact NH1-OD2 2.89Å; R184-D209 IonicContact NH2-OD1 3.07Å; R184-D209 IonicContact NH2-OD2 2.99Å; R184-D209 PolarHBondContact NH2-OD2 2.81Å
185	I	94.9	Very high	93.8	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	147.7	169.1	-169.6	147.2	0	0	0	109.1	I45 F156 F161 V206	I45-I185 HydrophobicContact CB-CD1 4.45Å; I45-I185 HydrophobicContact CD1-CB 4.46Å; I45-I185 HydrophobicContact CD1-CD1 4.34Å; I45-I185 HydrophobicContact CD1-CG2 3.85Å; I45-I185 HydrophobicContact CG1-CG2 4.22Å; I45-I185 HydrophobicContact CG2-CD1 3.79Å; I45-I185 HydrophobicContact CG2-CG2 4.41Å; F156-I185 HydrophobicContact CE1-CG2 4.13Å; F156-I185 HydrophobicContact CZ-CG2 4.49Å; F161-I185 HydrophobicContact CB-CG2 4.01Å; F161-I185 HydrophobicContact CD1-CG2 4.13Å; F161-I185 PolarHBondContact N-O 2.85Å; F161-I185 PolarHBondContact O-N 2.87Å; I185-V206 HydrophobicContact CD1-CG2 4.36Å
186	S	93.7	Very high	94.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	151.6	174.6	-169.9	0	0	0	0	111.2	N159 T188 Q190 P202 G203	N159-S186 WeakPolarHBondContact O-CA 3.45Å; N159-S186 WeakPolarHBondContact O-CB 3.34Å; N159-S186 PolarHBondContact O-OG 2.97Å; S186-T188 WeakPolarHBondContact CB-O 3.42Å; S186-T188 PolarHBondContact OG-N 2.94Å; S186-T188 VanDerWaalsContact OG-N 3.11Å; S186-T188 PolarHBondContact OG-O 2.83Å; S186-T188 VanDerWaalsContact OG-O 3.08Å; S186-T188 PolarHBondContact OG-OG1 2.95Å; S186-Q190 PolarHBondContact OG-NE2 2.85Å; S186-P202 WeakPolarHBondContact O-CA 3.36Å; S186-G203 PolarHBondContact O-N 3.11Å
187	N	91.9	Very high	94.3	Very high	51 Å²	51	34.2 Å²	34.2	27%	0.273	17%	0.165	S	C	.	.	S	Bend	trans	-93.1	4.2	167	66.9	-7.9	0	0	0	112.3	V23 F156 N159 P202	V23-N187 HydrophobicContact CB-CB 4.3Å; V23-N187 HydrophobicContact CG2-CB 4.47Å; F156-N187 HydrophobicContact CD1-CB 4.05Å; F156-N187 HydrophobicContact CD2-CB 4.29Å; F156-N187 HydrophobicContact CE1-CB 3.9Å; F156-N187 HydrophobicContact CE2-CB 4.15Å; F156-N187 HydrophobicContact CG-CB 4.25Å; F156-N187 HydrophobicContact CZ-CB 3.96Å; N159-N187 WeakPolarHBondContact CA-OD1 3.36Å; N159-N187 WeakPolarHBondContact CB-OD1 3.39Å; N159-N187 PolarHBondContact O-N 2.91Å; N159-N187 VanDerWaalsContact O-N 3.16Å; N159-N187 PolarHBondContact O-OD1 2.83Å; N159-N187 VanDerWaalsContact O-OD1 3.05Å; N159-N187 PolarHBondContact OD1-OD1 2.74Å; N187-P202 WeakPolarHBondContact O-CB 3.28Å
188	T	91.7	Very high	94.3	Very high	45 Å²	45	33.9 Å²	33.9	28%	0.276	16%	0.164	S	C	.	.	S	Bend	trans	-135.4	165.3	175.1	61.5	0	0	0	0	111.2	N159 S186 Q190	N159-T188 HydrophobicContact CB-CG2 3.98Å; N159-T188 WeakPolarHBondContact CB-OG1 3.07Å; S186-T188 WeakPolarHBondContact CB-O 3.42Å; S186-T188 PolarHBondContact OG-N 2.94Å; S186-T188 VanDerWaalsContact OG-N 3.11Å; S186-T188 PolarHBondContact OG-O 2.83Å; S186-T188 VanDerWaalsContact OG-O 3.08Å; S186-T188 PolarHBondContact OG-OG1 2.95Å; T188-Q190 PolarHBondContact O-N 2.8Å
189	T	92.3	Very high	94.2	Very high	73 Å²	73	32.6 Å²	32.6	45%	0.448	16%	0.159	S	C	.	.			trans	-81.9	111.5	169.5	-60.5	0	0	0	0	108.6	L199 F200 P202	T189-L199 HydrophobicContact CG2-CD1 3.99Å; T189-L199 HydrophobicContact CG2-CD2 4.38Å; T189-L199 HydrophobicContact CG2-CG 4.41Å; T189-F200 WeakPolarHBondContact CA-O 3.27Å; T189-P202 WeakPolarHBondContact OG1-CD 3.37Å
190	Q	91.6	Very high	94	Very high	56 Å²	56	32.6 Å²	32.6	26%	0.262	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	155.1	-179.7	58.1	173.8	-21.2	0	0	111.6	D158 N159 S186 T188 F200	D158-Q190 PolarHBondContact O-NE2 2.84Å; N159-Q190 PolarHBondContact O-NE2 2.89Å; S186-Q190 PolarHBondContact OG-NE2 2.85Å; T188-Q190 PolarHBondContact O-N 2.8Å; Q190-F200 HydrophobicContact CG-CD2 4.42Å; Q190-F200 PolarHBondContact N-O 3.37Å; Q190-F200 WeakPolarHBondContact O-CB 3.18Å; Q190-F200 WeakPolarHBondContact O-CD2 3.46Å; Q190-F200 PolarHBondContact O-N 2.8Å
191	H	93.2	Very high	93.7	Very high	71 Å²	71	35 Å²	35	33%	0.329	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	146.8	169.2	-73.1	-79.1	0	0	0	110.9	H197 L199 L254 D400	H191-H197 HydrophobicContact CB-CB 4.5Å; H191-H197 PolarHBondContact ND1-O 3.36Å; H191-L199 WeakPolarHBondContact NE2-CD1 3.38Å; H191-L254 WeakPolarHBondContact CE1-CD1 3.3Å; H191-D400 IonicContact CE1-OD1 3Å; H191-D400 PolarHBondContact CE1-OD1 3Å; H191-D400 VanDerWaalsContact CE1-OD1 3.25Å
192	H	93	Very high	93.3	Very high	11 Å²	11	35.9 Å²	35.9	5%	0.051	17%	0.174	C	C	.	.			trans	-67	149.8	169.6	-162.9	50	0	0	0	111.4	Y194 H197 L198 F200	H192-Y194 VanDerWaalsContact C-N 3.32Å; H192-Y194 AromaticContact NE2-CD2 3.46Å; H192-Y194 WeakPolarHBondContact NE2-CD2 3.35Å; H192-Y194 PolarHBondContact O-N 2.82Å; H192-H197 PolarHBondContact O-ND1 3.35Å; H192-L198 PolarHBondContact N-O 2.81Å; H192-L198 VanDerWaalsContact N-O 3.09Å; H192-F200 HydrophobicContact CB-CE2 3.89Å
193	K	91.9	Very high	92.5	Very high	150 Å²	150	34.4 Å²	34.4	65%	0.652	17%	0.168	S	C	*	.	S	Bend	trans	-72.9	-21.3	-177.8	71.6	-176.9	179.7	-171.4	0	114.6	H197	K193-H197 VanDerWaalsContact C-CE1 3.49Å; K193-H197 PolarHBondContact O-CE1 2.76Å; K193-H197 PolarHBondContact O-ND1 2.67Å
194	Y	93.4	Very high	92	Very high	65 Å²	65	36.7 Å²	36.7	26%	0.255	18%	0.176	S	C	.	.	S	Bend	trans	-103	146.4	179.5	-64.3	-60.3	0	0	0	110.6	H192 H197	H192-Y194 VanDerWaalsContact C-N 3.32Å; H192-Y194 AromaticContact NE2-CD2 3.46Å; H192-Y194 WeakPolarHBondContact NE2-CD2 3.35Å; H192-Y194 PolarHBondContact O-N 2.82Å; Y194-H197 WeakPolarHBondContact O-CA 3.11Å; Y194-H197 PolarHBondContact O-N 3.3Å
195	M	93.5	Very high	92	Very high	31 Å²	31	36.7 Å²	36.7	15%	0.153	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	141.7	171.1	-72.4	-170.4	175.6	0	0	111	H197 P256 F300 R306	M195-H197 VanDerWaalsContact C-N 3.33Å; M195-H197 VanDerWaalsContact CA-CD2 3.47Å; M195-H197 WeakPolarHBondContact CA-CD2 3.35Å; M195-H197 VanDerWaalsContact CA-N 3.34Å; M195-H197 VanDerWaalsContact CG-CD2 3.43Å; M195-H197 WeakPolarHBondContact CG-CD2 3.31Å; M195-H197 VanDerWaalsContact CG-NE2 3.26Å; M195-H197 WeakPolarHBondContact CG-NE2 3.37Å; M195-H197 PolarHBondContact N-NE2 3.28Å; M195-P256 HydrophobicContact CE-CG 4.28Å; M195-F300 HydrophobicContact CB-CE1 3.89Å; M195-F300 HydrophobicContact CB-CE2 4Å; M195-F300 HydrophobicContact CB-CZ 3.4Å; M195-F300 VanDerWaalsContact CB-CZ 3.4Å; M195-F300 HydrophobicContact CG-CZ 4.46Å; M195-F300 HydrophobicContact SD-CE1 4.18Å; M195-F300 HydrophobicContact SD-CZ 4.4Å; M195-R306 HydrophobicContact CB-CB 3.99Å; M195-R306 WeakPolarHBondContact CG-O 3.46Å; M195-R306 VanDerWaalsContact O-CD 3.24Å; M195-R306 WeakPolarHBondContact O-CD 3.46Å; M195-R306 PolarHBondContact O-NH1 3.33Å
196	P	94.2	Very high	92.1	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	cis	-88.6	24.8	8.4	33.3	-28.6	0	0	0	114.7	L198 T255 K296	P196-L198 VanDerWaalsContact C-N 3.29Å; P196-L198 HydrophobicContact CG-CD1 4.46Å; P196-L198 HydrophobicContact CG-CD2 4.13Å; P196-L198 HydrophobicContact CG-CG 4.01Å; P196-L198 PolarHBondContact O-N 2.9Å; P196-T255 HydrophobicContact CB-CG2 3.91Å; P196-T255 PolarHBondContact O-OG1 2.85Å; P196-K296 HydrophobicContact CB-CB 4.07Å; P196-K296 HydrophobicContact CB-CD 4.12Å; P196-K296 HydrophobicContact CB-CG 4.41Å; P196-K296 HydrophobicContact CG-CB 4.25Å
197	H	93.2	Very high	92.3	Very high	43 Å²	43	36.6 Å²	36.6	20%	0.199	18%	0.176	C	C	.	.			trans	53.3	41.1	173.9	-57.9	-83.6	0	0	0	113.5	H191 H192 K193 Y194 M195 L254	H191-H197 HydrophobicContact CB-CB 4.5Å; H191-H197 PolarHBondContact ND1-O 3.36Å; H192-H197 PolarHBondContact O-ND1 3.35Å; K193-H197 VanDerWaalsContact C-CE1 3.49Å; K193-H197 PolarHBondContact O-CE1 2.76Å; K193-H197 PolarHBondContact O-ND1 2.67Å; Y194-H197 WeakPolarHBondContact O-CA 3.11Å; Y194-H197 PolarHBondContact O-N 3.3Å; M195-H197 VanDerWaalsContact C-N 3.33Å; M195-H197 VanDerWaalsContact CA-CD2 3.47Å; M195-H197 WeakPolarHBondContact CA-CD2 3.35Å; M195-H197 VanDerWaalsContact CA-N 3.34Å; M195-H197 VanDerWaalsContact CG-CD2 3.43Å; M195-H197 WeakPolarHBondContact CG-CD2 3.31Å; M195-H197 VanDerWaalsContact CG-NE2 3.26Å; M195-H197 WeakPolarHBondContact CG-NE2 3.37Å; M195-H197 PolarHBondContact N-NE2 3.28Å; H197-L254 HydrophobicContact CB-CB 4.2Å; H197-L254 HydrophobicContact CB-CD2 4.49Å; H197-L254 PolarHBondContact CD2-O 2.91Å
198	L	94.2	Very high	92.6	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-59.6	147.3	-179.9	-59.2	-179.8	0	0	0	110.9	H192 P196 Q207 M261 K296 T389 S391	H192-L198 PolarHBondContact N-O 2.81Å; H192-L198 VanDerWaalsContact N-O 3.09Å; P196-L198 VanDerWaalsContact C-N 3.29Å; P196-L198 HydrophobicContact CG-CD1 4.46Å; P196-L198 HydrophobicContact CG-CD2 4.13Å; P196-L198 HydrophobicContact CG-CG 4.01Å; P196-L198 PolarHBondContact O-N 2.9Å; L198-Q207 PolarHBondContact O-NE2 2.9Å; L198-M261 HydrophobicContact CD2-CE 4.09Å; L198-K296 HydrophobicContact CD2-CG 4.03Å; L198-T389 HydrophobicContact CD1-CG2 4.09Å; L198-S391 VanDerWaalsContact CD1-OG 3.29Å; L198-S391 WeakPolarHBondContact CD1-OG 3.36Å
199	L	93.7	Very high	92.9	Very high	24 Å²	24	32 Å²	32	13%	0.126	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	136.2	179.5	-171.5	69.3	0	0	0	111.3	T189 H191 Q207 P398	T189-L199 HydrophobicContact CG2-CD1 3.99Å; T189-L199 HydrophobicContact CG2-CD2 4.38Å; T189-L199 HydrophobicContact CG2-CG 4.41Å; H191-L199 WeakPolarHBondContact NE2-CD1 3.38Å; L199-Q207 PolarHBondContact O-NE2 3.06Å; L199-P398 HydrophobicContact CB-CB 4.1Å; L199-P398 HydrophobicContact CB-CG 4.25Å; L199-P398 HydrophobicContact CD2-CB 3.69Å; L199-P398 HydrophobicContact CG-CB 4.38Å
200	F	93.4	Very high	93.2	Very high	1 Å²	1	28.7 Å²	28.7	0%	0.004	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	148.3	165	-70.4	-80.4	0	0	0	111	L160 R184 T189 Q190 H192 Q207	L160-F200 HydrophobicContact CD1-CD2 4.37Å; L160-F200 HydrophobicContact CD1-CE1 4.26Å; L160-F200 HydrophobicContact CD1-CE2 3.73Å; L160-F200 HydrophobicContact CD1-CZ 3.67Å; R184-F200 HydrophobicContact CB-CE1 3.92Å; R184-F200 HydrophobicContact CB-CZ 3.68Å; T189-F200 WeakPolarHBondContact CA-O 3.27Å; Q190-F200 HydrophobicContact CG-CD2 4.42Å; Q190-F200 PolarHBondContact N-O 3.37Å; Q190-F200 WeakPolarHBondContact O-CB 3.18Å; Q190-F200 WeakPolarHBondContact O-CD2 3.46Å; Q190-F200 PolarHBondContact O-N 2.8Å; H192-F200 HydrophobicContact CB-CE2 3.89Å; F200-Q207 HydrophobicContact CD1-CG 3.9Å; F200-Q207 HydrophobicContact CE1-CB 3.53Å; F200-Q207 HydrophobicContact CE1-CG 3.29Å; F200-Q207 VanDerWaalsContact CE2-CD 3.42Å; F200-Q207 HydrophobicContact CE2-CG 4.3Å; F200-Q207 VanDerWaalsContact CE2-OE1 3.3Å; F200-Q207 HydrophobicContact CZ-CB 3.64Å; F200-Q207 HydrophobicContact CZ-CG 3.53Å
201	K	91.4	Very high	93.5	Very high	70 Å²	70	26.3 Å²	26.3	30%	0.304	12%	0.118	S	C	.	.			trans	-124.8	138.1	161.2	-72.1	-163.8	173.6	-157	0	109.4	E18 G203 W204 I205	E18-K201 IonicContact OE1-NZ 3.74Å; K201-G203 PolarHBondContact O-N 3.28Å; K201-W204 HydrophobicContact CB-CB 4.36Å; K201-W204 PolarHBondContact O-N 2.6Å; K201-I205 HydrophobicContact CB-CD1 3.92Å; K201-I205 HydrophobicContact CB-CG1 4.21Å; K201-I205 HydrophobicContact CG-CD1 4.06Å
202	P	88.1	Confident	93.7	Very high	21 Å²	21	23 Å²	23	14%	0.136	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	119.8	-168.4	24.6	-35	0	0	0	112	W21 V23 S186 N187 T189 W204	W21-P202 HydrophobicContact CB-CB 4.18Å; W21-P202 HydrophobicContact CB-CG 4.24Å; V23-P202 HydrophobicContact CG2-CB 4.26Å; S186-P202 WeakPolarHBondContact O-CA 3.36Å; N187-P202 WeakPolarHBondContact O-CB 3.28Å; T189-P202 WeakPolarHBondContact OG1-CD 3.37Å; P202-W204 PolarHBondContact O-N 2.79Å
203	G	80.6	Confident	93.9	Very high	1 Å²	1	25 Å²	25	1%	0.01	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	-1.4	176.2	0	0	0	0	0	116.2	V54 S186 K201	V54-G203 WeakPolarHBondContact CG1-O 3.42Å; S186-G203 PolarHBondContact O-N 3.11Å; K201-G203 PolarHBondContact O-N 3.28Å
204	W	87.3	Confident	94.1	Very high	50 Å²	50	20.4 Å²	20.4	19%	0.189	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-27.5	-171.4	-77.6	54	0	0	0	113.9	W21 K201 P202 P289 G393 L394	W21-W204 AromaticContact CD2-CD1 3.85Å; W21-W204 AromaticContact CD2-NE1 3.23Å; W21-W204 AromaticContact CE2-CD1 3.95Å; W21-W204 AromaticContact CE2-CE2 3.72Å; W21-W204 AromaticContact CE2-NE1 2.97Å; W21-W204 AromaticContact CE3-CD1 3.99Å; W21-W204 AromaticContact CE3-NE1 3.4Å; W21-W204 AromaticContact CH2-CE2 3.63Å; W21-W204 AromaticContact CH2-CZ2 3.53Å; W21-W204 HydrophobicContact CH2-CZ2 3.53Å; W21-W204 AromaticContact CH2-NE1 3.18Å; W21-W204 AromaticContact CZ2-CE2 3.37Å; W21-W204 AromaticContact CZ2-CZ2 3.23Å; W21-W204 HydrophobicContact CZ2-CZ2 3.23Å; W21-W204 AromaticContact CZ2-NE1 2.99Å; W21-W204 HydrophobicContact CZ3-CZ2 4.5Å; W21-W204 AromaticContact CZ3-NE1 3.36Å; W21-W204 AromaticContact NE1-NE1 3.59Å; K201-W204 HydrophobicContact CB-CB 4.36Å; K201-W204 PolarHBondContact O-N 2.6Å; P202-W204 PolarHBondContact O-N 2.79Å; W204-P289 HydrophobicContact CH2-CB 4.05Å; W204-P289 HydrophobicContact CH2-CG 4.07Å; W204-P289 HydrophobicContact CZ3-CB 3.82Å; W204-P289 HydrophobicContact CZ3-CG 4.3Å; W204-G393 CarbonylContact O-C 3.53Å; W204-G393 WeakPolarHBondContact O-CA 3.34Å; W204-L394 HydrophobicContact CD2-CB 4.39Å; W204-L394 HydrophobicContact CE3-CB 3.71Å; W204-L394 VanDerWaalsContact CE3-O 3.25Å; W204-L394 HydrophobicContact CZ3-CB 4Å; W204-L394 PolarHBondContact O-N 2.95Å
205	I	95.6	Very high	94.2	Very high	2 Å²	2	17.6 Å²	17.6	1%	0.01	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	122.3	-171.9	-57.7	-179.7	0	0	0	109.4	K201 Q207 F292 P398	K201-I205 HydrophobicContact CB-CD1 3.92Å; K201-I205 HydrophobicContact CB-CG1 4.21Å; K201-I205 HydrophobicContact CG-CD1 4.06Å; I205-Q207 HydrophobicContact CG2-CG 4.35Å; I205-F292 HydrophobicContact CD1-CZ 3.95Å; I205-F292 HydrophobicContact CG1-CZ 4.04Å; I205-P398 HydrophobicContact CD1-CG 3.94Å
206	V	97.2	Very high	94.3	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	118.2	165.3	-176.7	0	0	0	0	107.7	V56 I58 I69 F183 R184 I185 F392	V56-V206 HydrophobicContact CG1-CG2 3.54Å; I58-V206 HydrophobicContact CD1-CG1 3.81Å; I58-V206 HydrophobicContact CD1-CG2 4.31Å; I69-V206 HydrophobicContact CD1-CB 4.29Å; I69-V206 HydrophobicContact CD1-CG1 3.83Å; I69-V206 HydrophobicContact CG2-CG2 4.26Å; F183-V206 HydrophobicContact CB-CG1 4.26Å; F183-V206 HydrophobicContact CD1-CG1 4.19Å; R184-V206 CarbonylContact O-C 3.52Å; R184-V206 WeakPolarHBondContact O-CA 3.37Å; I185-V206 HydrophobicContact CD1-CG2 4.36Å; V206-F392 PolarHBondContact N-O 3.16Å; V206-F392 PolarHBondContact O-N 3.46Å
207	Q	97.6	Very high	94.3	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	148	166.1	-68.6	-175.9	12.9	0	0	109.4	F183 R184 L198 L199 F200 I205 A390 S391	F183-Q207 CarbonylContact C-O 3.55Å; F183-Q207 WeakPolarHBondContact CA-O 3.35Å; R184-Q207 HydrophobicContact CB-CB 4.33Å; R184-Q207 PolarHBondContact N-O 2.98Å; R184-Q207 PolarHBondContact O-N 2.81Å; L198-Q207 PolarHBondContact O-NE2 2.9Å; L199-Q207 PolarHBondContact O-NE2 3.06Å; F200-Q207 HydrophobicContact CD1-CG 3.9Å; F200-Q207 HydrophobicContact CE1-CB 3.53Å; F200-Q207 HydrophobicContact CE1-CG 3.29Å; F200-Q207 VanDerWaalsContact CE2-CD 3.42Å; F200-Q207 HydrophobicContact CE2-CG 4.3Å; F200-Q207 VanDerWaalsContact CE2-OE1 3.3Å; F200-Q207 HydrophobicContact CZ-CB 3.64Å; F200-Q207 HydrophobicContact CZ-CG 3.53Å; I205-Q207 HydrophobicContact CG2-CG 4.35Å; Q207-A390 WeakPolarHBondContact CA-O 3.34Å; Q207-S391 WeakPolarHBondContact CG-OG 3.44Å
208	F	98	Very high	94.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	145.1	174.4	59.8	-92.4	0	0	0	112.1	I69 L107 F109 K182 F183 V210 W388 T389 A390 F392	I69-F208 HydrophobicContact CD1-CD1 4.21Å; L107-F208 HydrophobicContact CD2-CD1 4.38Å; L107-F208 HydrophobicContact CD2-CE1 3.53Å; L107-F208 HydrophobicContact CD2-CZ 3.74Å; F109-F208 AromaticContact CE1-CD2 3.73Å; F109-F208 HydrophobicContact CE1-CD2 3.73Å; F109-F208 AromaticContact CE1-CE2 3.92Å; F109-F208 HydrophobicContact CE1-CE2 3.92Å; F109-F208 HydrophobicContact CE1-CG 4.39Å; F109-F208 HydrophobicContact CZ-CB 4.25Å; F109-F208 HydrophobicContact CZ-CD1 4.36Å; F109-F208 AromaticContact CZ-CD2 3.62Å; F109-F208 HydrophobicContact CZ-CD2 3.62Å; F109-F208 AromaticContact CZ-CE2 3.98Å; F109-F208 HydrophobicContact CZ-CE2 3.98Å; F109-F208 AromaticContact CZ-CG 3.82Å; F109-F208 HydrophobicContact CZ-CG 3.82Å; F109-F208 HydrophobicContact CZ-CZ 4.49Å; K182-F208 CarbonylContact O-C 3.53Å; K182-F208 WeakPolarHBondContact O-CA 3.28Å; K182-F208 VanDerWaalsContact O-CB 3.31Å; K182-F208 WeakPolarHBondContact O-CB 3.38Å; F183-F208 HydrophobicContact CD1-CB 3.82Å; F183-F208 HydrophobicContact CE1-CB 4.1Å; F208-V210 HydrophobicContact CD2-CG2 4.16Å; F208-V210 HydrophobicContact CE2-CG2 4.45Å; F208-W388 HydrophobicContact CE2-CE3 4.33Å; F208-W388 HydrophobicContact CE2-CH2 4.06Å; F208-W388 AromaticContact CE2-CZ3 3.73Å; F208-W388 HydrophobicContact CE2-CZ3 3.73Å; F208-W388 HydrophobicContact CZ-CH2 4.3Å; F208-W388 HydrophobicContact CZ-CZ3 4.39Å; F208-T389 VanDerWaalsContact O-CA 3.3Å; F208-T389 WeakPolarHBondContact O-CA 3.3Å; F208-A390 HydrophobicContact CE1-CB 4.06Å; F208-A390 HydrophobicContact CE2-CB 3.82Å; F208-A390 HydrophobicContact CZ-CB 3.51Å; F208-A390 PolarHBondContact N-O 2.92Å; F208-A390 PolarHBondContact O-N 2.89Å; F208-F392 HydrophobicContact CE1-CB 4.15Å
209	D	98.1	Very high	94.3	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.4	166.3	-68.3	-5.3	0	0	0	109.7	I181 K182 R184 L211 R306 V387 W388 T389	I181-D209 CarbonylContact C-O 3.42Å; I181-D209 VanDerWaalsContact CA-O 3.28Å; I181-D209 WeakPolarHBondContact CA-O 3.48Å; K182-D209 HydrophobicContact CB-CB 4.11Å; K182-D209 HydrophobicContact CG-CB 4.36Å; K182-D209 PolarHBondContact N-O 2.86Å; K182-D209 PolarHBondContact O-N 3.01Å; R184-D209 IonicContact CZ-OD1 3.9Å; R184-D209 IonicContact CZ-OD2 3.26Å; R184-D209 VanDerWaalsContact CZ-OD2 3.3Å; R184-D209 IonicContact NH1-OD1 3.91Å; R184-D209 PolarHBondContact NH1-OD1 2.75Å; R184-D209 IonicContact NH1-OD2 3.81Å; R184-D209 PolarHBondContact NH1-OD2 2.89Å; R184-D209 IonicContact NH2-OD1 3.07Å; R184-D209 IonicContact NH2-OD2 2.99Å; R184-D209 PolarHBondContact NH2-OD2 2.81Å; D209-L211 HydrophobicContact CB-CD1 3.63Å; D209-R306 IonicContact OD1-NH1 4Å; D209-R306 IonicContact OD2-CZ 3.31Å; D209-R306 IonicContact OD2-NH1 2.71Å; D209-R306 IonicContact OD2-NH2 3.55Å; D209-R306 PolarHBondContact OD2-NH2 2.89Å; D209-V387 HydrophobicContact CB-CG2 4.07Å; D209-W388 CarbonylContact C-O 3.48Å; D209-W388 WeakPolarHBondContact CA-O 3.48Å; D209-T389 WeakPolarHBondContact OD1-CB 3.4Å; D209-T389 WeakPolarHBondContact OD1-CG2 3.33Å; D209-T389 PolarHBondContact OD1-OG1 2.84Å
210	V	98.4	Very high	94.3	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.018	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.4	164.8	-175.2	0	0	0	0	108.2	F109 F208 F212 L226 V387 W388	F109-V210 HydrophobicContact CD1-CG2 3.94Å; F109-V210 HydrophobicContact CE1-CG2 3.5Å; F109-V210 VanDerWaalsContact CE1-CG2 3.5Å; F208-V210 HydrophobicContact CD2-CG2 4.16Å; F208-V210 HydrophobicContact CE2-CG2 4.45Å; V210-F212 HydrophobicContact CG1-CD1 4.31Å; V210-F212 HydrophobicContact CG1-CE1 3.64Å; V210-F212 HydrophobicContact CG1-CZ 4.09Å; V210-L226 HydrophobicContact CB-CD2 4.48Å; V210-L226 HydrophobicContact CG1-CD2 4.28Å; V210-L226 HydrophobicContact CG2-CD2 3.89Å; V210-V387 WeakPolarHBondContact O-CA 3.29Å; V210-W388 HydrophobicContact CB-CE3 4.43Å; V210-W388 HydrophobicContact CG2-CE3 4.24Å; V210-W388 PolarHBondContact N-O 3.07Å; V210-W388 PolarHBondContact O-N 3Å
211	L	98.1	Very high	94.5	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.026	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132	179.2	-58.2	73.1	0	0	0	110	V179 I180 K182 D209 F385 I386 V387	V179-L211 WeakPolarHBondContact CA-O 3.5Å; I180-L211 HydrophobicContact CB-CB 4.08Å; I180-L211 HydrophobicContact CB-CD1 4.29Å; I180-L211 HydrophobicContact CG2-CD1 4.34Å; I180-L211 PolarHBondContact N-O 2.93Å; I180-L211 PolarHBondContact O-N 2.89Å; K182-L211 HydrophobicContact CD-CD1 4.36Å; K182-L211 HydrophobicContact CG-CD1 4.19Å; D209-L211 HydrophobicContact CB-CD1 3.63Å; L211-F385 HydrophobicContact CD2-CE2 4.33Å; L211-F385 HydrophobicContact CD2-CZ 3.91Å; L211-F385 HydrophobicContact CG-CZ 4.4Å; L211-I386 CarbonylContact C-O 3.5Å; L211-I386 WeakPolarHBondContact CA-O 3.38Å; L211-V387 HydrophobicContact CD1-CG2 3.95Å; L211-V387 HydrophobicContact CD2-CG2 4.42Å; L211-V387 HydrophobicContact CG-CB 3.98Å; L211-V387 HydrophobicContact CG-CG2 3.68Å
