G4LZ44_SCHMA Loading...

Rna-binding protein 12 (Sh3/ww domain anchor protein in the nucleus) (Swan), putative

AlphaFold DB , UniProt , Accession G4LZ44, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 923 aa.

						>G4LZ44_SCHMA|G4LZ44
MSVIIRLQNLPISANASNIRRFFSGLSIPEGGVHIVGGTEGDAFIAFATDEDARKAMLLDRQTINGASVRLFLSSKAEMQSIIESAKTSALFSSGGNPVLSQPISQKTETMHALDVTAPTLPSSFPSYRNGATRESFDDSSKQYPYTYSKGVTLDPPRGQIESAARNNPDKYPENLPPDRPHFNQDRDYSYNNQPNMHSRYDEIRDFPPTNDYGPRDTYLNNRSDLGHRSYRDDYDYNRHPPSIASEDNFVSRGKDNEVKNSPRDSYADHYPALHVSDGMTADYDKYRAQSPRVFNDRFPPHDIQSREFGHGNTHPFPSEFRSGPGHPLDRETACTNSRLQEERDFSVRPPWLNDNAPISGPKRPFQHQTSDFEEYPRKRRPQPSSYTRPSDIVPGETDYVLRVCLPAPEAGIKTVFEVLRGVQVVPKWGIRVEEDLLQRPTGYVFIMMTTRDSYERALSFNNRPHKGDVIKVIKSTLSEFYSVSDTNFTSKCPPEVAKKLPPPDQSYPPHYNDGCLELAELPSDTTKTEVVRFLGAPGLTCENVVLARFPPNDKSAPRGTNLTRALVTLPSAEDIKILLSAKPRPFRPDAGLPSVRLTPISKLQVSAYSALAIGSKSESIKESIKPPVPRDVDTEPTKPPGGFLTCACVSGFSRTVKDSEVLNLFPSILIPGDAVRLAPDANIAFIDFISENNCRRAVNEVSTEGSKAKQSHPSLHIEAISREEMLNRLGADSKDEQLNFDRPVRSRDRDPRESRIHWDQRQRPSPSNPFESRPPSVGRAKYDDSYYDRPSAPAPFDDHHDSFRRFRPPVDNLHSIPPHQSDISSAPRQPVPLPHRRPVPDFVTVFVGNLPPACTVDQLAGIMRDYYFVPGSIRLRRDPQGQFVGEALVDFKTSYEADRALRGLNGYRVAGRPLVLHFDHRK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	65.2	Low	89.9	Confident	210 Å²	210	48.5 Å²	48.5	100%	1.034	26%	0.261	S	S	*	.				0	149.7	0	-73.5	-177.7	177.2	0	0	107.4
2	S	83.7	Confident	89.5	Confident	81 Å²	81	59.7 Å²	59.7	57%	0.566	32%	0.317	S	S	*	.			trans	-74.1	133.3	172.7	52	0	0	0	0	111.2	F47	S2-F47 WeakPolarHBondContact CA-O 3.42Å; S2-F47 WeakPolarHBondContact CB-O 3.17Å
3	V	92.6	Very high	89.3	Confident	37 Å²	37	60.3 Å²	60.3	22%	0.224	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	134.9	175.5	178.6	0	0	0	0	108.5	A46 F47 D50 A53 L73	V3-A46 WeakPolarHBondContact O-CA 3.35Å; V3-F47 PolarHBondContact N-O 3.39Å; V3-F47 PolarHBondContact O-N 2.76Å; V3-D50 HydrophobicContact CG2-CB 3.99Å; V3-A53 HydrophobicContact CB-CB 3.6Å; V3-A53 HydrophobicContact CG1-CB 3.49Å; V3-A53 VanDerWaalsContact CG1-CB 3.49Å; V3-A53 HydrophobicContact CG2-CB 4.34Å; V3-L73 HydrophobicContact CG1-CD2 3.92Å
4	I	94.9	Very high	89.2	Confident	16 Å²	16	56.4 Å²	56.4	8%	0.082	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.3	-174.8	-58.4	164	0	0	0	109.2	F44 I45 A46 S74 K76 M79	I4-F44 HydrophobicContact CG2-CB 4.37Å; I4-F44 HydrophobicContact CG2-CD1 4.13Å; I4-I45 CarbonylContact C-O 3.54Å; I4-I45 WeakPolarHBondContact CA-O 3.29Å; I4-A46 HydrophobicContact CG1-CB 4.38Å; I4-S74 PolarHBondContact O-N 3.21Å; I4-K76 HydrophobicContact CD1-CB 3.73Å; I4-K76 HydrophobicContact CD1-CG 4.12Å; I4-M79 HydrophobicContact CD1-SD 3.88Å; I4-M79 HydrophobicContact CG1-SD 4.4Å; I4-M79 HydrophobicContact CG2-CB 4.38Å; I4-M79 HydrophobicContact CG2-SD 3.82Å
5	I	95.9	Very high	89.3	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.4	173.6	-70.9	172	0	0	0	108.6	F44 I45 F47 A53 A56 M57 L71 F72 L73	I5-F44 CarbonylContact O-C 3.55Å; I5-F44 WeakPolarHBondContact O-CA 3.49Å; I5-I45 HydrophobicContact CB-CG2 3.93Å; I5-I45 HydrophobicContact CG2-CG2 4.36Å; I5-I45 PolarHBondContact N-O 2.91Å; I5-I45 PolarHBondContact O-N 2.87Å; I5-F47 HydrophobicContact CB-CE2 4.37Å; I5-F47 HydrophobicContact CD1-CD2 4.07Å; I5-F47 HydrophobicContact CD1-CE2 3.81Å; I5-F47 HydrophobicContact CG1-CE2 4.43Å; I5-A53 HydrophobicContact CD1-CB 4.05Å; I5-A53 WeakPolarHBondContact CD1-O 3.33Å; I5-A56 HydrophobicContact CD1-CB 3.83Å; I5-M57 HydrophobicContact CD1-CG 3.72Å; I5-M57 HydrophobicContact CD1-SD 3.71Å; I5-M57 HydrophobicContact CG1-SD 4.03Å; I5-M57 HydrophobicContact CG2-SD 4.23Å; I5-L71 HydrophobicContact CG2-CB 4Å; I5-L71 HydrophobicContact CG2-CD2 4.22Å; I5-F72 CarbonylContact C-O 3.6Å; I5-F72 VanDerWaalsContact CA-O 3.26Å; I5-F72 WeakPolarHBondContact CA-O 3.42Å; I5-L73 HydrophobicContact CG1-CD2 4.12Å
6	R	95.6	Very high	89.5	Confident	38 Å²	38	58.1 Å²	58.1	14%	0.143	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	130.4	170.4	-177.7	178.2	178.7	-173.2	-2.9	109.1	Q8 E40 D42 A43 F44 L71 F72 E78 I82	R6-Q8 HydrophobicContact CG-CG 4.32Å; R6-E40 IonicContact NH2-OE2 3.18Å; R6-D42 IonicContact CZ-OD1 2.83Å; R6-D42 VanDerWaalsContact CZ-OD1 3.28Å; R6-D42 IonicContact CZ-OD2 3.97Å; R6-D42 IonicContact NE-OD1 3.49Å; R6-D42 PolarHBondContact NE-OD1 2.95Å; R6-D42 IonicContact NE-OD2 2.68Å; R6-D42 IonicContact NH2-OD1 3.69Å; R6-D42 PolarHBondContact NH2-OD1 2.93Å; R6-D42 IonicContact NH2-OD2 2.67Å; R6-D42 PolarHBondContact NH2-OD2 3.32Å; R6-A43 CarbonylContact C-O 3.49Å; R6-A43 WeakPolarHBondContact CA-O 3.5Å; R6-F44 HydrophobicContact CB-CD1 3.84Å; R6-F44 HydrophobicContact CB-CE1 3.59Å; R6-F44 HydrophobicContact CB-CZ 4.35Å; R6-F44 HydrophobicContact CG-CD1 4.14Å; R6-F44 HydrophobicContact CG-CE1 3.59Å; R6-F44 HydrophobicContact CG-CZ 3.83Å; R6-L71 WeakPolarHBondContact O-CA 3.36Å; R6-F72 HydrophobicContact CB-CB 4.45Å; R6-F72 PolarHBondContact N-O 2.74Å; R6-F72 PolarHBondContact O-N 3.31Å; R6-E78 IonicContact NH1-OE1 2.72Å; R6-E78 PolarHBondContact NH1-OE1 3.5Å; R6-I82 VanDerWaalsContact CZ-CD1 3.5Å
7	L	95.8	Very high	89.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	134.4	169.1	-67.8	75.7	0	0	0	108	L10 I19 F23 D42 A43 I45 I64 V69 R70 L71	L7-L10 HydrophobicContact CB-CD1 4.5Å; L7-L10 HydrophobicContact CD2-CD1 3.79Å; L7-I19 HydrophobicContact CD2-CD1 4.33Å; L7-I19 HydrophobicContact CD2-CG1 4.16Å; L7-I19 HydrophobicContact CD2-CG2 3.91Å; L7-F23 HydrophobicContact CD1-CE2 4.23Å; L7-F23 HydrophobicContact CD2-CE2 4.08Å; L7-F23 HydrophobicContact CG-CE2 4.44Å; L7-D42 WeakPolarHBondContact O-CA 3.26Å; L7-A43 HydrophobicContact CB-CB 4.25Å; L7-A43 PolarHBondContact N-O 2.79Å; L7-A43 PolarHBondContact O-N 2.8Å; L7-I45 HydrophobicContact CD1-CB 4.15Å; L7-I45 HydrophobicContact CD1-CG2 3.65Å; L7-I64 HydrophobicContact CD2-CD1 4.32Å; L7-V69 HydrophobicContact CB-CG1 3.9Å; L7-V69 HydrophobicContact CD2-CG1 4.18Å; L7-V69 HydrophobicContact CG-CG1 4.28Å; L7-R70 CarbonylContact C-O 3.6Å; L7-R70 VanDerWaalsContact CA-O 3.3Å; L7-R70 WeakPolarHBondContact CA-O 3.5Å; L7-L71 HydrophobicContact CB-CD2 4.46Å; L7-L71 HydrophobicContact CD1-CD2 4.45Å; L7-L71 HydrophobicContact CG-CD2 3.74Å
8	Q	94.1	Very high	89.7	Confident	27 Å²	27	59.2 Å²	59.2	13%	0.126	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	160.2	169.3	-53.5	-154.3	-70.3	0	0	111.1	R6 L10 E40 D42 V69 R70 F72	R6-Q8 HydrophobicContact CG-CG 4.32Å; Q8-L10 VanDerWaalsContact C-N 3.27Å; Q8-E40 PolarHBondContact NE2-OE2 2.79Å; Q8-D42 WeakPolarHBondContact CG-OD1 3.35Å; Q8-D42 PolarHBondContact NE2-OD1 3.47Å; Q8-V69 CarbonylContact O-C 3.6Å; Q8-V69 WeakPolarHBondContact O-CA 3.41Å; Q8-V69 WeakPolarHBondContact O-CG1 3.08Å; Q8-R70 HydrophobicContact CB-CB 4.43Å; Q8-R70 PolarHBondContact N-O 3.47Å; Q8-R70 PolarHBondContact O-N 2.88Å; Q8-F72 HydrophobicContact CB-CE2 4.32Å; Q8-F72 HydrophobicContact CG-CD2 3.98Å; Q8-F72 HydrophobicContact CG-CE2 3.77Å; Q8-F72 VanDerWaalsContact OE1-CE2 3.25Å
9	N	92.1	Very high	89.9	Confident	82 Å²	82	56.1 Å²	56.1	44%	0.439	32%	0.32	S	S	.	.	S	Bend	trans	60.8	31.4	-169.6	-55	-26.5	0	0	0	113.2	E40 S68	N9-E40 WeakPolarHBondContact CA-O 3.23Å; N9-E40 PolarHBondContact N-O 2.86Å; N9-S68 WeakPolarHBondContact CB-O 3.31Å
10	L	90.9	Very high	90.1	Very high	15 Å²	15	58.6 Å²	58.6	8%	0.079	32%	0.323	C	S	.	.			trans	-68	124.6	172.1	-157	89.4	0	0	0	108.9	L7 Q8 A14 I19 I35 G41 A43 I64 V69	L7-L10 HydrophobicContact CB-CD1 4.5Å; L7-L10 HydrophobicContact CD2-CD1 3.79Å; Q8-L10 VanDerWaalsContact C-N 3.27Å; L10-A14 HydrophobicContact CD1-CB 4.22Å; L10-A14 HydrophobicContact CD2-CB 3.82Å; L10-A14 HydrophobicContact CG-CB 3.72Å; L10-I19 HydrophobicContact CD1-CD1 4.03Å; L10-I19 HydrophobicContact CD1-CG1 3.91Å; L10-I19 HydrophobicContact CD2-CD1 3.89Å; L10-I19 HydrophobicContact CD2-CG1 4.44Å; L10-I35 HydrophobicContact CD2-CD1 4.4Å; L10-I35 HydrophobicContact CD2-CG1 4.48Å; L10-I35 HydrophobicContact CD2-CG2 4.24Å; L10-G41 WeakPolarHBondContact CB-O 3.34Å; L10-G41 PolarHBondContact N-O 2.96Å; L10-A43 HydrophobicContact CD2-CB 4.12Å; L10-I64 HydrophobicContact CD1-CD1 4.02Å; L10-V69 HydrophobicContact CD1-CG1 4.31Å
11	P	88.1	Confident	90.2	Very high	28 Å²	28	65.8 Å²	65.8	18%	0.182	35%	0.346	C	S	.	.			trans	-72.6	152.1	-178.2	28.6	-31.9	0	0	0	110.5	S13 A14 I64 N65 A67	P11-S13 PolarHBondContact O-N 3.02Å; P11-A14 HydrophobicContact CG-CB 3.96Å; P11-A14 WeakPolarHBondContact O-CB 3.29Å; P11-A14 PolarHBondContact O-N 3.39Å; P11-I64 WeakPolarHBondContact CG-O 3.26Å; P11-N65 HydrophobicContact CG-CB 3.98Å; P11-A67 HydrophobicContact CB-CB 3.96Å; P11-A67 HydrophobicContact CG-CB 3.85Å
12	I	85.1	Confident	91.5	Very high	182 Å²	182	57.3 Å²	57.3	93%	0.933	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-16.7	-177.4	-161	166.9	0	0	0	114.3
13	S	87.3	Confident	92	Very high	68 Å²	68	53.5 Å²	53.5	48%	0.476	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-2.2	175.9	64.2	0	0	0	0	114.9	P11 N65	P11-S13 PolarHBondContact O-N 3.02Å; S13-N65 PolarHBondContact O-ND2 3.19Å; S13-N65 VanDerWaalsContact O-ND2 3.07Å; S13-N65 PolarHBondContact OG-ND2 3.08Å; S13-N65 VanDerWaalsContact OG-ND2 3.09Å
14	A	87.6	Confident	91.9	Very high	5 Å²	5	56 Å²	56	4%	0.041	30%	0.296	C	S	.	.			trans	-91.2	117.6	-176	0	0	0	0	0	112	L10 P11 N18 I64	L10-A14 HydrophobicContact CD1-CB 4.22Å; L10-A14 HydrophobicContact CD2-CB 3.82Å; L10-A14 HydrophobicContact CG-CB 3.72Å; P11-A14 HydrophobicContact CG-CB 3.96Å; P11-A14 WeakPolarHBondContact O-CB 3.29Å; P11-A14 PolarHBondContact O-N 3.39Å; A14-N18 HydrophobicContact CB-CB 4.44Å; A14-I64 HydrophobicContact CB-CG2 3.85Å
15	N	91.2	Very high	91.5	Very high	100 Å²	100	59.2 Å²	59.2	54%	0.535	33%	0.332	S	S	.	.			trans	-98.5	172.5	177.5	-63.1	-15.4	0	0	0	111.1	S17 N18 I19	N15-S17 PolarHBondContact O-N 2.92Å; N15-S17 VanDerWaalsContact O-N 3.1Å; N15-N18 PolarHBondContact N-OD1 3.49Å; N15-N18 WeakPolarHBondContact O-CB 3.36Å; N15-N18 PolarHBondContact O-N 3.5Å; N15-I19 PolarHBondContact O-N 3.29Å
16	A	91.4	Very high	91.4	Very high	40 Å²	40	60.6 Å²	60.6	33%	0.331	34%	0.339	S	S	.	.	H	α-helix	trans	-56	-31.2	178	0	0	0	0	0	112.7	I19 R20 V33 I35	A16-I19 PolarHBondContact O-N 2.86Å; A16-R20 WeakPolarHBondContact O-CG 3.47Å; A16-R20 PolarHBondContact O-N 3.2Å; A16-V33 HydrophobicContact CB-CB 4.37Å; A16-V33 HydrophobicContact CB-CG1 3.98Å; A16-I35 HydrophobicContact CB-CD1 4.47Å
17	S	91.2	Very high	91.1	Very high	90 Å²	90	61.8 Å²	61.8	63%	0.629	35%	0.354	S	S	*	.	H	α-helix	trans	-62.4	-41.6	173.3	-43.7	0	0	0	0	112.8	N15 R20 R21	N15-S17 PolarHBondContact O-N 2.92Å; N15-S17 VanDerWaalsContact O-N 3.1Å; S17-R20 PolarHBondContact O-N 2.95Å; S17-R21 WeakPolarHBondContact O-CB 3.47Å; S17-R21 PolarHBondContact O-N 3.38Å
18	N	91.7	Very high	90.8	Very high	46 Å²	46	63.1 Å²	63.1	25%	0.246	36%	0.361	C	S	.	.	H	α-helix	trans	-66.9	-42.4	178.3	-55.7	65	0	0	0	110.2	A14 N15 R21 F22 I64 N65	A14-N18 HydrophobicContact CB-CB 4.44Å; N15-N18 PolarHBondContact N-OD1 3.49Å; N15-N18 WeakPolarHBondContact O-CB 3.36Å; N15-N18 PolarHBondContact O-N 3.5Å; N18-R21 PolarHBondContact O-N 3.11Å; N18-F22 WeakPolarHBondContact O-CB 3.25Å; N18-F22 PolarHBondContact O-N 3.02Å; N18-I64 HydrophobicContact CB-CG2 4Å; N18-N65 PolarHBondContact ND2-ND2 3.22Å; N18-N65 PolarHBondContact ND2-OD1 2.58Å
19	I	94	Very high	90.6	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.005	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-47.4	175.8	-61.1	172.9	0	0	0	110.9	L7 L10 N15 A16 R21 F22 F23 V33 I35 A43 I45 I64	L7-I19 HydrophobicContact CD2-CD1 4.33Å; L7-I19 HydrophobicContact CD2-CG1 4.16Å; L7-I19 HydrophobicContact CD2-CG2 3.91Å; L10-I19 HydrophobicContact CD1-CD1 4.03Å; L10-I19 HydrophobicContact CD1-CG1 3.91Å; L10-I19 HydrophobicContact CD2-CD1 3.89Å; L10-I19 HydrophobicContact CD2-CG1 4.44Å; N15-I19 PolarHBondContact O-N 3.29Å; A16-I19 PolarHBondContact O-N 2.86Å; I19-R21 VanDerWaalsContact C-N 3.29Å; I19-R21 PolarHBondContact O-N 3.38Å; I19-F22 WeakPolarHBondContact O-CB 3.21Å; I19-F22 PolarHBondContact O-N 3.39Å; I19-F23 HydrophobicContact CG2-CD2 3.98Å; I19-F23 HydrophobicContact CG2-CE2 4.04Å; I19-F23 WeakPolarHBondContact O-CD2 3.19Å; I19-F23 PolarHBondContact O-N 3.13Å; I19-F23 VanDerWaalsContact O-N 3.14Å; I19-V33 HydrophobicContact CB-CG1 4.31Å; I19-V33 HydrophobicContact CD1-CG1 3.81Å; I19-V33 HydrophobicContact CG2-CG1 4.18Å; I19-V33 HydrophobicContact CG2-CG2 4.49Å; I19-I35 HydrophobicContact CD1-CD1 3.82Å; I19-I35 HydrophobicContact CD1-CG1 3.75Å; I19-A43 HydrophobicContact CD1-CB 3.98Å; I19-I45 HydrophobicContact CG2-CD1 4.01Å; I19-I64 HydrophobicContact CG1-CD1 4.44Å
20	R	93.2	Very high	90	Very high	105 Å²	105	69.2 Å²	69.2	40%	0.396	39%	0.391	S	S	.	.	H	α-helix	trans	-61.3	-35.8	175.6	-77.5	-178.1	170.3	-174.8	-4.5	112.7	A16 S17 F23 S24 I28 V33	A16-R20 WeakPolarHBondContact O-CG 3.47Å; A16-R20 PolarHBondContact O-N 3.2Å; S17-R20 PolarHBondContact O-N 2.95Å; R20-F23 CarbonylContact O-C 3.4Å; R20-S24 PolarHBondContact O-N 3.37Å; R20-I28 HydrophobicContact CG-CD1 4.49Å; R20-V33 HydrophobicContact CG-CG2 4.18Å
21	R	92.2	Very high	89.8	Confident	210 Å²	210	71 Å²	71	79%	0.792	41%	0.413	S	S	*	.	H	α-helix	trans	-72.5	-33.4	177.7	-163.6	177.6	-164.7	172.4	5.8	112.7	S17 N18 I19 S24	S17-R21 WeakPolarHBondContact O-CB 3.47Å; S17-R21 PolarHBondContact O-N 3.38Å; N18-R21 PolarHBondContact O-N 3.11Å; I19-R21 VanDerWaalsContact C-N 3.29Å; I19-R21 PolarHBondContact O-N 3.38Å; R21-S24 WeakPolarHBondContact O-CB 3.38Å; R21-S24 PolarHBondContact O-N 3.2Å; R21-S24 PolarHBondContact O-OG 3.2Å
22	F	92.9	Very high	89.8	Confident	33 Å²	33	70 Å²	70	15%	0.145	41%	0.407	C	S	.	.	H	α-helix	trans	-65.6	-39.7	173.6	176.9	-94.9	0	0	0	112.1	N18 I19 S24 L59 Q62 I64 L71	N18-F22 WeakPolarHBondContact O-CB 3.25Å; N18-F22 PolarHBondContact O-N 3.02Å; I19-F22 WeakPolarHBondContact O-CB 3.21Å; I19-F22 PolarHBondContact O-N 3.39Å; F22-S24 VanDerWaalsContact C-N 3.31Å; F22-S24 PolarHBondContact O-N 3.26Å; F22-L59 HydrophobicContact CE1-CB 3.99Å; F22-L59 HydrophobicContact CE1-CD1 4.49Å; F22-L59 HydrophobicContact CZ-CB 4.08Å; F22-Q62 HydrophobicContact CE2-CB 3.44Å; F22-Q62 VanDerWaalsContact CE2-CB 3.44Å; F22-Q62 HydrophobicContact CZ-CB 3.64Å; F22-I64 HydrophobicContact CB-CD1 3.72Å; F22-I64 HydrophobicContact CB-CG1 3.85Å; F22-I64 HydrophobicContact CD1-CD1 4Å; F22-I64 HydrophobicContact CD1-CG1 4.37Å; F22-I64 HydrophobicContact CD2-CD1 3.83Å; F22-I64 HydrophobicContact CD2-CG1 3.27Å; F22-I64 HydrophobicContact CE1-CD1 4.5Å; F22-I64 HydrophobicContact CE2-CD1 4.31Å; F22-I64 HydrophobicContact CE2-CG1 3.73Å; F22-I64 HydrophobicContact CG-CD1 3.61Å; F22-I64 HydrophobicContact CG-CG1 3.61Å; F22-I64 HydrophobicContact CZ-CG1 4.44Å; F22-L71 HydrophobicContact CE1-CD1 4.4Å
23	F	94.1	Very high	90.2	Very high	1 Å²	1	62.4 Å²	62.4	0%	0.004	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	33.7	173.5	-63.6	-63.9	0	0	0	113.1	L7 I19 R20 G25 L26 I28 I45 F47 A56 L59 L71	L7-F23 HydrophobicContact CD1-CE2 4.23Å; L7-F23 HydrophobicContact CD2-CE2 4.08Å; L7-F23 HydrophobicContact CG-CE2 4.44Å; I19-F23 HydrophobicContact CG2-CD2 3.98Å; I19-F23 HydrophobicContact CG2-CE2 4.04Å; I19-F23 WeakPolarHBondContact O-CD2 3.19Å; I19-F23 PolarHBondContact O-N 3.13Å; I19-F23 VanDerWaalsContact O-N 3.14Å; R20-F23 CarbonylContact O-C 3.4Å; F23-G25 PolarHBondContact O-N 3.11Å; F23-L26 HydrophobicContact CB-CD1 4.24Å; F23-L26 HydrophobicContact CD1-CD1 4.07Å; F23-L26 PolarHBondContact O-N 2.61Å; F23-I28 HydrophobicContact CB-CD1 3.79Å; F23-I45 HydrophobicContact CD2-CD1 3.43Å; F23-I45 VanDerWaalsContact CD2-CD1 3.43Å; F23-I45 HydrophobicContact CE2-CD1 3.87Å; F23-I45 HydrophobicContact CE2-CG2 4.02Å; F23-I45 HydrophobicContact CG-CD1 4.23Å; F23-I45 HydrophobicContact CZ-CG2 4.48Å; F23-F47 HydrophobicContact CB-CE1 4.24Å; F23-F47 HydrophobicContact CB-CZ 4.24Å; F23-F47 HydrophobicContact CD1-CE1 4.48Å; F23-F47 AromaticContact CD1-CZ 3.82Å; F23-F47 HydrophobicContact CD1-CZ 3.82Å; F23-F47 HydrophobicContact CD2-CZ 4.09Å; F23-F47 HydrophobicContact CE1-CZ 4.15Å; F23-F47 HydrophobicContact CE2-CZ 4.36Å; F23-F47 HydrophobicContact CG-CE1 4.3Å; F23-F47 AromaticContact CG-CZ 3.8Å; F23-F47 HydrophobicContact CG-CZ 3.8Å; F23-F47 HydrophobicContact CZ-CZ 4.39Å; F23-A56 HydrophobicContact CD1-CB 3.81Å; F23-A56 HydrophobicContact CE1-CB 3.65Å; F23-L59 HydrophobicContact CD1-CD1 3.87Å; F23-L59 HydrophobicContact CE1-CD1 4.25Å; F23-L71 HydrophobicContact CE1-CD1 3.85Å; F23-L71 HydrophobicContact CZ-CD1 3.9Å; F23-L71 HydrophobicContact CZ-CD2 3.82Å
24	S	89.9	Confident	90.5	Very high	90 Å²	90	63 Å²	63	63%	0.629	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	131.9	-178.9	59.3	0	0	0	0	111.8	R20 R21 F22	R20-S24 PolarHBondContact O-N 3.37Å; R21-S24 WeakPolarHBondContact O-CB 3.38Å; R21-S24 PolarHBondContact O-N 3.2Å; R21-S24 PolarHBondContact O-OG 3.2Å; F22-S24 VanDerWaalsContact C-N 3.31Å; F22-S24 PolarHBondContact O-N 3.26Å
25	G	87.4	Confident	90.7	Very high	82 Å²	82	66.5 Å²	66.5	85%	0.845	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	2.2	-178.7	0	0	0	0	0	115	F23	F23-G25 PolarHBondContact O-N 3.11Å
26	L	93.2	Very high	90.7	Very high	29 Å²	29	63.2 Å²	63.2	15%	0.152	37%	0.366	C	S	.	.	S	Bend	trans	-108.3	144.6	175.1	-55.4	-178.2	0	0	0	110.9	F23 I28 F47 D52 K55 A56	F23-L26 HydrophobicContact CB-CD1 4.24Å; F23-L26 HydrophobicContact CD1-CD1 4.07Å; F23-L26 PolarHBondContact O-N 2.61Å; L26-I28 PolarHBondContact O-N 2.9Å; L26-F47 HydrophobicContact CB-CD1 4.06Å; L26-F47 HydrophobicContact CB-CE1 3.71Å; L26-F47 HydrophobicContact CD1-CE1 3.87Å; L26-F47 HydrophobicContact CD1-CZ 4.32Å; L26-F47 HydrophobicContact CG-CE1 4.46Å; L26-D52 HydrophobicContact CB-CB 4.29Å; L26-D52 HydrophobicContact CD2-CB 4.44Å; L26-K55 HydrophobicContact CD1-CB 4.3Å; L26-K55 HydrophobicContact CD2-CB 3.62Å; L26-K55 HydrophobicContact CD2-CD 3.74Å; L26-K55 HydrophobicContact CD2-CG 4.35Å; L26-A56 HydrophobicContact CD1-CB 3.75Å
27	S	88.9	Confident	90.4	Very high	63 Å²	63	62.6 Å²	62.6	44%	0.441	36%	0.363	S	S	.	.			trans	-78.4	106.5	-176.4	-167.1	0	0	0	0	112.3	F47 A48 D52	S27-F47 WeakPolarHBondContact O-CA 3.18Å; S27-A48 PolarHBondContact O-N 3.48Å; S27-A48 WeakPolarHBondContact OG-CB 3.25Å; S27-D52 WeakPolarHBondContact CB-OD2 3.5Å; S27-D52 PolarHBondContact N-OD2 3.23Å
28	I	91	Very high	89.9	Confident	29 Å²	29	61.5 Å²	61.5	15%	0.149	37%	0.366	C	S	.	.			trans	-116.9	111.7	-178.9	-58.9	151.2	0	0	0	108.2	R20 F23 L26 V33 I45 F47	R20-I28 HydrophobicContact CG-CD1 4.49Å; F23-I28 HydrophobicContact CB-CD1 3.79Å; L26-I28 PolarHBondContact O-N 2.9Å; I28-V33 HydrophobicContact CG2-CG2 4.03Å; I28-I45 HydrophobicContact CD1-CD1 3.7Å; I28-I45 HydrophobicContact CG1-CD1 3.79Å; I28-I45 HydrophobicContact CG1-CG1 4.33Å; I28-I45 HydrophobicContact CG2-CD1 3.99Å; I28-I45 HydrophobicContact CG2-CG1 3.97Å; I28-F47 HydrophobicContact CD1-CE1 4.12Å; I28-F47 HydrophobicContact CG1-CD1 3.83Å; I28-F47 HydrophobicContact CG1-CE1 3.6Å; I28-F47 HydrophobicContact CG1-CZ 4.48Å
29	P	89	Confident	89.4	Confident	53 Å²	53	66.8 Å²	66.8	34%	0.344	40%	0.4	S	S	.	.			trans	-57.8	158.1	179.1	-26.6	36.7	0	0	0	113.6	G32 A46 A48	P29-G32 WeakPolarHBondContact O-CA 3.32Å; P29-G32 PolarHBondContact O-N 3.21Å; P29-A46 VanDerWaalsContact CD-O 3.23Å; P29-A46 WeakPolarHBondContact CD-O 3.2Å; P29-A48 HydrophobicContact CG-CB 4.1Å
30	E	79.9	Confident	88.8	Confident	183 Å²	183	70.8 Å²	70.8	86%	0.855	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	136.9	170.3	-159.7	159.5	-133.3	0	0	110.5	G32	E30-G32 PolarHBondContact O-N 3.3Å
31	G	85.8	Confident	88.6	Confident	53 Å²	53	66.3 Å²	66.3	55%	0.546	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	2.3	-165.7	0	0	0	0	0	115.3	V33 H34	G31-V33 VanDerWaalsContact C-N 3.25Å; G31-V33 PolarHBondContact O-N 2.83Å; G31-H34 PolarHBondContact O-CE1 2.95Å; G31-H34 PolarHBondContact O-ND1 2.94Å
32	G	89.6	Confident	88.7	Confident	6 Å²	6	57.1 Å²	57.1	6%	0.062	37%	0.372	C	S	.	.			trans	-68.6	-12.6	-178.1	0	0	0	0	0	115.9	P29 E30 I45 A46	P29-G32 WeakPolarHBondContact O-CA 3.32Å; P29-G32 PolarHBondContact O-N 3.21Å; E30-G32 PolarHBondContact O-N 3.3Å; G32-I45 CarbonylContact O-C 3.45Å; G32-I45 WeakPolarHBondContact O-CA 3.42Å; G32-A46 PolarHBondContact O-N 2.89Å
33	V	93.6	Very high	88.8	Confident	24 Å²	24	55.5 Å²	55.5	15%	0.145	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.2	-177.3	-178.4	0	0	0	0	110.3	A16 I19 R20 I28 G31 I35 F44 I45	A16-V33 HydrophobicContact CB-CB 4.37Å; A16-V33 HydrophobicContact CB-CG1 3.98Å; I19-V33 HydrophobicContact CB-CG1 4.31Å; I19-V33 HydrophobicContact CD1-CG1 3.81Å; I19-V33 HydrophobicContact CG2-CG1 4.18Å; I19-V33 HydrophobicContact CG2-CG2 4.49Å; R20-V33 HydrophobicContact CG-CG2 4.18Å; I28-V33 HydrophobicContact CG2-CG2 4.03Å; G31-V33 VanDerWaalsContact C-N 3.25Å; G31-V33 PolarHBondContact O-N 2.83Å; V33-I35 HydrophobicContact CG1-CG1 4.42Å; V33-F44 CarbonylContact C-O 3.57Å; V33-F44 WeakPolarHBondContact CA-O 3.44Å; V33-I45 HydrophobicContact CG2-CD1 4.13Å; V33-I45 HydrophobicContact CG2-CG1 4.09Å
34	H	92.2	Very high	88.8	Confident	79 Å²	79	55.5 Å²	55.5	37%	0.366	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	107.9	-179.6	-64	66.5	0	0	0	109.6	G31 A43 F44 M79 I83	G31-H34 PolarHBondContact O-CE1 2.95Å; G31-H34 PolarHBondContact O-ND1 2.94Å; H34-A43 CarbonylContact O-C 3.51Å; H34-A43 VanDerWaalsContact O-CA 3.3Å; H34-A43 WeakPolarHBondContact O-CA 3.36Å; H34-F44 HydrophobicContact CB-CB 4.41Å; H34-F44 PolarHBondContact N-O 2.97Å; H34-F44 PolarHBondContact O-N 3.25Å; H34-M79 HydrophobicContact CB-CE 3.91Å; H34-M79 VanDerWaalsContact CE1-CE 3.42Å; H34-M79 WeakPolarHBondContact CE1-CE 3.49Å; H34-M79 WeakPolarHBondContact ND1-CE 3.44Å; H34-I83 HydrophobicContact CB-CD1 4.06Å
35	I	92.3	Very high	89.1	Confident	79 Å²	79	51.2 Å²	51.2	41%	0.405	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	128.7	176.2	-58.8	176.1	0	0	0	108.3	L10 A16 I19 V33 A43	L10-I35 HydrophobicContact CD2-CD1 4.4Å; L10-I35 HydrophobicContact CD2-CG1 4.48Å; L10-I35 HydrophobicContact CD2-CG2 4.24Å; A16-I35 HydrophobicContact CB-CD1 4.47Å; I19-I35 HydrophobicContact CD1-CD1 3.82Å; I19-I35 HydrophobicContact CD1-CG1 3.75Å; V33-I35 HydrophobicContact CG1-CG1 4.42Å; I35-A43 HydrophobicContact CB-CB 4.42Å; I35-A43 HydrophobicContact CG1-CB 4.11Å
36	V	90.5	Very high	89.4	Confident	32 Å²	32	48.1 Å²	48.1	19%	0.194	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	-36.5	-177.6	-172.3	0	0	0	0	111.2	D42 F44 I82 I83 A86	V36-D42 WeakPolarHBondContact CA-O 3.33Å; V36-D42 HydrophobicContact CB-CB 4.2Å; V36-D42 WeakPolarHBondContact CB-O 3.4Å; V36-D42 PolarHBondContact N-O 3.19Å; V36-F44 HydrophobicContact CG2-CD2 3.79Å; V36-F44 HydrophobicContact CG2-CE2 3.76Å; V36-I82 HydrophobicContact CG1-CG2 4.13Å; V36-I83 HydrophobicContact CG2-CG1 3.61Å; V36-A86 HydrophobicContact CG1-CB 3.22Å
37	G	85.7	Confident	89.5	Confident	26 Å²	26	46.7 Å²	46.7	27%	0.268	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	76.2	-131.3	-176.1	0	0	0	0	0	111.4	D42	G37-D42 PolarHBondContact N-O 3.36Å; G37-D42 PolarHBondContact O-N 2.88Å
38	G	81.1	Confident	89.6	Confident	68 Å²	68	45.6 Å²	45.6	70%	0.701	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	-176.3	-171.4	0	0	0	0	0	113	E40 G41	G38-E40 VanDerWaalsContact C-N 3.31Å; G38-E40 PolarHBondContact O-N 2.81Å; G38-G41 PolarHBondContact O-N 3.09Å; G38-G41 VanDerWaalsContact O-N 3.13Å
39	T	80.1	Confident	89.6	Confident	156 Å²	156	46.8 Å²	46.8	96%	0.957	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-25.9	-173	48.2	0	0	0	0	114.3
40	E	83.2	Confident	89.7	Confident	86 Å²	86	49.6 Å²	49.6	40%	0.402	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.6	175.2	-60.6	-166.4	154.6	0	0	112.8	R6 Q8 N9 G38	R6-E40 IonicContact NH2-OE2 3.18Å; Q8-E40 PolarHBondContact NE2-OE2 2.79Å; N9-E40 WeakPolarHBondContact CA-O 3.23Å; N9-E40 PolarHBondContact N-O 2.86Å; G38-E40 VanDerWaalsContact C-N 3.31Å; G38-E40 PolarHBondContact O-N 2.81Å
41	G	88.9	Confident	90.3	Very high	11 Å²	11	44.5 Å²	44.5	11%	0.113	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	55.5	-179.4	0	0	0	0	0	112.4	L10 G38	L10-G41 WeakPolarHBondContact CB-O 3.34Å; L10-G41 PolarHBondContact N-O 2.96Å; G38-G41 PolarHBondContact O-N 3.09Å; G38-G41 VanDerWaalsContact O-N 3.13Å
42	D	92.8	Very high	90.7	Very high	16 Å²	16	42.9 Å²	42.9	9%	0.086	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	138.4	-175.9	-79.7	-46.6	0	0	0	112.4	R6 L7 Q8 V36 G37	R6-D42 IonicContact CZ-OD1 2.83Å; R6-D42 VanDerWaalsContact CZ-OD1 3.28Å; R6-D42 IonicContact CZ-OD2 3.97Å; R6-D42 IonicContact NE-OD1 3.49Å; R6-D42 PolarHBondContact NE-OD1 2.95Å; R6-D42 IonicContact NE-OD2 2.68Å; R6-D42 IonicContact NH2-OD1 3.69Å; R6-D42 PolarHBondContact NH2-OD1 2.93Å; R6-D42 IonicContact NH2-OD2 2.67Å; R6-D42 PolarHBondContact NH2-OD2 3.32Å; L7-D42 WeakPolarHBondContact O-CA 3.26Å; Q8-D42 WeakPolarHBondContact CG-OD1 3.35Å; Q8-D42 PolarHBondContact NE2-OD1 3.47Å; V36-D42 WeakPolarHBondContact CA-O 3.33Å; V36-D42 HydrophobicContact CB-CB 4.2Å; V36-D42 WeakPolarHBondContact CB-O 3.4Å; V36-D42 PolarHBondContact N-O 3.19Å; G37-D42 PolarHBondContact N-O 3.36Å; G37-D42 PolarHBondContact O-N 2.88Å
43	A	94.9	Very high	90.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	162	163.4	0	0	0	0	0	110.7	R6 L7 L10 I19 H34 I35	R6-A43 CarbonylContact C-O 3.49Å; R6-A43 WeakPolarHBondContact CA-O 3.5Å; L7-A43 HydrophobicContact CB-CB 4.25Å; L7-A43 PolarHBondContact N-O 2.79Å; L7-A43 PolarHBondContact O-N 2.8Å; L10-A43 HydrophobicContact CD2-CB 4.12Å; I19-A43 HydrophobicContact CD1-CB 3.98Å; H34-A43 CarbonylContact O-C 3.51Å; H34-A43 VanDerWaalsContact O-CA 3.3Å; H34-A43 WeakPolarHBondContact O-CA 3.36Å; I35-A43 HydrophobicContact CB-CB 4.42Å; I35-A43 HydrophobicContact CG1-CB 4.11Å
44	F	95.3	Very high	91	Very high	1 Å²	1	49 Å²	49	0%	0.004	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.1	177.1	-62.4	-93.2	0	0	0	110.2	I4 I5 R6 V33 H34 V36 S74 M79 I82	I4-F44 HydrophobicContact CG2-CB 4.37Å; I4-F44 HydrophobicContact CG2-CD1 4.13Å; I5-F44 CarbonylContact O-C 3.55Å; I5-F44 WeakPolarHBondContact O-CA 3.49Å; R6-F44 HydrophobicContact CB-CD1 3.84Å; R6-F44 HydrophobicContact CB-CE1 3.59Å; R6-F44 HydrophobicContact CB-CZ 4.35Å; R6-F44 HydrophobicContact CG-CD1 4.14Å; R6-F44 HydrophobicContact CG-CE1 3.59Å; R6-F44 HydrophobicContact CG-CZ 3.83Å; V33-F44 CarbonylContact C-O 3.57Å; V33-F44 WeakPolarHBondContact CA-O 3.44Å; H34-F44 HydrophobicContact CB-CB 4.41Å; H34-F44 PolarHBondContact N-O 2.97Å; H34-F44 PolarHBondContact O-N 3.25Å; V36-F44 HydrophobicContact CG2-CD2 3.79Å; V36-F44 HydrophobicContact CG2-CE2 3.76Å; F44-S74 WeakPolarHBondContact CE1-OG 3.39Å; F44-M79 HydrophobicContact CB-CE 4.14Å; F44-M79 HydrophobicContact CB-CG 3.93Å; F44-M79 HydrophobicContact CB-SD 4.05Å; F44-M79 HydrophobicContact CD1-CB 3.69Å; F44-M79 HydrophobicContact CD1-CG 3.83Å; F44-M79 HydrophobicContact CD2-CG 4.07Å; F44-M79 HydrophobicContact CE1-CB 3.9Å; F44-M79 HydrophobicContact CE1-CG 4.38Å; F44-M79 HydrophobicContact CG-CB 4.07Å; F44-M79 HydrophobicContact CG-CG 3.65Å; F44-M79 HydrophobicContact CG-SD 4.4Å; F44-M79 HydrophobicContact CZ-CB 4.45Å; F44-I82 HydrophobicContact CE2-CB 4.13Å; F44-I82 HydrophobicContact CE2-CG2 3.8Å; F44-I82 HydrophobicContact CZ-CB 3.95Å; F44-I82 HydrophobicContact CZ-CD1 3.78Å; F44-I82 HydrophobicContact CZ-CG1 4.47Å; F44-I82 HydrophobicContact CZ-CG2 3.92Å
45	I	95.2	Very high	91.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	132.3	173.7	-170.3	165.4	0	0	0	110.1	I4 I5 L7 I19 F23 I28 G32 V33 F47	I4-I45 CarbonylContact C-O 3.54Å; I4-I45 WeakPolarHBondContact CA-O 3.29Å; I5-I45 HydrophobicContact CB-CG2 3.93Å; I5-I45 HydrophobicContact CG2-CG2 4.36Å; I5-I45 PolarHBondContact N-O 2.91Å; I5-I45 PolarHBondContact O-N 2.87Å; L7-I45 HydrophobicContact CD1-CB 4.15Å; L7-I45 HydrophobicContact CD1-CG2 3.65Å; I19-I45 HydrophobicContact CG2-CD1 4.01Å; F23-I45 HydrophobicContact CD2-CD1 3.43Å; F23-I45 VanDerWaalsContact CD2-CD1 3.43Å; F23-I45 HydrophobicContact CE2-CD1 3.87Å; F23-I45 HydrophobicContact CE2-CG2 4.02Å; F23-I45 HydrophobicContact CG-CD1 4.23Å; F23-I45 HydrophobicContact CZ-CG2 4.48Å; I28-I45 HydrophobicContact CD1-CD1 3.7Å; I28-I45 HydrophobicContact CG1-CD1 3.79Å; I28-I45 HydrophobicContact CG1-CG1 4.33Å; I28-I45 HydrophobicContact CG2-CD1 3.99Å; I28-I45 HydrophobicContact CG2-CG1 3.97Å; G32-I45 CarbonylContact O-C 3.45Å; G32-I45 WeakPolarHBondContact O-CA 3.42Å; V33-I45 HydrophobicContact CG2-CD1 4.13Å; V33-I45 HydrophobicContact CG2-CG1 4.09Å; I45-F47 HydrophobicContact CB-CE2 4.44Å; I45-F47 HydrophobicContact CD1-CE1 4.21Å; I45-F47 HydrophobicContact CD1-CE2 4.29Å; I45-F47 HydrophobicContact CD1-CZ 3.79Å; I45-F47 HydrophobicContact CG1-CE2 4.19Å; I45-F47 HydrophobicContact CG1-CZ 4.16Å; I45-F47 HydrophobicContact CG2-CD2 4.28Å; I45-F47 HydrophobicContact CG2-CE2 3.48Å; I45-F47 VanDerWaalsContact CG2-CE2 3.48Å; I45-F47 HydrophobicContact CG2-CZ 3.97Å
46	A	94.4	Very high	91.2	Very high	16 Å²	16	45.9 Å²	45.9	13%	0.132	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	126.5	169.6	0	0	0	0	0	109.4	V3 I4 P29 G32	V3-A46 WeakPolarHBondContact O-CA 3.35Å; I4-A46 HydrophobicContact CG1-CB 4.38Å; P29-A46 VanDerWaalsContact CD-O 3.23Å; P29-A46 WeakPolarHBondContact CD-O 3.2Å; G32-A46 PolarHBondContact O-N 2.89Å
47	F	95	Very high	91.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	147.9	169.5	-68.6	-80.5	0	0	0	110.2	S2 V3 I5 F23 L26 S27 I28 I45 T49 D52 A53 A56	S2-F47 WeakPolarHBondContact CA-O 3.42Å; S2-F47 WeakPolarHBondContact CB-O 3.17Å; V3-F47 PolarHBondContact N-O 3.39Å; V3-F47 PolarHBondContact O-N 2.76Å; I5-F47 HydrophobicContact CB-CE2 4.37Å; I5-F47 HydrophobicContact CD1-CD2 4.07Å; I5-F47 HydrophobicContact CD1-CE2 3.81Å; I5-F47 HydrophobicContact CG1-CE2 4.43Å; F23-F47 HydrophobicContact CB-CE1 4.24Å; F23-F47 HydrophobicContact CB-CZ 4.24Å; F23-F47 HydrophobicContact CD1-CE1 4.48Å; F23-F47 AromaticContact CD1-CZ 3.82Å; F23-F47 HydrophobicContact CD1-CZ 3.82Å; F23-F47 HydrophobicContact CD2-CZ 4.09Å; F23-F47 HydrophobicContact CE1-CZ 4.15Å; F23-F47 HydrophobicContact CE2-CZ 4.36Å; F23-F47 HydrophobicContact CG-CE1 4.3Å; F23-F47 AromaticContact CG-CZ 3.8Å; F23-F47 HydrophobicContact CG-CZ 3.8Å; F23-F47 HydrophobicContact CZ-CZ 4.39Å; L26-F47 HydrophobicContact CB-CD1 4.06Å; L26-F47 HydrophobicContact CB-CE1 3.71Å; L26-F47 HydrophobicContact CD1-CE1 3.87Å; L26-F47 HydrophobicContact CD1-CZ 4.32Å; L26-F47 HydrophobicContact CG-CE1 4.46Å; S27-F47 WeakPolarHBondContact O-CA 3.18Å; I28-F47 HydrophobicContact CD1-CE1 4.12Å; I28-F47 HydrophobicContact CG1-CD1 3.83Å; I28-F47 HydrophobicContact CG1-CE1 3.6Å; I28-F47 HydrophobicContact CG1-CZ 4.48Å; I45-F47 HydrophobicContact CB-CE2 4.44Å; I45-F47 HydrophobicContact CD1-CE1 4.21Å; I45-F47 HydrophobicContact CD1-CE2 4.29Å; I45-F47 HydrophobicContact CD1-CZ 3.79Å; I45-F47 HydrophobicContact CG1-CE2 4.19Å; I45-F47 HydrophobicContact CG1-CZ 4.16Å; I45-F47 HydrophobicContact CG2-CD2 4.28Å; I45-F47 HydrophobicContact CG2-CE2 3.48Å; I45-F47 VanDerWaalsContact CG2-CE2 3.48Å; I45-F47 HydrophobicContact CG2-CZ 3.97Å; F47-T49 VanDerWaalsContact C-N 3.34Å; F47-D52 HydrophobicContact CB-CB 4.21Å; F47-D52 HydrophobicContact CD1-CB 4.01Å; F47-D52 HydrophobicContact CG-CB 4.38Å; F47-A53 HydrophobicContact CB-CB 4.11Å; F47-A53 HydrophobicContact CD2-CB 3.98Å; F47-A53 HydrophobicContact CG-CB 4.24Å; F47-A56 HydrophobicContact CD2-CB 4.25Å; F47-A56 HydrophobicContact CE1-CB 4.02Å; F47-A56 HydrophobicContact CE2-CB 3.45Å; F47-A56 VanDerWaalsContact CE2-CB 3.45Å; F47-A56 HydrophobicContact CZ-CB 3.31Å
48	A	90.8	Very high	91.8	Very high	39 Å²	39	52.3 Å²	52.3	32%	0.322	29%	0.291	S	S	.	.	S	Bend	trans	-70.8	-31.4	179.7	0	0	0	0	0	112.6	S27 P29	S27-A48 PolarHBondContact O-N 3.48Å; S27-A48 WeakPolarHBondContact OG-CB 3.25Å; P29-A48 HydrophobicContact CG-CB 4.1Å
49	T	90.6	Very high	92.3	Very high	54 Å²	54	51.7 Å²	51.7	33%	0.331	27%	0.271	S	S	.	.	S	Bend	trans	-123.8	158.9	179.9	75.2	0	0	0	0	111.7	F47 D52 A53	F47-T49 VanDerWaalsContact C-N 3.34Å; T49-D52 VanDerWaalsContact OG1-CB 3.3Å; T49-D52 WeakPolarHBondContact OG1-CB 3.47Å; T49-D52 PolarHBondContact OG1-N 3.44Å; T49-D52 PolarHBondContact OG1-OD2 3.42Å; T49-A53 PolarHBondContact O-N 3.45Å
50	D	92.2	Very high	92.9	Very high	112 Å²	112	46.6 Å²	46.6	60%	0.599	24%	0.238	S	C	*	.	H	α-helix	trans	-72.8	-33.5	172	58.9	-39.7	0	0	0	112.6	V3 A53 R54	V3-D50 HydrophobicContact CG2-CB 3.99Å; D50-A53 PolarHBondContact O-N 3.19Å; D50-R54 PolarHBondContact O-N 3.39Å
51	E	92.5	Very high	93.3	Very high	77 Å²	77	50 Å²	50	36%	0.36	25%	0.248	S	C	.	.	H	α-helix	trans	-67.8	-36.5	174.7	179.5	54.8	-161.8	0	0	112.3	R54 K55	E51-R54 WeakPolarHBondContact O-CB 3.48Å; E51-R54 PolarHBondContact O-N 3.49Å; E51-R54 IonicContact OE2-CZ 2.79Å; E51-R54 IonicContact OE2-NE 3.2Å; E51-R54 PolarHBondContact OE2-NE 3.36Å; E51-R54 IonicContact OE2-NH2 2.84Å; E51-K55 WeakPolarHBondContact O-CG 3.45Å; E51-K55 PolarHBondContact O-N 2.96Å; E51-K55 WeakPolarHBondContact OE1-CE 3.42Å; E51-K55 IonicContact OE1-NZ 3.12Å
52	D	94.2	Very high	93.5	Very high	18 Å²	18	54.4 Å²	54.4	10%	0.096	27%	0.265	C	S	.	.	H	α-helix	trans	-66	-40.9	171.2	-69.1	-41.6	0	0	0	111.7	L26 S27 F47 T49 R54 K55 A56	L26-D52 HydrophobicContact CB-CB 4.29Å; L26-D52 HydrophobicContact CD2-CB 4.44Å; S27-D52 WeakPolarHBondContact CB-OD2 3.5Å; S27-D52 PolarHBondContact N-OD2 3.23Å; F47-D52 HydrophobicContact CB-CB 4.21Å; F47-D52 HydrophobicContact CD1-CB 4.01Å; F47-D52 HydrophobicContact CG-CB 4.38Å; T49-D52 VanDerWaalsContact OG1-CB 3.3Å; T49-D52 WeakPolarHBondContact OG1-CB 3.47Å; T49-D52 PolarHBondContact OG1-N 3.44Å; T49-D52 PolarHBondContact OG1-OD2 3.42Å; D52-R54 VanDerWaalsContact C-N 3.35Å; D52-K55 PolarHBondContact O-N 2.86Å; D52-A56 WeakPolarHBondContact O-CB 3.2Å; D52-A56 PolarHBondContact O-N 3.17Å
53	A	94.2	Very high	93.3	Very high	3 Å²	3	57.2 Å²	57.2	3%	0.025	28%	0.283	C	S	.	.	H	α-helix	trans	-65.9	-36.2	175	0	0	0	0	0	112.5	V3 I5 F47 T49 D50 A56 M57	V3-A53 HydrophobicContact CB-CB 3.6Å; V3-A53 HydrophobicContact CG1-CB 3.49Å; V3-A53 VanDerWaalsContact CG1-CB 3.49Å; V3-A53 HydrophobicContact CG2-CB 4.34Å; I5-A53 HydrophobicContact CD1-CB 4.05Å; I5-A53 WeakPolarHBondContact CD1-O 3.33Å; F47-A53 HydrophobicContact CB-CB 4.11Å; F47-A53 HydrophobicContact CD2-CB 3.98Å; F47-A53 HydrophobicContact CG-CB 4.24Å; T49-A53 PolarHBondContact O-N 3.45Å; D50-A53 PolarHBondContact O-N 3.19Å; A53-A56 WeakPolarHBondContact O-CB 3.49Å; A53-A56 PolarHBondContact O-N 3.41Å; A53-M57 WeakPolarHBondContact O-CG 3.34Å; A53-M57 PolarHBondContact O-N 2.69Å
54	R	93.8	Very high	93.1	Very high	155 Å²	155	57.5 Å²	57.5	59%	0.585	28%	0.284	S	S	*	.	H	α-helix	trans	-56.4	-53.8	169.3	-97.2	173.1	45.3	75	7.6	110.5	D50 E51 D52 A56 M57 L58	D50-R54 PolarHBondContact O-N 3.39Å; E51-R54 WeakPolarHBondContact O-CB 3.48Å; E51-R54 PolarHBondContact O-N 3.49Å; E51-R54 IonicContact OE2-CZ 2.79Å; E51-R54 IonicContact OE2-NE 3.2Å; E51-R54 PolarHBondContact OE2-NE 3.36Å; E51-R54 IonicContact OE2-NH2 2.84Å; D52-R54 VanDerWaalsContact C-N 3.35Å; R54-A56 VanDerWaalsContact C-N 3.31Å; R54-A56 PolarHBondContact O-N 3.14Å; R54-M57 PolarHBondContact O-N 3.3Å; R54-M57 VanDerWaalsContact O-N 3.13Å; R54-L58 WeakPolarHBondContact O-CD1 3.11Å; R54-L58 PolarHBondContact O-N 3.26Å
55	K	95	Very high	92.7	Very high	93 Å²	93	61.4 Å²	61.4	40%	0.404	31%	0.305	S	S	.	.	H	α-helix	trans	-57.8	-41.4	177.4	-69.5	167.8	-171.7	163.9	0	112.3	L26 E51 D52 M57 L58	L26-K55 HydrophobicContact CD1-CB 4.3Å; L26-K55 HydrophobicContact CD2-CB 3.62Å; L26-K55 HydrophobicContact CD2-CD 3.74Å; L26-K55 HydrophobicContact CD2-CG 4.35Å; E51-K55 WeakPolarHBondContact O-CG 3.45Å; E51-K55 PolarHBondContact O-N 2.96Å; E51-K55 WeakPolarHBondContact OE1-CE 3.42Å; E51-K55 IonicContact OE1-NZ 3.12Å; D52-K55 PolarHBondContact O-N 2.86Å; K55-M57 VanDerWaalsContact C-N 3.33Å; K55-M57 PolarHBondContact O-N 3.07Å; K55-L58 WeakPolarHBondContact O-CB 3.42Å; K55-L58 PolarHBondContact O-N 2.89Å; K55-L58 VanDerWaalsContact O-N 3.16Å
56	A	95	Very high	92.1	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-58.7	-41.7	175.6	0	0	0	0	0	112.4	I5 F23 L26 F47 D52 A53 R54 L58 L59 L71	I5-A56 HydrophobicContact CD1-CB 3.83Å; F23-A56 HydrophobicContact CD1-CB 3.81Å; F23-A56 HydrophobicContact CE1-CB 3.65Å; L26-A56 HydrophobicContact CD1-CB 3.75Å; F47-A56 HydrophobicContact CD2-CB 4.25Å; F47-A56 HydrophobicContact CE1-CB 4.02Å; F47-A56 HydrophobicContact CE2-CB 3.45Å; F47-A56 VanDerWaalsContact CE2-CB 3.45Å; F47-A56 HydrophobicContact CZ-CB 3.31Å; D52-A56 WeakPolarHBondContact O-CB 3.2Å; D52-A56 PolarHBondContact O-N 3.17Å; A53-A56 WeakPolarHBondContact O-CB 3.49Å; A53-A56 PolarHBondContact O-N 3.41Å; R54-A56 VanDerWaalsContact C-N 3.31Å; R54-A56 PolarHBondContact O-N 3.14Å; A56-L58 PolarHBondContact O-N 3.26Å; A56-L59 WeakPolarHBondContact O-CB 3.3Å; A56-L59 PolarHBondContact O-N 3.3Å; A56-L71 WeakPolarHBondContact O-CD1 3.46Å
57	M	95.1	Very high	91.7	Very high	59 Å²	59	64.1 Å²	64.1	29%	0.291	33%	0.332	S	S	.	.	H	α-helix	trans	-65.1	-21.2	177.9	-70.1	-63.3	-59.9	0	0	113.8	I5 A53 R54 K55 L59 D60 L71 L73	I5-M57 HydrophobicContact CD1-CG 3.72Å; I5-M57 HydrophobicContact CD1-SD 3.71Å; I5-M57 HydrophobicContact CG1-SD 4.03Å; I5-M57 HydrophobicContact CG2-SD 4.23Å; A53-M57 WeakPolarHBondContact O-CG 3.34Å; A53-M57 PolarHBondContact O-N 2.69Å; R54-M57 PolarHBondContact O-N 3.3Å; R54-M57 VanDerWaalsContact O-N 3.13Å; K55-M57 VanDerWaalsContact C-N 3.33Å; K55-M57 PolarHBondContact O-N 3.07Å; M57-L59 PolarHBondContact O-N 2.78Å; M57-D60 PolarHBondContact O-N 3.4Å; M57-L71 HydrophobicContact CE-CB 4.43Å; M57-L71 WeakPolarHBondContact CE-O 3.37Å; M57-L71 HydrophobicContact SD-CB 3.98Å; M57-L73 HydrophobicContact SD-CG 4.36Å
58	L	93.2	Very high	91.5	Very high	135 Å²	135	66.1 Å²	66.1	71%	0.707	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-12.9	170.6	-71.8	110.3	0	0	0	113.1	R54 K55 A56 D60	R54-L58 WeakPolarHBondContact O-CD1 3.11Å; R54-L58 PolarHBondContact O-N 3.26Å; K55-L58 WeakPolarHBondContact O-CB 3.42Å; K55-L58 PolarHBondContact O-N 2.89Å; K55-L58 VanDerWaalsContact O-N 3.16Å; A56-L58 PolarHBondContact O-N 3.26Å; L58-D60 VanDerWaalsContact C-N 3.34Å