212	F	97.8	Very high	94.7	Very high	1 Å²	1	28.5 Å²	28.5	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	112	166.1	-59.9	-26.3	0	0	0	107.2	M112 V179 V210 L215 F224 F372 Y380 F385 I386	M112-F212 HydrophobicContact CG-CE1 4.13Å; M112-F212 HydrophobicContact CG-CE2 4.35Å; M112-F212 HydrophobicContact CG-CZ 3.81Å; M112-F212 HydrophobicContact SD-CD1 3.81Å; M112-F212 HydrophobicContact SD-CD2 4.46Å; M112-F212 HydrophobicContact SD-CE1 3.52Å; M112-F212 VanDerWaalsContact SD-CE1 3.52Å; M112-F212 HydrophobicContact SD-CE2 4.19Å; M112-F212 HydrophobicContact SD-CG 4.29Å; M112-F212 HydrophobicContact SD-CZ 3.72Å; V179-F212 HydrophobicContact CG1-CD1 4.13Å; V179-F212 HydrophobicContact CG1-CE1 4.05Å; V179-F212 HydrophobicContact CG2-CD1 4.12Å; V179-F212 HydrophobicContact CG2-CE1 4.43Å; V210-F212 HydrophobicContact CG1-CD1 4.31Å; V210-F212 HydrophobicContact CG1-CE1 3.64Å; V210-F212 HydrophobicContact CG1-CZ 4.09Å; F212-L215 HydrophobicContact CB-CD1 3.67Å; F212-L215 HydrophobicContact CB-CG 4.16Å; F212-L215 HydrophobicContact CD1-CD1 4.17Å; F212-L215 HydrophobicContact CG-CD1 3.91Å; F212-F224 HydrophobicContact CD2-CB 3.62Å; F212-F224 HydrophobicContact CD2-CG 4.2Å; F212-F224 HydrophobicContact CE2-CB 3.57Å; F212-F224 HydrophobicContact CE2-CG 4.46Å; F212-F372 HydrophobicContact CD2-CD2 4.39Å; F212-F372 AromaticContact CE2-CD2 3.69Å; F212-F372 HydrophobicContact CE2-CD2 3.69Å; F212-F372 AromaticContact CE2-CE2 3.61Å; F212-F372 HydrophobicContact CE2-CE2 3.61Å; F212-F372 HydrophobicContact CZ-CE2 4.01Å; F212-Y380 HydrophobicContact CB-CE2 3.97Å; F212-Y380 PolarHBondContact O-OH 3.49Å; F212-F385 WeakPolarHBondContact O-CA 3.16Å; F212-I386 HydrophobicContact CB-CB 4.37Å; F212-I386 HydrophobicContact CD2-CB 4.37Å; F212-I386 HydrophobicContact CD2-CD1 4.29Å; F212-I386 PolarHBondContact N-O 3.3Å; F212-I386 PolarHBondContact O-N 3.05Å
213	N	96.5	Very high	95.1	Very high	53 Å²	53	27.6 Å²	27.6	28%	0.283	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	116.9	-173.5	-173.5	30	0	0	0	110.3	E177 Q178 L215 F385	E177-N213 WeakPolarHBondContact CA-O 3.32Å; Q178-N213 PolarHBondContact N-O 2.85Å; Q178-N213 VanDerWaalsContact N-O 3.1Å; Q178-N213 PolarHBondContact O-N 2.64Å; N213-L215 PolarHBondContact O-N 3.14Å; N213-F385 HydrophobicContact CB-CD2 4.4Å; N213-F385 HydrophobicContact CB-CE2 4.42Å
214	N	96.1	Very high	95.9	Very high	55 Å²	55	27.7 Å²	27.7	29%	0.294	14%	0.143	S	C	.	.	S	Bend	trans	54.5	21.3	174.2	-160.6	36	0	0	0	115.6	E177 K384	E177-N214 VanDerWaalsContact CG-O 3.3Å; E177-N214 WeakPolarHBondContact CG-O 3.26Å; N214-K384 WeakPolarHBondContact CA-O 3.47Å; N214-K384 PolarHBondContact N-O 3.18Å
215	L	96.1	Very high	96.4	Very high	6 Å²	6	25.3 Å²	25.3	3%	0.031	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-52.5	141.9	176.6	-56.7	-173.4	0	0	0	112	M112 M172 E177 V179 F212 N213 F224 Y380	M112-L215 HydrophobicContact CE-CD1 3.82Å; M112-L215 HydrophobicContact SD-CD1 3.65Å; M172-L215 HydrophobicContact CE-CD2 3.74Å; E177-L215 HydrophobicContact CB-CD2 4.29Å; V179-L215 HydrophobicContact CG2-CD1 4.47Å; V179-L215 HydrophobicContact CG2-CD2 4.35Å; F212-L215 HydrophobicContact CB-CD1 3.67Å; F212-L215 HydrophobicContact CB-CG 4.16Å; F212-L215 HydrophobicContact CD1-CD1 4.17Å; F212-L215 HydrophobicContact CG-CD1 3.91Å; N213-L215 PolarHBondContact O-N 3.14Å; L215-F224 HydrophobicContact CB-CE1 4.31Å; L215-F224 HydrophobicContact CB-CE2 4.27Å; L215-F224 HydrophobicContact CB-CZ 3.82Å; L215-F224 HydrophobicContact CD1-CD1 3.96Å; L215-F224 HydrophobicContact CD1-CE1 3.69Å; L215-F224 HydrophobicContact CD1-CE2 4.49Å; L215-F224 HydrophobicContact CD1-CG 4.46Å; L215-F224 HydrophobicContact CD1-CZ 3.99Å; L215-Y380 HydrophobicContact CB-CE1 3.89Å; L215-Y380 PolarHBondContact N-OH 2.77Å; L215-Y380 WeakPolarHBondContact O-CE1 3.48Å
216	T	94.2	Very high	96.5	Very high	45 Å²	45	25.3 Å²	25.3	28%	0.276	13%	0.134	S	C	.	.	P	Polyproline II helix	trans	-72.8	132	175.5	-71.7	0	0	0	0	110.8	T173 E177	T173-T216 HydrophobicContact CG2-CG2 4.48Å; T173-T216 PolarHBondContact OG1-OG1 2.77Å; E177-T216 PolarHBondContact OE1-OG1 2.89Å
217	S	94	Very high	96.4	Very high	37 Å²	37	25.6 Å²	25.6	26%	0.259	14%	0.135	S	C	.	.	P	Polyproline II helix	trans	-92.2	121.6	172.8	-61.3	0	0	0	0	110.3	E114 S222	E114-S217 WeakPolarHBondContact OE1-CA 3.49Å; S217-S222 WeakPolarHBondContact CB-OG 3.14Å
218	H	93.5	Very high	96.4	Very high	75 Å²	75	25.6 Å²	25.6	35%	0.347	14%	0.135	S	C	.	.			trans	-97.4	-16.6	-177.8	-60.4	96.4	0	0	0	113.2	E114 R135 S222	E114-H218 IonicContact OE1-CG 3.99Å; E114-H218 PolarHBondContact OE1-N 3.09Å; E114-H218 IonicContact OE1-ND1 3.82Å; E114-H218 PolarHBondContact OE1-ND1 2.96Å; E114-H218 IonicContact OE2-CE1 2.79Å; E114-H218 IonicContact OE2-CG 3.58Å; E114-H218 IonicContact OE2-ND1 2.65Å; E114-H218 PolarHBondContact OE2-ND1 3.17Å; R135-H218 PolarHBondContact NH1-CD2 3.49Å; R135-H218 PolarHBondContact NH1-NE2 2.72Å; H218-S222 PolarHBondContact N-OG 3.5Å
219	F	95	Very high	96.4	Very high	34 Å²	34	25.7 Å²	25.7	15%	0.149	14%	0.135	C	C	.	.	S	Bend	trans	-112.7	155.1	175.9	-49.5	-72.1	0	0	0	111.7	E114 N116 R135 Q221 S222	E114-F219 HydrophobicContact CG-CD2 3.96Å; E114-F219 HydrophobicContact CG-CE2 4.04Å; N116-F219 HydrophobicContact CB-CB 3.78Å; N116-F219 HydrophobicContact CB-CD1 3.91Å; N116-F219 HydrophobicContact CB-CD2 4.1Å; N116-F219 HydrophobicContact CB-CE1 4.48Å; N116-F219 HydrophobicContact CB-CG 3.67Å; R135-F219 HydrophobicContact CG-CE2 4.19Å; R135-F219 HydrophobicContact CG-CZ 3.99Å; F219-Q221 VanDerWaalsContact C-N 3.27Å; F219-Q221 PolarHBondContact O-N 2.88Å; F219-S222 VanDerWaalsContact C-OG 3.27Å; F219-S222 VanDerWaalsContact CA-OG 3.26Å; F219-S222 WeakPolarHBondContact CA-OG 3.41Å; F219-S222 VanDerWaalsContact CB-OG 3.32Å; F219-S222 WeakPolarHBondContact CB-OG 3.32Å; F219-S222 PolarHBondContact N-OG 2.8Å; F219-S222 PolarHBondContact O-N 3.47Å; F219-S222 PolarHBondContact O-OG 3.09Å
220	N	93.8	Very high	96.3	Very high	159 Å²	159	25.7 Å²	25.7	85%	0.85	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-35.7	176.3	-68.7	-15.1	0	0	0	112.3
221	Q	96.3	Very high	96.2	Very high	51 Å²	51	25.5 Å²	25.5	24%	0.238	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	46.4	178.8	-58.7	171.9	-96.7	0	0	110.3	N116 D117 L118 F219 R223 F379	N116-Q221 WeakPolarHBondContact OD1-CB 3.35Å; N116-Q221 PolarHBondContact OD1-N 3.3Å; D117-Q221 PolarHBondContact N-O 2.96Å; D117-Q221 WeakPolarHBondContact O-CB 3.28Å; D117-Q221 PolarHBondContact O-NE2 3.33Å; L118-Q221 PolarHBondContact O-NE2 3.29Å; F219-Q221 VanDerWaalsContact C-N 3.27Å; F219-Q221 PolarHBondContact O-N 2.88Å; Q221-R223 PolarHBondContact O-N 3.36Å; Q221-F379 HydrophobicContact CB-CD1 3.93Å; Q221-F379 HydrophobicContact CB-CD2 4.23Å; Q221-F379 HydrophobicContact CB-CE1 3.71Å; Q221-F379 HydrophobicContact CB-CE2 4.04Å; Q221-F379 HydrophobicContact CB-CG 4.2Å; Q221-F379 HydrophobicContact CB-CZ 3.8Å; Q221-F379 HydrophobicContact CG-CD2 4.23Å; Q221-F379 HydrophobicContact CG-CE1 4.13Å; Q221-F379 HydrophobicContact CG-CE2 3.7Å; Q221-F379 HydrophobicContact CG-CZ 3.66Å
222	S	96.9	Very high	96.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	123.8	-176.9	-63.2	0	0	0	0	112	E114 Y115 S217 H218 F219 Y380	E114-S222 PolarHBondContact OE1-OG 3.39Å; E114-S222 VanDerWaalsContact OE1-OG 3.14Å; Y115-S222 WeakPolarHBondContact O-CA 3.39Å; S217-S222 WeakPolarHBondContact CB-OG 3.14Å; H218-S222 PolarHBondContact N-OG 3.5Å; F219-S222 VanDerWaalsContact C-OG 3.27Å; F219-S222 VanDerWaalsContact CA-OG 3.26Å; F219-S222 WeakPolarHBondContact CA-OG 3.41Å; F219-S222 VanDerWaalsContact CB-OG 3.32Å; F219-S222 WeakPolarHBondContact CB-OG 3.32Å; F219-S222 PolarHBondContact N-OG 2.8Å; F219-S222 PolarHBondContact O-N 3.47Å; F219-S222 PolarHBondContact O-OG 3.09Å; S222-Y380 VanDerWaalsContact O-CB 3.31Å; S222-Y380 WeakPolarHBondContact O-CB 3.38Å; S222-Y380 PolarHBondContact O-N 3.38Å; S222-Y380 VanDerWaalsContact O-N 3.11Å
223	R	96.9	Very high	95.8	Very high	3 Å²	3	27.2 Å²	27.2	1%	0.011	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153.2	164.9	-67.5	-164.7	-177.6	-76.9	-2	110.2	E114 Y115 D117 D120 Q221 T374 D377 F379	E114-R223 CarbonylContact C-O 3.58Å; E114-R223 VanDerWaalsContact CA-O 3.3Å; E114-R223 WeakPolarHBondContact CA-O 3.36Å; Y115-R223 HydrophobicContact CD1-CB 4.34Å; Y115-R223 WeakPolarHBondContact CD1-O 3.48Å; Y115-R223 HydrophobicContact CE1-CB 3.71Å; Y115-R223 HydrophobicContact CE2-CB 3.95Å; Y115-R223 VanDerWaalsContact CZ-CB 3.49Å; Y115-R223 PolarHBondContact N-O 3.48Å; Y115-R223 PolarHBondContact O-N 3Å; D117-R223 HydrophobicContact CB-CB 4.44Å; D117-R223 HydrophobicContact CB-CG 3.87Å; D117-R223 WeakPolarHBondContact OD2-CD 3.42Å; D117-R223 IonicContact OD2-CZ 3.77Å; D117-R223 IonicContact OD2-NE 3.89Å; D117-R223 PolarHBondContact OD2-NE 2.8Å; D120-R223 IonicContact OD1-CZ 3.96Å; D120-R223 IonicContact OD1-NE 3.73Å; D120-R223 IonicContact OD1-NH2 3.63Å; D120-R223 PolarHBondContact OD1-NH2 2.68Å; Q221-R223 PolarHBondContact O-N 3.36Å; R223-T374 PolarHBondContact NH2-O 3.27Å; R223-D377 IonicContact CZ-OD1 2.67Å; R223-D377 IonicContact CZ-OD2 3.75Å; R223-D377 IonicContact NH1-OD1 2.75Å; R223-D377 PolarHBondContact NH1-OD1 3.23Å; R223-D377 IonicContact NH1-OD2 3.54Å; R223-D377 PolarHBondContact NH1-OD2 2.99Å; R223-D377 IonicContact NH2-OD1 3.3Å; R223-D377 PolarHBondContact NH2-OD1 3.29Å; R223-D377 IonicContact NH2-OD2 2.72Å; R223-F379 HydrophobicContact CG-CD1 4.03Å
224	F	97	Very high	95.4	Very high	3 Å²	3	25.4 Å²	25.4	1%	0.013	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	145.4	174.6	-69.6	-91.7	0	0	0	110.3	M112 L113 E114 F212 L215 F372 Y380	M112-F224 HydrophobicContact CE-CD1 3.98Å; M112-F224 HydrophobicContact CE-CE1 3.93Å; M112-F224 HydrophobicContact CG-CD1 4.04Å; M112-F224 HydrophobicContact SD-CD1 3.71Å; M112-F224 HydrophobicContact SD-CE1 4.23Å; L113-F224 CarbonylContact O-C 3.52Å; L113-F224 VanDerWaalsContact O-CA 3.28Å; L113-F224 WeakPolarHBondContact O-CA 3.45Å; E114-F224 HydrophobicContact CB-CD1 3.98Å; E114-F224 HydrophobicContact CB-CE1 3.66Å; E114-F224 HydrophobicContact CB-CZ 4.16Å; E114-F224 HydrophobicContact CG-CD1 4.45Å; E114-F224 HydrophobicContact CG-CE1 3.96Å; E114-F224 HydrophobicContact CG-CE2 4.41Å; E114-F224 HydrophobicContact CG-CZ 3.92Å; F212-F224 HydrophobicContact CD2-CB 3.62Å; F212-F224 HydrophobicContact CD2-CG 4.2Å; F212-F224 HydrophobicContact CE2-CB 3.57Å; F212-F224 HydrophobicContact CE2-CG 4.46Å; L215-F224 HydrophobicContact CB-CE1 4.31Å; L215-F224 HydrophobicContact CB-CE2 4.27Å; L215-F224 HydrophobicContact CB-CZ 3.82Å; L215-F224 HydrophobicContact CD1-CD1 3.96Å; L215-F224 HydrophobicContact CD1-CE1 3.69Å; L215-F224 HydrophobicContact CD1-CE2 4.49Å; L215-F224 HydrophobicContact CD1-CG 4.46Å; L215-F224 HydrophobicContact CD1-CZ 3.99Å; F224-F372 WeakPolarHBondContact O-CD2 3.4Å; F224-F372 PolarHBondContact O-N 3.04Å; F224-Y380 AromaticContact CD2-CD1 3.86Å; F224-Y380 HydrophobicContact CD2-CD1 3.86Å; F224-Y380 AromaticContact CD2-CD2 3.65Å; F224-Y380 HydrophobicContact CD2-CD2 3.65Å; F224-Y380 HydrophobicContact CD2-CE1 4.25Å; F224-Y380 HydrophobicContact CD2-CE2 4.05Å; F224-Y380 AromaticContact CD2-CG 3.51Å; F224-Y380 HydrophobicContact CD2-CG 3.51Å; F224-Y380 AromaticContact CE2-CD1 3.42Å; F224-Y380 HydrophobicContact CE2-CD1 3.42Å; F224-Y380 VanDerWaalsContact CE2-CD1 3.42Å; F224-Y380 HydrophobicContact CE2-CD2 4.1Å; F224-Y380 AromaticContact CE2-CE1 3.75Å; F224-Y380 HydrophobicContact CE2-CE1 3.75Å; F224-Y380 HydrophobicContact CE2-CE2 4.37Å; F224-Y380 AromaticContact CE2-CG 3.59Å; F224-Y380 HydrophobicContact CE2-CG 3.59Å
225	G	96.9	Very high	95.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	162.6	170.6	0	0	0	0	0	110.9	M112 L113 V370	M112-G225 CarbonylContact C-O 3.5Å; M112-G225 WeakPolarHBondContact CA-O 3.49Å; M112-G225 WeakPolarHBondContact CG-O 3.39Å; L113-G225 PolarHBondContact N-O 3.27Å; L113-G225 PolarHBondContact O-N 3.43Å; G225-V370 CarbonylContact C-O 3.59Å; G225-V370 WeakPolarHBondContact CA-O 3.34Å
226	L	97.3	Very high	94.7	Very high	2 Å²	2	26 Å²	26	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.3	179.1	-176.8	70.6	0	0	0	108.7	F109 L139 V210 L228 V370 F372 W388	F109-L226 HydrophobicContact CD1-CD2 4.13Å; L139-L226 HydrophobicContact CD1-CD1 4.15Å; V210-L226 HydrophobicContact CB-CD2 4.48Å; V210-L226 HydrophobicContact CG1-CD2 4.28Å; V210-L226 HydrophobicContact CG2-CD2 3.89Å; L226-L228 HydrophobicContact CD2-CD2 3.6Å; L226-L228 HydrophobicContact CD2-CG 4Å; L226-L228 HydrophobicContact CG-CD2 4.04Å; L226-L228 HydrophobicContact CG-CG 4.26Å; L226-V370 PolarHBondContact N-O 3.14Å; L226-V370 PolarHBondContact O-N 2.77Å; L226-F372 HydrophobicContact CB-CE2 3.98Å; L226-F372 HydrophobicContact CB-CZ 4.13Å; L226-W388 HydrophobicContact CD2-CE3 4.37Å; L226-W388 HydrophobicContact CD2-CZ3 3.94Å
227	Q	95.8	Very high	94.4	Very high	6 Å²	6	27.6 Å²	27.6	3%	0.028	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	120.2	167.8	-170.1	170.2	73.8	0	0	108.8	Y110 K111 L113 L367 L368 N369	Y110-Q227 WeakPolarHBondContact CB-O 3.24Å; Y110-Q227 HydrophobicContact CD1-CG 4.24Å; Y110-Q227 PolarHBondContact N-O 3.21Å; Y110-Q227 VanDerWaalsContact N-O 3.11Å; K111-Q227 HydrophobicContact CG-CB 3.74Å; K111-Q227 PolarHBondContact N-O 3.17Å; K111-Q227 PolarHBondContact O-N 2.82Å; L113-Q227 HydrophobicContact CD1-CB 4.24Å; Q227-L367 HydrophobicContact CG-CB 3.96Å; Q227-L367 HydrophobicContact CG-CD2 4.39Å; Q227-L368 WeakPolarHBondContact CA-O 3.47Å; Q227-N369 WeakPolarHBondContact CG-OD1 3.49Å; Q227-N369 PolarHBondContact NE2-OD1 3.3Å
228	L	97.7	Very high	94	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.9	175.7	-65.6	175.4	0	0	0	109.3	L107 V108 F109 L226 L367 L368 V370 W388	L107-L228 HydrophobicContact CD1-CB 3.95Å; L107-L228 HydrophobicContact CD1-CD1 4.29Å; L107-L228 HydrophobicContact CD1-CG 4.49Å; V108-L228 WeakPolarHBondContact O-CA 3.4Å; F109-L228 HydrophobicContact CD1-CD2 3.71Å; F109-L228 HydrophobicContact CE1-CD2 4Å; F109-L228 HydrophobicContact CG-CD2 4.14Å; L226-L228 HydrophobicContact CD2-CD2 3.6Å; L226-L228 HydrophobicContact CD2-CG 4Å; L226-L228 HydrophobicContact CG-CD2 4.04Å; L226-L228 HydrophobicContact CG-CG 4.26Å; L228-L367 CarbonylContact O-C 3.46Å; L228-L367 WeakPolarHBondContact O-CA 3.49Å; L228-L368 HydrophobicContact CB-CB 4.36Å; L228-L368 HydrophobicContact CD1-CD2 4.48Å; L228-L368 PolarHBondContact N-O 2.88Å; L228-L368 PolarHBondContact O-N 2.82Å; L228-V370 HydrophobicContact CD1-CG2 4.49Å; L228-W388 HydrophobicContact CD1-CH2 3.87Å; L228-W388 HydrophobicContact CD1-CZ3 4.07Å
229	M	97.2	Very high	93.7	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	115.4	173.7	172.9	171.8	59.1	0	0	109.3	V108 M231 L323 I336 T339 I365 L367	V108-M229 HydrophobicContact CB-CB 4.1Å; V108-M229 HydrophobicContact CB-CE 3.78Å; V108-M229 HydrophobicContact CG1-CE 3.72Å; V108-M229 HydrophobicContact CG2-CE 3.97Å; V108-M229 PolarHBondContact N-O 3.27Å; V108-M229 PolarHBondContact O-N 3.36Å; M229-M231 HydrophobicContact CE-CE 3.43Å; M229-M231 VanDerWaalsContact CE-CE 3.43Å; M229-M231 HydrophobicContact CG-CE 4.12Å; M229-M231 HydrophobicContact CG-CG 4.49Å; M229-M231 HydrophobicContact SD-CE 3.67Å; M229-L323 HydrophobicContact SD-CD1 4.23Å; M229-I336 HydrophobicContact CE-CG1 4.43Å; M229-I336 HydrophobicContact SD-CG1 4.34Å; M229-T339 HydrophobicContact CE-CG2 3.85Å; M229-I365 HydrophobicContact CG-CG2 3.53Å; M229-I365 HydrophobicContact SD-CG2 3.64Å; M229-L367 HydrophobicContact CB-CD2 3.62Å; M229-L367 HydrophobicContact CG-CD2 3.96Å; M229-L367 HydrophobicContact SD-CD2 4.48Å
230	M	97.5	Very high	93.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.7	-179.3	-53.7	179.3	-68.6	0	0	109.1	L107 F242 I264 L266 I293 Q320 I365 R366 L368	L107-M230 HydrophobicContact CD1-CG 4.09Å; M230-F242 HydrophobicContact CB-CD2 4.33Å; M230-F242 HydrophobicContact CB-CE2 4Å; M230-F242 HydrophobicContact CE-CD2 3.87Å; M230-F242 HydrophobicContact CE-CE2 4.49Å; M230-F242 HydrophobicContact SD-CD2 4.46Å; M230-I264 HydrophobicContact CE-CG2 4.43Å; M230-I264 HydrophobicContact SD-CD1 4.24Å; M230-I264 HydrophobicContact SD-CG2 3.91Å; M230-L266 HydrophobicContact CB-CD2 4.05Å; M230-L266 HydrophobicContact CG-CD2 4.44Å; M230-L266 HydrophobicContact SD-CD2 3.93Å; M230-I293 HydrophobicContact CG-CD1 3.66Å; M230-I293 HydrophobicContact SD-CD1 3.46Å; M230-I293 WeakPolarHBondContact SD-CD1 3.41Å; M230-Q320 HydrophobicContact CE-CG 3.84Å; M230-I365 WeakPolarHBondContact O-CA 3.31Å; M230-R366 HydrophobicContact CE-CB 3.88Å; M230-R366 PolarHBondContact N-O 2.84Å; M230-R366 PolarHBondContact O-N 2.64Å; M230-L368 HydrophobicContact CE-CB 3.88Å; M230-L368 HydrophobicContact SD-CB 4.08Å; M230-L368 HydrophobicContact SD-CD2 4.43Å
231	M	96.3	Very high	93.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.7	178	-56.7	179	172.5	0	0	110.4	Y105 A106 V108 M229 I336 P341 Y345 I363 S364 I365	Y105-M231 CarbonylContact C-O 3.52Å; Y105-M231 VanDerWaalsContact CA-O 3.31Å; Y105-M231 WeakPolarHBondContact CA-O 3Å; A106-M231 HydrophobicContact CB-CB 4.02Å; A106-M231 HydrophobicContact CB-CG 4.42Å; A106-M231 HydrophobicContact CB-SD 4.2Å; A106-M231 PolarHBondContact N-O 2.82Å; A106-M231 PolarHBondContact O-N 2.86Å; V108-M231 HydrophobicContact CG2-CE 4.19Å; M229-M231 HydrophobicContact CE-CE 3.43Å; M229-M231 VanDerWaalsContact CE-CE 3.43Å; M229-M231 HydrophobicContact CG-CE 4.12Å; M229-M231 HydrophobicContact CG-CG 4.49Å; M229-M231 HydrophobicContact SD-CE 3.67Å; M231-I336 HydrophobicContact CE-CG2 4.04Å; M231-P341 HydrophobicContact SD-CB 3.68Å; M231-P341 HydrophobicContact SD-CG 4.34Å; M231-Y345 HydrophobicContact CB-CE2 4.27Å; M231-Y345 HydrophobicContact SD-CD2 4.3Å; M231-Y345 HydrophobicContact SD-CE2 4.47Å; M231-I363 HydrophobicContact CB-CD1 4.3Å; M231-I363 HydrophobicContact SD-CD1 4.47Å; M231-S364 CarbonylContact C-O 3.56Å; M231-S364 VanDerWaalsContact CA-O 3.32Å; M231-S364 WeakPolarHBondContact CA-O 3.4Å; M231-I365 HydrophobicContact CE-CD1 4.31Å; M231-I365 HydrophobicContact CG-CG1 4.24Å
232	S	95.1	Very high	93.3	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	145	-179.9	179.3	0	0	0	0	111.8	Y105 L234 F242 L266 I363 S364	Y105-S232 VanDerWaalsContact CE1-OG 3.31Å; Y105-S232 WeakPolarHBondContact CE1-OG 3.29Å; S232-L234 PolarHBondContact O-N 3.03Å; S232-L234 VanDerWaalsContact O-N 3.11Å; S232-L234 PolarHBondContact OG-N 2.72Å; S232-F242 VanDerWaalsContact CB-CE1 3.44Å; S232-L266 WeakPolarHBondContact CB-O 3.33Å; S232-L266 PolarHBondContact OG-O 2.65Å; S232-I363 VanDerWaalsContact O-CB 3.32Å; S232-I363 WeakPolarHBondContact O-CB 3.41Å; S232-S364 PolarHBondContact N-O 3.47Å; S232-S364 PolarHBondContact O-N 2.8Å; S232-S364 VanDerWaalsContact O-N 3.1Å
233	N	91	Very high	93.1	Very high	42 Å²	42	21.6 Å²	21.6	23%	0.225	12%	0.119	C	C	.	.	S	Bend	trans	-54.1	-22.7	168	-179.4	33.9	0	0	0	113.3	Q103 S104 R348	Q103-N233 PolarHBondContact OE1-ND2 3.31Å; S104-N233 WeakPolarHBondContact O-CB 3.41Å; S104-N233 PolarHBondContact O-N 2.84Å; N233-R348 PolarHBondContact O-NH2 3Å; N233-R348 PolarHBondContact OD1-NH1 3.3Å
234	L	89.1	Confident	92.9	Very high	14 Å²	14	24.8 Å²	24.8	7%	0.073	13%	0.133	C	C	.	.	S	Bend	trans	-64.5	157.4	176.1	-63.5	-170.9	0	0	0	112.6	S232 L236 G267 N285 I363 S364	S232-L234 PolarHBondContact O-N 3.03Å; S232-L234 VanDerWaalsContact O-N 3.11Å; S232-L234 PolarHBondContact OG-N 2.72Å; L234-L236 HydrophobicContact CB-CD2 4.44Å; L234-G267 VanDerWaalsContact CD1-C 3.42Å; L234-N285 HydrophobicContact CD1-CB 4.24Å; L234-N285 HydrophobicContact CD2-CB 3.52Å; L234-I363 CarbonylContact O-C 3.42Å; L234-S364 VanDerWaalsContact C-OG 3.22Å; L234-S364 VanDerWaalsContact O-CB 3.31Å; L234-S364 WeakPolarHBondContact O-CB 3.3Å; L234-S364 PolarHBondContact O-N 2.81Å; L234-S364 PolarHBondContact O-OG 3.04Å
235	T	88.8	Confident	92.6	Very high	57 Å²	57	27 Å²	27	35%	0.35	14%	0.143	S	C	.	.			trans	-109.3	121	165.6	-52.7	0	0	0	0	108	K361 P362 S364	T235-K361 VanDerWaalsContact OG1-CB 3.25Å; T235-K361 WeakPolarHBondContact OG1-CB 3.19Å; T235-P362 WeakPolarHBondContact CB-O 3.3Å; T235-P362 HydrophobicContact CG2-CG 3.95Å; T235-P362 PolarHBondContact OG1-O 2.82Å; T235-S364 VanDerWaalsContact CA-OG 3.28Å; T235-S364 WeakPolarHBondContact CA-OG 3.25Å