59	L	92	Very high	91.6	Very high	54 Å²	54	64.2 Å²	64.2	28%	0.283	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	11.2	175.3	-56	175.5	0	0	0	112.9	F22 F23 A56 M57 R61 Q62 L71	F22-L59 HydrophobicContact CE1-CB 3.99Å; F22-L59 HydrophobicContact CE1-CD1 4.49Å; F22-L59 HydrophobicContact CZ-CB 4.08Å; F23-L59 HydrophobicContact CD1-CD1 3.87Å; F23-L59 HydrophobicContact CE1-CD1 4.25Å; A56-L59 WeakPolarHBondContact O-CB 3.3Å; A56-L59 PolarHBondContact O-N 3.3Å; M57-L59 PolarHBondContact O-N 2.78Å; L59-R61 PolarHBondContact O-N 3.25Å; L59-Q62 HydrophobicContact CB-CG 4.24Å; L59-Q62 HydrophobicContact CD2-CG 4.33Å; L59-Q62 WeakPolarHBondContact O-CB 3.41Å; L59-Q62 WeakPolarHBondContact O-CG 3.29Å; L59-Q62 PolarHBondContact O-N 3.25Å; L59-L71 HydrophobicContact CB-CD1 4.28Å
60	D	93	Very high	91.8	Very high	50 Å²	50	66.4 Å²	66.4	27%	0.267	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	136.7	173.2	-176.5	45	0	0	0	111	M57 L58 Q62 R70 L71	M57-D60 PolarHBondContact O-N 3.4Å; L58-D60 VanDerWaalsContact C-N 3.34Å; D60-Q62 PolarHBondContact O-N 3.05Å; D60-R70 VanDerWaalsContact OD1-CA 3.31Å; D60-R70 WeakPolarHBondContact OD1-CA 3.36Å; D60-L71 HydrophobicContact CB-CB 4.31Å; D60-L71 HydrophobicContact CB-CG 4.47Å; D60-L71 PolarHBondContact OD1-N 3.47Å
61	R	91.5	Very high	92	Very high	158 Å²	158	61.3 Å²	61.3	60%	0.596	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	4.1	-178.9	-39.2	-177	-172.8	-163.8	1.3	116.1	L59 V69	L59-R61 PolarHBondContact O-N 3.25Å; R61-V69 WeakPolarHBondContact CA-O 3.37Å; R61-V69 PolarHBondContact N-O 3.29Å
62	Q	91.8	Very high	92.1	Very high	103 Å²	103	61.6 Å²	61.6	48%	0.481	31%	0.305	S	S	.	.			trans	-67	163.3	166.5	-63.8	-69	-7.9	0	0	110.6	F22 L59 D60 V69	F22-Q62 HydrophobicContact CE2-CB 3.44Å; F22-Q62 VanDerWaalsContact CE2-CB 3.44Å; F22-Q62 HydrophobicContact CZ-CB 3.64Å; L59-Q62 HydrophobicContact CB-CG 4.24Å; L59-Q62 HydrophobicContact CD2-CG 4.33Å; L59-Q62 WeakPolarHBondContact O-CB 3.41Å; L59-Q62 WeakPolarHBondContact O-CG 3.29Å; L59-Q62 PolarHBondContact O-N 3.25Å; D60-Q62 PolarHBondContact O-N 3.05Å; Q62-V69 PolarHBondContact O-N 3.34Å
63	T	90.1	Very high	92.1	Very high	74 Å²	74	66.3 Å²	66.3	45%	0.454	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	136.1	-172.2	54.4	0	0	0	0	113.8	A67	T63-A67 CarbonylContact C-O 3.38Å; T63-A67 VanDerWaalsContact CA-O 3.24Å; T63-A67 WeakPolarHBondContact CA-O 3.39Å
64	I	90.8	Very high	92	Very high	6 Å²	6	66.8 Å²	66.8	3%	0.031	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.8	163.7	-63.4	-178.9	0	0	0	107.2	L7 L10 P11 A14 N18 I19 F22 G66 A67 V69	L7-I64 HydrophobicContact CD2-CD1 4.32Å; L10-I64 HydrophobicContact CD1-CD1 4.02Å; P11-I64 WeakPolarHBondContact CG-O 3.26Å; A14-I64 HydrophobicContact CB-CG2 3.85Å; N18-I64 HydrophobicContact CB-CG2 4Å; I19-I64 HydrophobicContact CG1-CD1 4.44Å; F22-I64 HydrophobicContact CB-CD1 3.72Å; F22-I64 HydrophobicContact CB-CG1 3.85Å; F22-I64 HydrophobicContact CD1-CD1 4Å; F22-I64 HydrophobicContact CD1-CG1 4.37Å; F22-I64 HydrophobicContact CD2-CD1 3.83Å; F22-I64 HydrophobicContact CD2-CG1 3.27Å; F22-I64 HydrophobicContact CE1-CD1 4.5Å; F22-I64 HydrophobicContact CE2-CD1 4.31Å; F22-I64 HydrophobicContact CE2-CG1 3.73Å; F22-I64 HydrophobicContact CG-CD1 3.61Å; F22-I64 HydrophobicContact CG-CG1 3.61Å; F22-I64 HydrophobicContact CZ-CG1 4.44Å; I64-G66 PolarHBondContact O-N 3.2Å; I64-A67 PolarHBondContact N-O 3.45Å; I64-A67 PolarHBondContact O-N 2.98Å; I64-V69 HydrophobicContact CB-CG2 3.71Å; I64-V69 HydrophobicContact CD1-CG2 3.9Å; I64-V69 HydrophobicContact CG1-CG2 3.62Å
65	N	86.9	Confident	91.9	Very high	84 Å²	84	62.3 Å²	62.3	45%	0.449	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	33.3	-178.3	-59.4	0.6	0	0	0	114.1	P11 S13 N18	P11-N65 HydrophobicContact CG-CB 3.98Å; S13-N65 PolarHBondContact O-ND2 3.19Å; S13-N65 VanDerWaalsContact O-ND2 3.07Å; S13-N65 PolarHBondContact OG-ND2 3.08Å; S13-N65 VanDerWaalsContact OG-ND2 3.09Å; N18-N65 PolarHBondContact ND2-ND2 3.22Å; N18-N65 PolarHBondContact ND2-OD1 2.58Å
66	G	81.4	Confident	91.7	Very high	43 Å²	43	64.7 Å²	64.7	44%	0.443	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	-11.5	-178.8	0	0	0	0	0	115.9	I64 Y868	I64-G66 PolarHBondContact O-N 3.2Å; G66-Y868 PolarHBondContact O-OH 2.81Å
67	A	86.5	Confident	91.5	Very high	29 Å²	29	67.8 Å²	67.8	24%	0.24	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	134.2	174.8	0	0	0	0	0	111.3	P11 T63 I64 V69	P11-A67 HydrophobicContact CB-CB 3.96Å; P11-A67 HydrophobicContact CG-CB 3.85Å; T63-A67 CarbonylContact C-O 3.38Å; T63-A67 VanDerWaalsContact CA-O 3.24Å; T63-A67 WeakPolarHBondContact CA-O 3.39Å; I64-A67 PolarHBondContact N-O 3.45Å; I64-A67 PolarHBondContact O-N 2.98Å; A67-V69 WeakPolarHBondContact O-CG2 3.36Å; A67-V69 PolarHBondContact O-N 3.18Å
68	S	90.9	Very high	91.3	Very high	42 Å²	42	68.1 Å²	68.1	29%	0.294	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	112.4	176.7	-61.2	0	0	0	0	111.3	N9	N9-S68 WeakPolarHBondContact CB-O 3.31Å
69	V	92.9	Very high	91.2	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.333	C	S	.	.			trans	-91.4	136.2	-173.7	-158.2	0	0	0	0	109.8	L7 Q8 L10 R61 Q62 I64 A67	L7-V69 HydrophobicContact CB-CG1 3.9Å; L7-V69 HydrophobicContact CD2-CG1 4.18Å; L7-V69 HydrophobicContact CG-CG1 4.28Å; Q8-V69 CarbonylContact O-C 3.6Å; Q8-V69 WeakPolarHBondContact O-CA 3.41Å; Q8-V69 WeakPolarHBondContact O-CG1 3.08Å; L10-V69 HydrophobicContact CD1-CG1 4.31Å; R61-V69 WeakPolarHBondContact CA-O 3.37Å; R61-V69 PolarHBondContact N-O 3.29Å; Q62-V69 PolarHBondContact O-N 3.34Å; I64-V69 HydrophobicContact CB-CG2 3.71Å; I64-V69 HydrophobicContact CD1-CG2 3.9Å; I64-V69 HydrophobicContact CG1-CG2 3.62Å; A67-V69 WeakPolarHBondContact O-CG2 3.36Å; A67-V69 PolarHBondContact O-N 3.18Å
70	R	94.8	Very high	91.2	Very high	99 Å²	99	64.5 Å²	64.5	37%	0.374	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	142.1	172.1	-69.1	-157.4	-171.2	-160.1	9.7	111.7	L7 Q8 D60 F72	L7-R70 CarbonylContact C-O 3.6Å; L7-R70 VanDerWaalsContact CA-O 3.3Å; L7-R70 WeakPolarHBondContact CA-O 3.5Å; Q8-R70 HydrophobicContact CB-CB 4.43Å; Q8-R70 PolarHBondContact N-O 3.47Å; Q8-R70 PolarHBondContact O-N 2.88Å; D60-R70 VanDerWaalsContact OD1-CA 3.31Å; D60-R70 WeakPolarHBondContact OD1-CA 3.36Å; R70-F72 HydrophobicContact CB-CD2 4.38Å; R70-F72 HydrophobicContact CB-CE2 3.57Å; R70-F72 HydrophobicContact CB-CZ 4.07Å
71	L	95.6	Very high	91.1	Very high	5 Å²	5	65.7 Å²	65.7	3%	0.026	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.6	-179.7	-54.7	-175.9	0	0	0	111	I5 R6 L7 F22 F23 A56 M57 L59 D60	I5-L71 HydrophobicContact CG2-CB 4Å; I5-L71 HydrophobicContact CG2-CD2 4.22Å; R6-L71 WeakPolarHBondContact O-CA 3.36Å; L7-L71 HydrophobicContact CB-CD2 4.46Å; L7-L71 HydrophobicContact CD1-CD2 4.45Å; L7-L71 HydrophobicContact CG-CD2 3.74Å; F22-L71 HydrophobicContact CE1-CD1 4.4Å; F23-L71 HydrophobicContact CE1-CD1 3.85Å; F23-L71 HydrophobicContact CZ-CD1 3.9Å; F23-L71 HydrophobicContact CZ-CD2 3.82Å; A56-L71 WeakPolarHBondContact O-CD1 3.46Å; M57-L71 HydrophobicContact CE-CB 4.43Å; M57-L71 WeakPolarHBondContact CE-O 3.37Å; M57-L71 HydrophobicContact SD-CB 3.98Å; L59-L71 HydrophobicContact CB-CD1 4.28Å; D60-L71 HydrophobicContact CB-CB 4.31Å; D60-L71 HydrophobicContact CB-CG 4.47Å; D60-L71 PolarHBondContact OD1-N 3.47Å
72	F	95.2	Very high	91	Very high	83 Å²	83	59.7 Å²	59.7	36%	0.364	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	138.9	177.9	-58.8	-89.1	0	0	0	110.5	I5 R6 Q8 R70 S74	I5-F72 CarbonylContact C-O 3.6Å; I5-F72 VanDerWaalsContact CA-O 3.26Å; I5-F72 WeakPolarHBondContact CA-O 3.42Å; R6-F72 HydrophobicContact CB-CB 4.45Å; R6-F72 PolarHBondContact N-O 2.74Å; R6-F72 PolarHBondContact O-N 3.31Å; Q8-F72 HydrophobicContact CB-CE2 4.32Å; Q8-F72 HydrophobicContact CG-CD2 3.98Å; Q8-F72 HydrophobicContact CG-CE2 3.77Å; Q8-F72 VanDerWaalsContact OE1-CE2 3.25Å; R70-F72 HydrophobicContact CB-CD2 4.38Å; R70-F72 HydrophobicContact CB-CE2 3.57Å; R70-F72 HydrophobicContact CB-CZ 4.07Å; F72-S74 PolarHBondContact O-N 2.86Å
73	L	93.8	Very high	90.9	Very high	117 Å²	117	56.1 Å²	56.1	61%	0.613	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	125	166.7	-72.8	169.4	0	0	0	109	V3 I5 M57	V3-L73 HydrophobicContact CG1-CD2 3.92Å; I5-L73 HydrophobicContact CG1-CD2 4.12Å; M57-L73 HydrophobicContact SD-CG 4.36Å
74	S	93	Very high	90.8	Very high	14 Å²	14	58.2 Å²	58.2	10%	0.098	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	145.9	-177.5	173.2	0	0	0	0	110.3	I4 F44 F72 E78	I4-S74 PolarHBondContact O-N 3.21Å; F44-S74 WeakPolarHBondContact CE1-OG 3.39Å; F72-S74 PolarHBondContact O-N 2.86Å; S74-E78 PolarHBondContact OG-OE2 3.45Å
75	S	92.5	Very high	90.6	Very high	61 Å²	61	61 Å²	61	43%	0.427	34%	0.341	S	S	.	.			trans	-78.7	160.2	167.5	73.7	0	0	0	0	111.2	A77 E78 M79	S75-A77 VanDerWaalsContact C-N 3.25Å; S75-A77 PolarHBondContact O-N 3.33Å; S75-E78 PolarHBondContact O-N 2.92Å; S75-E78 VanDerWaalsContact OG-CB 3.28Å; S75-E78 WeakPolarHBondContact OG-CB 3.38Å; S75-E78 PolarHBondContact OG-N 2.78Å; S75-M79 PolarHBondContact O-N 3.02Å; S75-M79 VanDerWaalsContact O-N 3.13Å
76	K	89.2	Confident	90.4	Very high	142 Å²	142	58.5 Å²	58.5	62%	0.617	33%	0.332	S	S	*	.	H	α-helix	trans	-62	-34.7	171.5	-172.9	176.2	179	179	0	112.2	I4 Q80	I4-K76 HydrophobicContact CD1-CB 3.73Å; I4-K76 HydrophobicContact CD1-CG 4.12Å; K76-Q80 VanDerWaalsContact O-CG 3.29Å; K76-Q80 WeakPolarHBondContact O-CG 3.43Å; K76-Q80 PolarHBondContact O-N 2.8Å; K76-Q80 PolarHBondContact O-OE1 2.93Å
77	A	90.6	Very high	90.4	Very high	65 Å²	65	62.9 Å²	62.9	54%	0.537	34%	0.339	S	S	.	.	H	α-helix	trans	-70.4	-39.6	178.3	0	0	0	0	0	112.3	S75 Q80 S81	S75-A77 VanDerWaalsContact C-N 3.25Å; S75-A77 PolarHBondContact O-N 3.33Å; A77-Q80 PolarHBondContact O-N 2.87Å; A77-S81 WeakPolarHBondContact O-CB 3.14Å; A77-S81 PolarHBondContact O-N 2.98Å
78	E	91.1	Very high	90	Very high	66 Å²	66	64.8 Å²	64.8	31%	0.308	35%	0.347	S	S	.	.	H	α-helix	trans	-61.8	-49.5	174.1	174.1	179.3	-175.8	0	0	111.3	R6 S74 S75 Q80 S81 I82	R6-E78 IonicContact NH1-OE1 2.72Å; R6-E78 PolarHBondContact NH1-OE1 3.5Å; S74-E78 PolarHBondContact OG-OE2 3.45Å; S75-E78 PolarHBondContact O-N 2.92Å; S75-E78 VanDerWaalsContact OG-CB 3.28Å; S75-E78 WeakPolarHBondContact OG-CB 3.38Å; S75-E78 PolarHBondContact OG-N 2.78Å; E78-Q80 VanDerWaalsContact C-N 3.32Å; E78-Q80 PolarHBondContact O-N 2.85Å; E78-S81 PolarHBondContact O-N 3.39Å; E78-I82 HydrophobicContact CG-CD1 3.72Å; E78-I82 WeakPolarHBondContact O-CG1 3.48Å; E78-I82 PolarHBondContact O-N 2.67Å
79	M	92.7	Very high	89.3	Confident	18 Å²	18	65.8 Å²	65.8	9%	0.089	35%	0.354	C	S	.	.	H	α-helix	trans	-54.1	-47.5	174.7	172.7	-174.7	175.4	0	0	111.9	I4 H34 F44 S75 I83	I4-M79 HydrophobicContact CD1-SD 3.88Å; I4-M79 HydrophobicContact CG1-SD 4.4Å; I4-M79 HydrophobicContact CG2-CB 4.38Å; I4-M79 HydrophobicContact CG2-SD 3.82Å; H34-M79 HydrophobicContact CB-CE 3.91Å; H34-M79 VanDerWaalsContact CE1-CE 3.42Å; H34-M79 WeakPolarHBondContact CE1-CE 3.49Å; H34-M79 WeakPolarHBondContact ND1-CE 3.44Å; F44-M79 HydrophobicContact CB-CE 4.14Å; F44-M79 HydrophobicContact CB-CG 3.93Å; F44-M79 HydrophobicContact CB-SD 4.05Å; F44-M79 HydrophobicContact CD1-CB 3.69Å; F44-M79 HydrophobicContact CD1-CG 3.83Å; F44-M79 HydrophobicContact CD2-CG 4.07Å; F44-M79 HydrophobicContact CE1-CB 3.9Å; F44-M79 HydrophobicContact CE1-CG 4.38Å; F44-M79 HydrophobicContact CG-CB 4.07Å; F44-M79 HydrophobicContact CG-CG 3.65Å; F44-M79 HydrophobicContact CG-SD 4.4Å; F44-M79 HydrophobicContact CZ-CB 4.45Å; S75-M79 PolarHBondContact O-N 3.02Å; S75-M79 VanDerWaalsContact O-N 3.13Å; M79-I83 HydrophobicContact CE-CD1 3.88Å; M79-I83 HydrophobicContact CG-CD1 3.74Å; M79-I83 WeakPolarHBondContact O-CB 3.23Å; M79-I83 WeakPolarHBondContact O-CD1 3.08Å; M79-I83 WeakPolarHBondContact O-CG1 3.42Å; M79-I83 PolarHBondContact O-N 3.15Å
80	Q	91.9	Very high	88	Confident	95 Å²	95	68.9 Å²	68.9	44%	0.444	38%	0.38	S	S	.	.	H	α-helix	trans	-63	-48.1	177.6	-74.5	175.3	-47.1	0	0	111.9	K76 A77 E78 I82 I83 E84	K76-Q80 VanDerWaalsContact O-CG 3.29Å; K76-Q80 WeakPolarHBondContact O-CG 3.43Å; K76-Q80 PolarHBondContact O-N 2.8Å; K76-Q80 PolarHBondContact O-OE1 2.93Å; A77-Q80 PolarHBondContact O-N 2.87Å; E78-Q80 VanDerWaalsContact C-N 3.32Å; E78-Q80 PolarHBondContact O-N 2.85Å; Q80-I82 VanDerWaalsContact C-N 3.33Å; Q80-I82 PolarHBondContact O-N 3.35Å; Q80-I83 PolarHBondContact O-N 3.1Å; Q80-E84 WeakPolarHBondContact O-CB 3.27Å; Q80-E84 VanDerWaalsContact O-CG 3.31Å; Q80-E84 WeakPolarHBondContact O-CG 3.32Å; Q80-E84 PolarHBondContact O-N 3.09Å
81	S	90.9	Very high	86.1	Confident	75 Å²	75	70 Å²	70	52%	0.524	39%	0.393	S	S	.	.	H	α-helix	trans	-59.2	-40.6	179.9	178.8	0	0	0	0	112.9	A77 E78 E84 S85	A77-S81 WeakPolarHBondContact O-CB 3.14Å; A77-S81 PolarHBondContact O-N 2.98Å; E78-S81 PolarHBondContact O-N 3.39Å; S81-E84 PolarHBondContact O-N 3.29Å; S81-S85 WeakPolarHBondContact O-CB 3.45Å; S81-S85 PolarHBondContact O-N 2.82Å
82	I	89.2	Confident	84.1	Confident	33 Å²	33	78.4 Å²	78.4	17%	0.169	43%	0.43	C	S	.	.	H	α-helix	trans	-73.6	-40.9	179.6	-70.3	165.1	0	0	0	111.3	R6 V36 F44 E78 Q80 E84 S85 A86	R6-I82 VanDerWaalsContact CZ-CD1 3.5Å; V36-I82 HydrophobicContact CG1-CG2 4.13Å; F44-I82 HydrophobicContact CE2-CB 4.13Å; F44-I82 HydrophobicContact CE2-CG2 3.8Å; F44-I82 HydrophobicContact CZ-CB 3.95Å; F44-I82 HydrophobicContact CZ-CD1 3.78Å; F44-I82 HydrophobicContact CZ-CG1 4.47Å; F44-I82 HydrophobicContact CZ-CG2 3.92Å; E78-I82 HydrophobicContact CG-CD1 3.72Å; E78-I82 WeakPolarHBondContact O-CG1 3.48Å; E78-I82 PolarHBondContact O-N 2.67Å; Q80-I82 VanDerWaalsContact C-N 3.33Å; Q80-I82 PolarHBondContact O-N 3.35Å; I82-E84 VanDerWaalsContact C-N 3.31Å; I82-E84 PolarHBondContact O-N 2.92Å; I82-S85 PolarHBondContact O-N 3.45Å; I82-A86 WeakPolarHBondContact O-CB 3.23Å; I82-A86 PolarHBondContact O-N 3.01Å
83	I	89	Confident	81.9	Confident	27 Å²	27	79.3 Å²	79.3	14%	0.138	45%	0.446	C	S	.	.	H	α-helix	trans	-60.9	-40.4	172.9	-70.5	166.3	0	0	0	111.2	H34 V36 M79 Q80 K87	H34-I83 HydrophobicContact CB-CD1 4.06Å; V36-I83 HydrophobicContact CG2-CG1 3.61Å; M79-I83 HydrophobicContact CE-CD1 3.88Å; M79-I83 HydrophobicContact CG-CD1 3.74Å; M79-I83 WeakPolarHBondContact O-CB 3.23Å; M79-I83 WeakPolarHBondContact O-CD1 3.08Å; M79-I83 WeakPolarHBondContact O-CG1 3.42Å; M79-I83 PolarHBondContact O-N 3.15Å; Q80-I83 PolarHBondContact O-N 3.1Å; I83-K87 HydrophobicContact CG2-CD 4.17Å; I83-K87 WeakPolarHBondContact O-CD 3.28Å; I83-K87 VanDerWaalsContact O-CG 3.26Å; I83-K87 WeakPolarHBondContact O-CG 3.33Å; I83-K87 PolarHBondContact O-N 3.28Å
84	E	88.2	Confident	79.2	Confident	119 Å²	119	78 Å²	78	56%	0.556	45%	0.447	S	S	*	.	H	α-helix	trans	-68.7	-44.5	177.8	-74.6	167.7	-165	0	0	111.9	Q80 S81 I82 A86 K87 T88	Q80-E84 WeakPolarHBondContact O-CB 3.27Å; Q80-E84 VanDerWaalsContact O-CG 3.31Å; Q80-E84 WeakPolarHBondContact O-CG 3.32Å; Q80-E84 PolarHBondContact O-N 3.09Å; S81-E84 PolarHBondContact O-N 3.29Å; I82-E84 VanDerWaalsContact C-N 3.31Å; I82-E84 PolarHBondContact O-N 2.92Å; E84-A86 PolarHBondContact O-N 3.17Å; E84-K87 WeakPolarHBondContact O-CB 3.45Å; E84-K87 PolarHBondContact O-N 3.36Å; E84-T88 PolarHBondContact O-N 3.4Å; E84-T88 PolarHBondContact O-OG1 3.45Å
85	S	85.9	Confident	76.2	Confident	65 Å²	65	81.5 Å²	81.5	46%	0.455	49%	0.485	S	S	.	.	H	α-helix	trans	-62.2	-37.5	176.7	-173.3	0	0	0	0	113.4	S81 I82 T88 S89	S81-S85 WeakPolarHBondContact O-CB 3.45Å; S81-S85 PolarHBondContact O-N 2.82Å; I82-S85 PolarHBondContact O-N 3.45Å; S85-T88 PolarHBondContact O-OG1 2.74Å; S85-S89 WeakPolarHBondContact O-CB 3.45Å; S85-S89 PolarHBondContact O-N 3.24Å; S85-S89 PolarHBondContact O-OG 3.05Å
86	A	82.6	Confident	73.2	Confident	31 Å²	31	81.7 Å²	81.7	26%	0.256	50%	0.496	S	S	.	.	H	α-helix	trans	-69.7	-38.6	174.8	0	0	0	0	0	112.3	V36 I82 E84 S89 A90	V36-A86 HydrophobicContact CG1-CB 3.22Å; I82-A86 WeakPolarHBondContact O-CB 3.23Å; I82-A86 PolarHBondContact O-N 3.01Å; E84-A86 PolarHBondContact O-N 3.17Å; A86-S89 PolarHBondContact O-N 3.08Å; A86-A90 WeakPolarHBondContact O-CB 3.46Å; A86-A90 PolarHBondContact O-N 3.47Å
87	K	81.7	Confident	70.6	Confident	134 Å²	134	82.3 Å²	82.3	58%	0.583	51%	0.507	S	S	*	.	H	α-helix	trans	-63.1	-43	175	-75.3	168.9	-179.4	176.7	0	112	I83 E84 L91	I83-K87 HydrophobicContact CG2-CD 4.17Å; I83-K87 WeakPolarHBondContact O-CD 3.28Å; I83-K87 VanDerWaalsContact O-CG 3.26Å; I83-K87 WeakPolarHBondContact O-CG 3.33Å; I83-K87 PolarHBondContact O-N 3.28Å; E84-K87 WeakPolarHBondContact O-CB 3.45Å; E84-K87 PolarHBondContact O-N 3.36Å; K87-L91 WeakPolarHBondContact O-CG 3.36Å; K87-L91 PolarHBondContact O-N 2.82Å
88	T	79.1	Confident	67.7	Low	69 Å²	69	85.4 Å²	85.4	42%	0.423	52%	0.521	S	S	.	.	H	α-helix	trans	-66.7	-43.8	175.8	53.9	0	0	0	0	111.3	E84 S85 A90 L91 F92	E84-T88 PolarHBondContact O-N 3.4Å; E84-T88 PolarHBondContact O-OG1 3.45Å; S85-T88 PolarHBondContact O-OG1 2.74Å; T88-A90 VanDerWaalsContact C-N 3.32Å; T88-A90 PolarHBondContact O-N 2.67Å; T88-L91 WeakPolarHBondContact O-CB 3.44Å; T88-L91 PolarHBondContact O-N 3.08Å; T88-L91 VanDerWaalsContact O-N 3.11Å; T88-F92 WeakPolarHBondContact O-CD2 3.49Å; T88-F92 PolarHBondContact O-N 2.98Å; T88-F92 VanDerWaalsContact O-N 3.13Å
89	S	74.8	Confident	64.9	Low	63 Å²	63	88.7 Å²	88.7	44%	0.441	55%	0.545	S	S	.	.	H	α-helix	trans	-60.5	-38.9	177.7	-58.2	0	0	0	0	113	S85 A86 F92 S93	S85-S89 WeakPolarHBondContact O-CB 3.45Å; S85-S89 PolarHBondContact O-N 3.24Å; S85-S89 PolarHBondContact O-OG 3.05Å; A86-S89 PolarHBondContact O-N 3.08Å; S89-F92 PolarHBondContact O-N 3.08Å; S89-S93 PolarHBondContact O-N 2.85Å; S89-S93 PolarHBondContact O-OG 3.15Å
90	A	65.8	Low	62	Low	65 Å²	65	94.7 Å²	94.7	54%	0.537	58%	0.577	S	S	.	*	H	α-helix	trans	-66.6	-34.7	175.2	0	0	0	0	0	112.8	A86 T88	A86-A90 WeakPolarHBondContact O-CB 3.46Å; A86-A90 PolarHBondContact O-N 3.47Å; T88-A90 VanDerWaalsContact C-N 3.32Å; T88-A90 PolarHBondContact O-N 2.67Å
91	L	56.4	Low	59.3	Low	124 Å²	124	96 Å²	96	65%	0.649	60%	0.597	S	S	*	*	H	α-helix	trans	-67	-44.6	175.9	-71.8	165.3	0	0	0	111.4	K87 T88 S93 S94	K87-L91 WeakPolarHBondContact O-CG 3.36Å; K87-L91 PolarHBondContact O-N 2.82Å; T88-L91 WeakPolarHBondContact O-CB 3.44Å; T88-L91 PolarHBondContact O-N 3.08Å; T88-L91 VanDerWaalsContact O-N 3.11Å; L91-S93 VanDerWaalsContact C-N 3.27Å; L91-S93 PolarHBondContact O-N 2.74Å; L91-S94 PolarHBondContact O-N 3.33Å; L91-S94 PolarHBondContact O-OG 3.23Å
92	F	53	Low	56.4	Low	181 Å²	181	100.3 Å²	100.3	79%	0.794	61%	0.609	S	S	*	*	H	α-helix	trans	-73.2	-14.8	-179.8	-69.3	-66.2	0	0	0	114.6	T88 S89	T88-F92 WeakPolarHBondContact O-CD2 3.49Å; T88-F92 PolarHBondContact O-N 2.98Å; T88-F92 VanDerWaalsContact O-N 3.13Å; S89-F92 PolarHBondContact O-N 3.08Å
93	S	48.1	Very low	53.5	Low	102 Å²	102	104.7 Å²	104.7	71%	0.713	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-1.3	179.5	-54.6	0	0	0	0	114	S89 L91 G95	S89-S93 PolarHBondContact O-N 2.85Å; S89-S93 PolarHBondContact O-OG 3.15Å; L91-S93 VanDerWaalsContact C-N 3.27Å; L91-S93 PolarHBondContact O-N 2.74Å; S93-G95 PolarHBondContact O-N 2.76Å
94	S	36.6	Very low	50.8	Low	90 Å²	90	110.7 Å²	110.7	63%	0.629	67%	0.67	S	S	*	*			trans	-96.1	43.6	-173.4	58.7	0	0	0	0	114.5	L91 G96	L91-S94 PolarHBondContact O-N 3.33Å; L91-S94 PolarHBondContact O-OG 3.23Å; S94-G96 VanDerWaalsContact C-N 3.28Å; S94-G96 PolarHBondContact O-N 2.94Å; S94-G96 VanDerWaalsContact O-N 3.09Å
95	G	31.7	Very low	47.9	Very low	87 Å²	87	110.4 Å²	110.4	90%	0.897	68%	0.681	S	S	*	*			trans	-80.5	56.8	172.7	0	0	0	0	0	114.1	S93	S93-G95 PolarHBondContact O-N 2.76Å
96	G	29.4	Very low	45.5	Very low	64 Å²	64	116.2 Å²	116.2	66%	0.66	70%	0.701	S	S	*	*	S	Bend	trans	-174.7	107.7	179.5	0	0	0	0	0	115	S94	S94-G96 VanDerWaalsContact C-N 3.28Å; S94-G96 PolarHBondContact O-N 2.94Å; S94-G96 VanDerWaalsContact O-N 3.09Å
97	N	33.5	Very low	42.9	Very low	156 Å²	156	123.8 Å²	123.8	83%	0.834	73%	0.728	S	S	*	*			trans	42.2	107	166.6	-70.8	-14.7	0	0	0	119	V99	N97-V99 PolarHBondContact O-N 2.94Å
98	P	31.2	Very low	40.4	Very low	129 Å²	129	122.6 Å²	122.6	84%	0.838	73%	0.732	S	S	*	*			trans	-80.4	119.4	169.4	32.7	-30.9	0	0	0	111.3
99	V	32.5	Very low	38.2	Very low	136 Å²	136	127.6 Å²	127.6	82%	0.824	75%	0.751	S	S	*	*			trans	-116.3	133.4	159.8	176.9	0	0	0	0	108.4	N97	N97-V99 PolarHBondContact O-N 2.94Å
100	L	31.3	Very low	36.2	Very low	144 Å²	144	130.7 Å²	130.7	75%	0.754	77%	0.767	S	S	*	*			trans	-59.1	138.1	-167.8	-77.7	68.4	0	0	0	113.2
101	S	33.6	Very low	34.9	Very low	122 Å²	122	136.8 Å²	136.8	85%	0.853	79%	0.787	S	S	*	*			trans	-150.4	113.5	152	-75.1	0	0	0	0	108.7
102	Q	31.1	Very low	33.9	Very low	166 Å²	166	139.7 Å²	139.7	78%	0.776	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-81.4	149.2	-173.9	-65.3	173.9	-12.1	0	0	111.5	I104	Q102-I104 PolarHBondContact O-N 3.46Å
103	P	29.1	Very low	32.9	Very low	125 Å²	125	135.1 Å²	135.1	81%	0.812	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-74.7	120.6	169.5	30.8	-32	0	0	0	110.1	S105	P103-S105 PolarHBondContact O-N 2.93Å
104	I	30.9	Very low	32.5	Very low	152 Å²	152	138.8 Å²	138.8	78%	0.779	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-68.2	119.3	173.6	-67.1	174.2	0	0	0	108.9	Q102 Q106	Q102-I104 PolarHBondContact O-N 3.46Å; I104-Q106 HydrophobicContact CG2-CG 4.39Å
105	S	28.7	Very low	32.2	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-69.6	129.9	165.1	-71.4	0	0	0	0	109.9	P103	P103-S105 PolarHBondContact O-N 2.93Å
106	Q	34.9	Very low	32.6	Very low	188 Å²	188	144.1 Å²	144.1	88%	0.879	81%	0.809	S	S	*	*			trans	-116.7	111.3	156.8	-75	-172.7	-21.6	0	0	108.7	I104	I104-Q106 HydrophobicContact CG2-CG 4.39Å
107	K	27.1	Very low	33.1	Very low	189 Å²	189	147.2 Å²	147.2	82%	0.822	82%	0.815	S	S	*	*			trans	-116.1	166.3	168.7	-176	-178.6	175.5	-169.6	0	106.4
108	T	29.8	Very low	33.2	Very low	110 Å²	110	144.1 Å²	144.1	68%	0.675	81%	0.811	S	S	*	*			trans	73.3	142.4	175.1	14.1	0	0	0	0	112.8
109	E	32.6	Very low	33.7	Very low	173 Å²	173	143.4 Å²	143.4	81%	0.808	81%	0.806	S	S	*	*			cis	-149.2	166.5	20.2	-152	132.8	-122.2	0	0	113.7
110	T	33.9	Very low	34	Very low	128 Å²	128	142.9 Å²	142.9	79%	0.785	80%	0.803	S	S	*	*			trans	-79.7	150.9	-176.4	46.8	0	0	0	0	114.1
111	M	37.6	Very low	34.6	Very low	193 Å²	193	144.1 Å²	144.1	95%	0.951	81%	0.81	S	S	*	*			trans	-150.3	158.1	149.1	-94.7	-110.8	-78.7	0	0	112.3
112	H	36.2	Very low	34.7	Very low	185 Å²	185	143.6 Å²	143.6	86%	0.856	80%	0.804	S	S	*	*			trans	-87.2	152.1	-157.6	-94.9	-86.6	0	0	0	116.5
113	A	31.5	Very low	34.7	Very low	86 Å²	86	140.9 Å²	140.9	71%	0.711	80%	0.803	S	S	*	*			trans	51.7	134.1	138	0	0	0	0	0	121.6
114	L	40.1	Very low	35.2	Very low	179 Å²	179	140.5 Å²	140.5	94%	0.937	80%	0.803	S	S	*	*				-161	131.7	114.3	-98.8	176.3	0	0	0	110.2
115	D	29.7	Very low	35.2	Very low	154 Å²	154	143.1 Å²	143.1	82%	0.824	81%	0.81	S	S	*	*			trans	-79.9	140.6	178.4	-91.5	-60	0	0	0	112.9
116	V	40.2	Very low	35.8	Very low	135 Å²	135	142.8 Å²	142.8	82%	0.818	81%	0.805	S	S	*	*			trans	-145.6	91.2	150.1	-174.9	0	0	0	0	110.9
117	T	39.4	Very low	35.6	Very low	129 Å²	129	139.8 Å²	139.8	79%	0.791	80%	0.804	S	S	*	*			trans	32.9	126	146.7	46.9	0	0	0	0	122.5
118	A	36.2	Very low	36.1	Very low	90 Å²	90	141.5 Å²	141.5	74%	0.744	81%	0.807	S	S	*	*			trans	-83.4	-174.4	166.2	0	0	0	0	0	113.1
119	P	41.2	Very low	36.3	Very low	115 Å²	115	147.1 Å²	147.1	75%	0.747	82%	0.816	S	S	*	*				-148.9	145	79.6	39.1	-20.1	0	0	0	118.3
120	T	38	Very low	36.5	Very low	124 Å²	124	146.4 Å²	146.4	76%	0.761	82%	0.818	S	S	*	*			trans	31.9	136.1	144.6	56.7	0	0	0	0	123.4
121	L	44.2	Very low	36.9	Very low	170 Å²	170	144.1 Å²	144.1	89%	0.89	82%	0.82	S	S	*	*				-159.5	160	110.7	-93.4	-173.5	0	0	0	110.6
122	P	35.7	Very low	37	Very low	112 Å²	112	139.1 Å²	139.1	73%	0.727	81%	0.809	S	S	*	*			trans	-102.7	163.5	-151	38.9	-38.4	0	0	0	117.1
123	S	32	Very low	37.2	Very low	108 Å²	108	137.1 Å²	137.1	76%	0.755	81%	0.81	S	S	*	*			trans	-77.4	136.2	167.8	56.3	0	0	0	0	113.2
124	S	38.4	Very low	37.5	Very low	117 Å²	117	143.4 Å²	143.4	82%	0.818	82%	0.815	S	S	*	*			trans	-151.6	121.6	159	-84.8	0	0	0	0	111.4
125	F	32.6	Very low	37.4	Very low	208 Å²	208	141.6 Å²	141.6	91%	0.912	80%	0.802	S	S	*	*			trans	-83.3	139.2	168.8	-75.2	-97.3	0	0	0	110.5
126	P	40	Very low	37.7	Very low	106 Å²	106	138.6 Å²	138.6	69%	0.688	79%	0.793	S	S	*	*			trans	-102.2	113.8	163.5	13.5	5.7	0	0	0	111.5
127	S	32.3	Very low	37.6	Very low	124 Å²	124	140.6 Å²	140.6	87%	0.867	79%	0.791	S	S	*	*			trans	-81.7	125	158.2	-84.7	0	0	0	0	109.4
128	Y	37.7	Very low	37.6	Very low	226 Å²	226	141.3 Å²	141.3	89%	0.886	79%	0.79	S	S	*	*			trans	-84.8	118.8	172	-84.5	-87.8	0	0	0	111.6
129	R	32.4	Very low	37.8	Very low	227 Å²	227	143.7 Å²	143.7	86%	0.857	79%	0.791	S	S	*	*			trans	-150.7	120.9	157	-167.1	-175.3	-165.9	-172.2	4.4	109.2
130	N	37.9	Very low	37.7	Very low	159 Å²	159	142.1 Å²	142.1	85%	0.85	78%	0.782	S	S	*	*				-179.3	145.2	127.7	-93.8	-14.8	0	0	0	113.2
131	G	42.9	Very low	37.6	Very low	80 Å²	80	140.9 Å²	140.9	83%	0.825	78%	0.779	S	S	*	*			trans	-173.5	109.2	169.4	0	0	0	0	0	105
132	A	38.1	Very low	37.5	Very low	88 Å²	88	142.5 Å²	142.5	73%	0.727	78%	0.779	S	S	*	*			trans	-113.1	151.1	-160.8	0	0	0	0	0	112.6
133	T	41.6	Very low	37.2	Very low	143 Å²	143	144.8 Å²	144.8	88%	0.877	78%	0.779	S	S	*	*			trans	-170.4	97.4	134.2	24.4	0	0	0	0	112.4
134	R	36.9	Very low	37.4	Very low	217 Å²	217	150.2 Å²	150.2	82%	0.819	79%	0.785	S	S	*	*				46.1	142.3	126.7	-131.2	-179.3	128.3	129.6	-2.2	123.7
135	E	37.2	Very low	37.2	Very low	142 Å²	142	149.8 Å²	149.8	66%	0.664	78%	0.78	S	S	*	*			trans	83.1	131.5	159	-50.3	-161	166.2	0	0	118.5
136	S	36.8	Very low	36.9	Very low	90 Å²	90	150.6 Å²	150.6	63%	0.629	78%	0.778	S	S	*	*			cis	-170	167.6	-27.2	35.1	0	0	0	0	111
137	F	38.6	Very low	36.7	Very low	177 Å²	177	152.2 Å²	152.2	78%	0.776	79%	0.786	S	S	*	*			trans	91.7	107.1	168.1	-71.4	-83.5	0	0	0	121.3
138	D	40	Very low	36.5	Very low	144 Å²	144	155.7 Å²	155.7	77%	0.77	78%	0.782	S	S	*	*				47.1	147.5	120.7	-55.8	-6	0	0	0	121.4
139	D	38.4	Very low	36.4	Very low	141 Å²	141	150.8 Å²	150.8	75%	0.754	78%	0.78	S	S	*	*			cis	-152.9	160.3	12.9	-165.7	10.4	0	0	0	113.8
140	S	39.7	Very low	36.5	Very low	82 Å²	82	148.9 Å²	148.9	57%	0.573	78%	0.778	S	S	*	*			trans	59.7	93.4	144.3	-82.8	0	0	0	0	124.2
141	S	36.8	Very low	36.3	Very low	98 Å²	98	144.8 Å²	144.8	69%	0.685	77%	0.774	S	S	*	*				56.2	122	103.7	76.5	0	0	0	0	122.4
142	K	41.6	Very low	36	Very low	204 Å²	204	148 Å²	148	89%	0.887	78%	0.777	S	S	*	*				-169.6	122.4	115.1	-100.7	159.1	-171.4	173.4	0	113.6
143	Q	30.1	Very low	35.7	Very low	160 Å²	160	149.6 Å²	149.6	75%	0.748	78%	0.778	S	S	*	*			trans	-76.3	166.4	167.3	-92	159.3	-50.5	0	0	110.3
144	Y	34.4	Very low	35.6	Very low	221 Å²	221	150.5 Å²	150.5	87%	0.867	78%	0.776	S	S	*	*				-153.3	162.9	59.5	-77.6	-83.6	0	0	0	114.9
145	P	34.7	Very low	35.6	Very low	109 Å²	109	146.8 Å²	146.8	71%	0.708	77%	0.773	S	S	*	*			trans	-104.9	170.5	-166.5	40.6	-35	0	0	0	115.6
146	Y	27	Very low	35.9	Very low	224 Å²	224	145.6 Å²	145.6	88%	0.878	78%	0.777	S	S	*	*			trans	-64.9	148.1	169	-79.1	-101.4	0	0	0	113.6
147	T	34.8	Very low	36.6	Very low	141 Å²	141	147.2 Å²	147.2	87%	0.865	79%	0.786	S	S	*	*			trans	-133.2	144.2	144.6	52.1	0	0	0	0	110.2
148	Y	29.5	Very low	36.3	Very low	197 Å²	197	151.1 Å²	151.1	77%	0.773	80%	0.795	S	S	*	*			trans	-132.4	122.8	-175.9	-179.2	-82.8	0	0	0	108.2	K150	Y148-K150 HydrophobicContact CE1-CG 4.14Å
149	S	35.7	Very low	36	Very low	122 Å²	122	147.3 Å²	147.3	85%	0.853	79%	0.791	S	S	*	*			trans	-132	126.9	175.8	-72.4	0	0	0	0	110.8
150	K	34.1	Very low	35.8	Very low	187 Å²	187	149 Å²	149	81%	0.813	79%	0.794	S	S	*	*			trans	-73.6	134.1	-178.5	-90.8	172.8	168.1	175.1	0	112.1	Y148	Y148-K150 HydrophobicContact CE1-CG 4.14Å
151	G	33	Very low	35.6	Very low	73 Å²	73	151 Å²	151	75%	0.753	80%	0.797	S	S	*	*				69.6	139	124.5	0	0	0	0	0	120
152	V	37	Very low	35.6	Very low	148 Å²	148	154.2 Å²	154.2	90%	0.897	80%	0.801	S	S	*	*				-159.7	144	123.6	142.2	0	0	0	0	108.2
153	T	32.1	Very low	35.2	Very low	122 Å²	122	149.7 Å²	149.7	75%	0.748	80%	0.795	S	S	*	*			trans	-68.1	150.6	-179.8	-48.2	0	0	0	0	113.1
154	L	39.4	Very low	35.5	Very low	161 Å²	161	146.7 Å²	146.7	84%	0.843	80%	0.798	S	S	*	*			trans	-170	164.2	140.7	-101.8	156.7	0	0	0	112.1
155	D	37.3	Very low	35.5	Very low	139 Å²	139	140.7 Å²	140.7	74%	0.743	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-75.7	163.8	-155.1	-71.7	-75.9	0	0	0	119.1
156	P	42.3	Very low	35.5	Very low	117 Å²	117	146.4 Å²	146.4	76%	0.76	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-91.9	150.7	172.6	36.8	-33.9	0	0	0	113.4
157	P	52	Low	36	Very low	125 Å²	125	142.6 Å²	142.6	81%	0.812	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-100.6	128.9	163.5	33.1	-26.4	0	0	0	112.5
158	R	32.4	Very low	36.1	Very low	258 Å²	258	143.4 Å²	143.4	97%	0.974	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-67.9	152	155.3	-80	171.1	158.4	171.3	-7.1	109.4
159	G	33.5	Very low	36.6	Very low	65 Å²	65	138.8 Å²	138.8	67%	0.67	79%	0.789	S	S	*	*			trans	147.1	115.8	137.6	0	0	0	0	0	118.3
160	Q	35.3	Very low	36.5	Very low	175 Å²	175	138.7 Å²	138.7	82%	0.818	78%	0.779	S	S	*	*			trans	80.6	118.5	133.7	-64.7	-174.4	3.2	0	0	118.4
161	I	34.8	Very low	36.6	Very low	126 Å²	126	136.7 Å²	136.7	65%	0.646	77%	0.77	S	S	*	*				83.9	126.9	101.9	-68	172.2	0	0	0	109
162	E	35.7	Very low	36.7	Very low	165 Å²	165	142.7 Å²	142.7	77%	0.771	77%	0.772	S	S	*	*			cis	-159.2	136.3	42.4	-129.3	136.2	-141.4	0	0	106.7
163	S	34.6	Very low	37	Very low	109 Å²	109	140.1 Å²	140.1	76%	0.762	76%	0.758	S	S	*	*				98.6	155.4	77.3	-71.5	0	0	0	0	115.7
164	A	36.5	Very low	37.2	Very low	97 Å²	97	141.8 Å²	141.8	80%	0.802	76%	0.757	S	S	*	*			trans	69.9	104.8	176.6	0	0	0	0	0	116.6
165	A	32.7	Very low	37.1	Very low	94 Å²	94	141.4 Å²	141.4	78%	0.777	76%	0.756	S	S	*	*			cis	87.6	114.6	38.1	0	0	0	0	0	115.9
166	R	36.4	Very low	37.2	Very low	230 Å²	230	142.4 Å²	142.4	87%	0.868	76%	0.761	S	S	*	*			trans	169.9	118	142.8	-92.3	156.8	-175	-166.7	1.3	108.1
167	N	36	Very low	37.2	Very low	144 Å²	144	142.5 Å²	142.5	77%	0.77	76%	0.761	S	S	*	*				58.2	116.8	84.9	-56.9	-2.2	0	0	0	110.6
168	N	36.7	Very low	37.2	Very low	157 Å²	157	141.5 Å²	141.5	84%	0.84	76%	0.755	S	S	*	*				-167	174.9	57.6	-128.2	17	0	0	0	112.4
169	P	41.1	Very low	37.5	Very low	100 Å²	100	135.2 Å²	135.2	65%	0.649	74%	0.741	S	S	*	*			trans	-105.7	-162.2	-175	43	-36.1	0	0	0	114.2
170	D	34.1	Very low	37.9	Very low	120 Å²	120	142 Å²	142	64%	0.642	75%	0.746	S	S	*	*			trans	88.9	122.2	156	-90.3	12.3	0	0	0	121.8
171	K	35.9	Very low	38.4	Very low	145 Å²	145	138.2 Å²	138.2	63%	0.63	74%	0.737	S	S	*	*				87.9	140.4	129.4	-77.8	172.1	171.3	119.6	0	124.2
172	Y	35.1	Very low	38.6	Very low	199 Å²	199	138.7 Å²	138.7	78%	0.78	74%	0.736	S	S	*	*			trans	103	147.2	142.6	-72.2	-37.3	0	0	0	121.5
173	P	43.6	Very low	38.6	Very low	94 Å²	94	139 Å²	139	61%	0.61	74%	0.735	S	S	*	*				-140.5	-163.4	-122.9	47.8	-29.4	0	0	0	116.1
174	E	35.4	Very low	38.8	Very low	158 Å²	158	139.2 Å²	139.2	74%	0.738	73%	0.728	S	S	*	*			trans	32.3	130.2	150.5	-68.7	171.8	124.3	0	0	121.4
175	N	37.1	Very low	38.9	Very low	153 Å²	153	141.7 Å²	141.7	82%	0.818	72%	0.722	S	S	*	*				-177.1	156.8	98.3	-96.5	-71.7	0	0	0	114.7
176	L	40.7	Very low	39.3	Very low	160 Å²	160	142.5 Å²	142.5	84%	0.838	71%	0.714	S	S	*	*			trans	-82.2	-172	-177.8	-80.2	157.1	0	0	0	112.1
177	P	40.7	Very low	39.3	Very low	119 Å²	119	141.8 Å²	141.8	77%	0.773	71%	0.711	S	S	*	*			cis	-150.4	-146.5	29.4	43.4	-15.4	0	0	0	116.5
178	P	52.5	Low	39.3	Very low	103 Å²	103	141.9 Å²	141.9	67%	0.669	71%	0.712	S	S	*	*				-137.8	-160.2	-102.7	44.8	-23	0	0	0	117.8
179	D	38.8	Very low	39.2	Very low	127 Å²	127	145.8 Å²	145.8	68%	0.679	72%	0.716	S	S	*	*			trans	108.6	97.8	151.7	-73.8	-36.8	0	0	0	124.2
180	R	41.9	Very low	38.9	Very low	206 Å²	206	146 Å²	146	78%	0.777	72%	0.72	S	S	*	*				61.6	160.5	114.2	-77	-167.4	-178.8	-139.5	2.2	123.6
181	P	45.2	Very low	38.9	Very low	97 Å²	97	150.1 Å²	150.1	63%	0.63	73%	0.728	S	S	*	*			cis	-152.6	178.6	-31	44.2	-25.3	0	0	0	120
182	H	40.4	Very low	38.7	Very low	135 Å²	135	150.4 Å²	150.4	63%	0.625	74%	0.737	S	S	*	*			trans	58.8	126.8	144.9	-59.7	-55.3	0	0	0	126.4
183	F	36	Very low	38.7	Very low	173 Å²	173	148 Å²	148	76%	0.759	74%	0.737	S	S	*	*				167.8	110.5	98.7	-105	-92.4	0	0	0	109
184	N	38.1	Very low	38.1	Very low	113 Å²	113	152 Å²	152	60%	0.604	75%	0.748	S	S	*	*				70.1	144.1	95.8	-75.3	13.8	0	0	0	114.8
185	Q	39.2	Very low	38.2	Very low	148 Å²	148	150 Å²	150	69%	0.692	75%	0.749	S	S	*	*			cis	-161.9	177.1	9.5	-130.3	170.3	-86.2	0	0	108
186	D	39.6	Very low	37.9	Very low	112 Å²	112	148 Å²	148	60%	0.599	74%	0.738	S	S	*	*			cis	-160.7	170.4	7.2	-161.7	6	0	0	0	110.9
187	R	38.2	Very low	37.6	Very low	215 Å²	215	148.2 Å²	148.2	81%	0.811	74%	0.737	S	S	*	*			trans	79.7	83.3	155.6	-57.4	-161.6	179.6	-170.2	-2.5	123.3
188	D	34.6	Very low	37.1	Very low	146 Å²	146	150 Å²	150	78%	0.781	73%	0.734	S	S	*	*			trans	-74.2	164	148.3	-64.7	-69.5	0	0	0	113.8
189	Y	35	Very low	36.3	Very low	238 Å²	238	150 Å²	150	93%	0.933	74%	0.737	S	S	*	*			trans	-144.1	117.2	132.8	-98	-72.3	0	0	0	110.3
190	S	33.9	Very low	36.1	Very low	106 Å²	106	152.9 Å²	152.9	74%	0.741	74%	0.738	S	S	*	*			trans	-147.5	136.2	169.3	-175.2	0	0	0	0	107.8
191	Y	34.3	Very low	35.9	Very low	205 Å²	205	150.9 Å²	150.9	80%	0.804	73%	0.732	S	S	*	*			trans	-152.9	118.4	172.7	-129.8	-86.6	0	0	0	112
192	N	32.6	Very low	35.4	Very low	152 Å²	152	152.5 Å²	152.5	81%	0.813	74%	0.735	S	S	*	*			trans	-75.1	134.5	162.3	-85.4	-40.2	0	0	0	109.2
193	N	34.6	Very low	35.4	Very low	148 Å²	148	153.9 Å²	153.9	79%	0.791	74%	0.742	S	S	*	*			trans	-160	125.1	155.4	-108.3	-13.9	0	0	0	112.1
194	Q	32.3	Very low	35.5	Very low	177 Å²	177	151.2 Å²	151.2	83%	0.827	73%	0.734	S	S	*	*			trans	-67.2	159.2	147.5	-75.7	-175.7	-17.4	0	0	108.2
195	P	36.2	Very low	35.2	Very low	117 Å²	117	156.1 Å²	156.1	76%	0.76	74%	0.744	S	S	*	*			cis	-152.8	170.5	45.1	42.4	-20.8	0	0	0	119.4
196	N	30.8	Very low	35.1	Very low	110 Å²	110	156 Å²	156	59%	0.588	75%	0.749	S	S	*	*			trans	40.7	108.4	138	-163.5	18.5	0	0	0	121.4	H198	N196-H198 PolarHBondContact OD1-CE1 2.85Å; N196-H198 PolarHBondContact OD1-ND1 2.81Å
197	M	35.2	Very low	34.9	Very low	165 Å²	165	159 Å²	159	81%	0.813	76%	0.756	S	S	*	*			trans	177.9	104.7	136.7	-87.6	-45.4	147.8	0	0	107.4
198	H	30.4	Very low	35	Very low	157 Å²	157	154.8 Å²	154.8	73%	0.727	76%	0.757	S	S	*	*				75.9	133.1	69.9	-83.8	92.7	0	0	0	117.1	N196	N196-H198 PolarHBondContact OD1-CE1 2.85Å; N196-H198 PolarHBondContact OD1-ND1 2.81Å
199	S	35.3	Very low	35.2	Very low	102 Å²	102	151.6 Å²	151.6	71%	0.713	74%	0.744	S	S	*	*			trans	72.1	140.6	174.9	-71.1	0	0	0	0	116.6
200	R	34.7	Very low	35.2	Very low	189 Å²	189	145.9 Å²	145.9	71%	0.713	73%	0.734	S	S	*	*			cis	-170.7	160.2	7.9	-113.4	161.7	173.2	178.7	-1.2	106.9
201	Y	37.7	Very low	35.1	Very low	163 Å²	163	147.9 Å²	147.9	64%	0.639	74%	0.737	S	S	*	*			cis	-128.8	140.5	-4.1	-97.7	-86.1	0	0	0	105.2
202	D	34.4	Very low	35.1	Very low	131 Å²	131	144.9 Å²	144.9	70%	0.701	73%	0.734	S	S	*	*				50.6	140.8	99.6	-59.2	-61	0	0	0	114.5
203	E	39.4	Very low	35.3	Very low	164 Å²	164	147.8 Å²	147.8	77%	0.766	74%	0.736	S	S	*	*			cis	-161.6	143.8	41.8	-157.6	165.5	-170.6	0	0	113.4
204	I	38.8	Very low	35.3	Very low	118 Å²	118	143.8 Å²	143.8	61%	0.605	73%	0.729	S	S	*	*			trans	53	105.5	146.6	-70.6	174.3	0	0	0	117.7
205	R	32	Very low	35.7	Very low	216 Å²	216	140.8 Å²	140.8	82%	0.815	73%	0.725	S	S	*	*				53.6	116.8	87.2	-64.8	175.6	177.2	172.7	-1.3	113.4
206	D	38.1	Very low	35.4	Very low	146 Å²	146	145.2 Å²	145.2	78%	0.781	73%	0.727	S	S	*	*				-178.8	160.1	103.5	-93.1	-32.5	0	0	0	113.5
207	F	33.7	Very low	35.4	Very low	173 Å²	173	145.8 Å²	145.8	76%	0.759	73%	0.73	S	S	*	*			trans	-72.5	160.9	-176.7	-86.8	-84.7	0	0	0	113.3	P209	F207-P209 HydrophobicContact CD1-CB 4.31Å; F207-P209 HydrophobicContact CD1-CG 3.92Å; F207-P209 HydrophobicContact CE1-CG 4.35Å
208	P	41.3	Very low	35.2	Very low	127 Å²	127	142.2 Å²	142.2	83%	0.825	72%	0.717	S	S	*	*				-131.2	140.3	85.1	36.4	-27.2	0	0	0	114.7
209	P	38.2	Very low	35.1	Very low	80 Å²	80	144 Å²	144	52%	0.519	72%	0.719	S	S	.	*			trans	-96.1	-157.2	156.9	41.1	-27.8	0	0	0	109	F207	F207-P209 HydrophobicContact CD1-CB 4.31Å; F207-P209 HydrophobicContact CD1-CG 3.92Å; F207-P209 HydrophobicContact CE1-CG 4.35Å
210	T	35.7	Very low	34.9	Very low	117 Å²	117	145.2 Å²	145.2	72%	0.718	72%	0.717	S	S	*	*			trans	65.3	112.8	166.1	47.3	0	0	0	0	115.4
211	N	30.9	Very low	34.6	Very low	148 Å²	148	142 Å²	142	79%	0.791	71%	0.714	S	S	*	*				52.3	111.2	86.8	-71.8	-6.5	0	0	0	112.1
212	D	35.4	Very low	34.3	Very low	142 Å²	142	139.9 Å²	139.9	76%	0.759	71%	0.714	S	S	*	*				-157.2	130.3	120.1	-106.6	2.5	0	0	0	113.1
213	Y	36	Very low	34.2	Very low	214 Å²	214	144 Å²	144	84%	0.839	72%	0.719	S	S	*	*			trans	23	127.8	147.1	-67.6	-104.1	0	0	0	120.5
214	G	35.1	Very low	34.1	Very low	64 Å²	64	141 Å²	141	66%	0.66	72%	0.717	S	S	*	*			trans	-68.3	-165	152.5	0	0	0	0	0	111.9
215	P	40.5	Very low	34.1	Very low	114 Å²	114	141.9 Å²	141.9	74%	0.74	72%	0.723	S	S	*	*				-152.5	174.9	69.8	44.3	-27.1	0	0	0	115.3
216	R	30	Very low	34.6	Very low	209 Å²	209	138.9 Å²	138.9	79%	0.789	72%	0.722	S	S	*	*			trans	55.9	147.3	132.8	-89.9	179.2	164.3	147	0.9	122.1
217	D	31.2	Very low	34.6	Very low	122 Å²	122	135 Å²	135	65%	0.652	72%	0.716	S	S	*	*			trans	59.7	127.9	138	-56	-11.7	0	0	0	117.6
218	T	29.9	Very low	34.8	Very low	90 Å²	90	133.8 Å²	133.8	55%	0.552	71%	0.713	S	S	*	*			cis	169.8	177.2	-2.1	28.7	0	0	0	0	102.9
219	Y	28.8	Very low	34.4	Very low	194 Å²	194	137.5 Å²	137.5	76%	0.761	71%	0.71	S	S	*	*			trans	71.7	125.7	146.8	-67.9	-44.7	0	0	0	121.2
220	L	30.8	Very low	34.1	Very low	129 Å²	129	137.7 Å²	137.7	68%	0.675	71%	0.714	S	S	*	*			trans	78.4	112.8	130.8	-66.4	169.6	0	0	0	118.8
221	N	29.7	Very low	34	Very low	122 Å²	122	142.3 Å²	142.3	65%	0.652	72%	0.719	S	S	*	*				46.9	121.9	109.5	-64.1	0.1	0	0	0	117
222	N	30.7	Very low	34	Very low	117 Å²	117	144.7 Å²	144.7	63%	0.626	72%	0.717	S	S	*	*				-169.5	148.4	64.8	-95.1	-52	0	0	0	109.5
223	R	32.4	Very low	34	Very low	217 Å²	217	143.2 Å²	143.2	82%	0.819	71%	0.709	S	S	*	*				52.8	148.5	105	-51.8	175.2	168.5	-175.8	-5.2	115.4
224	S	37.8	Very low	33.9	Very low	103 Å²	103	139 Å²	139	72%	0.72	70%	0.701	S	S	*	*			cis	-153.7	177.7	19.5	-29.7	0	0	0	0	108.6
225	D	37.7	Very low	33.9	Very low	135 Å²	135	145.2 Å²	145.2	72%	0.722	71%	0.706	S	S	*	*			cis	-168.9	167.6	-16.1	-120.8	-40.5	0	0	0	105
226	L	42.4	Very low	33.7	Very low	153 Å²	153	146.1 Å²	146.1	80%	0.801	71%	0.705	S	S	*	*			cis	-115.4	-163.5	1	-80.2	106.2	0	0	0	108.3
227	G	39	Very low	33.8	Very low	64 Å²	64	145.5 Å²	145.5	66%	0.66	70%	0.704	S	S	*	*			cis	110.5	140.3	7.8	0	0	0	0	0	111.3
228	H	37.2	Very low	33.9	Very low	149 Å²	149	145.7 Å²	145.7	69%	0.69	71%	0.705	S	S	*	*			cis	-165.9	149.9	6.7	-136.2	-11.8	0	0	0	110.4