236	L	88.8	Confident	92.4	Very high	16 Å²	16	30.3 Å²	30.3	8%	0.084	16%	0.163	C	C	.	.			trans	-118.1	136.4	-177.9	-64.8	-172.1	0	0	0	110	L234 E240 F242 S364	L234-L236 HydrophobicContact CB-CD2 4.44Å; L236-E240 WeakPolarHBondContact CA-OE2 3.46Å; L236-E240 HydrophobicContact CB-CB 4.17Å; L236-E240 HydrophobicContact CD2-CB 4.46Å; L236-F242 HydrophobicContact CD1-CD1 3.7Å; L236-F242 HydrophobicContact CD1-CE1 3.52Å; L236-F242 HydrophobicContact CD1-CG 4.36Å; L236-F242 HydrophobicContact CD1-CZ 4.06Å; L236-F242 HydrophobicContact CG-CE1 4.38Å; L236-S364 WeakPolarHBondContact CB-OG 3.12Å; L236-S364 VanDerWaalsContact CG-OG 3.27Å; L236-S364 WeakPolarHBondContact CG-OG 3.36Å; L236-S364 PolarHBondContact N-OG 3.26Å
237	D	87.1	Confident	92.1	Very high	79 Å²	79	33.1 Å²	33.1	42%	0.422	18%	0.178	S	C	.	.			trans	-62.4	149.2	169.7	-175.5	-88.4	0	0	0	110.5	T239 E240 R366	D237-T239 PolarHBondContact O-N 3.06Å; D237-T239 VanDerWaalsContact OD1-CB 3.29Å; D237-T239 WeakPolarHBondContact OD1-CB 3.35Å; D237-T239 WeakPolarHBondContact OD1-CG2 3.44Å; D237-T239 PolarHBondContact OD1-N 2.91Å; D237-T239 PolarHBondContact OD1-OG1 2.56Å; D237-E240 HydrophobicContact CB-CG 4.11Å; D237-E240 PolarHBondContact N-OE2 3.16Å; D237-E240 WeakPolarHBondContact O-CB 3.42Å; D237-E240 PolarHBondContact O-N 3.43Å; D237-R366 PolarHBondContact O-NH2 2.89Å
238	P	86	Confident	91.7	Very high	79 Å²	79	39.5 Å²	39.5	51%	0.513	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-25.7	175	-29.6	37.5	0	0	0	115	E240 L322	P238-E240 VanDerWaalsContact C-N 3.34Å; P238-L322 HydrophobicContact CB-CD1 3.92Å
239	T	87.5	Confident	91.1	Very high	60 Å²	60	42.3 Å²	42.3	37%	0.368	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-5.3	175.6	65.8	0	0	0	0	114.1	D237 K272	D237-T239 PolarHBondContact O-N 3.06Å; D237-T239 VanDerWaalsContact OD1-CB 3.29Å; D237-T239 WeakPolarHBondContact OD1-CB 3.35Å; D237-T239 WeakPolarHBondContact OD1-CG2 3.44Å; D237-T239 PolarHBondContact OD1-N 2.91Å; D237-T239 PolarHBondContact OD1-OG1 2.56Å; T239-K272 WeakPolarHBondContact O-CB 3.37Å; T239-K272 VanDerWaalsContact O-CG 3.22Å; T239-K272 WeakPolarHBondContact O-CG 3.32Å; T239-K272 PolarHBondContact O-N 3.03Å
240	E	90.2	Very high	90.3	Very high	32 Å²	32	49.5 Å²	49.5	15%	0.15	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	152	176.6	-66.4	-179.1	110.5	0	0	112.3	L236 D237 P238 S269 V270 R366	L236-E240 WeakPolarHBondContact CA-OE2 3.46Å; L236-E240 HydrophobicContact CB-CB 4.17Å; L236-E240 HydrophobicContact CD2-CB 4.46Å; D237-E240 HydrophobicContact CB-CG 4.11Å; D237-E240 PolarHBondContact N-OE2 3.16Å; D237-E240 WeakPolarHBondContact O-CB 3.42Å; D237-E240 PolarHBondContact O-N 3.43Å; P238-E240 VanDerWaalsContact C-N 3.34Å; E240-S269 PolarHBondContact OE1-OG 3.12Å; E240-V270 WeakPolarHBondContact CA-O 3.46Å; E240-R366 PolarHBondContact O-NE 2.8Å; E240-R366 PolarHBondContact O-NH2 2.93Å
241	E	92.4	Very high	89.5	Confident	20 Å²	20	50.2 Å²	50.2	9%	0.093	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	160.2	172.1	62.8	-170.2	178	0	0	111.2	S269 V270 K272 H319 Q320	E241-S269 VanDerWaalsContact O-CA 3.3Å; E241-S269 WeakPolarHBondContact O-CA 3.25Å; E241-V270 HydrophobicContact CG-CG1 3.65Å; E241-V270 PolarHBondContact N-O 2.7Å; E241-V270 PolarHBondContact O-N 3.38Å; E241-K272 HydrophobicContact CG-CG 4.32Å; E241-K272 WeakPolarHBondContact OE2-CE 3.36Å; E241-H319 IonicContact OE1-ND1 3.85Å; E241-H319 PolarHBondContact OE1-ND1 2.98Å; E241-H319 WeakPolarHBondContact OE2-CA 3.14Å; E241-H319 IonicContact OE2-ND1 2.81Å; E241-Q320 HydrophobicContact CB-CB 4.23Å; E241-Q320 HydrophobicContact CB-CG 4.38Å; E241-Q320 PolarHBondContact OE2-N 2.8Å; E241-Q320 VanDerWaalsContact OE2-N 3.1Å
242	F	94	Very high	88.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	140.1	173.7	-63.5	-58.8	0	0	0	109.7	M230 S232 L236 K244 I264 L266 E268 Q320 R366	M230-F242 HydrophobicContact CB-CD2 4.33Å; M230-F242 HydrophobicContact CB-CE2 4Å; M230-F242 HydrophobicContact CE-CD2 3.87Å; M230-F242 HydrophobicContact CE-CE2 4.49Å; M230-F242 HydrophobicContact SD-CD2 4.46Å; S232-F242 VanDerWaalsContact CB-CE1 3.44Å; L236-F242 HydrophobicContact CD1-CD1 3.7Å; L236-F242 HydrophobicContact CD1-CE1 3.52Å; L236-F242 HydrophobicContact CD1-CG 4.36Å; L236-F242 HydrophobicContact CD1-CZ 4.06Å; L236-F242 HydrophobicContact CG-CE1 4.38Å; F242-K244 PolarHBondContact O-N 2.85Å; F242-I264 HydrophobicContact CB-CG2 3.88Å; F242-L266 HydrophobicContact CB-CD2 4.19Å; F242-L266 HydrophobicContact CD1-CB 4.44Å; F242-L266 HydrophobicContact CD1-CD2 4.23Å; F242-L266 HydrophobicContact CD2-CD2 3.55Å; F242-L266 HydrophobicContact CE1-CB 4.5Å; F242-L266 WeakPolarHBondContact CE1-O 3.44Å; F242-L266 HydrophobicContact CE2-CD2 3.91Å; F242-L266 HydrophobicContact CG-CD2 3.73Å; F242-L266 HydrophobicContact CZ-CD2 4.41Å; F242-E268 WeakPolarHBondContact CA-O 3.48Å; F242-Q320 PolarHBondContact O-NE2 3.22Å; F242-R366 HydrophobicContact CD2-CB 3.92Å; F242-R366 HydrophobicContact CD2-CG 3.95Å; F242-R366 HydrophobicContact CE2-CB 3.76Å; F242-R366 HydrophobicContact CE2-CG 3.77Å
243	R	92.6	Very high	88.1	Confident	39 Å²	39	57.4 Å²	57.4	15%	0.147	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	128.6	-178.3	-177.3	177.8	171.8	-122.2	-15.2	110.3	E245 I264 L265 E268 Y282	R243-E245 IonicContact CZ-OE1 3.25Å; R243-E245 IonicContact NH1-OE1 2.72Å; R243-E245 IonicContact NH2-OE1 3.49Å; R243-E245 PolarHBondContact NH2-OE1 2.94Å; R243-I264 WeakPolarHBondContact O-CA 3.4Å; R243-L265 HydrophobicContact CB-CB 4.47Å; R243-L265 PolarHBondContact O-N 2.91Å; R243-E268 HydrophobicContact CB-CB 3.93Å; R243-E268 VanDerWaalsContact CD-OE2 3.28Å; R243-E268 WeakPolarHBondContact CD-OE2 3.32Å; R243-E268 IonicContact CZ-OE2 3.61Å; R243-E268 PolarHBondContact N-O 2.72Å; R243-E268 IonicContact NE-OE2 3.58Å; R243-E268 IonicContact NH1-OE2 2.8Å; R243-E268 PolarHBondContact NH1-OE2 3.22Å; R243-Y282 HydrophobicContact CG-CD1 4.05Å; R243-Y282 HydrophobicContact CG-CE1 4.13Å
244	K	92.8	Very high	87.7	Confident	70 Å²	70	57.5 Å²	57.5	30%	0.304	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121.9	170	-177.1	-177.8	178.2	178.8	0	108.3	F242 T262 N263 I316	F242-K244 PolarHBondContact O-N 2.85Å; K244-T262 HydrophobicContact CD-CG2 4.38Å; K244-T262 HydrophobicContact CG-CG2 3.99Å; K244-N263 WeakPolarHBondContact CA-O 3.32Å; K244-I316 PolarHBondContact NZ-O 2.86Å
245	E	91.6	Very high	87.5	Confident	51 Å²	51	57 Å²	57	24%	0.238	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	127.4	176	-179	177.7	-104.4	0	0	108.9	R243 L247 N263	R243-E245 IonicContact CZ-OE1 3.25Å; R243-E245 IonicContact NH1-OE1 2.72Å; R243-E245 IonicContact NH2-OE1 3.49Å; R243-E245 PolarHBondContact NH2-OE1 2.94Å; E245-L247 HydrophobicContact CG-CD2 3.86Å; E245-L247 HydrophobicContact CG-CG 4.3Å; E245-N263 HydrophobicContact CB-CB 4.47Å; E245-N263 PolarHBondContact N-O 3.43Å; E245-N263 PolarHBondContact O-N 3.11Å
246	V	92.1	Very high	87.3	Confident	68 Å²	68	57 Å²	57	41%	0.412	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	113	176.3	-179.6	0	0	0	0	107.7	E260	V246-E260 HydrophobicContact CG1-CG 3.43Å; V246-E260 VanDerWaalsContact CG1-CG 3.43Å; V246-E260 WeakPolarHBondContact CG1-OE1 3.12Å
247	L	90.8	Very high	87	Confident	62 Å²	62	58.9 Å²	58.9	33%	0.325	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	126.9	176.4	-58.6	179.7	0	0	0	108.9	E245 E260 M261 N263 T399	E245-L247 HydrophobicContact CG-CD2 3.86Å; E245-L247 HydrophobicContact CG-CG 4.3Å; L247-E260 WeakPolarHBondContact O-CA 3.27Å; L247-M261 HydrophobicContact CB-CB 4.39Å; L247-M261 PolarHBondContact N-O 2.9Å; L247-M261 PolarHBondContact O-N 3.06Å; L247-N263 VanDerWaalsContact CD1-ND2 3.33Å; L247-N263 WeakPolarHBondContact CD1-ND2 3.32Å; L247-T399 HydrophobicContact CD1-CG2 4.21Å
248	L	88.1	Confident	86.8	Confident	139 Å²	139	56 Å²	56	73%	0.728	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.2	171.8	-63	175	0	0	0	108.7	F259 E260	L248-F259 WeakPolarHBondContact CA-O 3.44Å; L248-E260 HydrophobicContact CD2-CB 4.18Å; L248-E260 HydrophobicContact CD2-CG 4.13Å
249	S	84.7	Confident	86.8	Confident	59 Å²	59	57 Å²	57	41%	0.413	31%	0.311	S	S	.	.			trans	-134	141.9	176.6	-173.5	0	0	0	0	109.8	D251 F259	S249-D251 PolarHBondContact O-N 2.84Å; S249-D251 WeakPolarHBondContact OG-CB 3.21Å; S249-D251 PolarHBondContact OG-N 3.11Å; S249-D251 VanDerWaalsContact OG-N 3.15Å; S249-F259 PolarHBondContact N-O 3.18Å; S249-F259 WeakPolarHBondContact O-CA 3.34Å; S249-F259 VanDerWaalsContact O-CB 3.23Å; S249-F259 WeakPolarHBondContact O-CB 3.37Å; S249-F259 WeakPolarHBondContact O-CD1 3.31Å
250	I	80.2	Confident	86.9	Confident	153 Å²	153	57.4 Å²	57.4	79%	0.785	31%	0.308	S	S	*	.	S	Bend	trans	-74.2	-16.8	171.5	-60.7	170	0	0	0	110.4	D252	I250-D252 PolarHBondContact O-N 3.08Å; I250-D252 VanDerWaalsContact O-N 3.14Å
251	D	80.2	Confident	87.1	Confident	14 Å²	14	56.8 Å²	56.8	8%	0.075	31%	0.305	C	S	.	.			trans	-70	105.8	177.5	-170.8	4.3	0	0	0	111.4	S249 E253 L402	S249-D251 PolarHBondContact O-N 2.84Å; S249-D251 WeakPolarHBondContact OG-CB 3.21Å; S249-D251 PolarHBondContact OG-N 3.11Å; S249-D251 VanDerWaalsContact OG-N 3.15Å; D251-E253 WeakPolarHBondContact OD1-CB 3.4Å; D251-E253 PolarHBondContact OD1-N 2.92Å; D251-E253 VanDerWaalsContact OD1-N 3.09Å; D251-L402 HydrophobicContact CB-CD2 3.61Å; D251-L402 HydrophobicContact CB-CG 4.5Å; D251-L402 PolarHBondContact OD2-N 2.75Å
252	D	79.5	Confident	87.2	Confident	55 Å²	55	55.9 Å²	55.9	29%	0.294	30%	0.301	S	S	.	.			trans	-115.3	13.4	172.6	75.7	-28.1	0	0	0	112.5	I250 L254 T255 P256 G257 F259	I250-D252 PolarHBondContact O-N 3.08Å; I250-D252 VanDerWaalsContact O-N 3.14Å; D252-L254 PolarHBondContact O-N 3.18Å; D252-L254 VanDerWaalsContact O-N 3.17Å; D252-T255 CarbonylContact O-C 3.56Å; D252-T255 PolarHBondContact O-N 3.23Å; D252-P256 VanDerWaalsContact O-CA 3.25Å; D252-P256 WeakPolarHBondContact O-CA 3.21Å; D252-P256 WeakPolarHBondContact O-CD 3.33Å; D252-G257 PolarHBondContact OD2-N 2.8Å; D252-F259 HydrophobicContact CB-CD1 4.04Å; D252-F259 HydrophobicContact CB-CE1 3.6Å; D252-F259 HydrophobicContact CB-CZ 4.22Å
253	E	82.4	Confident	87.3	Confident	96 Å²	96	56 Å²	56	45%	0.449	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-42.6	-173.3	-176.8	174.5	167.6	0	0	111.8	D251 S403	D251-E253 WeakPolarHBondContact OD1-CB 3.4Å; D251-E253 PolarHBondContact OD1-N 2.92Å; D251-E253 VanDerWaalsContact OD1-N 3.09Å; E253-S403 WeakPolarHBondContact OE1-CB 3.36Å; E253-S403 PolarHBondContact OE1-OG 2.96Å; E253-S403 WeakPolarHBondContact OE2-CB 3.41Å; E253-S403 PolarHBondContact OE2-N 3.39Å; E253-S403 PolarHBondContact OE2-OG 3.46Å
254	L	83.5	Confident	87.5	Confident	44 Å²	44	54.1 Å²	54.1	23%	0.23	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-17.8	179.2	-64.2	176.6	0	0	0	113.2	H191 H197 D252	H191-L254 WeakPolarHBondContact CE1-CD1 3.3Å; H197-L254 HydrophobicContact CB-CB 4.2Å; H197-L254 HydrophobicContact CB-CD2 4.49Å; H197-L254 PolarHBondContact CD2-O 2.91Å; D252-L254 PolarHBondContact O-N 3.18Å; D252-L254 VanDerWaalsContact O-N 3.17Å
255	T	84.1	Confident	87.6	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.031	28%	0.283	C	S	.	.	S	Bend	trans	-147.8	77.1	-179.9	-43.8	0	0	0	0	109.5	P196 D252 G257 N258 K296	P196-T255 HydrophobicContact CB-CG2 3.91Å; P196-T255 PolarHBondContact O-OG1 2.85Å; D252-T255 CarbonylContact O-C 3.56Å; D252-T255 PolarHBondContact O-N 3.23Å; T255-G257 PolarHBondContact O-N 3.11Å; T255-N258 HydrophobicContact CG2-CB 4Å; T255-N258 PolarHBondContact O-N 2.8Å; T255-N258 VanDerWaalsContact O-N 3.07Å; T255-K296 HydrophobicContact CG2-CD 4.14Å; T255-K296 PolarHBondContact OG1-NZ 2.75Å
256	P	84.7	Confident	87.7	Confident	55 Å²	55	48.9 Å²	48.9	36%	0.357	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	135.7	-170.2	-28.9	36.3	0	0	0	112.8	M195 D252 N258 V308	M195-P256 HydrophobicContact CE-CG 4.28Å; D252-P256 VanDerWaalsContact O-CA 3.25Å; D252-P256 WeakPolarHBondContact O-CA 3.21Å; D252-P256 WeakPolarHBondContact O-CD 3.33Å; P256-N258 VanDerWaalsContact C-N 3.26Å; P256-N258 PolarHBondContact O-N 2.95Å; P256-V308 HydrophobicContact CB-CG2 3.98Å
257	G	83.3	Confident	87.7	Confident	56 Å²	56	45.7 Å²	45.7	58%	0.577	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	0.6	-178.9	0	0	0	0	0	115.7	D252 T255	D252-G257 PolarHBondContact OD2-N 2.8Å; T255-G257 PolarHBondContact O-N 3.11Å
258	N	82.6	Confident	87.8	Confident	20 Å²	20	44 Å²	44	11%	0.107	24%	0.243	C	C	.	.			trans	-113.1	111.3	172.9	-168	-19.3	0	0	0	110.9	T255 P256 E260 P297	T255-N258 HydrophobicContact CG2-CB 4Å; T255-N258 PolarHBondContact O-N 2.8Å; T255-N258 VanDerWaalsContact O-N 3.07Å; P256-N258 VanDerWaalsContact C-N 3.26Å; P256-N258 PolarHBondContact O-N 2.95Å; N258-E260 PolarHBondContact OD1-N 2.97Å; N258-E260 VanDerWaalsContact OD1-N 3.08Å; N258-E260 PolarHBondContact OD1-O 3.1Å; N258-P297 WeakPolarHBondContact ND2-CD 3.44Å
259	F	85.4	Confident	87.9	Confident	100 Å²	100	37.4 Å²	37.4	44%	0.439	21%	0.208	S	C	.	.			trans	-104.9	11	-175.1	-57.4	-71.7	0	0	0	112.8	L248 S249 D252	L248-F259 WeakPolarHBondContact CA-O 3.44Å; S249-F259 PolarHBondContact N-O 3.18Å; S249-F259 WeakPolarHBondContact O-CA 3.34Å; S249-F259 VanDerWaalsContact O-CB 3.23Å; S249-F259 WeakPolarHBondContact O-CB 3.37Å; S249-F259 WeakPolarHBondContact O-CD1 3.31Å; D252-F259 HydrophobicContact CB-CD1 4.04Å; D252-F259 HydrophobicContact CB-CE1 3.6Å; D252-F259 HydrophobicContact CB-CZ 4.22Å
260	E	90.8	Very high	88.1	Confident	68 Å²	68	35 Å²	35	32%	0.318	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	139.6	-173.5	-169.7	-172.1	144.5	0	0	111.7	V246 L247 L248 N258 T262 P297	V246-E260 HydrophobicContact CG1-CG 3.43Å; V246-E260 VanDerWaalsContact CG1-CG 3.43Å; V246-E260 WeakPolarHBondContact CG1-OE1 3.12Å; L247-E260 WeakPolarHBondContact O-CA 3.27Å; L248-E260 HydrophobicContact CD2-CB 4.18Å; L248-E260 HydrophobicContact CD2-CG 4.13Å; N258-E260 PolarHBondContact OD1-N 2.97Å; N258-E260 VanDerWaalsContact OD1-N 3.08Å; N258-E260 PolarHBondContact OD1-O 3.1Å; E260-T262 PolarHBondContact OE1-OG1 2.81Å; E260-P297 HydrophobicContact CB-CG 4.09Å; E260-P297 HydrophobicContact CG-CG 4.45Å; E260-P297 VanDerWaalsContact O-CD 3.26Å; E260-P297 WeakPolarHBondContact O-CD 3.46Å
261	M	92.7	Very high	88.3	Confident	19 Å²	19	29.7 Å²	29.7	9%	0.094	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	123	165.5	-173.3	73.1	79.4	0	0	109.4	L198 L247 Q294 I295 K296	L198-M261 HydrophobicContact CD2-CE 4.09Å; L247-M261 HydrophobicContact CB-CB 4.39Å; L247-M261 PolarHBondContact N-O 2.9Å; L247-M261 PolarHBondContact O-N 3.06Å; M261-Q294 HydrophobicContact CE-CG 4.06Å; M261-Q294 HydrophobicContact CG-CG 3.75Å; M261-Q294 HydrophobicContact SD-CG 3.28Å; M261-Q294 WeakPolarHBondContact SD-CG 3.31Å; M261-I295 VanDerWaalsContact SD-C 3.59Å; M261-K296 HydrophobicContact CE-CD 4.01Å; M261-K296 HydrophobicContact CE-CG 3.42Å; M261-K296 VanDerWaalsContact CE-CG 3.42Å; M261-K296 HydrophobicContact SD-CB 4.32Å; M261-K296 HydrophobicContact SD-CG 3.42Å; M261-K296 WeakPolarHBondContact SD-CG 3.36Å
262	T	95	Very high	88.1	Confident	1 Å²	1	32 Å²	32	1%	0.006	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.8	171.9	-73.5	0	0	0	0	109.8	K244 E260 I295 I316	K244-T262 HydrophobicContact CD-CG2 4.38Å; K244-T262 HydrophobicContact CG-CG2 3.99Å; E260-T262 PolarHBondContact OE1-OG1 2.81Å; T262-I295 PolarHBondContact N-O 2.83Å; T262-I295 PolarHBondContact O-N 2.78Å; T262-I316 HydrophobicContact CG2-CD1 3.65Å
263	N	96	Very high	87.2	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	131	172.1	-57.6	-46.7	0	0	0	109.8	K244 E245 L247 L265 I293 Q294 P397	K244-N263 WeakPolarHBondContact CA-O 3.32Å; E245-N263 HydrophobicContact CB-CB 4.47Å; E245-N263 PolarHBondContact N-O 3.43Å; E245-N263 PolarHBondContact O-N 3.11Å; L247-N263 VanDerWaalsContact CD1-ND2 3.33Å; L247-N263 WeakPolarHBondContact CD1-ND2 3.32Å; N263-L265 HydrophobicContact CB-CD2 4.21Å; N263-I293 CarbonylContact C-O 3.6Å; N263-I293 WeakPolarHBondContact CA-O 3.31Å; N263-Q294 VanDerWaalsContact OD1-CG 3.31Å; N263-Q294 WeakPolarHBondContact OD1-CG 3.34Å; N263-Q294 PolarHBondContact OD1-NE2 2.83Å; N263-Q294 VanDerWaalsContact OD1-NE2 3.17Å; N263-P397 HydrophobicContact CB-CB 4.42Å; N263-P397 HydrophobicContact CB-CG 3.95Å; N263-P397 WeakPolarHBondContact OD1-CB 3.47Å
264	I	96.1	Very high	85.8	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	116.5	169.5	-58	169.8	0	0	0	107.8	M230 F242 R243 L266 F292 I293 L368	M230-I264 HydrophobicContact CE-CG2 4.43Å; M230-I264 HydrophobicContact SD-CD1 4.24Å; M230-I264 HydrophobicContact SD-CG2 3.91Å; F242-I264 HydrophobicContact CB-CG2 3.88Å; R243-I264 WeakPolarHBondContact O-CA 3.4Å; I264-L266 HydrophobicContact CG2-CD2 4.02Å; I264-F292 CarbonylContact O-C 3.48Å; I264-F292 WeakPolarHBondContact O-CA 3.38Å; I264-I293 HydrophobicContact CB-CB 4.34Å; I264-I293 PolarHBondContact N-O 2.87Å; I264-I293 PolarHBondContact O-N 2.7Å; I264-L368 HydrophobicContact CD1-CD1 3.55Å; I264-L368 HydrophobicContact CD1-CD2 3.26Å; I264-L368 HydrophobicContact CD1-CG 3.99Å
265	L	94.9	Very high	84.3	Confident	11 Å²	11	36.5 Å²	36.5	6%	0.058	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	107.3	-173.2	-53.1	179.4	0	0	0	109.9	R243 N263 G267 E268 F292 P397	R243-L265 HydrophobicContact CB-CB 4.47Å; R243-L265 PolarHBondContact O-N 2.91Å; N263-L265 HydrophobicContact CB-CD2 4.21Å; L265-G267 VanDerWaalsContact C-N 3.29Å; L265-G267 PolarHBondContact O-N 3.15Å; L265-E268 HydrophobicContact CB-CB 4.22Å; L265-E268 HydrophobicContact CB-CG 4.46Å; L265-E268 PolarHBondContact O-N 2.79Å; L265-F292 HydrophobicContact CD2-CB 3.95Å; L265-P397 HydrophobicContact CD2-CG 3.79Å
266	L	95.2	Very high	82.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-8.5	-171.7	-57.5	-173	0	0	0	114.2	Y105 M230 S232 F242 I264 A291 F392	Y105-L266 HydrophobicContact CD1-CB 3.63Å; Y105-L266 HydrophobicContact CD1-CD1 4.22Å; Y105-L266 HydrophobicContact CE1-CB 3.9Å; M230-L266 HydrophobicContact CB-CD2 4.05Å; M230-L266 HydrophobicContact CG-CD2 4.44Å; M230-L266 HydrophobicContact SD-CD2 3.93Å; S232-L266 WeakPolarHBondContact CB-O 3.33Å; S232-L266 PolarHBondContact OG-O 2.65Å; F242-L266 HydrophobicContact CB-CD2 4.19Å; F242-L266 HydrophobicContact CD1-CB 4.44Å; F242-L266 HydrophobicContact CD1-CD2 4.23Å; F242-L266 HydrophobicContact CD2-CD2 3.55Å; F242-L266 HydrophobicContact CE1-CB 4.5Å; F242-L266 WeakPolarHBondContact CE1-O 3.44Å; F242-L266 HydrophobicContact CE2-CD2 3.91Å; F242-L266 HydrophobicContact CG-CD2 3.73Å; F242-L266 HydrophobicContact CZ-CD2 4.41Å; I264-L266 HydrophobicContact CG2-CD2 4.02Å; L266-A291 HydrophobicContact CB-CB 4.3Å; L266-A291 HydrophobicContact CD1-CB 4.21Å; L266-A291 PolarHBondContact N-O 2.67Å; L266-F392 HydrophobicContact CD1-CE2 3.66Å; L266-F392 HydrophobicContact CD1-CZ 4.27Å
267	G	92.5	Very high	81	Confident	1 Å²	1	46 Å²	46	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	9	173.7	0	0	0	0	0	114	L234 L265 S290	L234-G267 VanDerWaalsContact CD1-C 3.42Å; L265-G267 VanDerWaalsContact C-N 3.29Å; L265-G267 PolarHBondContact O-N 3.15Å; G267-S290 WeakPolarHBondContact CA-OG 3.41Å; G267-S290 PolarHBondContact N-OG 3.2Å
268	E	91.4	Very high	79.7	Confident	26 Å²	26	49.9 Å²	49.9	12%	0.121	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.8	177	-61.4	-176.8	-168.2	0	0	109.3	F242 R243 L265 F283 K284	F242-E268 WeakPolarHBondContact CA-O 3.48Å; R243-E268 HydrophobicContact CB-CB 3.93Å; R243-E268 VanDerWaalsContact CD-OE2 3.28Å; R243-E268 WeakPolarHBondContact CD-OE2 3.32Å; R243-E268 IonicContact CZ-OE2 3.61Å; R243-E268 PolarHBondContact N-O 2.72Å; R243-E268 IonicContact NE-OE2 3.58Å; R243-E268 IonicContact NH1-OE2 2.8Å; R243-E268 PolarHBondContact NH1-OE2 3.22Å; L265-E268 HydrophobicContact CB-CB 4.22Å; L265-E268 HydrophobicContact CB-CG 4.46Å; L265-E268 PolarHBondContact O-N 2.79Å; E268-F283 WeakPolarHBondContact CA-O 3.45Å; E268-K284 HydrophobicContact CG-CB 4.43Å; E268-K284 HydrophobicContact CG-CG 4.32Å
269	S	90.5	Very high	78.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	156.5	175.8	65	0	0	0	0	112.7	E240 E241 F283	E240-S269 PolarHBondContact OE1-OG 3.12Å; E241-S269 VanDerWaalsContact O-CA 3.3Å; E241-S269 WeakPolarHBondContact O-CA 3.25Å; S269-F283 PolarHBondContact N-O 3.44Å; S269-F283 PolarHBondContact O-N 2.91Å
270	V	89.5	Confident	77.2	Confident	10 Å²	10	54.9 Å²	54.9	6%	0.061	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	141.9	169.4	66.7	0	0	0	0	108.8	E240 E241 E280 Y282	E240-V270 WeakPolarHBondContact CA-O 3.46Å; E241-V270 HydrophobicContact CG-CG1 3.65Å; E241-V270 PolarHBondContact N-O 2.7Å; E241-V270 PolarHBondContact O-N 3.38Å; V270-E280 HydrophobicContact CG2-CB 4.04Å; V270-E280 HydrophobicContact CG2-CG 4.2Å; V270-Y282 HydrophobicContact CB-CD1 4.45Å; V270-Y282 HydrophobicContact CG2-CD1 4.36Å; V270-Y282 HydrophobicContact CG2-CE1 4.26Å