229	R	34.1	Very low	34	Very low	205 Å²	205	153 Å²	153	77%	0.774	72%	0.722	S	S	*	*			trans	69.3	155.7	148	-73	173.8	-168.3	-152.4	-0.4	120
230	S	31.1	Very low	34.4	Very low	84 Å²	84	152.5 Å²	152.5	59%	0.587	73%	0.726	S	S	*	*			cis	172.5	134	-31.6	51.5	0	0	0	0	108.7
231	Y	32.7	Very low	35.1	Very low	213 Å²	213	152 Å²	152	84%	0.835	73%	0.731	S	S	*	*			trans	59.8	153.8	158.6	-80.3	-102.1	0	0	0	115.3
232	R	32.6	Very low	35.5	Very low	199 Å²	199	151.6 Å²	151.6	75%	0.751	74%	0.735	S	S	*	*			cis	-158.8	160.2	15.5	-162.7	153.2	-176.6	176.7	0.9	110.5
233	D	34.1	Very low	35.5	Very low	110 Å²	110	151.6 Å²	151.6	59%	0.588	74%	0.744	S	S	*	*			trans	4.8	152.6	151.9	-42	-33.3	0	0	0	121.6
234	D	34	Very low	35.6	Very low	125 Å²	125	148.8 Å²	148.8	67%	0.668	74%	0.744	S	S	*	*			trans	110.7	127.5	137.4	-75.1	-17	0	0	0	123.3
235	Y	34.4	Very low	35.2	Very low	196 Å²	196	147.7 Å²	147.7	77%	0.769	74%	0.741	S	S	*	*			trans	40	110.2	154.9	-53.1	-64.3	0	0	0	122.8
236	D	36.2	Very low	35	Very low	132 Å²	132	146.4 Å²	146.4	71%	0.706	74%	0.743	S	S	*	*				40.2	106.7	105.9	-160	18.5	0	0	0	118.1
237	Y	33.2	Very low	34.5	Very low	197 Å²	197	147.3 Å²	147.3	77%	0.773	74%	0.742	S	S	*	*				-177.2	145.7	120.4	-118.4	-113.2	0	0	0	113.5
238	N	33.9	Very low	34.2	Very low	125 Å²	125	150.3 Å²	150.3	67%	0.668	74%	0.744	S	S	*	*			trans	-12.5	127	159	-63.9	-78.7	0	0	0	119
239	R	31.9	Very low	33.9	Very low	245 Å²	245	148.7 Å²	148.7	93%	0.925	74%	0.74	S	S	*	*				-172.4	135	116	-106.4	169.1	-177.5	-172.8	0.6	115
240	H	36.9	Very low	33.8	Very low	183 Å²	183	147.9 Å²	147.9	85%	0.847	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-64.7	153.7	160.4	-62.7	-92.4	0	0	0	111.8
241	P	45.6	Very low	33.9	Very low	117 Å²	117	148.7 Å²	148.7	76%	0.76	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-95.4	152.2	139.4	33.7	-27.5	0	0	0	110.9
242	P	36.8	Very low	33.9	Very low	114 Å²	114	143.1 Å²	143.1	74%	0.74	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-93	168.2	-159.6	36.8	-37.7	0	0	0	115
243	S	31.9	Very low	33.8	Very low	118 Å²	118	144.8 Å²	144.8	83%	0.825	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-57	130.3	164.3	51.8	0	0	0	0	112.8
244	I	33.5	Very low	33.8	Very low	158 Å²	158	142.7 Å²	142.7	81%	0.81	75%	0.747	S	S	*	*			trans	-127.3	120.7	152.4	-64.3	-177.8	0	0	0	107.1
245	A	30.8	Very low	33.8	Very low	80 Å²	80	145.3 Å²	145.3	66%	0.661	75%	0.752	S	S	*	*			trans	-89.8	156.4	171.5	0	0	0	0	0	109.7
246	S	31.7	Very low	33.8	Very low	108 Å²	108	141.5 Å²	141.5	76%	0.755	75%	0.745	S	S	*	*			trans	61.1	145.8	166.4	52.3	0	0	0	0	114.9
247	E	32.8	Very low	33.8	Very low	171 Å²	171	141.9 Å²	141.9	80%	0.799	75%	0.747	S	S	*	*			cis	-146	151.8	29.3	-68.8	171	131.4	0	0	111.4
248	D	32.4	Very low	33.7	Very low	128 Å²	128	139.7 Å²	139.7	68%	0.684	74%	0.744	S	S	*	*			trans	52.1	132.2	136	-67.5	-30.9	0	0	0	125.5
249	N	31.9	Very low	33.8	Very low	115 Å²	115	138.2 Å²	138.2	62%	0.615	74%	0.739	S	S	*	*				36.1	121.4	126.6	-45.2	-50.6	0	0	0	117.9
250	F	31.7	Very low	34	Very low	188 Å²	188	134.9 Å²	134.9	83%	0.825	73%	0.731	S	S	*	*				-163.6	129.6	71.3	-107.8	-107.8	0	0	0	107.8
251	V	31.9	Very low	33.9	Very low	100 Å²	100	132.9 Å²	132.9	61%	0.606	73%	0.727	S	S	*	*				73.7	128	62.4	169.8	0	0	0	0	113.7
252	S	33.1	Very low	33.3	Very low	97 Å²	97	132.5 Å²	132.5	68%	0.678	73%	0.727	S	S	*	*			trans	81.4	147.9	155.9	-76.1	0	0	0	0	120.2
253	R	31	Very low	33.6	Very low	233 Å²	233	132.7 Å²	132.7	88%	0.879	73%	0.728	S	S	*	*			cis	-176.1	147.9	-23.8	-151.3	169.5	177.4	173.6	-1.5	110.2
254	G	33.8	Very low	33.5	Very low	67 Å²	67	137.2 Å²	137.2	69%	0.691	73%	0.728	S	S	*	*			trans	69	178.8	155.5	0	0	0	0	0	115.3
255	K	34.2	Very low	33.5	Very low	180 Å²	180	135.7 Å²	135.7	78%	0.783	72%	0.721	S	S	*	*			cis	-139.2	129.7	4.3	-83.6	-165.5	161.2	-174.7	0	108.3
256	D	34.4	Very low	33.6	Very low	115 Å²	115	136 Å²	136	62%	0.615	72%	0.719	S	S	*	*				81.3	149.2	94.6	-53.4	-20	0	0	0	112.1
257	N	35.3	Very low	33.8	Very low	141 Å²	141	141.6 Å²	141.6	75%	0.754	72%	0.724	S	S	*	*			trans	76.8	146.2	156.9	-64.9	1.3	0	0	0	119.9
258	E	32.5	Very low	34	Very low	151 Å²	151	137 Å²	137	71%	0.706	72%	0.716	S	S	*	*			cis	-172.6	161.6	-26.2	-146.4	-172.7	129.6	0	0	110.1
259	V	34.6	Very low	34.3	Very low	94 Å²	94	138.5 Å²	138.5	57%	0.57	72%	0.724	S	S	*	*			trans	62	147.5	157.3	-113.2	0	0	0	0	123.9
260	K	38.1	Very low	34.6	Very low	174 Å²	174	140.7 Å²	140.7	76%	0.757	73%	0.73	S	S	*	*			trans	78.8	144.5	150.9	-67.9	151	-167	175.9	0	118.2
261	N	34.2	Very low	35.1	Very low	141 Å²	141	142.6 Å²	142.6	75%	0.754	73%	0.734	S	S	*	*			cis	174.6	114.4	-26.4	-109.7	-3.9	0	0	0	107.1
262	S	32.2	Very low	35.4	Very low	110 Å²	110	143.1 Å²	143.1	77%	0.769	74%	0.739	S	S	*	*			trans	60.9	-176.6	150.6	-49.4	0	0	0	0	117.5
263	P	42.9	Very low	35.4	Very low	117 Å²	117	142.3 Å²	142.3	76%	0.76	74%	0.738	S	S	*	*				-134.4	-160.7	-91.8	41.8	-22.8	0	0	0	113.8
264	R	31.3	Very low	35.7	Very low	214 Å²	214	139.9 Å²	139.9	81%	0.808	74%	0.742	S	S	*	*			trans	88.4	132.8	161.1	-86	-176.7	151.1	145.4	1.5	120.6
265	D	33.3	Very low	35.7	Very low	126 Å²	126	145.3 Å²	145.3	67%	0.674	75%	0.749	S	S	*	*			trans	62.4	150.8	131.8	-54.6	-16.7	0	0	0	119.3
266	S	32.5	Very low	35.8	Very low	87 Å²	87	143.2 Å²	143.2	61%	0.608	75%	0.751	S	S	*	*			cis	-171.7	-179.1	-17	-92.5	0	0	0	0	107.8
267	Y	36.8	Very low	35.9	Very low	224 Å²	224	142.8 Å²	142.8	88%	0.878	76%	0.757	S	S	*	*			trans	75.8	122.1	176.2	-60.2	-91.1	0	0	0	115.5
268	A	36.6	Very low	35.7	Very low	76 Å²	76	143.9 Å²	143.9	63%	0.628	76%	0.763	S	S	*	*			cis	93.8	120.5	23.3	0	0	0	0	0	115.5
269	D	39	Very low	35.9	Very low	158 Å²	158	139.8 Å²	139.8	85%	0.845	76%	0.761	S	S	*	*			trans	-179.9	109.8	144.4	-88.1	-25	0	0	0	106.5
270	H	38.3	Very low	35.8	Very low	162 Å²	162	143.2 Å²	143.2	75%	0.75	77%	0.772	S	S	*	*				67	115.3	66.2	-81	51.9	0	0	0	115.9
271	Y	41.4	Very low	35.5	Very low	228 Å²	228	141.4 Å²	141.4	89%	0.894	78%	0.776	S	S	*	*			trans	-177.7	154.7	134.5	-95.8	-67.9	0	0	0	108.2
272	P	38.6	Very low	35.4	Very low	110 Å²	110	138.2 Å²	138.2	71%	0.714	77%	0.769	S	S	*	*				-140.7	171.9	-115.9	35.9	-12.9	0	0	0	118.1
273	A	32.4	Very low	35.6	Very low	81 Å²	81	139.6 Å²	139.6	67%	0.669	77%	0.768	S	S	*	*			trans	21.2	129	147.8	0	0	0	0	0	122.3
274	L	38.2	Very low	35.3	Very low	181 Å²	181	145.2 Å²	145.2	95%	0.948	78%	0.776	S	S	*	*				-130.9	134.9	126.3	-82.9	-179.5	0	0	0	110.3
275	H	32.1	Very low	35.5	Very low	181 Å²	181	142 Å²	142	84%	0.838	78%	0.775	S	S	*	*			trans	-130.2	113.3	-170.3	-131.9	-80	0	0	0	107.9
276	V	36.7	Very low	35.7	Very low	137 Å²	137	144 Å²	144	83%	0.83	78%	0.777	S	S	*	*			trans	-159.6	137	170.6	-174.2	0	0	0	0	108.1
277	S	37.2	Very low	35.9	Very low	105 Å²	105	150 Å²	150	73%	0.734	79%	0.788	S	S	*	*			cis	-168.1	158.5	-34.9	55.3	0	0	0	0	107.6
278	D	31.5	Very low	35.7	Very low	165 Å²	165	150.5 Å²	150.5	88%	0.882	79%	0.789	S	S	*	*			trans	-62.4	156.8	172	-69.9	-67.9	0	0	0	113.9
279	G	35.2	Very low	35.7	Very low	64 Å²	64	150.5 Å²	150.5	66%	0.66	79%	0.788	S	S	*	*			trans	166.7	93.1	168.7	0	0	0	0	0	111.6
280	M	33.5	Very low	35.5	Very low	166 Å²	166	151.6 Å²	151.6	82%	0.818	79%	0.788	S	S	*	*				69.5	128.4	90.7	-98.2	81.7	173.1	0	0	115.9
281	T	31.8	Very low	35	Very low	137 Å²	137	149.3 Å²	149.3	84%	0.84	79%	0.79	S	S	*	*			trans	65.9	150	150.6	57.3	0	0	0	0	118.6
282	A	32.7	Very low	34.9	Very low	73 Å²	73	144.3 Å²	144.3	60%	0.603	79%	0.786	S	S	*	*			cis	-165.4	175.7	-17.7	0	0	0	0	0	108.5
283	D	35.2	Very low	34.5	Very low	140 Å²	140	149.9 Å²	149.9	75%	0.749	79%	0.793	S	S	*	*			trans	58.8	117.8	157.7	-58.6	-36.7	0	0	0	119.9
284	Y	37.2	Very low	34.4	Very low	235 Å²	235	151.8 Å²	151.8	92%	0.922	80%	0.796	S	S	*	*				-157	96.3	101.3	-111.3	-75.6	0	0	0	110.6
285	D	35.6	Very low	34.2	Very low	146 Å²	146	151.8 Å²	151.8	78%	0.781	79%	0.788	S	S	*	*			trans	-99.6	165.2	168.7	-148.4	-23.4	0	0	0	109.8
286	K	36.7	Very low	34.1	Very low	169 Å²	169	150.4 Å²	150.4	74%	0.735	79%	0.787	S	S	*	*			trans	84	131.6	-163.9	-53.1	160.7	-178.7	167.2	0	113
287	Y	38.3	Very low	34.1	Very low	212 Å²	212	149 Å²	149	83%	0.831	78%	0.775	S	S	*	*			cis	-132.7	161.4	13.7	-58.2	-105.3	0	0	0	108.2
288	R	31.5	Very low	34	Very low	235 Å²	235	153.1 Å²	153.1	89%	0.887	77%	0.774	S	S	*	*			cis	-165.9	146.6	28.6	-165.1	170.4	174.8	150.7	-3.2	110.1
289	A	36.7	Very low	34.2	Very low	75 Å²	75	153.4 Å²	153.4	62%	0.62	77%	0.768	S	S	*	*			trans	11.1	145.4	153	0	0	0	0	0	120.9
290	Q	34.3	Very low	34.5	Very low	181 Å²	181	155.4 Å²	155.4	85%	0.846	77%	0.77	S	S	*	*			cis	-167.2	143.5	5.9	-112.3	157.1	11.5	0	0	108
291	S	27.2	Very low	34.8	Very low	114 Å²	114	152.7 Å²	152.7	80%	0.797	76%	0.764	S	S	*	*			trans	-79	150	153.2	-75.9	0	0	0	0	109.2
292	P	40.1	Very low	35.2	Very low	123 Å²	123	155 Å²	155	80%	0.799	77%	0.765	S	S	*	*				-124	130.8	116.3	-0.7	20.8	0	0	0	112.5
293	R	30.1	Very low	35.4	Very low	227 Å²	227	158.7 Å²	158.7	86%	0.857	78%	0.775	S	S	*	*			trans	-70.8	163	145.1	-71.2	177.5	169.8	167.8	-3.7	108.3
294	V	31	Very low	35.5	Very low	121 Å²	121	159.3 Å²	159.3	73%	0.733	78%	0.776	S	S	*	*			trans	73.4	103.5	168.5	-166.3	0	0	0	0	114.5
295	F	33.2	Very low	35.5	Very low	181 Å²	181	156.2 Å²	156.2	79%	0.794	77%	0.77	S	S	*	*				-138	114.2	114.4	-122	-84.4	0	0	0	109.7	D297	F295-D297 HydrophobicContact CD1-CB 4.1Å; F295-D297 VanDerWaalsContact CE1-OD2 3.25Å; F295-D297 WeakPolarHBondContact CE1-OD2 3.46Å
296	N	30.4	Very low	35.5	Very low	152 Å²	152	154.9 Å²	154.9	81%	0.813	77%	0.772	S	S	*	*			trans	-105.9	103	173.2	-156	25.6	0	0	0	105
297	D	37.6	Very low	35.4	Very low	107 Å²	107	157.5 Å²	157.5	57%	0.572	78%	0.778	S	S	*	*			trans	-148.7	145.1	179.6	-103.6	-4	0	0	0	109.3	F295	F295-D297 HydrophobicContact CD1-CB 4.1Å; F295-D297 VanDerWaalsContact CE1-OD2 3.25Å; F295-D297 WeakPolarHBondContact CE1-OD2 3.46Å
298	R	35	Very low	35.3	Very low	192 Å²	192	156.9 Å²	156.9	73%	0.725	78%	0.782	S	S	*	*			cis	-172.3	128.7	-33.8	-127.1	-175.1	177.2	166.1	-4.9	107.4
299	F	34.7	Very low	35.6	Very low	172 Å²	172	155.5 Å²	155.5	75%	0.754	78%	0.783	S	S	*	*			trans	63.8	163.9	162.6	-59.9	-65.3	0	0	0	119.3
300	P	41.5	Very low	35.6	Very low	106 Å²	106	155.6 Å²	155.6	69%	0.688	79%	0.791	S	S	*	*			cis	-123.2	166.8	-23.2	23.5	-2.6	0	0	0	113.4
301	P	39.1	Very low	36	Very low	109 Å²	109	156 Å²	156	71%	0.708	79%	0.793	S	S	*	*			trans	-83.8	150.6	170.1	35.2	-33.5	0	0	0	111.9
302	H	40.2	Very low	36.5	Very low	184 Å²	184	153.5 Å²	153.5	85%	0.852	79%	0.785	S	S	*	*			trans	-149.6	115.3	155.3	-95.6	-71.6	0	0	0	110.9
303	D	37.6	Very low	36.3	Very low	151 Å²	151	155 Å²	155	81%	0.807	79%	0.787	S	S	*	*			trans	-58.7	140.7	158.5	-60.6	-81.7	0	0	0	110.6
304	I	37.4	Very low	36.7	Very low	153 Å²	153	149.2 Å²	149.2	79%	0.785	78%	0.777	S	S	*	*				-151.3	107.3	122.7	-64.5	-159	0	0	0	109.3
305	Q	36.6	Very low	37.1	Very low	170 Å²	170	150.3 Å²	150.3	79%	0.794	77%	0.774	S	S	*	*			trans	41.3	113.1	141.5	-57.8	175	-5.4	0	0	121.5
306	S	36.3	Very low	37.8	Very low	118 Å²	118	147.4 Å²	147.4	83%	0.825	77%	0.773	S	S	*	*				54.7	140.8	119.3	-55.9	0	0	0	0	121.9
307	R	33.6	Very low	38	Very low	225 Å²	225	148 Å²	148	85%	0.849	77%	0.769	S	S	*	*			cis	-176.4	99.5	-8.5	175.2	-172.8	-172.2	178.6	2.5	108.6
308	E	36.9	Very low	38.3	Very low	198 Å²	198	148 Å²	148	93%	0.925	78%	0.775	S	S	*	*			trans	-142.1	141.7	171.1	-97.7	175.9	176.9	0	0	110.6
309	F	39.2	Very low	38.4	Very low	206 Å²	206	143.3 Å²	143.3	90%	0.904	77%	0.771	S	S	*	*			trans	-105.8	133.8	-174.6	-101.5	-94.1	0	0	0	111.4
310	G	36.7	Very low	38.6	Very low	77 Å²	77	142.7 Å²	142.7	79%	0.794	77%	0.771	S	S	*	*			trans	-75.1	132.1	-166.3	0	0	0	0	0	116.4
311	H	40.8	Very low	38.4	Very low	189 Å²	189	145.4 Å²	145.4	88%	0.875	77%	0.772	S	S	*	*			trans	-54.5	160.4	141.4	-55	-76.6	0	0	0	109.9
312	G	38.3	Very low	38.3	Very low	62 Å²	62	150.5 Å²	150.5	64%	0.639	78%	0.777	S	S	*	*			cis	124.8	153.4	12.5	0	0	0	0	0	110.5
313	N	36.2	Very low	38.2	Very low	154 Å²	154	147.2 Å²	147.2	82%	0.824	78%	0.775	S	S	*	*			trans	67.5	161.9	142.9	-71.5	9.2	0	0	0	120.3
314	T	37.9	Very low	38.2	Very low	107 Å²	107	143.6 Å²	143.6	66%	0.656	77%	0.773	S	S	*	*			cis	-170.1	166.2	-23.7	-87.9	0	0	0	0	108.6
315	H	40.9	Very low	38.5	Very low	143 Å²	143	142.9 Å²	142.9	66%	0.662	78%	0.778	S	S	*	*			trans	-39.2	167.5	160.1	-55.5	-92	0	0	0	115.7	F317	H315-F317 HydrophobicContact CB-CD2 4.25Å; H315-F317 HydrophobicContact CB-CE2 4.48Å
316	P	46	Very low	38.6	Very low	121 Å²	121	138.3 Å²	138.3	79%	0.786	78%	0.777	S	S	*	*				-148.5	144.3	79.2	36	-15.5	0	0	0	118.1
317	F	35.8	Very low	39	Very low	165 Å²	165	141.9 Å²	141.9	72%	0.724	78%	0.78	S	S	*	*				5.8	165.5	115	-64.8	-74.8	0	0	0	119.6	H315	H315-F317 HydrophobicContact CB-CD2 4.25Å; H315-F317 HydrophobicContact CB-CE2 4.48Å
318	P	43	Very low	39.4	Very low	107 Å²	107	135.6 Å²	135.6	70%	0.695	77%	0.768	S	S	*	*			cis	-143.7	154.6	25.9	49.7	-31.5	0	0	0	116.5
319	S	37.9	Very low	39.4	Very low	93 Å²	93	132.9 Å²	132.9	65%	0.65	76%	0.759	S	S	*	*				76.6	134.5	103	76.1	0	0	0	0	118.7
320	E	39	Very low	39.3	Very low	159 Å²	159	129.8 Å²	129.8	74%	0.743	75%	0.752	S	S	*	*			trans	139.5	129.1	130.8	-68.3	-120.8	130.6	0	0	116.2
321	F	37.6	Very low	39.3	Very low	163 Å²	163	136.1 Å²	136.1	72%	0.715	75%	0.752	S	S	*	*			trans	31.3	120.1	151.2	-65.2	-92.1	0	0	0	121.2
322	R	35.7	Very low	39	Very low	216 Å²	216	134 Å²	134	82%	0.815	74%	0.742	S	S	*	*				100.7	135.2	60.7	-165.5	-174.9	-157.8	-158.1	12.9	112.2
323	S	39.5	Very low	38.9	Very low	115 Å²	115	137.1 Å²	137.1	80%	0.804	75%	0.749	S	S	*	*			trans	68.6	129.2	157.8	45.2	0	0	0	0	122.1
324	G	37.1	Very low	38.6	Very low	75 Å²	75	133.8 Å²	133.8	77%	0.773	74%	0.743	S	S	*	*			trans	122.6	107.3	137.6	0	0	0	0	0	117.5
325	P	43.3	Very low	38.3	Very low	138 Å²	138	134.2 Å²	134.2	90%	0.896	75%	0.75	S	S	*	*			trans	-96.5	156.5	172.2	37.2	-32.6	0	0	0	112.9
326	G	39.1	Very low	38	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	75%	0.751	S	S	*	*			trans	177.9	77	172.7	0	0	0	0	0	118.6
327	H	44.4	Very low	37.3	Very low	193 Å²	193	133.9 Å²	133.9	89%	0.894	75%	0.75	S	S	*	*			trans	55.9	173.7	144.2	-103.5	-91.5	0	0	0	118.4
328	P	41.8	Very low	37.3	Very low	94 Å²	94	131.7 Å²	131.7	61%	0.61	76%	0.755	S	S	*	*			trans	-124.1	-177.2	-134.8	35.8	-13.3	0	0	0	112.9
329	L	37.5	Very low	36.9	Very low	141 Å²	141	136.7 Å²	136.7	74%	0.738	76%	0.76	S	S	*	*				169.8	139.1	118.8	-88.3	161.2	0	0	0	109.4
330	D	36.9	Very low	37	Very low	140 Å²	140	139.7 Å²	139.7	75%	0.749	77%	0.768	S	S	*	*			trans	36	126	144.2	-53.2	-17.4	0	0	0	120.8
331	R	36.1	Very low	36.8	Very low	211 Å²	211	138.7 Å²	138.7	80%	0.796	76%	0.764	S	S	*	*				123.3	99.9	116.4	-149.4	165.6	-170.9	152.2	7.2	117
332	E	35.7	Very low	36.8	Very low	143 Å²	143	139.9 Å²	139.9	67%	0.668	77%	0.772	S	S	*	*			trans	55.9	145.6	135.5	-55.3	180	100.8	0	0	122
333	T	35.1	Very low	36.9	Very low	128 Å²	128	136 Å²	136	79%	0.785	76%	0.763	S	S	*	*			trans	80.7	82.6	152	-16.7	0	0	0	0	119.5
334	A	31.5	Very low	37	Very low	84 Å²	84	142.4 Å²	142.4	69%	0.694	77%	0.769	S	S	*	*				47.8	158.6	114.9	0	0	0	0	0	123.1
335	C	30.9	Very low	37	Very low	117 Å²	117	144.5 Å²	144.5	79%	0.791	76%	0.762	S	S	*	*			trans	81.8	141	170.9	-54.7	0	0	0	0	115.7
336	T	34.4	Very low	36.6	Very low	112 Å²	112	147.8 Å²	147.8	69%	0.687	76%	0.763	S	S	*	*			cis	-165.6	149.3	-11.8	16.6	0	0	0	0	109.9
337	N	32	Very low	36.7	Very low	145 Å²	145	148.5 Å²	148.5	78%	0.775	76%	0.757	S	S	*	*			trans	37	118.2	143.2	-56.6	-22.5	0	0	0	121.5
338	S	35.7	Very low	36.4	Very low	119 Å²	119	145.8 Å²	145.8	83%	0.832	75%	0.753	S	S	*	*				164	152.9	122.7	-77.7	0	0	0	0	110.6
339	R	34.8	Very low	36.6	Very low	211 Å²	211	152.1 Å²	152.1	80%	0.796	77%	0.765	S	S	*	*			cis	-174.5	169.6	-21.6	-169.1	171.5	-176.3	-172.7	0.2	105.9
340	L	39.2	Very low	36.5	Very low	157 Å²	157	149.9 Å²	149.9	82%	0.822	76%	0.759	S	S	*	*			trans	79.8	107.9	178.4	-44.9	173.4	0	0	0	112.8
341	Q	34	Very low	36.5	Very low	138 Å²	138	149.2 Å²	149.2	65%	0.645	76%	0.762	S	S	*	*			cis	85.6	112.5	22.3	-161.7	176.3	5.6	0	0	116.1	E343	Q341-E343 PolarHBondContact NE2-OE1 2.84Å
342	E	38.5	Very low	36.7	Very low	188 Å²	188	149.5 Å²	149.5	88%	0.879	76%	0.763	S	S	*	*			trans	165.6	84.8	145.2	-95.1	177.2	-171.5	0	0	107.6
343	E	37.6	Very low	37	Very low	134 Å²	134	150.4 Å²	150.4	63%	0.626	77%	0.772	S	S	*	*				64	113.9	82.7	-74.8	178.4	-152.6	0	0	116.6	Q341	Q341-E343 PolarHBondContact NE2-OE1 2.84Å
344	R	41	Very low	37.1	Very low	250 Å²	250	151.4 Å²	151.4	94%	0.943	77%	0.772	S	S	*	*			trans	-144.5	110.6	139.4	-70	-162.7	-165.5	-165.7	5.9	109.5
345	D	36.8	Very low	37.5	Very low	118 Å²	118	154.1 Å²	154.1	63%	0.631	78%	0.775	S	S	*	*			trans	-75	150.4	177.5	-89	-51.8	0	0	0	113.7
346	F	36.7	Very low	37.9	Very low	208 Å²	208	155.1 Å²	155.1	91%	0.912	77%	0.773	S	S	*	*			trans	-130.6	57.9	153.1	-93.1	-81.5	0	0	0	110
347	S	40.8	Very low	38.2	Very low	88 Å²	88	154.2 Å²	154.2	62%	0.615	78%	0.777	S	S	*	*			trans	-99.1	95.2	172	57.3	0	0	0	0	111	R349	S347-R349 PolarHBondContact O-N 2.76Å
348	V	38.4	Very low	38.6	Very low	136 Å²	136	152.8 Å²	152.8	82%	0.824	78%	0.776	S	S	*	*			trans	-96.1	89.1	167.5	-176.1	0	0	0	0	109.1
349	R	45.9	Very low	38.7	Very low	227 Å²	227	155.1 Å²	155.1	86%	0.857	78%	0.777	S	S	*	*			trans	-82.2	135	160.8	-87.8	-177	168.1	178.3	-3.1	109.2	S347	S347-R349 PolarHBondContact O-N 2.76Å
350	P	35.5	Very low	38.9	Very low	93 Å²	93	150.8 Å²	150.8	60%	0.604	78%	0.779	S	S	*	*			trans	-60.3	130.5	174.8	-25.2	35	0	0	0	112.5	W352	P350-W352 PolarHBondContact O-N 3.21Å
351	P	35.7	Very low	38.9	Very low	126 Å²	126	146.3 Å²	146.3	82%	0.818	77%	0.77	S	S	*	*	S	Bend	trans	-89.2	97.6	-176	33.2	-33.4	0	0	0	112.6
352	W	41.2	Very low	39.5	Very low	217 Å²	217	144.7 Å²	144.7	82%	0.822	77%	0.772	S	S	*	*			trans	-155.9	11.7	160	53.9	57.7	0	0	0	114.7	P350	P350-W352 PolarHBondContact O-N 3.21Å
353	L	41.5	Very low	39.6	Very low	163 Å²	163	144.5 Å²	144.5	85%	0.853	77%	0.768	S	S	*	*			trans	-128	64.8	-175.9	-138.3	82.6	0	0	0	111.7
354	N	36.8	Very low	39.6	Very low	148 Å²	148	149.1 Å²	149.1	79%	0.791	78%	0.78	S	S	*	*			trans	-155.1	114.7	173.4	-160.8	40.9	0	0	0	111
355	D	40.3	Very low	39.7	Very low	141 Å²	141	141.9 Å²	141.9	75%	0.754	77%	0.765	S	S	*	*			trans	-158	108.9	161.2	-98.4	-43.8	0	0	0	109.4
356	N	38.7	Very low	39.7	Very low	138 Å²	138	145.1 Å²	145.1	74%	0.738	77%	0.774	S	S	*	*				49.7	134.9	120.5	-61.8	-43.8	0	0	0	119.5
357	A	41	Very low	39.6	Very low	93 Å²	93	142.2 Å²	142.2	77%	0.769	76%	0.763	S	S	*	*			cis	-163.2	174.1	4	0	0	0	0	0	111
358	P	40.5	Very low	39.5	Very low	116 Å²	116	144.7 Å²	144.7	75%	0.753	77%	0.765	S	S	*	*			trans	-113.1	-179.5	-163.6	42.5	-35.2	0	0	0	116.1
359	I	38.6	Very low	39.3	Very low	168 Å²	168	145.6 Å²	145.6	86%	0.862	76%	0.76	S	S	*	*			trans	-165.1	136.7	151.9	-99.3	145	0	0	0	113.8
360	S	38.1	Very low	38.6	Very low	119 Å²	119	140.9 Å²	140.9	83%	0.832	76%	0.757	S	S	*	*			trans	16.1	151	149.9	-145.4	0	0	0	0	122.3
361	G	38.8	Very low	38.7	Very low	63 Å²	63	142.1 Å²	142.1	65%	0.649	77%	0.768	S	S	*	*			cis	160.4	-177.6	19	0	0	0	0	0	113.1
362	P	46.2	Very low	38.8	Very low	105 Å²	105	143.2 Å²	143.2	68%	0.682	77%	0.767	S	S	*	*				-142.2	-176.6	-113.9	44.7	-28.9	0	0	0	119.6
363	K	40.6	Very low	38.7	Very low	183 Å²	183	143.2 Å²	143.2	80%	0.796	77%	0.773	S	S	*	*			trans	79	153.4	160	-60.1	163.9	-173.9	173.2	0	117.9
364	R	39.4	Very low	38.4	Very low	231 Å²	231	144.7 Å²	144.7	87%	0.872	78%	0.776	S	S	*	*			cis	-163.2	175.2	-9.7	-112.3	-172.2	-176.2	-168.4	2.1	111.4
365	P	43	Very low	38.6	Very low	98 Å²	98	146.9 Å²	146.9	64%	0.636	78%	0.781	S	S	*	*			trans	-115.4	-176.5	-167.1	44.6	-37.5	0	0	0	117.5
366	F	36.4	Very low	38.4	Very low	186 Å²	186	150.8 Å²	150.8	82%	0.816	79%	0.787	S	S	*	*			trans	148.2	119.4	152.7	-84.1	-66.2	0	0	0	109.1
367	Q	33.7	Very low	38.4	Very low	147 Å²	147	149.8 Å²	149.8	69%	0.687	79%	0.788	S	S	*	*				83.9	110.6	61.9	-165.7	180	0.6	0	0	115.4
368	H	38.8	Very low	38.5	Very low	140 Å²	140	157 Å²	157	65%	0.648	80%	0.795	S	S	*	*				167.7	139.3	129.4	-100.4	-87.5	0	0	0	115.5
369	Q	35.4	Very low	38.3	Very low	155 Å²	155	161.7 Å²	161.7	72%	0.724	80%	0.804	S	S	*	*			trans	49.4	111.2	143.6	-76.9	164.8	4.2	0	0	121.7
370	T	31.3	Very low	38.4	Very low	129 Å²	129	165.1 Å²	165.1	79%	0.791	81%	0.806	S	S	*	*				74.8	106.3	81.4	59.8	0	0	0	0	117.3
371	S	37.6	Very low	38.5	Very low	119 Å²	119	171.2 Å²	171.2	83%	0.832	81%	0.811	S	S	*	*				-179.2	152.9	128.8	59.1	0	0	0	0	111.9
372	D	35.8	Very low	38.6	Very low	149 Å²	149	173.6 Å²	173.6	80%	0.797	82%	0.815	S	S	*	*			trans	-54.7	148.4	-172.8	-48.5	-72	0	0	0	117.3
373	F	39.7	Very low	38.3	Very low	217 Å²	217	176.4 Å²	176.4	95%	0.952	82%	0.819	S	S	*	*			trans	-167.5	138	135.7	-108.8	-73.7	0	0	0	110.1
374	E	36.5	Very low	38.1	Very low	194 Å²	194	173.3 Å²	173.3	91%	0.907	82%	0.817	S	S	*	*			trans	-78.6	127.7	179	-67.9	177	110.7	0	0	112.4
375	E	41.2	Very low	38.1	Very low	193 Å²	193	165.8 Å²	165.8	90%	0.902	80%	0.8	S	S	*	*			trans	-150.8	147.5	155.6	-148	-178.8	162.9	0	0	112.2
376	Y	36	Very low	37.8	Very low	223 Å²	223	166.7 Å²	166.7	88%	0.875	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-70.8	157.6	-167.2	-88.6	-98.6	0	0	0	114.9
377	P	38.6	Very low	37.7	Very low	118 Å²	118	167 Å²	167	77%	0.766	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-83	129.1	-153.5	31.1	-35.6	0	0	0	114.8
378	R	42	Very low	38	Very low	244 Å²	244	165.4 Å²	165.4	92%	0.921	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-95.8	126.4	165.7	-73.6	-171.3	177	-178.7	1.8	112.3	R380	R378-R380 PolarHBondContact O-N 2.87Å
379	K	37	Very low	37.9	Very low	214 Å²	214	168 Å²	168	93%	0.93	81%	0.81	S	S	*	*			trans	-45.5	121	-178.9	-60.1	170.6	-180	176.7	0	113.2
380	R	40.5	Very low	38.4	Very low	240 Å²	240	166.5 Å²	166.5	91%	0.906	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-98.7	136.2	159.8	-80.5	-173.2	172	-177.5	-1.1	110.2	R378	R378-R380 PolarHBondContact O-N 2.87Å
381	R	39.8	Very low	39	Very low	248 Å²	248	164.6 Å²	164.6	94%	0.936	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-61.6	134.1	174.9	-89.5	178.5	168.1	169.7	-5.2	111.1
382	P	41.9	Very low	39.6	Very low	113 Å²	113	163.7 Å²	163.7	73%	0.734	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68.3	149.9	160.1	-16.9	31.9	0	0	0	111.7
383	Q	38.4	Very low	40.4	Very low	164 Å²	164	162.2 Å²	162.2	77%	0.766	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-63.7	156.3	167.1	-72.6	-79	9.1	0	0	110.8	S385	Q383-S385 VanDerWaalsContact C-N 3.32Å; Q383-S385 PolarHBondContact O-N 2.84Å
384	P	37.2	Very low	41.6	Very low	117 Å²	117	152.3 Å²	152.3	76%	0.76	74%	0.74	S	S	*	*			trans	-76	81.9	175.9	32.6	-33.4	0	0	0	110.8
385	S	38.7	Very low	42.7	Very low	74 Å²	74	148.8 Å²	148.8	52%	0.517	73%	0.734	S	S	.	*			trans	-65.2	140.8	158.8	52.5	0	0	0	0	109.5	Q383 Y387	Q383-S385 VanDerWaalsContact C-N 3.32Å; Q383-S385 PolarHBondContact O-N 2.84Å; S385-Y387 WeakPolarHBondContact O-CD2 3.47Å; S385-Y387 PolarHBondContact O-N 2.75Å
386	S	36.5	Very low	44.1	Very low	117 Å²	117	141.2 Å²	141.2	82%	0.818	71%	0.708	S	S	*	*			trans	-56.8	99.1	-179.3	49.8	0	0	0	0	112.7	T388	S386-T388 PolarHBondContact O-N 2.97Å
387	Y	35.8	Very low	46.4	Very low	193 Å²	193	132.4 Å²	132.4	76%	0.757	68%	0.675	S	S	*	*			trans	-80.6	92.2	172.1	-76	-81	0	0	0	110.4	S385	S385-Y387 WeakPolarHBondContact O-CD2 3.47Å; S385-Y387 PolarHBondContact O-N 2.75Å
388	T	38.9	Very low	48.8	Very low	113 Å²	113	128 Å²	128	69%	0.693	65%	0.645	S	S	*	*			trans	-57.3	135.8	158.1	-47.7	0	0	0	0	108.4	S386	S386-T388 PolarHBondContact O-N 2.97Å
389	R	36.8	Very low	51.1	Low	193 Å²	193	122.3 Å²	122.3	73%	0.728	63%	0.634	S	S	*	*			trans	-64	139.2	-176.4	-73.7	-175.6	177	-170.5	0.5	110.2	S391 D392	R389-S391 PolarHBondContact O-N 3.34Å; R389-D392 PolarHBondContact O-N 3.41Å
390	P	46.4	Very low	53.8	Low	124 Å²	124	116.1 Å²	116.1	81%	0.805	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	3.9	178	-25	35.1	0	0	0	116.4
391	S	44.7	Very low	56.5	Low	89 Å²	89	104.7 Å²	104.7	62%	0.622	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-15.1	-179.7	51.9	0	0	0	0	114.5	R389	R389-S391 PolarHBondContact O-N 3.34Å
392	D	50.3	Low	59.2	Low	100 Å²	100	92.9 Å²	92.9	54%	0.535	52%	0.517	S	S	.	.	S	Bend	trans	-111.1	9	-165.3	-49.6	-26.1	0	0	0	113.4	R389	R389-D392 PolarHBondContact O-N 3.41Å
393	I	52.4	Low	61.9	Low	119 Å²	119	89.8 Å²	89.8	61%	0.61	49%	0.491	S	S	*	.			trans	-84.1	114.5	177.3	-57.2	175.3	0	0	0	108.7
394	V	64	Low	64.6	Low	8 Å²	8	82 Å²	82	5%	0.048	46%	0.455	C	S	.	.			trans	-67.8	132	175.2	-171	0	0	0	0	108.9	G396 E397 P494 E496 V497	V394-G396 PolarHBondContact O-N 3.47Å; V394-E397 HydrophobicContact CB-CB 4.28Å; V394-E397 VanDerWaalsContact CG2-OE2 3.31Å; V394-E397 WeakPolarHBondContact CG2-OE2 3.42Å; V394-E397 WeakPolarHBondContact O-CB 3.43Å; V394-E397 PolarHBondContact O-N 2.66Å; V394-P494 HydrophobicContact CG1-CB 4.18Å; V394-P494 HydrophobicContact CG1-CG 4.32Å; V394-E496 HydrophobicContact CB-CB 4.36Å; V394-E496 HydrophobicContact CG1-CB 4Å; V394-E496 HydrophobicContact CG2-CB 3.4Å; V394-E496 VanDerWaalsContact CG2-CB 3.4Å; V394-E496 HydrophobicContact CG2-CG 4.36Å; V394-V497 HydrophobicContact CB-CG2 4.29Å; V394-V497 HydrophobicContact CG1-CG2 3.94Å; V394-V497 HydrophobicContact CG2-CG2 4.31Å
395	P	60.1	Low	67.4	Low	120 Å²	120	77.1 Å²	77.1	78%	0.779	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	110	179.6	-28.9	36.3	0	0	0	112.6
396	G	71	Confident	70.1	Confident	35 Å²	35	73.8 Å²	73.8	36%	0.361	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.9	-2.6	-178.8	0	0	0	0	0	115.8	V394 V426	V394-G396 PolarHBondContact O-N 3.47Å; G396-V426 WeakPolarHBondContact O-CG1 3.31Å; G396-V426 WeakPolarHBondContact O-CG2 3.38Å
397	E	82.9	Confident	72.7	Confident	38 Å²	38	69.4 Å²	69.4	18%	0.178	37%	0.368	C	S	.	.			trans	-73.9	130.3	172.5	-170	176	148.1	0	0	111.2	V394 W429 Y482 K500	V394-E397 HydrophobicContact CB-CB 4.28Å; V394-E397 VanDerWaalsContact CG2-OE2 3.31Å; V394-E397 WeakPolarHBondContact CG2-OE2 3.42Å; V394-E397 WeakPolarHBondContact O-CB 3.43Å; V394-E397 PolarHBondContact O-N 2.66Å; E397-W429 HydrophobicContact CB-CH2 4.36Å; E397-Y482 WeakPolarHBondContact CG-OH 3.41Å; E397-Y482 PolarHBondContact OE1-OH 2.91Å; E397-K500 IonicContact OE1-NZ 3.74Å; E397-K500 PolarHBondContact OE1-NZ 2.99Å; E397-K500 IonicContact OE2-NZ 2.87Å; E397-K500 PolarHBondContact OE2-NZ 3.33Å
398	T	88.9	Confident	75.3	Confident	24 Å²	24	60.3 Å²	60.3	15%	0.147	33%	0.333	C	S	.	.			trans	-143.8	151.6	-179.3	77.4	0	0	0	0	112.2	Y400 M448 M449 L478	T398-Y400 HydrophobicContact CG2-CD2 4.28Å; T398-Y400 PolarHBondContact O-N 3.24Å; T398-Y400 PolarHBondContact OG1-N 2.95Å; T398-M448 PolarHBondContact N-SD 2.79Å; T398-M448 WeakPolarHBondContact OG1-CG 3.29Å; T398-M449 WeakPolarHBondContact CG2-O 3.24Å; T398-M449 PolarHBondContact OG1-O 3.32Å; T398-L478 WeakPolarHBondContact O-CD2 3.46Å
399	D	90.7	Very high	77.6	Confident	126 Å²	126	60 Å²	60	67%	0.674	33%	0.332	S	S	*	.	S	Bend	trans	-71.6	-1.8	170.9	-63.1	-54.7	0	0	0	113.6	V401 L478	D399-V401 PolarHBondContact O-N 2.83Å; D399-L478 VanDerWaalsContact OD1-CD1 3.25Å; D399-L478 WeakPolarHBondContact OD1-CD1 3.47Å
400	Y	95.2	Very high	80	Confident	83 Å²	83	53.7 Å²	53.7	33%	0.325	31%	0.311	S	S	.	.			trans	-82.6	57.3	-173.9	-57.6	-55.1	0	0	0	112.1	T398 M449 R452 Y455	T398-Y400 HydrophobicContact CG2-CD2 4.28Å; T398-Y400 PolarHBondContact O-N 3.24Å; T398-Y400 PolarHBondContact OG1-N 2.95Å; Y400-M449 PolarHBondContact O-N 3.19Å; Y400-R452 HydrophobicContact CE1-CB 3.8Å; Y400-R452 HydrophobicContact CE1-CG 3.97Å; Y400-R452 HydrophobicContact CE2-CB 4.31Å; Y400-Y455 HydrophobicContact CD1-CD1 4.16Å; Y400-Y455 HydrophobicContact CD1-CG 4.16Å; Y400-Y455 HydrophobicContact CG-CG 4.44Å
401	V	96.4	Very high	82.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	133.3	-177.9	-174.2	0	0	0	0	111.3	D399 I447 M448 Y455 S476 L478 F481	D399-V401 PolarHBondContact O-N 2.83Å; V401-I447 WeakPolarHBondContact CA-O 3.14Å; V401-M448 HydrophobicContact CG2-CE 4.38Å; V401-M448 HydrophobicContact CG2-CG 4.49Å; V401-Y455 WeakPolarHBondContact O-CE2 3.29Å; V401-S476 CarbonylContact O-C 3.41Å; V401-S476 PolarHBondContact O-N 2.72Å; V401-L478 HydrophobicContact CG2-CD2 3.92Å; V401-L478 HydrophobicContact CG2-CG 4.23Å; V401-F481 HydrophobicContact CG1-CB 3.86Å; V401-F481 HydrophobicContact CG1-CD2 4.04Å; V401-F481 HydrophobicContact CG1-CG 4.36Å; V401-F481 HydrophobicContact CG2-CB 4.3Å
402	L	96.9	Very high	84.4	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	157.8	170.3	64.7	79	0	0	0	112	V404 L420 F446 I447 M449 Y455 A458 V473 I474	L402-V404 HydrophobicContact CD1-CG2 3.44Å; L402-V404 VanDerWaalsContact CD1-CG2 3.44Å; L402-L420 HydrophobicContact CD1-CD1 4.41Å; L402-F446 CarbonylContact O-C 3.53Å; L402-F446 WeakPolarHBondContact O-CA 3.38Å; L402-I447 HydrophobicContact CD1-CB 3.86Å; L402-I447 HydrophobicContact CD1-CD1 3.98Å; L402-I447 HydrophobicContact CD1-CG1 4.11Å; L402-I447 HydrophobicContact CG-CB 4.25Å; L402-I447 PolarHBondContact N-O 2.97Å; L402-I447 PolarHBondContact O-N 3.11Å; L402-M449 HydrophobicContact CD2-CE 3.71Å; L402-M449 HydrophobicContact CG-CE 4.27Å; L402-Y455 HydrophobicContact CB-CE2 4.19Å; L402-Y455 HydrophobicContact CD2-CD2 4.4Å; L402-A458 HydrophobicContact CD2-CB 3.35Å; L402-V473 HydrophobicContact CD1-CG1 4.03Å; L402-V473 HydrophobicContact CD2-CG1 3.98Å; L402-V473 HydrophobicContact CG-CG1 4.44Å; L402-I474 CarbonylContact C-O 3.5Å; L402-I474 WeakPolarHBondContact CA-O 3.46Å; L402-I474 WeakPolarHBondContact CB-O 3.26Å
403	R	97	Very high	86.4	Confident	49 Å²	49	43.6 Å²	43.6	19%	0.185	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	122.8	171.3	-178.4	174.8	67.1	139	-11.5	109	Y444 V445 F446 I474	R403-Y444 HydrophobicContact CG-CD1 4.31Å; R403-V445 WeakPolarHBondContact CA-O 3.37Å; R403-F446 HydrophobicContact CB-CD1 4.11Å; R403-F446 HydrophobicContact CB-CE1 3.92Å; R403-F446 HydrophobicContact CB-CZ 4.29Å; R403-F446 HydrophobicContact CG-CD1 4.42Å; R403-F446 HydrophobicContact CG-CD2 4.5Å; R403-F446 HydrophobicContact CG-CE1 4.01Å; R403-F446 HydrophobicContact CG-CE2 4.1Å; R403-F446 HydrophobicContact CG-CZ 3.86Å; R403-I474 PolarHBondContact N-O 3.46Å; R403-I474 PolarHBondContact O-N 2.89Å
404	V	96.5	Very high	88.2	Confident	1 Å²	1	46 Å²	46	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	130.1	169.7	-168.1	0	0	0	0	108.7	L402 L406 L420 Y444 V445 I447 K472 V473	L402-V404 HydrophobicContact CD1-CG2 3.44Å; L402-V404 VanDerWaalsContact CD1-CG2 3.44Å; V404-L406 HydrophobicContact CG1-CD2 3.83Å; V404-L406 HydrophobicContact CG1-CG 3.88Å; V404-L420 HydrophobicContact CG2-CD1 3.88Å; V404-Y444 WeakPolarHBondContact O-CA 3.49Å; V404-V445 PolarHBondContact N-O 3.25Å; V404-V445 PolarHBondContact O-N 3.14Å; V404-I447 HydrophobicContact CG2-CD1 3.6Å; V404-I447 HydrophobicContact CG2-CG1 4.42Å; V404-K472 CarbonylContact C-O 3.56Å; V404-K472 WeakPolarHBondContact CA-O 3.29Å; V404-V473 HydrophobicContact CG1-CG2 4.46Å
405	C	95.9	Very high	89.6	Confident	14 Å²	14	46.3 Å²	46.3	10%	0.095	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	115.2	169.5	-53.1	0	0	0	0	108.5	Y444 K472 L604	C405-Y444 HydrophobicContact CB-CD1 4.36Å; C405-Y444 HydrophobicContact CB-CE1 4.28Å; C405-Y444 VanDerWaalsContact SG-CE1 3.59Å; C405-K472 HydrophobicContact CB-CB 3.97Å; C405-K472 PolarHBondContact N-O 3.47Å; C405-K472 PolarHBondContact O-N 3.4Å; C405-L604 HydrophobicContact CB-CD1 4Å
406	L	94.3	Very high	91.1	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.016	22%	0.221	C	C	.	.			trans	-119	158.2	175.6	-62.1	176.1	0	0	0	109.4	V404 A408 A411 T415 V416 V419 G443 V445 I471	V404-L406 HydrophobicContact CG1-CD2 3.83Å; V404-L406 HydrophobicContact CG1-CG 3.88Å; L406-A408 PolarHBondContact O-N 2.55Å; L406-A411 HydrophobicContact CB-CB 4.12Å; L406-T415 HydrophobicContact CD1-CG2 3.98Å; L406-T415 HydrophobicContact CD2-CG2 4.48Å; L406-V416 HydrophobicContact CD1-CG2 4.13Å; L406-V419 HydrophobicContact CD2-CG2 4.4Å; L406-G443 PolarHBondContact N-O 3.25Å; L406-G443 VanDerWaalsContact O-CA 3.25Å; L406-G443 WeakPolarHBondContact O-CA 3.25Å; L406-V445 HydrophobicContact CD1-CG2 4.21Å; L406-I471 HydrophobicContact CD2-CB 4.43Å; L406-I471 HydrophobicContact CD2-CG2 3.82Å
407	P	91.6	Very high	92.1	Very high	25 Å²	25	44.6 Å²	44.6	16%	0.162	23%	0.228	C	C	.	.			trans	-54.3	128.8	171.2	-24.2	35.2	0	0	0	110.1	P409 E410 A411 D469	P407-P409 VanDerWaalsContact C-CD 3.5Å; P407-E410 HydrophobicContact CB-CB 4.43Å; P407-E410 HydrophobicContact CB-CG 4.36Å; P407-E410 CarbonylContact O-C 3.56Å; P407-E410 WeakPolarHBondContact O-CA 3.21Å; P407-E410 PolarHBondContact O-N 3.3Å; P407-A411 PolarHBondContact O-N 3.11Å; P407-A411 VanDerWaalsContact O-N 3.11Å; P407-D469 HydrophobicContact CG-CB 3.81Å; P407-D469 VanDerWaalsContact CG-OD2 3.23Å; P407-D469 WeakPolarHBondContact CG-OD2 3.13Å
408	A	90.3	Very high	92.5	Very high	2 Å²	2	47.1 Å²	47.1	2%	0.017	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-45.9	-50.5	-173	0	0	0	0	0	114.8	L406 E410 A411 P441 Q605 A608	L406-A408 PolarHBondContact O-N 2.55Å; A408-E410 PolarHBondContact O-N 2.86Å; A408-E410 VanDerWaalsContact O-N 3.17Å; A408-A411 PolarHBondContact O-N 3.34Å; A408-P441 VanDerWaalsContact O-CG 3.26Å; A408-P441 WeakPolarHBondContact O-CG 3.21Å; A408-Q605 HydrophobicContact CB-CG 3.86Å; A408-A608 HydrophobicContact CB-CB 4.27Å
409	P	86.6	Confident	92.6	Very high	106 Å²	106	46.6 Å²	46.6	69%	0.688	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-68.4	-12.7	179.6	29.1	-37.2	0	0	0	114.8	P407	P407-P409 VanDerWaalsContact C-CD 3.5Å
410	E	87.7	Confident	92.7	Very high	61 Å²	61	40.9 Å²	40.9	29%	0.285	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-106.5	-6.5	-179.8	-57.4	-149.7	127.7	0	0	114	P407 A408 G412 T415 H466 K467	P407-E410 HydrophobicContact CB-CB 4.43Å; P407-E410 HydrophobicContact CB-CG 4.36Å; P407-E410 CarbonylContact O-C 3.56Å; P407-E410 WeakPolarHBondContact O-CA 3.21Å; P407-E410 PolarHBondContact O-N 3.3Å; A408-E410 PolarHBondContact O-N 2.86Å; A408-E410 VanDerWaalsContact O-N 3.17Å; E410-G412 PolarHBondContact O-N 3.38Å; E410-G412 VanDerWaalsContact O-N 3.09Å; E410-T415 WeakPolarHBondContact O-CB 3.41Å; E410-T415 PolarHBondContact O-OG1 3.24Å; E410-H466 IonicContact OE2-CD2 3.26Å; E410-K467 WeakPolarHBondContact OE1-CD 3.39Å; E410-K467 WeakPolarHBondContact OE1-CE 3.42Å; E410-K467 IonicContact OE1-NZ 2.78Å; E410-K467 PolarHBondContact OE1-NZ 3.13Å; E410-K467 WeakPolarHBondContact OE2-CD 3.38Å; E410-K467 IonicContact OE2-NZ 3.68Å; E410-K467 PolarHBondContact OE2-NZ 3.16Å
411	A	91.6	Very high	92.5	Very high	11 Å²	11	45.1 Å²	45.1	9%	0.091	22%	0.221	C	C	.	.			trans	-68.2	110.7	-178.4	0	0	0	0	0	110.7	L406 P407 A408 P441 V445	L406-A411 HydrophobicContact CB-CB 4.12Å; P407-A411 PolarHBondContact O-N 3.11Å; P407-A411 VanDerWaalsContact O-N 3.11Å; A408-A411 PolarHBondContact O-N 3.34Å; A411-P441 HydrophobicContact CB-CB 4.17Å; A411-V445 HydrophobicContact CB-CG2 4.18Å
412	G	91.5	Very high	92.2	Very high	20 Å²	20	47.8 Å²	47.8	21%	0.206	25%	0.249	C	C	.	.	S	Bend	trans	-170.7	162.7	-177.7	0	0	0	0	0	112	E410 K414 T415 V416	E410-G412 PolarHBondContact O-N 3.38Å; E410-G412 VanDerWaalsContact O-N 3.09Å; G412-K414 PolarHBondContact O-N 3.25Å; G412-T415 PolarHBondContact O-N 2.86Å; G412-V416 PolarHBondContact O-N 2.69Å; G412-V416 VanDerWaalsContact O-N 3.13Å
413	I	92.1	Very high	92.1	Very high	70 Å²	70	48.7 Å²	48.7	36%	0.359	25%	0.254	S	S	.	.	H	α-helix	trans	-57.9	-35.3	-173.2	-60	172.7	0	0	0	112.2	V416 F417 I431 V433	I413-V416 PolarHBondContact O-N 3.46Å; I413-F417 HydrophobicContact CG2-CD2 3.9Å; I413-F417 HydrophobicContact CG2-CE2 3.58Å; I413-F417 WeakPolarHBondContact O-CD2 3.44Å; I413-F417 PolarHBondContact O-N 3.09Å; I413-I431 HydrophobicContact CG1-CG2 4.1Å; I413-I431 HydrophobicContact CG2-CD1 4.1Å; I413-V433 HydrophobicContact CG1-CG2 4.09Å
414	K	91.6	Very high	91.8	Very high	170 Å²	170	52 Å²	52	74%	0.739	27%	0.272	S	S	*	.	H	α-helix	trans	-62.9	-52.4	177.1	-66.1	-178.4	-179.6	178.1	0	111.6	G412 V416 F417 E418	G412-K414 PolarHBondContact O-N 3.25Å; K414-V416 PolarHBondContact O-N 3.13Å; K414-F417 PolarHBondContact O-N 3.19Å; K414-E418 PolarHBondContact O-N 2.93Å
415	T	92.6	Very high	91.7	Very high	14 Å²	14	53 Å²	53	9%	0.086	28%	0.278	C	S	.	.	H	α-helix	trans	-56.6	-39.7	178.2	-40	0	0	0	0	111.2	L406 E410 G412 F417 E418 V419	L406-T415 HydrophobicContact CD1-CG2 3.98Å; L406-T415 HydrophobicContact CD2-CG2 4.48Å; E410-T415 WeakPolarHBondContact O-CB 3.41Å; E410-T415 PolarHBondContact O-OG1 3.24Å; G412-T415 PolarHBondContact O-N 2.86Å; T415-F417 PolarHBondContact O-N 3.17Å; T415-E418 PolarHBondContact O-N 2.7Å; T415-V419 HydrophobicContact CG2-CG2 4.4Å; T415-V419 VanDerWaalsContact O-CB 3.28Å; T415-V419 WeakPolarHBondContact O-CB 3.33Å; T415-V419 VanDerWaalsContact O-CG2 3.23Å; T415-V419 WeakPolarHBondContact O-CG2 3.37Å; T415-V419 PolarHBondContact O-N 3Å
416	V	92.5	Very high	91.5	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.012	27%	0.274	C	S	.	.	H	α-helix	trans	-58.4	-47.1	174	166.9	0	0	0	0	112.6	L406 G412 I413 K414 E418 V419 L420 I431 V445 I447	L406-V416 HydrophobicContact CD1-CG2 4.13Å; G412-V416 PolarHBondContact O-N 2.69Å; G412-V416 VanDerWaalsContact O-N 3.13Å; I413-V416 PolarHBondContact O-N 3.46Å; K414-V416 PolarHBondContact O-N 3.13Å; V416-E418 VanDerWaalsContact C-N 3.34Å; V416-V419 PolarHBondContact O-N 3.29Å; V416-L420 PolarHBondContact O-N 3.26Å; V416-I431 HydrophobicContact CG1-CD1 4.22Å; V416-V445 HydrophobicContact CG2-CB 4.1Å; V416-V445 HydrophobicContact CG2-CG1 3.74Å; V416-V445 HydrophobicContact CG2-CG2 4.23Å; V416-I447 HydrophobicContact CB-CD1 4.46Å; V416-I447 HydrophobicContact CG1-CD1 3.37Å; V416-I447 HydrophobicContact CG1-CG1 4.44Å; V416-I447 HydrophobicContact CG2-CD1 4.21Å
417	F	92	Very high	91.2	Very high	117 Å²	117	56.7 Å²	56.7	51%	0.513	30%	0.302	S	S	.	.	H	α-helix	trans	-72.6	-24.7	178.4	-73.9	-62.6	0	0	0	113.7	I413 K414 T415 R421 I431	I413-F417 HydrophobicContact CG2-CD2 3.9Å; I413-F417 HydrophobicContact CG2-CE2 3.58Å; I413-F417 WeakPolarHBondContact O-CD2 3.44Å; I413-F417 PolarHBondContact O-N 3.09Å; K414-F417 PolarHBondContact O-N 3.19Å; T415-F417 PolarHBondContact O-N 3.17Å; F417-R421 VanDerWaalsContact O-CG 3.27Å; F417-R421 WeakPolarHBondContact O-CG 3.2Å; F417-I431 HydrophobicContact CE1-CD1 4.29Å; F417-I431 HydrophobicContact CE2-CD1 3.72Å; F417-I431 HydrophobicContact CZ-CD1 3.56Å
418	E	90.9	Very high	90.8	Very high	92 Å²	92	64.8 Å²	64.8	43%	0.43	34%	0.335	S	S	.	.	H	α-helix	trans	-70.7	-38.9	170.4	-72.2	173.1	-163.1	0	0	112.1	K414 T415 V416 R421	K414-E418 PolarHBondContact O-N 2.93Å; T415-E418 PolarHBondContact O-N 2.7Å; V416-E418 VanDerWaalsContact C-N 3.34Å; E418-R421 PolarHBondContact O-NE 3.27Å
419	V	91.4	Very high	90.9	Very high	13 Å²	13	65.4 Å²	65.4	8%	0.079	34%	0.337	C	S	.	.	H	α-helix	trans	-81.3	-54.3	-176.3	166.1	0	0	0	0	112.2	L406 T415 V416 R421 F461 H466 I471	L406-V419 HydrophobicContact CD2-CG2 4.4Å; T415-V419 HydrophobicContact CG2-CG2 4.4Å; T415-V419 VanDerWaalsContact O-CB 3.28Å; T415-V419 WeakPolarHBondContact O-CB 3.33Å; T415-V419 VanDerWaalsContact O-CG2 3.23Å; T415-V419 WeakPolarHBondContact O-CG2 3.37Å; T415-V419 PolarHBondContact O-N 3Å; V416-V419 PolarHBondContact O-N 3.29Å; V419-R421 PolarHBondContact O-N 3.49Å; V419-F461 WeakPolarHBondContact O-CD1 3.43Å; V419-F461 WeakPolarHBondContact O-CE1 3.37Å; V419-H466 HydrophobicContact CG2-CB 4.4Å; V419-H466 WeakPolarHBondContact CG2-ND1 3.22Å; V419-I471 HydrophobicContact CG1-CD1 3.19Å
420	L	92.7	Very high	91.2	Very high	5 Å²	5	60.4 Å²	60.4	3%	0.026	30%	0.304	C	S	.	.	S	Bend	trans	-94	61.6	-177.2	-60.6	-174.9	0	0	0	111.2	L402 V404 V416 V423 I447 M449 A458 F461 V473	L402-L420 HydrophobicContact CD1-CD1 4.41Å; V404-L420 HydrophobicContact CG2-CD1 3.88Å; V416-L420 PolarHBondContact O-N 3.26Å; L420-V423 HydrophobicContact CB-CG2 3.94Å; L420-V423 WeakPolarHBondContact O-CG2 3.4Å; L420-I447 HydrophobicContact CD1-CD1 3.67Å; L420-M449 HydrophobicContact CD1-CE 4.24Å; L420-A458 HydrophobicContact CD1-CB 4.4Å; L420-F461 HydrophobicContact CD2-CB 3.55Å; L420-F461 HydrophobicContact CD2-CD1 4.27Å; L420-F461 HydrophobicContact CD2-CD2 3.85Å; L420-F461 HydrophobicContact CD2-CG 3.66Å; L420-V473 HydrophobicContact CD2-CG2 4.3Å
421	R	90.3	Very high	91.5	Very high	172 Å²	172	58.4 Å²	58.4	65%	0.649	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	134.7	-179.9	-76.3	179	170.9	162.3	1.7	112	F417 E418 V419 F461	F417-R421 VanDerWaalsContact O-CG 3.27Å; F417-R421 WeakPolarHBondContact O-CG 3.2Å; E418-R421 PolarHBondContact O-NE 3.27Å; V419-R421 PolarHBondContact O-N 3.49Å; R421-F461 WeakPolarHBondContact O-CZ 3.37Å
422	G	90.1	Very high	91.7	Very high	56 Å²	56	58.3 Å²	58.3	58%	0.577	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	22.5	173.6	0	0	0	0	0	115.4	R457	G422-R457 WeakPolarHBondContact O-CD 3.29Å; G422-R457 PolarHBondContact O-NH1 3.49Å
423	V	94.1	Very high	91.9	Very high	20 Å²	20	58 Å²	58	12%	0.121	29%	0.286	C	S	.	.			trans	-103.8	146.4	169.4	-50.3	0	0	0	0	110	L420 V425 M449 R457 A458 F461	L420-V423 HydrophobicContact CB-CG2 3.94Å; L420-V423 WeakPolarHBondContact O-CG2 3.4Å; V423-V425 HydrophobicContact CG2-CG2 4.08Å; V423-M449 HydrophobicContact CB-CE 4.32Å; V423-M449 HydrophobicContact CB-SD 4.18Å; V423-M449 HydrophobicContact CG2-CE 3.68Å; V423-M449 HydrophobicContact CG2-SD 3.88Å; V423-R457 HydrophobicContact CG1-CB 4.45Å; V423-R457 HydrophobicContact CG1-CG 4.17Å; V423-A458 HydrophobicContact CG1-CB 3.99Å; V423-F461 HydrophobicContact CG1-CE2 4.26Å
424	Q	92.4	Very high	92	Very high	117 Å²	117	54.7 Å²	54.7	55%	0.547	27%	0.269	S	S	.	.			trans	-94.9	112.8	177	-57.4	-178.3	21.5	0	0	111.1	M449 T450 S454	Q424-M449 WeakPolarHBondContact O-CA 3.5Å; Q424-M449 VanDerWaalsContact O-SD 3.37Å; Q424-T450 WeakPolarHBondContact CB-OG1 3.38Å; Q424-T450 PolarHBondContact O-N 3.16Å; Q424-T450 PolarHBondContact O-OG1 3.06Å; Q424-T450 PolarHBondContact OE1-OG1 3.49Å; Q424-S454 WeakPolarHBondContact CB-OG 3.28Å; Q424-S454 VanDerWaalsContact N-CB 3.34Å; Q424-S454 PolarHBondContact N-OG 3.35Å
425	V	93.3	Very high	92.2	Very high	23 Å²	23	47.9 Å²	47.9	14%	0.139	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-99.7	147.9	178.4	-175.8	0	0	0	0	109.9	V423 I431 I447 M448 M449	V423-V425 HydrophobicContact CG2-CG2 4.08Å; V425-I431 HydrophobicContact CG1-CD1 4.14Å; V425-I431 HydrophobicContact CG1-CG1 3.59Å; V425-I447 HydrophobicContact CB-CG2 4.29Å; V425-I447 HydrophobicContact CG1-CG2 3.57Å; V425-I447 HydrophobicContact CG2-CG2 3.75Å; V425-M448 WeakPolarHBondContact CG1-O 3.22Å; V425-M449 HydrophobicContact CG2-CE 4.14Å; V425-M449 HydrophobicContact CG2-SD 3.8Å
426	V	91.9	Very high	92.2	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.018	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-59.5	120.8	174.8	174.3	0	0	0	0	109.5	G396 W429 G430 M448 T450	G396-V426 WeakPolarHBondContact O-CG1 3.31Å; G396-V426 WeakPolarHBondContact O-CG2 3.38Å; V426-W429 HydrophobicContact CG1-CD2 4.09Å; V426-W429 HydrophobicContact CG1-CH2 4.12Å; V426-W429 HydrophobicContact CG1-CZ2 3.59Å; V426-G430 WeakPolarHBondContact O-CA 3.38Å; V426-G430 PolarHBondContact O-N 3.29Å; V426-M448 HydrophobicContact CG2-CB 4.22Å; V426-M448 HydrophobicContact CG2-CG 3.8Å; V426-M448 WeakPolarHBondContact CG2-O 3.49Å; V426-M448 HydrophobicContact CG2-SD 4.07Å; V426-M448 PolarHBondContact N-O 3.45Å; V426-T450 HydrophobicContact CG2-CG2 3.96Å
427	P	87.6	Confident	92.2	Very high	92 Å²	92	52.7 Å²	52.7	60%	0.597	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	151.9	-167.7	26.3	-34.8	0	0	0	112.6	W429	P427-W429 VanDerWaalsContact O-CD1 3.22Å; P427-W429 PolarHBondContact O-N 3.3Å
428	K	84.7	Confident	92.1	Very high	195 Å²	195	49.7 Å²	49.7	85%	0.848	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	-41.7	179.2	-53	178.1	-180	178.4	0	116.5
429	W	90.9	Very high	92.1	Very high	15 Å²	15	51.7 Å²	51.7	6%	0.057	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.6	-8.1	-171.3	63.4	-89.7	0	0	0	115	E397 V426 P427 I431 M448 F481 F489 K492 C493 P494 V497	E397-W429 HydrophobicContact CB-CH2 4.36Å; V426-W429 HydrophobicContact CG1-CD2 4.09Å; V426-W429 HydrophobicContact CG1-CH2 4.12Å; V426-W429 HydrophobicContact CG1-CZ2 3.59Å; P427-W429 VanDerWaalsContact O-CD1 3.22Å; P427-W429 PolarHBondContact O-N 3.3Å; W429-I431 PolarHBondContact O-N 2.75Å; W429-I431 VanDerWaalsContact O-N 3.08Å; W429-M448 HydrophobicContact CH2-CE 4.24Å; W429-M448 HydrophobicContact CH2-SD 3.67Å; W429-M448 HydrophobicContact CZ3-CE 3.83Å; W429-M448 HydrophobicContact CZ3-SD 3.7Å; W429-F481 HydrophobicContact CE3-CE1 4.36Å; W429-F481 HydrophobicContact CE3-CZ 4.41Å; W429-F481 HydrophobicContact CZ3-CE1 4.2Å; W429-F489 HydrophobicContact CB-CE2 4.17Å; W429-F489 HydrophobicContact CE3-CE2 4.14Å; W429-F489 HydrophobicContact CE3-CZ 4.21Å; W429-F489 WeakPolarHBondContact O-CE2 3.45Å; W429-K492 HydrophobicContact CB-CB 4.48Å; W429-C493 HydrophobicContact CB-CB 4.35Å; W429-P494 HydrophobicContact CZ2-CG 4.45Å; W429-V497 HydrophobicContact CH2-CG2 4.01Å; W429-V497 HydrophobicContact CZ2-CG2 4.24Å; W429-V497 HydrophobicContact CZ3-CG1 4.35Å; W429-V497 HydrophobicContact CZ3-CG2 4.27Å
430	G	92.9	Very high	92.2	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.263	C	S	.	.	S	Bend	trans	-72	5.7	-178.5	0	0	0	0	0	116.6	V426 I447 M448	V426-G430 WeakPolarHBondContact O-CA 3.38Å; V426-G430 PolarHBondContact O-N 3.29Å; G430-I447 CarbonylContact O-C 3.6Å; G430-I447 WeakPolarHBondContact O-CA 3.39Å; G430-M448 PolarHBondContact O-N 3.2Å
431	I	94.6	Very high	92.2	Very high	19 Å²	19	53.7 Å²	53.7	10%	0.097	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.1	173.7	-55.2	177.4	0	0	0	107.5	I413 V416 F417 V425 W429 V445 F446 I447	I413-I431 HydrophobicContact CG1-CG2 4.1Å; I413-I431 HydrophobicContact CG2-CD1 4.1Å; V416-I431 HydrophobicContact CG1-CD1 4.22Å; F417-I431 HydrophobicContact CE1-CD1 4.29Å; F417-I431 HydrophobicContact CE2-CD1 3.72Å; F417-I431 HydrophobicContact CZ-CD1 3.56Å; V425-I431 HydrophobicContact CG1-CD1 4.14Å; V425-I431 HydrophobicContact CG1-CG1 3.59Å; W429-I431 PolarHBondContact O-N 2.75Å; W429-I431 VanDerWaalsContact O-N 3.08Å; I431-V445 HydrophobicContact CG2-CG1 3.65Å; I431-F446 WeakPolarHBondContact CA-O 3.22Å; I431-I447 HydrophobicContact CG1-CG2 4.32Å; I431-I447 HydrophobicContact CG2-CG1 4.49Å
432	R	95.1	Very high	92.5	Very high	9 Å²	9	45.5 Å²	45.5	3%	0.034	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.6	171.6	-58.1	-169.5	73.3	-168.2	2.3	109.9	V445 F446 F481 Y482 V484 D486 F489	R432-V445 CarbonylContact O-C 3.57Å; R432-V445 WeakPolarHBondContact O-CA 3.41Å; R432-V445 WeakPolarHBondContact O-CG1 3.45Å; R432-F446 PolarHBondContact N-O 2.95Å; R432-F446 PolarHBondContact O-N 3Å; R432-F481 HydrophobicContact CB-CE2 4.5Å; R432-F481 WeakPolarHBondContact CD-O 3.35Å; R432-F481 HydrophobicContact CG-CE1 4.19Å; R432-F481 HydrophobicContact CG-CE2 3.84Å; R432-F481 HydrophobicContact CG-CZ 3.63Å; R432-F481 PolarHBondContact NH1-O 2.93Å; R432-Y482 PolarHBondContact NH1-O 3.25Å; R432-V484 HydrophobicContact CB-CB 4.39Å; R432-V484 HydrophobicContact CB-CG1 3.91Å; R432-V484 PolarHBondContact NH1-O 3.2Å; R432-V484 VanDerWaalsContact NH1-O 3.12Å; R432-V484 PolarHBondContact NH2-O 2.9Å; R432-D486 VanDerWaalsContact CA-OD2 3.22Å; R432-D486 WeakPolarHBondContact CA-OD2 3.47Å; R432-D486 HydrophobicContact CB-CB 4.2Å; R432-F489 HydrophobicContact CG-CD2 3.58Å; R432-F489 HydrophobicContact CG-CE2 3.84Å; R432-F489 HydrophobicContact CG-CG 4.31Å
433	V	95.7	Very high	92.8	Very high	14 Å²	14	42.9 Å²	42.9	9%	0.085	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	122.5	173.3	179.9	0	0	0	0	106.9	I413 E435 P441 V445 D486	I413-V433 HydrophobicContact CG1-CG2 4.09Å; V433-E435 PolarHBondContact O-N 3.2Å; V433-P441 HydrophobicContact CG1-CB 4.33Å; V433-V445 HydrophobicContact CG1-CG2 4.41Å; V433-V445 HydrophobicContact CG2-CG1 4.08Å; V433-V445 HydrophobicContact CG2-CG2 4.28Å; V433-D486 PolarHBondContact N-OD2 3.16Å; V433-D486 WeakPolarHBondContact O-CB 3.5Å
434	E	95.6	Very high	92.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	123.3	-179.1	-173.1	177.8	-165.1	0	0	110.3	T442 Y444 F446 V484 S485 P509 P510 H511	E434-T442 WeakPolarHBondContact CB-OG1 3.25Å; E434-T442 HydrophobicContact CG-CG2 4.05Å; E434-T442 WeakPolarHBondContact O-CB 3.46Å; E434-T442 WeakPolarHBondContact O-CG2 3.47Å; E434-T442 PolarHBondContact O-N 2.88Å; E434-T442 PolarHBondContact O-OG1 3.37Å; E434-Y444 WeakPolarHBondContact CB-O 3.38Å; E434-Y444 PolarHBondContact N-O 3.31Å; E434-Y444 WeakPolarHBondContact OE2-CB 3.47Å; E434-Y444 WeakPolarHBondContact OE2-CD2 3.38Å; E434-F446 HydrophobicContact CB-CE2 4.33Å; E434-F446 WeakPolarHBondContact OE2-CE2 3.21Å; E434-V484 HydrophobicContact CB-CG1 3.79Å; E434-V484 HydrophobicContact CG-CG1 4.1Å; E434-S485 CarbonylContact C-O 3.59Å; E434-S485 WeakPolarHBondContact CA-O 3.48Å; E434-P509 WeakPolarHBondContact OE1-CB 3.45Å; E434-P510 WeakPolarHBondContact OE1-CD 3.32Å; E434-P510 VanDerWaalsContact OE1-N 3.15Å; E434-H511 IonicContact OE1-CE1 3.25Å; E434-H511 IonicContact OE1-CG 3.77Å; E434-H511 PolarHBondContact OE1-N 3.05Å; E434-H511 IonicContact OE1-ND1 4Å; E434-H511 PolarHBondContact OE1-ND1 3.15Å
435	E	94.5	Very high	93.1	Very high	27 Å²	27	36.9 Å²	36.9	13%	0.126	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	143.6	-176.4	-65	171	156.8	0	0	110.1	V433 R440 S485 T487	V433-E435 PolarHBondContact O-N 3.2Å; E435-R440 CarbonylContact C-O 3.49Å; E435-R440 WeakPolarHBondContact CA-O 3.09Å; E435-S485 PolarHBondContact N-O 3.28Å; E435-S485 VanDerWaalsContact O-CB 3.29Å; E435-S485 WeakPolarHBondContact O-CB 3.2Å; E435-S485 PolarHBondContact O-OG 3.46Å; E435-T487 WeakPolarHBondContact OE2-CB 3.47Å; E435-T487 WeakPolarHBondContact OE2-CG2 3.09Å; E435-T487 PolarHBondContact OE2-N 3.25Å; E435-T487 PolarHBondContact OE2-OG1 3.09Å
436	D	93.5	Very high	93.3	Very high	8 Å²	8	35.8 Å²	35.8	4%	0.043	18%	0.18	C	C	.	.			trans	-78.1	179.7	170.5	70.7	13.2	0	0	0	112.2	L438 Q439 R440 T442 Q605	D436-L438 PolarHBondContact O-N 3Å; D436-L438 WeakPolarHBondContact OD1-CA 3.24Å; D436-L438 WeakPolarHBondContact OD1-CB 3.38Å; D436-L438 PolarHBondContact OD1-N 3.05Å; D436-Q439 PolarHBondContact O-N 3.46Å; D436-Q439 PolarHBondContact OD1-N 3.39Å; D436-R440 PolarHBondContact N-O 3.43Å; D436-R440 WeakPolarHBondContact OD1-CB 3.31Å; D436-R440 PolarHBondContact OD1-N 3.24Å; D436-R440 IonicContact OD1-NE 2.71Å; D436-R440 IonicContact OD2-CZ 2.78Å; D436-R440 IonicContact OD2-NE 3.18Å; D436-R440 PolarHBondContact OD2-NE 3.06Å; D436-R440 IonicContact OD2-NH2 3.38Å; D436-R440 PolarHBondContact OD2-NH2 2.97Å; D436-T442 HydrophobicContact CB-CG2 4.36Å; D436-Q605 PolarHBondContact OD2-NE2 3.05Å
437	L	91.5	Very high	93.5	Very high	109 Å²	109	35.7 Å²	35.7	57%	0.571	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-11.7	178.8	-60.5	-179.9	0	0	0	114.2	T599 P600	L437-T599 HydrophobicContact CB-CG2 4.38Å; L437-P600 HydrophobicContact CD1-CG 4.49Å
438	L	90.5	Very high	93.8	Very high	54 Å²	54	31.3 Å²	31.3	28%	0.283	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	12.6	-179.9	-53.2	171.8	0	0	0	111.7	D436 R440 R597 T599	D436-L438 PolarHBondContact O-N 3Å; D436-L438 WeakPolarHBondContact OD1-CA 3.24Å; D436-L438 WeakPolarHBondContact OD1-CB 3.38Å; D436-L438 PolarHBondContact OD1-N 3.05Å; L438-R440 HydrophobicContact CB-CG 4.19Å; L438-R440 PolarHBondContact O-N 2.75Å; L438-R597 VanDerWaalsContact CD2-NH1 3.26Å; L438-T599 HydrophobicContact CD1-CG2 3.76Å; L438-T599 HydrophobicContact CG-CG2 3.94Å
439	Q	91.8	Very high	94.3	Very high	134 Å²	134	22 Å²	22	63%	0.626	11%	0.11	S	C	*	.	S	Bend	trans	59.3	28.1	-177.3	-56.8	176.7	2.3	0	0	113.1	D436 T487	D436-Q439 PolarHBondContact O-N 3.46Å; D436-Q439 PolarHBondContact OD1-N 3.39Å; Q439-T487 HydrophobicContact CG-CG2 4.06Å
440	R	92	Very high	94.4	Very high	19 Å²	19	23.6 Å²	23.6	7%	0.072	12%	0.121	C	C	.	.			trans	-91.9	137.6	173.6	-54	176.6	-58.2	179.3	7.1	109	E435 D436 L438 T442 E518 D554 S556	E435-R440 CarbonylContact C-O 3.49Å; E435-R440 WeakPolarHBondContact CA-O 3.09Å; D436-R440 PolarHBondContact N-O 3.43Å; D436-R440 WeakPolarHBondContact OD1-CB 3.31Å; D436-R440 PolarHBondContact OD1-N 3.24Å; D436-R440 IonicContact OD1-NE 2.71Å; D436-R440 IonicContact OD2-CZ 2.78Å; D436-R440 IonicContact OD2-NE 3.18Å; D436-R440 PolarHBondContact OD2-NE 3.06Å; D436-R440 IonicContact OD2-NH2 3.38Å; D436-R440 PolarHBondContact OD2-NH2 2.97Å; L438-R440 HydrophobicContact CB-CG 4.19Å; L438-R440 PolarHBondContact O-N 2.75Å; R440-T442 PolarHBondContact O-N 3.41Å; R440-E518 IonicContact CZ-OE2 3.71Å; R440-E518 IonicContact NH1-OE1 3.54Å; R440-E518 IonicContact NH1-OE2 3.72Å; R440-E518 PolarHBondContact NH1-OE2 3.41Å; R440-E518 IonicContact NH2-OE2 2.83Å; R440-E518 PolarHBondContact NH2-OE2 2.88Å; R440-D554 IonicContact NH1-OD2 2.93Å; R440-S556 PolarHBondContact NH1-OG 2.9Å
441	P	94.3	Very high	94.4	Very high	42 Å²	42	25.7 Å²	25.7	27%	0.273	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	127.3	178.3	25	-34	0	0	0	111.1	A408 A411 V433 G443	A408-P441 VanDerWaalsContact O-CG 3.26Å; A408-P441 WeakPolarHBondContact O-CG 3.21Å; A411-P441 HydrophobicContact CB-CB 4.17Å; V433-P441 HydrophobicContact CG1-CB 4.33Å; P441-G443 VanDerWaalsContact C-N 3.25Å; P441-G443 PolarHBondContact O-N 3.41Å
442	T	95.9	Very high	94.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-13.6	179.8	61.1	0	0	0	0	113.3	E434 D436 R440 Y444 H511 S602	E434-T442 WeakPolarHBondContact CB-OG1 3.25Å; E434-T442 HydrophobicContact CG-CG2 4.05Å; E434-T442 WeakPolarHBondContact O-CB 3.46Å; E434-T442 WeakPolarHBondContact O-CG2 3.47Å; E434-T442 PolarHBondContact O-N 2.88Å; E434-T442 PolarHBondContact O-OG1 3.37Å; D436-T442 HydrophobicContact CB-CG2 4.36Å; R440-T442 PolarHBondContact O-N 3.41Å; T442-Y444 PolarHBondContact OG1-N 2.94Å; T442-H511 HydrophobicContact CG2-CB 4.27Å; T442-S602 WeakPolarHBondContact O-CB 3.33Å; T442-S602 PolarHBondContact O-OG 3.44Å
443	G	95.3	Very high	94.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	92.9	-13	-168.2	0	0	0	0	0	114.1	L406 P441	L406-G443 PolarHBondContact N-O 3.25Å; L406-G443 VanDerWaalsContact O-CA 3.25Å; L406-G443 WeakPolarHBondContact O-CA 3.25Å; P441-G443 VanDerWaalsContact C-N 3.25Å; P441-G443 PolarHBondContact O-N 3.41Å
444	Y	96.9	Very high	94.3	Very high	12 Å²	12	36.2 Å²	36.2	5%	0.047	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	131.9	176.1	-59.6	-43.3	0	0	0	111.8	R403 V404 C405 E434 T442 H511 D514 L604	R403-Y444 HydrophobicContact CG-CD1 4.31Å; V404-Y444 WeakPolarHBondContact O-CA 3.49Å; C405-Y444 HydrophobicContact CB-CD1 4.36Å; C405-Y444 HydrophobicContact CB-CE1 4.28Å; C405-Y444 VanDerWaalsContact SG-CE1 3.59Å; E434-Y444 WeakPolarHBondContact CB-O 3.38Å; E434-Y444 PolarHBondContact N-O 3.31Å; E434-Y444 WeakPolarHBondContact OE2-CB 3.47Å; E434-Y444 WeakPolarHBondContact OE2-CD2 3.38Å; T442-Y444 PolarHBondContact OG1-N 2.94Å; Y444-H511 HydrophobicContact CD2-CB 4.09Å; Y444-H511 HydrophobicContact CE2-CB 4.14Å; Y444-D514 WeakPolarHBondContact CE2-OD2 3.23Å; Y444-D514 PolarHBondContact OH-OD1 3.46Å; Y444-D514 PolarHBondContact OH-OD2 2.85Å; Y444-L604 HydrophobicContact CD1-CD1 3.7Å; Y444-L604 HydrophobicContact CE1-CD1 3.32Å; Y444-L604 HydrophobicContact CE1-CG 4.01Å
445	V	96.9	Very high	94.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	121.9	174.7	-169.7	0	0	0	0	109.3	R403 V404 L406 A411 V416 I431 R432 V433 I447	R403-V445 WeakPolarHBondContact CA-O 3.37Å; V404-V445 PolarHBondContact N-O 3.25Å; V404-V445 PolarHBondContact O-N 3.14Å; L406-V445 HydrophobicContact CD1-CG2 4.21Å; A411-V445 HydrophobicContact CB-CG2 4.18Å; V416-V445 HydrophobicContact CG2-CB 4.1Å; V416-V445 HydrophobicContact CG2-CG1 3.74Å; V416-V445 HydrophobicContact CG2-CG2 4.23Å; I431-V445 HydrophobicContact CG2-CG1 3.65Å; R432-V445 CarbonylContact O-C 3.57Å; R432-V445 WeakPolarHBondContact O-CA 3.41Å; R432-V445 WeakPolarHBondContact O-CG1 3.45Å; V433-V445 HydrophobicContact CG1-CG2 4.41Å; V433-V445 HydrophobicContact CG2-CG1 4.08Å; V433-V445 HydrophobicContact CG2-CG2 4.28Å; V445-I447 HydrophobicContact CG1-CG1 4.26Å
446	F	96.9	Very high	94.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	132.2	-178.8	-68.7	-103.7	0	0	0	109.9	L402 R403 I431 R432 E434 S476 E480 F481 V484 P510	L402-F446 CarbonylContact O-C 3.53Å; L402-F446 WeakPolarHBondContact O-CA 3.38Å; R403-F446 HydrophobicContact CB-CD1 4.11Å; R403-F446 HydrophobicContact CB-CE1 3.92Å; R403-F446 HydrophobicContact CB-CZ 4.29Å; R403-F446 HydrophobicContact CG-CD1 4.42Å; R403-F446 HydrophobicContact CG-CD2 4.5Å; R403-F446 HydrophobicContact CG-CE1 4.01Å; R403-F446 HydrophobicContact CG-CE2 4.1Å; R403-F446 HydrophobicContact CG-CZ 3.86Å; I431-F446 WeakPolarHBondContact CA-O 3.22Å; R432-F446 PolarHBondContact N-O 2.95Å; R432-F446 PolarHBondContact O-N 3Å; E434-F446 HydrophobicContact CB-CE2 4.33Å; E434-F446 WeakPolarHBondContact OE2-CE2 3.21Å; F446-S476 WeakPolarHBondContact CD1-OG 3.26Å; F446-S476 VanDerWaalsContact CE1-OG 3.29Å; F446-S476 WeakPolarHBondContact CE1-OG 3.3Å; F446-E480 HydrophobicContact CD1-CB 4.46Å; F446-E480 HydrophobicContact CE1-CB 3.88Å; F446-F481 HydrophobicContact CB-CD2 3.93Å; F446-F481 HydrophobicContact CB-CE2 4.5Å; F446-V484 HydrophobicContact CB-CG2 3.97Å; F446-V484 HydrophobicContact CD1-CG2 4.1Å; F446-V484 HydrophobicContact CD2-CG1 4.41Å; F446-V484 HydrophobicContact CD2-CG2 3.31Å; F446-V484 HydrophobicContact CE1-CG2 4.42Å; F446-V484 HydrophobicContact CE2-CG2 3.7Å; F446-V484 HydrophobicContact CG-CG2 3.53Å; F446-V484 HydrophobicContact CZ-CG2 4.22Å; F446-P510 HydrophobicContact CE1-CG 4.33Å; F446-P510 HydrophobicContact CE2-CB 4.23Å; F446-P510 HydrophobicContact CE2-CG 4.2Å; F446-P510 HydrophobicContact CZ-CB 3.62Å; F446-P510 HydrophobicContact CZ-CG 3.68Å
447	I	96.3	Very high	94.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	124.6	-170.2	-50.5	176.3	0	0	0	109.9	V401 L402 V404 V416 L420 V425 G430 I431 V445 M449	V401-I447 WeakPolarHBondContact CA-O 3.14Å; L402-I447 HydrophobicContact CD1-CB 3.86Å; L402-I447 HydrophobicContact CD1-CD1 3.98Å; L402-I447 HydrophobicContact CD1-CG1 4.11Å; L402-I447 HydrophobicContact CG-CB 4.25Å; L402-I447 PolarHBondContact N-O 2.97Å; L402-I447 PolarHBondContact O-N 3.11Å; V404-I447 HydrophobicContact CG2-CD1 3.6Å; V404-I447 HydrophobicContact CG2-CG1 4.42Å; V416-I447 HydrophobicContact CB-CD1 4.46Å; V416-I447 HydrophobicContact CG1-CD1 3.37Å; V416-I447 HydrophobicContact CG1-CG1 4.44Å; V416-I447 HydrophobicContact CG2-CD1 4.21Å; L420-I447 HydrophobicContact CD1-CD1 3.67Å; V425-I447 HydrophobicContact CB-CG2 4.29Å; V425-I447 HydrophobicContact CG1-CG2 3.57Å; V425-I447 HydrophobicContact CG2-CG2 3.75Å; G430-I447 CarbonylContact O-C 3.6Å; G430-I447 WeakPolarHBondContact O-CA 3.39Å; I431-I447 HydrophobicContact CG1-CG2 4.32Å; I431-I447 HydrophobicContact CG2-CG1 4.49Å; V445-I447 HydrophobicContact CG1-CG1 4.26Å; I447-M449 HydrophobicContact CB-CE 4.18Å; I447-M449 HydrophobicContact CG2-CE 3.47Å; I447-M449 VanDerWaalsContact CG2-CE 3.47Å; I447-M449 HydrophobicContact CG2-SD 4.13Å
448	M	95.4	Very high	94.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	119	173.9	-172.7	-177.7	-67.1	0	0	109.7	T398 V401 V425 V426 W429 G430 L478 F481	T398-M448 PolarHBondContact N-SD 2.79Å; T398-M448 WeakPolarHBondContact OG1-CG 3.29Å; V401-M448 HydrophobicContact CG2-CE 4.38Å; V401-M448 HydrophobicContact CG2-CG 4.49Å; V425-M448 WeakPolarHBondContact CG1-O 3.22Å; V426-M448 HydrophobicContact CG2-CB 4.22Å; V426-M448 HydrophobicContact CG2-CG 3.8Å; V426-M448 WeakPolarHBondContact CG2-O 3.49Å; V426-M448 HydrophobicContact CG2-SD 4.07Å; V426-M448 PolarHBondContact N-O 3.45Å; W429-M448 HydrophobicContact CH2-CE 4.24Å; W429-M448 HydrophobicContact CH2-SD 3.67Å; W429-M448 HydrophobicContact CZ3-CE 3.83Å; W429-M448 HydrophobicContact CZ3-SD 3.7Å; G430-M448 PolarHBondContact O-N 3.2Å; M448-L478 HydrophobicContact CE-CD2 3.39Å; M448-F481 HydrophobicContact CB-CE2 4.05Å; M448-F481 HydrophobicContact CB-CZ 4.3Å; M448-F481 HydrophobicContact CE-CD1 3.82Å; M448-F481 HydrophobicContact CE-CE1 3.78Å; M448-F481 HydrophobicContact CE-CG 4.24Å; M448-F481 HydrophobicContact CE-CZ 4.14Å
449	M	94.6	Very high	95	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-91.1	144.2	-178.2	-62.2	-65.4	173.4	0	0	111.6	T398 Y400 L402 L420 V423 Q424 V425 I447 T451 Y455 A458	T398-M449 WeakPolarHBondContact CG2-O 3.24Å; T398-M449 PolarHBondContact OG1-O 3.32Å; Y400-M449 PolarHBondContact O-N 3.19Å; L402-M449 HydrophobicContact CD2-CE 3.71Å; L402-M449 HydrophobicContact CG-CE 4.27Å; L420-M449 HydrophobicContact CD1-CE 4.24Å; V423-M449 HydrophobicContact CB-CE 4.32Å; V423-M449 HydrophobicContact CB-SD 4.18Å; V423-M449 HydrophobicContact CG2-CE 3.68Å; V423-M449 HydrophobicContact CG2-SD 3.88Å; Q424-M449 WeakPolarHBondContact O-CA 3.5Å; Q424-M449 VanDerWaalsContact O-SD 3.37Å; V425-M449 HydrophobicContact CG2-CE 4.14Å; V425-M449 HydrophobicContact CG2-SD 3.8Å; I447-M449 HydrophobicContact CB-CE 4.18Å; I447-M449 HydrophobicContact CG2-CE 3.47Å; I447-M449 VanDerWaalsContact CG2-CE 3.47Å; I447-M449 HydrophobicContact CG2-SD 4.13Å; M449-T451 VanDerWaalsContact C-N 3.29Å; M449-T451 PolarHBondContact O-N 3.32Å; M449-Y455 HydrophobicContact CG-CD2 4.46Å; M449-A458 HydrophobicContact CE-CB 3.76Å
450	T	92	Very high	95.1	Very high	48 Å²	48	37.4 Å²	37.4	29%	0.294	18%	0.184	S	C	.	.	S	Bend	trans	-71.8	-25.7	177.7	58.8	0	0	0	0	112.9	Q424 V426	Q424-T450 WeakPolarHBondContact CB-OG1 3.38Å; Q424-T450 PolarHBondContact O-N 3.16Å; Q424-T450 PolarHBondContact O-OG1 3.06Å; Q424-T450 PolarHBondContact OE1-OG1 3.49Å; V426-T450 HydrophobicContact CG2-CG2 3.96Å
451	T	92.9	Very high	95.1	Very high	44 Å²	44	37.3 Å²	37.3	27%	0.27	18%	0.184	S	C	.	.	S	Bend	trans	-140	145.6	-167.5	44.8	0	0	0	0	111.3	M449 D453 S454 Y455	M449-T451 VanDerWaalsContact C-N 3.29Å; M449-T451 PolarHBondContact O-N 3.32Å; T451-D453 VanDerWaalsContact C-N 3.29Å; T451-D453 PolarHBondContact O-N 3.22Å; T451-S454 PolarHBondContact O-N 2.61Å; T451-S454 VanDerWaalsContact OG1-CB 3.26Å; T451-S454 WeakPolarHBondContact OG1-CB 3.45Å; T451-S454 PolarHBondContact OG1-OG 2.72Å; T451-Y455 PolarHBondContact O-N 3.12Å; T451-Y455 VanDerWaalsContact O-N 3.09Å
452	R	94.5	Very high	95.1	Very high	147 Å²	147	38.4 Å²	38.4	56%	0.555	19%	0.187	S	C	*	.	H	α-helix	trans	-57	-41.7	174.8	-174	173.5	170.6	165.3	-2.3	112.3	Y400 S454 Y455 E456	Y400-R452 HydrophobicContact CE1-CB 3.8Å; Y400-R452 HydrophobicContact CE1-CG 3.97Å; Y400-R452 HydrophobicContact CE2-CB 4.31Å; R452-S454 VanDerWaalsContact C-N 3.31Å; R452-S454 PolarHBondContact O-N 3.01Å; R452-Y455 WeakPolarHBondContact O-CB 3.4Å; R452-Y455 PolarHBondContact O-N 3.15Å; R452-Y455 VanDerWaalsContact O-N 3.13Å; R452-E456 HydrophobicContact CG-CG 4.37Å; R452-E456 IonicContact CZ-OE1 3.36Å; R452-E456 VanDerWaalsContact CZ-OE1 3.26Å; R452-E456 IonicContact NE-OE1 3.51Å; R452-E456 PolarHBondContact NE-OE1 3.08Å; R452-E456 IonicContact NH2-OE1 2.68Å; R452-E456 PolarHBondContact NH2-OE1 3.27Å; R452-E456 PolarHBondContact O-N 2.64Å
453	D	94.9	Very high	94.9	Very high	113 Å²	113	43.2 Å²	43.2	60%	0.604	21%	0.213	S	C	*	.	H	α-helix	trans	-63.5	-37.8	179.7	-50.9	-29.5	0	0	0	111.9	T451 Y455 R457	T451-D453 VanDerWaalsContact C-N 3.29Å; T451-D453 PolarHBondContact O-N 3.22Å; D453-Y455 VanDerWaalsContact C-N 3.34Å; D453-R457 WeakPolarHBondContact O-CB 3.12Å; D453-R457 PolarHBondContact O-N 2.85Å
454	S	95.1	Very high	94.6	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-68.7	-35.3	175.3	-65.8	0	0	0	0	112	Q424 T451 R452 A458	Q424-S454 WeakPolarHBondContact CB-OG 3.28Å; Q424-S454 VanDerWaalsContact N-CB 3.34Å; Q424-S454 PolarHBondContact N-OG 3.35Å; T451-S454 PolarHBondContact O-N 2.61Å; T451-S454 VanDerWaalsContact OG1-CB 3.26Å; T451-S454 WeakPolarHBondContact OG1-CB 3.45Å; T451-S454 PolarHBondContact OG1-OG 2.72Å; R452-S454 VanDerWaalsContact C-N 3.31Å; R452-S454 PolarHBondContact O-N 3.01Å; S454-A458 VanDerWaalsContact O-CB 3.23Å; S454-A458 WeakPolarHBondContact O-CB 3.31Å; S454-A458 PolarHBondContact O-N 3.41Å
455	Y	96.6	Very high	94.2	Very high	28 Å²	28	53.4 Å²	53.4	11%	0.11	27%	0.266	C	S	.	.	H	α-helix	trans	-68.5	-49.1	175.7	175.2	-101.7	0	0	0	112.8	Y400 V401 L402 M449 T451 R452 D453 R457 A458 L459 K475	Y400-Y455 HydrophobicContact CD1-CD1 4.16Å; Y400-Y455 HydrophobicContact CD1-CG 4.16Å; Y400-Y455 HydrophobicContact CG-CG 4.44Å; V401-Y455 WeakPolarHBondContact O-CE2 3.29Å; L402-Y455 HydrophobicContact CB-CE2 4.19Å; L402-Y455 HydrophobicContact CD2-CD2 4.4Å; M449-Y455 HydrophobicContact CG-CD2 4.46Å; T451-Y455 PolarHBondContact O-N 3.12Å; T451-Y455 VanDerWaalsContact O-N 3.09Å; R452-Y455 WeakPolarHBondContact O-CB 3.4Å; R452-Y455 PolarHBondContact O-N 3.15Å; R452-Y455 VanDerWaalsContact O-N 3.13Å; D453-Y455 VanDerWaalsContact C-N 3.34Å; Y455-R457 VanDerWaalsContact C-N 3.34Å; Y455-R457 PolarHBondContact O-N 2.8Å; Y455-A458 PolarHBondContact O-N 2.98Å; Y455-L459 HydrophobicContact CD1-CD1 4.04Å; Y455-L459 HydrophobicContact CE1-CD1 3.66Å; Y455-L459 HydrophobicContact CE2-CD1 4.46Å; Y455-L459 WeakPolarHBondContact O-CG 3.37Å; Y455-L459 PolarHBondContact O-N 2.92Å; Y455-K475 WeakPolarHBondContact OH-CB 3.48Å; Y455-K475 VanDerWaalsContact OH-CG 3.29Å; Y455-K475 WeakPolarHBondContact OH-CG 3.34Å
456	E	96	Very high	93.7	Very high	93 Å²	93	54.9 Å²	54.9	44%	0.435	27%	0.272	S	S	.	.	H	α-helix	trans	-64.3	-40	175.6	-68.3	-176.5	-177.8	0	0	111	R452 A458 L459 S460	R452-E456 HydrophobicContact CG-CG 4.37Å; R452-E456 IonicContact CZ-OE1 3.36Å; R452-E456 VanDerWaalsContact CZ-OE1 3.26Å; R452-E456 IonicContact NE-OE1 3.51Å; R452-E456 PolarHBondContact NE-OE1 3.08Å; R452-E456 IonicContact NH2-OE1 2.68Å; R452-E456 PolarHBondContact NH2-OE1 3.27Å; R452-E456 PolarHBondContact O-N 2.64Å; E456-A458 PolarHBondContact O-N 3.26Å; E456-L459 PolarHBondContact O-N 2.85Å; E456-S460 PolarHBondContact O-N 3.42Å
457	R	95.5	Very high	93	Very high	130 Å²	130	61 Å²	61	49%	0.491	30%	0.299	S	S	.	.	H	α-helix	trans	-60.4	-44.6	171.2	-176.5	-178.7	-62.4	171.1	1.1	111.8	G422 V423 D453 Y455 L459 S460 F461	G422-R457 WeakPolarHBondContact O-CD 3.29Å; G422-R457 PolarHBondContact O-NH1 3.49Å; V423-R457 HydrophobicContact CG1-CB 4.45Å; V423-R457 HydrophobicContact CG1-CG 4.17Å; D453-R457 WeakPolarHBondContact O-CB 3.12Å; D453-R457 PolarHBondContact O-N 2.85Å; Y455-R457 VanDerWaalsContact C-N 3.34Å; Y455-R457 PolarHBondContact O-N 2.8Å; R457-L459 PolarHBondContact O-N 2.79Å; R457-S460 WeakPolarHBondContact O-CB 3.43Å; R457-S460 PolarHBondContact O-N 3.47Å; R457-S460 VanDerWaalsContact O-N 3.11Å; R457-S460 PolarHBondContact O-OG 2.98Å; R457-F461 HydrophobicContact CG-CE2 4.18Å; R457-F461 WeakPolarHBondContact O-CD2 3.43Å; R457-F461 WeakPolarHBondContact O-CE2 3.21Å
458	A	95.4	Very high	92.2	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-63	-40.1	179.2	0	0	0	0	0	112.7	L402 L420 V423 M449 S454 Y455 E456 S460 F461	L402-A458 HydrophobicContact CD2-CB 3.35Å; L420-A458 HydrophobicContact CD1-CB 4.4Å; V423-A458 HydrophobicContact CG1-CB 3.99Å; M449-A458 HydrophobicContact CE-CB 3.76Å; S454-A458 VanDerWaalsContact O-CB 3.23Å; S454-A458 WeakPolarHBondContact O-CB 3.31Å; S454-A458 PolarHBondContact O-N 3.41Å; Y455-A458 PolarHBondContact O-N 2.98Å; E456-A458 PolarHBondContact O-N 3.26Å; A458-S460 PolarHBondContact O-N 2.93Å; A458-F461 WeakPolarHBondContact O-CB 3.46Å; A458-F461 PolarHBondContact O-N 3.08Å
459	L	95.9	Very high	91.7	Very high	35 Å²	35	69 Å²	69	18%	0.183	36%	0.36	C	S	.	.	H	α-helix	trans	-60.7	-28.5	174	-69.7	166.4	0	0	0	112.6	Y455 E456 R457 F461 N462 V473 K475	Y455-L459 HydrophobicContact CD1-CD1 4.04Å; Y455-L459 HydrophobicContact CE1-CD1 3.66Å; Y455-L459 HydrophobicContact CE2-CD1 4.46Å; Y455-L459 WeakPolarHBondContact O-CG 3.37Å; Y455-L459 PolarHBondContact O-N 2.92Å; E456-L459 PolarHBondContact O-N 2.85Å; R457-L459 PolarHBondContact O-N 2.79Å; L459-F461 PolarHBondContact O-N 2.89Å; L459-N462 VanDerWaalsContact O-CB 3.29Å; L459-N462 WeakPolarHBondContact O-CB 3.42Å; L459-N462 PolarHBondContact O-N 2.81Å; L459-N462 VanDerWaalsContact O-N 3.11Å; L459-V473 HydrophobicContact CD2-CG1 4.35Å; L459-K475 HydrophobicContact CD1-CD 4.36Å; L459-K475 HydrophobicContact CD1-CG 3.99Å; L459-K475 HydrophobicContact CD2-CG 3.75Å
460	S	94.1	Very high	91.5	Very high	72 Å²	72	73 Å²	73	50%	0.503	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-4.9	173.4	83.3	0	0	0	0	115.1	E456 R457 A458	E456-S460 PolarHBondContact O-N 3.42Å; R457-S460 WeakPolarHBondContact O-CB 3.43Å; R457-S460 PolarHBondContact O-N 3.47Å; R457-S460 VanDerWaalsContact O-N 3.11Å; R457-S460 PolarHBondContact O-OG 2.98Å; A458-S460 PolarHBondContact O-N 2.93Å
461	F	92.8	Very high	91.4	Very high	17 Å²	17	71 Å²	71	8%	0.075	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-3.4	170.3	-67.5	-102.3	0	0	0	113.1	V419 L420 R421 V423 R457 A458 L459 R464 I471 V473	V419-F461 WeakPolarHBondContact O-CD1 3.43Å; V419-F461 WeakPolarHBondContact O-CE1 3.37Å; L420-F461 HydrophobicContact CD2-CB 3.55Å; L420-F461 HydrophobicContact CD2-CD1 4.27Å; L420-F461 HydrophobicContact CD2-CD2 3.85Å; L420-F461 HydrophobicContact CD2-CG 3.66Å; R421-F461 WeakPolarHBondContact O-CZ 3.37Å; V423-F461 HydrophobicContact CG1-CE2 4.26Å; R457-F461 HydrophobicContact CG-CE2 4.18Å; R457-F461 WeakPolarHBondContact O-CD2 3.43Å; R457-F461 WeakPolarHBondContact O-CE2 3.21Å; A458-F461 WeakPolarHBondContact O-CB 3.46Å; A458-F461 PolarHBondContact O-N 3.08Å; L459-F461 PolarHBondContact O-N 2.89Å; F461-R464 WeakPolarHBondContact O-CG 3.49Å; F461-R464 PolarHBondContact O-N 2.88Å; F461-I471 HydrophobicContact CB-CD1 4.39Å; F461-I471 WeakPolarHBondContact O-CD1 3.48Å; F461-I471 WeakPolarHBondContact O-CG1 3.45Å; F461-V473 HydrophobicContact CB-CG2 4.26Å
462	N	93.4	Very high	91.5	Very high	64 Å²	64	74.2 Å²	74.2	34%	0.342	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	140.9	175.7	-171.3	41.3	0	0	0	111.8	L459 R464 K472 V473	L459-N462 VanDerWaalsContact O-CB 3.29Å; L459-N462 WeakPolarHBondContact O-CB 3.42Å; L459-N462 PolarHBondContact O-N 2.81Å; L459-N462 VanDerWaalsContact O-N 3.11Å; N462-R464 VanDerWaalsContact C-N 3.3Å; N462-R464 PolarHBondContact O-N 3.24Å; N462-K472 WeakPolarHBondContact OD1-CA 3.37Å; N462-V473 HydrophobicContact CB-CB 4.12Å; N462-V473 PolarHBondContact OD1-N 3.32Å; N462-V473 PolarHBondContact OD1-O 3.04Å
463	N	92.3	Very high	91.6	Very high	101 Å²	101	67.5 Å²	67.5	54%	0.54	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	23	-177.7	-58	-33.4	0	0	0	116.1	V470 I471	N463-V470 HydrophobicContact CB-CG1 4.11Å; N463-I471 VanDerWaalsContact CA-O 3.26Å; N463-I471 WeakPolarHBondContact CA-O 3.41Å; N463-I471 PolarHBondContact N-O 2.82Å
464	R	89.2	Confident	91.7	Very high	117 Å²	117	65.2 Å²	65.2	44%	0.442	34%	0.344	S	S	.	.			trans	-80.1	143.4	171.3	-71.1	-173.9	-173.5	-158.1	6.9	112.4	F461 N462 I471	F461-R464 WeakPolarHBondContact O-CG 3.49Å; F461-R464 PolarHBondContact O-N 2.88Å; N462-R464 VanDerWaalsContact C-N 3.3Å; N462-R464 PolarHBondContact O-N 3.24Å; R464-I471 HydrophobicContact CB-CD1 4.05Å; R464-I471 HydrophobicContact CB-CG1 4.22Å; R464-I471 WeakPolarHBondContact O-CG1 3.26Å; R464-I471 PolarHBondContact O-N 3.17Å
465	P	88.1	Confident	91.8	Very high	110 Å²	110	71.8 Å²	71.8	71%	0.714	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	135.1	171.2	29.9	-33.6	0	0	0	111.1	D469	P465-D469 CarbonylContact C-O 3.57Å; P465-D469 WeakPolarHBondContact CA-O 3.44Å
466	H	85.1	Confident	91.7	Very high	30 Å²	30	71 Å²	71	14%	0.139	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	115.4	170.1	-175.2	79.9	0	0	0	108.5	E410 V419 G468 D469 I471	E410-H466 IonicContact OE2-CD2 3.26Å; V419-H466 HydrophobicContact CG2-CB 4.4Å; V419-H466 WeakPolarHBondContact CG2-ND1 3.22Å; H466-G468 PolarHBondContact O-N 2.91Å; H466-G468 VanDerWaalsContact O-N 3.09Å; H466-D469 PolarHBondContact N-O 3.35Å; H466-D469 PolarHBondContact O-N 3.1Å; H466-D469 VanDerWaalsContact O-N 3.1Å; H466-I471 HydrophobicContact CB-CG2 3.71Å
467	K	82.7	Confident	91.6	Very high	128 Å²	128	70 Å²	70	56%	0.557	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	27.8	178	-59.5	167.4	-177.9	165.1	0	116.3	E410	E410-K467 WeakPolarHBondContact OE1-CD 3.39Å; E410-K467 WeakPolarHBondContact OE1-CE 3.42Å; E410-K467 IonicContact OE1-NZ 2.78Å; E410-K467 PolarHBondContact OE1-NZ 3.13Å; E410-K467 WeakPolarHBondContact OE2-CD 3.38Å; E410-K467 IonicContact OE2-NZ 3.68Å; E410-K467 PolarHBondContact OE2-NZ 3.16Å
468	G	80.6	Confident	91.5	Very high	77 Å²	77	65.3 Å²	65.3	79%	0.794	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.2	-23.6	178.5	0	0	0	0	0	113.9	H466	H466-G468 PolarHBondContact O-N 2.91Å; H466-G468 VanDerWaalsContact O-N 3.09Å
469	D	84	Confident	91.2	Very high	93 Å²	93	69.8 Å²	69.8	50%	0.497	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	160.3	173.8	-77.8	-48.3	0	0	0	112	P407 P465 H466	P407-D469 HydrophobicContact CG-CB 3.81Å; P407-D469 VanDerWaalsContact CG-OD2 3.23Å; P407-D469 WeakPolarHBondContact CG-OD2 3.13Å; P465-D469 CarbonylContact C-O 3.57Å; P465-D469 WeakPolarHBondContact CA-O 3.44Å; H466-D469 PolarHBondContact N-O 3.35Å; H466-D469 PolarHBondContact O-N 3.1Å; H466-D469 VanDerWaalsContact O-N 3.1Å
470	V	89.7	Confident	91.1	Very high	84 Å²	84	71.1 Å²	71.1	51%	0.509	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	116.2	177	177.2	0	0	0	0	109.6	N463	N463-V470 HydrophobicContact CB-CG1 4.11Å
471	I	91.8	Very high	91.1	Very high	4 Å²	4	67.7 Å²	67.7	2%	0.021	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-69.8	147.4	177.5	75	-176.1	0	0	0	110.4	L406 V419 F461 N463 R464 H466 V473	L406-I471 HydrophobicContact CD2-CB 4.43Å; L406-I471 HydrophobicContact CD2-CG2 3.82Å; V419-I471 HydrophobicContact CG1-CD1 3.19Å; F461-I471 HydrophobicContact CB-CD1 4.39Å; F461-I471 WeakPolarHBondContact O-CD1 3.48Å; F461-I471 WeakPolarHBondContact O-CG1 3.45Å; N463-I471 VanDerWaalsContact CA-O 3.26Å; N463-I471 WeakPolarHBondContact CA-O 3.41Å; N463-I471 PolarHBondContact N-O 2.82Å; R464-I471 HydrophobicContact CB-CD1 4.05Å; R464-I471 HydrophobicContact CB-CG1 4.22Å; R464-I471 WeakPolarHBondContact O-CG1 3.26Å; R464-I471 PolarHBondContact O-N 3.17Å; H466-I471 HydrophobicContact CB-CG2 3.71Å; I471-V473 HydrophobicContact CD1-CG2 4.39Å
472	K	94.9	Very high	91.1	Very high	113 Å²	113	68 Å²	68	49%	0.491	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.3	168.7	-59.9	179.9	-179	177.2	0	109.7	V404 C405 N462 I474	V404-K472 CarbonylContact C-O 3.56Å; V404-K472 WeakPolarHBondContact CA-O 3.29Å; C405-K472 HydrophobicContact CB-CB 3.97Å; C405-K472 PolarHBondContact N-O 3.47Å; C405-K472 PolarHBondContact O-N 3.4Å; N462-K472 WeakPolarHBondContact OD1-CA 3.37Å; K472-I474 HydrophobicContact CB-CD1 4.41Å; K472-I474 HydrophobicContact CB-CG1 4.35Å
473	V	96.2	Very high	91	Very high	5 Å²	5	66.1 Å²	66.1	3%	0.03	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	112.9	176.4	-171.4	0	0	0	0	107.4	L402 V404 L420 L459 F461 N462 I471	L402-V473 HydrophobicContact CD1-CG1 4.03Å; L402-V473 HydrophobicContact CD2-CG1 3.98Å; L402-V473 HydrophobicContact CG-CG1 4.44Å; V404-V473 HydrophobicContact CG1-CG2 4.46Å; L420-V473 HydrophobicContact CD2-CG2 4.3Å; L459-V473 HydrophobicContact CD2-CG1 4.35Å; F461-V473 HydrophobicContact CB-CG2 4.26Å; N462-V473 HydrophobicContact CB-CB 4.12Å; N462-V473 PolarHBondContact OD1-N 3.32Å; N462-V473 PolarHBondContact OD1-O 3.04Å; I471-V473 HydrophobicContact CD1-CG2 4.39Å
474	I	95.7	Very high	91.1	Very high	65 Å²	65	61.5 Å²	61.5	33%	0.333	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	141.5	-168.1	-50	176.5	0	0	0	108.5	L402 R403 K472	L402-I474 CarbonylContact C-O 3.5Å; L402-I474 WeakPolarHBondContact CA-O 3.46Å; L402-I474 WeakPolarHBondContact CB-O 3.26Å; R403-I474 PolarHBondContact N-O 3.46Å; R403-I474 PolarHBondContact O-N 2.89Å; K472-I474 HydrophobicContact CB-CD1 4.41Å; K472-I474 HydrophobicContact CB-CG1 4.35Å
475	K	97	Very high	91.2	Very high	142 Å²	142	57.6 Å²	57.6	62%	0.617	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	141	171.1	-60.2	-171.1	175.6	-179.4	0	109.8	Y455 L459	Y455-K475 WeakPolarHBondContact OH-CB 3.48Å; Y455-K475 VanDerWaalsContact OH-CG 3.29Å; Y455-K475 WeakPolarHBondContact OH-CG 3.34Å; L459-K475 HydrophobicContact CD1-CD 4.36Å; L459-K475 HydrophobicContact CD1-CG 3.99Å; L459-K475 HydrophobicContact CD2-CG 3.75Å
476	S	96.1	Very high	91.4	Very high	11 Å²	11	53 Å²	53	8%	0.077	30%	0.296	C	S	.	.			trans	-138.6	173.8	-178.6	179.7	0	0	0	0	109.6	V401 F446 E480	V401-S476 CarbonylContact O-C 3.41Å; V401-S476 PolarHBondContact O-N 2.72Å; F446-S476 WeakPolarHBondContact CD1-OG 3.26Å; F446-S476 VanDerWaalsContact CE1-OG 3.29Å; F446-S476 WeakPolarHBondContact CE1-OG 3.3Å; S476-E480 WeakPolarHBondContact CA-OE2 3.39Å; S476-E480 VanDerWaalsContact CB-OE2 3.3Å; S476-E480 WeakPolarHBondContact CB-OE2 3.35Å; S476-E480 PolarHBondContact OG-OE2 2.83Å