271	S	84.9	Confident	75.8	Confident	40 Å²	40	57.8 Å²	57.8	28%	0.28	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	135.4	175.9	-53.8	0	0	0	0	110.9	I273	S271-I273 PolarHBondContact O-N 3.42Å; S271-I273 VanDerWaalsContact O-N 3.16Å
272	K	74.5	Confident	74.7	Confident	62 Å²	62	62.2 Å²	62.2	27%	0.27	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-12.7	176.9	-70	176.4	177.4	-178.5	0	114	T239 E241 N274 Q320	T239-K272 WeakPolarHBondContact O-CB 3.37Å; T239-K272 VanDerWaalsContact O-CG 3.22Å; T239-K272 WeakPolarHBondContact O-CG 3.32Å; T239-K272 PolarHBondContact O-N 3.03Å; E241-K272 HydrophobicContact CG-CG 4.32Å; E241-K272 WeakPolarHBondContact OE2-CE 3.36Å; K272-N274 PolarHBondContact O-N 3.07Å; K272-N274 VanDerWaalsContact O-N 3.15Å; K272-Q320 PolarHBondContact NZ-O 3.26Å
273	I	60.9	Low	73.4	Confident	128 Å²	128	65.7 Å²	65.7	66%	0.656	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-9.5	-166.6	-68	175.5	0	0	0	113.7	S271 N275	S271-I273 PolarHBondContact O-N 3.42Å; S271-I273 VanDerWaalsContact O-N 3.16Å; I273-N275 PolarHBondContact O-N 2.92Å
274	N	53.2	Low	72.2	Confident	48 Å²	48	72.3 Å²	72.3	26%	0.257	37%	0.366	S	S	.	.			trans	-107.3	72.5	-174.6	-65.3	0.7	0	0	0	112.5	K272 N276 D277 N279	K272-N274 PolarHBondContact O-N 3.07Å; K272-N274 VanDerWaalsContact O-N 3.15Å; N274-N276 VanDerWaalsContact C-N 3.25Å; N274-D277 HydrophobicContact CB-CB 4.07Å; N274-N279 PolarHBondContact ND2-O 3.48Å; N274-N279 VanDerWaalsContact ND2-O 3.09Å
275	N	52.1	Low	70.7	Confident	115 Å²	115	76.5 Å²	76.5	62%	0.615	39%	0.388	S	S	*	.	S	Bend	trans	-74.1	-21	163.6	-86.6	-32.4	0	0	0	112.2	I273	I273-N275 PolarHBondContact O-N 2.92Å
276	N	52	Low	69.3	Low	153 Å²	153	76.8 Å²	76.8	82%	0.818	39%	0.391	S	S	*	.	S	Bend	trans	-115.4	-21.9	-174.3	-69.6	-5.1	0	0	0	114.2	N274	N274-N276 VanDerWaalsContact C-N 3.25Å
277	D	48.5	Very low	67.9	Low	106 Å²	106	83.6 Å²	83.6	57%	0.567	43%	0.433	S	S	*	.			trans	-92.1	110	179.6	-72.5	-27.9	0	0	0	109.2	N274 N279	N274-D277 HydrophobicContact CB-CB 4.07Å; D277-N279 PolarHBondContact O-N 3.06Å
278	T	54.8	Low	67.1	Low	138 Å²	138	86.4 Å²	86.4	85%	0.847	45%	0.447	S	S	*	.	S	Bend	trans	-57.8	-4.7	174.2	44.8	0	0	0	0	114.2	E280	T278-E280 PolarHBondContact O-N 2.84Å
279	N	53.7	Low	66.2	Low	129 Å²	129	86.7 Å²	86.7	69%	0.69	45%	0.451	S	S	*	.			trans	-99.1	77	176.2	-62.4	-31.4	0	0	0	109.4	N274 D277 Q281	N274-N279 PolarHBondContact ND2-O 3.48Å; N274-N279 VanDerWaalsContact ND2-O 3.09Å; D277-N279 PolarHBondContact O-N 3.06Å; N279-Q281 PolarHBondContact O-N 3.08Å; N279-Q281 VanDerWaalsContact O-N 3.14Å
280	E	61.1	Low	66	Low	96 Å²	96	87.5 Å²	87.5	45%	0.449	46%	0.457	S	S	.	.			trans	-60.6	114.5	163.5	-71.4	-178.6	175	0	0	108.4	V270 T278 Y282	V270-E280 HydrophobicContact CG2-CB 4.04Å; V270-E280 HydrophobicContact CG2-CG 4.2Å; T278-E280 PolarHBondContact O-N 2.84Å; E280-Y282 HydrophobicContact CB-CD1 4.43Å; E280-Y282 HydrophobicContact CB-CE1 3.66Å; E280-Y282 PolarHBondContact O-N 3.39Å; E280-Y282 VanDerWaalsContact OE2-CE1 3.25Å; E280-Y282 WeakPolarHBondContact OE2-CE1 3.39Å; E280-Y282 PolarHBondContact OE2-OH 3.32Å
281	Q	61.6	Low	66.3	Low	129 Å²	129	87 Å²	87	60%	0.603	45%	0.454	S	S	*	.			trans	-84.3	110.1	176.4	-166.9	172.5	-5.9	0	0	108.8	N279 F283	N279-Q281 PolarHBondContact O-N 3.08Å; N279-Q281 VanDerWaalsContact O-N 3.14Å; Q281-F283 HydrophobicContact CB-CE2 4.26Å; Q281-F283 HydrophobicContact CB-CZ 4.37Å; Q281-F283 HydrophobicContact CG-CE1 4.3Å; Q281-F283 HydrophobicContact CG-CE2 4.06Å; Q281-F283 HydrophobicContact CG-CZ 3.75Å
282	Y	69.6	Low	66.8	Low	112 Å²	112	85.1 Å²	85.1	44%	0.439	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	132.3	179.2	-54.9	-55.3	0	0	0	111.3	R243 V270 E280	R243-Y282 HydrophobicContact CG-CD1 4.05Å; R243-Y282 HydrophobicContact CG-CE1 4.13Å; V270-Y282 HydrophobicContact CB-CD1 4.45Å; V270-Y282 HydrophobicContact CG2-CD1 4.36Å; V270-Y282 HydrophobicContact CG2-CE1 4.26Å; E280-Y282 HydrophobicContact CB-CD1 4.43Å; E280-Y282 HydrophobicContact CB-CE1 3.66Å; E280-Y282 PolarHBondContact O-N 3.39Å; E280-Y282 VanDerWaalsContact OE2-CE1 3.25Å; E280-Y282 WeakPolarHBondContact OE2-CE1 3.39Å; E280-Y282 PolarHBondContact OE2-OH 3.32Å
283	F	68.4	Low	68	Low	73 Å²	73	82.2 Å²	82.2	32%	0.32	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	113.5	174.8	-61.1	-83	0	0	0	110.1	E268 S269 Q281	E268-F283 WeakPolarHBondContact CA-O 3.45Å; S269-F283 PolarHBondContact N-O 3.44Å; S269-F283 PolarHBondContact O-N 2.91Å; Q281-F283 HydrophobicContact CB-CE2 4.26Å; Q281-F283 HydrophobicContact CB-CZ 4.37Å; Q281-F283 HydrophobicContact CG-CE1 4.3Å; Q281-F283 HydrophobicContact CG-CE2 4.06Å; Q281-F283 HydrophobicContact CG-CZ 3.75Å
284	K	70.3	Confident	69.7	Low	141 Å²	141	76.3 Å²	76.3	61%	0.613	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	106.7	171.1	-173.3	168.9	-175.5	163.6	0	109.4	E268 S286	E268-K284 HydrophobicContact CG-CB 4.43Å; E268-K284 HydrophobicContact CG-CG 4.32Å; K284-S286 WeakPolarHBondContact CE-O 3.43Å
285	N	64.9	Low	71.7	Confident	89 Å²	89	74 Å²	74	48%	0.476	39%	0.386	S	S	.	.			trans	-90.4	3.2	-171.5	-75.2	-15.7	0	0	0	114.1	L234	L234-N285 HydrophobicContact CD1-CB 4.24Å; L234-N285 HydrophobicContact CD2-CB 3.52Å
286	S	65.6	Low	73.7	Confident	16 Å²	16	68.9 Å²	68.9	11%	0.112	36%	0.358	C	S	.	.			trans	-149.7	140.6	-172.9	170.9	0	0	0	0	113.8	Q103 K284 N288	Q103-S286 VanDerWaalsContact NE2-CB 3.26Å; Q103-S286 PolarHBondContact NE2-OG 3.03Å; K284-S286 WeakPolarHBondContact CE-O 3.43Å; S286-N288 WeakPolarHBondContact OG-CA 3.49Å; S286-N288 WeakPolarHBondContact OG-CB 3.48Å; S286-N288 PolarHBondContact OG-N 3.29Å; S286-N288 PolarHBondContact OG-O 3.28Å
287	T	66.9	Low	75.7	Confident	144 Å²	144	62.6 Å²	62.6	88%	0.883	33%	0.325	S	S	*	.	S	Bend	trans	-83.3	-24.3	165.2	50.7	0	0	0	0	113
288	N	73.7	Confident	77.9	Confident	59 Å²	59	57.9 Å²	57.9	32%	0.316	30%	0.301	S	S	.	.	S	Bend	trans	-73.5	155.2	177	-64.3	-47.4	0	0	0	111.3	Q103 S286 S290	Q103-N288 HydrophobicContact CG-CB 3.56Å; S286-N288 WeakPolarHBondContact OG-CA 3.49Å; S286-N288 WeakPolarHBondContact OG-CB 3.48Å; S286-N288 PolarHBondContact OG-N 3.29Å; S286-N288 PolarHBondContact OG-O 3.28Å; N288-S290 PolarHBondContact O-N 3.23Å; N288-S290 VanDerWaalsContact O-N 3.16Å
289	P	73.3	Confident	79.9	Confident	32 Å²	32	51.4 Å²	51.4	21%	0.208	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-54.6	121.9	-179.4	22.1	-33.8	0	0	0	110.8	W204	W204-P289 HydrophobicContact CH2-CB 4.05Å; W204-P289 HydrophobicContact CH2-CG 4.07Å; W204-P289 HydrophobicContact CZ3-CB 3.82Å; W204-P289 HydrophobicContact CZ3-CG 4.3Å
290	S	87	Confident	82	Confident	18 Å²	18	45.3 Å²	45.3	13%	0.126	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-74.1	158.9	174.7	-175.2	0	0	0	0	110.4	G267 N288 L394 G395	G267-S290 WeakPolarHBondContact CA-OG 3.41Å; G267-S290 PolarHBondContact N-OG 3.2Å; N288-S290 PolarHBondContact O-N 3.23Å; N288-S290 VanDerWaalsContact O-N 3.16Å; S290-L394 CarbonylContact O-C 3.56Å; S290-L394 WeakPolarHBondContact O-CA 3.31Å; S290-G395 PolarHBondContact O-N 2.83Å
291	A	94.9	Very high	83.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	153.3	165.3	0	0	0	0	0	111.7	Y105 L266 F392 G393 L394	Y105-A291 HydrophobicContact CD1-CB 3.75Å; Y105-A291 HydrophobicContact CD2-CB 3.23Å; Y105-A291 HydrophobicContact CE1-CB 4.21Å; Y105-A291 HydrophobicContact CE2-CB 3.7Å; Y105-A291 HydrophobicContact CG-CB 3.23Å; L266-A291 HydrophobicContact CB-CB 4.3Å; L266-A291 HydrophobicContact CD1-CB 4.21Å; L266-A291 PolarHBondContact N-O 2.67Å; A291-F392 HydrophobicContact CB-CE2 3.97Å; A291-F392 HydrophobicContact CB-CZ 4.47Å; A291-G393 CarbonylContact C-O 3.53Å; A291-G393 WeakPolarHBondContact CA-O 3.22Å; A291-G393 WeakPolarHBondContact CB-O 3.12Å; A291-L394 HydrophobicContact CB-CD2 4.06Å
292	F	96.4	Very high	85.4	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	153.3	173.7	64.2	-93.8	0	0	0	111.5	I205 I264 L265 Q294 F392 G393 L394 G395 P397	I205-F292 HydrophobicContact CD1-CZ 3.95Å; I205-F292 HydrophobicContact CG1-CZ 4.04Å; I264-F292 CarbonylContact O-C 3.48Å; I264-F292 WeakPolarHBondContact O-CA 3.38Å; L265-F292 HydrophobicContact CD2-CB 3.95Å; F292-Q294 HydrophobicContact CD2-CB 3.79Å; F292-Q294 HydrophobicContact CE2-CB 3.9Å; F292-F392 WeakPolarHBondContact O-CA 3.4Å; F292-F392 VanDerWaalsContact O-CD2 3.27Å; F292-F392 WeakPolarHBondContact O-CD2 3.25Å; F292-G393 PolarHBondContact N-O 3.08Å; F292-G393 PolarHBondContact O-N 3.5Å; F292-L394 VanDerWaalsContact CE1-O 3.31Å; F292-L394 WeakPolarHBondContact CE1-O 3.37Å; F292-G395 WeakPolarHBondContact CD1-O 3.38Å; F292-P397 HydrophobicContact CB-CG 3.79Å; F292-P397 HydrophobicContact CD1-CB 4.35Å; F292-P397 HydrophobicContact CD1-CG 4.01Å; F292-P397 HydrophobicContact CD2-CB 4.02Å; F292-P397 HydrophobicContact CD2-CG 4.12Å; F292-P397 HydrophobicContact CE2-CB 4.28Å; F292-P397 HydrophobicContact CG-CB 4.07Å; F292-P397 HydrophobicContact CG-CG 3.71Å
293	I	98	Very high	86.6	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.2	160.4	-54.9	167.8	0	0	0	106.9	L107 M230 N263 I264 I295 S391 F392	L107-I293 HydrophobicContact CD1-CD1 3.64Å; L107-I293 HydrophobicContact CD2-CD1 4.47Å; M230-I293 HydrophobicContact CG-CD1 3.66Å; M230-I293 HydrophobicContact SD-CD1 3.46Å; M230-I293 WeakPolarHBondContact SD-CD1 3.41Å; N263-I293 CarbonylContact C-O 3.6Å; N263-I293 WeakPolarHBondContact CA-O 3.31Å; I264-I293 HydrophobicContact CB-CB 4.34Å; I264-I293 PolarHBondContact N-O 2.87Å; I264-I293 PolarHBondContact O-N 2.7Å; I293-I295 HydrophobicContact CG2-CD1 4.07Å; I293-I295 HydrophobicContact CG2-CG1 3.97Å; I293-S391 CarbonylContact C-O 3.47Å; I293-S391 VanDerWaalsContact CA-O 3.3Å; I293-S391 WeakPolarHBondContact CA-O 3.49Å; I293-F392 HydrophobicContact CG1-CD2 3.75Å; I293-F392 HydrophobicContact CG1-CE2 4.31Å
294	Q	96.9	Very high	87.7	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.019	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.1	-179.3	175.2	174.3	83.2	0	0	110.2	M261 N263 F292 A390 S391 P398	M261-Q294 HydrophobicContact CE-CG 4.06Å; M261-Q294 HydrophobicContact CG-CG 3.75Å; M261-Q294 HydrophobicContact SD-CG 3.28Å; M261-Q294 WeakPolarHBondContact SD-CG 3.31Å; N263-Q294 VanDerWaalsContact OD1-CG 3.31Å; N263-Q294 WeakPolarHBondContact OD1-CG 3.34Å; N263-Q294 PolarHBondContact OD1-NE2 2.83Å; N263-Q294 VanDerWaalsContact OD1-NE2 3.17Å; F292-Q294 HydrophobicContact CD2-CB 3.79Å; F292-Q294 HydrophobicContact CE2-CB 3.9Å; Q294-A390 WeakPolarHBondContact O-CB 3.46Å; Q294-S391 PolarHBondContact N-O 2.82Å; Q294-S391 PolarHBondContact O-N 2.91Å; Q294-P398 PolarHBondContact NE2-O 3.14Å
295	I	96.3	Very high	88.8	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	116.4	-171.7	-53.2	171.1	0	0	0	108.5	M261 T262 I293 I316 L368 W388 A390	M261-I295 VanDerWaalsContact SD-C 3.59Å; T262-I295 PolarHBondContact N-O 2.83Å; T262-I295 PolarHBondContact O-N 2.78Å; I293-I295 HydrophobicContact CG2-CD1 4.07Å; I293-I295 HydrophobicContact CG2-CG1 3.97Å; I295-I316 HydrophobicContact CB-CD1 3.86Å; I295-I316 HydrophobicContact CD1-CD1 3.84Å; I295-I316 HydrophobicContact CD1-CG1 4.32Å; I295-I316 HydrophobicContact CG1-CD1 4.44Å; I295-I316 HydrophobicContact CG2-CD1 3.64Å; I295-I316 HydrophobicContact CG2-CG1 4.36Å; I295-L368 HydrophobicContact CD1-CD2 4.18Å; I295-W388 HydrophobicContact CB-CZ2 4.49Å; I295-W388 HydrophobicContact CD1-CH2 4.43Å; I295-W388 HydrophobicContact CD1-CZ2 4.01Å; I295-W388 HydrophobicContact CG1-CZ2 3.97Å; I295-W388 HydrophobicContact CG2-CZ2 3.75Å; I295-A390 HydrophobicContact CG1-CB 4.12Å
296	K	93.5	Very high	90.2	Very high	8 Å²	8	32.3 Å²	32.3	4%	0.035	18%	0.178	C	C	.	.			trans	-78.6	132.3	155.9	-76.8	-149.7	-176	178.1	0	107.9	P196 L198 T255 M261 A298 D400	P196-K296 HydrophobicContact CB-CB 4.07Å; P196-K296 HydrophobicContact CB-CD 4.12Å; P196-K296 HydrophobicContact CB-CG 4.41Å; P196-K296 HydrophobicContact CG-CB 4.25Å; L198-K296 HydrophobicContact CD2-CG 4.03Å; T255-K296 HydrophobicContact CG2-CD 4.14Å; T255-K296 PolarHBondContact OG1-NZ 2.75Å; M261-K296 HydrophobicContact CE-CD 4.01Å; M261-K296 HydrophobicContact CE-CG 3.42Å; M261-K296 VanDerWaalsContact CE-CG 3.42Å; M261-K296 HydrophobicContact SD-CB 4.32Å; M261-K296 HydrophobicContact SD-CG 3.42Å; M261-K296 WeakPolarHBondContact SD-CG 3.36Å; K296-A298 PolarHBondContact O-N 2.79Å; K296-D400 IonicContact NZ-OD2 3.71Å
297	P	93.6	Very high	91.5	Very high	20 Å²	20	34.2 Å²	34.2	13%	0.13	19%	0.189	C	C	.	.	S	Bend	trans	-76.1	49.7	-172.8	30.7	-36.5	0	0	0	113.2	N258 E260 V314	N258-P297 WeakPolarHBondContact ND2-CD 3.44Å; E260-P297 HydrophobicContact CB-CG 4.09Å; E260-P297 HydrophobicContact CG-CG 4.45Å; E260-P297 VanDerWaalsContact O-CD 3.26Å; E260-P297 WeakPolarHBondContact O-CD 3.46Å; P297-V314 PolarHBondContact O-N 3Å
298	A	95.3	Very high	92.7	Very high	8 Å²	8	31.1 Å²	31.1	7%	0.066	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	137.6	-178.9	0	0	0	0	0	112	K296 F300 R312	K296-A298 PolarHBondContact O-N 2.79Å; A298-F300 HydrophobicContact CB-CZ 4.48Å; A298-R312 CarbonylContact C-O 3.58Å; A298-R312 VanDerWaalsContact CA-O 3.31Å; A298-R312 WeakPolarHBondContact CA-O 3.36Å
299	C	97.1	Very high	93.6	Very high	1 Å²	1	36 Å²	36	1%	0.007	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	170.6	167.6	66.8	0	0	0	0	109.2	S311 R312 V314 F372 I386 V387 W388	C299-S311 CarbonylContact O-C 3.58Å; C299-S311 VanDerWaalsContact O-CA 3.3Å; C299-S311 WeakPolarHBondContact O-CA 3.38Å; C299-R312 PolarHBondContact N-O 3.1Å; C299-R312 PolarHBondContact O-N 3.07Å; C299-V314 HydrophobicContact CB-CG2 3.73Å; C299-F372 HydrophobicContact CB-CD1 4.22Å; C299-I386 HydrophobicContact CB-CG2 4.2Å; C299-V387 CarbonylContact C-O 3.57Å; C299-V387 WeakPolarHBondContact CA-O 3.39Å; C299-V387 WeakPolarHBondContact CB-O 3.38Å; C299-W388 HydrophobicContact CB-CB 3.97Å
300	F	97.8	Very high	94.7	Very high	2 Å²	2	36 Å²	36	1%	0.009	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	146.9	-173.6	-55.6	-90	0	0	0	111.6	M195 A298 R306 N310 I386 V387	M195-F300 HydrophobicContact CB-CE1 3.89Å; M195-F300 HydrophobicContact CB-CE2 4Å; M195-F300 HydrophobicContact CB-CZ 3.4Å; M195-F300 VanDerWaalsContact CB-CZ 3.4Å; M195-F300 HydrophobicContact CG-CZ 4.46Å; M195-F300 HydrophobicContact SD-CE1 4.18Å; M195-F300 HydrophobicContact SD-CZ 4.4Å; A298-F300 HydrophobicContact CB-CZ 4.48Å; F300-R306 HydrophobicContact CB-CB 4.28Å; F300-R306 HydrophobicContact CB-CG 3.96Å; F300-R306 HydrophobicContact CD1-CB 3.69Å; F300-R306 HydrophobicContact CD1-CG 4.29Å; F300-R306 HydrophobicContact CD2-CB 4.09Å; F300-R306 HydrophobicContact CD2-CG 4.07Å; F300-R306 HydrophobicContact CE1-CB 4.02Å; F300-R306 HydrophobicContact CE2-CB 4.42Å; F300-R306 HydrophobicContact CG-CB 3.73Å; F300-R306 HydrophobicContact CG-CG 3.83Å; F300-R306 HydrophobicContact CZ-CB 4.4Å; F300-N310 VanDerWaalsContact CA-O 3.31Å; F300-N310 WeakPolarHBondContact CA-O 3.34Å; F300-I386 CarbonylContact O-C 3.58Å; F300-I386 WeakPolarHBondContact O-CA 3.11Å; F300-V387 HydrophobicContact CB-CG1 3.81Å; F300-V387 PolarHBondContact N-O 3.3Å; F300-V387 PolarHBondContact O-N 2.9Å
301	I	97.6	Very high	95.1	Very high	41 Å²	41	36.8 Å²	36.8	21%	0.21	20%	0.195	C	C	.	.	S	Bend	trans	-94.2	8.7	178.1	61.6	157.6	0	0	0	113.9	N310 R312 F385	I301-N310 HydrophobicContact CG1-CB 3.91Å; I301-N310 WeakPolarHBondContact CG1-O 3.26Å; I301-N310 PolarHBondContact N-O 2.84Å; I301-R312 HydrophobicContact CG2-CG 3.9Å; I301-F385 VanDerWaalsContact C-CD1 3.45Å; I301-F385 WeakPolarHBondContact O-CD1 3.34Å
302	D	96.2	Very high	95.1	Very high	52 Å²	52	38.8 Å²	38.8	28%	0.278	20%	0.202	S	C	.	.			trans	-143	137.4	173.8	-170.3	-62.2	0	0	0	109	H304 L305 R306	D302-H304 PolarHBondContact OD1-N 2.86Å; D302-L305 HydrophobicContact CB-CB 4.15Å; D302-L305 PolarHBondContact OD1-N 3.46Å; D302-R306 WeakPolarHBondContact O-CG 3.36Å
303	N	94.1	Very high	95.1	Very high	29 Å²	29	43.2 Å²	43.2	16%	0.155	23%	0.226	C	C	.	.	S	Bend	trans	-71.8	-37.3	-177.9	-174.6	46.2	0	0	0	113.3	R306 F385	N303-R306 PolarHBondContact O-NE 2.81Å; N303-R306 VanDerWaalsContact O-NE 3.17Å; N303-R306 PolarHBondContact OD1-NH2 2.91Å; N303-F385 HydrophobicContact CB-CE1 4.1Å; N303-F385 HydrophobicContact CB-CE2 4.46Å; N303-F385 HydrophobicContact CB-CZ 3.64Å
304	H	92.7	Very high	95	Very high	128 Å²	128	43.6 Å²	43.6	59%	0.593	23%	0.228	S	C	*	.	S	Bend	trans	-100.3	-37.5	-172	-61.9	-70.9	0	0	0	111.7	D302 R306	D302-H304 PolarHBondContact OD1-N 2.86Å; H304-R306 PolarHBondContact O-N 2.88Å
305	L	93.8	Very high	95	Very high	105 Å²	105	47.4 Å²	47.4	55%	0.55	24%	0.243	S	C	.	.			trans	-97	60.1	179	-61.5	174.6	0	0	0	110.7	D302 T307 N310	D302-L305 HydrophobicContact CB-CB 4.15Å; D302-L305 PolarHBondContact OD1-N 3.46Å; L305-T307 PolarHBondContact O-N 2.79Å; L305-N310 WeakPolarHBondContact O-CB 3.41Å; L305-N310 PolarHBondContact O-ND2 2.95Å
306	R	94.2	Very high	94.9	Very high	12 Å²	12	48 Å²	48	5%	0.045	25%	0.246	C	C	.	.			trans	-76	77.7	174.5	-57.8	-168.6	-162.1	-174.9	-3.7	110.3	M195 D209 F300 D302 N303 H304 V387 T389	M195-R306 HydrophobicContact CB-CB 3.99Å; M195-R306 WeakPolarHBondContact CG-O 3.46Å; M195-R306 VanDerWaalsContact O-CD 3.24Å; M195-R306 WeakPolarHBondContact O-CD 3.46Å; M195-R306 PolarHBondContact O-NH1 3.33Å; D209-R306 IonicContact OD1-NH1 4Å; D209-R306 IonicContact OD2-CZ 3.31Å; D209-R306 IonicContact OD2-NH1 2.71Å; D209-R306 IonicContact OD2-NH2 3.55Å; D209-R306 PolarHBondContact OD2-NH2 2.89Å; F300-R306 HydrophobicContact CB-CB 4.28Å; F300-R306 HydrophobicContact CB-CG 3.96Å; F300-R306 HydrophobicContact CD1-CB 3.69Å; F300-R306 HydrophobicContact CD1-CG 4.29Å; F300-R306 HydrophobicContact CD2-CB 4.09Å; F300-R306 HydrophobicContact CD2-CG 4.07Å; F300-R306 HydrophobicContact CE1-CB 4.02Å; F300-R306 HydrophobicContact CE2-CB 4.42Å; F300-R306 HydrophobicContact CG-CB 3.73Å; F300-R306 HydrophobicContact CG-CG 3.83Å; F300-R306 HydrophobicContact CZ-CB 4.4Å; D302-R306 WeakPolarHBondContact O-CG 3.36Å; N303-R306 PolarHBondContact O-NE 2.81Å; N303-R306 VanDerWaalsContact O-NE 3.17Å; N303-R306 PolarHBondContact OD1-NH2 2.91Å; H304-R306 PolarHBondContact O-N 2.88Å; R306-V387 VanDerWaalsContact NH2-CG2 3.33Å; R306-T389 PolarHBondContact NH1-OG1 3.46Å
307	T	92.7	Very high	94.9	Very high	56 Å²	56	47.8 Å²	47.8	34%	0.344	25%	0.246	S	C	.	.			trans	-110.3	168.3	179.3	67.6	0	0	0	0	110.7	L305 Q309 N310 S311	L305-T307 PolarHBondContact O-N 2.79Å; T307-Q309 PolarHBondContact O-N 3.01Å; T307-N310 CarbonylContact O-C 3.52Å; T307-N310 PolarHBondContact O-N 2.84Å; T307-N310 PolarHBondContact OG1-N 2.89Å; T307-S311 PolarHBondContact O-N 3.23Å
308	V	91.9	Very high	94.5	Very high	79 Å²	79	53 Å²	53	48%	0.479	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-54.2	-40.8	174	-178.9	0	0	0	0	111.5	P256 N310 S311	P256-V308 HydrophobicContact CB-CG2 3.98Å; V308-N310 VanDerWaalsContact C-N 3.28Å; V308-N310 PolarHBondContact O-N 2.86Å; V308-S311 WeakPolarHBondContact O-CB 3.05Å; V308-S311 PolarHBondContact O-N 2.82Å; V308-S311 VanDerWaalsContact O-N 3.12Å; V308-S311 PolarHBondContact O-OG 3Å
309	Q	92.4	Very high	94.2	Very high	161 Å²	161	55.9 Å²	55.9	75%	0.752	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-61.2	-36.7	178.2	-175.6	178.8	0.8	0	0	112.8	T307 R312	T307-Q309 PolarHBondContact O-N 3.01Å; Q309-R312 PolarHBondContact O-NH1 3Å; Q309-R312 VanDerWaalsContact O-NH1 3.16Å
310	N	95.7	Very high	93.8	Very high	31 Å²	31	56.3 Å²	56.3	17%	0.166	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-92.4	1.6	179.7	-70.3	-19.1	0	0	0	113	F300 I301 L305 T307 V308	F300-N310 VanDerWaalsContact CA-O 3.31Å; F300-N310 WeakPolarHBondContact CA-O 3.34Å; I301-N310 HydrophobicContact CG1-CB 3.91Å; I301-N310 WeakPolarHBondContact CG1-O 3.26Å; I301-N310 PolarHBondContact N-O 2.84Å; L305-N310 WeakPolarHBondContact O-CB 3.41Å; L305-N310 PolarHBondContact O-ND2 2.95Å; T307-N310 CarbonylContact O-C 3.52Å; T307-N310 PolarHBondContact O-N 2.84Å; T307-N310 PolarHBondContact OG1-N 2.89Å; V308-N310 VanDerWaalsContact C-N 3.28Å; V308-N310 PolarHBondContact O-N 2.86Å
311	S	96.1	Very high	93.4	Very high	36 Å²	36	59.2 Å²	59.2	25%	0.252	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	146.3	177.6	75.4	0	0	0	0	111.9	C299 T307 V308	C299-S311 CarbonylContact O-C 3.58Å; C299-S311 VanDerWaalsContact O-CA 3.3Å; C299-S311 WeakPolarHBondContact O-CA 3.38Å; T307-S311 PolarHBondContact O-N 3.23Å; V308-S311 WeakPolarHBondContact O-CB 3.05Å; V308-S311 PolarHBondContact O-N 2.82Å; V308-S311 VanDerWaalsContact O-N 3.12Å; V308-S311 PolarHBondContact O-OG 3Å