477	T	94	Very high	91.6	Very high	71 Å²	71	55.1 Å²	55.1	44%	0.436	31%	0.311	S	S	.	.			trans	-115	160.7	-176.5	67.3	0	0	0	0	112.5	S479 E480 F481	T477-S479 PolarHBondContact O-N 3.38Å; T477-E480 PolarHBondContact N-OE2 2.86Å; T477-E480 PolarHBondContact O-N 2.98Å; T477-E480 WeakPolarHBondContact OG1-CG 3.16Å; T477-E480 PolarHBondContact OG1-N 2.9Å; T477-E480 VanDerWaalsContact OG1-N 3.14Å; T477-F481 PolarHBondContact O-N 2.8Å
478	L	92.2	Very high	91.8	Very high	33 Å²	33	52.7 Å²	52.7	17%	0.173	30%	0.304	C	S	.	.	H	α-helix	trans	-56.9	-37.8	169.3	-82.3	176.4	0	0	0	112.6	T398 D399 V401 M448 E480 F481 Y482	T398-L478 WeakPolarHBondContact O-CD2 3.46Å; D399-L478 VanDerWaalsContact OD1-CD1 3.25Å; D399-L478 WeakPolarHBondContact OD1-CD1 3.47Å; V401-L478 HydrophobicContact CG2-CD2 3.92Å; V401-L478 HydrophobicContact CG2-CG 4.23Å; M448-L478 HydrophobicContact CE-CD2 3.39Å; L478-E480 PolarHBondContact O-N 2.96Å; L478-F481 WeakPolarHBondContact O-CB 3.39Å; L478-F481 PolarHBondContact O-N 3.18Å; L478-Y482 HydrophobicContact CB-CD2 4.5Å; L478-Y482 HydrophobicContact CB-CE2 4.14Å; L478-Y482 HydrophobicContact CD2-CE2 4.06Å; L478-Y482 WeakPolarHBondContact O-CD2 3.33Å; L478-Y482 PolarHBondContact O-N 3.39Å
479	S	90.3	Very high	92.3	Very high	93 Å²	93	49.1 Å²	49.1	65%	0.65	27%	0.267	S	S	*	.	H	α-helix	trans	-61.8	-44.5	177.7	-168	0	0	0	0	111.7	T477 Y482 S483	T477-S479 PolarHBondContact O-N 3.38Å; S479-Y482 PolarHBondContact O-N 2.72Å; S479-S483 WeakPolarHBondContact O-CB 3.34Å; S479-S483 PolarHBondContact O-N 2.95Å; S479-S483 VanDerWaalsContact O-N 3.08Å; S479-S483 PolarHBondContact O-OG 2.89Å
480	E	92.9	Very high	92.2	Very high	63 Å²	63	49.2 Å²	49.2	29%	0.294	27%	0.271	S	S	.	.	H	α-helix	trans	-61.9	-48.9	173.7	-71.1	172.7	136.9	0	0	110.6	F446 S476 T477 L478 Y482 S483 V484 P510	F446-E480 HydrophobicContact CD1-CB 4.46Å; F446-E480 HydrophobicContact CE1-CB 3.88Å; S476-E480 WeakPolarHBondContact CA-OE2 3.39Å; S476-E480 VanDerWaalsContact CB-OE2 3.3Å; S476-E480 WeakPolarHBondContact CB-OE2 3.35Å; S476-E480 PolarHBondContact OG-OE2 2.83Å; T477-E480 PolarHBondContact N-OE2 2.86Å; T477-E480 PolarHBondContact O-N 2.98Å; T477-E480 WeakPolarHBondContact OG1-CG 3.16Å; T477-E480 PolarHBondContact OG1-N 2.9Å; T477-E480 VanDerWaalsContact OG1-N 3.14Å; L478-E480 PolarHBondContact O-N 2.96Å; E480-Y482 VanDerWaalsContact C-N 3.27Å; E480-Y482 PolarHBondContact O-N 2.72Å; E480-S483 WeakPolarHBondContact CA-OG 3.32Å; E480-S483 PolarHBondContact O-N 2.66Å; E480-S483 PolarHBondContact O-OG 3.17Å; E480-V484 WeakPolarHBondContact O-CG2 2.91Å; E480-V484 PolarHBondContact O-N 3.18Å; E480-V484 VanDerWaalsContact O-N 3.15Å; E480-P510 HydrophobicContact CB-CG 4.47Å
481	F	94.1	Very high	91.9	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-53.9	-40.3	178.8	-175.1	-89.9	0	0	0	113.1	V401 W429 R432 F446 M448 T477 L478 F489	V401-F481 HydrophobicContact CG1-CB 3.86Å; V401-F481 HydrophobicContact CG1-CD2 4.04Å; V401-F481 HydrophobicContact CG1-CG 4.36Å; V401-F481 HydrophobicContact CG2-CB 4.3Å; W429-F481 HydrophobicContact CE3-CE1 4.36Å; W429-F481 HydrophobicContact CE3-CZ 4.41Å; W429-F481 HydrophobicContact CZ3-CE1 4.2Å; R432-F481 HydrophobicContact CB-CE2 4.5Å; R432-F481 WeakPolarHBondContact CD-O 3.35Å; R432-F481 HydrophobicContact CG-CE1 4.19Å; R432-F481 HydrophobicContact CG-CE2 3.84Å; R432-F481 HydrophobicContact CG-CZ 3.63Å; R432-F481 PolarHBondContact NH1-O 2.93Å; F446-F481 HydrophobicContact CB-CD2 3.93Å; F446-F481 HydrophobicContact CB-CE2 4.5Å; M448-F481 HydrophobicContact CB-CE2 4.05Å; M448-F481 HydrophobicContact CB-CZ 4.3Å; M448-F481 HydrophobicContact CE-CD1 3.82Å; M448-F481 HydrophobicContact CE-CE1 3.78Å; M448-F481 HydrophobicContact CE-CG 4.24Å; M448-F481 HydrophobicContact CE-CZ 4.14Å; T477-F481 PolarHBondContact O-N 2.8Å; L478-F481 WeakPolarHBondContact O-CB 3.39Å; L478-F481 PolarHBondContact O-N 3.18Å; F481-F489 HydrophobicContact CE1-CE2 4.1Å; F481-F489 HydrophobicContact CE1-CZ 4.07Å; F481-F489 HydrophobicContact CZ-CE2 4.25Å
482	Y	92	Very high	91.7	Very high	25 Å²	25	53.8 Å²	53.8	10%	0.098	30%	0.297	C	S	.	.	H	α-helix	trans	-75.7	-34.6	177.4	-64.5	-47.1	0	0	0	113	E397 R432 L478 S479 E480 V484 V497 L501	E397-Y482 WeakPolarHBondContact CG-OH 3.41Å; E397-Y482 PolarHBondContact OE1-OH 2.91Å; R432-Y482 PolarHBondContact NH1-O 3.25Å; L478-Y482 HydrophobicContact CB-CD2 4.5Å; L478-Y482 HydrophobicContact CB-CE2 4.14Å; L478-Y482 HydrophobicContact CD2-CE2 4.06Å; L478-Y482 WeakPolarHBondContact O-CD2 3.33Å; L478-Y482 PolarHBondContact O-N 3.39Å; S479-Y482 PolarHBondContact O-N 2.72Å; E480-Y482 VanDerWaalsContact C-N 3.27Å; E480-Y482 PolarHBondContact O-N 2.72Å; Y482-V484 VanDerWaalsContact C-N 3.26Å; Y482-V484 PolarHBondContact O-N 2.86Å; Y482-V497 HydrophobicContact CD1-CG1 4.38Å; Y482-V497 HydrophobicContact CE1-CG1 3.63Å; Y482-L501 HydrophobicContact CD1-CD2 4.13Å
483	S	91.9	Very high	91.3	Very high	23 Å²	23	49.1 Å²	49.1	16%	0.161	28%	0.278	C	S	.	.	H	α-helix	trans	-71.4	-10.7	175.6	66.9	0	0	0	0	115.4	S479 E480 S485 P510	S479-S483 WeakPolarHBondContact O-CB 3.34Å; S479-S483 PolarHBondContact O-N 2.95Å; S479-S483 VanDerWaalsContact O-N 3.08Å; S479-S483 PolarHBondContact O-OG 2.89Å; E480-S483 WeakPolarHBondContact CA-OG 3.32Å; E480-S483 PolarHBondContact O-N 2.66Å; E480-S483 PolarHBondContact O-OG 3.17Å; S483-S485 PolarHBondContact O-N 2.94Å; S483-P510 WeakPolarHBondContact OG-CD 3.2Å; S483-P510 WeakPolarHBondContact OG-CG 3.18Å
484	V	93.6	Very high	90.9	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.03	29%	0.286	C	S	.	.			trans	-55.9	133.6	176.7	176.8	0	0	0	0	111.3	R432 E434 F446 E480 Y482 D486 P510	R432-V484 HydrophobicContact CB-CB 4.39Å; R432-V484 HydrophobicContact CB-CG1 3.91Å; R432-V484 PolarHBondContact NH1-O 3.2Å; R432-V484 VanDerWaalsContact NH1-O 3.12Å; R432-V484 PolarHBondContact NH2-O 2.9Å; E434-V484 HydrophobicContact CB-CG1 3.79Å; E434-V484 HydrophobicContact CG-CG1 4.1Å; F446-V484 HydrophobicContact CB-CG2 3.97Å; F446-V484 HydrophobicContact CD1-CG2 4.1Å; F446-V484 HydrophobicContact CD2-CG1 4.41Å; F446-V484 HydrophobicContact CD2-CG2 3.31Å; F446-V484 HydrophobicContact CE1-CG2 4.42Å; F446-V484 HydrophobicContact CE2-CG2 3.7Å; F446-V484 HydrophobicContact CG-CG2 3.53Å; F446-V484 HydrophobicContact CZ-CG2 4.22Å; E480-V484 WeakPolarHBondContact O-CG2 2.91Å; E480-V484 PolarHBondContact O-N 3.18Å; E480-V484 VanDerWaalsContact O-N 3.15Å; Y482-V484 VanDerWaalsContact C-N 3.26Å; Y482-V484 PolarHBondContact O-N 2.86Å; V484-D486 HydrophobicContact CG1-CB 4.24Å; V484-D486 PolarHBondContact O-N 3.15Å; V484-P510 HydrophobicContact CG2-CG 4.32Å
485	S	92.1	Very high	90.4	Very high	35 Å²	35	51.2 Å²	51.2	25%	0.245	30%	0.296	C	S	.	.			trans	-79.8	99.3	164.6	39.1	0	0	0	0	109.9	E434 E435 S483	E434-S485 CarbonylContact C-O 3.59Å; E434-S485 WeakPolarHBondContact CA-O 3.48Å; E435-S485 PolarHBondContact N-O 3.28Å; E435-S485 VanDerWaalsContact O-CB 3.29Å; E435-S485 WeakPolarHBondContact O-CB 3.2Å; E435-S485 PolarHBondContact O-OG 3.46Å; S483-S485 PolarHBondContact O-N 2.94Å
486	D	92.2	Very high	89.8	Confident	12 Å²	12	48.8 Å²	48.8	6%	0.064	29%	0.287	C	S	.	.			trans	-133.6	106.8	170.8	178.8	-32.8	0	0	0	107	R432 V433 V484 N488 F489	R432-D486 VanDerWaalsContact CA-OD2 3.22Å; R432-D486 WeakPolarHBondContact CA-OD2 3.47Å; R432-D486 HydrophobicContact CB-CB 4.2Å; V433-D486 PolarHBondContact N-OD2 3.16Å; V433-D486 WeakPolarHBondContact O-CB 3.5Å; V484-D486 HydrophobicContact CG1-CB 4.24Å; V484-D486 PolarHBondContact O-N 3.15Å; D486-N488 PolarHBondContact O-N 3.4Å; D486-N488 WeakPolarHBondContact OD1-CA 3.34Å; D486-N488 WeakPolarHBondContact OD1-CB 3.29Å; D486-N488 PolarHBondContact OD1-N 3.01Å; D486-F489 HydrophobicContact CB-CB 4.09Å; D486-F489 WeakPolarHBondContact O-CB 3.41Å; D486-F489 PolarHBondContact O-N 2.84Å; D486-F489 PolarHBondContact OD1-N 2.67Å
487	T	89.4	Confident	89.4	Confident	75 Å²	75	48.2 Å²	48.2	46%	0.46	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.4	-176.3	53.4	0	0	0	0	113.3	E435 Q439	E435-T487 WeakPolarHBondContact OE2-CB 3.47Å; E435-T487 WeakPolarHBondContact OE2-CG2 3.09Å; E435-T487 PolarHBondContact OE2-N 3.25Å; E435-T487 PolarHBondContact OE2-OG1 3.09Å; Q439-T487 HydrophobicContact CG-CG2 4.06Å
488	N	86.7	Confident	89	Confident	77 Å²	77	46.7 Å²	46.7	41%	0.412	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	3.9	-177.8	-64.9	-85.3	0	0	0	112.9	D486 S491 K492	D486-N488 PolarHBondContact O-N 3.4Å; D486-N488 WeakPolarHBondContact OD1-CA 3.34Å; D486-N488 WeakPolarHBondContact OD1-CB 3.29Å; D486-N488 PolarHBondContact OD1-N 3.01Å; N488-S491 PolarHBondContact O-OG 3.05Å; N488-K492 VanDerWaalsContact CB-NZ 3.3Å; N488-K492 WeakPolarHBondContact O-CD 3.47Å; N488-K492 WeakPolarHBondContact O-CE 3.25Å; N488-K492 WeakPolarHBondContact O-CG 3.42Å; N488-K492 PolarHBondContact O-NZ 2.79Å
489	F	90.6	Very high	88.7	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.009	31%	0.305	C	S	.	.	S	Bend	trans	-76.2	-45.3	-177.7	-177.4	-107.4	0	0	0	112.9	W429 R432 F481 D486 S491 K492 C493 V497 L501	W429-F489 HydrophobicContact CB-CE2 4.17Å; W429-F489 HydrophobicContact CE3-CE2 4.14Å; W429-F489 HydrophobicContact CE3-CZ 4.21Å; W429-F489 WeakPolarHBondContact O-CE2 3.45Å; R432-F489 HydrophobicContact CG-CD2 3.58Å; R432-F489 HydrophobicContact CG-CE2 3.84Å; R432-F489 HydrophobicContact CG-CG 4.31Å; F481-F489 HydrophobicContact CE1-CE2 4.1Å; F481-F489 HydrophobicContact CE1-CZ 4.07Å; F481-F489 HydrophobicContact CZ-CE2 4.25Å; D486-F489 HydrophobicContact CB-CB 4.09Å; D486-F489 WeakPolarHBondContact O-CB 3.41Å; D486-F489 PolarHBondContact O-N 2.84Å; D486-F489 PolarHBondContact OD1-N 2.67Å; F489-S491 PolarHBondContact O-N 3.3Å; F489-S491 VanDerWaalsContact O-N 3.15Å; F489-K492 PolarHBondContact O-N 3.25Å; F489-C493 HydrophobicContact CD1-CB 4.04Å; F489-C493 HydrophobicContact CD2-CB 4.32Å; F489-C493 HydrophobicContact CE1-CB 3.54Å; F489-C493 HydrophobicContact CE2-CB 3.88Å; F489-C493 HydrophobicContact CG-CB 4.41Å; F489-C493 HydrophobicContact CZ-CB 3.47Å; F489-C493 VanDerWaalsContact CZ-CB 3.47Å; F489-C493 PolarHBondContact O-N 3.48Å; F489-V497 HydrophobicContact CE1-CG1 4.1Å; F489-V497 HydrophobicContact CZ-CG1 3.85Å; F489-L501 HydrophobicContact CD1-CD1 3.95Å; F489-L501 HydrophobicContact CD1-CD2 4.17Å; F489-L501 HydrophobicContact CE1-CD1 4.01Å; F489-L501 HydrophobicContact CE1-CD2 3.84Å; F489-L501 HydrophobicContact CE1-CG 4.28Å
490	T	83.3	Confident	88.4	Confident	95 Å²	95	53 Å²	53	58%	0.583	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-31.1	-174.1	-45.8	0	0	0	0	112.9
491	S	83.3	Confident	88.1	Confident	101 Å²	101	52 Å²	52	71%	0.706	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-10.7	176.8	58.4	0	0	0	0	114.5	N488 F489	N488-S491 PolarHBondContact O-OG 3.05Å; F489-S491 PolarHBondContact O-N 3.3Å; F489-S491 VanDerWaalsContact O-N 3.15Å
492	K	86	Confident	87.6	Confident	83 Å²	83	54.3 Å²	54.3	36%	0.361	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-28.5	-177.4	-62.4	171.6	-165.7	157.1	0	113.5	W429 N488 F489	W429-K492 HydrophobicContact CB-CB 4.48Å; N488-K492 VanDerWaalsContact CB-NZ 3.3Å; N488-K492 WeakPolarHBondContact O-CD 3.47Å; N488-K492 WeakPolarHBondContact O-CE 3.25Å; N488-K492 WeakPolarHBondContact O-CG 3.42Å; N488-K492 PolarHBondContact O-NZ 2.79Å; F489-K492 PolarHBondContact O-N 3.25Å
493	C	87.2	Confident	86.9	Confident	15 Å²	15	56.3 Å²	56.3	10%	0.101	32%	0.32	C	S	.	.	S	Bend	trans	-77.3	151.6	-174.9	73.9	0	0	0	0	112.7	W429 F489 V497	W429-C493 HydrophobicContact CB-CB 4.35Å; F489-C493 HydrophobicContact CD1-CB 4.04Å; F489-C493 HydrophobicContact CD2-CB 4.32Å; F489-C493 HydrophobicContact CE1-CB 3.54Å; F489-C493 HydrophobicContact CE2-CB 3.88Å; F489-C493 HydrophobicContact CG-CB 4.41Å; F489-C493 HydrophobicContact CZ-CB 3.47Å; F489-C493 VanDerWaalsContact CZ-CB 3.47Å; F489-C493 PolarHBondContact O-N 3.48Å; C493-V497 HydrophobicContact CB-CB 4.31Å; C493-V497 HydrophobicContact CB-CG1 4.38Å
494	P	87.2	Confident	85.9	Confident	30 Å²	30	60.8 Å²	60.8	20%	0.195	35%	0.348	C	S	.	.			trans	-61.8	150	171.6	-21.5	32.4	0	0	0	112.4	V394 W429 E496 V497 A498	V394-P494 HydrophobicContact CG1-CB 4.18Å; V394-P494 HydrophobicContact CG1-CG 4.32Å; W429-P494 HydrophobicContact CZ2-CG 4.45Å; P494-E496 WeakPolarHBondContact CB-OE2 3.35Å; P494-E496 PolarHBondContact O-N 3.12Å; P494-E496 VanDerWaalsContact O-N 3.11Å; P494-V497 HydrophobicContact CB-CG2 4.2Å; P494-V497 HydrophobicContact CG-CG2 4.05Å; P494-V497 PolarHBondContact O-N 2.67Å; P494-A498 PolarHBondContact O-N 3.49Å
495	P	86.1	Confident	84.6	Confident	85 Å²	85	68.2 Å²	68.2	55%	0.552	39%	0.388	S	S	*	.	H	α-helix	trans	-55.8	-29.7	178.3	-26	35.2	0	0	0	114.3	K499	P495-K499 WeakPolarHBondContact O-CG 3.1Å; P495-K499 PolarHBondContact O-N 2.95Å
496	E	85.3	Confident	83.4	Confident	90 Å²	90	73.9 Å²	73.9	42%	0.421	41%	0.41	S	S	.	.	H	α-helix	trans	-71.6	-33.9	177.5	-58.6	68.3	-146.9	0	0	111.8	V394 P494	V394-E496 HydrophobicContact CB-CB 4.36Å; V394-E496 HydrophobicContact CG1-CB 4Å; V394-E496 HydrophobicContact CG2-CB 3.4Å; V394-E496 VanDerWaalsContact CG2-CB 3.4Å; V394-E496 HydrophobicContact CG2-CG 4.36Å; P494-E496 WeakPolarHBondContact CB-OE2 3.35Å; P494-E496 PolarHBondContact O-N 3.12Å; P494-E496 VanDerWaalsContact O-N 3.11Å
497	V	87.2	Confident	82.7	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-75.3	-39.1	173.9	-175.5	0	0	0	0	110.5	V394 W429 Y482 F489 C493 P494 K499 K500 L501	V394-V497 HydrophobicContact CB-CG2 4.29Å; V394-V497 HydrophobicContact CG1-CG2 3.94Å; V394-V497 HydrophobicContact CG2-CG2 4.31Å; W429-V497 HydrophobicContact CH2-CG2 4.01Å; W429-V497 HydrophobicContact CZ2-CG2 4.24Å; W429-V497 HydrophobicContact CZ3-CG1 4.35Å; W429-V497 HydrophobicContact CZ3-CG2 4.27Å; Y482-V497 HydrophobicContact CD1-CG1 4.38Å; Y482-V497 HydrophobicContact CE1-CG1 3.63Å; F489-V497 HydrophobicContact CE1-CG1 4.1Å; F489-V497 HydrophobicContact CZ-CG1 3.85Å; C493-V497 HydrophobicContact CB-CB 4.31Å; C493-V497 HydrophobicContact CB-CG1 4.38Å; P494-V497 HydrophobicContact CB-CG2 4.2Å; P494-V497 HydrophobicContact CG-CG2 4.05Å; P494-V497 PolarHBondContact O-N 2.67Å; V497-K499 PolarHBondContact O-N 3.18Å; V497-K500 WeakPolarHBondContact O-CB 3.47Å; V497-K500 PolarHBondContact O-N 2.69Å; V497-L501 PolarHBondContact O-N 3.43Å
498	A	86	Confident	82.5	Confident	39 Å²	39	77.2 Å²	77.2	32%	0.322	42%	0.419	S	S	.	.	H	α-helix	trans	-57	-36.2	175.7	0	0	0	0	0	112.4	P494 K500 L501	P494-A498 PolarHBondContact O-N 3.49Å; A498-K500 VanDerWaalsContact C-N 3.28Å; A498-K500 PolarHBondContact O-N 3.46Å; A498-L501 PolarHBondContact O-N 3.24Å
499	K	85	Confident	82.8	Confident	171 Å²	171	74.4 Å²	74.4	74%	0.743	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-19.4	174.6	-69.6	166.5	-172.6	172.4	0	114.5	P495 V497	P495-K499 WeakPolarHBondContact O-CG 3.1Å; P495-K499 PolarHBondContact O-N 2.95Å; V497-K499 PolarHBondContact O-N 3.18Å
500	K	84.7	Confident	82.9	Confident	87 Å²	87	74.8 Å²	74.8	38%	0.378	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-10	177.8	-68.7	179.2	175.1	179.8	0	113.1	E397 V497 A498	E397-K500 IonicContact OE1-NZ 3.74Å; E397-K500 PolarHBondContact OE1-NZ 2.99Å; E397-K500 IonicContact OE2-NZ 2.87Å; E397-K500 PolarHBondContact OE2-NZ 3.33Å; V497-K500 WeakPolarHBondContact O-CB 3.47Å; V497-K500 PolarHBondContact O-N 2.69Å; A498-K500 VanDerWaalsContact C-N 3.28Å; A498-K500 PolarHBondContact O-N 3.46Å
501	L	85.7	Confident	83.4	Confident	42 Å²	42	70.3 Å²	70.3	22%	0.22	38%	0.381	C	S	.	.	S	Bend	trans	-67.5	135.8	178.1	-69.5	173.6	0	0	0	110.4	Y482 F489 V497 A498	Y482-L501 HydrophobicContact CD1-CD2 4.13Å; F489-L501 HydrophobicContact CD1-CD1 3.95Å; F489-L501 HydrophobicContact CD1-CD2 4.17Å; F489-L501 HydrophobicContact CE1-CD1 4.01Å; F489-L501 HydrophobicContact CE1-CD2 3.84Å; F489-L501 HydrophobicContact CE1-CG 4.28Å; V497-L501 PolarHBondContact O-N 3.43Å; A498-L501 PolarHBondContact O-N 3.24Å
502	P	84	Confident	84	Confident	48 Å²	48	66.7 Å²	66.7	31%	0.312	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-62.1	146.4	171.1	27.6	-34.5	0	0	0	110.2	S507	P502-S507 WeakPolarHBondContact CB-OG 3.39Å; P502-S507 WeakPolarHBondContact CG-OG 3.34Å
503	P	78.3	Confident	84.3	Confident	67 Å²	67	68.4 Å²	68.4	44%	0.435	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-63.4	147.6	171.6	25.6	-30	0	0	0	109.9	D505 Q506	P503-D505 PolarHBondContact O-N 2.84Å; P503-Q506 HydrophobicContact CG-CB 3.76Å; P503-Q506 VanDerWaalsContact CG-OE1 3.26Å; P503-Q506 PolarHBondContact O-N 3.47Å
504	P	69.9	Low	84.7	Confident	117 Å²	117	69.6 Å²	69.6	76%	0.76	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-28.8	-166.9	22.2	-34.2	0	0	0	113.9
505	D	66.8	Low	85	Confident	161 Å²	161	68.2 Å²	68.2	86%	0.861	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-8.1	-178.2	-50.6	-50.5	0	0	0	113.9	P503	P503-D505 PolarHBondContact O-N 2.84Å
506	Q	67.1	Low	85.6	Confident	155 Å²	155	64.2 Å²	64.2	72%	0.724	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-13.1	-168.6	-161.9	171.3	35.1	0	0	114.5	P503	P503-Q506 HydrophobicContact CG-CB 3.76Å; P503-Q506 VanDerWaalsContact CG-OE1 3.26Å; P503-Q506 PolarHBondContact O-N 3.47Å
507	S	76.2	Confident	86.1	Confident	32 Å²	32	59.9 Å²	59.9	22%	0.224	32%	0.315	C	S	.	.			trans	-126	124.8	177.8	62.7	0	0	0	0	112.4	P502	P502-S507 WeakPolarHBondContact CB-OG 3.39Å; P502-S507 WeakPolarHBondContact CG-OG 3.34Å
508	Y	85.9	Confident	86.5	Confident	124 Å²	124	60 Å²	60	49%	0.486	32%	0.316	S	S	.	.			trans	-78.2	131	167.3	-64.1	-71.6	0	0	0	110.1	Y512 K577	Y508-Y512 AromaticContact CD1-CD1 3.51Å; Y508-Y512 HydrophobicContact CD1-CD1 3.51Å; Y508-Y512 AromaticContact CD1-CE1 3.51Å; Y508-Y512 HydrophobicContact CD1-CE1 3.51Å; Y508-Y512 HydrophobicContact CD1-CG 4.5Å; Y508-Y512 HydrophobicContact CE1-CD1 4.37Å; Y508-Y512 HydrophobicContact CE1-CE1 4.17Å; Y508-Y512 HydrophobicContact CG-CD1 4.08Å; Y508-Y512 HydrophobicContact CG-CE1 4.46Å; Y508-K577 HydrophobicContact CD2-CD 4.31Å; Y508-K577 HydrophobicContact CE1-CG 4.33Å; Y508-K577 HydrophobicContact CE2-CD 3.79Å; Y508-K577 HydrophobicContact CE2-CG 4Å
509	P	92.3	Very high	86.9	Confident	19 Å²	19	58.2 Å²	58.2	12%	0.123	30%	0.301	C	S	.	.			trans	-57.8	148.5	175.1	-28.2	35.8	0	0	0	113.5	E434 H511 Y512	E434-P509 WeakPolarHBondContact OE1-CB 3.45Å; P509-H511 VanDerWaalsContact C-N 3.25Å; P509-H511 PolarHBondContact O-N 2.6Å; P509-H511 VanDerWaalsContact O-N 3.08Å; P509-Y512 HydrophobicContact CB-CD2 4.13Å; P509-Y512 HydrophobicContact CB-CE2 4.25Å; P509-Y512 HydrophobicContact CG-CD2 4.3Å; P509-Y512 HydrophobicContact CG-CE2 3.97Å; P509-Y512 WeakPolarHBondContact O-CB 3.38Å; P509-Y512 PolarHBondContact O-N 3.35Å
510	P	93.3	Very high	87.2	Confident	9 Å²	9	50.1 Å²	50.1	6%	0.058	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-48.6	-36.8	-178.1	-31.8	35.9	0	0	0	116.2	E434 F446 E480 S483 V484 Y512 N513	E434-P510 WeakPolarHBondContact OE1-CD 3.32Å; E434-P510 VanDerWaalsContact OE1-N 3.15Å; F446-P510 HydrophobicContact CE1-CG 4.33Å; F446-P510 HydrophobicContact CE2-CB 4.23Å; F446-P510 HydrophobicContact CE2-CG 4.2Å; F446-P510 HydrophobicContact CZ-CB 3.62Å; F446-P510 HydrophobicContact CZ-CG 3.68Å; E480-P510 HydrophobicContact CB-CG 4.47Å; S483-P510 WeakPolarHBondContact OG-CD 3.2Å; S483-P510 WeakPolarHBondContact OG-CG 3.18Å; V484-P510 HydrophobicContact CG2-CG 4.32Å; P510-Y512 PolarHBondContact O-N 2.86Å; P510-N513 WeakPolarHBondContact O-CB 3.44Å; P510-N513 PolarHBondContact O-N 2.87Å; P510-N513 PolarHBondContact O-ND2 3.08Å; P510-N513 VanDerWaalsContact O-ND2 3.08Å
511	H	94.5	Very high	87.3	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.009	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-64.8	-17.9	179.2	70.4	-86.2	0	0	0	114.5	E434 T442 Y444 P509 N513 D514	E434-H511 IonicContact OE1-CE1 3.25Å; E434-H511 IonicContact OE1-CG 3.77Å; E434-H511 PolarHBondContact OE1-N 3.05Å; E434-H511 IonicContact OE1-ND1 4Å; E434-H511 PolarHBondContact OE1-ND1 3.15Å; T442-H511 HydrophobicContact CG2-CB 4.27Å; Y444-H511 HydrophobicContact CD2-CB 4.09Å; Y444-H511 HydrophobicContact CE2-CB 4.14Å; P509-H511 VanDerWaalsContact C-N 3.25Å; P509-H511 PolarHBondContact O-N 2.6Å; P509-H511 VanDerWaalsContact O-N 3.08Å; H511-N513 PolarHBondContact O-N 3.09Å; H511-D514 WeakPolarHBondContact O-CB 3.4Å; H511-D514 PolarHBondContact O-N 3.03Å
512	Y	94.4	Very high	87.4	Confident	24 Å²	24	45.8 Å²	45.8	9%	0.094	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-63.4	-24.1	175.3	-78.4	-135.6	0	0	0	111.5	Y508 P509 P510 D514 G515 I576 L580 P600	Y508-Y512 AromaticContact CD1-CD1 3.51Å; Y508-Y512 HydrophobicContact CD1-CD1 3.51Å; Y508-Y512 AromaticContact CD1-CE1 3.51Å; Y508-Y512 HydrophobicContact CD1-CE1 3.51Å; Y508-Y512 HydrophobicContact CD1-CG 4.5Å; Y508-Y512 HydrophobicContact CE1-CD1 4.37Å; Y508-Y512 HydrophobicContact CE1-CE1 4.17Å; Y508-Y512 HydrophobicContact CG-CD1 4.08Å; Y508-Y512 HydrophobicContact CG-CE1 4.46Å; P509-Y512 HydrophobicContact CB-CD2 4.13Å; P509-Y512 HydrophobicContact CB-CE2 4.25Å; P509-Y512 HydrophobicContact CG-CD2 4.3Å; P509-Y512 HydrophobicContact CG-CE2 3.97Å; P509-Y512 WeakPolarHBondContact O-CB 3.38Å; P509-Y512 PolarHBondContact O-N 3.35Å; P510-Y512 PolarHBondContact O-N 2.86Å; Y512-D514 PolarHBondContact O-N 3.2Å; Y512-G515 PolarHBondContact O-N 3.38Å; Y512-I576 HydrophobicContact CD1-CG2 3.8Å; Y512-I576 HydrophobicContact CE1-CG2 4.19Å; Y512-L580 HydrophobicContact CD1-CD1 4.37Å; Y512-L580 HydrophobicContact CE1-CD1 3.56Å; Y512-P600 HydrophobicContact CD2-CB 3.98Å; Y512-P600 HydrophobicContact CE1-CB 4.24Å; Y512-P600 HydrophobicContact CE1-CG 3.89Å; Y512-P600 HydrophobicContact CE2-CB 3.63Å; Y512-P600 HydrophobicContact CE2-CG 3.98Å; Y512-P600 HydrophobicContact CG-CB 4.43Å
513	N	93.6	Very high	87.6	Confident	120 Å²	120	44.2 Å²	44.2	64%	0.642	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-68.8	-12.5	175.7	-61.1	-50.1	0	0	0	113.6	P510 H511 G515	P510-N513 WeakPolarHBondContact O-CB 3.44Å; P510-N513 PolarHBondContact O-N 2.87Å; P510-N513 PolarHBondContact O-ND2 3.08Å; P510-N513 VanDerWaalsContact O-ND2 3.08Å; H511-N513 PolarHBondContact O-N 3.09Å; N513-G515 VanDerWaalsContact C-N 3.27Å; N513-G515 PolarHBondContact O-N 3.01Å
514	D	95.1	Very high	87.9	Confident	39 Å²	39	44.8 Å²	44.8	21%	0.209	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-75.8	-12.4	175.3	-74.8	-15.1	0	0	0	113.4	Y444 H511 Y512 C516 S602 K603	Y444-D514 WeakPolarHBondContact CE2-OD2 3.23Å; Y444-D514 PolarHBondContact OH-OD1 3.46Å; Y444-D514 PolarHBondContact OH-OD2 2.85Å; H511-D514 WeakPolarHBondContact O-CB 3.4Å; H511-D514 PolarHBondContact O-N 3.03Å; Y512-D514 PolarHBondContact O-N 3.2Å; D514-C516 HydrophobicContact CB-CB 4.49Å; D514-C516 PolarHBondContact O-N 3.35Å; D514-C516 PolarHBondContact O-SG 3.29Å; D514-S602 VanDerWaalsContact OD2-CA 3.31Å; D514-S602 WeakPolarHBondContact OD2-CA 3.15Å; D514-S602 WeakPolarHBondContact OD2-CB 3.41Å; D514-K603 HydrophobicContact CB-CB 4.2Å; D514-K603 PolarHBondContact OD2-N 2.93Å
515	G	94.7	Very high	88.7	Confident	2 Å²	2	43.7 Å²	43.7	2%	0.021	23%	0.229	C	C	.	.			trans	64.9	20.8	-178.9	0	0	0	0	0	114.7	Y512 N513 L570	Y512-G515 PolarHBondContact O-N 3.38Å; N513-G515 VanDerWaalsContact C-N 3.27Å; N513-G515 PolarHBondContact O-N 3.01Å; G515-L570 VanDerWaalsContact O-CB 3.29Å; G515-L570 WeakPolarHBondContact O-CB 3.36Å; G515-L570 WeakPolarHBondContact O-CG 3.19Å; G515-L570 PolarHBondContact O-N 2.76Å
516	C	96.9	Very high	89.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	139.7	-174.5	-66.4	0	0	0	0	112.9	D514 V568 I601 V606	D514-C516 HydrophobicContact CB-CB 4.49Å; D514-C516 PolarHBondContact O-N 3.35Å; D514-C516 PolarHBondContact O-SG 3.29Å; C516-V568 CarbonylContact C-O 3.59Å; C516-V568 WeakPolarHBondContact CA-O 3.48Å; C516-I601 HydrophobicContact CB-CG1 4.16Å; C516-I601 WeakPolarHBondContact CB-O 3.39Å; C516-I601 PolarHBondContact O-N 3.24Å; C516-I601 VanDerWaalsContact O-N 3.08Å; C516-I601 VanDerWaalsContact O-O 3.12Å; C516-V606 HydrophobicContact CB-CG2 3.68Å
517	L	96	Very high	91.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	138.3	-173.6	-163.8	73.9	0	0	0	111.4	L519 L535 V568 L579 L598 P600	L517-L519 HydrophobicContact CD2-CD1 3.92Å; L517-L519 HydrophobicContact CG-CD1 4.2Å; L517-L535 HydrophobicContact CD2-CD2 4.27Å; L517-V568 PolarHBondContact N-O 3.22Å; L517-V568 PolarHBondContact O-N 2.93Å; L517-L579 HydrophobicContact CD2-CD1 4.18Å; L517-L598 HydrophobicContact CD1-CB 4.3Å; L517-L598 HydrophobicContact CD2-CB 4.39Å; L517-L598 HydrophobicContact CD2-CD1 4.48Å; L517-L598 HydrophobicContact CD2-CD2 4.17Å; L517-P600 HydrophobicContact CD1-CG 4.29Å
518	E	95.5	Very high	92	Very high	3 Å²	3	33.9 Å²	33.9	1%	0.014	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.6	169.1	-177.2	172.2	-171	0	0	109.9	R440 R565 A566 L567 T599 I601	R440-E518 IonicContact CZ-OE2 3.71Å; R440-E518 IonicContact NH1-OE1 3.54Å; R440-E518 IonicContact NH1-OE2 3.72Å; R440-E518 PolarHBondContact NH1-OE2 3.41Å; R440-E518 IonicContact NH2-OE2 2.83Å; R440-E518 PolarHBondContact NH2-OE2 2.88Å; E518-R565 HydrophobicContact CG-CB 4.43Å; E518-R565 WeakPolarHBondContact OE1-CD 3.26Å; E518-R565 IonicContact OE1-CZ 3.85Å; E518-R565 IonicContact OE1-NE 2.67Å; E518-R565 IonicContact OE1-NH1 3.49Å; E518-R565 PolarHBondContact OE1-NH1 3.03Å; E518-R565 IonicContact OE2-NH1 2.74Å; E518-A566 WeakPolarHBondContact CA-O 3.49Å; E518-L567 HydrophobicContact CB-CD2 4.46Å; E518-L567 HydrophobicContact CG-CD2 4.22Å; E518-T599 PolarHBondContact N-O 3Å; E518-T599 PolarHBondContact O-N 3.43Å; E518-I601 HydrophobicContact CB-CD1 4.02Å; E518-I601 HydrophobicContact CB-CG1 4.34Å; E518-I601 HydrophobicContact CB-CG2 4.03Å
519	L	94.8	Very high	92.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	118.9	168.7	-73.8	64.3	0	0	0	107.8	L517 L522 V531 F534 L535 R565 A566 V568 V596 L598	L517-L519 HydrophobicContact CD2-CD1 3.92Å; L517-L519 HydrophobicContact CG-CD1 4.2Å; L519-L522 HydrophobicContact CB-CD1 3.96Å; L519-L522 HydrophobicContact CB-CG 4.37Å; L519-V531 HydrophobicContact CD2-CG1 3.89Å; L519-F534 HydrophobicContact CD2-CD1 4.16Å; L519-F534 HydrophobicContact CD2-CE1 4.47Å; L519-L535 HydrophobicContact CD1-CD1 4.18Å; L519-L535 HydrophobicContact CD1-CD2 4.29Å; L519-L535 HydrophobicContact CD2-CD1 4.4Å; L519-L535 HydrophobicContact CD2-CD2 4.18Å; L519-L535 HydrophobicContact CD2-CG 4.25Å; L519-R565 CarbonylContact O-C 3.6Å; L519-R565 WeakPolarHBondContact O-CA 3.33Å; L519-R565 VanDerWaalsContact O-CB 3.3Å; L519-R565 WeakPolarHBondContact O-CB 3.31Å; L519-A566 HydrophobicContact CB-CB 4.23Å; L519-A566 PolarHBondContact N-O 2.88Å; L519-A566 PolarHBondContact O-N 3.3Å; L519-V568 HydrophobicContact CD1-CG2 3.84Å; L519-V596 HydrophobicContact CB-CG1 3.95Å; L519-V596 HydrophobicContact CD2-CG1 4.24Å; L519-V596 HydrophobicContact CG-CG1 4.01Å; L519-L598 HydrophobicContact CD1-CD2 4.06Å; L519-L598 HydrophobicContact CD2-CD2 4.45Å; L519-L598 HydrophobicContact CG-CD2 3.66Å
520	A	91.5	Very high	92.5	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.008	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	172.3	173.3	0	0	0	0	0	111.7	L522 F550 R597	A520-L522 VanDerWaalsContact C-N 3.31Å; A520-L522 PolarHBondContact O-N 3.45Å; A520-F550 HydrophobicContact CB-CZ 3.84Å; A520-R597 HydrophobicContact CB-CB 4.36Å; A520-R597 PolarHBondContact N-O 2.99Å
521	E	86.4	Confident	92.6	Very high	38 Å²	38	31.9 Å²	31.9	18%	0.178	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	66.6	29.3	175.6	-61.8	155.8	-128.3	0	0	113.8	P558 P594 R597	E521-P558 HydrophobicContact CG-CB 3.83Å; E521-P558 HydrophobicContact CG-CG 4.09Å; E521-P594 HydrophobicContact CB-CG 4.23Å; E521-P594 HydrophobicContact CG-CG 4.5Å; E521-P594 WeakPolarHBondContact OE2-CG 3.38Å; E521-R597 IonicContact OE1-NE 3.38Å; E521-R597 PolarHBondContact OE1-NE 3.27Å; E521-R597 IonicContact OE1-NH2 3.7Å
522	L	89.3	Confident	92.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	137	175.6	-57.3	-179.9	0	0	0	111.3	L519 A520 T526 V531 T564 A566 F587 V596	L519-L522 HydrophobicContact CB-CD1 3.96Å; L519-L522 HydrophobicContact CB-CG 4.37Å; A520-L522 VanDerWaalsContact C-N 3.31Å; A520-L522 PolarHBondContact O-N 3.45Å; L522-T526 HydrophobicContact CB-CG2 4.4Å; L522-T526 HydrophobicContact CD1-CG2 4.23Å; L522-V531 HydrophobicContact CD1-CG2 4.12Å; L522-T564 PolarHBondContact N-O 3.29Å; L522-T564 PolarHBondContact O-N 2.98Å; L522-T564 PolarHBondContact O-OG1 2.83Å; L522-A566 HydrophobicContact CD1-CB 3.59Å; L522-F587 HydrophobicContact CD2-CB 4.21Å; L522-F587 HydrophobicContact CD2-CD1 4.11Å; L522-F587 HydrophobicContact CD2-CD2 3.57Å; L522-F587 HydrophobicContact CD2-CE1 4.39Å; L522-F587 HydrophobicContact CD2-CE2 3.86Å; L522-F587 HydrophobicContact CD2-CG 3.7Å; L522-F587 HydrophobicContact CD2-CZ 4.26Å; L522-V596 HydrophobicContact CD2-CG1 4.27Å; L522-V596 HydrophobicContact CD2-CG2 4.25Å
523	P	86.9	Confident	92.5	Very high	16 Å²	16	40.3 Å²	40.3	10%	0.104	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54	152.6	169.8	-29.3	37.4	0	0	0	113.7	D525 T526 T564 L593	P523-D525 WeakPolarHBondContact CB-OD1 3.32Å; P523-D525 PolarHBondContact O-N 2.68Å; P523-T526 WeakPolarHBondContact CD-OG1 3.27Å; P523-T526 VanDerWaalsContact O-CB 3.26Å; P523-T526 WeakPolarHBondContact O-CB 3.28Å; P523-T526 PolarHBondContact O-N 3Å; P523-T526 VanDerWaalsContact O-N 3.16Å; P523-T526 PolarHBondContact O-OG1 3.47Å; P523-T564 PolarHBondContact O-OG1 2.98Å; P523-T564 VanDerWaalsContact O-OG1 3.09Å; P523-L593 HydrophobicContact CG-CD1 3.45Å; P523-L593 VanDerWaalsContact CG-CD1 3.45Å
524	S	84.9	Confident	92.5	Very high	79 Å²	79	36 Å²	36	55%	0.552	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.1	178.7	49.3	0	0	0	0	115.2	N562	S524-N562 WeakPolarHBondContact CB-O 3.34Å; S524-N562 PolarHBondContact N-O 3.38Å
525	D	87.4	Confident	92.4	Very high	93 Å²	93	34.5 Å²	34.5	50%	0.497	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	5.7	178.2	67.5	-57.9	0	0	0	113.3	P523 T527 R588	P523-D525 WeakPolarHBondContact CB-OD1 3.32Å; P523-D525 PolarHBondContact O-N 2.68Å; D525-T527 PolarHBondContact O-N 2.81Å; D525-R588 IonicContact OD1-NH1 2.86Å; D525-R588 PolarHBondContact OD1-NH1 3.49Å; D525-R588 IonicContact OD2-CZ 2.72Å; D525-R588 VanDerWaalsContact OD2-CZ 3.24Å; D525-R588 IonicContact OD2-NH1 3.71Å; D525-R588 PolarHBondContact OD2-NH1 3.13Å; D525-R588 IonicContact OD2-NH2 3.93Å; D525-R588 PolarHBondContact OD2-NH2 3.11Å
526	T	90.7	Very high	92.2	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.043	21%	0.206	C	C	.	.			trans	-59.4	128.5	179.1	-62.5	0	0	0	0	111.5	L522 P523 V531 L547 F587	L522-T526 HydrophobicContact CB-CG2 4.4Å; L522-T526 HydrophobicContact CD1-CG2 4.23Å; P523-T526 WeakPolarHBondContact CD-OG1 3.27Å; P523-T526 VanDerWaalsContact O-CB 3.26Å; P523-T526 WeakPolarHBondContact O-CB 3.28Å; P523-T526 PolarHBondContact O-N 3Å; P523-T526 VanDerWaalsContact O-N 3.16Å; P523-T526 PolarHBondContact O-OG1 3.47Å; T526-V531 HydrophobicContact CG2-CG2 3.79Å; T526-L547 HydrophobicContact CG2-CD2 4.43Å; T526-L547 WeakPolarHBondContact O-CD1 3.15Å; T526-F587 HydrophobicContact CG2-CE1 3.44Å; T526-F587 VanDerWaalsContact CG2-CE1 3.44Å; T526-F587 HydrophobicContact CG2-CZ 3.44Å; T526-F587 VanDerWaalsContact CG2-CZ 3.44Å
527	T	93.2	Very high	91.7	Very high	58 Å²	58	37.8 Å²	37.8	36%	0.356	21%	0.21	S	C	.	.			trans	-93.6	153.9	174.4	66.2	0	0	0	0	112.7	D525 T529 E530 V531	D525-T527 PolarHBondContact O-N 2.81Å; T527-T529 PolarHBondContact O-N 2.87Å; T527-E530 WeakPolarHBondContact CB-OE1 3.47Å; T527-E530 WeakPolarHBondContact CG2-OE1 3.28Å; T527-E530 PolarHBondContact N-OE1 3.28Å; T527-E530 WeakPolarHBondContact O-CB 3.32Å; T527-E530 PolarHBondContact O-N 2.82Å; T527-E530 VanDerWaalsContact O-N 3.08Å; T527-E530 VanDerWaalsContact OG1-CD 3.28Å; T527-E530 VanDerWaalsContact OG1-CG 3.31Å; T527-E530 WeakPolarHBondContact OG1-CG 3.26Å; T527-E530 PolarHBondContact OG1-N 3.39Å; T527-E530 PolarHBondContact OG1-OE1 3.21Å; T527-V531 PolarHBondContact O-N 3.44Å
528	K	95.2	Very high	91.3	Very high	77 Å²	77	42.4 Å²	42.4	34%	0.335	24%	0.24	S	C	.	.	H	α-helix	trans	-55.2	-39.8	173.4	-63.8	-169.9	179	-158.3	0	111.8	E530 V531 V532 C542 V545 L547	K528-E530 VanDerWaalsContact C-N 3.32Å; K528-E530 PolarHBondContact O-N 2.85Å; K528-V531 WeakPolarHBondContact O-CB 3.38Å; K528-V531 PolarHBondContact O-N 2.67Å; K528-V531 VanDerWaalsContact O-N 3.15Å; K528-V532 WeakPolarHBondContact O-CG2 3.42Å; K528-V532 PolarHBondContact O-N 2.93Å; K528-C542 HydrophobicContact CB-CB 4.13Å; K528-C542 HydrophobicContact CD-CB 4.45Å; K528-C542 WeakPolarHBondContact CD-O 3.25Å; K528-V545 HydrophobicContact CB-CB 4.36Å; K528-V545 HydrophobicContact CB-CG1 4.3Å; K528-V545 HydrophobicContact CD-CB 4.5Å; K528-V545 VanDerWaalsContact CD-O 3.31Å; K528-V545 WeakPolarHBondContact CD-O 3.33Å; K528-V545 WeakPolarHBondContact CE-O 3.39Å; K528-V545 HydrophobicContact CG-CB 4.43Å; K528-V545 HydrophobicContact CG-CG1 4.22Å; K528-V545 PolarHBondContact NZ-O 3.49Å; K528-L547 HydrophobicContact CG-CD1 4Å; K528-L547 HydrophobicContact CG-CG 4.04Å
529	T	94.4	Very high	91	Very high	75 Å²	75	45.2 Å²	45.2	46%	0.46	27%	0.271	S	S	.	.	H	α-helix	trans	-65.2	-31.2	178.5	-44.5	0	0	0	0	112.8	T527 R533	T527-T529 PolarHBondContact O-N 2.87Å; T529-R533 WeakPolarHBondContact O-CB 3.31Å; T529-R533 VanDerWaalsContact O-CG 3.28Å; T529-R533 WeakPolarHBondContact O-CG 3.44Å; T529-R533 PolarHBondContact O-N 3.26Å; T529-R533 VanDerWaalsContact O-N 3.16Å; T529-R533 PolarHBondContact O-NE 3.01Å
530	E	93.3	Very high	90.9	Very high	35 Å²	35	45.9 Å²	45.9	16%	0.164	27%	0.274	C	S	.	.	H	α-helix	trans	-69.6	-41.2	170.6	-74	158.4	-116.3	0	0	111.8	T527 K528 V532 R533 F534 F587 R588	T527-E530 WeakPolarHBondContact CB-OE1 3.47Å; T527-E530 WeakPolarHBondContact CG2-OE1 3.28Å; T527-E530 PolarHBondContact N-OE1 3.28Å; T527-E530 WeakPolarHBondContact O-CB 3.32Å; T527-E530 PolarHBondContact O-N 2.82Å; T527-E530 VanDerWaalsContact O-N 3.08Å; T527-E530 VanDerWaalsContact OG1-CD 3.28Å; T527-E530 VanDerWaalsContact OG1-CG 3.31Å; T527-E530 WeakPolarHBondContact OG1-CG 3.26Å; T527-E530 PolarHBondContact OG1-N 3.39Å; T527-E530 PolarHBondContact OG1-OE1 3.21Å; K528-E530 VanDerWaalsContact C-N 3.32Å; K528-E530 PolarHBondContact O-N 2.85Å; E530-V532 PolarHBondContact O-N 3.16Å; E530-R533 VanDerWaalsContact CG-NH2 3.3Å; E530-R533 PolarHBondContact O-N 3.37Å; E530-F534 WeakPolarHBondContact O-CB 3.35Å; E530-F534 PolarHBondContact O-N 3.05Å; E530-F587 HydrophobicContact CB-CE1 4.01Å; E530-F587 HydrophobicContact CB-CZ 3.58Å; E530-R588 IonicContact OE1-NH2 2.69Å; E530-R588 IonicContact OE2-CZ 3.28Å; E530-R588 IonicContact OE2-NE 2.96Å; E530-R588 PolarHBondContact OE2-NE 3Å; E530-R588 IonicContact OE2-NH2 2.74Å; E530-R588 PolarHBondContact OE2-NH2 3.22Å
531	V	95	Very high	91	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-45.6	176.3	171.8	0	0	0	0	111.6	L519 L522 T526 T527 K528 F534 L535 V545 L547 A566 V568 F587	L519-V531 HydrophobicContact CD2-CG1 3.89Å; L522-V531 HydrophobicContact CD1-CG2 4.12Å; T526-V531 HydrophobicContact CG2-CG2 3.79Å; T527-V531 PolarHBondContact O-N 3.44Å; K528-V531 WeakPolarHBondContact O-CB 3.38Å; K528-V531 PolarHBondContact O-N 2.67Å; K528-V531 VanDerWaalsContact O-N 3.15Å; V531-F534 PolarHBondContact O-N 2.82Å; V531-L535 HydrophobicContact CG1-CD1 4.24Å; V531-L535 PolarHBondContact O-N 3.23Å; V531-V545 HydrophobicContact CB-CG1 4.08Å; V531-V545 HydrophobicContact CG1-CG1 3.85Å; V531-V545 HydrophobicContact CG1-CG2 4.12Å; V531-V545 HydrophobicContact CG2-CG1 4.49Å; V531-L547 HydrophobicContact CG2-CD2 4.21Å; V531-A566 HydrophobicContact CB-CB 4.48Å; V531-A566 HydrophobicContact CG1-CB 3.97Å; V531-A566 HydrophobicContact CG2-CB 3.78Å; V531-V568 HydrophobicContact CG1-CG2 3.86Å; V531-F587 HydrophobicContact CG2-CE2 4.28Å; V531-F587 HydrophobicContact CG2-CZ 4.11Å
532	V	95.5	Very high	91.3	Very high	28 Å²	28	49.2 Å²	49.2	17%	0.17	30%	0.298	C	S	.	.	H	α-helix	trans	-59.2	-49.5	176	174.9	0	0	0	0	111	K528 E530 F534 L535 G536 L540 T541 V545	K528-V532 WeakPolarHBondContact O-CG2 3.42Å; K528-V532 PolarHBondContact O-N 2.93Å; E530-V532 PolarHBondContact O-N 3.16Å; V532-F534 VanDerWaalsContact C-N 3.34Å; V532-F534 PolarHBondContact O-N 3.48Å; V532-L535 PolarHBondContact O-N 3.21Å; V532-G536 PolarHBondContact O-N 3.18Å; V532-L540 HydrophobicContact CG1-CG 4.42Å; V532-L540 WeakPolarHBondContact CG1-O 3.45Å; V532-L540 HydrophobicContact CG2-CD2 4.44Å; V532-L540 HydrophobicContact CG2-CG 4.31Å; V532-T541 WeakPolarHBondContact CG2-O 3.18Å; V532-V545 HydrophobicContact CG2-CG2 3.83Å
533	R	92.8	Very high	91.5	Very high	175 Å²	175	57.7 Å²	57.7	66%	0.66	34%	0.338	S	S	*	.	H	α-helix	trans	-63.9	-36.2	178	-74.3	-176.7	-65.4	164.3	-1.1	113	T529 E530	T529-R533 WeakPolarHBondContact O-CB 3.31Å; T529-R533 VanDerWaalsContact O-CG 3.28Å; T529-R533 WeakPolarHBondContact O-CG 3.44Å; T529-R533 PolarHBondContact O-N 3.26Å; T529-R533 VanDerWaalsContact O-N 3.16Å; T529-R533 PolarHBondContact O-NE 3.01Å; E530-R533 VanDerWaalsContact CG-NH2 3.3Å; E530-R533 PolarHBondContact O-N 3.37Å
534	F	93.1	Very high	91.9	Very high	29 Å²	29	58.9 Å²	58.9	13%	0.127	34%	0.344	C	S	.	.	H	α-helix	trans	-67.9	-42.3	179.9	174.9	-97.2	0	0	0	112	L519 E530 V531 V532 R585 F587 V596	L519-F534 HydrophobicContact CD2-CD1 4.16Å; L519-F534 HydrophobicContact CD2-CE1 4.47Å; E530-F534 WeakPolarHBondContact O-CB 3.35Å; E530-F534 PolarHBondContact O-N 3.05Å; V531-F534 PolarHBondContact O-N 2.82Å; V532-F534 VanDerWaalsContact C-N 3.34Å; V532-F534 PolarHBondContact O-N 3.48Å; F534-R585 HydrophobicContact CE2-CG 3.76Å; F534-R585 HydrophobicContact CZ-CG 3.73Å; F534-R585 PolarHBondContact O-NH2 3.24Å; F534-F587 HydrophobicContact CB-CD2 4Å; F534-F587 HydrophobicContact CB-CE2 3.6Å; F534-F587 HydrophobicContact CD1-CD2 4.03Å; F534-F587 HydrophobicContact CD1-CE2 4.19Å; F534-F587 AromaticContact CD2-CD2 3.68Å; F534-F587 HydrophobicContact CD2-CD2 3.68Å; F534-F587 HydrophobicContact CD2-CE2 4.2Å; F534-F587 HydrophobicContact CE1-CD2 4.47Å; F534-F587 HydrophobicContact CE2-CD2 4.15Å; F534-F587 AromaticContact CG-CD2 3.61Å; F534-F587 HydrophobicContact CG-CD2 3.61Å; F534-F587 AromaticContact CG-CE2 3.74Å; F534-F587 HydrophobicContact CG-CE2 3.74Å; F534-V596 HydrophobicContact CE1-CB 3.95Å; F534-V596 HydrophobicContact CE1-CG1 4.11Å; F534-V596 HydrophobicContact CE1-CG2 3.89Å; F534-V596 HydrophobicContact CE2-CG2 4.1Å; F534-V596 HydrophobicContact CZ-CB 3.78Å; F534-V596 HydrophobicContact CZ-CG1 4.45Å; F534-V596 HydrophobicContact CZ-CG2 3.5Å