312	R	96	Very high	92.9	Very high	42 Å²	42	60.8 Å²	60.8	16%	0.158	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	163.1	169.5	-60	-64.3	178.7	-90.8	-1.5	108.4	A298 C299 I301 Q309 T374	A298-R312 CarbonylContact C-O 3.58Å; A298-R312 VanDerWaalsContact CA-O 3.31Å; A298-R312 WeakPolarHBondContact CA-O 3.36Å; C299-R312 PolarHBondContact N-O 3.1Å; C299-R312 PolarHBondContact O-N 3.07Å; I301-R312 HydrophobicContact CG2-CG 3.9Å; Q309-R312 PolarHBondContact O-NH1 3Å; Q309-R312 VanDerWaalsContact O-NH1 3.16Å; R312-T374 WeakPolarHBondContact CA-OG1 3.31Å
313	N	95.6	Very high	92.2	Very high	93 Å²	93	59.1 Å²	59.1	50%	0.497	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	158.4	-179.1	-61.7	-13.2	0	0	0	110.8	G373 T374	N313-G373 CarbonylContact C-O 3.1Å; N313-G373 WeakPolarHBondContact CB-O 3.31Å; N313-G373 PolarHBondContact N-O 3.41Å; N313-G373 PolarHBondContact O-N 2.97Å; N313-T374 PolarHBondContact N-OG1 3.28Å
314	V	96.7	Very high	91.2	Very high	8 Å²	8	60.5 Å²	60.5	5%	0.048	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.7	167.9	177.3	0	0	0	0	107.1	P297 C299 I316 V370 S371 F372 W388	P297-V314 PolarHBondContact O-N 3Å; C299-V314 HydrophobicContact CB-CG2 3.73Å; V314-I316 HydrophobicContact CG1-CG1 4.34Å; V314-V370 HydrophobicContact CG1-CG1 3.32Å; V314-S371 CarbonylContact C-O 3.52Å; V314-S371 WeakPolarHBondContact CA-O 3.28Å; V314-F372 HydrophobicContact CG1-CD1 4.28Å; V314-F372 HydrophobicContact CG1-CE1 4.15Å; V314-F372 HydrophobicContact CG2-CD1 4.03Å; V314-F372 HydrophobicContact CG2-CE1 4.33Å; V314-W388 HydrophobicContact CG2-CG 4.36Å
315	Y	95.9	Very high	89.8	Confident	83 Å²	83	59.1 Å²	59.1	33%	0.325	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	122.6	174.3	178	-92	0	0	0	109.9	V122 N123 V370 S371	V122-Y315 WeakPolarHBondContact O-CB 3.23Å; N123-Y315 HydrophobicContact CB-CD1 4.33Å; N123-Y315 HydrophobicContact CB-CE1 4.01Å; N123-Y315 VanDerWaalsContact OD1-CE1 3.23Å; N123-Y315 WeakPolarHBondContact OD1-CE1 3.28Å; Y315-V370 CarbonylContact O-C 3.57Å; Y315-V370 WeakPolarHBondContact O-CA 3.47Å; Y315-S371 PolarHBondContact N-O 3.35Å; Y315-S371 PolarHBondContact O-N 3.15Å
316	I	95.3	Very high	87.8	Confident	12 Å²	12	60.6 Å²	60.6	6%	0.062	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.5	177.8	-55.3	165.2	0	0	0	107.3	K244 T262 I295 V314 L368	K244-I316 PolarHBondContact NZ-O 2.86Å; T262-I316 HydrophobicContact CG2-CD1 3.65Å; I295-I316 HydrophobicContact CB-CD1 3.86Å; I295-I316 HydrophobicContact CD1-CD1 3.84Å; I295-I316 HydrophobicContact CD1-CG1 4.32Å; I295-I316 HydrophobicContact CG1-CD1 4.44Å; I295-I316 HydrophobicContact CG2-CD1 3.64Å; I295-I316 HydrophobicContact CG2-CG1 4.36Å; V314-I316 HydrophobicContact CG1-CG1 4.34Å; I316-L368 HydrophobicContact CG2-CD1 3.75Å; I316-L368 HydrophobicContact CG2-CG 4.41Å
317	S	92.2	Very high	85.8	Confident	5 Å²	5	64.5 Å²	64.5	4%	0.035	33%	0.33	C	S	.	.			trans	-52.6	145.5	-177.7	63.2	0	0	0	0	112.6	S125 H319 N369	S125-S317 VanDerWaalsContact OG-CB 3.3Å; S125-S317 WeakPolarHBondContact OG-CB 3.28Å; S317-H319 VanDerWaalsContact C-N 3.35Å; S317-H319 PolarHBondContact OG-O 2.66Å; S317-N369 PolarHBondContact N-O 3.02Å; S317-N369 PolarHBondContact OG-N 3.46Å; S317-N369 PolarHBondContact OG-O 3.22Å
318	K	86.2	Confident	83.8	Confident	129 Å²	129	69.7 Å²	69.7	56%	0.561	36%	0.356	S	S	*	.	S	Bend	trans	-63.1	-44.4	177	-174.3	-177.8	177	-168	0	111.1
319	H	88.7	Confident	81.9	Confident	69 Å²	69	73.4 Å²	73.4	32%	0.319	37%	0.373	S	S	.	.	S	Bend	trans	-113.1	157.8	-177.5	-63.9	-59.1	0	0	0	111.8	E241 S317	E241-H319 IonicContact OE1-ND1 3.85Å; E241-H319 PolarHBondContact OE1-ND1 2.98Å; E241-H319 WeakPolarHBondContact OE2-CA 3.14Å; E241-H319 IonicContact OE2-ND1 2.81Å; S317-H319 VanDerWaalsContact C-N 3.35Å; S317-H319 PolarHBondContact OG-O 2.66Å
320	Q	88.9	Confident	80.2	Confident	9 Å²	9	71 Å²	71	4%	0.042	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-97.7	132.6	172.6	-63.4	161.1	36.1	0	0	110.4	M230 E241 F242 K272 R366 L367	M230-Q320 HydrophobicContact CE-CG 3.84Å; E241-Q320 HydrophobicContact CB-CB 4.23Å; E241-Q320 HydrophobicContact CB-CG 4.38Å; E241-Q320 PolarHBondContact OE2-N 2.8Å; E241-Q320 VanDerWaalsContact OE2-N 3.1Å; F242-Q320 PolarHBondContact O-NE2 3.22Å; K272-Q320 PolarHBondContact NZ-O 3.26Å; Q320-R366 HydrophobicContact CB-CB 4.05Å; Q320-R366 HydrophobicContact CB-CG 4.41Å; Q320-R366 VanDerWaalsContact OE1-CB 3.32Å; Q320-L367 WeakPolarHBondContact CA-O 3.32Å
321	D	88	Confident	78.8	Confident	64 Å²	64	70.6 Å²	70.6	34%	0.342	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-80.7	151.4	178	-56.2	-36.3	0	0	0	110.3	L367 N369	D321-L367 HydrophobicContact CB-CB 4.08Å; D321-L367 HydrophobicContact CB-CD1 4.41Å; D321-L367 PolarHBondContact N-O 2.87Å; D321-L367 PolarHBondContact O-N 2.82Å; D321-N369 PolarHBondContact OD2-ND2 3.01Å
322	L	87.6	Confident	77.6	Confident	74 Å²	74	70.1 Å²	70.1	39%	0.387	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-80.7	150.9	169	-63.1	175	0	0	0	109.4	P238 D324 R366	P238-L322 HydrophobicContact CB-CD1 3.92Å; L322-D324 PolarHBondContact O-N 3.2Å; L322-R366 VanDerWaalsContact CD2-CZ 3.47Å
323	L	82.4	Confident	76.5	Confident	16 Å²	16	71.6 Å²	71.6	8%	0.084	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-69.8	118	166.8	-164	74.7	0	0	0	107.9	M229 Q332 F333 I336 I365 L367	M229-L323 HydrophobicContact SD-CD1 4.23Å; L323-Q332 HydrophobicContact CD1-CB 3.67Å; L323-Q332 HydrophobicContact CD2-CB 4.35Å; L323-Q332 HydrophobicContact CG-CB 3.69Å; L323-F333 HydrophobicContact CD2-CD1 4.01Å; L323-F333 HydrophobicContact CD2-CD2 4.09Å; L323-F333 HydrophobicContact CD2-CE1 3.99Å; L323-F333 HydrophobicContact CD2-CE2 4.06Å; L323-F333 HydrophobicContact CD2-CG 4.06Å; L323-F333 HydrophobicContact CD2-CZ 4.01Å; L323-F333 HydrophobicContact CG-CE2 4.44Å; L323-I336 HydrophobicContact CD2-CD1 3.57Å; L323-I336 HydrophobicContact CD2-CG1 4.03Å; L323-I365 HydrophobicContact CB-CG2 4.44Å; L323-I365 HydrophobicContact CD2-CG2 4.5Å; L323-L367 HydrophobicContact CD1-CD1 4.2Å; L323-L367 HydrophobicContact CD1-CD2 4.16Å
324	D	71.8	Confident	75.9	Confident	59 Å²	59	70.7 Å²	70.7	32%	0.316	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-91.8	130.9	-171.5	161.8	43	0	0	0	111.8	L322 N326 Q332	L322-D324 PolarHBondContact O-N 3.2Å; D324-N326 WeakPolarHBondContact OD1-CB 3.37Å; D324-N326 PolarHBondContact OD1-N 2.9Å; D324-Q332 VanDerWaalsContact CB-NE2 3.31Å; D324-Q332 WeakPolarHBondContact O-CB 3.4Å; D324-Q332 WeakPolarHBondContact O-CG 3.44Å; D324-Q332 PolarHBondContact O-NE2 2.73Å
325	N	63.3	Low	75.4	Confident	98 Å²	98	71.1 Å²	71.1	52%	0.524	36%	0.362	S	S	.	.			trans	-94.3	-11.8	-177.5	-160.7	20.8	0	0	0	112.9	N327 S331 F333	N325-N327 VanDerWaalsContact C-N 3.35Å; N325-N327 PolarHBondContact O-N 2.67Å; N325-S331 WeakPolarHBondContact OD1-CB 3.39Å; N325-F333 HydrophobicContact CB-CD2 4.28Å; N325-F333 HydrophobicContact CB-CE2 4.24Å
326	N	52.6	Low	75.2	Confident	136 Å²	136	67.2 Å²	67.2	73%	0.727	35%	0.347	S	S	*	.			trans	-86.9	13.1	-163.1	-76.4	-14.6	0	0	0	115.8	D324	D324-N326 WeakPolarHBondContact OD1-CB 3.37Å; D324-N326 PolarHBondContact OD1-N 2.9Å
327	N	51.5	Low	75	Confident	95 Å²	95	69 Å²	69	51%	0.508	36%	0.356	S	S	.	.			trans	-96.1	113.5	177.1	-74.7	-22.9	0	0	0	111.7	N325 N329	N325-N327 VanDerWaalsContact C-N 3.35Å; N325-N327 PolarHBondContact O-N 2.67Å; N327-N329 PolarHBondContact O-N 3Å
328	N	51.9	Low	75	Confident	165 Å²	165	73.7 Å²	73.7	88%	0.882	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-4.9	-171.4	-70.3	-26	0	0	0	117.4
329	N	51.8	Low	75.4	Confident	157 Å²	157	67.5 Å²	67.5	84%	0.84	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-39.7	-171.6	-68.8	-6.7	0	0	0	113.6	N327	N327-N329 PolarHBondContact O-N 3Å
330	I	56	Low	75.8	Confident	109 Å²	109	64.2 Å²	64.2	56%	0.559	33%	0.332	S	S	*	.	S	Bend	trans	-154.3	122.8	173.2	-61.3	-178.6	0	0	0	105.2	D334	I330-D334 HydrophobicContact CG2-CB 3.73Å
331	S	65.7	Low	76.2	Confident	24 Å²	24	63.8 Å²	63.8	17%	0.168	33%	0.33	C	S	.	.			trans	-67.1	143	177.5	70.9	0	0	0	0	108.8	N325 F333 D334	N325-S331 WeakPolarHBondContact OD1-CB 3.39Å; S331-F333 PolarHBondContact O-N 3.07Å; S331-D334 WeakPolarHBondContact CB-OD2 3.49Å; S331-D334 PolarHBondContact N-OD2 3.47Å; S331-D334 WeakPolarHBondContact O-CB 3.3Å; S331-D334 PolarHBondContact O-N 3.29Å; S331-D334 PolarHBondContact OG-N 3.03Å; S331-D334 VanDerWaalsContact OG-N 3.14Å; S331-D334 PolarHBondContact OG-OD1 2.64Å; S331-D334 PolarHBondContact OG-OD2 3.26Å
332	Q	70.6	Confident	76.5	Confident	26 Å²	26	61 Å²	61	12%	0.121	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-19.7	175.1	-63.3	178.6	31.5	0	0	111.7	L323 D324 L335	L323-Q332 HydrophobicContact CD1-CB 3.67Å; L323-Q332 HydrophobicContact CD2-CB 4.35Å; L323-Q332 HydrophobicContact CG-CB 3.69Å; D324-Q332 VanDerWaalsContact CB-NE2 3.31Å; D324-Q332 WeakPolarHBondContact O-CB 3.4Å; D324-Q332 WeakPolarHBondContact O-CG 3.44Å; D324-Q332 PolarHBondContact O-NE2 2.73Å; Q332-L335 WeakPolarHBondContact O-CB 3.37Å; Q332-L335 PolarHBondContact O-N 3.12Å
333	F	74.3	Confident	76.8	Confident	72 Å²	72	57.7 Å²	57.7	32%	0.316	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-34.5	170.6	-78.8	-86	0	0	0	113.4	L323 N325 S331 L335 I336	L323-F333 HydrophobicContact CD2-CD1 4.01Å; L323-F333 HydrophobicContact CD2-CD2 4.09Å; L323-F333 HydrophobicContact CD2-CE1 3.99Å; L323-F333 HydrophobicContact CD2-CE2 4.06Å; L323-F333 HydrophobicContact CD2-CG 4.06Å; L323-F333 HydrophobicContact CD2-CZ 4.01Å; L323-F333 HydrophobicContact CG-CE2 4.44Å; N325-F333 HydrophobicContact CB-CD2 4.28Å; N325-F333 HydrophobicContact CB-CE2 4.24Å; S331-F333 PolarHBondContact O-N 3.07Å; F333-L335 PolarHBondContact O-N 3.49Å; F333-I336 HydrophobicContact CD1-CD1 3.6Å; F333-I336 HydrophobicContact CE1-CD1 4.12Å; F333-I336 HydrophobicContact CG-CD1 4.33Å; F333-I336 VanDerWaalsContact O-CB 3.25Å; F333-I336 WeakPolarHBondContact O-CB 3.48Å; F333-I336 PolarHBondContact O-N 3.39Å
334	D	81.6	Confident	77.5	Confident	74 Å²	74	57.9 Å²	57.9	40%	0.396	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-62.4	-33.1	174.8	-63.1	-47.5	0	0	0	111.3	I330 S331 I336 N337	I330-D334 HydrophobicContact CG2-CB 3.73Å; S331-D334 WeakPolarHBondContact CB-OD2 3.49Å; S331-D334 PolarHBondContact N-OD2 3.47Å; S331-D334 WeakPolarHBondContact O-CB 3.3Å; S331-D334 PolarHBondContact O-N 3.29Å; S331-D334 PolarHBondContact OG-N 3.03Å; S331-D334 VanDerWaalsContact OG-N 3.14Å; S331-D334 PolarHBondContact OG-OD1 2.64Å; S331-D334 PolarHBondContact OG-OD2 3.26Å; D334-I336 PolarHBondContact O-N 3.41Å; D334-N337 WeakPolarHBondContact O-CB 3.42Å; D334-N337 PolarHBondContact O-N 3.1Å; D334-N337 VanDerWaalsContact O-N 3.16Å
335	L	88	Confident	78.5	Confident	17 Å²	17	55.2 Å²	55.2	9%	0.089	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-65.3	-24.3	176.7	-69	170.4	0	0	0	112.5	L66 Y110 Q332 F333 N337 Y338	L66-L335 VanDerWaalsContact CD1-O 3.31Å; L66-L335 WeakPolarHBondContact CD1-O 3.36Å; Y110-L335 HydrophobicContact CE2-CB 4Å; Y110-L335 HydrophobicContact CE2-CD1 3.69Å; Y110-L335 HydrophobicContact CE2-CG 4.48Å; Y110-L335 WeakPolarHBondContact OH-CD1 3.43Å; Q332-L335 WeakPolarHBondContact O-CB 3.37Å; Q332-L335 PolarHBondContact O-N 3.12Å; F333-L335 PolarHBondContact O-N 3.49Å; L335-N337 PolarHBondContact O-N 3.24Å; L335-Y338 HydrophobicContact CD2-CD2 4.27Å; L335-Y338 HydrophobicContact CD2-CE2 4.36Å; L335-Y338 PolarHBondContact O-N 3.14Å
336	I	90.5	Very high	79.9	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-60.9	-32.2	175.6	-60.6	173.1	0	0	0	110.8	M229 M231 L323 F333 D334 Y338 T339 S342 L349 I365	M229-I336 HydrophobicContact CE-CG1 4.43Å; M229-I336 HydrophobicContact SD-CG1 4.34Å; M231-I336 HydrophobicContact CE-CG2 4.04Å; L323-I336 HydrophobicContact CD2-CD1 3.57Å; L323-I336 HydrophobicContact CD2-CG1 4.03Å; F333-I336 HydrophobicContact CD1-CD1 3.6Å; F333-I336 HydrophobicContact CE1-CD1 4.12Å; F333-I336 HydrophobicContact CG-CD1 4.33Å; F333-I336 VanDerWaalsContact O-CB 3.25Å; F333-I336 WeakPolarHBondContact O-CB 3.48Å; F333-I336 PolarHBondContact O-N 3.39Å; D334-I336 PolarHBondContact O-N 3.41Å; I336-Y338 PolarHBondContact O-N 2.88Å; I336-Y338 VanDerWaalsContact O-N 3.11Å; I336-T339 VanDerWaalsContact O-CB 3.29Å; I336-T339 WeakPolarHBondContact O-CB 3.39Å; I336-T339 WeakPolarHBondContact O-CG2 3.41Å; I336-T339 PolarHBondContact O-N 3.29Å; I336-T339 PolarHBondContact O-OG1 3.38Å; I336-S342 VanDerWaalsContact O-CB 3.25Å; I336-S342 WeakPolarHBondContact O-CB 3.33Å; I336-L349 HydrophobicContact CD1-CD2 4.13Å; I336-L349 HydrophobicContact CG2-CD1 3.59Å; I336-L349 HydrophobicContact CG2-CD2 3.97Å; I336-L349 HydrophobicContact CG2-CG 4.45Å; I336-I365 HydrophobicContact CD1-CD1 3.59Å
337	N	90.5	Very high	81.6	Confident	48 Å²	48	48.4 Å²	48.4	26%	0.257	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-65.9	-15.8	-178.3	-62.9	-31.7	0	0	0	113.4	R63 S91 D334 L335 T339	R63-N337 PolarHBondContact NH1-O 2.91Å; S91-N337 PolarHBondContact O-OD1 3.13Å; D334-N337 WeakPolarHBondContact O-CB 3.42Å; D334-N337 PolarHBondContact O-N 3.1Å; D334-N337 VanDerWaalsContact O-N 3.16Å; L335-N337 PolarHBondContact O-N 3.24Å; N337-T339 VanDerWaalsContact C-N 3.29Å
338	Y	93	Very high	83.4	Confident	104 Å²	104	45.8 Å²	45.8	41%	0.408	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-86.5	1.7	172.7	-61.6	-87.4	0	0	0	113.2	F64 S65 L66 N140 L335 I336	F64-Y338 CarbonylContact C-O 3.59Å; F64-Y338 VanDerWaalsContact C-O 3.27Å; F64-Y338 WeakPolarHBondContact CA-O 3.23Å; S65-Y338 PolarHBondContact N-O 2.92Å; L66-Y338 PolarHBondContact N-O 3.15Å; N140-Y338 HydrophobicContact CB-CG 4.45Å; L335-Y338 HydrophobicContact CD2-CD2 4.27Å; L335-Y338 HydrophobicContact CD2-CE2 4.36Å; L335-Y338 PolarHBondContact O-N 3.14Å; I336-Y338 PolarHBondContact O-N 2.88Å; I336-Y338 VanDerWaalsContact O-N 3.11Å
339	T	95.4	Very high	85	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	-101.1	143.3	178.5	77	0	0	0	0	110	L66 V108 M229 I336 N337 S342	L66-T339 HydrophobicContact CB-CG2 3.91Å; L66-T339 HydrophobicContact CD1-CG2 3.54Å; L66-T339 HydrophobicContact CG-CG2 4.35Å; V108-T339 HydrophobicContact CB-CG2 4.43Å; V108-T339 HydrophobicContact CG1-CG2 3.62Å; V108-T339 HydrophobicContact CG2-CG2 4Å; M229-T339 HydrophobicContact CE-CG2 3.85Å; I336-T339 VanDerWaalsContact O-CB 3.29Å; I336-T339 WeakPolarHBondContact O-CB 3.39Å; I336-T339 WeakPolarHBondContact O-CG2 3.41Å; I336-T339 PolarHBondContact O-N 3.29Å; I336-T339 PolarHBondContact O-OG1 3.38Å; N337-T339 VanDerWaalsContact C-N 3.29Å; T339-S342 WeakPolarHBondContact O-CB 3.25Å; T339-S342 PolarHBondContact O-N 2.99Å; T339-S342 PolarHBondContact O-OG 3.03Å; T339-S342 PolarHBondContact OG1-N 2.68Å
340	F	96.4	Very high	85.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-37.4	172.7	-170.6	-98.3	0	0	0	113.5	V42 F57 T59 F64 S68 L70 I83 L96 S342 I343	V42-F340 HydrophobicContact CB-CE2 4.49Å; V42-F340 HydrophobicContact CG1-CE1 4.45Å; V42-F340 HydrophobicContact CG1-CE2 4Å; V42-F340 HydrophobicContact CG1-CZ 3.88Å; V42-F340 HydrophobicContact CG2-CD2 4.01Å; V42-F340 HydrophobicContact CG2-CE2 3.63Å; V42-F340 HydrophobicContact CG2-CZ 4.35Å; F57-F340 HydrophobicContact CB-CD1 3.81Å; F57-F340 HydrophobicContact CB-CE1 3.45Å; F57-F340 VanDerWaalsContact CB-CE1 3.45Å; F57-F340 HydrophobicContact CB-CZ 4.34Å; F57-F340 AromaticContact CD1-CE1 3.79Å; F57-F340 HydrophobicContact CD1-CE1 3.79Å; F57-F340 HydrophobicContact CD1-CZ 4.04Å; F57-F340 HydrophobicContact CD2-CE1 4.26Å; F57-F340 HydrophobicContact CG-CD1 4.37Å; F57-F340 AromaticContact CG-CE1 3.57Å; F57-F340 HydrophobicContact CG-CE1 3.57Å; F57-F340 HydrophobicContact CG-CZ 4.29Å; T59-F340 HydrophobicContact CG2-CB 3.47Å; T59-F340 VanDerWaalsContact CG2-CB 3.47Å; T59-F340 HydrophobicContact CG2-CD2 4.04Å; T59-F340 HydrophobicContact CG2-CG 3.88Å; F64-F340 HydrophobicContact CD1-CB 4.16Å; F64-F340 HydrophobicContact CD1-CD2 4.33Å; F64-F340 AromaticContact CD2-CD2 3.83Å; F64-F340 HydrophobicContact CD2-CD2 3.83Å; F64-F340 HydrophobicContact CE1-CD2 4.08Å; F64-F340 AromaticContact CE2-CD2 3.56Å; F64-F340 HydrophobicContact CE2-CD2 3.56Å; F64-F340 HydrophobicContact CE2-CE2 4.06Å; F64-F340 HydrophobicContact CG-CB 4.21Å; F64-F340 HydrophobicContact CG-CD2 4.21Å; F64-F340 AromaticContact CZ-CD2 3.69Å; F64-F340 HydrophobicContact CZ-CD2 3.69Å; F64-F340 HydrophobicContact CZ-CE2 4.23Å; S68-F340 PolarHBondContact OG-N 2.65Å; L70-F340 HydrophobicContact CB-CD1 4.43Å; L70-F340 HydrophobicContact CD2-CD1 4.13Å; L70-F340 HydrophobicContact CD2-CE1 4.18Å; I83-F340 HydrophobicContact CD1-CZ 4.23Å; L96-F340 HydrophobicContact CD2-CE1 3.72Å; L96-F340 HydrophobicContact CD2-CZ 4.13Å; F340-S342 PolarHBondContact O-N 3.46Å; F340-I343 HydrophobicContact CD2-CD1 4.2Å; F340-I343 HydrophobicContact CE2-CD1 3.75Å; F340-I343 HydrophobicContact CZ-CD1 4.01Å; F340-I343 WeakPolarHBondContact O-CG1 3.43Å; F340-I343 PolarHBondContact O-N 2.98Å
341	P	96.6	Very high	85.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-26.5	172.8	-29.8	35.1	0	0	0	115.2	S68 L70 A106 V108 M231 I343 F344 Y345	S68-P341 WeakPolarHBondContact OG-CD 3.34Å; L70-P341 HydrophobicContact CB-CG 4.27Å; L70-P341 HydrophobicContact CD1-CB 4.38Å; A106-P341 HydrophobicContact CB-CB 3.71Å; A106-P341 HydrophobicContact CB-CG 3.33Å; V108-P341 HydrophobicContact CG2-CG 4.12Å; M231-P341 HydrophobicContact SD-CB 3.68Å; M231-P341 HydrophobicContact SD-CG 4.34Å; P341-I343 VanDerWaalsContact C-N 3.28Å; P341-I343 PolarHBondContact O-N 3.06Å; P341-F344 PolarHBondContact O-N 3.35Å; P341-F344 VanDerWaalsContact O-N 3.11Å; P341-Y345 HydrophobicContact CB-CD2 4.02Å; P341-Y345 HydrophobicContact CB-CE2 4.28Å; P341-Y345 WeakPolarHBondContact O-CD2 3.38Å; P341-Y345 PolarHBondContact O-N 3.11Å
342	S	94	Very high	84.9	Confident	5 Å²	5	37.6 Å²	37.6	4%	0.035	19%	0.19	C	C	.	.	H	α-helix	trans	-59	-36.7	-178.7	68.1	0	0	0	0	113.9	I336 T339 F340 F344 Y345 A346	I336-S342 VanDerWaalsContact O-CB 3.25Å; I336-S342 WeakPolarHBondContact O-CB 3.33Å; T339-S342 WeakPolarHBondContact O-CB 3.25Å; T339-S342 PolarHBondContact O-N 2.99Å; T339-S342 PolarHBondContact O-OG 3.03Å; T339-S342 PolarHBondContact OG1-N 2.68Å; F340-S342 PolarHBondContact O-N 3.46Å; S342-F344 PolarHBondContact O-N 2.88Å; S342-Y345 PolarHBondContact O-N 3.05Å; S342-A346 WeakPolarHBondContact O-CA 3.45Å; S342-A346 WeakPolarHBondContact O-CB 3.42Å; S342-A346 PolarHBondContact O-N 2.88Å
343	I	94.8	Very high	83.8	Confident	5 Å²	5	40.9 Å²	40.9	3%	0.026	22%	0.216	C	C	.	.	H	α-helix	trans	-76.5	-13.2	-178.7	66.7	158.2	0	0	0	113.1	F64 L88 K94 R95 L96 F340 P341	F64-I343 HydrophobicContact CE1-CG2 4.27Å; L88-I343 HydrophobicContact CD2-CD1 3.59Å; L88-I343 HydrophobicContact CD2-CG2 4.25Å; K94-I343 CarbonylContact C-O 3.46Å; K94-I343 WeakPolarHBondContact CA-O 3.47Å; R95-I343 HydrophobicContact CB-CB 4.08Å; R95-I343 HydrophobicContact CB-CD1 4.28Å; R95-I343 PolarHBondContact N-O 2.91Å; L96-I343 HydrophobicContact CB-CD1 3.92Å; L96-I343 HydrophobicContact CB-CG1 4.1Å; L96-I343 PolarHBondContact N-O 3.27Å; F340-I343 HydrophobicContact CD2-CD1 4.2Å; F340-I343 HydrophobicContact CE2-CD1 3.75Å; F340-I343 HydrophobicContact CZ-CD1 4.01Å; F340-I343 WeakPolarHBondContact O-CG1 3.43Å; F340-I343 PolarHBondContact O-N 2.98Å; P341-I343 VanDerWaalsContact C-N 3.28Å; P341-I343 PolarHBondContact O-N 3.06Å
344	F	96.2	Very high	82.5	Confident	20 Å²	20	44.6 Å²	44.6	9%	0.088	24%	0.239	C	C	.	.	H	α-helix	trans	-92.6	-41.4	172.8	177	-104.9	0	0	0	111.1	L70 I72 L96 V101 S104 P341 S342	L70-F344 HydrophobicContact CD1-CD1 4.21Å; L70-F344 HydrophobicContact CD2-CB 3.86Å; L70-F344 HydrophobicContact CD2-CD1 4.49Å; L70-F344 HydrophobicContact CD2-CG 4.17Å; I72-F344 HydrophobicContact CD1-CD1 4.37Å; I72-F344 HydrophobicContact CD1-CD2 3.67Å; I72-F344 HydrophobicContact CD1-CE1 4.25Å; I72-F344 HydrophobicContact CD1-CE2 3.53Å; I72-F344 HydrophobicContact CD1-CG 4.1Å; I72-F344 HydrophobicContact CD1-CZ 3.84Å; I72-F344 HydrophobicContact CG1-CE1 4.32Å; I72-F344 HydrophobicContact CG1-CE2 4.32Å; I72-F344 HydrophobicContact CG1-CZ 4.12Å; I72-F344 HydrophobicContact CG2-CZ 4.39Å; L96-F344 HydrophobicContact CB-CB 4.28Å; L96-F344 HydrophobicContact CB-CD2 4.49Å; L96-F344 HydrophobicContact CD2-CB 4.17Å; L96-F344 HydrophobicContact CD2-CD2 4.35Å; L96-F344 HydrophobicContact CG-CB 4.4Å; L96-F344 HydrophobicContact CG-CD2 4.08Å; V101-F344 HydrophobicContact CG1-CZ 4.33Å; V101-F344 HydrophobicContact CG2-CZ 4.41Å; S104-F344 WeakPolarHBondContact OG-CE1 3.41Å; P341-F344 PolarHBondContact O-N 3.35Å; P341-F344 VanDerWaalsContact O-N 3.11Å; S342-F344 PolarHBondContact O-N 2.88Å