535	L	93.9	Very high	92.4	Very high	8 Å²	8	55.1 Å²	55.1	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-73.8	-42.1	178.1	-69.4	175.5	0	0	0	112.1	L517 L519 V531 V532 A537 L540 V568 L579 L598	L517-L535 HydrophobicContact CD2-CD2 4.27Å; L519-L535 HydrophobicContact CD1-CD1 4.18Å; L519-L535 HydrophobicContact CD1-CD2 4.29Å; L519-L535 HydrophobicContact CD2-CD1 4.4Å; L519-L535 HydrophobicContact CD2-CD2 4.18Å; L519-L535 HydrophobicContact CD2-CG 4.25Å; V531-L535 HydrophobicContact CG1-CD1 4.24Å; V531-L535 PolarHBondContact O-N 3.23Å; V532-L535 PolarHBondContact O-N 3.21Å; L535-A537 PolarHBondContact O-N 2.95Å; L535-L540 HydrophobicContact CB-CD2 4.06Å; L535-L540 HydrophobicContact CD1-CD2 3.77Å; L535-V568 HydrophobicContact CD1-CB 4.36Å; L535-V568 HydrophobicContact CD1-CG1 3.88Å; L535-V568 HydrophobicContact CD1-CG2 4.04Å; L535-L579 HydrophobicContact CB-CD2 4.47Å; L535-L579 HydrophobicContact CD2-CD1 4.32Å; L535-L579 HydrophobicContact CD2-CD2 4.12Å; L535-L598 HydrophobicContact CD2-CD2 4.34Å
536	G	89.1	Confident	92.8	Very high	59 Å²	59	52.5 Å²	52.5	61%	0.608	31%	0.305	S	S	*	.			trans	66.5	17.4	-180	0	0	0	0	0	114.6	V532	V532-G536 PolarHBondContact O-N 3.18Å
537	A	88	Confident	93.1	Very high	12 Å²	12	53.2 Å²	53.2	10%	0.099	31%	0.308	C	S	.	.			trans	-69.1	134.4	-179.3	0	0	0	0	0	111.4	L535 G539 L540 L570	L535-A537 PolarHBondContact O-N 2.95Å; A537-G539 PolarHBondContact O-N 3.36Å; A537-L540 HydrophobicContact CB-CB 4.09Å; A537-L540 HydrophobicContact CB-CD2 4.27Å; A537-L540 VanDerWaalsContact O-CB 3.32Å; A537-L540 WeakPolarHBondContact O-CB 3.37Å; A537-L540 PolarHBondContact O-N 2.85Å; A537-L570 HydrophobicContact CB-CD2 3.94Å
538	P	86.1	Confident	93.1	Very high	97 Å²	97	50.5 Å²	50.5	63%	0.63	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	132.9	-179.4	-25.2	35	0	0	0	112.8	L540 P571	P538-L540 PolarHBondContact O-N 2.93Å; P538-P571 WeakPolarHBondContact O-CG 3.4Å
539	G	89	Confident	92.9	Very high	63 Å²	63	53.6 Å²	53.6	65%	0.649	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	0.4	178.5	0	0	0	0	0	115.7	A537 T541 P571	A537-G539 PolarHBondContact O-N 3.36Å; G539-T541 PolarHBondContact O-N 3.5Å; G539-P571 VanDerWaalsContact C-CG 3.48Å; G539-P571 WeakPolarHBondContact O-CG 3.31Å
540	L	92.8	Very high	92.6	Very high	13 Å²	13	51.4 Å²	51.4	7%	0.068	29%	0.285	C	S	.	.			trans	-69.7	125.3	177.9	-177.3	69.3	0	0	0	110.4	V532 L535 A537 P538 N544 V568 L570	V532-L540 HydrophobicContact CG1-CG 4.42Å; V532-L540 WeakPolarHBondContact CG1-O 3.45Å; V532-L540 HydrophobicContact CG2-CD2 4.44Å; V532-L540 HydrophobicContact CG2-CG 4.31Å; L535-L540 HydrophobicContact CB-CD2 4.06Å; L535-L540 HydrophobicContact CD1-CD2 3.77Å; A537-L540 HydrophobicContact CB-CB 4.09Å; A537-L540 HydrophobicContact CB-CD2 4.27Å; A537-L540 VanDerWaalsContact O-CB 3.32Å; A537-L540 WeakPolarHBondContact O-CB 3.37Å; A537-L540 PolarHBondContact O-N 2.85Å; P538-L540 PolarHBondContact O-N 2.93Å; L540-N544 HydrophobicContact CD1-CB 3.41Å; L540-N544 VanDerWaalsContact CD1-CB 3.41Å; L540-V568 HydrophobicContact CD1-CG1 3.67Å; L540-V568 HydrophobicContact CD2-CG1 4.1Å; L540-L570 HydrophobicContact CD1-CD2 4.38Å; L540-L570 HydrophobicContact CD2-CD2 4.47Å
541	T	94	Very high	92	Very high	62 Å²	62	51.3 Å²	51.3	38%	0.38	29%	0.287	S	S	.	.			trans	-115.1	175.2	178.8	78.5	0	0	0	0	112	V532 G539 E543 N544	V532-T541 WeakPolarHBondContact CG2-O 3.18Å; G539-T541 PolarHBondContact O-N 3.5Å; T541-E543 PolarHBondContact O-N 2.91Å; T541-E543 PolarHBondContact OG1-N 3.24Å; T541-N544 PolarHBondContact N-OD1 3.39Å; T541-N544 WeakPolarHBondContact O-CB 3.06Å; T541-N544 PolarHBondContact O-N 3Å; T541-N544 PolarHBondContact OG1-OD1 3.42Å
542	C	93.7	Very high	90.9	Very high	47 Å²	47	56.3 Å²	56.3	32%	0.318	32%	0.32	S	S	.	.	S	Bend	trans	-69.5	-16.2	174.3	-66.7	0	0	0	0	113.5	K528 N544 V545	K528-C542 HydrophobicContact CB-CB 4.13Å; K528-C542 HydrophobicContact CD-CB 4.45Å; K528-C542 WeakPolarHBondContact CD-O 3.25Å; C542-N544 VanDerWaalsContact C-N 3.34Å; C542-V545 PolarHBondContact O-N 3.48Å
543	E	93.5	Very high	89.7	Confident	178 Å²	178	61.2 Å²	61.2	83%	0.832	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-33.5	174.8	-58.9	-175.6	174.5	0	0	111.2	T541 V545	T541-E543 PolarHBondContact O-N 2.91Å; T541-E543 PolarHBondContact OG1-N 3.24Å; E543-V545 PolarHBondContact O-N 3.41Å
544	N	94.2	Very high	89	Confident	42 Å²	42	54.2 Å²	54.2	23%	0.225	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-5.8	176.3	-61.4	89.2	0	0	0	114.2	L540 T541 C542 V568 T569	L540-N544 HydrophobicContact CD1-CB 3.41Å; L540-N544 VanDerWaalsContact CD1-CB 3.41Å; T541-N544 PolarHBondContact N-OD1 3.39Å; T541-N544 WeakPolarHBondContact O-CB 3.06Å; T541-N544 PolarHBondContact O-N 3Å; T541-N544 PolarHBondContact OG1-OD1 3.42Å; C542-N544 VanDerWaalsContact C-N 3.34Å; N544-V568 WeakPolarHBondContact O-CA 3.47Å; N544-T569 WeakPolarHBondContact CB-O 3.4Å; N544-T569 PolarHBondContact ND2-O 2.85Å; N544-T569 PolarHBondContact O-N 3.08Å
545	V	96.3	Very high	88.3	Confident	0 Å²	0	63 Å²	63	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.9	-172.6	-176.9	0	0	0	0	111	K528 V531 V532 C542 E543 A566 L567 V568	K528-V545 HydrophobicContact CB-CB 4.36Å; K528-V545 HydrophobicContact CB-CG1 4.3Å; K528-V545 HydrophobicContact CD-CB 4.5Å; K528-V545 VanDerWaalsContact CD-O 3.31Å; K528-V545 WeakPolarHBondContact CD-O 3.33Å; K528-V545 WeakPolarHBondContact CE-O 3.39Å; K528-V545 HydrophobicContact CG-CB 4.43Å; K528-V545 HydrophobicContact CG-CG1 4.22Å; K528-V545 PolarHBondContact NZ-O 3.49Å; V531-V545 HydrophobicContact CB-CG1 4.08Å; V531-V545 HydrophobicContact CG1-CG1 3.85Å; V531-V545 HydrophobicContact CG1-CG2 4.12Å; V531-V545 HydrophobicContact CG2-CG1 4.49Å; V532-V545 HydrophobicContact CG2-CG2 3.83Å; C542-V545 PolarHBondContact O-N 3.48Å; E543-V545 PolarHBondContact O-N 3.41Å; V545-A566 HydrophobicContact CG1-CB 4.19Å; V545-L567 WeakPolarHBondContact CA-O 3.48Å; V545-V568 HydrophobicContact CG1-CG2 4.39Å; V545-V568 HydrophobicContact CG2-CG1 4.39Å; V545-V568 HydrophobicContact CG2-CG2 4.22Å
546	V	96.2	Very high	87.4	Confident	38 Å²	38	63.6 Å²	63.6	23%	0.23	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	116.2	171.8	-179.1	0	0	0	0	108.9	L567 A613	V546-L567 HydrophobicContact CB-CB 4.34Å; V546-L567 PolarHBondContact N-O 2.91Å; V546-L567 PolarHBondContact O-N 3.05Å; V546-A613 HydrophobicContact CG1-CB 3.75Å
547	L	95.6	Very high	87	Confident	22 Å²	22	62.3 Å²	62.3	12%	0.115	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	132	171.1	-61.3	174	0	0	0	108.6	T526 K528 V531 R565 A566 A613 I614	T526-L547 HydrophobicContact CG2-CD2 4.43Å; T526-L547 WeakPolarHBondContact O-CD1 3.15Å; K528-L547 HydrophobicContact CG-CD1 4Å; K528-L547 HydrophobicContact CG-CG 4.04Å; V531-L547 HydrophobicContact CG2-CD2 4.21Å; L547-R565 WeakPolarHBondContact CA-O 3.33Å; L547-A566 HydrophobicContact CD2-CB 3.81Å; L547-A613 CarbonylContact O-C 3.58Å; L547-A613 VanDerWaalsContact O-CA 3.26Å; L547-A613 WeakPolarHBondContact O-CA 3.26Å; L547-I614 PolarHBondContact O-N 3.04Å
548	A	93.5	Very high	86.4	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	157.3	-176	0	0	0	0	0	112.2	R565 L567 L612	A548-R565 HydrophobicContact CB-CG 4.23Å; A548-R565 PolarHBondContact N-O 3.45Å; A548-R565 WeakPolarHBondContact O-CG 3.5Å; A548-R565 PolarHBondContact O-N 3.27Å; A548-L567 HydrophobicContact CB-CD1 4.23Å; A548-L612 CarbonylContact C-O 3.59Å; A548-L612 VanDerWaalsContact CA-O 3.29Å; A548-L612 WeakPolarHBondContact CA-O 3.42Å; A548-L612 WeakPolarHBondContact CB-O 3.21Å
549	R	90.6	Very high	85.5	Confident	143 Å²	143	70.2 Å²	70.2	54%	0.54	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-77.5	157.4	164.8	-64	-174.5	179.3	-175.5	-1	109.6	R565 L612 I614 E724	R549-R565 PolarHBondContact O-NE 3.22Å; R549-R565 PolarHBondContact O-NH2 3.07Å; R549-L612 PolarHBondContact N-O 3.48Å; R549-I614 HydrophobicContact CG-CD1 3.76Å; R549-I614 HydrophobicContact CG-CG1 3.82Å; R549-E724 IonicContact NH1-OE1 2.7Å; R549-E724 PolarHBondContact NH1-OE1 3.35Å
550	F	88.4	Confident	84.1	Confident	28 Å²	28	69.4 Å²	69.4	12%	0.123	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-72.7	147.3	164.6	-71.5	-86.1	0	0	0	109.9	A520 A557 P558 R565	A520-F550 HydrophobicContact CB-CZ 3.84Å; F550-A557 HydrophobicContact CB-CB 3.75Å; F550-A557 HydrophobicContact CD1-CB 3.85Å; F550-A557 HydrophobicContact CD2-CB 4.32Å; F550-A557 HydrophobicContact CG-CB 3.7Å; F550-P558 HydrophobicContact CE2-CG 4.11Å; F550-P558 HydrophobicContact CZ-CG 4.39Å; F550-R565 HydrophobicContact CD2-CG 4.42Å; F550-R565 HydrophobicContact CE1-CB 4.24Å; F550-R565 HydrophobicContact CE1-CG 4.36Å; F550-R565 HydrophobicContact CE2-CB 3.89Å; F550-R565 HydrophobicContact CE2-CG 4.18Å; F550-R565 HydrophobicContact CZ-CB 3.68Å; F550-R565 HydrophobicContact CZ-CG 4.15Å
551	P	80	Confident	82.3	Confident	34 Å²	34	75 Å²	75	22%	0.221	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-60.8	144.8	169.6	-14.9	26.9	0	0	0	110.4	N553 D554 L612	P551-N553 PolarHBondContact O-N 3.34Å; P551-N553 VanDerWaalsContact O-N 3.08Å; P551-D554 HydrophobicContact CB-CB 4.02Å; P551-D554 HydrophobicContact CG-CB 3.91Å; P551-D554 WeakPolarHBondContact O-CB 2.98Å; P551-D554 PolarHBondContact O-N 3.12Å; P551-L612 HydrophobicContact CB-CD1 3.98Å; P551-L612 HydrophobicContact CG-CD1 3.81Å
552	P	72.1	Confident	81	Confident	105 Å²	105	78 Å²	78	68%	0.682	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.3	-175	23.9	-34.3	0	0	0	114.1	F644	P552-F644 HydrophobicContact CG-CD2 4.11Å; P552-F644 HydrophobicContact CG-CE2 4.15Å
553	N	71.7	Confident	80.4	Confident	131 Å²	131	78.2 Å²	78.2	70%	0.701	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	11.1	179.5	-63.4	-24.1	0	0	0	113.3	P551 K555	P551-N553 PolarHBondContact O-N 3.34Å; P551-N553 VanDerWaalsContact O-N 3.08Å; N553-K555 PolarHBondContact O-N 3.06Å
554	D	77.9	Confident	80.2	Confident	28 Å²	28	70.3 Å²	70.3	15%	0.15	37%	0.367	C	S	.	.			trans	-77.2	104.9	179.9	-169.8	-15.8	0	0	0	110.8	R440 P551 S556 A557	R440-D554 IonicContact NH1-OD2 2.93Å; P551-D554 HydrophobicContact CB-CB 4.02Å; P551-D554 HydrophobicContact CG-CB 3.91Å; P551-D554 WeakPolarHBondContact O-CB 2.98Å; P551-D554 PolarHBondContact O-N 3.12Å; D554-S556 VanDerWaalsContact CG-OG 3.28Å; D554-S556 PolarHBondContact O-N 3.32Å; D554-S556 VanDerWaalsContact O-N 3.09Å; D554-S556 WeakPolarHBondContact OD1-CA 3.39Å; D554-S556 VanDerWaalsContact OD1-CB 3.29Å; D554-S556 WeakPolarHBondContact OD1-CB 3.39Å; D554-S556 PolarHBondContact OD1-N 3.44Å; D554-S556 PolarHBondContact OD1-OG 3.09Å; D554-S556 PolarHBondContact OD2-OG 3.05Å; D554-A557 VanDerWaalsContact O-CB 3.25Å; D554-A557 WeakPolarHBondContact O-CB 3.47Å; D554-A557 PolarHBondContact O-N 3.49Å
555	K	77.1	Confident	80.1	Confident	213 Å²	213	68.3 Å²	68.3	93%	0.926	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-17.8	177.3	-63.1	-177.4	-179.8	-179.4	0	113.6	N553	N553-K555 PolarHBondContact O-N 3.06Å
556	S	76.4	Confident	80.1	Confident	20 Å²	20	68.3 Å²	68.3	14%	0.14	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-2.6	178.5	78.9	0	0	0	0	113.9	R440 D554 R597	R440-S556 PolarHBondContact NH1-OG 2.9Å; D554-S556 VanDerWaalsContact CG-OG 3.28Å; D554-S556 PolarHBondContact O-N 3.32Å; D554-S556 VanDerWaalsContact O-N 3.09Å; D554-S556 WeakPolarHBondContact OD1-CA 3.39Å; D554-S556 VanDerWaalsContact OD1-CB 3.29Å; D554-S556 WeakPolarHBondContact OD1-CB 3.39Å; D554-S556 PolarHBondContact OD1-N 3.44Å; D554-S556 PolarHBondContact OD1-OG 3.09Å; D554-S556 PolarHBondContact OD2-OG 3.05Å; S556-R597 PolarHBondContact O-NH2 3.21Å
557	A	80	Confident	80.1	Confident	33 Å²	33	66.5 Å²	66.5	27%	0.273	35%	0.346	S	S	.	.	S	Bend	trans	-64.6	135.6	172.2	0	0	0	0	0	110.6	F550 D554	F550-A557 HydrophobicContact CB-CB 3.75Å; F550-A557 HydrophobicContact CD1-CB 3.85Å; F550-A557 HydrophobicContact CD2-CB 4.32Å; F550-A557 HydrophobicContact CG-CB 3.7Å; D554-A557 VanDerWaalsContact O-CB 3.25Å; D554-A557 WeakPolarHBondContact O-CB 3.47Å; D554-A557 PolarHBondContact O-N 3.49Å
558	P	75.8	Confident	80.2	Confident	26 Å²	26	65.5 Å²	65.5	17%	0.169	34%	0.341	C	S	.	.			trans	-63.9	142.4	177.3	27.5	-34.4	0	0	0	111.1	E521 F550 G560 L563	E521-P558 HydrophobicContact CG-CB 3.83Å; E521-P558 HydrophobicContact CG-CG 4.09Å; F550-P558 HydrophobicContact CE2-CG 4.11Å; F550-P558 HydrophobicContact CZ-CG 4.39Å; P558-G560 VanDerWaalsContact C-N 3.31Å; P558-G560 PolarHBondContact O-N 3.19Å; P558-L563 HydrophobicContact CB-CD1 3.68Å; P558-L563 HydrophobicContact CG-CB 3.88Å; P558-L563 HydrophobicContact CG-CD1 3.51Å; P558-L563 HydrophobicContact CG-CG 4.35Å
559	R	66.9	Low	80.3	Confident	248 Å²	248	67.7 Å²	67.7	94%	0.936	35%	0.354	S	S	*	.	S	Bend	trans	-72.7	80.3	179.6	-67.2	-172.2	-177.7	-170.2	3.2	111.1
560	G	60.2	Low	80.6	Confident	46 Å²	46	61.4 Å²	61.4	47%	0.474	33%	0.331	S	S	.	.	S	Bend	trans	-165.9	138.5	175.7	0	0	0	0	0	112	P558 N562	P558-G560 VanDerWaalsContact C-N 3.31Å; P558-G560 PolarHBondContact O-N 3.19Å; G560-N562 PolarHBondContact O-N 3.41Å
561	T	53.7	Low	80.8	Confident	132 Å²	132	63.6 Å²	63.6	81%	0.81	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	127.3	173.2	51.9	0	0	0	0	109.7
562	N	68	Low	81.5	Confident	124 Å²	124	64 Å²	64	66%	0.663	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	26.6	175.5	-44.7	-21.5	0	0	0	117	S524 G560	S524-N562 WeakPolarHBondContact CB-O 3.34Å; S524-N562 PolarHBondContact N-O 3.38Å; G560-N562 PolarHBondContact O-N 3.41Å
563	L	80.2	Confident	82.4	Confident	52 Å²	52	60.6 Å²	60.6	27%	0.272	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	141.7	165	-68.3	170.8	0	0	0	111.4	P558	P558-L563 HydrophobicContact CB-CD1 3.68Å; P558-L563 HydrophobicContact CG-CB 3.88Å; P558-L563 HydrophobicContact CG-CD1 3.51Å; P558-L563 HydrophobicContact CG-CG 4.35Å
564	T	89	Confident	83.4	Confident	11 Å²	11	60.8 Å²	60.8	7%	0.067	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	173.8	177.3	65.9	0	0	0	0	111	L522 P523 I614	L522-T564 PolarHBondContact N-O 3.29Å; L522-T564 PolarHBondContact O-N 2.98Å; L522-T564 PolarHBondContact O-OG1 2.83Å; P523-T564 PolarHBondContact O-OG1 2.98Å; P523-T564 VanDerWaalsContact O-OG1 3.09Å; T564-I614 HydrophobicContact CG2-CD1 3.48Å; T564-I614 VanDerWaalsContact CG2-CD1 3.48Å
565	R	92.8	Very high	84.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	154.4	173.3	53.5	172.8	178.4	175.2	4.1	111.4	E518 L519 L547 A548 R549 F550 Y609	E518-R565 HydrophobicContact CG-CB 4.43Å; E518-R565 WeakPolarHBondContact OE1-CD 3.26Å; E518-R565 IonicContact OE1-CZ 3.85Å; E518-R565 IonicContact OE1-NE 2.67Å; E518-R565 IonicContact OE1-NH1 3.49Å; E518-R565 PolarHBondContact OE1-NH1 3.03Å; E518-R565 IonicContact OE2-NH1 2.74Å; L519-R565 CarbonylContact O-C 3.6Å; L519-R565 WeakPolarHBondContact O-CA 3.33Å; L519-R565 VanDerWaalsContact O-CB 3.3Å; L519-R565 WeakPolarHBondContact O-CB 3.31Å; L547-R565 WeakPolarHBondContact CA-O 3.33Å; A548-R565 HydrophobicContact CB-CG 4.23Å; A548-R565 PolarHBondContact N-O 3.45Å; A548-R565 WeakPolarHBondContact O-CG 3.5Å; A548-R565 PolarHBondContact O-N 3.27Å; R549-R565 PolarHBondContact O-NE 3.22Å; R549-R565 PolarHBondContact O-NH2 3.07Å; F550-R565 HydrophobicContact CD2-CG 4.42Å; F550-R565 HydrophobicContact CE1-CB 4.24Å; F550-R565 HydrophobicContact CE1-CG 4.36Å; F550-R565 HydrophobicContact CE2-CB 3.89Å; F550-R565 HydrophobicContact CE2-CG 4.18Å; F550-R565 HydrophobicContact CZ-CB 3.68Å; F550-R565 HydrophobicContact CZ-CG 4.15Å; R565-Y609 VanDerWaalsContact NH2-CB 3.26Å; R565-Y609 VanDerWaalsContact NH2-CG 3.31Å
566	A	95.8	Very high	84.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	126.5	168.8	0	0	0	0	0	109.8	E518 L519 L522 V531 V545 L547 V568	E518-A566 WeakPolarHBondContact CA-O 3.49Å; L519-A566 HydrophobicContact CB-CB 4.23Å; L519-A566 PolarHBondContact N-O 2.88Å; L519-A566 PolarHBondContact O-N 3.3Å; L522-A566 HydrophobicContact CD1-CB 3.59Å; V531-A566 HydrophobicContact CB-CB 4.48Å; V531-A566 HydrophobicContact CG1-CB 3.97Å; V531-A566 HydrophobicContact CG2-CB 3.78Å; V545-A566 HydrophobicContact CG1-CB 4.19Å; L547-A566 HydrophobicContact CD2-CB 3.81Å; A566-V568 HydrophobicContact CB-CG2 4.35Å
567	L	96.8	Very high	85.4	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	125.8	169.4	-49.4	169.6	0	0	0	106.9	E518 V545 V546 A548 I601 V606 Y609	E518-L567 HydrophobicContact CB-CD2 4.46Å; E518-L567 HydrophobicContact CG-CD2 4.22Å; V545-L567 WeakPolarHBondContact CA-O 3.48Å; V546-L567 HydrophobicContact CB-CB 4.34Å; V546-L567 PolarHBondContact N-O 2.91Å; V546-L567 PolarHBondContact O-N 3.05Å; A548-L567 HydrophobicContact CB-CD1 4.23Å; L567-I601 HydrophobicContact CD2-CD1 3.96Å; L567-V606 HydrophobicContact CB-CG1 4.44Å; L567-Y609 HydrophobicContact CD2-CD2 3.99Å; L567-Y609 HydrophobicContact CD2-CG 4.48Å
568	V	97.1	Very high	86	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.9	-172	-176.1	0	0	0	0	109.5	C516 L517 L519 V531 L535 L540 N544 V545 A566 L570	C516-V568 CarbonylContact C-O 3.59Å; C516-V568 WeakPolarHBondContact CA-O 3.48Å; L517-V568 PolarHBondContact N-O 3.22Å; L517-V568 PolarHBondContact O-N 2.93Å; L519-V568 HydrophobicContact CD1-CG2 3.84Å; V531-V568 HydrophobicContact CG1-CG2 3.86Å; L535-V568 HydrophobicContact CD1-CB 4.36Å; L535-V568 HydrophobicContact CD1-CG1 3.88Å; L535-V568 HydrophobicContact CD1-CG2 4.04Å; L540-V568 HydrophobicContact CD1-CG1 3.67Å; L540-V568 HydrophobicContact CD2-CG1 4.1Å; N544-V568 WeakPolarHBondContact O-CA 3.47Å; V545-V568 HydrophobicContact CG1-CG2 4.39Å; V545-V568 HydrophobicContact CG2-CG1 4.39Å; V545-V568 HydrophobicContact CG2-CG2 4.22Å; A566-V568 HydrophobicContact CB-CG2 4.35Å; V568-L570 HydrophobicContact CG1-CD2 4.03Å; V568-L570 HydrophobicContact CG1-CG 4.48Å
569	T	97	Very high	86.8	Confident	47 Å²	47	57.1 Å²	57.1	29%	0.288	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	101.4	171.2	-57.8	0	0	0	0	108.8	N544	N544-T569 WeakPolarHBondContact CB-O 3.4Å; N544-T569 PolarHBondContact ND2-O 2.85Å; N544-T569 PolarHBondContact O-N 3.08Å
570	L	95.7	Very high	87.9	Confident	10 Å²	10	48 Å²	48	5%	0.052	28%	0.276	C	S	.	.			trans	-67.3	147.3	-177.1	-59.8	165.2	0	0	0	110.8	G515 A537 L540 V568 S572 D575 I576 L579	G515-L570 VanDerWaalsContact O-CB 3.29Å; G515-L570 WeakPolarHBondContact O-CB 3.36Å; G515-L570 WeakPolarHBondContact O-CG 3.19Å; G515-L570 PolarHBondContact O-N 2.76Å; A537-L570 HydrophobicContact CB-CD2 3.94Å; L540-L570 HydrophobicContact CD1-CD2 4.38Å; L540-L570 HydrophobicContact CD2-CD2 4.47Å; V568-L570 HydrophobicContact CG1-CD2 4.03Å; V568-L570 HydrophobicContact CG1-CG 4.48Å; L570-S572 VanDerWaalsContact C-N 3.3Å; L570-S572 WeakPolarHBondContact CB-O 3.29Å; L570-S572 PolarHBondContact O-N 2.92Å; L570-D575 HydrophobicContact CD1-CB 4.18Å; L570-I576 HydrophobicContact CD1-CG1 3.52Å; L570-L579 HydrophobicContact CD1-CD1 3.75Å; L570-L579 HydrophobicContact CD2-CD1 3.77Å; L570-L579 HydrophobicContact CG-CD1 4.43Å
571	P	93.7	Very high	89.3	Confident	74 Å²	74	50.5 Å²	50.5	48%	0.481	29%	0.286	S	S	.	.	S	Bend	trans	-64.8	-32.2	176.2	-23.2	35.9	0	0	0	113.6	P538 G539	P538-P571 WeakPolarHBondContact O-CG 3.4Å; G539-P571 VanDerWaalsContact C-CG 3.48Å; G539-P571 WeakPolarHBondContact O-CG 3.31Å
572	S	93.7	Very high	91	Very high	43 Å²	43	46 Å²	46	30%	0.301	26%	0.262	S	S	.	.			trans	-120.1	136.6	172.4	-178.3	0	0	0	0	111.1	L570 E574 D575	L570-S572 VanDerWaalsContact C-N 3.3Å; L570-S572 WeakPolarHBondContact CB-O 3.29Å; L570-S572 PolarHBondContact O-N 2.92Å; S572-E574 PolarHBondContact O-N 3.09Å; S572-E574 PolarHBondContact OG-N 3.4Å; S572-D575 WeakPolarHBondContact O-CB 3.27Å; S572-D575 PolarHBondContact O-N 3.44Å
573	A	92	Very high	92	Very high	33 Å²	33	48.8 Å²	48.8	27%	0.273	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-20.6	171.5	0	0	0	0	0	112.6	D575 I576	A573-D575 VanDerWaalsContact C-N 3.28Å; A573-D575 PolarHBondContact O-N 2.8Å; A573-I576 PolarHBondContact O-N 2.9Å
574	E	90.9	Very high	92.4	Very high	136 Å²	136	51 Å²	51	64%	0.636	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-29.3	176.4	-58.3	-168.3	147.8	0	0	112.1	S572 I576 K577	S572-E574 PolarHBondContact O-N 3.09Å; S572-E574 PolarHBondContact OG-N 3.4Å; E574-I576 PolarHBondContact O-N 3.17Å; E574-K577 WeakPolarHBondContact O-CB 3.41Å; E574-K577 PolarHBondContact O-N 3.39Å
575	D	92.9	Very high	92.4	Very high	20 Å²	20	54.9 Å²	54.9	11%	0.107	30%	0.299	C	S	.	.	H	α-helix	trans	-60.9	-25.9	178.4	-64.7	-26.8	0	0	0	112.4	L570 S572 A573 K577 I578 L579	L570-D575 HydrophobicContact CD1-CB 4.18Å; S572-D575 WeakPolarHBondContact O-CB 3.27Å; S572-D575 PolarHBondContact O-N 3.44Å; A573-D575 VanDerWaalsContact C-N 3.28Å; A573-D575 PolarHBondContact O-N 2.8Å; D575-K577 VanDerWaalsContact C-N 3.27Å; D575-K577 PolarHBondContact O-N 2.87Å; D575-I578 PolarHBondContact O-N 2.54Å; D575-L579 WeakPolarHBondContact O-CB 3.38Å; D575-L579 WeakPolarHBondContact O-CG 3.46Å; D575-L579 PolarHBondContact O-N 3.03Å
576	I	92.2	Very high	92.1	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-55.9	-44.7	172.8	-69.9	-169.7	0	0	0	110.5	Y512 L570 A573 E574 I578 L579 L580 P600	Y512-I576 HydrophobicContact CD1-CG2 3.8Å; Y512-I576 HydrophobicContact CE1-CG2 4.19Å; L570-I576 HydrophobicContact CD1-CG1 3.52Å; A573-I576 PolarHBondContact O-N 2.9Å; E574-I576 PolarHBondContact O-N 3.17Å; I576-I578 VanDerWaalsContact C-N 3.29Å; I576-I578 PolarHBondContact O-N 3.32Å; I576-L579 PolarHBondContact O-N 2.77Å; I576-L580 HydrophobicContact CG2-CD1 3.53Å; I576-L580 HydrophobicContact CG2-CG 4Å; I576-L580 WeakPolarHBondContact O-CB 3.37Å; I576-L580 VanDerWaalsContact O-CG 3.24Å; I576-L580 WeakPolarHBondContact O-CG 3.27Å; I576-L580 PolarHBondContact O-N 3.34Å; I576-P600 HydrophobicContact CG2-CG 4.29Å
577	K	89.1	Confident	91.8	Very high	99 Å²	99	57.5 Å²	57.5	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-63.5	-40.4	-177.4	-59.5	176.3	-175	168.4	0	110.6	Y508 E574 D575 S581	Y508-K577 HydrophobicContact CD2-CD 4.31Å; Y508-K577 HydrophobicContact CE1-CG 4.33Å; Y508-K577 HydrophobicContact CE2-CD 3.79Å; Y508-K577 HydrophobicContact CE2-CG 4Å; E574-K577 WeakPolarHBondContact O-CB 3.41Å; E574-K577 PolarHBondContact O-N 3.39Å; D575-K577 VanDerWaalsContact C-N 3.27Å; D575-K577 PolarHBondContact O-N 2.87Å; K577-S581 VanDerWaalsContact O-CB 3.29Å; K577-S581 WeakPolarHBondContact O-CB 3.39Å; K577-S581 PolarHBondContact O-N 3.31Å; K577-S581 PolarHBondContact O-OG 3.48Å
578	I	91.7	Very high	91.3	Very high	109 Å²	109	60.8 Å²	60.8	56%	0.559	33%	0.327	S	S	*	.	H	α-helix	trans	-64.5	-51.6	176.6	-55.3	176.8	0	0	0	109.9	D575 I576 L580 S581 A582	D575-I578 PolarHBondContact O-N 2.54Å; I576-I578 VanDerWaalsContact C-N 3.29Å; I576-I578 PolarHBondContact O-N 3.32Å; I578-L580 PolarHBondContact O-N 2.65Å; I578-S581 PolarHBondContact O-N 3.46Å; I578-S581 PolarHBondContact O-OG 3.24Å; I578-A582 PolarHBondContact O-N 3.05Å; I578-A582 VanDerWaalsContact O-N 3.15Å
579	L	92.9	Very high	90.3	Very high	13 Å²	13	65.2 Å²	65.2	7%	0.068	36%	0.356	C	S	.	.	H	α-helix	trans	-63.7	-37.9	-177.5	-71.1	171.7	0	0	0	113.3	L517 L535 L570 D575 I576 A582 L598	L517-L579 HydrophobicContact CD2-CD1 4.18Å; L535-L579 HydrophobicContact CB-CD2 4.47Å; L535-L579 HydrophobicContact CD2-CD1 4.32Å; L535-L579 HydrophobicContact CD2-CD2 4.12Å; L570-L579 HydrophobicContact CD1-CD1 3.75Å; L570-L579 HydrophobicContact CD2-CD1 3.77Å; L570-L579 HydrophobicContact CG-CD1 4.43Å; D575-L579 WeakPolarHBondContact O-CB 3.38Å; D575-L579 WeakPolarHBondContact O-CG 3.46Å; D575-L579 PolarHBondContact O-N 3.03Å; I576-L579 PolarHBondContact O-N 2.77Å; L579-A582 WeakPolarHBondContact O-CB 3.37Å; L579-A582 PolarHBondContact O-N 3.34Å; L579-L598 HydrophobicContact CB-CD1 4.46Å
580	L	91.1	Very high	89	Confident	58 Å²	58	70.9 Å²	70.9	30%	0.304	38%	0.384	S	S	.	.	H	α-helix	trans	-74.2	-29	175.3	-64.9	176.7	0	0	0	113.1	Y512 I576 I578 A582 L598 P600	Y512-L580 HydrophobicContact CD1-CD1 4.37Å; Y512-L580 HydrophobicContact CE1-CD1 3.56Å; I576-L580 HydrophobicContact CG2-CD1 3.53Å; I576-L580 HydrophobicContact CG2-CG 4Å; I576-L580 WeakPolarHBondContact O-CB 3.37Å; I576-L580 VanDerWaalsContact O-CG 3.24Å; I576-L580 WeakPolarHBondContact O-CG 3.27Å; I576-L580 PolarHBondContact O-N 3.34Å; I578-L580 PolarHBondContact O-N 2.65Å; L580-A582 VanDerWaalsContact C-N 3.27Å; L580-L598 HydrophobicContact CD2-CB 4.3Å; L580-P600 HydrophobicContact CD1-CG 3.58Å; L580-P600 HydrophobicContact CD2-CG 3.89Å; L580-P600 HydrophobicContact CG-CG 4.24Å
581	S	88.8	Confident	87.7	Confident	98 Å²	98	73.2 Å²	73.2	69%	0.685	41%	0.405	S	S	*	.	H	α-helix	trans	-74.9	-17.1	174.3	74.9	0	0	0	0	113.4	K577 I578	K577-S581 VanDerWaalsContact O-CB 3.29Å; K577-S581 WeakPolarHBondContact O-CB 3.39Å; K577-S581 PolarHBondContact O-N 3.31Å; K577-S581 PolarHBondContact O-OG 3.48Å; I578-S581 PolarHBondContact O-N 3.46Å; I578-S581 PolarHBondContact O-OG 3.24Å
582	A	89.7	Confident	86.4	Confident	38 Å²	38	73.2 Å²	73.2	31%	0.314	42%	0.418	S	S	.	.	S	Bend	trans	-71.5	142.2	-179.7	0	0	0	0	0	111.6	I578 L579 L580	I578-A582 PolarHBondContact O-N 3.05Å; I578-A582 VanDerWaalsContact O-N 3.15Å; L579-A582 WeakPolarHBondContact O-CB 3.37Å; L579-A582 PolarHBondContact O-N 3.34Å; L580-A582 VanDerWaalsContact C-N 3.27Å
583	K	88.1	Confident	85.4	Confident	182 Å²	182	73.6 Å²	73.6	79%	0.791	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-58.2	132.4	177.2	-172.2	177.5	179.2	178.7	0	110.8	R585	K583-R585 PolarHBondContact O-N 2.96Å
584	P	88.9	Confident	84.7	Confident	98 Å²	98	75.3 Å²	75.3	64%	0.636	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-54.1	138.2	173.7	-27.2	35	0	0	0	112
585	R	89.3	Confident	84.4	Confident	92 Å²	92	71.4 Å²	71.4	35%	0.347	41%	0.413	S	S	.	.			trans	-145	147.5	-177.9	60.3	178.5	-179.8	-82.8	6.8	111.2	F534 K583 S595 V596	F534-R585 HydrophobicContact CE2-CG 3.76Å; F534-R585 HydrophobicContact CZ-CG 3.73Å; F534-R585 PolarHBondContact O-NH2 3.24Å; K583-R585 PolarHBondContact O-N 2.96Å; R585-S595 WeakPolarHBondContact O-CA 3.38Å; R585-V596 PolarHBondContact O-N 2.82Å
586	P	87.1	Confident	84.3	Confident	37 Å²	37	70.9 Å²	70.9	24%	0.24	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-67.9	149.7	174.7	29.7	-36	0	0	0	111.6	P589	P586-P589 HydrophobicContact CG-CB 4.3Å; P586-P589 HydrophobicContact CG-CG 4.31Å
587	F	89	Confident	84.3	Confident	18 Å²	18	73.8 Å²	73.8	8%	0.079	42%	0.421	C	S	.	.	S	Bend	trans	-64.6	-42.8	-179.2	-167.6	-117.6	0	0	0	112.3	L522 T526 E530 V531 F534 V596	L522-F587 HydrophobicContact CD2-CB 4.21Å; L522-F587 HydrophobicContact CD2-CD1 4.11Å; L522-F587 HydrophobicContact CD2-CD2 3.57Å; L522-F587 HydrophobicContact CD2-CE1 4.39Å; L522-F587 HydrophobicContact CD2-CE2 3.86Å; L522-F587 HydrophobicContact CD2-CG 3.7Å; L522-F587 HydrophobicContact CD2-CZ 4.26Å; T526-F587 HydrophobicContact CG2-CE1 3.44Å; T526-F587 VanDerWaalsContact CG2-CE1 3.44Å; T526-F587 HydrophobicContact CG2-CZ 3.44Å; T526-F587 VanDerWaalsContact CG2-CZ 3.44Å; E530-F587 HydrophobicContact CB-CE1 4.01Å; E530-F587 HydrophobicContact CB-CZ 3.58Å; V531-F587 HydrophobicContact CG2-CE2 4.28Å; V531-F587 HydrophobicContact CG2-CZ 4.11Å; F534-F587 HydrophobicContact CB-CD2 4Å; F534-F587 HydrophobicContact CB-CE2 3.6Å; F534-F587 HydrophobicContact CD1-CD2 4.03Å; F534-F587 HydrophobicContact CD1-CE2 4.19Å; F534-F587 AromaticContact CD2-CD2 3.68Å; F534-F587 HydrophobicContact CD2-CD2 3.68Å; F534-F587 HydrophobicContact CD2-CE2 4.2Å; F534-F587 HydrophobicContact CE1-CD2 4.47Å; F534-F587 HydrophobicContact CE2-CD2 4.15Å; F534-F587 AromaticContact CG-CD2 3.61Å; F534-F587 HydrophobicContact CG-CD2 3.61Å; F534-F587 AromaticContact CG-CE2 3.74Å; F534-F587 HydrophobicContact CG-CE2 3.74Å; F587-V596 HydrophobicContact CB-CG2 3.53Å; F587-V596 HydrophobicContact CD2-CG2 4.04Å; F587-V596 HydrophobicContact CG-CG2 4.24Å
588	R	85.7	Confident	84.6	Confident	70 Å²	70	71 Å²	71	26%	0.264	41%	0.411	S	S	.	.	S	Bend	trans	-130	102.2	174.8	-65.7	177.6	-176.1	170.4	-2.7	107.2	D525 E530 D590 A591	D525-R588 IonicContact OD1-NH1 2.86Å; D525-R588 PolarHBondContact OD1-NH1 3.49Å; D525-R588 IonicContact OD2-CZ 2.72Å; D525-R588 VanDerWaalsContact OD2-CZ 3.24Å; D525-R588 IonicContact OD2-NH1 3.71Å; D525-R588 PolarHBondContact OD2-NH1 3.13Å; D525-R588 IonicContact OD2-NH2 3.93Å; D525-R588 PolarHBondContact OD2-NH2 3.11Å; E530-R588 IonicContact OE1-NH2 2.69Å; E530-R588 IonicContact OE2-CZ 3.28Å; E530-R588 IonicContact OE2-NE 2.96Å; E530-R588 PolarHBondContact OE2-NE 3Å; E530-R588 IonicContact OE2-NH2 2.74Å; E530-R588 PolarHBondContact OE2-NH2 3.22Å; R588-D590 PolarHBondContact O-N 2.95Å; R588-A591 HydrophobicContact CB-CB 4.07Å; R588-A591 PolarHBondContact O-N 2.73Å
589	P	76.3	Confident	84.7	Confident	94 Å²	94	66 Å²	66	61%	0.61	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-55.2	-38	-175.3	-27.1	34.7	0	0	0	113.5	P586 A591	P586-P589 HydrophobicContact CG-CB 4.3Å; P586-P589 HydrophobicContact CG-CG 4.31Å; P589-A591 PolarHBondContact O-N 3.37Å
590	D	70.6	Confident	84.8	Confident	166 Å²	166	65.3 Å²	65.3	89%	0.888	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-70.7	-15	-175.2	-45.5	-49.1	0	0	0	113.7	R588	R588-D590 PolarHBondContact O-N 2.95Å
591	A	68	Low	85.1	Confident	59 Å²	59	62.6 Å²	62.6	49%	0.488	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-90.7	-3.3	-174.2	0	0	0	0	0	114.2	R588 P589 L593	R588-A591 HydrophobicContact CB-CB 4.07Å; R588-A591 PolarHBondContact O-N 2.73Å; P589-A591 PolarHBondContact O-N 3.37Å; A591-L593 HydrophobicContact CB-CD1 3.74Å; A591-L593 HydrophobicContact CB-CG 3.85Å; A591-L593 PolarHBondContact O-N 3.41Å
592	G	67.1	Low	85.4	Confident	74 Å²	74	57.9 Å²	57.9	76%	0.763	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	18.3	-176.9	0	0	0	0	0	114.5
593	L	71.9	Confident	85.7	Confident	51 Å²	51	62.5 Å²	62.5	27%	0.267	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-73.2	155.1	-179.7	-70.8	167	0	0	0	111.7	P523 A591	P523-L593 HydrophobicContact CG-CD1 3.45Å; P523-L593 VanDerWaalsContact CG-CD1 3.45Å; A591-L593 HydrophobicContact CB-CD1 3.74Å; A591-L593 HydrophobicContact CB-CG 3.85Å; A591-L593 PolarHBondContact O-N 3.41Å
594	P	77.1	Confident	86	Confident	69 Å²	69	56 Å²	56	45%	0.448	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-61.2	165.7	171.6	28.2	-36	0	0	0	112.3	E521	E521-P594 HydrophobicContact CB-CG 4.23Å; E521-P594 HydrophobicContact CG-CG 4.5Å; E521-P594 WeakPolarHBondContact OE2-CG 3.38Å
595	S	85.6	Confident	86.3	Confident	53 Å²	53	51.4 Å²	51.4	37%	0.371	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-68.9	135.5	174.4	-69.6	0	0	0	0	110.9	R585 R597	R585-S595 WeakPolarHBondContact O-CA 3.38Å; S595-R597 PolarHBondContact O-N 3.01Å
596	V	90.5	Very high	86.6	Confident	10 Å²	10	47.8 Å²	47.8	6%	0.061	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-60.2	122.4	-178.8	-177.5	0	0	0	0	109.8	L519 L522 F534 R585 F587 L598	L519-V596 HydrophobicContact CB-CG1 3.95Å; L519-V596 HydrophobicContact CD2-CG1 4.24Å; L519-V596 HydrophobicContact CG-CG1 4.01Å; L522-V596 HydrophobicContact CD2-CG1 4.27Å; L522-V596 HydrophobicContact CD2-CG2 4.25Å; F534-V596 HydrophobicContact CE1-CB 3.95Å; F534-V596 HydrophobicContact CE1-CG1 4.11Å; F534-V596 HydrophobicContact CE1-CG2 3.89Å; F534-V596 HydrophobicContact CE2-CG2 4.1Å; F534-V596 HydrophobicContact CZ-CB 3.78Å; F534-V596 HydrophobicContact CZ-CG1 4.45Å; F534-V596 HydrophobicContact CZ-CG2 3.5Å; R585-V596 PolarHBondContact O-N 2.82Å; F587-V596 HydrophobicContact CB-CG2 3.53Å; F587-V596 HydrophobicContact CD2-CG2 4.04Å; F587-V596 HydrophobicContact CG-CG2 4.24Å; V596-L598 HydrophobicContact CG1-CD2 3.94Å; V596-L598 PolarHBondContact O-N 3.17Å
597	R	91.7	Very high	86.9	Confident	62 Å²	62	50.1 Å²	50.1	23%	0.234	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	117.7	171.7	175.5	169	53.5	117.6	1.6	109.7	L438 A520 E521 S556 S595	L438-R597 VanDerWaalsContact CD2-NH1 3.26Å; A520-R597 HydrophobicContact CB-CB 4.36Å; A520-R597 PolarHBondContact N-O 2.99Å; E521-R597 IonicContact OE1-NE 3.38Å; E521-R597 PolarHBondContact OE1-NE 3.27Å; E521-R597 IonicContact OE1-NH2 3.7Å; S556-R597 PolarHBondContact O-NH2 3.21Å; S595-R597 PolarHBondContact O-N 3.01Å
598	L	94.6	Very high	87	Confident	39 Å²	39	51 Å²	51	20%	0.204	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	123.7	172.7	-54	-174.6	0	0	0	109	L517 L519 L535 L579 L580 V596	L517-L598 HydrophobicContact CD1-CB 4.3Å; L517-L598 HydrophobicContact CD2-CB 4.39Å; L517-L598 HydrophobicContact CD2-CD1 4.48Å; L517-L598 HydrophobicContact CD2-CD2 4.17Å; L519-L598 HydrophobicContact CD1-CD2 4.06Å; L519-L598 HydrophobicContact CD2-CD2 4.45Å; L519-L598 HydrophobicContact CG-CD2 3.66Å; L535-L598 HydrophobicContact CD2-CD2 4.34Å; L579-L598 HydrophobicContact CB-CD1 4.46Å; L580-L598 HydrophobicContact CD2-CB 4.3Å; V596-L598 HydrophobicContact CG1-CD2 3.94Å; V596-L598 PolarHBondContact O-N 3.17Å
599	T	94.7	Very high	87.4	Confident	4 Å²	4	49 Å²	49	3%	0.025	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	117.8	177.8	-53.4	0	0	0	0	109.4	L437 L438 E518 I601	L437-T599 HydrophobicContact CB-CG2 4.38Å; L438-T599 HydrophobicContact CD1-CG2 3.76Å; L438-T599 HydrophobicContact CG-CG2 3.94Å; E518-T599 PolarHBondContact N-O 3Å; E518-T599 PolarHBondContact O-N 3.43Å; T599-I601 HydrophobicContact CG2-CG2 4.31Å; T599-I601 PolarHBondContact O-N 3.4Å
600	P	95.9	Very high	88.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	134.9	168.9	-24.4	38.2	0	0	0	110	L437 Y512 L517 I576 L580	L437-P600 HydrophobicContact CD1-CG 4.49Å; Y512-P600 HydrophobicContact CD2-CB 3.98Å; Y512-P600 HydrophobicContact CE1-CB 4.24Å; Y512-P600 HydrophobicContact CE1-CG 3.89Å; Y512-P600 HydrophobicContact CE2-CB 3.63Å; Y512-P600 HydrophobicContact CE2-CG 3.98Å; Y512-P600 HydrophobicContact CG-CB 4.43Å; L517-P600 HydrophobicContact CD1-CG 4.29Å; I576-P600 HydrophobicContact CG2-CG 4.29Å; L580-P600 HydrophobicContact CD1-CG 3.58Å; L580-P600 HydrophobicContact CD2-CG 3.89Å; L580-P600 HydrophobicContact CG-CG 4.24Å
601	I	96	Very high	89.2	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	160.3	179.9	55.5	163.4	0	0	0	109.2	C516 E518 L567 T599 Q605 V606	C516-I601 HydrophobicContact CB-CG1 4.16Å; C516-I601 WeakPolarHBondContact CB-O 3.39Å; C516-I601 PolarHBondContact O-N 3.24Å; C516-I601 VanDerWaalsContact O-N 3.08Å; C516-I601 VanDerWaalsContact O-O 3.12Å; E518-I601 HydrophobicContact CB-CD1 4.02Å; E518-I601 HydrophobicContact CB-CG1 4.34Å; E518-I601 HydrophobicContact CB-CG2 4.03Å; L567-I601 HydrophobicContact CD2-CD1 3.96Å; T599-I601 HydrophobicContact CG2-CG2 4.31Å; T599-I601 PolarHBondContact O-N 3.4Å; I601-Q605 HydrophobicContact CB-CB 4.04Å; I601-Q605 HydrophobicContact CD1-CB 4.41Å; I601-V606 HydrophobicContact CD1-CG2 3.5Å; I601-V606 VanDerWaalsContact CD1-CG2 3.5Å; I601-V606 HydrophobicContact CG1-CG2 4.14Å
602	S	96.7	Very high	90.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	27%	0.269	C	S	.	.			trans	-78.8	165.4	173.7	77.9	0	0	0	0	112.7	T442 D514 L604 Q605 V606	T442-S602 WeakPolarHBondContact O-CB 3.33Å; T442-S602 PolarHBondContact O-OG 3.44Å; D514-S602 VanDerWaalsContact OD2-CA 3.31Å; D514-S602 WeakPolarHBondContact OD2-CA 3.15Å; D514-S602 WeakPolarHBondContact OD2-CB 3.41Å; S602-L604 PolarHBondContact O-N 3.3Å; S602-L604 PolarHBondContact OG-N 3.07Å; S602-L604 VanDerWaalsContact OG-N 3.14Å; S602-Q605 WeakPolarHBondContact O-CB 3.4Å; S602-Q605 PolarHBondContact O-N 2.96Å; S602-Q605 PolarHBondContact OG-N 3.38Å; S602-V606 PolarHBondContact O-N 3.47Å
603	K	95.3	Very high	91.3	Very high	134 Å²	134	41.7 Å²	41.7	58%	0.583	25%	0.251	S	S	*	.	H	α-helix	trans	-61.9	-27.7	168.7	-172	166.2	-174.4	163.4	0	112.7	D514 S607	D514-K603 HydrophobicContact CB-CB 4.2Å; D514-K603 PolarHBondContact OD2-N 2.93Å; K603-S607 PolarHBondContact O-N 2.88Å
604	L	94.7	Very high	91.9	Very high	47 Å²	47	42.7 Å²	42.7	25%	0.246	26%	0.256	C	S	.	.	H	α-helix	trans	-73.7	-36.7	175.8	-59.7	173.7	0	0	0	111.5	C405 Y444 S602 S607 A608	C405-L604 HydrophobicContact CB-CD1 4Å; Y444-L604 HydrophobicContact CD1-CD1 3.7Å; Y444-L604 HydrophobicContact CE1-CD1 3.32Å; Y444-L604 HydrophobicContact CE1-CG 4.01Å; S602-L604 PolarHBondContact O-N 3.3Å; S602-L604 PolarHBondContact OG-N 3.07Å; S602-L604 VanDerWaalsContact OG-N 3.14Å; L604-S607 PolarHBondContact O-N 2.94Å; L604-A608 WeakPolarHBondContact O-CB 3.47Å; L604-A608 PolarHBondContact O-N 3.25Å
605	Q	95	Very high	91.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-44.7	170.1	-74.6	176.1	-76.9	0	0	111.1	A408 D436 I601 S602 S607 A608 Y609	A408-Q605 HydrophobicContact CB-CG 3.86Å; D436-Q605 PolarHBondContact OD2-NE2 3.05Å; I601-Q605 HydrophobicContact CB-CB 4.04Å; I601-Q605 HydrophobicContact CD1-CB 4.41Å; S602-Q605 WeakPolarHBondContact O-CB 3.4Å; S602-Q605 PolarHBondContact O-N 2.96Å; S602-Q605 PolarHBondContact OG-N 3.38Å; Q605-S607 VanDerWaalsContact C-N 3.29Å; Q605-S607 PolarHBondContact O-N 3.1Å; Q605-A608 PolarHBondContact O-N 3.36Å; Q605-Y609 HydrophobicContact CB-CD2 4.14Å; Q605-Y609 HydrophobicContact CB-CE2 3.79Å; Q605-Y609 HydrophobicContact CG-CE2 4.19Å; Q605-Y609 PolarHBondContact NE2-OH 3.48Å; Q605-Y609 WeakPolarHBondContact O-CB 3.44Å; Q605-Y609 WeakPolarHBondContact O-CD2 3.45Å; Q605-Y609 PolarHBondContact O-N 3.06Å
606	V	95.3	Very high	89.1	Confident	16 Å²	16	44.5 Å²	44.5	10%	0.097	28%	0.281	C	S	.	.	H	α-helix	trans	-54.3	-46.9	173	174.9	0	0	0	0	110.8	C516 L567 I601 S602 Y609 S610	C516-V606 HydrophobicContact CB-CG2 3.68Å; L567-V606 HydrophobicContact CB-CG1 4.44Å; I601-V606 HydrophobicContact CD1-CG2 3.5Å; I601-V606 VanDerWaalsContact CD1-CG2 3.5Å; I601-V606 HydrophobicContact CG1-CG2 4.14Å; S602-V606 PolarHBondContact O-N 3.47Å; V606-Y609 PolarHBondContact O-N 3.13Å; V606-S610 VanDerWaalsContact O-CB 3.24Å; V606-S610 WeakPolarHBondContact O-CB 3.4Å; V606-S610 PolarHBondContact O-N 2.83Å; V606-S610 PolarHBondContact O-OG 2.8Å
607	S	93.3	Very high	86.4	Confident	87 Å²	87	54.7 Å²	54.7	61%	0.608	32%	0.324	S	S	*	.	H	α-helix	trans	-60.4	-48.6	177.8	-166	0	0	0	0	112.5	K603 L604 Q605	K603-S607 PolarHBondContact O-N 2.88Å; L604-S607 PolarHBondContact O-N 2.94Å; Q605-S607 VanDerWaalsContact C-N 3.29Å; Q605-S607 PolarHBondContact O-N 3.1Å
608	A	92.1	Very high	83.5	Confident	37 Å²	37	55.8 Å²	55.8	31%	0.306	34%	0.342	S	S	.	.	H	α-helix	trans	-66.4	-38.7	-179.8	0	0	0	0	0	112.7	A408 L604 Q605 A611	A408-A608 HydrophobicContact CB-CB 4.27Å; L604-A608 WeakPolarHBondContact O-CB 3.47Å; L604-A608 PolarHBondContact O-N 3.25Å; Q605-A608 PolarHBondContact O-N 3.36Å; A608-A611 WeakPolarHBondContact O-CB 3.39Å