345	Y	94.5	Very high	80.9	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-90.7	2.5	-177.1	-68.8	-56.4	0	0	0	115	L70 S104 Y105 A106 M231 P341 S342 D347 R348 L349 I363	L70-Y345 HydrophobicContact CD1-CE2 4.04Å; S104-Y345 VanDerWaalsContact CB-OH 3.23Å; S104-Y345 WeakPolarHBondContact CB-OH 3.46Å; S104-Y345 PolarHBondContact O-OH 3.16Å; S104-Y345 VanDerWaalsContact OG-CE1 3.28Å; S104-Y345 WeakPolarHBondContact OG-CE1 3.39Å; S104-Y345 PolarHBondContact OG-OH 2.61Å; Y105-Y345 PolarHBondContact N-OH 3.12Å; A106-Y345 HydrophobicContact CB-CE2 4.42Å; M231-Y345 HydrophobicContact CB-CE2 4.27Å; M231-Y345 HydrophobicContact SD-CD2 4.3Å; M231-Y345 HydrophobicContact SD-CE2 4.47Å; P341-Y345 HydrophobicContact CB-CD2 4.02Å; P341-Y345 HydrophobicContact CB-CE2 4.28Å; P341-Y345 WeakPolarHBondContact O-CD2 3.38Å; P341-Y345 PolarHBondContact O-N 3.11Å; S342-Y345 PolarHBondContact O-N 3.05Å; Y345-D347 VanDerWaalsContact C-N 3.26Å; Y345-D347 PolarHBondContact O-N 3.19Å; Y345-R348 CarbonylContact O-C 3.6Å; Y345-R348 WeakPolarHBondContact O-CA 3.11Å; Y345-R348 PolarHBondContact O-N 2.78Å; Y345-L349 PolarHBondContact O-N 2.85Å; Y345-I363 HydrophobicContact CD1-CD1 4.12Å; Y345-I363 HydrophobicContact CD1-CG2 3.53Å; Y345-I363 HydrophobicContact CD2-CD1 3.79Å; Y345-I363 HydrophobicContact CE1-CG2 3.7Å; Y345-I363 HydrophobicContact CE2-CD1 4.26Å; Y345-I363 HydrophobicContact CG-CD1 3.7Å; Y345-I363 HydrophobicContact CG-CG2 4.23Å
346	A	91.3	Very high	79.2	Confident	15 Å²	15	52.6 Å²	52.6	12%	0.124	28%	0.282	C	S	.	.	H	α-helix	trans	-44.8	-45.8	-172.5	0	0	0	0	0	114.5	G93 K94 S342 R348 L349	G93-A346 WeakPolarHBondContact O-CB 3Å; K94-A346 HydrophobicContact CB-CB 4.22Å; K94-A346 VanDerWaalsContact N-CB 3.33Å; S342-A346 WeakPolarHBondContact O-CA 3.45Å; S342-A346 WeakPolarHBondContact O-CB 3.42Å; S342-A346 PolarHBondContact O-N 2.88Å; A346-R348 PolarHBondContact O-N 2.83Å; A346-R348 VanDerWaalsContact O-N 3.13Å; A346-L349 PolarHBondContact O-N 2.78Å
347	D	88.2	Confident	77.4	Confident	77 Å²	77	59 Å²	59	41%	0.412	32%	0.317	S	S	.	.	H	α-helix	trans	-70.4	-7.7	-178.6	-54.2	-25.4	0	0	0	113.9	K94 Y345 L360	K94-D347 VanDerWaalsContact CD-OD2 3.25Å; K94-D347 WeakPolarHBondContact CD-OD2 3.22Å; Y345-D347 VanDerWaalsContact C-N 3.26Å; Y345-D347 PolarHBondContact O-N 3.19Å; D347-L360 HydrophobicContact CB-CD1 4.13Å
348	R	89.5	Confident	75.6	Confident	39 Å²	39	61.7 Å²	61.7	15%	0.147	34%	0.339	C	S	.	.	H	α-helix	trans	-127.5	1.7	-173.9	-59.4	-176.8	63.7	-161.4	-2.8	113.9	N233 Y345 A346 L360 K361 P362 I363	N233-R348 PolarHBondContact O-NH2 3Å; N233-R348 PolarHBondContact OD1-NH1 3.3Å; Y345-R348 CarbonylContact O-C 3.6Å; Y345-R348 WeakPolarHBondContact O-CA 3.11Å; Y345-R348 PolarHBondContact O-N 2.78Å; A346-R348 PolarHBondContact O-N 2.83Å; A346-R348 VanDerWaalsContact O-N 3.13Å; R348-L360 HydrophobicContact CG-CB 4.2Å; R348-K361 VanDerWaalsContact CZ-O 3.29Å; R348-K361 PolarHBondContact NE-O 2.92Å; R348-K361 PolarHBondContact NH2-O 3.18Å; R348-P362 PolarHBondContact NH2-O 3.08Å; R348-P362 WeakPolarHBondContact O-CA 3.43Å; R348-I363 HydrophobicContact CB-CG2 3.94Å; R348-I363 VanDerWaalsContact CZ-CG2 3.4Å; R348-I363 PolarHBondContact O-N 3.15Å; R348-I363 VanDerWaalsContact O-N 3.15Å
349	L	86.3	Confident	74.3	Confident	23 Å²	23	65.5 Å²	65.5	12%	0.12	36%	0.36	C	S	.	.	H	α-helix	trans	-84.3	-32.9	175.3	-77.2	175.8	0	0	0	112.4	I336 Y345 A346 I363 I365	I336-L349 HydrophobicContact CD1-CD2 4.13Å; I336-L349 HydrophobicContact CG2-CD1 3.59Å; I336-L349 HydrophobicContact CG2-CD2 3.97Å; I336-L349 HydrophobicContact CG2-CG 4.45Å; Y345-L349 PolarHBondContact O-N 2.85Å; A346-L349 PolarHBondContact O-N 2.78Å; L349-I363 HydrophobicContact CD2-CD1 3.71Å; L349-I363 HydrophobicContact CD2-CG1 4.07Å; L349-I365 HydrophobicContact CD2-CD1 3.85Å
350	N	67	Low	73.5	Confident	112 Å²	112	69.8 Å²	69.8	60%	0.599	38%	0.383	S	S	*	.	S	Bend	trans	-91.5	147.4	-179.8	-68.7	-24.6	0	0	0	111.1	P352	N350-P352 WeakPolarHBondContact O-CD 3.18Å
351	D	55.6	Low	73	Confident	108 Å²	108	76.8 Å²	76.8	58%	0.578	41%	0.413	S	S	*	.			trans	-55.6	119.5	175.1	-179.9	4.7	0	0	0	110	S353 N354	D351-S353 PolarHBondContact O-N 3.31Å; D351-S353 WeakPolarHBondContact OD1-CB 3.46Å; D351-S353 PolarHBondContact OD1-N 3.45Å; D351-S353 PolarHBondContact OD1-OG 2.87Å; D351-S353 WeakPolarHBondContact OD2-CB 3.48Å; D351-S353 PolarHBondContact OD2-OG 3.04Å; D351-N354 PolarHBondContact O-N 3.12Å
352	P	49	Very low	72.7	Confident	41 Å²	41	79 Å²	79	27%	0.266	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-61.7	-8.2	178.8	24	-32.7	0	0	0	113.4	N350 N354 N355	N350-P352 WeakPolarHBondContact O-CD 3.18Å; P352-N354 PolarHBondContact O-N 2.99Å; P352-N355 PolarHBondContact O-N 3.12Å; P352-N355 VanDerWaalsContact O-O 3.05Å
353	S	46.8	Very low	72.6	Confident	95 Å²	95	79.6 Å²	79.6	66%	0.664	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-54.2	-25.1	173.2	69.5	0	0	0	0	113.8	D351	D351-S353 PolarHBondContact O-N 3.31Å; D351-S353 WeakPolarHBondContact OD1-CB 3.46Å; D351-S353 PolarHBondContact OD1-N 3.45Å; D351-S353 PolarHBondContact OD1-OG 2.87Å; D351-S353 WeakPolarHBondContact OD2-CB 3.48Å; D351-S353 PolarHBondContact OD2-OG 3.04Å
354	N	47.3	Very low	72.4	Confident	150 Å²	150	79.5 Å²	79.5	80%	0.802	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-96.9	-7.3	177.7	-121.4	-5	0	0	0	114.5	D351 P352	D351-N354 PolarHBondContact O-N 3.12Å; P352-N354 PolarHBondContact O-N 2.99Å
355	N	48.6	Very low	72.4	Confident	90 Å²	90	79.2 Å²	79.2	48%	0.481	43%	0.429	S	S	.	.			trans	-114.1	114.2	-179.3	-84.7	-23.9	0	0	0	109.9	P352 N357	P352-N355 PolarHBondContact O-N 3.12Å; P352-N355 VanDerWaalsContact O-O 3.05Å; N355-N357 CarbonylContact O-C 3.52Å; N355-N357 PolarHBondContact O-N 2.88Å
356	N	51.5	Low	72.4	Confident	168 Å²	168	79.7 Å²	79.7	90%	0.898	43%	0.431	S	S	*	.	S	Bend	trans	-53.6	-12.9	172.7	-69.5	-26.6	0	0	0	113.9	S358	N356-S358 VanDerWaalsContact C-N 3.29Å; N356-S358 PolarHBondContact O-N 2.82Å; N356-S358 VanDerWaalsContact O-N 3.13Å
357	N	52.3	Low	72.5	Confident	138 Å²	138	79.1 Å²	79.1	74%	0.738	43%	0.426	S	S	*	.			trans	-83.2	68.3	170.5	-75.3	-9.8	0	0	0	111.4	N355 Q359	N355-N357 CarbonylContact O-C 3.52Å; N355-N357 PolarHBondContact O-N 2.88Å; N357-Q359 PolarHBondContact O-N 2.88Å
358	S	54.1	Low	72.9	Confident	103 Å²	103	75.6 Å²	75.6	72%	0.72	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	8.3	-179.7	57.4	0	0	0	0	116.3	N356	N356-S358 VanDerWaalsContact C-N 3.29Å; N356-S358 PolarHBondContact O-N 2.82Å; N356-S358 VanDerWaalsContact O-N 3.13Å
359	Q	65.8	Low	73.2	Confident	184 Å²	184	73.8 Å²	73.8	86%	0.86	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-26.8	-174.7	-68.3	-174.9	-4.3	0	0	113.8	N357	N357-Q359 PolarHBondContact O-N 2.88Å
360	L	77.6	Confident	73.8	Confident	90 Å²	90	72.7 Å²	72.7	47%	0.471	40%	0.395	S	S	.	.	S	Bend	trans	-95.6	108.9	-175.2	-69.9	169.8	0	0	0	110.7	D347 R348	D347-L360 HydrophobicContact CB-CD1 4.13Å; R348-L360 HydrophobicContact CG-CB 4.2Å
361	K	86	Confident	75.2	Confident	148 Å²	148	67.4 Å²	67.4	64%	0.643	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-67.8	146.3	174.5	-60.9	-174.1	177.3	-176.5	0	110.9	T235 R348	T235-K361 VanDerWaalsContact OG1-CB 3.25Å; T235-K361 WeakPolarHBondContact OG1-CB 3.19Å; R348-K361 VanDerWaalsContact CZ-O 3.29Å; R348-K361 PolarHBondContact NE-O 2.92Å; R348-K361 PolarHBondContact NH2-O 3.18Å
362	P	89.4	Confident	77.2	Confident	47 Å²	47	62.4 Å²	62.4	31%	0.305	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-63.3	153.4	179.7	25.6	-32.7	0	0	0	111.7	T235 R348	T235-P362 WeakPolarHBondContact CB-O 3.3Å; T235-P362 HydrophobicContact CG2-CG 3.95Å; T235-P362 PolarHBondContact OG1-O 2.82Å; R348-P362 PolarHBondContact NH2-O 3.08Å; R348-P362 WeakPolarHBondContact O-CA 3.43Å
363	I	92.4	Very high	79.5	Confident	16 Å²	16	60.6 Å²	60.6	8%	0.082	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-77	163.2	170.4	59.4	155.7	0	0	0	111.4	M231 S232 L234 Y345 R348 L349 I365	M231-I363 HydrophobicContact CB-CD1 4.3Å; M231-I363 HydrophobicContact SD-CD1 4.47Å; S232-I363 VanDerWaalsContact O-CB 3.32Å; S232-I363 WeakPolarHBondContact O-CB 3.41Å; L234-I363 CarbonylContact O-C 3.42Å; Y345-I363 HydrophobicContact CD1-CD1 4.12Å; Y345-I363 HydrophobicContact CD1-CG2 3.53Å; Y345-I363 HydrophobicContact CD2-CD1 3.79Å; Y345-I363 HydrophobicContact CE1-CG2 3.7Å; Y345-I363 HydrophobicContact CE2-CD1 4.26Å; Y345-I363 HydrophobicContact CG-CD1 3.7Å; Y345-I363 HydrophobicContact CG-CG2 4.23Å; R348-I363 HydrophobicContact CB-CG2 3.94Å; R348-I363 VanDerWaalsContact CZ-CG2 3.4Å; R348-I363 PolarHBondContact O-N 3.15Å; R348-I363 VanDerWaalsContact O-N 3.15Å; L349-I363 HydrophobicContact CD2-CD1 3.71Å; L349-I363 HydrophobicContact CD2-CG1 4.07Å; I363-I365 HydrophobicContact CD1-CD1 4.25Å; I363-I365 HydrophobicContact CD1-CG1 4.08Å; I363-I365 HydrophobicContact CG1-CG1 4.38Å
364	S	92	Very high	81.8	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.021	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	131.9	176.1	-58.5	0	0	0	0	110.8	M231 S232 L234 T235 L236	M231-S364 CarbonylContact C-O 3.56Å; M231-S364 VanDerWaalsContact CA-O 3.32Å; M231-S364 WeakPolarHBondContact CA-O 3.4Å; S232-S364 PolarHBondContact N-O 3.47Å; S232-S364 PolarHBondContact O-N 2.8Å; S232-S364 VanDerWaalsContact O-N 3.1Å; L234-S364 VanDerWaalsContact C-OG 3.22Å; L234-S364 VanDerWaalsContact O-CB 3.31Å; L234-S364 WeakPolarHBondContact O-CB 3.3Å; L234-S364 PolarHBondContact O-N 2.81Å; L234-S364 PolarHBondContact O-OG 3.04Å; T235-S364 VanDerWaalsContact CA-OG 3.28Å; T235-S364 WeakPolarHBondContact CA-OG 3.25Å; L236-S364 WeakPolarHBondContact CB-OG 3.12Å; L236-S364 VanDerWaalsContact CG-OG 3.27Å; L236-S364 WeakPolarHBondContact CG-OG 3.36Å; L236-S364 PolarHBondContact N-OG 3.26Å
365	I	94.4	Very high	84.1	Confident	15 Å²	15	53.6 Å²	53.6	8%	0.077	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.1	176.1	-52.7	-178	0	0	0	108.5	M229 M230 M231 L323 I336 L349 I363	M229-I365 HydrophobicContact CG-CG2 3.53Å; M229-I365 HydrophobicContact SD-CG2 3.64Å; M230-I365 WeakPolarHBondContact O-CA 3.31Å; M231-I365 HydrophobicContact CE-CD1 4.31Å; M231-I365 HydrophobicContact CG-CG1 4.24Å; L323-I365 HydrophobicContact CB-CG2 4.44Å; L323-I365 HydrophobicContact CD2-CG2 4.5Å; I336-I365 HydrophobicContact CD1-CD1 3.59Å; L349-I365 HydrophobicContact CD2-CD1 3.85Å; I363-I365 HydrophobicContact CD1-CD1 4.25Å; I363-I365 HydrophobicContact CD1-CG1 4.08Å; I363-I365 HydrophobicContact CG1-CG1 4.38Å
366	R	94.5	Very high	86.3	Confident	12 Å²	12	55.1 Å²	55.1	5%	0.045	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	144.8	177.6	-69.3	-64.3	179	-82.6	-0.9	110.2	M230 D237 E240 F242 Q320 L322	M230-R366 HydrophobicContact CE-CB 3.88Å; M230-R366 PolarHBondContact N-O 2.84Å; M230-R366 PolarHBondContact O-N 2.64Å; D237-R366 PolarHBondContact O-NH2 2.89Å; E240-R366 PolarHBondContact O-NE 2.8Å; E240-R366 PolarHBondContact O-NH2 2.93Å; F242-R366 HydrophobicContact CD2-CB 3.92Å; F242-R366 HydrophobicContact CD2-CG 3.95Å; F242-R366 HydrophobicContact CE2-CB 3.76Å; F242-R366 HydrophobicContact CE2-CG 3.77Å; Q320-R366 HydrophobicContact CB-CB 4.05Å; Q320-R366 HydrophobicContact CB-CG 4.41Å; Q320-R366 VanDerWaalsContact OE1-CB 3.32Å; L322-R366 VanDerWaalsContact CD2-CZ 3.47Å
367	L	95.1	Very high	88.4	Confident	3 Å²	3	48 Å²	48	2%	0.016	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.8	-180	-57.5	174.8	0	0	0	109.6	Y110 Q227 L228 M229 Q320 D321 L323	Y110-L367 HydrophobicContact CD1-CD2 3.94Å; Y110-L367 HydrophobicContact CE1-CD1 4.41Å; Y110-L367 HydrophobicContact CE1-CD2 4.29Å; Q227-L367 HydrophobicContact CG-CB 3.96Å; Q227-L367 HydrophobicContact CG-CD2 4.39Å; L228-L367 CarbonylContact O-C 3.46Å; L228-L367 WeakPolarHBondContact O-CA 3.49Å; M229-L367 HydrophobicContact CB-CD2 3.62Å; M229-L367 HydrophobicContact CG-CD2 3.96Å; M229-L367 HydrophobicContact SD-CD2 4.48Å; Q320-L367 WeakPolarHBondContact CA-O 3.32Å; D321-L367 HydrophobicContact CB-CB 4.08Å; D321-L367 HydrophobicContact CB-CD1 4.41Å; D321-L367 PolarHBondContact N-O 2.87Å; D321-L367 PolarHBondContact O-N 2.82Å; L323-L367 HydrophobicContact CD1-CD1 4.2Å; L323-L367 HydrophobicContact CD1-CD2 4.16Å
368	L	96.4	Very high	90.4	Very high	3 Å²	3	43 Å²	43	2%	0.016	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.3	175.6	-177.7	70.5	0	0	0	109.7	Q227 L228 M230 I264 I295 I316 V370	Q227-L368 WeakPolarHBondContact CA-O 3.47Å; L228-L368 HydrophobicContact CB-CB 4.36Å; L228-L368 HydrophobicContact CD1-CD2 4.48Å; L228-L368 PolarHBondContact N-O 2.88Å; L228-L368 PolarHBondContact O-N 2.82Å; M230-L368 HydrophobicContact CE-CB 3.88Å; M230-L368 HydrophobicContact SD-CB 4.08Å; M230-L368 HydrophobicContact SD-CD2 4.43Å; I264-L368 HydrophobicContact CD1-CD1 3.55Å; I264-L368 HydrophobicContact CD1-CD2 3.26Å; I264-L368 HydrophobicContact CD1-CG 3.99Å; I295-L368 HydrophobicContact CD1-CD2 4.18Å; I316-L368 HydrophobicContact CG2-CD1 3.75Å; I316-L368 HydrophobicContact CG2-CG 4.41Å; L368-V370 HydrophobicContact CD2-CG2 3.92Å; L368-V370 HydrophobicContact CG-CG2 4Å
369	N	95.7	Very high	92.5	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	125.6	175.1	-63.9	-30.9	0	0	0	109.7	M124 Q227 S317 D321	M124-N369 HydrophobicContact CE-CB 4Å; M124-N369 HydrophobicContact CG-CB 3.93Å; M124-N369 HydrophobicContact SD-CB 3.78Å; Q227-N369 WeakPolarHBondContact CG-OD1 3.49Å; Q227-N369 PolarHBondContact NE2-OD1 3.3Å; S317-N369 PolarHBondContact N-O 3.02Å; S317-N369 PolarHBondContact OG-N 3.46Å; S317-N369 PolarHBondContact OG-O 3.22Å; D321-N369 PolarHBondContact OD2-ND2 3.01Å
370	V	97.5	Very high	94	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.7	179.7	-174.1	0	0	0	0	108.5	M124 G225 L226 L228 V314 Y315 L368 F372 W388	M124-V370 VanDerWaalsContact SD-O 3.4Å; G225-V370 CarbonylContact C-O 3.59Å; G225-V370 WeakPolarHBondContact CA-O 3.34Å; L226-V370 PolarHBondContact N-O 3.14Å; L226-V370 PolarHBondContact O-N 2.77Å; L228-V370 HydrophobicContact CD1-CG2 4.49Å; V314-V370 HydrophobicContact CG1-CG1 3.32Å; Y315-V370 CarbonylContact O-C 3.57Å; Y315-V370 WeakPolarHBondContact O-CA 3.47Å; L368-V370 HydrophobicContact CD2-CG2 3.92Å; L368-V370 HydrophobicContact CG-CG2 4Å; V370-F372 HydrophobicContact CB-CZ 4.43Å; V370-F372 HydrophobicContact CG1-CD1 4.48Å; V370-F372 HydrophobicContact CG1-CE1 3.65Å; V370-F372 HydrophobicContact CG1-CZ 3.86Å; V370-W388 HydrophobicContact CG1-CH2 4.16Å; V370-W388 HydrophobicContact CG1-CZ2 4.09Å; V370-W388 HydrophobicContact CG1-CZ3 4.46Å; V370-W388 HydrophobicContact CG2-CH2 4.21Å
371	S	97.2	Very high	94.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	148.9	-178	-58.1	0	0	0	0	111	V122 M124 V314 Y315	V122-S371 WeakPolarHBondContact O-CB 3.32Å; V122-S371 PolarHBondContact O-OG 2.86Å; M124-S371 WeakPolarHBondContact CB-OG 3.32Å; M124-S371 WeakPolarHBondContact CG-OG 3.38Å; M124-S371 PolarHBondContact N-OG 3.44Å; M124-S371 PolarHBondContact SD-OG 2.99Å; V314-S371 CarbonylContact C-O 3.52Å; V314-S371 WeakPolarHBondContact CA-O 3.28Å; Y315-S371 PolarHBondContact N-O 3.35Å; Y315-S371 PolarHBondContact O-N 3.15Å
372	F	97.9	Very high	95.4	Very high	3 Å²	3	29.4 Å²	29.4	1%	0.013	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133.1	-171.4	-53.6	-63.9	0	0	0	112.1	V122 F212 F224 L226 C299 V314 V370 I386 W388	V122-F372 VanDerWaalsContact CG1-C 3.47Å; F212-F372 HydrophobicContact CD2-CD2 4.39Å; F212-F372 AromaticContact CE2-CD2 3.69Å; F212-F372 HydrophobicContact CE2-CD2 3.69Å; F212-F372 AromaticContact CE2-CE2 3.61Å; F212-F372 HydrophobicContact CE2-CE2 3.61Å; F212-F372 HydrophobicContact CZ-CE2 4.01Å; F224-F372 WeakPolarHBondContact O-CD2 3.4Å; F224-F372 PolarHBondContact O-N 3.04Å; L226-F372 HydrophobicContact CB-CE2 3.98Å; L226-F372 HydrophobicContact CB-CZ 4.13Å; C299-F372 HydrophobicContact CB-CD1 4.22Å; V314-F372 HydrophobicContact CG1-CD1 4.28Å; V314-F372 HydrophobicContact CG1-CE1 4.15Å; V314-F372 HydrophobicContact CG2-CD1 4.03Å; V314-F372 HydrophobicContact CG2-CE1 4.33Å; V370-F372 HydrophobicContact CB-CZ 4.43Å; V370-F372 HydrophobicContact CG1-CD1 4.48Å; V370-F372 HydrophobicContact CG1-CE1 3.65Å; V370-F372 HydrophobicContact CG1-CZ 3.86Å; F372-I386 HydrophobicContact CB-CD1 3.7Å; F372-I386 HydrophobicContact CB-CG2 4.22Å; F372-I386 HydrophobicContact CD1-CG2 4.49Å; F372-I386 HydrophobicContact CD2-CG2 4.47Å; F372-I386 HydrophobicContact CG-CD1 4.42Å; F372-I386 HydrophobicContact CG-CG2 4.13Å; F372-W388 HydrophobicContact CD1-CB 4.2Å; F372-W388 HydrophobicContact CD1-CG 4.33Å; F372-W388 HydrophobicContact CE1-CB 3.6Å; F372-W388 AromaticContact CE1-CD2 3.64Å; F372-W388 HydrophobicContact CE1-CD2 3.64Å; F372-W388 AromaticContact CE1-CE3 3.91Å; F372-W388 HydrophobicContact CE1-CE3 3.91Å; F372-W388 AromaticContact CE1-CG 3.5Å; F372-W388 HydrophobicContact CE1-CG 3.5Å; F372-W388 VanDerWaalsContact CE1-CG 3.5Å; F372-W388 HydrophobicContact CZ-CB 4.16Å; F372-W388 HydrophobicContact CZ-CD2 4.02Å; F372-W388 AromaticContact CZ-CE3 3.79Å; F372-W388 HydrophobicContact CZ-CE3 3.79Å; F372-W388 HydrophobicContact CZ-CG 4.2Å; F372-W388 HydrophobicContact CZ-CZ3 4.49Å
373	G	96.7	Very high	95.7	Very high	4 Å²	4	28.9 Å²	28.9	4%	0.041	17%	0.173	C	C	.	.			trans	136.1	175.2	175	0	0	0	0	0	113.8	N313 D377	N313-G373 CarbonylContact C-O 3.1Å; N313-G373 WeakPolarHBondContact CB-O 3.31Å; N313-G373 PolarHBondContact N-O 3.41Å; N313-G373 PolarHBondContact O-N 2.97Å; G373-D377 WeakPolarHBondContact CA-OD2 3.48Å
374	T	95.8	Very high	95.9	Very high	38 Å²	38	33.1 Å²	33.1	23%	0.233	19%	0.191	C	C	.	.			trans	-130.9	146	173.2	-56.6	0	0	0	0	108.5	R223 R312 N313 T376 D377	R223-T374 PolarHBondContact NH2-O 3.27Å; R312-T374 WeakPolarHBondContact CA-OG1 3.31Å; N313-T374 PolarHBondContact N-OG1 3.28Å; T374-T376 PolarHBondContact O-N 3.29Å; T374-D377 PolarHBondContact N-OD2 3.23Å; T374-D377 WeakPolarHBondContact O-CB 3.45Å; T374-D377 PolarHBondContact O-N 3.11Å; T374-D377 VanDerWaalsContact O-N 3.11Å
375	S	95.3	Very high	96.1	Very high	59 Å²	59	34.3 Å²	34.3	41%	0.413	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	140.7	172.6	175.6	0	0	0	0	111	D120 D377	D120-S375 WeakPolarHBondContact O-CB 3.29Å; D120-S375 VanDerWaalsContact OD2-CA 3.25Å; D120-S375 WeakPolarHBondContact OD2-CA 3.43Å; D120-S375 WeakPolarHBondContact OD2-CB 3.36Å; D120-S375 PolarHBondContact OD2-OG 2.68Å; S375-D377 PolarHBondContact O-N 3.45Å
376	T	94.6	Very high	96.3	Very high	123 Å²	123	34.1 Å²	34.1	76%	0.755	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.1	13.2	-178.4	70.8	0	0	0	0	115.3	D120 T374 G378	D120-T376 PolarHBondContact OD2-N 2.64Å; T374-T376 PolarHBondContact O-N 3.29Å; T376-G378 PolarHBondContact O-N 3.43Å
377	D	95.2	Very high	96.5	Very high	18 Å²	18	33.6 Å²	33.6	10%	0.096	19%	0.193	C	C	.	.	S	Bend	trans	-70.5	-11.8	177.1	66.8	-1.5	0	0	0	114.1	R223 G373 T374 S375 F379 K382	R223-D377 IonicContact CZ-OD1 2.67Å; R223-D377 IonicContact CZ-OD2 3.75Å; R223-D377 IonicContact NH1-OD1 2.75Å; R223-D377 PolarHBondContact NH1-OD1 3.23Å; R223-D377 IonicContact NH1-OD2 3.54Å; R223-D377 PolarHBondContact NH1-OD2 2.99Å; R223-D377 IonicContact NH2-OD1 3.3Å; R223-D377 PolarHBondContact NH2-OD1 3.29Å; R223-D377 IonicContact NH2-OD2 2.72Å; G373-D377 WeakPolarHBondContact CA-OD2 3.48Å; T374-D377 PolarHBondContact N-OD2 3.23Å; T374-D377 WeakPolarHBondContact O-CB 3.45Å; T374-D377 PolarHBondContact O-N 3.11Å; T374-D377 VanDerWaalsContact O-N 3.11Å; S375-D377 PolarHBondContact O-N 3.45Å; D377-F379 WeakPolarHBondContact OD1-CA 3.47Å; D377-F379 PolarHBondContact OD1-N 3.01Å; D377-K382 WeakPolarHBondContact O-CD 3.41Å; D377-K382 PolarHBondContact O-NZ 2.78Å
378	G	95.6	Very high	96.7	Very high	33 Å²	33	33.4 Å²	33.4	34%	0.34	19%	0.192	S	C	.	.			trans	85.2	17.8	-174.3	0	0	0	0	0	113.9	T376	T376-G378 PolarHBondContact O-N 3.43Å