609	Y	93.2	Very high	80.4	Confident	26 Å²	26	63.4 Å²	63.4	10%	0.102	38%	0.376	C	S	.	.	H	α-helix	trans	-79.7	-26.4	-177.3	-65	-14.5	0	0	0	113	R565 L567 Q605 V606 A611 L612	R565-Y609 VanDerWaalsContact NH2-CB 3.26Å; R565-Y609 VanDerWaalsContact NH2-CG 3.31Å; L567-Y609 HydrophobicContact CD2-CD2 3.99Å; L567-Y609 HydrophobicContact CD2-CG 4.48Å; Q605-Y609 HydrophobicContact CB-CD2 4.14Å; Q605-Y609 HydrophobicContact CB-CE2 3.79Å; Q605-Y609 HydrophobicContact CG-CE2 4.19Å; Q605-Y609 PolarHBondContact NE2-OH 3.48Å; Q605-Y609 WeakPolarHBondContact O-CB 3.44Å; Q605-Y609 WeakPolarHBondContact O-CD2 3.45Å; Q605-Y609 PolarHBondContact O-N 3.06Å; V606-Y609 PolarHBondContact O-N 3.13Å; Y609-A611 PolarHBondContact O-N 2.68Å; Y609-L612 PolarHBondContact O-N 2.9Å; Y609-L612 VanDerWaalsContact O-N 3.1Å
610	S	93.1	Very high	77.4	Confident	37 Å²	37	68.8 Å²	68.8	26%	0.259	41%	0.414	S	S	.	.	H	α-helix	trans	-65.6	-17.1	174.4	-63.5	0	0	0	0	113.3	V606 L612 A613	V606-S610 VanDerWaalsContact O-CB 3.24Å; V606-S610 WeakPolarHBondContact O-CB 3.4Å; V606-S610 PolarHBondContact O-N 2.83Å; V606-S610 PolarHBondContact O-OG 2.8Å; S610-L612 PolarHBondContact O-N 3.04Å; S610-L612 VanDerWaalsContact O-N 3.16Å; S610-A613 VanDerWaalsContact O-CB 3.25Å; S610-A613 WeakPolarHBondContact O-CB 3.42Å; S610-A613 PolarHBondContact O-N 2.97Å; S610-A613 VanDerWaalsContact O-N 3.13Å
611	A	90.8	Very high	74.7	Confident	87 Å²	87	77 Å²	77	72%	0.719	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-18.8	170.4	0	0	0	0	0	113.3	A608 Y609	A608-A611 WeakPolarHBondContact O-CB 3.39Å; Y609-A611 PolarHBondContact O-N 2.68Å
612	L	89.2	Confident	71.8	Confident	68 Å²	68	86.6 Å²	86.6	36%	0.356	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	24.8	177	-59.1	176	0	0	0	112.9	A548 R549 P551 Y609 S610	A548-L612 CarbonylContact C-O 3.59Å; A548-L612 VanDerWaalsContact CA-O 3.29Å; A548-L612 WeakPolarHBondContact CA-O 3.42Å; A548-L612 WeakPolarHBondContact CB-O 3.21Å; R549-L612 PolarHBondContact N-O 3.48Å; P551-L612 HydrophobicContact CB-CD1 3.98Å; P551-L612 HydrophobicContact CG-CD1 3.81Å; Y609-L612 PolarHBondContact O-N 2.9Å; Y609-L612 VanDerWaalsContact O-N 3.1Å; S610-L612 PolarHBondContact O-N 3.04Å; S610-L612 VanDerWaalsContact O-N 3.16Å
613	A	91.2	Very high	68.9	Low	48 Å²	48	95.5 Å²	95.5	40%	0.397	54%	0.539	S	S	.	.	B	Isolated β-bridge	trans	-62.1	145.3	-178	0	0	0	0	0	113.8	V546 L547 S610	V546-A613 HydrophobicContact CG1-CB 3.75Å; L547-A613 CarbonylContact O-C 3.58Å; L547-A613 VanDerWaalsContact O-CA 3.26Å; L547-A613 WeakPolarHBondContact O-CA 3.26Å; S610-A613 VanDerWaalsContact O-CB 3.25Å; S610-A613 WeakPolarHBondContact O-CB 3.42Å; S610-A613 PolarHBondContact O-N 2.97Å; S610-A613 VanDerWaalsContact O-N 3.13Å
614	I	84.1	Confident	66	Low	72 Å²	72	94.8 Å²	94.8	37%	0.369	55%	0.552	S	S	.	*			trans	-101.4	95.3	180	-56.5	169.2	0	0	0	108.5	L547 R549 T564	L547-I614 PolarHBondContact O-N 3.04Å; R549-I614 HydrophobicContact CG-CD1 3.76Å; R549-I614 HydrophobicContact CG-CG1 3.82Å; T564-I614 HydrophobicContact CG2-CD1 3.48Å; T564-I614 VanDerWaalsContact CG2-CD1 3.48Å
615	G	62.9	Low	63.5	Low	64 Å²	64	99.4 Å²	99.4	66%	0.66	58%	0.575	S	S	*	*	S	Bend	trans	78.2	143.9	-177	0	0	0	0	0	113.5
616	S	40.8	Very low	60.8	Low	97 Å²	97	108.4 Å²	108.4	68%	0.678	61%	0.614	S	S	*	*			cis	-128.7	111.8	1.7	47.9	0	0	0	0	109.9	S618	S616-S618 PolarHBondContact O-N 3.1Å; S616-S618 VanDerWaalsContact O-N 3.15Å
617	K	34.5	Very low	57.7	Low	223 Å²	223	113.6 Å²	113.6	97%	0.97	65%	0.648	S	S	*	*			trans	-90.6	60.2	175	-136	177	-172	179.3	0	110.9
618	S	29.2	Very low	55.2	Low	85 Å²	85	115.3 Å²	115.3	59%	0.594	66%	0.657	S	S	*	*			trans	-145.3	133	172.9	50	0	0	0	0	106.5	S616	S616-S618 PolarHBondContact O-N 3.1Å; S616-S618 VanDerWaalsContact O-N 3.15Å
619	E	30.8	Very low	52.9	Low	199 Å²	199	119.5 Å²	119.5	93%	0.93	68%	0.679	S	S	*	*	S	Bend	trans	78.3	69.6	-172.8	-50.8	-163.6	127.6	0	0	117.2
620	S	32.2	Very low	50.3	Low	117 Å²	117	123.8 Å²	123.8	82%	0.818	71%	0.71	S	S	*	*			trans	-158.6	50	148.8	43.5	0	0	0	0	112.9
621	I	37.4	Very low	47.9	Very low	173 Å²	173	133 Å²	133	89%	0.887	74%	0.739	S	S	*	*			trans	-121.9	80.6	163	-53.7	-179.7	0	0	0	108.5
622	K	36.6	Very low	45.3	Very low	201 Å²	201	136.7 Å²	136.7	87%	0.874	75%	0.746	S	S	*	*			trans	-137.9	92.1	164.1	-88.2	-175.1	176.8	172.8	0	108.1
623	E	35.5	Very low	43.2	Very low	187 Å²	187	139.5 Å²	139.5	87%	0.874	77%	0.766	S	S	*	*				160.6	133.8	125	-88.1	-169.7	132.2	0	0	111.6
624	S	34.9	Very low	40.5	Very low	120 Å²	120	144.9 Å²	144.9	84%	0.839	79%	0.788	S	S	*	*			trans	67.3	133	161.6	-125.2	0	0	0	0	115.8
625	I	41.7	Very low	38.3	Very low	144 Å²	144	147.8 Å²	147.8	74%	0.738	81%	0.809	S	S	*	*			cis	-155.6	138.3	32.9	-71	172.6	0	0	0	110.2
626	K	37.5	Very low	37.1	Very low	188 Å²	188	153 Å²	153	82%	0.817	82%	0.817	S	S	*	*			trans	40.5	142.9	158	-70.1	179.4	173.8	178.6	0	122.9
627	P	31.6	Very low	37.1	Very low	125 Å²	125	154.3 Å²	154.3	81%	0.812	82%	0.823	S	S	*	*			trans	-87	145.8	174.7	36.3	-34.2	0	0	0	113.4
628	P	39.9	Very low	37	Very low	124 Å²	124	150.5 Å²	150.5	81%	0.805	82%	0.818	S	S	*	*			trans	-119	138.3	158.2	32.6	-19.3	0	0	0	113.6
629	V	44.6	Very low	37.4	Very low	125 Å²	125	152.3 Å²	152.3	76%	0.758	82%	0.816	S	S	*	*			trans	-28.3	137.1	170.7	-174.3	0	0	0	0	116
630	P	38.7	Very low	37.6	Very low	116 Å²	116	148.2 Å²	148.2	75%	0.753	81%	0.806	S	S	*	*			trans	-73.1	137.6	173.9	31.7	-34.7	0	0	0	111.8
631	R	42	Very low	37.7	Very low	231 Å²	231	149 Å²	149	87%	0.872	81%	0.809	S	S	*	*			trans	-141.1	127.2	159.3	-73.7	-169.5	175.9	-176	-1.5	108.7	V633	R631-V633 PolarHBondContact O-N 3.19Å
632	D	35.5	Very low	37.6	Very low	163 Å²	163	144.9 Å²	144.9	87%	0.872	81%	0.809	S	S	*	*			trans	-69.3	122.3	-176.1	-46.8	-85.5	0	0	0	111.7
633	V	45.1	Very low	38.1	Very low	127 Å²	127	137.9 Å²	137.9	77%	0.77	79%	0.793	S	S	*	*			trans	-148.6	142.5	152.9	-170.9	0	0	0	0	107.6	R631	R631-V633 PolarHBondContact O-N 3.19Å
634	D	35.6	Very low	39.1	Very low	161 Å²	161	135 Å²	135	86%	0.861	78%	0.779	S	S	*	*			trans	-53.9	141.1	-170.4	-55.4	-81	0	0	0	115.3
635	T	36.7	Very low	41	Very low	133 Å²	133	131.5 Å²	131.5	82%	0.816	75%	0.75	S	S	*	*			trans	-106.4	108.1	-178.7	-60.3	0	0	0	0	111.2
636	E	38	Very low	43.1	Very low	174 Å²	174	126.8 Å²	126.8	81%	0.813	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-70.7	145.8	158.9	-81.7	-162.7	141.4	0	0	110.9	T638	E636-T638 PolarHBondContact O-N 3.41Å
637	P	40.3	Very low	45.6	Very low	124 Å²	124	117.8 Å²	117.8	81%	0.805	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-70.2	119.9	178.3	28.4	-33.4	0	0	0	111.4	K639	P637-K639 PolarHBondContact O-N 3.17Å
638	T	34.4	Very low	48.5	Very low	143 Å²	143	111.9 Å²	111.9	88%	0.877	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-73.2	121	-178.1	18.2	0	0	0	0	111.9	E636	E636-T638 PolarHBondContact O-N 3.41Å
639	K	37	Very low	51	Low	124 Å²	124	106.1 Å²	106.1	54%	0.539	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-71.6	136	-175.7	-159.7	158.3	-178.5	153.3	0	111.6	P637 E719 A720	P637-K639 PolarHBondContact O-N 3.17Å; K639-E719 IonicContact NZ-OE1 3.66Å; K639-E719 PolarHBondContact NZ-OE1 3.32Å; K639-A720 PolarHBondContact NZ-O 2.88Å
640	P	34.5	Very low	53.3	Low	112 Å²	112	100.1 Å²	100.1	73%	0.727	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-69.4	153.3	-178.1	28	-35.5	0	0	0	112.7
641	P	34.6	Very low	55.7	Low	134 Å²	134	96.2 Å²	96.2	87%	0.87	55%	0.552	S	S	*	*	S	Bend	trans	-81.7	129	-169.7	31.1	-34.9	0	0	0	114.1
642	G	35.9	Very low	57.8	Low	87 Å²	87	86.7 Å²	86.7	90%	0.897	53%	0.526	S	S	*	.			trans	81.7	48.3	139.9	0	0	0	0	0	118.9
643	G	46.5	Very low	60.3	Low	53 Å²	53	79.4 Å²	79.4	55%	0.546	49%	0.486	S	S	.	.			trans	-105.4	143.3	159.1	0	0	0	0	0	111.3	L645	G643-L645 WeakPolarHBondContact O-CG 3.34Å; G643-L645 PolarHBondContact O-N 3.16Å; G643-L645 VanDerWaalsContact O-N 3.12Å
644	F	56.4	Low	62.1	Low	128 Å²	128	76.6 Å²	76.6	56%	0.561	47%	0.472	S	S	*	.			trans	-68.9	106.5	171.1	-60.7	-70.2	0	0	0	109.3	P552 T646 E692	P552-F644 HydrophobicContact CG-CD2 4.11Å; P552-F644 HydrophobicContact CG-CE2 4.15Å; F644-T646 PolarHBondContact O-N 2.91Å; F644-E692 WeakPolarHBondContact CD1-OE2 3.43Å
645	L	74.7	Confident	64.4	Low	46 Å²	46	74.2 Å²	74.2	24%	0.241	45%	0.451	C	S	.	.			trans	-87	97	-176.5	-53.4	-178.8	0	0	0	109.5	G643 C695 A720	G643-L645 WeakPolarHBondContact O-CG 3.34Å; G643-L645 PolarHBondContact O-N 3.16Å; G643-L645 VanDerWaalsContact O-N 3.12Å; L645-C695 WeakPolarHBondContact O-CB 3.28Å; L645-C695 PolarHBondContact O-SG 3.22Å; L645-A720 HydrophobicContact CB-CB 3.9Å; L645-A720 HydrophobicContact CD1-CB 3.61Å; L645-A720 HydrophobicContact CG-CB 4.4Å
646	T	86.3	Confident	66.5	Low	44 Å²	44	72.7 Å²	72.7	27%	0.27	44%	0.442	S	S	.	.			trans	-84.8	-18.3	170.1	59.4	0	0	0	0	112.5	F644 D688 F689	F644-T646 PolarHBondContact O-N 2.91Å; T646-D688 PolarHBondContact OG1-OD1 3.19Å; T646-F689 WeakPolarHBondContact O-CB 3.17Å; T646-F689 WeakPolarHBondContact O-CD2 3.19Å; T646-F689 PolarHBondContact O-N 3.12Å
647	C	90.3	Very high	68.7	Low	0 Å²	0	64.7 Å²	64.7	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	147.3	-178	-47.2	0	0	0	0	111.4	I687 D688 I721 M726	C647-I687 CarbonylContact C-O 3.58Å; C647-I687 VanDerWaalsContact CA-O 3.26Å; C647-I687 WeakPolarHBondContact CA-O 3.23Å; C647-D688 PolarHBondContact SG-OD1 3.37Å; C647-I721 HydrophobicContact CB-CG1 4.22Å; C647-I721 PolarHBondContact O-N 2.83Å; C647-M726 HydrophobicContact CB-CB 4.43Å; C647-M726 HydrophobicContact CB-SD 4.06Å
648	A	92.1	Very high	70.8	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	149.8	170	0	0	0	0	0	112.9	F686 I687 F689 I718 E719	A648-F686 CarbonylContact O-C 3.52Å; A648-F686 WeakPolarHBondContact O-CA 3.37Å; A648-I687 PolarHBondContact N-O 3.46Å; A648-I687 PolarHBondContact O-N 3.39Å; A648-F689 HydrophobicContact CB-CD2 4.49Å; A648-F689 HydrophobicContact CB-CE2 3.78Å; A648-I718 HydrophobicContact CB-CD1 3.77Å; A648-I718 HydrophobicContact CB-CG1 3.75Å; A648-E719 CarbonylContact C-O 3.57Å; A648-E719 WeakPolarHBondContact CA-O 3.44Å; A648-E719 WeakPolarHBondContact CB-O 3.18Å
649	C	92.5	Very high	73.2	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.02	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	116.4	170.1	179	0	0	0	0	108.4	F686 I718 E719 I721	C649-F686 HydrophobicContact CB-CD1 4.06Å; C649-F686 HydrophobicContact CB-CE1 3.95Å; C649-I718 CarbonylContact O-C 3.49Å; C649-I718 VanDerWaalsContact O-CA 3.31Å; C649-I718 WeakPolarHBondContact O-CA 3.43Å; C649-E719 PolarHBondContact N-O 3.3Å; C649-E719 PolarHBondContact O-N 3.28Å; C649-I721 HydrophobicContact CB-CD1 3.96Å; C649-I721 HydrophobicContact CB-CG1 4.23Å; C649-I721 HydrophobicContact CB-CG2 3.99Å
650	V	92.1	Very high	75.4	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.6	170.3	-169.5	0	0	0	0	108	F653 F666 I684 A685 I687 L716 H717 I718	V650-F653 HydrophobicContact CB-CE2 4.5Å; V650-F653 HydrophobicContact CB-CZ 3.84Å; V650-F653 HydrophobicContact CG1-CE1 3.63Å; V650-F653 HydrophobicContact CG1-CE2 4.32Å; V650-F653 HydrophobicContact CG1-CZ 3.42Å; V650-F653 VanDerWaalsContact CG1-CZ 3.42Å; V650-F666 HydrophobicContact CG2-CE2 4.41Å; V650-F666 HydrophobicContact CG2-CZ 4.32Å; V650-I684 CarbonylContact O-C 3.58Å; V650-I684 WeakPolarHBondContact O-CA 3.44Å; V650-A685 HydrophobicContact CB-CB 4.4Å; V650-A685 PolarHBondContact N-O 3.15Å; V650-A685 PolarHBondContact O-N 2.99Å; V650-I687 HydrophobicContact CG2-CD1 3.72Å; V650-I687 HydrophobicContact CG2-CG1 4.34Å; V650-L716 HydrophobicContact CG1-CD1 4.29Å; V650-L716 HydrophobicContact CG1-CD2 3.77Å; V650-L716 HydrophobicContact CG1-CG 3.96Å; V650-H717 CarbonylContact C-O 3.54Å; V650-H717 WeakPolarHBondContact CA-O 3.21Å; V650-I718 HydrophobicContact CG2-CB 4.35Å; V650-I718 HydrophobicContact CG2-CD1 3.89Å; V650-I718 HydrophobicContact CG2-CG1 3.89Å
651	S	89.8	Confident	77.9	Confident	33 Å²	33	57 Å²	57	23%	0.231	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	158.8	-175.4	55.4	0	0	0	0	111.1	H717	S651-H717 PolarHBondContact N-O 2.91Å; S651-H717 PolarHBondContact O-N 3.42Å
652	G	84.8	Confident	80.4	Confident	31 Å²	31	50.7 Å²	50.7	32%	0.32	31%	0.307	S	S	.	.			trans	85.6	31.2	175.4	0	0	0	0	0	113.8	S654 S715	G652-S654 PolarHBondContact O-N 2.79Å; G652-S715 CarbonylContact O-C 3.48Å; G652-S715 WeakPolarHBondContact O-CB 3.14Å; G652-S715 PolarHBondContact O-OG 3.4Å
653	F	88.2	Confident	82.7	Confident	10 Å²	10	49 Å²	49	4%	0.044	28%	0.278	C	S	.	.			trans	-66.1	126.4	168.6	-57.2	-63.3	0	0	0	110.8	V650 R655 V657 V662 L665 N683 A685 L716	V650-F653 HydrophobicContact CB-CE2 4.5Å; V650-F653 HydrophobicContact CB-CZ 3.84Å; V650-F653 HydrophobicContact CG1-CE1 3.63Å; V650-F653 HydrophobicContact CG1-CE2 4.32Å; V650-F653 HydrophobicContact CG1-CZ 3.42Å; V650-F653 VanDerWaalsContact CG1-CZ 3.42Å; F653-R655 WeakPolarHBondContact CB-O 3.48Å; F653-R655 PolarHBondContact O-N 3.09Å; F653-R655 VanDerWaalsContact O-N 3.1Å; F653-V657 HydrophobicContact CB-CG2 3.45Å; F653-V657 VanDerWaalsContact CB-CG2 3.45Å; F653-V657 HydrophobicContact CD1-CG2 3.69Å; F653-V657 HydrophobicContact CD2-CB 4.3Å; F653-V657 HydrophobicContact CD2-CG2 3.79Å; F653-V657 HydrophobicContact CE1-CG2 4.35Å; F653-V657 HydrophobicContact CE2-CG2 4.45Å; F653-V657 HydrophobicContact CG-CB 4.31Å; F653-V657 HydrophobicContact CG-CG2 3.37Å; F653-V662 HydrophobicContact CZ-CG2 4.22Å; F653-L665 HydrophobicContact CE1-CD1 3.75Å; F653-N683 VanDerWaalsContact CD2-O 3.27Å; F653-N683 WeakPolarHBondContact CD2-O 3.36Å; F653-A685 HydrophobicContact CE2-CB 3.69Å; F653-A685 HydrophobicContact CZ-CB 3.82Å; F653-L716 HydrophobicContact CD1-CD1 3.79Å; F653-L716 HydrophobicContact CD1-CG 4.46Å; F653-L716 HydrophobicContact CE1-CD1 3.69Å; F653-L716 HydrophobicContact CE1-CG 4.37Å
654	S	82.9	Confident	84.6	Confident	69 Å²	69	52.5 Å²	52.5	48%	0.483	28%	0.283	S	S	.	.	S	Bend	trans	-71.2	4.6	178.6	-39.8	0	0	0	0	115.8	G652 H713 S715	G652-S654 PolarHBondContact O-N 2.79Å; S654-H713 PolarHBondContact N-ND1 3.42Å; S654-H713 VanDerWaalsContact N-ND1 3.19Å; S654-S715 PolarHBondContact OG-OG 2.83Å
655	R	83.7	Confident	85.9	Confident	111 Å²	111	47.1 Å²	47.1	42%	0.419	26%	0.261	S	S	.	.	S	Bend	trans	-159.7	166.1	174.6	62.9	174.9	-178.7	-69	-15.9	108.4	F653 V657 E661 H713	F653-R655 WeakPolarHBondContact CB-O 3.48Å; F653-R655 PolarHBondContact O-N 3.09Å; F653-R655 VanDerWaalsContact O-N 3.1Å; R655-V657 WeakPolarHBondContact O-CG2 3.13Å; R655-V657 PolarHBondContact O-N 3.11Å; R655-E661 IonicContact CZ-OE2 3.72Å; R655-E661 IonicContact NE-OE2 3.66Å; R655-E661 PolarHBondContact NE-OE2 2.89Å; R655-E661 IonicContact NH2-OE2 3.85Å; R655-E661 PolarHBondContact NH2-OE2 2.97Å; R655-H713 PolarHBondContact NH1-CE1 3.04Å; R655-H713 PolarHBondContact NH1-NE2 2.88Å; R655-H713 PolarHBondContact NH2-CE1 3.49Å; R655-H713 PolarHBondContact NH2-NE2 3.39Å
656	T	81.9	Confident	86.4	Confident	100 Å²	100	45 Å²	45	61%	0.613	25%	0.249	S	C	*	.			trans	-61.8	131.1	169.3	50.5	0	0	0	0	111	A682	T656-A682 HydrophobicContact CG2-CB 4.15Å
657	V	84	Confident	86.1	Confident	6 Å²	6	47.7 Å²	47.7	4%	0.036	27%	0.268	C	S	.	.			trans	-114.3	149.4	-172	-170.6	0	0	0	0	111	F653 R655 E661 V662 L678 A682	F653-V657 HydrophobicContact CB-CG2 3.45Å; F653-V657 VanDerWaalsContact CB-CG2 3.45Å; F653-V657 HydrophobicContact CD1-CG2 3.69Å; F653-V657 HydrophobicContact CD2-CB 4.3Å; F653-V657 HydrophobicContact CD2-CG2 3.79Å; F653-V657 HydrophobicContact CE1-CG2 4.35Å; F653-V657 HydrophobicContact CE2-CG2 4.45Å; F653-V657 HydrophobicContact CG-CB 4.31Å; F653-V657 HydrophobicContact CG-CG2 3.37Å; R655-V657 WeakPolarHBondContact O-CG2 3.13Å; R655-V657 PolarHBondContact O-N 3.11Å; V657-E661 HydrophobicContact CG1-CB 3.42Å; V657-E661 VanDerWaalsContact CG1-CB 3.42Å; V657-V662 HydrophobicContact CG1-CG2 3.73Å; V657-L678 WeakPolarHBondContact O-CD1 3.41Å; V657-A682 PolarHBondContact N-O 3.29Å
658	K	85.2	Confident	85.4	Confident	142 Å²	142	51 Å²	51	62%	0.617	29%	0.291	S	S	*	.			trans	-100.9	156.8	172.4	-64.3	176.8	-177.9	174	0	111.2	S660 E661 V662	K658-S660 PolarHBondContact O-N 2.76Å; K658-S660 VanDerWaalsContact O-N 3.08Å; K658-E661 WeakPolarHBondContact O-CA 3.21Å; K658-E661 WeakPolarHBondContact O-CB 3.42Å; K658-E661 PolarHBondContact O-N 2.78Å; K658-V662 PolarHBondContact O-N 2.85Å; K658-V662 VanDerWaalsContact O-N 3.11Å
659	D	84	Confident	85	Confident	76 Å²	76	51.7 Å²	51.7	41%	0.406	29%	0.294	S	S	.	.	H	α-helix	trans	-49.7	-40.7	176.7	-52.4	-37.8	0	0	0	112.4	E661 V662 L663 V676 L678	D659-E661 PolarHBondContact O-N 3.02Å; D659-V662 PolarHBondContact O-N 2.96Å; D659-L663 WeakPolarHBondContact O-CG 3.4Å; D659-L663 PolarHBondContact O-N 3Å; D659-V676 HydrophobicContact CB-CG1 4.36Å; D659-L678 VanDerWaalsContact OD1-CD1 3.23Å; D659-L678 WeakPolarHBondContact OD1-CD1 3.12Å; D659-L678 WeakPolarHBondContact OD1-CG 3.04Å
660	S	83.2	Confident	84.4	Confident	69 Å²	69	57.7 Å²	57.7	48%	0.483	33%	0.326	S	S	.	.	H	α-helix	trans	-63.2	-34	176.1	57.6	0	0	0	0	114.3	K658 N664	K658-S660 PolarHBondContact O-N 2.76Å; K658-S660 VanDerWaalsContact O-N 3.08Å; S660-N664 PolarHBondContact O-N 2.93Å; S660-N664 PolarHBondContact O-ND2 2.78Å
661	E	85.9	Confident	83.9	Confident	56 Å²	56	58.6 Å²	58.6	26%	0.262	33%	0.33	S	S	.	.	H	α-helix	trans	-74	-37.5	175.1	-77.1	175.7	-120.1	0	0	110.7	R655 V657 K658 D659 N664 L665	R655-E661 IonicContact CZ-OE2 3.72Å; R655-E661 IonicContact NE-OE2 3.66Å; R655-E661 PolarHBondContact NE-OE2 2.89Å; R655-E661 IonicContact NH2-OE2 3.85Å; R655-E661 PolarHBondContact NH2-OE2 2.97Å; V657-E661 HydrophobicContact CG1-CB 3.42Å; V657-E661 VanDerWaalsContact CG1-CB 3.42Å; K658-E661 WeakPolarHBondContact O-CA 3.21Å; K658-E661 WeakPolarHBondContact O-CB 3.42Å; K658-E661 PolarHBondContact O-N 2.78Å; D659-E661 PolarHBondContact O-N 3.02Å; E661-N664 PolarHBondContact O-N 2.86Å; E661-L665 PolarHBondContact O-N 2.9Å
662	V	87.7	Confident	83.2	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.8	-43.7	174.9	-177.5	0	0	0	0	111.4	F653 V657 K658 D659 N664 L665 V676 L678 A685 I687	F653-V662 HydrophobicContact CZ-CG2 4.22Å; V657-V662 HydrophobicContact CG1-CG2 3.73Å; K658-V662 PolarHBondContact O-N 2.85Å; K658-V662 VanDerWaalsContact O-N 3.11Å; D659-V662 PolarHBondContact O-N 2.96Å; V662-N664 VanDerWaalsContact C-N 3.28Å; V662-N664 PolarHBondContact O-N 2.79Å; V662-L665 WeakPolarHBondContact O-CB 3.34Å; V662-L665 PolarHBondContact O-N 2.86Å; V662-V676 HydrophobicContact CB-CG1 4Å; V662-V676 HydrophobicContact CG1-CG1 3.93Å; V662-V676 HydrophobicContact CG1-CG2 4.39Å; V662-V676 HydrophobicContact CG2-CG1 4.31Å; V662-L678 HydrophobicContact CG2-CD2 4.16Å; V662-A685 HydrophobicContact CG1-CB 4.15Å; V662-A685 HydrophobicContact CG2-CB 3.9Å; V662-I687 HydrophobicContact CG1-CD1 3.7Å; V662-I687 HydrophobicContact CG1-CG1 4.15Å
663	L	85.4	Confident	82.4	Confident	53 Å²	53	60.2 Å²	60.2	28%	0.277	34%	0.344	S	S	.	.	H	α-helix	trans	-59.6	-38.3	175	-69.2	170.9	0	0	0	112.2	D659 L665 F666 I671 V676	D659-L663 WeakPolarHBondContact O-CG 3.4Å; D659-L663 PolarHBondContact O-N 3Å; L663-L665 PolarHBondContact O-N 3.45Å; L663-F666 PolarHBondContact O-N 3.32Å; L663-I671 HydrophobicContact CD2-CB 3.68Å; L663-I671 HydrophobicContact CD2-CG2 3.57Å; L663-V676 HydrophobicContact CD2-CG2 3.79Å; L663-V676 HydrophobicContact CG-CG2 4.18Å
664	N	84.5	Confident	82	Confident	125 Å²	125	66 Å²	66	67%	0.668	38%	0.376	S	S	*	.	H	α-helix	trans	-71.3	-12.3	179.6	-74.1	-21.8	0	0	0	114.4	S660 E661 V662 F666	S660-N664 PolarHBondContact O-N 2.93Å; S660-N664 PolarHBondContact O-ND2 2.78Å; E661-N664 PolarHBondContact O-N 2.86Å; V662-N664 VanDerWaalsContact C-N 3.28Å; V662-N664 PolarHBondContact O-N 2.79Å; N664-F666 VanDerWaalsContact C-N 3.3Å
665	L	85.1	Confident	82.1	Confident	16 Å²	16	63.2 Å²	63.2	8%	0.084	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-22.5	174.8	-63.7	168.9	0	0	0	112.8	F653 E661 V662 L663 P667 A709 L716	F653-L665 HydrophobicContact CE1-CD1 3.75Å; E661-L665 PolarHBondContact O-N 2.9Å; V662-L665 WeakPolarHBondContact O-CB 3.34Å; V662-L665 PolarHBondContact O-N 2.86Å; L663-L665 PolarHBondContact O-N 3.45Å; L665-P667 WeakPolarHBondContact O-CD 3.3Å; L665-A709 HydrophobicContact CB-CB 4.38Å; L665-A709 HydrophobicContact CD2-CB 3.84Å; L665-L716 HydrophobicContact CD1-CD1 3.92Å; L665-L716 HydrophobicContact CD2-CD1 4.3Å
666	F	85.7	Confident	82.3	Confident	1 Å²	1	58.4 Å²	58.4	0%	0.004	34%	0.34	C	S	.	.			trans	-124	55.9	-173.6	-54.8	-75.3	0	0	0	112.5	V650 L663 N664 S668 I669 I671 I687 A698 V702 I718	V650-F666 HydrophobicContact CG2-CE2 4.41Å; V650-F666 HydrophobicContact CG2-CZ 4.32Å; L663-F666 PolarHBondContact O-N 3.32Å; N664-F666 VanDerWaalsContact C-N 3.3Å; F666-S668 PolarHBondContact O-N 2.86Å; F666-I669 HydrophobicContact CB-CB 4.11Å; F666-I669 HydrophobicContact CB-CD1 4.16Å; F666-I669 HydrophobicContact CB-CG1 4.18Å; F666-I669 HydrophobicContact CD1-CD1 4.09Å; F666-I669 HydrophobicContact CG-CD1 4.47Å; F666-I669 PolarHBondContact O-N 3.19Å; F666-I671 HydrophobicContact CB-CD1 3.78Å; F666-I671 HydrophobicContact CD2-CD1 3.74Å; F666-I671 HydrophobicContact CG-CD1 4.04Å; F666-I687 HydrophobicContact CD2-CD1 4.09Å; F666-I687 HydrophobicContact CE2-CD1 3.57Å; F666-I687 HydrophobicContact CZ-CD1 4.4Å; F666-A698 HydrophobicContact CD1-CB 3.74Å; F666-A698 HydrophobicContact CE1-CB 3.62Å; F666-A698 HydrophobicContact CZ-CB 4.35Å; F666-V702 HydrophobicContact CE1-CG2 3.71Å; F666-V702 HydrophobicContact CZ-CG2 3.99Å; F666-I718 HydrophobicContact CE1-CD1 4.23Å; F666-I718 HydrophobicContact CZ-CD1 3.9Å
667	P	78.3	Confident	82.6	Confident	101 Å²	101	59.8 Å²	59.8	66%	0.656	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.4	-175.8	30.3	-37.1	0	0	0	113.4	L665 I669	L665-P667 WeakPolarHBondContact O-CD 3.3Å; P667-I669 VanDerWaalsContact C-N 3.32Å
668	S	76.8	Confident	82.8	Confident	69 Å²	69	61.7 Å²	61.7	48%	0.483	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-5.4	175.8	85.9	0	0	0	0	113.7	F666 E701	F666-S668 PolarHBondContact O-N 2.86Å; S668-E701 PolarHBondContact OG-OE2 3.02Å
669	I	82.9	Confident	82.8	Confident	15 Å²	15	55.6 Å²	55.6	8%	0.077	32%	0.32	C	S	.	.	S	Bend	trans	-130.9	127	-165.2	-45.7	-174.4	0	0	0	110.6	F666 P667 I671 F689 N694 R697 A698	F666-I669 HydrophobicContact CB-CB 4.11Å; F666-I669 HydrophobicContact CB-CD1 4.16Å; F666-I669 HydrophobicContact CB-CG1 4.18Å; F666-I669 HydrophobicContact CD1-CD1 4.09Å; F666-I669 HydrophobicContact CG-CD1 4.47Å; F666-I669 PolarHBondContact O-N 3.19Å; P667-I669 VanDerWaalsContact C-N 3.32Å; I669-I671 HydrophobicContact CG2-CG1 4.31Å; I669-I671 PolarHBondContact O-N 3.18Å; I669-F689 HydrophobicContact CG2-CD1 3.95Å; I669-F689 HydrophobicContact CG2-CE1 3.95Å; I669-N694 HydrophobicContact CG2-CB 3.55Å; I669-R697 HydrophobicContact CD1-CB 3.91Å; I669-A698 VanDerWaalsContact CD1-CA 3.48Å; I669-A698 HydrophobicContact CD1-CB 3.6Å; I669-A698 VanDerWaalsContact CD1-N 3.29Å
670	L	79.7	Confident	82.3	Confident	129 Å²	129	57.8 Å²	57.8	68%	0.675	34%	0.338	S	S	*	.			trans	-74.4	108.4	173.8	-172.8	69	0	0	0	110.1	I690	L670-I690 HydrophobicContact CB-CD1 4.37Å; L670-I690 HydrophobicContact CD2-CD1 3.77Å; L670-I690 HydrophobicContact CG-CD1 3.9Å
671	I	82.1	Confident	81.8	Confident	18 Å²	18	58.1 Å²	58.1	9%	0.092	34%	0.335	C	S	.	.			trans	-113.8	120	173.4	-56.7	171.5	0	0	0	107.9	L663 F666 I669 A675 V676 I687 F689	L663-I671 HydrophobicContact CD2-CB 3.68Å; L663-I671 HydrophobicContact CD2-CG2 3.57Å; F666-I671 HydrophobicContact CB-CD1 3.78Å; F666-I671 HydrophobicContact CD2-CD1 3.74Å; F666-I671 HydrophobicContact CG-CD1 4.04Å; I669-I671 HydrophobicContact CG2-CG1 4.31Å; I669-I671 PolarHBondContact O-N 3.18Å; I671-A675 HydrophobicContact CG2-CB 4.03Å; I671-V676 HydrophobicContact CG2-CG2 3.95Å; I671-I687 HydrophobicContact CD1-CD1 4.49Å; I671-I687 HydrophobicContact CD1-CG2 4.12Å; I671-I687 HydrophobicContact CG1-CG2 4.4Å; I671-I687 HydrophobicContact CG2-CG2 3.8Å; I671-F689 HydrophobicContact CD1-CD1 4.48Å; I671-F689 HydrophobicContact CD1-CE1 3.74Å; I671-F689 HydrophobicContact CD1-CZ 4.38Å; I671-F689 HydrophobicContact CG1-CD1 4.04Å; I671-F689 HydrophobicContact CG1-CE1 3.78Å
672	P	75.2	Confident	81.1	Confident	41 Å²	41	56.5 Å²	56.5	27%	0.266	33%	0.331	S	S	.	.			trans	-61	145.9	172.3	-23.3	34.7	0	0	0	111.7	D674 A675 I690	P672-D674 WeakPolarHBondContact CB-OD1 3.39Å; P672-D674 PolarHBondContact O-N 2.98Å; P672-A675 HydrophobicContact CB-CB 4.09Å; P672-A675 HydrophobicContact CG-CB 4.28Å; P672-A675 VanDerWaalsContact O-CB 3.28Å; P672-A675 WeakPolarHBondContact O-CB 3.31Å; P672-A675 PolarHBondContact O-N 2.99Å; P672-I690 HydrophobicContact CG-CD1 3.78Å; P672-I690 HydrophobicContact CG-CG1 3.68Å
673	G	67.8	Low	80.8	Confident	57 Å²	57	59.6 Å²	59.6	59%	0.588	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.8	-177.7	0	0	0	0	0	114.5
674	D	79.6	Confident	81	Confident	132 Å²	132	59.6 Å²	59.6	71%	0.706	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-4	176.4	61.1	-35.4	0	0	0	114	P672	P672-D674 WeakPolarHBondContact CB-OD1 3.39Å; P672-D674 PolarHBondContact O-N 2.98Å
675	A	84.7	Confident	81.3	Confident	10 Å²	10	53.6 Å²	53.6	8%	0.083	32%	0.315	C	S	.	.	S	Bend	trans	-83.1	-13.1	178.3	0	0	0	0	0	114	I671 P672 I687 D688	I671-A675 HydrophobicContact CG2-CB 4.03Å; P672-A675 HydrophobicContact CB-CB 4.09Å; P672-A675 HydrophobicContact CG-CB 4.28Å; P672-A675 VanDerWaalsContact O-CB 3.28Å; P672-A675 WeakPolarHBondContact O-CB 3.31Å; P672-A675 PolarHBondContact O-N 2.99Å; A675-I687 WeakPolarHBondContact O-CA 3.45Å; A675-D688 HydrophobicContact CB-CB 4.45Å; A675-D688 VanDerWaalsContact CB-O 3.27Å; A675-D688 WeakPolarHBondContact CB-O 3.46Å; A675-D688 PolarHBondContact O-N 3.38Å
676	V	89.1	Confident	81.6	Confident	11 Å²	11	53 Å²	53	7%	0.067	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	134.1	178.5	-178.1	0	0	0	0	110	D659 V662 L663 I671 F686	D659-V676 HydrophobicContact CB-CG1 4.36Å; V662-V676 HydrophobicContact CB-CG1 4Å; V662-V676 HydrophobicContact CG1-CG1 3.93Å; V662-V676 HydrophobicContact CG1-CG2 4.39Å; V662-V676 HydrophobicContact CG2-CG1 4.31Å; L663-V676 HydrophobicContact CD2-CG2 3.79Å; L663-V676 HydrophobicContact CG-CG2 4.18Å; I671-V676 HydrophobicContact CG2-CG2 3.95Å; V676-F686 CarbonylContact C-O 3.57Å; V676-F686 WeakPolarHBondContact CA-O 3.42Å
677	R	88.1	Confident	81.9	Confident	128 Å²	128	53 Å²	53	48%	0.483	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	111.6	176.3	-60.5	-178	178.4	-136.9	-4.5	110	F686 L730	R677-F686 HydrophobicContact CB-CB 4.4Å; R677-F686 PolarHBondContact N-O 3.24Å; R677-F686 PolarHBondContact O-N 3.03Å; R677-L730 HydrophobicContact CB-CD1 4.1Å; R677-L730 HydrophobicContact CB-CD2 4.23Å; R677-L730 HydrophobicContact CG-CD1 4.47Å
678	L	88.2	Confident	82.5	Confident	47 Å²	47	50.4 Å²	50.4	25%	0.246	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	142.8	172.9	-69	165.9	0	0	0	111.3	V657 D659 V662 A685	V657-L678 WeakPolarHBondContact O-CD1 3.41Å; D659-L678 VanDerWaalsContact OD1-CD1 3.23Å; D659-L678 WeakPolarHBondContact OD1-CD1 3.12Å; D659-L678 WeakPolarHBondContact OD1-CG 3.04Å; V662-L678 HydrophobicContact CG2-CD2 4.16Å; L678-A685 HydrophobicContact CD2-CB 3.81Å
679	A	84	Confident	83.2	Confident	14 Å²	14	47.3 Å²	47.3	12%	0.116	27%	0.27	C	S	.	.			trans	-70.6	161.6	166.4	0	0	0	0	0	110.9	D681 A682 I684 F686	A679-D681 WeakPolarHBondContact CB-OD1 3.3Å; A679-D681 PolarHBondContact O-N 3.2Å; A679-D681 VanDerWaalsContact O-N 3.1Å; A679-A682 PolarHBondContact O-N 3.24Å; A679-I684 HydrophobicContact CB-CB 3.9Å; A679-I684 WeakPolarHBondContact CB-O 3.44Å; A679-I684 PolarHBondContact N-O 3.3Å; A679-F686 HydrophobicContact CB-CE2 4.28Å
680	P	74.8	Confident	83.3	Confident	121 Å²	121	51.5 Å²	51.5	79%	0.786	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.7	-177.8	-25	34.9	0	0	0	114.8
681	D	72	Confident	83.6	Confident	77 Å²	77	47.4 Å²	47.4	41%	0.412	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-7.2	178.2	69.4	-5.7	0	0	0	114.1	A679 N683 I684	A679-D681 WeakPolarHBondContact CB-OD1 3.3Å; A679-D681 PolarHBondContact O-N 3.2Å; A679-D681 VanDerWaalsContact O-N 3.1Å; D681-N683 PolarHBondContact O-N 3.23Å; D681-N683 PolarHBondContact O-ND2 3.34Å; D681-N683 PolarHBondContact OD1-N 3.38Å; D681-I684 PolarHBondContact OD1-N 3.43Å
682	A	71.8	Confident	83.8	Confident	21 Å²	21	50.2 Å²	50.2	17%	0.174	29%	0.287	C	S	.	.	S	Bend	trans	52.6	17.5	-174.1	0	0	0	0	0	115.6	T656 V657 A679	T656-A682 HydrophobicContact CG2-CB 4.15Å; V657-A682 PolarHBondContact N-O 3.29Å; A679-A682 PolarHBondContact O-N 3.24Å
683	N	81.9	Confident	84.3	Confident	65 Å²	65	51.3 Å²	51.3	35%	0.348	29%	0.29	S	S	.	.	S	Bend	trans	-106.4	-7.6	178.7	-65.2	-32.4	0	0	0	112.6	F653 D681	F653-N683 VanDerWaalsContact CD2-O 3.27Å; F653-N683 WeakPolarHBondContact CD2-O 3.36Å; D681-N683 PolarHBondContact O-N 3.23Å; D681-N683 PolarHBondContact O-ND2 3.34Å; D681-N683 PolarHBondContact OD1-N 3.38Å
684	I	88.6	Confident	85.3	Confident	53 Å²	53	50 Å²	50	27%	0.272	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.2	171.7	-55.9	176	0	0	0	109	V650 A679 D681 F686	V650-I684 CarbonylContact O-C 3.58Å; V650-I684 WeakPolarHBondContact O-CA 3.44Å; A679-I684 HydrophobicContact CB-CB 3.9Å; A679-I684 WeakPolarHBondContact CB-O 3.44Å; A679-I684 PolarHBondContact N-O 3.3Å; D681-I684 PolarHBondContact OD1-N 3.43Å; I684-F686 HydrophobicContact CG2-CE1 4.15Å; I684-F686 HydrophobicContact CG2-CE2 3.87Å; I684-F686 HydrophobicContact CG2-CZ 3.64Å
685	A	90.4	Very high	85.8	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.3	174.1	0	0	0	0	0	110.3	V650 F653 V662 L678	V650-A685 HydrophobicContact CB-CB 4.4Å; V650-A685 PolarHBondContact N-O 3.15Å; V650-A685 PolarHBondContact O-N 2.99Å; F653-A685 HydrophobicContact CE2-CB 3.69Å; F653-A685 HydrophobicContact CZ-CB 3.82Å; V662-A685 HydrophobicContact CG1-CB 4.15Å; V662-A685 HydrophobicContact CG2-CB 3.9Å; L678-A685 HydrophobicContact CD2-CB 3.81Å
686	F	92.3	Very high	86.1	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.018	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	137.1	174.1	-57.5	-80.9	0	0	0	109.8	A648 C649 V676 R677 A679 I684 I721 M726 R729 L730	A648-F686 CarbonylContact O-C 3.52Å; A648-F686 WeakPolarHBondContact O-CA 3.37Å; C649-F686 HydrophobicContact CB-CD1 4.06Å; C649-F686 HydrophobicContact CB-CE1 3.95Å; V676-F686 CarbonylContact C-O 3.57Å; V676-F686 WeakPolarHBondContact CA-O 3.42Å; R677-F686 HydrophobicContact CB-CB 4.4Å; R677-F686 PolarHBondContact N-O 3.24Å; R677-F686 PolarHBondContact O-N 3.03Å; A679-F686 HydrophobicContact CB-CE2 4.28Å; I684-F686 HydrophobicContact CG2-CE1 4.15Å; I684-F686 HydrophobicContact CG2-CE2 3.87Å; I684-F686 HydrophobicContact CG2-CZ 3.64Å; F686-I721 HydrophobicContact CD1-CD1 3.83Å; F686-I721 HydrophobicContact CE1-CD1 4.13Å; F686-M726 HydrophobicContact CB-CG 3.76Å; F686-M726 HydrophobicContact CB-SD 3.91Å; F686-M726 HydrophobicContact CD1-CG 4.04Å; F686-M726 HydrophobicContact CG-CG 4.02Å; F686-R729 HydrophobicContact CE1-CB 3.88Å; F686-R729 HydrophobicContact CZ-CB 3.6Å; F686-L730 HydrophobicContact CD2-CD1 4.23Å; F686-L730 HydrophobicContact CD2-CD2 3.53Å; F686-L730 HydrophobicContact CD2-CG 3.71Å; F686-L730 HydrophobicContact CE2-CD2 3.78Å; F686-L730 HydrophobicContact CE2-CG 3.93Å; F686-L730 HydrophobicContact CG-CD1 4.48Å; F686-L730 HydrophobicContact CG-CG 4.33Å
687	I	92.2	Very high	86	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	123.8	-176	-52	177.5	0	0	0	109.4	C647 A648 V650 V662 F666 I671 A675 F689	C647-I687 CarbonylContact C-O 3.58Å; C647-I687 VanDerWaalsContact CA-O 3.26Å; C647-I687 WeakPolarHBondContact CA-O 3.23Å; A648-I687 PolarHBondContact N-O 3.46Å; A648-I687 PolarHBondContact O-N 3.39Å; V650-I687 HydrophobicContact CG2-CD1 3.72Å; V650-I687 HydrophobicContact CG2-CG1 4.34Å; V662-I687 HydrophobicContact CG1-CD1 3.7Å; V662-I687 HydrophobicContact CG1-CG1 4.15Å; F666-I687 HydrophobicContact CD2-CD1 4.09Å; F666-I687 HydrophobicContact CE2-CD1 3.57Å; F666-I687 HydrophobicContact CZ-CD1 4.4Å; I671-I687 HydrophobicContact CD1-CD1 4.49Å; I671-I687 HydrophobicContact CD1-CG2 4.12Å; I671-I687 HydrophobicContact CG1-CG2 4.4Å; I671-I687 HydrophobicContact CG2-CG2 3.8Å; A675-I687 WeakPolarHBondContact O-CA 3.45Å; I687-F689 HydrophobicContact CB-CD2 4.39Å; I687-F689 HydrophobicContact CB-CE2 3.85Å; I687-F689 HydrophobicContact CB-CZ 4.1Å; I687-F689 HydrophobicContact CD1-CZ 4.2Å; I687-F689 HydrophobicContact CG2-CD1 4.2Å; I687-F689 HydrophobicContact CG2-CD2 3.98Å; I687-F689 HydrophobicContact CG2-CE1 3.91Å; I687-F689 HydrophobicContact CG2-CE2 3.67Å; I687-F689 HydrophobicContact CG2-CG 4.24Å; I687-F689 HydrophobicContact CG2-CZ 3.62Å
688	D	90.7	Very high	86.1	Confident	46 Å²	46	49.1 Å²	49.1	25%	0.246	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	93.2	174.9	-158	3.8	0	0	0	110.5	T646 C647 A675 R723 M726	T646-D688 PolarHBondContact OG1-OD1 3.19Å; C647-D688 PolarHBondContact SG-OD1 3.37Å; A675-D688 HydrophobicContact CB-CB 4.45Å; A675-D688 VanDerWaalsContact CB-O 3.27Å; A675-D688 WeakPolarHBondContact CB-O 3.46Å; A675-D688 PolarHBondContact O-N 3.38Å; D688-R723 IonicContact OD2-NE 3.21Å; D688-M726 HydrophobicContact CB-CE 4.4Å
689	F	90.3	Very high	86.1	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.018	25%	0.25	C	S	.	.			trans	-73.1	141.4	-174.9	-66.2	-88.2	0	0	0	112.3	T646 A648 I669 I671 I687 S691 N694 C695 A698	T646-F689 WeakPolarHBondContact O-CB 3.17Å; T646-F689 WeakPolarHBondContact O-CD2 3.19Å; T646-F689 PolarHBondContact O-N 3.12Å; A648-F689 HydrophobicContact CB-CD2 4.49Å; A648-F689 HydrophobicContact CB-CE2 3.78Å; I669-F689 HydrophobicContact CG2-CD1 3.95Å; I669-F689 HydrophobicContact CG2-CE1 3.95Å; I671-F689 HydrophobicContact CD1-CD1 4.48Å; I671-F689 HydrophobicContact CD1-CE1 3.74Å; I671-F689 HydrophobicContact CD1-CZ 4.38Å; I671-F689 HydrophobicContact CG1-CD1 4.04Å; I671-F689 HydrophobicContact CG1-CE1 3.78Å; I687-F689 HydrophobicContact CB-CD2 4.39Å; I687-F689 HydrophobicContact CB-CE2 3.85Å; I687-F689 HydrophobicContact CB-CZ 4.1Å; I687-F689 HydrophobicContact CD1-CZ 4.2Å; I687-F689 HydrophobicContact CG2-CD1 4.2Å; I687-F689 HydrophobicContact CG2-CD2 3.98Å; I687-F689 HydrophobicContact CG2-CE1 3.91Å; I687-F689 HydrophobicContact CG2-CE2 3.67Å; I687-F689 HydrophobicContact CG2-CG 4.24Å; I687-F689 HydrophobicContact CG2-CZ 3.62Å; F689-S691 PolarHBondContact O-N 3.47Å; F689-N694 HydrophobicContact CB-CB 4.05Å; F689-N694 HydrophobicContact CD1-CB 3.9Å; F689-N694 HydrophobicContact CG-CB 4.3Å; F689-C695 HydrophobicContact CB-CB 4.12Å; F689-C695 HydrophobicContact CD2-CB 3.56Å; F689-C695 HydrophobicContact CE2-CB 4.2Å; F689-C695 HydrophobicContact CG-CB 3.98Å; F689-A698 HydrophobicContact CE1-CB 3.72Å; F689-A698 HydrophobicContact CE2-CB 4.04Å; F689-A698 HydrophobicContact CZ-CB 3.28Å
690	I	85.1	Confident	86.3	Confident	103 Å²	103	52.1 Å²	52.1	53%	0.528	27%	0.269	S	S	.	.	S	Bend	trans	-54.3	-25.8	175.8	-52	172.9	0	0	0	112.5	L670 P672	L670-I690 HydrophobicContact CB-CD1 4.37Å; L670-I690 HydrophobicContact CD2-CD1 3.77Å; L670-I690 HydrophobicContact CG-CD1 3.9Å; P672-I690 HydrophobicContact CG-CD1 3.78Å; P672-I690 HydrophobicContact CG-CG1 3.68Å
691	S	86.3	Confident	86.7	Confident	43 Å²	43	49 Å²	49	30%	0.301	24%	0.244	S	C	.	.	S	Bend	trans	-149.1	153.6	175.3	68.6	0	0	0	0	112.6	F689 N693 N694 C695	F689-S691 PolarHBondContact O-N 3.47Å; S691-N693 PolarHBondContact O-N 3.12Å; S691-N694 WeakPolarHBondContact O-CB 3.42Å; S691-N694 PolarHBondContact O-N 3.18Å; S691-N694 PolarHBondContact OG-N 2.71Å; S691-N694 PolarHBondContact OG-OD1 3.48Å; S691-C695 PolarHBondContact O-N 3.05Å; S691-C695 VanDerWaalsContact O-N 3.07Å
692	E	86.4	Confident	87.3	Confident	78 Å²	78	45.5 Å²	45.5	36%	0.364	23%	0.225	S	C	.	.	H	α-helix	trans	-54.1	-37.3	169.8	-174.6	-158.9	-175.2	0	0	111.9	F644 N694 C695 R696	F644-E692 WeakPolarHBondContact CD1-OE2 3.43Å; E692-N694 VanDerWaalsContact C-N 3.29Å; E692-N694 PolarHBondContact O-N 3.38Å; E692-C695 PolarHBondContact O-N 2.95Å; E692-R696 WeakPolarHBondContact O-CB 3.23Å; E692-R696 PolarHBondContact O-N 2.91Å
693	N	86	Confident	87.8	Confident	64 Å²	64	47.8 Å²	47.8	34%	0.342	24%	0.239	S	C	.	.	H	α-helix	trans	-65.5	-32.9	178	-176.5	69.7	0	0	0	112.4	S691 R696 R697	S691-N693 PolarHBondContact O-N 3.12Å; N693-R696 PolarHBondContact OD1-NH2 3.25Å; N693-R697 WeakPolarHBondContact O-CB 3.45Å; N693-R697 VanDerWaalsContact O-CG 3.31Å; N693-R697 WeakPolarHBondContact O-CG 3.45Å; N693-R697 PolarHBondContact O-N 3.28Å; N693-R697 VanDerWaalsContact O-N 3.08Å
694	N	89.3	Confident	87.7	Confident	29 Å²	29	48.4 Å²	48.4	16%	0.155	25%	0.246	C	C	.	.	H	α-helix	trans	-69.9	-45.1	171.5	-74.1	6.4	0	0	0	110.8	I669 F689 S691 E692 R696 R697 A698	I669-N694 HydrophobicContact CG2-CB 3.55Å; F689-N694 HydrophobicContact CB-CB 4.05Å; F689-N694 HydrophobicContact CD1-CB 3.9Å; F689-N694 HydrophobicContact CG-CB 4.3Å; S691-N694 WeakPolarHBondContact O-CB 3.42Å; S691-N694 PolarHBondContact O-N 3.18Å; S691-N694 PolarHBondContact OG-N 2.71Å; S691-N694 PolarHBondContact OG-OD1 3.48Å; E692-N694 VanDerWaalsContact C-N 3.29Å; E692-N694 PolarHBondContact O-N 3.38Å; N694-R696 PolarHBondContact O-N 3.03Å; N694-R697 PolarHBondContact O-N 3.41Å; N694-A698 PolarHBondContact O-N 3.49Å
695	C	90.6	Very high	86.5	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.014	28%	0.275	C	S	.	.	H	α-helix	trans	-58.3	-48.2	175.5	-173.7	0	0	0	0	111.9	L645 F689 S691 E692 R697 A698 V699	L645-C695 WeakPolarHBondContact O-CB 3.28Å; L645-C695 PolarHBondContact O-SG 3.22Å; F689-C695 HydrophobicContact CB-CB 4.12Å; F689-C695 HydrophobicContact CD2-CB 3.56Å; F689-C695 HydrophobicContact CE2-CB 4.2Å; F689-C695 HydrophobicContact CG-CB 3.98Å; S691-C695 PolarHBondContact O-N 3.05Å; S691-C695 VanDerWaalsContact O-N 3.07Å; E692-C695 PolarHBondContact O-N 2.95Å; C695-R697 VanDerWaalsContact C-N 3.32Å; C695-R697 PolarHBondContact O-N 3.32Å; C695-A698 WeakPolarHBondContact O-CB 3.3Å; C695-A698 PolarHBondContact O-N 3.47Å; C695-V699 WeakPolarHBondContact O-CG2 3.47Å; C695-V699 PolarHBondContact O-N 3.11Å
696	R	89.2	Confident	85.3	Confident	125 Å²	125	57.7 Å²	57.7	47%	0.472	30%	0.304	S	S	.	.	H	α-helix	trans	-62.1	-36.8	177	-176.1	175.4	61.7	-137.9	-3.2	112.6	E692 N693 N694 N700	E692-R696 WeakPolarHBondContact O-CB 3.23Å; E692-R696 PolarHBondContact O-N 2.91Å; N693-R696 PolarHBondContact OD1-NH2 3.25Å; N694-R696 PolarHBondContact O-N 3.03Å; R696-N700 WeakPolarHBondContact O-CB 3.41Å; R696-N700 VanDerWaalsContact O-CG 3.23Å; R696-N700 PolarHBondContact O-N 3.13Å; R696-N700 PolarHBondContact O-OD1 2.88Å