379	F	97.2	Very high	96.7	Very high	37 Å²	37	33.3 Å²	33.3	16%	0.162	19%	0.192	C	C	.	.	H	α-helix	trans	61.2	-175.2	177.2	-49.3	-78.8	0	0	0	113	D117 D120 Q221 R223 D377 A381 K382	D117-F379 HydrophobicContact CB-CE1 4.32Å; D120-F379 HydrophobicContact CB-CE1 4.28Å; D120-F379 HydrophobicContact CB-CZ 4.27Å; D120-F379 VanDerWaalsContact OD1-CE1 3.29Å; D120-F379 WeakPolarHBondContact OD1-CE1 3.3Å; Q221-F379 HydrophobicContact CB-CD1 3.93Å; Q221-F379 HydrophobicContact CB-CD2 4.23Å; Q221-F379 HydrophobicContact CB-CE1 3.71Å; Q221-F379 HydrophobicContact CB-CE2 4.04Å; Q221-F379 HydrophobicContact CB-CG 4.2Å; Q221-F379 HydrophobicContact CB-CZ 3.8Å; Q221-F379 HydrophobicContact CG-CD2 4.23Å; Q221-F379 HydrophobicContact CG-CE1 4.13Å; Q221-F379 HydrophobicContact CG-CE2 3.7Å; Q221-F379 HydrophobicContact CG-CZ 3.66Å; R223-F379 HydrophobicContact CG-CD1 4.03Å; D377-F379 WeakPolarHBondContact OD1-CA 3.47Å; D377-F379 PolarHBondContact OD1-N 3.01Å; F379-A381 PolarHBondContact O-N 3.24Å; F379-K382 PolarHBondContact O-N 3.34Å
380	Y	97.2	Very high	96.8	Very high	6 Å²	6	33.3 Å²	33.3	2%	0.024	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-33.8	-179.4	-175.6	-95.7	0	0	0	112.5	F212 L215 S222 F224 K382 S383 K384 I386	F212-Y380 HydrophobicContact CB-CE2 3.97Å; F212-Y380 PolarHBondContact O-OH 3.49Å; L215-Y380 HydrophobicContact CB-CE1 3.89Å; L215-Y380 PolarHBondContact N-OH 2.77Å; L215-Y380 WeakPolarHBondContact O-CE1 3.48Å; S222-Y380 VanDerWaalsContact O-CB 3.31Å; S222-Y380 WeakPolarHBondContact O-CB 3.38Å; S222-Y380 PolarHBondContact O-N 3.38Å; S222-Y380 VanDerWaalsContact O-N 3.11Å; F224-Y380 AromaticContact CD2-CD1 3.86Å; F224-Y380 HydrophobicContact CD2-CD1 3.86Å; F224-Y380 AromaticContact CD2-CD2 3.65Å; F224-Y380 HydrophobicContact CD2-CD2 3.65Å; F224-Y380 HydrophobicContact CD2-CE1 4.25Å; F224-Y380 HydrophobicContact CD2-CE2 4.05Å; F224-Y380 AromaticContact CD2-CG 3.51Å; F224-Y380 HydrophobicContact CD2-CG 3.51Å; F224-Y380 AromaticContact CE2-CD1 3.42Å; F224-Y380 HydrophobicContact CE2-CD1 3.42Å; F224-Y380 VanDerWaalsContact CE2-CD1 3.42Å; F224-Y380 HydrophobicContact CE2-CD2 4.1Å; F224-Y380 AromaticContact CE2-CE1 3.75Å; F224-Y380 HydrophobicContact CE2-CE1 3.75Å; F224-Y380 HydrophobicContact CE2-CE2 4.37Å; F224-Y380 AromaticContact CE2-CG 3.59Å; F224-Y380 HydrophobicContact CE2-CG 3.59Å; Y380-K382 PolarHBondContact O-N 3.13Å; Y380-S383 PolarHBondContact O-N 3.05Å; Y380-K384 HydrophobicContact CE1-CB 4.33Å; Y380-K384 VanDerWaalsContact CZ-C 3.48Å; Y380-K384 WeakPolarHBondContact O-CA 3.34Å; Y380-K384 PolarHBondContact O-N 3.11Å; Y380-K384 PolarHBondContact OH-O 3.26Å; Y380-K384 VanDerWaalsContact OH-O 3.08Å; Y380-I386 HydrophobicContact CD2-CD1 3.48Å; Y380-I386 VanDerWaalsContact CD2-CD1 3.48Å; Y380-I386 HydrophobicContact CD2-CG1 3.84Å; Y380-I386 HydrophobicContact CE2-CB 4.44Å; Y380-I386 HydrophobicContact CE2-CD1 3.84Å; Y380-I386 HydrophobicContact CE2-CG1 3.87Å
381	A	96.4	Very high	96.9	Very high	49 Å²	49	33.3 Å²	33.3	41%	0.405	19%	0.192	S	C	.	.	H	α-helix	trans	-58.3	-25.3	-176.4	0	0	0	0	0	113.9	F379	F379-A381 PolarHBondContact O-N 3.24Å
382	K	96.6	Very high	96.9	Very high	147 Å²	147	33.3 Å²	33.3	64%	0.639	19%	0.192	S	C	*	.	H	α-helix	trans	-71.5	-45.7	-179.5	-172.6	-176.3	-172.9	172.8	0	113.4	D377 F379 Y380	D377-K382 WeakPolarHBondContact O-CD 3.41Å; D377-K382 PolarHBondContact O-NZ 2.78Å; F379-K382 PolarHBondContact O-N 3.34Å; Y380-K382 PolarHBondContact O-N 3.13Å
383	S	95.8	Very high	96.9	Very high	37 Å²	37	33.1 Å²	33.1	26%	0.259	19%	0.191	S	C	.	.	H	α-helix	trans	-97.5	-29.8	-179.6	60.6	0	0	0	0	112.9	Y380 F385	Y380-S383 PolarHBondContact O-N 3.05Å; S383-F385 PolarHBondContact O-N 3.16Å; S383-F385 VanDerWaalsContact O-N 3.11Å; S383-F385 PolarHBondContact OG-N 2.9Å; S383-F385 PolarHBondContact OG-O 2.89Å
384	K	96.4	Very high	96.7	Very high	104 Å²	104	33.1 Å²	33.1	45%	0.452	19%	0.19	S	C	.	.			trans	51	26.6	-168.4	-56.1	-173.9	177	-175.3	0	113.3	N214 Y380	N214-K384 WeakPolarHBondContact CA-O 3.47Å; N214-K384 PolarHBondContact N-O 3.18Å; Y380-K384 HydrophobicContact CE1-CB 4.33Å; Y380-K384 VanDerWaalsContact CZ-C 3.48Å; Y380-K384 WeakPolarHBondContact O-CA 3.34Å; Y380-K384 PolarHBondContact O-N 3.11Å; Y380-K384 PolarHBondContact OH-O 3.26Å; Y380-K384 VanDerWaalsContact OH-O 3.08Å
385	F	97.7	Very high	96.4	Very high	29 Å²	29	32 Å²	32	13%	0.127	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	134.9	-177.3	-171.1	-86.4	0	0	0	110.4	L211 F212 N213 I301 N303 S383 V387	L211-F385 HydrophobicContact CD2-CE2 4.33Å; L211-F385 HydrophobicContact CD2-CZ 3.91Å; L211-F385 HydrophobicContact CG-CZ 4.4Å; F212-F385 WeakPolarHBondContact O-CA 3.16Å; N213-F385 HydrophobicContact CB-CD2 4.4Å; N213-F385 HydrophobicContact CB-CE2 4.42Å; I301-F385 VanDerWaalsContact C-CD1 3.45Å; I301-F385 WeakPolarHBondContact O-CD1 3.34Å; N303-F385 HydrophobicContact CB-CE1 4.1Å; N303-F385 HydrophobicContact CB-CE2 4.46Å; N303-F385 HydrophobicContact CB-CZ 3.64Å; S383-F385 PolarHBondContact O-N 3.16Å; S383-F385 VanDerWaalsContact O-N 3.11Å; S383-F385 PolarHBondContact OG-N 2.9Å; S383-F385 PolarHBondContact OG-O 2.89Å; F385-V387 HydrophobicContact CE1-CB 3.84Å; F385-V387 HydrophobicContact CE1-CG1 3.85Å; F385-V387 HydrophobicContact CZ-CB 4.19Å
386	I	98.1	Very high	96.2	Very high	11 Å²	11	35.8 Å²	35.8	6%	0.056	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	138.7	168.6	-68.1	169.8	0	0	0	107.7	L211 F212 C299 F300 F372 Y380	L211-I386 CarbonylContact C-O 3.5Å; L211-I386 WeakPolarHBondContact CA-O 3.38Å; F212-I386 HydrophobicContact CB-CB 4.37Å; F212-I386 HydrophobicContact CD2-CB 4.37Å; F212-I386 HydrophobicContact CD2-CD1 4.29Å; F212-I386 PolarHBondContact N-O 3.3Å; F212-I386 PolarHBondContact O-N 3.05Å; C299-I386 HydrophobicContact CB-CG2 4.2Å; F300-I386 CarbonylContact O-C 3.58Å; F300-I386 WeakPolarHBondContact O-CA 3.11Å; F372-I386 HydrophobicContact CB-CD1 3.7Å; F372-I386 HydrophobicContact CB-CG2 4.22Å; F372-I386 HydrophobicContact CD1-CG2 4.49Å; F372-I386 HydrophobicContact CD2-CG2 4.47Å; F372-I386 HydrophobicContact CG-CD1 4.42Å; F372-I386 HydrophobicContact CG-CG2 4.13Å; Y380-I386 HydrophobicContact CD2-CD1 3.48Å; Y380-I386 VanDerWaalsContact CD2-CD1 3.48Å; Y380-I386 HydrophobicContact CD2-CG1 3.84Å; Y380-I386 HydrophobicContact CE2-CB 4.44Å; Y380-I386 HydrophobicContact CE2-CD1 3.84Å; Y380-I386 HydrophobicContact CE2-CG1 3.87Å
387	V	98.3	Very high	96.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	130.1	159.5	62.1	0	0	0	0	110.1	D209 V210 L211 C299 F300 R306 F385	D209-V387 HydrophobicContact CB-CG2 4.07Å; V210-V387 WeakPolarHBondContact O-CA 3.29Å; L211-V387 HydrophobicContact CD1-CG2 3.95Å; L211-V387 HydrophobicContact CD2-CG2 4.42Å; L211-V387 HydrophobicContact CG-CB 3.98Å; L211-V387 HydrophobicContact CG-CG2 3.68Å; C299-V387 CarbonylContact C-O 3.57Å; C299-V387 WeakPolarHBondContact CA-O 3.39Å; C299-V387 WeakPolarHBondContact CB-O 3.38Å; F300-V387 HydrophobicContact CB-CG1 3.81Å; F300-V387 PolarHBondContact N-O 3.3Å; F300-V387 PolarHBondContact O-N 2.9Å; R306-V387 VanDerWaalsContact NH2-CG2 3.33Å; F385-V387 HydrophobicContact CE1-CB 3.84Å; F385-V387 HydrophobicContact CE1-CG1 3.85Å; F385-V387 HydrophobicContact CZ-CB 4.19Å
388	W	98.2	Very high	95.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136.9	176.2	172.2	57.7	0	0	0	110	F208 D209 V210 L226 L228 I295 C299 V314 V370 F372 A390	F208-W388 HydrophobicContact CE2-CE3 4.33Å; F208-W388 HydrophobicContact CE2-CH2 4.06Å; F208-W388 AromaticContact CE2-CZ3 3.73Å; F208-W388 HydrophobicContact CE2-CZ3 3.73Å; F208-W388 HydrophobicContact CZ-CH2 4.3Å; F208-W388 HydrophobicContact CZ-CZ3 4.39Å; D209-W388 CarbonylContact C-O 3.48Å; D209-W388 WeakPolarHBondContact CA-O 3.48Å; V210-W388 HydrophobicContact CB-CE3 4.43Å; V210-W388 HydrophobicContact CG2-CE3 4.24Å; V210-W388 PolarHBondContact N-O 3.07Å; V210-W388 PolarHBondContact O-N 3Å; L226-W388 HydrophobicContact CD2-CE3 4.37Å; L226-W388 HydrophobicContact CD2-CZ3 3.94Å; L228-W388 HydrophobicContact CD1-CH2 3.87Å; L228-W388 HydrophobicContact CD1-CZ3 4.07Å; I295-W388 HydrophobicContact CB-CZ2 4.49Å; I295-W388 HydrophobicContact CD1-CH2 4.43Å; I295-W388 HydrophobicContact CD1-CZ2 4.01Å; I295-W388 HydrophobicContact CG1-CZ2 3.97Å; I295-W388 HydrophobicContact CG2-CZ2 3.75Å; C299-W388 HydrophobicContact CB-CB 3.97Å; V314-W388 HydrophobicContact CG2-CG 4.36Å; V370-W388 HydrophobicContact CG1-CH2 4.16Å; V370-W388 HydrophobicContact CG1-CZ2 4.09Å; V370-W388 HydrophobicContact CG1-CZ3 4.46Å; V370-W388 HydrophobicContact CG2-CH2 4.21Å; F372-W388 HydrophobicContact CD1-CB 4.2Å; F372-W388 HydrophobicContact CD1-CG 4.33Å; F372-W388 HydrophobicContact CE1-CB 3.6Å; F372-W388 AromaticContact CE1-CD2 3.64Å; F372-W388 HydrophobicContact CE1-CD2 3.64Å; F372-W388 AromaticContact CE1-CE3 3.91Å; F372-W388 HydrophobicContact CE1-CE3 3.91Å; F372-W388 AromaticContact CE1-CG 3.5Å; F372-W388 HydrophobicContact CE1-CG 3.5Å; F372-W388 VanDerWaalsContact CE1-CG 3.5Å; F372-W388 HydrophobicContact CZ-CB 4.16Å; F372-W388 HydrophobicContact CZ-CD2 4.02Å; F372-W388 AromaticContact CZ-CE3 3.79Å; F372-W388 HydrophobicContact CZ-CE3 3.79Å; F372-W388 HydrophobicContact CZ-CG 4.2Å; F372-W388 HydrophobicContact CZ-CZ3 4.49Å; W388-A390 HydrophobicContact CH2-CB 3.9Å; W388-A390 HydrophobicContact CZ2-CB 3.56Å
389	T	98	Very high	95.3	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.006	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	133.8	-179.4	-57.4	0	0	0	0	110.2	L198 F208 D209 R306	L198-T389 HydrophobicContact CD1-CG2 4.09Å; F208-T389 VanDerWaalsContact O-CA 3.3Å; F208-T389 WeakPolarHBondContact O-CA 3.3Å; D209-T389 WeakPolarHBondContact OD1-CB 3.4Å; D209-T389 WeakPolarHBondContact OD1-CG2 3.33Å; D209-T389 PolarHBondContact OD1-OG1 2.84Å; R306-T389 PolarHBondContact NH1-OG1 3.46Å
390	A	98.1	Very high	94.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	167.2	172.4	0	0	0	0	0	111	Q207 F208 Q294 I295 W388	Q207-A390 WeakPolarHBondContact CA-O 3.34Å; F208-A390 HydrophobicContact CE1-CB 4.06Å; F208-A390 HydrophobicContact CE2-CB 3.82Å; F208-A390 HydrophobicContact CZ-CB 3.51Å; F208-A390 PolarHBondContact N-O 2.92Å; F208-A390 PolarHBondContact O-N 2.89Å; Q294-A390 WeakPolarHBondContact O-CB 3.46Å; I295-A390 HydrophobicContact CG1-CB 4.12Å; W388-A390 HydrophobicContact CH2-CB 3.9Å; W388-A390 HydrophobicContact CZ2-CB 3.56Å
391	S	98	Very high	93.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	141.1	178.5	-58.1	0	0	0	0	111	L198 Q207 I293 Q294	L198-S391 VanDerWaalsContact CD1-OG 3.29Å; L198-S391 WeakPolarHBondContact CD1-OG 3.36Å; Q207-S391 WeakPolarHBondContact CG-OG 3.44Å; I293-S391 CarbonylContact C-O 3.47Å; I293-S391 VanDerWaalsContact CA-O 3.3Å; I293-S391 WeakPolarHBondContact CA-O 3.49Å; Q294-S391 PolarHBondContact N-O 2.82Å; Q294-S391 PolarHBondContact O-N 2.91Å
392	F	98.2	Very high	92.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123	169.2	178.5	-131.1	0	0	0	108.7	I69 I71 L107 V206 F208 L266 A291 F292 I293	I69-F392 HydrophobicContact CB-CD1 3.97Å; I69-F392 HydrophobicContact CB-CE1 4.19Å; I69-F392 HydrophobicContact CD1-CB 4.45Å; I69-F392 HydrophobicContact CD1-CD1 4.07Å; I69-F392 HydrophobicContact CG2-CD1 3.8Å; I69-F392 HydrophobicContact CG2-CE1 4.02Å; I71-F392 HydrophobicContact CD1-CD1 3.62Å; I71-F392 HydrophobicContact CD1-CE1 3.51Å; I71-F392 HydrophobicContact CD1-CG 4.26Å; I71-F392 HydrophobicContact CD1-CZ 4.05Å; I71-F392 HydrophobicContact CG1-CD1 4.18Å; I71-F392 HydrophobicContact CG1-CE1 3.71Å; I71-F392 HydrophobicContact CG1-CZ 4.36Å; L107-F392 HydrophobicContact CB-CD1 3.85Å; L107-F392 HydrophobicContact CB-CE1 3.87Å; L107-F392 HydrophobicContact CB-CG 4.2Å; L107-F392 HydrophobicContact CB-CZ 4.27Å; L107-F392 HydrophobicContact CD2-CB 4.07Å; L107-F392 HydrophobicContact CD2-CD1 4.48Å; L107-F392 HydrophobicContact CD2-CG 4.18Å; V206-F392 PolarHBondContact N-O 3.16Å; V206-F392 PolarHBondContact O-N 3.46Å; F208-F392 HydrophobicContact CE1-CB 4.15Å; L266-F392 HydrophobicContact CD1-CE2 3.66Å; L266-F392 HydrophobicContact CD1-CZ 4.27Å; A291-F392 HydrophobicContact CB-CE2 3.97Å; A291-F392 HydrophobicContact CB-CZ 4.47Å; F292-F392 WeakPolarHBondContact O-CA 3.4Å; F292-F392 VanDerWaalsContact O-CD2 3.27Å; F292-F392 WeakPolarHBondContact O-CD2 3.25Å; I293-F392 HydrophobicContact CG1-CD2 3.75Å; I293-F392 HydrophobicContact CG1-CE2 4.31Å
393	G	96.4	Very high	92.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	177	-174.2	0	0	0	0	0	114.5	W204 A291 F292	W204-G393 CarbonylContact O-C 3.53Å; W204-G393 WeakPolarHBondContact O-CA 3.34Å; A291-G393 CarbonylContact C-O 3.53Å; A291-G393 WeakPolarHBondContact CA-O 3.22Å; A291-G393 WeakPolarHBondContact CB-O 3.12Å; F292-G393 PolarHBondContact N-O 3.08Å; F292-G393 PolarHBondContact O-N 3.5Å
394	L	93.3	Very high	91.7	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	162	174.3	-75.4	173.5	0	0	0	111.9	V54 I71 H73 Y105 W204 S290 A291 F292	V54-L394 HydrophobicContact CB-CD1 4.45Å; V54-L394 HydrophobicContact CG1-CD1 3.71Å; V54-L394 HydrophobicContact CG2-CD1 3.85Å; I71-L394 HydrophobicContact CG2-CD1 3.48Å; I71-L394 VanDerWaalsContact CG2-CD1 3.48Å; I71-L394 HydrophobicContact CG2-CD2 4.33Å; I71-L394 HydrophobicContact CG2-CG 3.69Å; H73-L394 HydrophobicContact CB-CD1 4Å; Y105-L394 HydrophobicContact CD2-CD2 3.7Å; Y105-L394 HydrophobicContact CE2-CD2 3.71Å; W204-L394 HydrophobicContact CD2-CB 4.39Å; W204-L394 HydrophobicContact CE3-CB 3.71Å; W204-L394 VanDerWaalsContact CE3-O 3.25Å; W204-L394 HydrophobicContact CZ3-CB 4Å; W204-L394 PolarHBondContact O-N 2.95Å; S290-L394 CarbonylContact O-C 3.56Å; S290-L394 WeakPolarHBondContact O-CA 3.31Å; A291-L394 HydrophobicContact CB-CD2 4.06Å; F292-L394 VanDerWaalsContact CE1-O 3.31Å; F292-L394 WeakPolarHBondContact CE1-O 3.37Å
395	G	90.5	Very high	91.2	Very high	13 Å²	13	38.7 Å²	38.7	13%	0.134	22%	0.223	C	C	.	.	S	Bend	trans	84.2	-153.3	177.7	0	0	0	0	0	112.8	S290 F292	S290-G395 PolarHBondContact O-N 2.83Å; F292-G395 WeakPolarHBondContact CD1-O 3.38Å
396	N	89.9	Confident	90.7	Very high	139 Å²	139	40 Å²	40	74%	0.743	23%	0.231	S	C	*	.	S	Bend	trans	-82.5	138.6	174.3	-63.2	-26.7	0	0	0	109
397	P	92.4	Very high	90.2	Very high	20 Å²	20	42.9 Å²	42.9	13%	0.13	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-52.3	135.4	171.4	-20.2	28.2	0	0	0	110.3	N263 L265 F292	N263-P397 HydrophobicContact CB-CB 4.42Å; N263-P397 HydrophobicContact CB-CG 3.95Å; N263-P397 WeakPolarHBondContact OD1-CB 3.47Å; L265-P397 HydrophobicContact CD2-CG 3.79Å; F292-P397 HydrophobicContact CB-CG 3.79Å; F292-P397 HydrophobicContact CD1-CB 4.35Å; F292-P397 HydrophobicContact CD1-CG 4.01Å; F292-P397 HydrophobicContact CD2-CB 4.02Å; F292-P397 HydrophobicContact CD2-CG 4.12Å; F292-P397 HydrophobicContact CE2-CB 4.28Å; F292-P397 HydrophobicContact CG-CB 4.07Å; F292-P397 HydrophobicContact CG-CG 3.71Å
398	P	89.8	Confident	89.9	Confident	8 Å²	8	44.6 Å²	44.6	5%	0.052	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-64.7	141.7	175.6	28.1	-33.3	0	0	0	109.7	L199 I205 Q294	L199-P398 HydrophobicContact CB-CB 4.1Å; L199-P398 HydrophobicContact CB-CG 4.25Å; L199-P398 HydrophobicContact CD2-CB 3.69Å; L199-P398 HydrophobicContact CG-CB 4.38Å; I205-P398 HydrophobicContact CD1-CG 3.94Å; Q294-P398 PolarHBondContact NE2-O 3.14Å
399	T	84.3	Confident	89.5	Confident	85 Å²	85	49.3 Å²	49.3	52%	0.521	29%	0.288	S	S	.	.			trans	-115.3	132.2	174	54	0	0	0	0	108.7	L247	L247-T399 HydrophobicContact CD1-CG2 4.21Å
400	D	81.2	Confident	89.2	Confident	38 Å²	38	52.9 Å²	52.9	20%	0.203	31%	0.306	C	S	.	.			trans	-71.9	138.1	171	-60.8	-31	0	0	0	108.8	H191 K296	H191-D400 IonicContact CE1-OD1 3Å; H191-D400 PolarHBondContact CE1-OD1 3Å; H191-D400 VanDerWaalsContact CE1-OD1 3.25Å; K296-D400 IonicContact NZ-OD2 3.71Å
401	N	78.4	Confident	89.1	Confident	137 Å²	137	57.4 Å²	57.4	73%	0.733	33%	0.33	S	S	*	.			trans	-110.2	146.4	170.4	-66.9	-53.4	0	0	0	107.6	S403	N401-S403 PolarHBondContact O-N 3.43Å
402	L	79.7	Confident	88.9	Confident	63 Å²	63	63.6 Å²	63.6	33%	0.33	36%	0.357	S	S	.	.			trans	-49.7	134.7	172.8	-60.6	170.7	0	0	0	110	D251 L406 I407 I410	D251-L402 HydrophobicContact CB-CD2 3.61Å; D251-L402 HydrophobicContact CB-CG 4.5Å; D251-L402 PolarHBondContact OD2-N 2.75Å; L402-L406 HydrophobicContact CB-CD2 4.39Å; L402-L406 HydrophobicContact CD2-CD2 3.61Å; L402-I407 HydrophobicContact CB-CD1 4.1Å; L402-I407 HydrophobicContact CB-CG1 3.78Å; L402-I407 HydrophobicContact CD1-CG1 4.49Å; L402-I407 WeakPolarHBondContact O-CD1 3.13Å; L402-I410 HydrophobicContact CD1-CD1 4.42Å
403	S	83.6	Confident	88.8	Confident	28 Å²	28	66.2 Å²	66.2	20%	0.196	38%	0.375	C	S	.	.			trans	-58.4	150.3	178.1	63.5	0	0	0	0	111.6	E253 N401 L405 L406 I407	E253-S403 WeakPolarHBondContact OE1-CB 3.36Å; E253-S403 PolarHBondContact OE1-OG 2.96Å; E253-S403 WeakPolarHBondContact OE2-CB 3.41Å; E253-S403 PolarHBondContact OE2-N 3.39Å; E253-S403 PolarHBondContact OE2-OG 3.46Å; N401-S403 PolarHBondContact O-N 3.43Å; S403-L405 PolarHBondContact O-N 3.38Å; S403-L405 VanDerWaalsContact O-N 3.15Å; S403-L406 PolarHBondContact O-N 2.81Å; S403-L406 WeakPolarHBondContact OG-CB 3.5Å; S403-L406 PolarHBondContact OG-N 2.87Å; S403-L406 VanDerWaalsContact OG-N 3.17Å; S403-I407 WeakPolarHBondContact O-CG1 3.48Å; S403-I407 PolarHBondContact O-N 2.83Å
404	S	84.9	Confident	88.7	Confident	110 Å²	110	71.4 Å²	71.4	77%	0.769	40%	0.401	S	S	*	.	H	α-helix	trans	-58.3	-29.3	175.4	-52.9	0	0	0	0	112.2	G408	S404-G408 PolarHBondContact O-N 2.81Å
405	L	87.1	Confident	88.9	Confident	127 Å²	127	76.5 Å²	76.5	67%	0.665	43%	0.427	S	S	*	.	H	α-helix	trans	-65.2	-52	173.4	-179.5	68.2	0	0	0	111.1	S403 G408 L409	S403-L405 PolarHBondContact O-N 3.38Å; S403-L405 VanDerWaalsContact O-N 3.15Å; L405-G408 CarbonylContact O-C 3.55Å; L405-G408 WeakPolarHBondContact O-CA 3.36Å; L405-G408 PolarHBondContact O-N 2.83Å; L405-G408 VanDerWaalsContact O-N 3.1Å; L405-L409 HydrophobicContact CG-CD1 4.49Å; L405-L409 WeakPolarHBondContact O-CG 3.36Å; L405-L409 PolarHBondContact O-N 3.47Å
406	L	86.2	Confident	89.2	Confident	56 Å²	56	80.3 Å²	80.3	29%	0.293	44%	0.444	S	S	.	.	H	α-helix	trans	-62.4	-44.4	179.7	179.5	55.8	0	0	0	111.6	L402 S403 G408 L409 I410	L402-L406 HydrophobicContact CB-CD2 4.39Å; L402-L406 HydrophobicContact CD2-CD2 3.61Å; S403-L406 PolarHBondContact O-N 2.81Å; S403-L406 WeakPolarHBondContact OG-CB 3.5Å; S403-L406 PolarHBondContact OG-N 2.87Å; S403-L406 VanDerWaalsContact OG-N 3.17Å; L406-G408 VanDerWaalsContact C-N 3.26Å; L406-G408 PolarHBondContact O-N 3.11Å; L406-L409 PolarHBondContact O-N 2.85Å; L406-L409 VanDerWaalsContact O-N 3.14Å; L406-I410 HydrophobicContact CD1-CD1 4.17Å; L406-I410 HydrophobicContact CD1-CG1 4.31Å; L406-I410 HydrophobicContact CG-CD1 4.01Å; L406-I410 VanDerWaalsContact O-CG1 3.31Å; L406-I410 WeakPolarHBondContact O-CG1 3.36Å; L406-I410 PolarHBondContact O-N 2.83Å
407	I	87.5	Confident	89.5	Confident	71 Å²	71	78.3 Å²	78.3	36%	0.364	43%	0.432	S	S	.	.	H	α-helix	trans	-56.9	-44.3	172.8	-65.5	169.6	0	0	0	110.2	L402 S403 L409 I410 I411	L402-I407 HydrophobicContact CB-CD1 4.1Å; L402-I407 HydrophobicContact CB-CG1 3.78Å; L402-I407 HydrophobicContact CD1-CG1 4.49Å; L402-I407 WeakPolarHBondContact O-CD1 3.13Å; S403-I407 WeakPolarHBondContact O-CG1 3.48Å; S403-I407 PolarHBondContact O-N 2.83Å; I407-L409 PolarHBondContact O-N 2.87Å; I407-I410 PolarHBondContact O-N 2.71Å; I407-I411 HydrophobicContact CG2-CD1 3.72Å; I407-I411 HydrophobicContact CG2-CG1 4.37Å; I407-I411 WeakPolarHBondContact O-CB 3.28Å; I407-I411 VanDerWaalsContact O-CG1 3.26Å; I407-I411 WeakPolarHBondContact O-CG1 3.37Å; I407-I411 PolarHBondContact O-N 2.92Å
408	G	91.5	Very high	89.7	Confident	36 Å²	36	81.4 Å²	81.4	37%	0.371	45%	0.45	S	S	.	.	H	α-helix	trans	-58.6	-43.9	175.2	0	0	0	0	0	113.2	S404 L405 L406 I411 F412	S404-G408 PolarHBondContact O-N 2.81Å; L405-G408 CarbonylContact O-C 3.55Å; L405-G408 WeakPolarHBondContact O-CA 3.36Å; L405-G408 PolarHBondContact O-N 2.83Å; L405-G408 VanDerWaalsContact O-N 3.1Å; L406-G408 VanDerWaalsContact C-N 3.26Å; L406-G408 PolarHBondContact O-N 3.11Å; G408-I411 PolarHBondContact O-N 2.97Å; G408-F412 VanDerWaalsContact O-CB 3.32Å; G408-F412 WeakPolarHBondContact O-CB 3.45Å; G408-F412 PolarHBondContact O-N 2.9Å
409	L	91.6	Very high	90	Very high	100 Å²	100	84.7 Å²	84.7	52%	0.524	47%	0.474	S	S	.	.	H	α-helix	trans	-65.8	-40.5	176.7	-68.9	174.6	0	0	0	112.2	L405 L406 I407 F412 S413	L405-L409 HydrophobicContact CG-CD1 4.49Å; L405-L409 WeakPolarHBondContact O-CG 3.36Å; L405-L409 PolarHBondContact O-N 3.47Å; L406-L409 PolarHBondContact O-N 2.85Å; L406-L409 VanDerWaalsContact O-N 3.14Å; I407-L409 PolarHBondContact O-N 2.87Å; L409-F412 PolarHBondContact O-N 2.82Å; L409-S413 WeakPolarHBondContact O-CB 3.1Å; L409-S413 PolarHBondContact O-N 3.33Å; L409-S413 PolarHBondContact O-OG 3.18Å; L409-S413 VanDerWaalsContact O-OG 3.06Å
410	I	90.7	Very high	90.5	Very high	75 Å²	75	84.5 Å²	84.5	39%	0.385	48%	0.475	S	S	.	.	H	α-helix	trans	-63.2	-47.7	175.6	-67.5	165.8	0	0	0	109.8	L402 L406 I407 F412 S413 M414	L402-I410 HydrophobicContact CD1-CD1 4.42Å; L406-I410 HydrophobicContact CD1-CD1 4.17Å; L406-I410 HydrophobicContact CD1-CG1 4.31Å; L406-I410 HydrophobicContact CG-CD1 4.01Å; L406-I410 VanDerWaalsContact O-CG1 3.31Å; L406-I410 WeakPolarHBondContact O-CG1 3.36Å; L406-I410 PolarHBondContact O-N 2.83Å; I407-I410 PolarHBondContact O-N 2.71Å; I410-F412 VanDerWaalsContact C-N 3.33Å; I410-F412 PolarHBondContact O-N 2.85Å; I410-S413 WeakPolarHBondContact CA-OG 3Å; I410-S413 PolarHBondContact O-N 3.19Å; I410-S413 PolarHBondContact O-OG 2.83Å; I410-M414 HydrophobicContact CG2-CG 4.46Å; I410-M414 WeakPolarHBondContact O-CB 3.31Å; I410-M414 VanDerWaalsContact O-CG 3.26Å; I410-M414 WeakPolarHBondContact O-CG 3.48Å; I410-M414 PolarHBondContact O-N 2.8Å
411	I	95.1	Very high	91.3	Very high	96 Å²	96	86.6 Å²	86.6	49%	0.492	49%	0.49	S	S	.	.	H	α-helix	trans	-60.2	-45.1	177.1	-68.8	168.2	0	0	0	110.6	I407 G408 M414 L415	I407-I411 HydrophobicContact CG2-CD1 3.72Å; I407-I411 HydrophobicContact CG2-CG1 4.37Å; I407-I411 WeakPolarHBondContact O-CB 3.28Å; I407-I411 VanDerWaalsContact O-CG1 3.26Å; I407-I411 WeakPolarHBondContact O-CG1 3.37Å; I407-I411 PolarHBondContact O-N 2.92Å; G408-I411 PolarHBondContact O-N 2.97Å; I411-M414 PolarHBondContact O-N 3.48Å; I411-L415 HydrophobicContact CG2-CD1 3.99Å; I411-L415 HydrophobicContact CG2-CG 4.43Å; I411-L415 WeakPolarHBondContact O-CB 3.44Å; I411-L415 VanDerWaalsContact O-CG 3.29Å; I411-L415 WeakPolarHBondContact O-CG 3.33Å; I411-L415 PolarHBondContact O-N 3.06Å
412	F	95.1	Very high	92.2	Very high	130 Å²	130	84.3 Å²	84.3	57%	0.57	48%	0.48	S	S	*	.	H	α-helix	trans	-63.2	-44.7	179.9	-174.5	-105.7	0	0	0	112.6	G408 L409 I410 L415 I416	G408-F412 VanDerWaalsContact O-CB 3.32Å; G408-F412 WeakPolarHBondContact O-CB 3.45Å; G408-F412 PolarHBondContact O-N 2.9Å; L409-F412 PolarHBondContact O-N 2.82Å; I410-F412 VanDerWaalsContact C-N 3.33Å; I410-F412 PolarHBondContact O-N 2.85Å; F412-L415 PolarHBondContact O-N 2.91Å; F412-I416 HydrophobicContact CD1-CD1 3.75Å; F412-I416 HydrophobicContact CE1-CD1 3.37Å; F412-I416 HydrophobicContact CE1-CG1 4.37Å; F412-I416 HydrophobicContact CZ-CD1 3.86Å; F412-I416 HydrophobicContact CZ-CG1 4.5Å; F412-I416 WeakPolarHBondContact O-CG1 3.41Å; F412-I416 PolarHBondContact O-N 3.03Å
413	S	95.2	Very high	93	Very high	54 Å²	54	86 Å²	86	38%	0.378	49%	0.489	S	S	.	.	H	α-helix	trans	-63.8	-41.3	176.6	60	0	0	0	0	112.2	L409 I410 L415 I416 I417	L409-S413 WeakPolarHBondContact O-CB 3.1Å; L409-S413 PolarHBondContact O-N 3.33Å; L409-S413 PolarHBondContact O-OG 3.18Å; L409-S413 VanDerWaalsContact O-OG 3.06Å; I410-S413 WeakPolarHBondContact CA-OG 3Å; I410-S413 PolarHBondContact O-N 3.19Å; I410-S413 PolarHBondContact O-OG 2.83Å; S413-L415 PolarHBondContact O-N 3.29Å; S413-I416 PolarHBondContact O-N 3.21Å; S413-I417 WeakPolarHBondContact O-CG1 3.02Å; S413-I417 PolarHBondContact O-N 3.41Å
414	M	95.3	Very high	93.6	Very high	110 Å²	110	86.2 Å²	86.2	54%	0.542	50%	0.495	S	S	.	.	H	α-helix	trans	-63.8	-39.5	175	-70.4	-65.5	-82.7	0	0	112.1	I410 I411 I416 I417 V418	I410-M414 HydrophobicContact CG2-CG 4.46Å; I410-M414 WeakPolarHBondContact O-CB 3.31Å; I410-M414 VanDerWaalsContact O-CG 3.26Å; I410-M414 WeakPolarHBondContact O-CG 3.48Å; I410-M414 PolarHBondContact O-N 2.8Å; I411-M414 PolarHBondContact O-N 3.48Å; M414-I416 VanDerWaalsContact C-N 3.35Å; M414-I416 PolarHBondContact O-N 3.39Å; M414-I417 PolarHBondContact O-N 3.38Å; M414-V418 WeakPolarHBondContact O-CB 3.33Å; M414-V418 VanDerWaalsContact O-CG2 3.3Å; M414-V418 WeakPolarHBondContact O-CG2 3.46Å; M414-V418 PolarHBondContact O-N 2.81Å
415	L	96.3	Very high	94.1	Very high	111 Å²	111	85.5 Å²	85.5	58%	0.581	48%	0.482	S	S	*	.	H	α-helix	trans	-62.2	-41	175.3	-76	170.2	0	0	0	112.1	I411 F412 S413 S419	I411-L415 HydrophobicContact CG2-CD1 3.99Å; I411-L415 HydrophobicContact CG2-CG 4.43Å; I411-L415 WeakPolarHBondContact O-CB 3.44Å; I411-L415 VanDerWaalsContact O-CG 3.29Å; I411-L415 WeakPolarHBondContact O-CG 3.33Å; I411-L415 PolarHBondContact O-N 3.06Å; F412-L415 PolarHBondContact O-N 2.91Å; S413-L415 PolarHBondContact O-N 3.29Å; L415-S419 WeakPolarHBondContact O-CB 3.25Å; L415-S419 PolarHBondContact O-N 3.25Å
416	I	96.9	Very high	94.5	Very high	93 Å²	93	84.2 Å²	84.2	48%	0.477	48%	0.475	S	S	.	.	H	α-helix	trans	-62.3	-47	175.6	-68.9	167.5	0	0	0	110.5	F412 S413 M414 S419 S420	F412-I416 HydrophobicContact CD1-CD1 3.75Å; F412-I416 HydrophobicContact CE1-CD1 3.37Å; F412-I416 HydrophobicContact CE1-CG1 4.37Å; F412-I416 HydrophobicContact CZ-CD1 3.86Å; F412-I416 HydrophobicContact CZ-CG1 4.5Å; F412-I416 WeakPolarHBondContact O-CG1 3.41Å; F412-I416 PolarHBondContact O-N 3.03Å; S413-I416 PolarHBondContact O-N 3.21Å; M414-I416 VanDerWaalsContact C-N 3.35Å; M414-I416 PolarHBondContact O-N 3.39Å; I416-S419 PolarHBondContact O-N 3.3Å; I416-S420 WeakPolarHBondContact O-CB 3.32Å; I416-S420 PolarHBondContact O-N 2.83Å
417	I	96.9	Very high	94.9	Very high	97 Å²	97	86.2 Å²	86.2	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-61.7	-49	-179.9	-66.5	165.5	0	0	0	110.4	S413 M414 S419 S420 V421	S413-I417 WeakPolarHBondContact O-CG1 3.02Å; S413-I417 PolarHBondContact O-N 3.41Å; M414-I417 PolarHBondContact O-N 3.38Å; I417-S419 PolarHBondContact O-N 2.79Å; I417-S420 WeakPolarHBondContact O-CB 3.37Å; I417-S420 PolarHBondContact O-N 3.33Å; I417-V421 WeakPolarHBondContact O-CG2 3.1Å; I417-V421 PolarHBondContact O-N 3.34Å
418	V	96.5	Very high	95.3	Very high	84 Å²	84	87.2 Å²	87.2	51%	0.509	50%	0.495	S	S	.	.	H	α-helix	trans	-63.2	-43.5	179.8	172.2	0	0	0	0	111.2	M414 S420 V421 V422	M414-V418 WeakPolarHBondContact O-CB 3.33Å; M414-V418 VanDerWaalsContact O-CG2 3.3Å; M414-V418 WeakPolarHBondContact O-CG2 3.46Å; M414-V418 PolarHBondContact O-N 2.81Å; V418-S420 VanDerWaalsContact C-N 3.33Å; V418-S420 PolarHBondContact O-N 3.16Å; V418-V421 PolarHBondContact O-N 2.75Å; V418-V422 HydrophobicContact CG1-CG2 4.27Å; V418-V422 WeakPolarHBondContact O-CB 3.09Å; V418-V422 VanDerWaalsContact O-CG2 3.31Å; V418-V422 WeakPolarHBondContact O-CG2 3.21Å; V418-V422 PolarHBondContact O-N 3.07Å
419	S	95.5	Very high	95.4	Very high	78 Å²	78	89.3 Å²	89.3	55%	0.545	50%	0.497	S	S	.	.	H	α-helix	trans	-59.8	-43.7	176.6	-176	0	0	0	0	111.7	L415 I416 I417 V422 L423	L415-S419 WeakPolarHBondContact O-CB 3.25Å; L415-S419 PolarHBondContact O-N 3.25Å; I416-S419 PolarHBondContact O-N 3.3Å; I417-S419 PolarHBondContact O-N 2.79Å; S419-V422 PolarHBondContact O-N 3.07Å; S419-L423 VanDerWaalsContact O-CB 3.31Å; S419-L423 WeakPolarHBondContact O-CB 3.46Å; S419-L423 PolarHBondContact O-N 2.88Å
420	S	96.2	Very high	95.4	Very high	80 Å²	80	88.5 Å²	88.5	56%	0.559	50%	0.496	S	S	*	.	H	α-helix	trans	-61.6	-44.2	176	-175.3	0	0	0	0	112.2	I416 I417 V418 L423 G424	I416-S420 WeakPolarHBondContact O-CB 3.32Å; I416-S420 PolarHBondContact O-N 2.83Å; I417-S420 WeakPolarHBondContact O-CB 3.37Å; I417-S420 PolarHBondContact O-N 3.33Å; V418-S420 VanDerWaalsContact C-N 3.33Å; V418-S420 PolarHBondContact O-N 3.16Å; S420-L423 PolarHBondContact O-N 3.27Å; S420-G424 PolarHBondContact O-N 2.84Å
421	V	97	Very high	95.4	Very high	83 Å²	83	90.2 Å²	90.2	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-64.8	-45.2	177.3	172.1	0	0	0	0	111.4	I417 V418 L423 G424 I425	I417-V421 WeakPolarHBondContact O-CG2 3.1Å; I417-V421 PolarHBondContact O-N 3.34Å; V418-V421 PolarHBondContact O-N 2.75Å; V421-L423 PolarHBondContact O-N 3.16Å; V421-G424 PolarHBondContact O-N 3.5Å; V421-I425 HydrophobicContact CG1-CD1 3.8Å; V421-I425 HydrophobicContact CG1-CG1 4.42Å; V421-I425 VanDerWaalsContact O-CG1 3.3Å; V421-I425 WeakPolarHBondContact O-CG1 3.4Å; V421-I425 PolarHBondContact O-N 2.7Å
422	V	96.7	Very high	95.1	Very high	88 Å²	88	94.7 Å²	94.7	53%	0.533	52%	0.516	S	S	.	.	H	α-helix	trans	-62.3	-44	177.9	170.3	0	0	0	0	110.9	V418 S419 G424 I425 L426	V418-V422 HydrophobicContact CG1-CG2 4.27Å; V418-V422 WeakPolarHBondContact O-CB 3.09Å; V418-V422 VanDerWaalsContact O-CG2 3.31Å; V418-V422 WeakPolarHBondContact O-CG2 3.21Å; V418-V422 PolarHBondContact O-N 3.07Å; S419-V422 PolarHBondContact O-N 3.07Å; V422-G424 VanDerWaalsContact C-N 3.34Å; V422-I425 PolarHBondContact O-N 3.36Å; V422-L426 WeakPolarHBondContact O-CB 3.27Å; V422-L426 PolarHBondContact O-N 3.07Å
423	L	96.6	Very high	94.6	Very high	100 Å²	100	97 Å²	97	52%	0.524	52%	0.521	S	S	.	.	H	α-helix	trans	-62.8	-42.8	176.3	-174.8	65.5	0	0	0	111.2	S419 S420 V421 L426 L427	S419-L423 VanDerWaalsContact O-CB 3.31Å; S419-L423 WeakPolarHBondContact O-CB 3.46Å; S419-L423 PolarHBondContact O-N 2.88Å; S420-L423 PolarHBondContact O-N 3.27Å; V421-L423 PolarHBondContact O-N 3.16Å; L423-L426 PolarHBondContact O-N 3.17Å; L423-L427 HydrophobicContact CG-CD1 4.34Å; L423-L427 WeakPolarHBondContact O-CB 3.5Å; L423-L427 VanDerWaalsContact O-CG 3.3Å; L423-L427 WeakPolarHBondContact O-CG 3.17Å; L423-L427 PolarHBondContact O-N 3.37Å
424	G	96.3	Very high	93.7	Very high	31 Å²	31	97 Å²	97	32%	0.32	52%	0.521	S	S	.	.	H	α-helix	trans	-60.1	-47	175	0	0	0	0	0	112.6	S420 V421 V422 L426 L427 V428	S420-G424 PolarHBondContact O-N 2.84Å; V421-G424 PolarHBondContact O-N 3.5Å; V422-G424 VanDerWaalsContact C-N 3.34Å; G424-L426 PolarHBondContact O-N 2.81Å; G424-L427 PolarHBondContact O-N 3.24Å; G424-V428 WeakPolarHBondContact O-CG2 3.35Å; G424-V428 PolarHBondContact O-N 2.86Å
425	I	95.9	Very high	92.6	Very high	95 Å²	95	95.3 Å²	95.3	49%	0.487	52%	0.517	S	S	.	.	H	α-helix	trans	-61.4	-45.1	176	-68.8	167.3	0	0	0	110.6	V421 V422 L427 V428 I429	V421-I425 HydrophobicContact CG1-CD1 3.8Å; V421-I425 HydrophobicContact CG1-CG1 4.42Å; V421-I425 VanDerWaalsContact O-CG1 3.3Å; V421-I425 WeakPolarHBondContact O-CG1 3.4Å; V421-I425 PolarHBondContact O-N 2.7Å; V422-I425 PolarHBondContact O-N 3.36Å; I425-L427 VanDerWaalsContact C-N 3.33Å; I425-L427 PolarHBondContact O-N 3.23Å; I425-V428 PolarHBondContact O-N 3.34Å; I425-I429 HydrophobicContact CG2-CD1 3.77Å; I425-I429 HydrophobicContact CG2-CG1 4.39Å; I425-I429 VanDerWaalsContact O-CG1 3.32Å; I425-I429 WeakPolarHBondContact O-CG1 3.34Å; I425-I429 PolarHBondContact O-N 2.95Å
426	L	95.6	Very high	91.3	Very high	100 Å²	100	93.6 Å²	93.6	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-59.8	-44.7	178.7	-174.3	69.9	0	0	0	111.1	V422 L423 G424 V428 I429 V430	V422-L426 WeakPolarHBondContact O-CB 3.27Å; V422-L426 PolarHBondContact O-N 3.07Å; L423-L426 PolarHBondContact O-N 3.17Å; G424-L426 PolarHBondContact O-N 2.81Å; L426-V428 PolarHBondContact O-N 2.81Å; L426-I429 PolarHBondContact O-N 2.68Å; L426-V430 VanDerWaalsContact O-CG2 3.29Å; L426-V430 WeakPolarHBondContact O-CG2 3.1Å; L426-V430 PolarHBondContact O-N 2.91Å
427	L	94.9	Very high	89.6	Confident	98 Å²	98	93.3 Å²	93.3	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-60.4	-45.1	175.9	-74.5	170.4	0	0	0	111.7	L423 G424 I425 I429 V430 L431	L423-L427 HydrophobicContact CG-CD1 4.34Å; L423-L427 WeakPolarHBondContact O-CB 3.5Å; L423-L427 VanDerWaalsContact O-CG 3.3Å; L423-L427 WeakPolarHBondContact O-CG 3.17Å; L423-L427 PolarHBondContact O-N 3.37Å; G424-L427 PolarHBondContact O-N 3.24Å; I425-L427 VanDerWaalsContact C-N 3.33Å; I425-L427 PolarHBondContact O-N 3.23Å; L427-I429 VanDerWaalsContact C-N 3.34Å; L427-I429 PolarHBondContact O-N 3.39Å; L427-V430 PolarHBondContact O-N 2.78Å; L427-L431 WeakPolarHBondContact O-CB 3.43Å; L427-L431 VanDerWaalsContact O-CG 3.25Å; L427-L431 WeakPolarHBondContact O-CG 3.37Å; L427-L431 PolarHBondContact O-N 3.19Å
428	V	94.8	Very high	87.8	Confident	93 Å²	93	93.1 Å²	93.1	56%	0.564	51%	0.513	S	S	*	.	H	α-helix	trans	-60.8	-42.8	176.6	171.5	0	0	0	0	111.4	G424 I425 L426 L431 R432	G424-V428 WeakPolarHBondContact O-CG2 3.35Å; G424-V428 PolarHBondContact O-N 2.86Å; I425-V428 PolarHBondContact O-N 3.34Å; L426-V428 PolarHBondContact O-N 2.81Å; V428-L431 PolarHBondContact O-N 3.07Å; V428-R432 WeakPolarHBondContact O-CB 3.29Å; V428-R432 PolarHBondContact O-N 3.19Å
429	I	93.3	Very high	86	Confident	79 Å²	79	94.2 Å²	94.2	41%	0.405	52%	0.516	S	S	.	.	H	α-helix	trans	-62.8	-44.8	177.6	-68.8	167.7	0	0	0	110.8	I425 L426 L427 R432 R433	I425-I429 HydrophobicContact CG2-CD1 3.77Å; I425-I429 HydrophobicContact CG2-CG1 4.39Å; I425-I429 VanDerWaalsContact O-CG1 3.32Å; I425-I429 WeakPolarHBondContact O-CG1 3.34Å; I425-I429 PolarHBondContact O-N 2.95Å; L426-I429 PolarHBondContact O-N 2.68Å; L427-I429 VanDerWaalsContact C-N 3.34Å; L427-I429 PolarHBondContact O-N 3.39Å; I429-R432 PolarHBondContact O-N 3Å; I429-R433 WeakPolarHBondContact O-CG 3Å; I429-R433 PolarHBondContact O-N 3.02Å
430	V	92.5	Very high	84.1	Confident	84 Å²	84	96.9 Å²	96.9	51%	0.509	52%	0.523	S	S	.	.	H	α-helix	trans	-62.1	-46	178.4	170.4	0	0	0	0	110.8	L426 L427 R432 R433 S434	L426-V430 VanDerWaalsContact O-CG2 3.29Å; L426-V430 WeakPolarHBondContact O-CG2 3.1Å; L426-V430 PolarHBondContact O-N 2.91Å; L427-V430 PolarHBondContact O-N 2.78Å; V430-R432 VanDerWaalsContact C-N 3.33Å; V430-R432 PolarHBondContact O-N 3.42Å; V430-R433 PolarHBondContact O-N 3.03Å; V430-S434 PolarHBondContact O-N 3.37Å; V430-S434 PolarHBondContact O-OG 2.03Å
431	L	90.1	Very high	82.3	Confident	111 Å²	111	99.5 Å²	99.5	58%	0.581	53%	0.531	S	S	*	.	H	α-helix	trans	-64.8	-34.5	178.3	-69.9	172	0	0	0	112.9	L427 V428 S434 T435	L427-L431 WeakPolarHBondContact O-CB 3.43Å; L427-L431 VanDerWaalsContact O-CG 3.25Å; L427-L431 WeakPolarHBondContact O-CG 3.37Å; L427-L431 PolarHBondContact O-N 3.19Å; V428-L431 PolarHBondContact O-N 3.07Å; L431-S434 PolarHBondContact O-OG 3.27Å; L431-T435 PolarHBondContact O-N 3.49Å; L431-T435 PolarHBondContact O-OG1 3.11Å
432	R	89.2	Confident	79.9	Confident	189 Å²	189	105 Å²	105	71%	0.713	54%	0.543	S	S	*	.	H	α-helix	trans	-72.9	-34.1	176	-166.6	175.3	179.4	-175.8	-0	112.4	V428 I429 V430 T435 T436	V428-R432 WeakPolarHBondContact O-CB 3.29Å; V428-R432 PolarHBondContact O-N 3.19Å; I429-R432 PolarHBondContact O-N 3Å; V430-R432 VanDerWaalsContact C-N 3.33Å; V430-R432 PolarHBondContact O-N 3.42Å; R432-T435 WeakPolarHBondContact CA-OG1 3.32Å; R432-T435 PolarHBondContact O-OG1 3.1Å; R432-T435 VanDerWaalsContact O-OG1 3.08Å; R432-T436 PolarHBondContact O-N 3.12Å; R432-T436 PolarHBondContact O-OG1 3.27Å
433	R	84.1	Confident	77.2	Confident	180 Å²	180	109 Å²	109	68%	0.679	56%	0.556	S	S	*	*	H	α-helix	trans	-69.7	-41.7	174.9	-77.6	-177.2	173.1	-173.2	-0.9	111.9	I429 V430 T435 T436 V437	I429-R433 WeakPolarHBondContact O-CG 3Å; I429-R433 PolarHBondContact O-N 3.02Å; V430-R433 PolarHBondContact O-N 3.03Å; R433-T435 PolarHBondContact O-N 2.95Å; R433-T436 WeakPolarHBondContact CA-OG1 3.13Å; R433-T436 PolarHBondContact O-N 3.33Å; R433-T436 PolarHBondContact O-OG1 3.32Å; R433-V437 WeakPolarHBondContact O-CG2 2.94Å; R433-V437 PolarHBondContact O-N 3.02Å
434	S	76.3	Confident	74.9	Confident	54 Å²	54	108.8 Å²	108.8	38%	0.378	56%	0.561	S	S	.	*	H	α-helix	trans	-64.4	-40.1	177.5	61.7	0	0	0	0	112.3	V430 L431 V437 I438	V430-S434 PolarHBondContact O-N 3.37Å; V430-S434 PolarHBondContact O-OG 2.03Å; L431-S434 PolarHBondContact O-OG 3.27Å; S434-V437 PolarHBondContact O-N 3.11Å; S434-I438 WeakPolarHBondContact O-CD1 3.03Å; S434-I438 VanDerWaalsContact O-CG1 3.26Å; S434-I438 WeakPolarHBondContact O-CG1 3.23Å; S434-I438 PolarHBondContact O-N 3.43Å; S434-I438 VanDerWaalsContact O-N 3.1Å
435	T	72.6	Confident	72.5	Confident	74 Å²	74	114.9 Å²	114.9	45%	0.454	58%	0.584	S	S	.	*	H	α-helix	trans	-67.1	-35.5	175.8	34.1	0	0	0	0	113.6	L431 R432 R433 N439	L431-T435 PolarHBondContact O-N 3.49Å; L431-T435 PolarHBondContact O-OG1 3.11Å; R432-T435 WeakPolarHBondContact CA-OG1 3.32Å; R432-T435 PolarHBondContact O-OG1 3.1Å; R432-T435 VanDerWaalsContact O-OG1 3.08Å; R433-T435 PolarHBondContact O-N 2.95Å; T435-N439 PolarHBondContact O-N 3.13Å; T435-N439 VanDerWaalsContact O-N 3.12Å
436	T	68.5	Low	70.1	Confident	74 Å²	74	118 Å²	118	45%	0.454	60%	0.601	S	S	.	*	H	α-helix	trans	-71.2	-37.1	175.5	35	0	0	0	0	112.8	R432 R433 N439 N440	R432-T436 PolarHBondContact O-N 3.12Å; R432-T436 PolarHBondContact O-OG1 3.27Å; R433-T436 WeakPolarHBondContact CA-OG1 3.13Å; R433-T436 PolarHBondContact O-N 3.33Å; R433-T436 PolarHBondContact O-OG1 3.32Å; T436-N439 PolarHBondContact O-N 3.49Å; T436-N440 PolarHBondContact O-N 3.24Å
437	V	62.9	Low	67.8	Low	87 Å²	87	118.2 Å²	118.2	53%	0.527	61%	0.611	S	S	.	*	H	α-helix	trans	-61.7	-46.8	172.8	172.3	0	0	0	0	110.8	R433 S434 N439 N440 D441	R433-V437 WeakPolarHBondContact O-CG2 2.94Å; R433-V437 PolarHBondContact O-N 3.02Å; S434-V437 PolarHBondContact O-N 3.11Å; V437-N439 VanDerWaalsContact C-N 3.26Å; V437-N439 PolarHBondContact O-N 3.13Å; V437-N440 PolarHBondContact O-N 3.16Å; V437-D441 PolarHBondContact O-N 2.93Å; V437-D441 VanDerWaalsContact O-N 3.12Å
438	I	59.1	Low	65.4	Low	94 Å²	94	121 Å²	121	48%	0.482	62%	0.621	S	S	.	*	H	α-helix	trans	-61.9	-33.8	178.4	-66.8	164.4	0	0	0	112.1	S434	S434-I438 WeakPolarHBondContact O-CD1 3.03Å; S434-I438 VanDerWaalsContact O-CG1 3.26Å; S434-I438 WeakPolarHBondContact O-CG1 3.23Å; S434-I438 PolarHBondContact O-N 3.43Å; S434-I438 VanDerWaalsContact O-N 3.1Å
439	N	57.7	Low	63.1	Low	107 Å²	107	126.4 Å²	126.4	57%	0.572	64%	0.637	S	S	*	*	H	α-helix	trans	-76.9	-33.2	177.6	-77.6	-16.1	0	0	0	113.2	T435 T436 V437 R442	T435-N439 PolarHBondContact O-N 3.13Å; T435-N439 VanDerWaalsContact O-N 3.12Å; T436-N439 PolarHBondContact O-N 3.49Å; V437-N439 VanDerWaalsContact C-N 3.26Å; V437-N439 PolarHBondContact O-N 3.13Å; N439-R442 PolarHBondContact O-N 2.84Å; N439-R442 VanDerWaalsContact O-N 3.16Å
440	N	56.4	Low	60.9	Low	133 Å²	133	128.9 Å²	128.9	71%	0.711	66%	0.656	S	S	*	*	H	α-helix	trans	-70.6	-34	175.7	-83.1	-4.2	0	0	0	112.4	T436 V437 R442	T436-N440 PolarHBondContact O-N 3.24Å; V437-N440 PolarHBondContact O-N 3.16Å; N440-R442 PolarHBondContact O-N 2.74Å
441	D	56.9	Low	58.6	Low	136 Å²	136	131.8 Å²	131.8	73%	0.727	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-7.5	171.9	-72.6	-20.4	0	0	0	112.7	V437	V437-D441 PolarHBondContact O-N 2.93Å; V437-D441 VanDerWaalsContact O-N 3.12Å
442	R	47.5	Very low	56.2	Low	197 Å²	197	134.7 Å²	134.7	74%	0.743	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	35.5	178.3	-79	-171.4	176.8	-177	0.8	114.2	N439 N440	N439-R442 PolarHBondContact O-N 2.84Å; N439-R442 VanDerWaalsContact O-N 3.16Å; N440-R442 PolarHBondContact O-N 2.74Å
443	Q	40.3	Very low	54.2	Low	172 Å²	172	130.2 Å²	130.2	80%	0.804	68%	0.68	S	S	*	*	S	Bend	trans	-88.4	139.4	155.6	-89.4	-163.5	-27.5	0	0	111.3
444	P	47.4	Very low	52	Low	97 Å²	97	129.6 Å²	129.6	63%	0.63	69%	0.688	S	S	*	*				-101.2	128.5	-118.6	34.2	-32.1	0	0	0	111.6	L446	P444-L446 HydrophobicContact CB-CB 4.28Å; P444-L446 PolarHBondContact O-N 3.01Å
445	I	46.5	Very low	50.6	Low	159 Å²	159	135.3 Å²	135.3	82%	0.815	74%	0.739	S	S	*	*			trans	-71.5	67	161.3	-49.8	168.2	0	0	0	107
446	L	44.7	Very low	49.5	Very low	160 Å²	160	138.4 Å²	138.4	84%	0.838	75%	0.753	S	S	*	*			trans	-113.3	30.9	171.7	-140.6	108.7	0	0	0	110.8	P444	P444-L446 HydrophobicContact CB-CB 4.28Å; P444-L446 PolarHBondContact O-N 3.01Å
447	S	47.4	Very low	48.5	Very low	105 Å²	105	141.7 Å²	141.7	73%	0.734	77%	0.769	S	S	*	*	S	Bend	trans	-119.2	7.2	178.4	60.2	0	0	0	0	114.9
448	H	46	Very low	47.7	Very low	155 Å²	155	144.8 Å²	144.8	72%	0.718	78%	0.782	S	S	*	*	S	Bend	trans	-115.6	17.4	-175.6	-137.8	-63.5	0	0	0	116.9
449	F	44.9	Very low	47	Very low	207 Å²	207	147.8 Å²	147.8	91%	0.908	80%	0.8	S	S	*	*	S	Bend	trans	-128.9	50.8	170	-66.2	-72	0	0	0	112.2
450	V	47.8	Very low	46.4	Very low	131 Å²	131	150.3 Å²	150.3	79%	0.794	81%	0.814	S	S	*	*			trans	-139.4	82.4	157.1	-175.4	0	0	0	0	106
451	N	43.9	Very low	45.7	Very low	145 Å²	145	151.5 Å²	151.5	78%	0.775	82%	0.821	S	S	*	*			trans	-171	72.7	164	-87.9	-23.2	0	0	0	107.9
452	D	40.8	Very low	44.9	Very low	172 Å²	172	152.6 Å²	152.6	92%	0.92	83%	0.828	S	S	*	*			trans	-119.2	98.3	146.5	-90.9	-31	0	0	0	107.1
453	P	46	Very low	44.7	Very low	95 Å²	95	149.2 Å²	149.2	62%	0.617	83%	0.834	S	S	*	*			trans	-86.5	138.9	174.6	33.3	-28.4	0	0	0	110.7
454	I	39	Very low	45.1	Very low	167 Å²	167	147.3 Å²	147.3	86%	0.856	84%	0.837	S	S	*	*			trans	64.2	102.4	141.8	-50.9	162.1	0	0	0	116.7
455	A	46.5	Very low	44.9	Very low	174 Å²	174	151.8 Å²	151.8	100%	1.438	86%	0.856	S	S	*	*				-173.8	0	112.8	0	0	0	0	0	110.3

Retrieved 455 of 455 residues in 114.7 ms (Link to these results)

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