697	R	88	Confident	84.2	Confident	136 Å²	136	58.2 Å²	58.2	51%	0.513	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-45.3	172.5	-81	179.7	177	-161	0.1	111.6	I669 N693 N694 C695 V699 N700 E701	I669-R697 HydrophobicContact CD1-CB 3.91Å; N693-R697 WeakPolarHBondContact O-CB 3.45Å; N693-R697 VanDerWaalsContact O-CG 3.31Å; N693-R697 WeakPolarHBondContact O-CG 3.45Å; N693-R697 PolarHBondContact O-N 3.28Å; N693-R697 VanDerWaalsContact O-N 3.08Å; N694-R697 PolarHBondContact O-N 3.41Å; C695-R697 VanDerWaalsContact C-N 3.32Å; C695-R697 PolarHBondContact O-N 3.32Å; R697-V699 VanDerWaalsContact C-N 3.32Å; R697-V699 PolarHBondContact O-N 2.88Å; R697-N700 PolarHBondContact O-N 3.36Å; R697-E701 VanDerWaalsContact O-CB 3.25Å; R697-E701 WeakPolarHBondContact O-CB 3.36Å; R697-E701 PolarHBondContact O-N 3.32Å
698	A	89.3	Confident	83.3	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-60.2	-42.9	177	0	0	0	0	0	111.9	F666 I669 F689 N694 C695 E701 V702 I718	F666-A698 HydrophobicContact CD1-CB 3.74Å; F666-A698 HydrophobicContact CE1-CB 3.62Å; F666-A698 HydrophobicContact CZ-CB 4.35Å; I669-A698 VanDerWaalsContact CD1-CA 3.48Å; I669-A698 HydrophobicContact CD1-CB 3.6Å; I669-A698 VanDerWaalsContact CD1-N 3.29Å; F689-A698 HydrophobicContact CE1-CB 3.72Å; F689-A698 HydrophobicContact CE2-CB 4.04Å; F689-A698 HydrophobicContact CZ-CB 3.28Å; N694-A698 PolarHBondContact O-N 3.49Å; C695-A698 WeakPolarHBondContact O-CB 3.3Å; C695-A698 PolarHBondContact O-N 3.47Å; A698-E701 PolarHBondContact O-N 3.38Å; A698-V702 PolarHBondContact O-N 2.81Å; A698-V702 VanDerWaalsContact O-N 3.09Å; A698-I718 HydrophobicContact CB-CD1 3.92Å
699	V	89.7	Confident	82.5	Confident	29 Å²	29	64.3 Å²	64.3	18%	0.176	33%	0.333	C	S	.	.	H	α-helix	trans	-62.3	-46.7	176.3	174	0	0	0	0	111.5	C695 R697 S703 I718 A720	C695-V699 WeakPolarHBondContact O-CG2 3.47Å; C695-V699 PolarHBondContact O-N 3.11Å; R697-V699 VanDerWaalsContact C-N 3.32Å; R697-V699 PolarHBondContact O-N 2.88Å; V699-S703 VanDerWaalsContact O-CB 3.23Å; V699-S703 WeakPolarHBondContact O-CB 3.37Å; V699-S703 PolarHBondContact O-N 3.22Å; V699-S703 PolarHBondContact O-OG 2.88Å; V699-I718 HydrophobicContact CB-CG2 4.3Å; V699-I718 HydrophobicContact CG2-CD1 4.29Å; V699-I718 HydrophobicContact CG2-CG1 4.24Å; V699-I718 HydrophobicContact CG2-CG2 4.16Å; V699-A720 HydrophobicContact CG2-CB 4.21Å
700	N	86.7	Confident	81.9	Confident	94 Å²	94	67 Å²	67	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-65.5	-42.4	176.8	-69.7	-1.9	0	0	0	112.2	R696 R697 V702 S703 T704	R696-N700 WeakPolarHBondContact O-CB 3.41Å; R696-N700 VanDerWaalsContact O-CG 3.23Å; R696-N700 PolarHBondContact O-N 3.13Å; R696-N700 PolarHBondContact O-OD1 2.88Å; R697-N700 PolarHBondContact O-N 3.36Å; N700-V702 VanDerWaalsContact C-N 3.29Å; N700-V702 PolarHBondContact O-N 3.27Å; N700-S703 PolarHBondContact O-N 2.9Å; N700-S703 VanDerWaalsContact O-N 3.16Å; N700-T704 PolarHBondContact O-N 2.76Å; N700-T704 PolarHBondContact O-OG1 2.89Å
701	E	84.8	Confident	81.5	Confident	57 Å²	57	69 Å²	69	27%	0.266	35%	0.352	S	S	.	.	H	α-helix	trans	-66.4	-26.3	-178.1	-175.5	167.7	-171.3	0	0	112.7	S668 R697 A698 T704 S707	S668-E701 PolarHBondContact OG-OE2 3.02Å; R697-E701 VanDerWaalsContact O-CB 3.25Å; R697-E701 WeakPolarHBondContact O-CB 3.36Å; R697-E701 PolarHBondContact O-N 3.32Å; A698-E701 PolarHBondContact O-N 3.38Å; E701-T704 PolarHBondContact O-OG1 3.02Å; E701-S707 WeakPolarHBondContact O-CB 3.42Å; E701-S707 PolarHBondContact O-OG 2.93Å
702	V	84.7	Confident	81.1	Confident	3 Å²	3	69.5 Å²	69.5	2%	0.018	36%	0.356	C	S	.	.	H	α-helix	trans	-88.2	-33.4	169.3	166.1	0	0	0	0	111.9	F666 A698 N700 T704 A709 K710 L716 I718	F666-V702 HydrophobicContact CE1-CG2 3.71Å; F666-V702 HydrophobicContact CZ-CG2 3.99Å; A698-V702 PolarHBondContact O-N 2.81Å; A698-V702 VanDerWaalsContact O-N 3.09Å; N700-V702 VanDerWaalsContact C-N 3.29Å; N700-V702 PolarHBondContact O-N 3.27Å; V702-T704 PolarHBondContact O-N 2.75Å; V702-A709 HydrophobicContact CG2-CB 4.24Å; V702-K710 WeakPolarHBondContact O-CD 3.45Å; V702-K710 WeakPolarHBondContact O-CE 3.46Å; V702-K710 PolarHBondContact O-NZ 3.26Å; V702-L716 HydrophobicContact CB-CD2 4.27Å; V702-L716 HydrophobicContact CG1-CD2 3.44Å; V702-L716 VanDerWaalsContact CG1-CD2 3.44Å; V702-L716 HydrophobicContact CG2-CD2 3.74Å; V702-I718 HydrophobicContact CB-CB 4.35Å; V702-I718 HydrophobicContact CB-CG2 3.46Å; V702-I718 VanDerWaalsContact CB-CG2 3.46Å; V702-I718 HydrophobicContact CG1-CB 4.22Å; V702-I718 HydrophobicContact CG1-CG2 3.61Å; V702-I718 HydrophobicContact CG2-CB 4.48Å; V702-I718 HydrophobicContact CG2-CG2 3.97Å
703	S	81.1	Confident	80.9	Confident	68 Å²	68	65.9 Å²	65.9	48%	0.476	34%	0.339	S	S	.	.	H	α-helix	trans	-65.6	-38	-178.6	-63.2	0	0	0	0	112.3	V699 N700 K710	V699-S703 VanDerWaalsContact O-CB 3.23Å; V699-S703 WeakPolarHBondContact O-CB 3.37Å; V699-S703 PolarHBondContact O-N 3.22Å; V699-S703 PolarHBondContact O-OG 2.88Å; N700-S703 PolarHBondContact O-N 2.9Å; N700-S703 VanDerWaalsContact O-N 3.16Å; S703-K710 PolarHBondContact O-NZ 3.33Å
704	T	79.1	Confident	80.6	Confident	78 Å²	78	67.8 Å²	67.8	48%	0.479	36%	0.355	S	S	.	.	S	Bend	trans	-57.1	140.8	177.3	44.4	0	0	0	0	112.9	N700 E701 V702 S707	N700-T704 PolarHBondContact O-N 2.76Å; N700-T704 PolarHBondContact O-OG1 2.89Å; E701-T704 PolarHBondContact O-OG1 3.02Å; V702-T704 PolarHBondContact O-N 2.75Å; T704-S707 PolarHBondContact O-OG 2.96Å; T704-S707 PolarHBondContact OG1-OG 2.83Å
705	E	64.2	Low	80.3	Confident	189 Å²	189	69.9 Å²	69.9	88%	0.883	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	138	171.3	-63.2	-174.7	159	0	0	110
706	G	66.3	Low	80.1	Confident	59 Å²	59	70 Å²	70	61%	0.608	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.2	-4.6	-179.3	0	0	0	0	0	116.2	Q711	G706-Q711 PolarHBondContact O-NE2 3.34Å
707	S	69.3	Low	80.1	Confident	15 Å²	15	69.2 Å²	69.2	11%	0.105	37%	0.373	C	S	.	.			trans	-57.4	141.3	-179.6	-59.5	0	0	0	0	114.3	E701 T704 A709 K710 Q711	E701-S707 WeakPolarHBondContact O-CB 3.42Å; E701-S707 PolarHBondContact O-OG 2.93Å; T704-S707 PolarHBondContact O-OG 2.96Å; T704-S707 PolarHBondContact OG1-OG 2.83Å; S707-A709 PolarHBondContact O-N 3.23Å; S707-A709 VanDerWaalsContact O-N 3.12Å; S707-K710 PolarHBondContact O-N 2.91Å; S707-Q711 PolarHBondContact O-N 2.77Å; S707-Q711 VanDerWaalsContact O-N 3.15Å
708	K	71.8	Confident	80.3	Confident	169 Å²	169	63 Å²	63	74%	0.735	35%	0.35	S	S	*	.	H	α-helix	trans	-53.9	-34.4	178.4	-67.5	-176.3	178.4	-178.9	0	113.2	Q711	K708-Q711 PolarHBondContact O-N 2.84Å
709	A	73.3	Confident	80.4	Confident	5 Å²	5	65.8 Å²	65.8	4%	0.041	36%	0.363	C	S	.	.	H	α-helix	trans	-64.3	-38.1	174.7	0	0	0	0	0	113.6	L665 V702 S707 S712 H713	L665-A709 HydrophobicContact CB-CB 4.38Å; L665-A709 HydrophobicContact CD2-CB 3.84Å; V702-A709 HydrophobicContact CG2-CB 4.24Å; S707-A709 PolarHBondContact O-N 3.23Å; S707-A709 VanDerWaalsContact O-N 3.12Å; A709-S712 PolarHBondContact O-OG 2.84Å; A709-H713 PolarHBondContact O-N 3.17Å; A709-H713 VanDerWaalsContact O-N 3.16Å
710	K	79.5	Confident	80.5	Confident	61 Å²	61	65.4 Å²	65.4	27%	0.265	36%	0.363	S	S	.	.	H	α-helix	trans	-77.4	-22.3	177	-83.3	176.7	167.9	163.8	0	113.1	V702 S703 S707 H713 P714	V702-K710 WeakPolarHBondContact O-CD 3.45Å; V702-K710 WeakPolarHBondContact O-CE 3.46Å; V702-K710 PolarHBondContact O-NZ 3.26Å; S703-K710 PolarHBondContact O-NZ 3.33Å; S707-K710 PolarHBondContact O-N 2.91Å; K710-H713 CarbonylContact O-C 3.52Å; K710-P714 WeakPolarHBondContact O-CA 3.43Å
711	Q	76.8	Confident	80.7	Confident	145 Å²	145	61 Å²	61	68%	0.678	34%	0.339	S	S	*	.	H	α-helix	trans	-67.3	-35.5	173.8	-64.2	173.3	15.5	0	0	112.2	G706 S707 K708	G706-Q711 PolarHBondContact O-NE2 3.34Å; S707-Q711 PolarHBondContact O-N 2.77Å; S707-Q711 VanDerWaalsContact O-N 3.15Å; K708-Q711 PolarHBondContact O-N 2.84Å
712	S	76.3	Confident	80.8	Confident	54 Å²	54	60.1 Å²	60.1	38%	0.378	34%	0.34	S	S	.	.	H	α-helix	trans	-92.2	-20.2	178.4	56.3	0	0	0	0	114	A709	A709-S712 PolarHBondContact O-OG 2.84Å
713	H	82.6	Confident	80.9	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.009	37%	0.366	C	S	.	.			trans	-143.7	89.5	178.4	-60	-84.3	0	0	0	110.2	S654 R655 A709 K710 S715 L716	S654-H713 PolarHBondContact N-ND1 3.42Å; S654-H713 VanDerWaalsContact N-ND1 3.19Å; R655-H713 PolarHBondContact NH1-CE1 3.04Å; R655-H713 PolarHBondContact NH1-NE2 2.88Å; R655-H713 PolarHBondContact NH2-CE1 3.49Å; R655-H713 PolarHBondContact NH2-NE2 3.39Å; A709-H713 PolarHBondContact O-N 3.17Å; A709-H713 VanDerWaalsContact O-N 3.16Å; K710-H713 CarbonylContact O-C 3.52Å; H713-S715 PolarHBondContact O-N 3.13Å; H713-L716 HydrophobicContact CB-CB 3.75Å; H713-L716 HydrophobicContact CB-CD1 3.73Å; H713-L716 HydrophobicContact CB-CG 4.35Å; H713-L716 WeakPolarHBondContact O-CB 3.29Å; H713-L716 PolarHBondContact O-N 3.36Å
714	P	79.6	Confident	80.9	Confident	104 Å²	104	69.6 Å²	69.6	68%	0.675	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.2	-173.5	21.7	-34	0	0	0	114.7	K710	K710-P714 WeakPolarHBondContact O-CA 3.43Å
715	S	82.8	Confident	81.3	Confident	72 Å²	72	68.6 Å²	68.6	50%	0.503	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	7.1	176.9	46.1	0	0	0	0	114.2	G652 S654 H713 H717	G652-S715 CarbonylContact O-C 3.48Å; G652-S715 WeakPolarHBondContact O-CB 3.14Å; G652-S715 PolarHBondContact O-OG 3.4Å; S654-S715 PolarHBondContact OG-OG 2.83Å; H713-S715 PolarHBondContact O-N 3.13Å; S715-H717 PolarHBondContact O-N 2.85Å
716	L	88.2	Confident	82.4	Confident	5 Å²	5	59.8 Å²	59.8	3%	0.026	32%	0.319	C	S	.	.			trans	-73.9	119	-171.2	-165.6	155.4	0	0	0	111.8	V650 F653 L665 V702 H713	V650-L716 HydrophobicContact CG1-CD1 4.29Å; V650-L716 HydrophobicContact CG1-CD2 3.77Å; V650-L716 HydrophobicContact CG1-CG 3.96Å; F653-L716 HydrophobicContact CD1-CD1 3.79Å; F653-L716 HydrophobicContact CD1-CG 4.46Å; F653-L716 HydrophobicContact CE1-CD1 3.69Å; F653-L716 HydrophobicContact CE1-CG 4.37Å; L665-L716 HydrophobicContact CD1-CD1 3.92Å; L665-L716 HydrophobicContact CD2-CD1 4.3Å; V702-L716 HydrophobicContact CB-CD2 4.27Å; V702-L716 HydrophobicContact CG1-CD2 3.44Å; V702-L716 VanDerWaalsContact CG1-CD2 3.44Å; V702-L716 HydrophobicContact CG2-CD2 3.74Å; H713-L716 HydrophobicContact CB-CB 3.75Å; H713-L716 HydrophobicContact CB-CD1 3.73Å; H713-L716 HydrophobicContact CB-CG 4.35Å; H713-L716 WeakPolarHBondContact O-CB 3.29Å; H713-L716 PolarHBondContact O-N 3.36Å
717	H	89.2	Confident	83.2	Confident	108 Å²	108	61 Å²	61	50%	0.5	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	145.9	175.8	-179.2	-95.8	0	0	0	109.4	V650 S651 S715	V650-H717 CarbonylContact C-O 3.54Å; V650-H717 WeakPolarHBondContact CA-O 3.21Å; S651-H717 PolarHBondContact N-O 2.91Å; S651-H717 PolarHBondContact O-N 3.42Å; S715-H717 PolarHBondContact O-N 2.85Å
718	I	91.3	Very high	83.8	Confident	6 Å²	6	66.2 Å²	66.2	3%	0.031	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	132.6	171	-174.1	175.8	0	0	0	109.1	A648 C649 V650 F666 A698 V699 V702	A648-I718 HydrophobicContact CB-CD1 3.77Å; A648-I718 HydrophobicContact CB-CG1 3.75Å; C649-I718 CarbonylContact O-C 3.49Å; C649-I718 VanDerWaalsContact O-CA 3.31Å; C649-I718 WeakPolarHBondContact O-CA 3.43Å; V650-I718 HydrophobicContact CG2-CB 4.35Å; V650-I718 HydrophobicContact CG2-CD1 3.89Å; V650-I718 HydrophobicContact CG2-CG1 3.89Å; F666-I718 HydrophobicContact CE1-CD1 4.23Å; F666-I718 HydrophobicContact CZ-CD1 3.9Å; A698-I718 HydrophobicContact CB-CD1 3.92Å; V699-I718 HydrophobicContact CB-CG2 4.3Å; V699-I718 HydrophobicContact CG2-CD1 4.29Å; V699-I718 HydrophobicContact CG2-CG1 4.24Å; V699-I718 HydrophobicContact CG2-CG2 4.16Å; V702-I718 HydrophobicContact CB-CB 4.35Å; V702-I718 HydrophobicContact CB-CG2 3.46Å; V702-I718 VanDerWaalsContact CB-CG2 3.46Å; V702-I718 HydrophobicContact CG1-CB 4.22Å; V702-I718 HydrophobicContact CG1-CG2 3.61Å; V702-I718 HydrophobicContact CG2-CB 4.48Å; V702-I718 HydrophobicContact CG2-CG2 3.97Å
719	E	90.5	Very high	84.4	Confident	58 Å²	58	63.4 Å²	63.4	27%	0.271	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	129.1	176	-158.7	-165.6	169.9	0	0	109.8	K639 A648 C649 I721 R729	K639-E719 IonicContact NZ-OE1 3.66Å; K639-E719 PolarHBondContact NZ-OE1 3.32Å; A648-E719 CarbonylContact C-O 3.57Å; A648-E719 WeakPolarHBondContact CA-O 3.44Å; A648-E719 WeakPolarHBondContact CB-O 3.18Å; C649-E719 PolarHBondContact N-O 3.3Å; C649-E719 PolarHBondContact O-N 3.28Å; E719-I721 HydrophobicContact CB-CG2 4.28Å; E719-I721 HydrophobicContact CG-CG2 4.38Å; E719-I721 PolarHBondContact O-N 2.99Å; E719-R729 IonicContact OE2-NH2 3.18Å
720	A	92.1	Very high	84.7	Confident	21 Å²	21	66 Å²	66	17%	0.174	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	124.2	163.6	0	0	0	0	0	109.1	K639 L645 V699	K639-A720 PolarHBondContact NZ-O 2.88Å; L645-A720 HydrophobicContact CB-CB 3.9Å; L645-A720 HydrophobicContact CD1-CB 3.61Å; L645-A720 HydrophobicContact CG-CB 4.4Å; V699-A720 HydrophobicContact CG2-CB 4.21Å
721	I	90.7	Very high	83.9	Confident	1 Å²	1	65 Å²	65	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	162.1	-175.8	57.7	156.8	0	0	0	110.6	C647 C649 F686 E719 E725 M726	C647-I721 HydrophobicContact CB-CG1 4.22Å; C647-I721 PolarHBondContact O-N 2.83Å; C649-I721 HydrophobicContact CB-CD1 3.96Å; C649-I721 HydrophobicContact CB-CG1 4.23Å; C649-I721 HydrophobicContact CB-CG2 3.99Å; F686-I721 HydrophobicContact CD1-CD1 3.83Å; F686-I721 HydrophobicContact CE1-CD1 4.13Å; E719-I721 HydrophobicContact CB-CG2 4.28Å; E719-I721 HydrophobicContact CG-CG2 4.38Å; E719-I721 PolarHBondContact O-N 2.99Å; I721-E725 HydrophobicContact CB-CG 4.17Å; I721-E725 WeakPolarHBondContact CB-OE2 2.97Å; I721-E725 HydrophobicContact CD1-CG 4.44Å; I721-E725 HydrophobicContact CG2-CG 4.44Å; I721-M726 HydrophobicContact CD1-CB 3.68Å; I721-M726 HydrophobicContact CD1-CG 4.35Å
722	S	87.8	Confident	82.6	Confident	40 Å²	40	61.7 Å²	61.7	28%	0.28	34%	0.34	S	S	.	.			trans	-75.6	157.1	175	72	0	0	0	0	111.9	E724 E725 M726	S722-E724 VanDerWaalsContact C-N 3.26Å; S722-E724 PolarHBondContact O-N 3.08Å; S722-E725 PolarHBondContact N-OE2 2.83Å; S722-E725 WeakPolarHBondContact O-CB 3.44Å; S722-E725 PolarHBondContact O-N 3.28Å; S722-E725 WeakPolarHBondContact OG-CB 3.49Å; S722-E725 PolarHBondContact OG-N 3.11Å; S722-M726 PolarHBondContact O-N 3.11Å
723	R	85.6	Confident	81	Confident	152 Å²	152	66.1 Å²	66.1	57%	0.574	36%	0.359	S	S	*	.	H	α-helix	trans	-63.6	-34.3	173.9	-166.1	175.4	-170.2	-118.9	3.4	112.3	D688 M726 L727	D688-R723 IonicContact OD2-NE 3.21Å; R723-M726 HydrophobicContact CG-CE 4.19Å; R723-M726 PolarHBondContact O-N 2.83Å; R723-L727 VanDerWaalsContact O-CG 3.27Å; R723-L727 WeakPolarHBondContact O-CG 3.35Å; R723-L727 PolarHBondContact O-N 2.9Å; R723-L727 VanDerWaalsContact O-N 3.09Å
724	E	83.1	Confident	78.9	Confident	117 Å²	117	70.6 Å²	70.6	55%	0.547	39%	0.391	S	S	.	.	H	α-helix	trans	-65.1	-43.5	174.7	-65.1	171.6	165.2	0	0	110.2	R549 S722 L727 N728	R549-E724 IonicContact NH1-OE1 2.7Å; R549-E724 PolarHBondContact NH1-OE1 3.35Å; S722-E724 VanDerWaalsContact C-N 3.26Å; S722-E724 PolarHBondContact O-N 3.08Å; E724-L727 PolarHBondContact O-N 3.17Å; E724-N728 WeakPolarHBondContact O-CB 3.46Å; E724-N728 PolarHBondContact O-N 3.02Å; E724-N728 PolarHBondContact O-ND2 3.11Å
725	E	85.5	Confident	76.7	Confident	58 Å²	58	74.6 Å²	74.6	27%	0.271	40%	0.398	S	S	.	.	H	α-helix	trans	-65.8	-40.6	174.2	176.9	172.7	-156.2	0	0	113.4	I721 S722 L727 N728 R729	I721-E725 HydrophobicContact CB-CG 4.17Å; I721-E725 WeakPolarHBondContact CB-OE2 2.97Å; I721-E725 HydrophobicContact CD1-CG 4.44Å; I721-E725 HydrophobicContact CG2-CG 4.44Å; S722-E725 PolarHBondContact N-OE2 2.83Å; S722-E725 WeakPolarHBondContact O-CB 3.44Å; S722-E725 PolarHBondContact O-N 3.28Å; S722-E725 WeakPolarHBondContact OG-CB 3.49Å; S722-E725 PolarHBondContact OG-N 3.11Å; E725-L727 VanDerWaalsContact C-N 3.33Å; E725-L727 PolarHBondContact O-N 3.41Å; E725-N728 PolarHBondContact O-N 3.24Å; E725-R729 HydrophobicContact CG-CG 4.32Å; E725-R729 WeakPolarHBondContact O-CB 3.37Å; E725-R729 WeakPolarHBondContact O-CG 3.37Å; E725-R729 PolarHBondContact O-N 3.13Å; E725-R729 IonicContact OE1-CZ 2.78Å; E725-R729 IonicContact OE1-NE 3.34Å; E725-R729 PolarHBondContact OE1-NE 3.01Å; E725-R729 IonicContact OE1-NH2 3.74Å; E725-R729 PolarHBondContact OE1-NH2 2.92Å
726	M	87.5	Confident	74.4	Confident	4 Å²	4	79 Å²	79	2%	0.02	42%	0.415	C	S	.	.	H	α-helix	trans	-57.9	-46.9	173.4	-178.5	179.4	70.3	0	0	110.9	C647 F686 D688 I721 S722 R723 L730	C647-M726 HydrophobicContact CB-CB 4.43Å; C647-M726 HydrophobicContact CB-SD 4.06Å; F686-M726 HydrophobicContact CB-CG 3.76Å; F686-M726 HydrophobicContact CB-SD 3.91Å; F686-M726 HydrophobicContact CD1-CG 4.04Å; F686-M726 HydrophobicContact CG-CG 4.02Å; D688-M726 HydrophobicContact CB-CE 4.4Å; I721-M726 HydrophobicContact CD1-CB 3.68Å; I721-M726 HydrophobicContact CD1-CG 4.35Å; S722-M726 PolarHBondContact O-N 3.11Å; R723-M726 HydrophobicContact CG-CE 4.19Å; R723-M726 PolarHBondContact O-N 2.83Å; M726-L730 HydrophobicContact CG-CD1 3.94Å; M726-L730 WeakPolarHBondContact O-CB 3.5Å; M726-L730 WeakPolarHBondContact O-CD1 3.32Å; M726-L730 VanDerWaalsContact O-CG 3.28Å; M726-L730 WeakPolarHBondContact O-CG 3.2Å; M726-L730 PolarHBondContact O-N 2.87Å
727	L	83.8	Confident	71.8	Confident	85 Å²	85	87.5 Å²	87.5	45%	0.445	46%	0.455	S	S	.	.	H	α-helix	trans	-66.9	-38	178.7	-69.3	169.3	0	0	0	112.1	R723 E724 E725 L730 G731	R723-L727 VanDerWaalsContact O-CG 3.27Å; R723-L727 WeakPolarHBondContact O-CG 3.35Å; R723-L727 PolarHBondContact O-N 2.9Å; R723-L727 VanDerWaalsContact O-N 3.09Å; E724-L727 PolarHBondContact O-N 3.17Å; E725-L727 VanDerWaalsContact C-N 3.33Å; E725-L727 PolarHBondContact O-N 3.41Å; L727-L730 PolarHBondContact O-N 2.86Å; L727-G731 PolarHBondContact O-N 2.88Å
728	N	82.7	Confident	68.9	Low	123 Å²	123	91.5 Å²	91.5	66%	0.658	47%	0.474	S	S	*	.	H	α-helix	trans	-66.6	-47.3	175.9	-70.8	-18.7	0	0	0	111.9	E724 E725 L730 G731	E724-N728 WeakPolarHBondContact O-CB 3.46Å; E724-N728 PolarHBondContact O-N 3.02Å; E724-N728 PolarHBondContact O-ND2 3.11Å; E725-N728 PolarHBondContact O-N 3.24Å; N728-L730 PolarHBondContact O-N 3.15Å; N728-G731 PolarHBondContact O-N 3.04Å; N728-G731 VanDerWaalsContact O-N 3.12Å
729	R	84	Confident	66.1	Low	111 Å²	111	98.8 Å²	98.8	42%	0.419	51%	0.512	S	S	.	.	H	α-helix	trans	-65.2	-24.8	177.3	-67.5	-177.9	-173.7	-158	11	112.5	F686 E719 E725	F686-R729 HydrophobicContact CE1-CB 3.88Å; F686-R729 HydrophobicContact CZ-CB 3.6Å; E719-R729 IonicContact OE2-NH2 3.18Å; E725-R729 HydrophobicContact CG-CG 4.32Å; E725-R729 WeakPolarHBondContact O-CB 3.37Å; E725-R729 WeakPolarHBondContact O-CG 3.37Å; E725-R729 PolarHBondContact O-N 3.13Å; E725-R729 IonicContact OE1-CZ 2.78Å; E725-R729 IonicContact OE1-NE 3.34Å; E725-R729 PolarHBondContact OE1-NE 3.01Å; E725-R729 IonicContact OE1-NH2 3.74Å; E725-R729 PolarHBondContact OE1-NH2 2.92Å
730	L	78.9	Confident	63.3	Low	58 Å²	58	102.5 Å²	102.5	30%	0.304	53%	0.534	S	S	.	.	H	α-helix	trans	-86	-14.4	172.9	-77.4	169.4	0	0	0	114.7	R677 F686 M726 L727 N728	R677-L730 HydrophobicContact CB-CD1 4.1Å; R677-L730 HydrophobicContact CB-CD2 4.23Å; R677-L730 HydrophobicContact CG-CD1 4.47Å; F686-L730 HydrophobicContact CD2-CD1 4.23Å; F686-L730 HydrophobicContact CD2-CD2 3.53Å; F686-L730 HydrophobicContact CD2-CG 3.71Å; F686-L730 HydrophobicContact CE2-CD2 3.78Å; F686-L730 HydrophobicContact CE2-CG 3.93Å; F686-L730 HydrophobicContact CG-CD1 4.48Å; F686-L730 HydrophobicContact CG-CG 4.33Å; M726-L730 HydrophobicContact CG-CD1 3.94Å; M726-L730 WeakPolarHBondContact O-CB 3.5Å; M726-L730 WeakPolarHBondContact O-CD1 3.32Å; M726-L730 VanDerWaalsContact O-CG 3.28Å; M726-L730 WeakPolarHBondContact O-CG 3.2Å; M726-L730 PolarHBondContact O-N 2.87Å; L727-L730 PolarHBondContact O-N 2.86Å; N728-L730 PolarHBondContact O-N 3.15Å
731	G	62.7	Low	60.6	Low	41 Å²	41	111.1 Å²	111.1	42%	0.423	57%	0.568	S	S	.	*			trans	-109.1	4.3	-166	0	0	0	0	0	116.3	L727 N728 D733 S734	L727-G731 PolarHBondContact O-N 2.88Å; N728-G731 PolarHBondContact O-N 3.04Å; N728-G731 VanDerWaalsContact O-N 3.12Å; G731-D733 PolarHBondContact O-N 2.84Å; G731-S734 PolarHBondContact O-OG 3.37Å
732	A	49.9	Very low	58	Low	76 Å²	76	118.4 Å²	118.4	63%	0.628	61%	0.607	S	S	*	*			trans	-68.6	-23.5	-166.7	0	0	0	0	0	115.6	S734	A732-S734 VanDerWaalsContact C-N 3.28Å; A732-S734 PolarHBondContact O-N 2.99Å
733	D	43.4	Very low	55.4	Low	147 Å²	147	128.1 Å²	128.1	79%	0.786	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	36.2	-173.7	-72.1	-34	0	0	0	115	G731	G731-D733 PolarHBondContact O-N 2.84Å
734	S	37.5	Very low	52.9	Low	96 Å²	96	126.2 Å²	126.2	67%	0.671	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.9	16.5	-176.8	60.6	0	0	0	0	117	G731 A732	G731-S734 PolarHBondContact O-OG 3.37Å; A732-S734 VanDerWaalsContact C-N 3.28Å; A732-S734 PolarHBondContact O-N 2.99Å
735	K	34	Very low	50.4	Low	188 Å²	188	126.5 Å²	126.5	82%	0.817	65%	0.654	S	S	*	*			trans	-141.7	55.6	-178.6	-71.4	-171.8	177.6	178.8	0	114.6
736	D	34.1	Very low	47.9	Very low	163 Å²	163	135.4 Å²	135.4	87%	0.872	69%	0.685	S	S	*	*			trans	-139.6	49.6	171.1	-88.5	-45.5	0	0	0	112.7
737	E	33.9	Very low	45.2	Very low	185 Å²	185	140.4 Å²	140.4	86%	0.864	72%	0.721	S	S	*	*			trans	-146.2	66.7	165.9	-97.7	-156.4	118.8	0	0	111.9
738	Q	28.6	Very low	42.9	Very low	192 Å²	192	148.1 Å²	148.1	90%	0.897	74%	0.744	S	S	*	*			trans	-169.5	97.9	159.9	-109.8	151.9	51	0	0	111.2
739	L	32.3	Very low	40.7	Very low	159 Å²	159	149.5 Å²	149.5	83%	0.832	75%	0.751	S	S	*	*			trans	178.8	145	145.3	-98.1	163.4	0	0	0	110.4
740	N	32	Very low	38.4	Very low	135 Å²	135	156.2 Å²	156.2	72%	0.722	78%	0.777	S	S	*	*			trans	67.5	113.6	179.1	-48.9	-31.2	0	0	0	114.8
741	F	35	Very low	36.5	Very low	202 Å²	202	161.1 Å²	161.1	89%	0.886	80%	0.803	S	S	*	*				-157.3	136.3	56.4	-103.4	-87.7	0	0	0	113.5
742	D	35.2	Very low	35.5	Very low	154 Å²	154	164 Å²	164	82%	0.824	82%	0.815	S	S	*	*			trans	-67.3	126.9	162.8	-88.4	-63.8	0	0	0	112.3
743	R	34.4	Very low	34.7	Very low	244 Å²	244	171.4 Å²	171.4	92%	0.921	83%	0.826	S	S	*	*			trans	-176.1	137.7	133.3	-106.3	172.1	-171.2	-146	1.8	113.2
744	P	32.8	Very low	34.3	Very low	112 Å²	112	173.3 Å²	173.3	73%	0.727	83%	0.83	S	S	*	*			trans	-107.8	165.2	-176	41.3	-36.4	0	0	0	115.3
745	V	31.2	Very low	34.4	Very low	124 Å²	124	173.9 Å²	173.9	75%	0.752	83%	0.834	S	S	*	*			trans	69.6	111.6	160.5	-149.8	0	0	0	0	118.4
746	R	33	Very low	34.3	Very low	244 Å²	244	176.1 Å²	176.1	92%	0.921	84%	0.838	S	S	*	*				-174.3	132.1	104.2	-96.4	176	-173	-174.1	1.5	113.6
747	S	30.2	Very low	34.5	Very low	110 Å²	110	176.9 Å²	176.9	77%	0.769	84%	0.84	S	S	*	*			trans	-69.7	153.6	179.8	-34.4	0	0	0	0	113.4
748	R	35.6	Very low	34.4	Very low	246 Å²	246	175.7 Å²	175.7	93%	0.928	83%	0.834	S	S	*	*			trans	-158.4	129.2	141.4	-115.4	172	-173	-178.1	1.5	112
749	D	35.6	Very low	34.3	Very low	152 Å²	152	178 Å²	178	81%	0.813	84%	0.835	S	S	*	*			trans	-67.4	148.9	-179.6	-47.4	-96.1	0	0	0	113.1
750	R	35.9	Very low	34.3	Very low	252 Å²	252	175.7 Å²	175.7	95%	0.951	82%	0.823	S	S	*	*				-161.6	136.9	127.7	-114.4	171.9	-179.1	178.6	-0.9	113.6
751	D	40.1	Very low	34.3	Very low	161 Å²	161	175.9 Å²	175.9	86%	0.861	82%	0.82	S	S	*	*			trans	-77.1	167.6	-173.8	-115.3	-16.1	0	0	0	114.1
752	P	40	Very low	34.1	Very low	103 Å²	103	176.7 Å²	176.7	67%	0.669	82%	0.817	S	S	*	*			trans	-96.1	161.6	-168.9	38.5	-37	0	0	0	114.5
753	R	32.9	Very low	34.1	Very low	231 Å²	231	178.2 Å²	178.2	87%	0.872	82%	0.819	S	S	*	*			trans	-175.6	156.5	143.1	-103.4	157.2	-161.7	-164.8	5.9	111.6
754	E	36.6	Very low	34	Very low	186 Å²	186	177.9 Å²	177.9	87%	0.869	82%	0.818	S	S	*	*			trans	68.4	137.5	170.3	-66	158.2	-154.1	0	0	115.3
755	S	38.1	Very low	34.3	Very low	108 Å²	108	177.8 Å²	177.8	76%	0.755	82%	0.817	S	S	*	*			cis	-148.9	143.4	13.2	56.1	0	0	0	0	113.7
756	R	33	Very low	34.4	Very low	236 Å²	236	177.2 Å²	177.2	89%	0.891	82%	0.819	S	S	*	*			trans	14.4	134.9	147.2	-59.5	173.2	-172.7	159.7	4.1	117.4
757	I	38.8	Very low	34.8	Very low	178 Å²	178	171.6 Å²	171.6	91%	0.913	81%	0.814	S	S	*	*				-141.1	153.4	74.2	-81.5	148.4	0	0	0	112.4
758	H	30.5	Very low	35.3	Very low	161 Å²	161	172.1 Å²	172.1	75%	0.745	82%	0.818	S	S	*	*			trans	-112.6	137.6	-156.3	179.3	-82.8	0	0	0	112.6
759	W	26.2	Very low	35.3	Very low	239 Å²	239	167.9 Å²	167.9	91%	0.905	81%	0.814	S	S	*	*			trans	-72.9	123.1	164.5	-76	79.6	0	0	0	109.9
760	D	32.3	Very low	35.7	Very low	112 Å²	112	165.6 Å²	165.6	60%	0.599	81%	0.807	S	S	*	*				-165.1	156.1	128	-127.6	-12.2	0	0	0	118.9
761	Q	32.2	Very low	35.6	Very low	139 Å²	139	161.6 Å²	161.6	65%	0.65	80%	0.797	S	S	*	*			trans	-12.7	135.5	155	-62.6	152	50.7	0	0	118.3
762	R	32	Very low	35.2	Very low	219 Å²	219	161.5 Å²	161.5	83%	0.826	79%	0.791	S	S	*	*				-178.5	144.2	107	-97.3	160.8	-160.6	-121.8	1.7	114.6
763	Q	35.1	Very low	35.2	Very low	186 Å²	186	162.2 Å²	162.2	87%	0.869	80%	0.798	S	S	*	*			trans	80	117.6	154.8	-66.8	174.6	90.4	0	0	120.9
764	R	32.8	Very low	35.3	Very low	236 Å²	236	162.9 Å²	162.9	89%	0.891	80%	0.801	S	S	*	*			trans	-83	-165.8	157.7	-54.5	176.8	163.9	-171	-4.1	109
765	P	37.8	Very low	35.9	Very low	110 Å²	110	159.3 Å²	159.3	71%	0.714	79%	0.794	S	S	*	*			cis	-140.4	150.7	-7.3	19.8	7.1	0	0	0	119.3
766	S	34.3	Very low	36.2	Very low	112 Å²	112	159.6 Å²	159.6	78%	0.783	79%	0.793	S	S	*	*			trans	69.6	-178.6	133.1	-39.7	0	0	0	0	120
767	P	41.7	Very low	36.5	Very low	126 Å²	126	153.1 Å²	153.1	82%	0.818	78%	0.784	S	S	*	*				-140.1	170.1	-113.8	36	-11.7	0	0	0	118.1
768	S	39.2	Very low	36.6	Very low	121 Å²	121	151.6 Å²	151.6	85%	0.846	78%	0.783	S	S	*	*			trans	-161.5	127.9	163.3	53.8	0	0	0	0	115.7
769	N	36.1	Very low	37	Very low	158 Å²	158	147.4 Å²	147.4	85%	0.845	78%	0.783	S	S	*	*			trans	-74.6	-169.4	165.3	-88.6	2.1	0	0	0	111.8
770	P	43.4	Very low	37.5	Very low	103 Å²	103	147.2 Å²	147.2	67%	0.669	78%	0.782	S	S	*	*				-126.6	-166.5	-52.4	37.6	-21.4	0	0	0	110.5
771	F	35.2	Very low	37.7	Very low	169 Å²	169	145.6 Å²	145.6	74%	0.741	78%	0.784	S	S	*	*			trans	171.4	136.5	135.4	-110.3	-116.6	0	0	0	111.6
772	E	31.9	Very low	38.1	Very low	159 Å²	159	147.8 Å²	147.8	74%	0.743	79%	0.792	S	S	*	*			trans	32.7	149.4	131.4	-71.7	-177.5	170.3	0	0	122.3
773	S	39.9	Very low	38.5	Very low	117 Å²	117	146.7 Å²	146.7	82%	0.818	79%	0.789	S	S	*	*			cis	-162.8	168.8	15.4	32.6	0	0	0	0	114.2
774	R	34.3	Very low	38.7	Very low	245 Å²	245	143.5 Å²	143.5	93%	0.925	78%	0.778	S	S	*	*			trans	-50.9	161.6	-169.5	-86.9	178	155	-170.2	-5	121.4
775	P	49.5	Very low	39.1	Very low	112 Å²	112	138.8 Å²	138.8	73%	0.727	77%	0.77	S	S	*	*			trans	-93	-179.8	168.4	41.5	-38	0	0	0	113.3
776	P	45	Very low	39.2	Very low	114 Å²	114	138 Å²	138	74%	0.74	77%	0.767	S	S	*	*				-155.4	171.3	117.1	37.1	-17.5	0	0	0	119.4
777	S	39	Very low	39.3	Very low	100 Å²	100	142 Å²	142	70%	0.699	77%	0.767	S	S	*	*			trans	86.6	121	134.3	49.7	0	0	0	0	126.5
778	V	39.2	Very low	39.1	Very low	145 Å²	145	144.6 Å²	144.6	88%	0.879	76%	0.761	S	S	*	*				92	125.7	124.1	170.3	0	0	0	0	122.4
779	G	39.8	Very low	38.9	Very low	73 Å²	73	144.7 Å²	144.7	75%	0.753	75%	0.752	S	S	*	*			trans	133.3	126.5	150.1	0	0	0	0	0	115.9
780	R	36.2	Very low	39	Very low	236 Å²	236	147.7 Å²	147.7	89%	0.891	75%	0.752	S	S	*	*				171.6	113	-50.3	174.6	-179.1	-176.7	-170.7	2.8	107.2
781	A	37.6	Very low	39.4	Very low	78 Å²	78	148.3 Å²	148.3	65%	0.645	76%	0.756	S	S	*	*			trans	66	159.5	156.9	0	0	0	0	0	117.2
782	K	39.8	Very low	39.6	Very low	184 Å²	184	146.4 Å²	146.4	80%	0.8	76%	0.764	S	S	*	*			cis	-156.5	145.3	39.5	-75.9	-172.2	175.7	-175.2	0	115.7
783	Y	41.3	Very low	40	Very low	197 Å²	197	143.3 Å²	143.3	77%	0.773	77%	0.765	S	S	*	*				48	147.2	129.6	-70.9	-101.8	0	0	0	121.2
784	D	39	Very low	40.5	Very low	119 Å²	119	143.6 Å²	143.6	64%	0.636	76%	0.764	S	S	*	*			cis	-175.1	-177.6	-17	-147.9	-21.5	0	0	0	109.6
785	D	40.4	Very low	41.1	Very low	136 Å²	136	136.3 Å²	136.3	73%	0.727	76%	0.757	S	S	*	*			trans	67.4	154.1	151.5	-90.1	-45.5	0	0	0	119.8
786	S	39.3	Very low	40.9	Very low	93 Å²	93	136.9 Å²	136.9	65%	0.65	76%	0.76	S	S	*	*			cis	-163.7	137.3	-34.8	24.3	0	0	0	0	107.3
787	Y	36.5	Very low	40.4	Very low	197 Å²	197	140.8 Å²	140.8	77%	0.773	77%	0.766	S	S	*	*				86.1	130.2	80.8	-140.8	-119.7	0	0	0	115.3
788	Y	37.4	Very low	40.6	Very low	180 Å²	180	143 Å²	143	71%	0.706	77%	0.77	S	S	*	*			trans	83.5	132	169.7	-74.5	-56.7	0	0	0	124.5
789	D	36.4	Very low	40.6	Very low	124 Å²	124	141.9 Å²	141.9	66%	0.663	76%	0.759	S	S	*	*			trans	52.7	147.5	135.9	-71.3	-4.2	0	0	0	122.2
790	R	38.4	Very low	40.8	Very low	221 Å²	221	145.3 Å²	145.3	83%	0.834	76%	0.755	S	S	*	*			cis	-162	175.7	-5.5	-118	180	172.3	-160.6	-2.3	109.2
791	P	51.5	Low	40.8	Very low	115 Å²	115	141.6 Å²	141.6	75%	0.747	75%	0.747	S	S	*	*			trans	-96.8	163.2	-166.1	38.8	-37.7	0	0	0	116.2
792	S	39.9	Very low	40.7	Very low	130 Å²	130	143.7 Å²	143.7	91%	0.909	75%	0.748	S	S	*	*			trans	-151	151.5	164.9	-69.2	0	0	0	0	111.9
793	A	39.9	Very low	40.5	Very low	94 Å²	94	138.8 Å²	138.8	78%	0.777	74%	0.737	S	S	*	*			trans	-116.6	-150.4	-178	0	0	0	0	0	111.4
794	P	50.7	Low	40.2	Very low	123 Å²	123	137 Å²	137	80%	0.799	73%	0.733	S	S	*	*				-128.6	-179.7	-83.6	37.9	-22.5	0	0	0	116.3
795	A	45.8	Very low	40	Very low	92 Å²	92	141 Å²	141	76%	0.76	74%	0.74	S	S	*	*			trans	75	172.4	155.2	0	0	0	0	0	118.2
796	P	45.1	Very low	39.8	Very low	124 Å²	124	146.2 Å²	146.2	81%	0.805	75%	0.749	S	S	*	*			cis	-131.7	-162.7	-6.8	35.1	-12.6	0	0	0	115.7
797	F	35.1	Very low	39.6	Very low	196 Å²	196	151 Å²	151	86%	0.86	76%	0.758	S	S	*	*			trans	-64.3	171.7	-175.1	-84.4	-111.9	0	0	0	118.6
798	D	43.5	Very low	39.6	Very low	147 Å²	147	153.2 Å²	153.2	79%	0.786	77%	0.765	S	S	*	*			trans	125.5	144.6	145.7	-69.9	-14.4	0	0	0	114
799	D	39.4	Very low	39.7	Very low	121 Å²	121	150 Å²	150	65%	0.647	77%	0.767	S	S	*	*			cis	-166.6	180	-24.2	-167.6	-1.7	0	0	0	106.9
800	H	43.1	Very low	40.2	Very low	145 Å²	145	149.5 Å²	149.5	67%	0.671	77%	0.77	S	S	*	*			trans	94	97.8	154.7	-60.1	-11.7	0	0	0	120.9
801	H	37.2	Very low	40.4	Very low	157 Å²	157	146 Å²	146	73%	0.727	77%	0.773	S	S	*	*				60.6	104.3	112	-86.2	-76	0	0	0	121.6
802	D	34.3	Very low	39.7	Very low	122 Å²	122	147.2 Å²	147.2	65%	0.652	77%	0.773	S	S	*	*				89.4	154.3	105.9	-129.3	-47	0	0	0	121.9
803	S	37	Very low	39.8	Very low	82 Å²	82	148.9 Å²	148.9	57%	0.573	77%	0.772	S	S	*	*			trans	88.1	89.2	140.7	-74.7	0	0	0	0	121.6
804	F	34.4	Very low	39.6	Very low	159 Å²	159	151.2 Å²	151.2	70%	0.697	77%	0.77	S	S	*	*				69	112.8	127	-64.4	-71.6	0	0	0	121.7
805	R	35.1	Very low	39.1	Very low	204 Å²	204	153.4 Å²	153.4	77%	0.77	77%	0.77	S	S	*	*				55	126.8	129.1	-59.3	173	-177.7	-157.1	4.5	118.2
806	R	36.5	Very low	38.6	Very low	244 Å²	244	154.2 Å²	154.2	92%	0.921	77%	0.77	S	S	*	*				-172.7	137.8	97.2	-96	156.2	-159.7	-153.4	4.8	113.7
807	F	33.7	Very low	38.4	Very low	193 Å²	193	156.1 Å²	156.1	85%	0.846	77%	0.772	S	S	*	*			trans	-44.6	142.4	165.9	-70.1	-107	0	0	0	114.9
808	R	37	Very low	38.9	Very low	244 Å²	244	152.2 Å²	152.2	92%	0.921	77%	0.766	S	S	*	*				-170.4	135	116.8	-104	172.3	-174.9	-174.8	1.1	112.4
809	P	39.8	Very low	38.7	Very low	114 Å²	114	151 Å²	151	74%	0.74	77%	0.766	S	S	*	*			trans	-107.1	-156.1	177.8	45.3	-36.5	0	0	0	111.3
810	P	47.8	Very low	38.5	Very low	113 Å²	113	153.9 Å²	153.9	73%	0.734	78%	0.775	S	S	*	*				-121.1	-177.5	-106.8	37	-17.4	0	0	0	113.8
811	V	42.4	Very low	38.3	Very low	146 Å²	146	156.2 Å²	156.2	89%	0.885	79%	0.787	S	S	*	*			trans	-146.4	133.8	161.9	-150.3	0	0	0	0	111.1
812	D	37.2	Very low	38.3	Very low	141 Å²	141	153.3 Å²	153.3	75%	0.754	78%	0.784	S	S	*	*			trans	-76.1	161.3	177.5	-56.2	-76.9	0	0	0	113.8
813	N	40.3	Very low	38.6	Very low	165 Å²	165	155.3 Å²	155.3	88%	0.882	79%	0.794	S	S	*	*			trans	-156	139.3	139.6	-107.9	-38.4	0	0	0	113
814	L	36.4	Very low	38.4	Very low	143 Å²	143	159 Å²	159	75%	0.749	81%	0.806	S	S	*	*			trans	-87	180	-175.6	-80	146.9	0	0	0	113.2
815	H	39.5	Very low	38.7	Very low	169 Å²	169	157.2 Å²	157.2	78%	0.782	81%	0.814	S	S	*	*			trans	88.6	135.3	165.5	-48.9	96.4	0	0	0	115
816	S	37	Very low	38.7	Very low	109 Å²	109	153 Å²	153	76%	0.762	82%	0.815	S	S	*	*			cis	-152.2	161.2	7.8	-83.9	0	0	0	0	112.7
817	I	39.7	Very low	39.2	Very low	164 Å²	164	145.6 Å²	145.6	84%	0.841	81%	0.806	S	S	*	*			trans	-91.1	143.5	167.1	-60.2	167.2	0	0	0	110.4
818	P	46.1	Very low	39.6	Very low	114 Å²	114	142.4 Å²	142.4	74%	0.74	81%	0.805	S	S	*	*			trans	-122.2	163.5	148.3	6.6	15.9	0	0	0	113.6
819	P	38.7	Very low	39.6	Very low	122 Å²	122	142.5 Å²	142.5	79%	0.792	81%	0.805	S	S	*	*			trans	-108.3	176.8	-152.1	41.1	-36.6	0	0	0	117.1
820	H	35.1	Very low	40	Very low	182 Å²	182	145.4 Å²	145.4	84%	0.843	81%	0.809	S	S	*	*			trans	-41.2	140.9	170.7	-106.1	-95.4	0	0	0	115.9
821	Q	40.2	Very low	39.8	Very low	194 Å²	194	145.8 Å²	145.8	91%	0.907	81%	0.812	S	S	*	*			trans	-146.1	145.7	138.3	-113.4	171.4	21.9	0	0	111
822	S	36.5	Very low	40	Very low	96 Å²	96	144.9 Å²	144.9	67%	0.671	81%	0.806	S	S	*	*			trans	-89.4	147	-178.1	49.3	0	0	0	0	111.6
823	D	39.7	Very low	40.2	Very low	163 Å²	163	143.2 Å²	143.2	87%	0.872	80%	0.803	S	S	*	*			trans	-158	160.9	133.1	-111.7	-30.6	0	0	0	114.4
824	I	33.9	Very low	40.3	Very low	159 Å²	159	142.7 Å²	142.7	82%	0.815	80%	0.799	S	S	*	*			trans	-98.1	130.4	-162.8	-62	161	0	0	0	111.1
825	S	40.7	Very low	40.5	Very low	123 Å²	123	141.5 Å²	141.5	86%	0.86	80%	0.8	S	S	*	*			trans	-150.9	138.1	151.7	-165.6	0	0	0	0	112.5
826	S	35.5	Very low	40.5	Very low	115 Å²	115	142 Å²	142	80%	0.804	80%	0.803	S	S	*	*			trans	-97.4	124.2	-165.3	50.6	0	0	0	0	113.3
827	A	46.6	Very low	40.6	Very low	88 Å²	88	146.9 Å²	146.9	73%	0.727	80%	0.804	S	S	*	*			trans	-127.2	150.3	166.5	0	0	0	0	0	109.8	R829	A827-R829 PolarHBondContact O-N 3.21Å
828	P	42.6	Very low	40.5	Very low	127 Å²	127	149.6 Å²	149.6	83%	0.825	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-70.2	129.5	-164.7	27.2	-34.6	0	0	0	112.3	Q830	P828-Q830 PolarHBondContact O-N 2.92Å
829	R	36.9	Very low	40.1	Very low	246 Å²	246	150.2 Å²	150.2	93%	0.928	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-64.4	118.9	174.1	-70.8	-175.1	176.2	-137.9	-0.6	109.8	A827	A827-R829 PolarHBondContact O-N 3.21Å
830	Q	46.8	Very low	40.3	Very low	174 Å²	174	149.2 Å²	149.2	81%	0.813	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-58.8	146.8	162.4	-69.7	-178	-12.1	0	0	109.5	P828 V832	P828-Q830 PolarHBondContact O-N 2.92Å; Q830-V832 PolarHBondContact O-N 3.1Å
831	P	44.1	Very low	41.1	Very low	122 Å²	122	144.3 Å²	144.3	79%	0.792	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-63.1	127.9	178.6	26.4	-33.4	0	0	0	109.8
832	V	47.5	Very low	42.3	Very low	127 Å²	127	142.5 Å²	142.5	77%	0.77	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-57.6	130.7	175.3	-176	0	0	0	0	108.4	Q830 L834	Q830-V832 PolarHBondContact O-N 3.1Å; V832-L834 PolarHBondContact O-N 3.45Å
833	P	40.2	Very low	44.5	Very low	106 Å²	106	142.5 Å²	142.5	69%	0.688	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-56	127.8	174.4	-23.7	33.6	0	0	0	109.9
834	L	41.9	Very low	46.7	Very low	154 Å²	154	136.6 Å²	136.6	81%	0.806	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-52.7	136.2	174.5	-71.6	166.3	0	0	0	109.2	V832 H836	V832-L834 PolarHBondContact O-N 3.45Å; L834-H836 PolarHBondContact O-N 2.94Å; L834-H836 VanDerWaalsContact O-N 3.15Å
835	P	41.1	Very low	49.5	Very low	117 Å²	117	130.4 Å²	130.4	76%	0.76	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-56.8	126	-179.1	23.9	-33.4	0	0	0	108.9	R837	P835-R837 PolarHBondContact O-N 2.78Å
836	H	40.6	Very low	52	Low	181 Å²	181	124.5 Å²	124.5	84%	0.838	67%	0.666	S	S	*	*			trans	-54.2	115.5	179.6	-67.6	-42	0	0	0	109.1	L834 R838	L834-H836 PolarHBondContact O-N 2.94Å; L834-H836 VanDerWaalsContact O-N 3.15Å; H836-R838 PolarHBondContact O-N 2.65Å
837	R	38.3	Very low	54.8	Low	211 Å²	211	120 Å²	120	80%	0.796	63%	0.632	S	S	*	*			trans	-51.9	126.7	169.5	-91.6	-175.8	165.8	-176.7	-5.4	107.5	P835	P835-R837 PolarHBondContact O-N 2.78Å
838	R	38.6	Very low	57.1	Low	221 Å²	221	115.8 Å²	115.8	83%	0.834	60%	0.598	S	S	*	*			trans	-50.1	142.6	168.2	-58.6	-177.9	-169.8	178.8	2.8	107.8	H836 V840	H836-R838 PolarHBondContact O-N 2.65Å; R838-V840 PolarHBondContact O-N 3.18Å
839	P	36.3	Very low	59.5	Low	127 Å²	127	110 Å²	110	83%	0.825	56%	0.56	S	S	*	*			trans	-57.3	106.5	169	-18.8	31.1	0	0	0	107.6	P841	P839-P841 WeakPolarHBondContact O-CD 3.22Å
840	V	43.3	Very low	62.1	Low	101 Å²	101	100.7 Å²	100.7	61%	0.612	53%	0.529	S	S	*	.			trans	-67.2	122.4	167.8	-175.7	0	0	0	0	104.1	R838 D842	R838-V840 PolarHBondContact O-N 3.18Å; V840-D842 PolarHBondContact O-N 2.68Å
841	P	51.7	Low	64.2	Low	79 Å²	79	92.7 Å²	92.7	51%	0.513	49%	0.492	S	S	.	.			trans	-62.4	127	174.5	-10.7	24.4	0	0	0	106.9	P839 F843	P839-P841 WeakPolarHBondContact O-CD 3.22Å; P841-F843 VanDerWaalsContact C-N 3.25Å; P841-F843 HydrophobicContact CB-CD1 3.92Å; P841-F843 HydrophobicContact CB-CE1 3.52Å; P841-F843 HydrophobicContact CB-CZ 4.12Å; P841-F843 HydrophobicContact CG-CE1 3.68Å; P841-F843 HydrophobicContact CG-CZ 3.93Å; P841-F843 WeakPolarHBondContact O-CD1 3.45Å; P841-F843 WeakPolarHBondContact O-CD2 3.47Å; P841-F843 WeakPolarHBondContact O-CG 3.33Å; P841-F843 PolarHBondContact O-N 3.42Å
842	D	66.1	Low	66.2	Low	155 Å²	155	87.5 Å²	87.5	83%	0.829	46%	0.459	S	S	*	.			trans	-70	82.2	-173.7	-73.1	-43.3	0	0	0	110.8	V840	V840-D842 PolarHBondContact O-N 2.68Å
843	F	81.5	Confident	67.7	Low	96 Å²	96	85.7 Å²	85.7	42%	0.421	45%	0.449	S	S	.	.			trans	-111.3	146.2	166.7	32.4	-118.2	0	0	0	111	P841 D891 F892	P841-F843 VanDerWaalsContact C-N 3.25Å; P841-F843 HydrophobicContact CB-CD1 3.92Å; P841-F843 HydrophobicContact CB-CE1 3.52Å; P841-F843 HydrophobicContact CB-CZ 4.12Å; P841-F843 HydrophobicContact CG-CE1 3.68Å; P841-F843 HydrophobicContact CG-CZ 3.93Å; P841-F843 WeakPolarHBondContact O-CD1 3.45Å; P841-F843 WeakPolarHBondContact O-CD2 3.47Å; P841-F843 WeakPolarHBondContact O-CG 3.33Å; P841-F843 PolarHBondContact O-N 3.42Å; F843-D891 HydrophobicContact CB-CB 4.15Å; F843-D891 HydrophobicContact CG-CB 4.44Å; F843-F892 CarbonylContact C-O 3.56Å; F843-F892 VanDerWaalsContact CA-O 3.25Å; F843-F892 WeakPolarHBondContact CA-O 3.35Å; F843-F892 WeakPolarHBondContact CB-O 3.4Å
844	V	87.4	Confident	69.6	Low	40 Å²	40	84.4 Å²	84.4	24%	0.242	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	105.9	179.8	-178.8	0	0	0	0	108.1	F892 A898 F919	V844-F892 PolarHBondContact N-O 3.24Å; V844-F892 PolarHBondContact O-N 3.31Å; V844-A898 HydrophobicContact CB-CB 4.28Å; V844-A898 HydrophobicContact CG1-CB 3.85Å; V844-F919 HydrophobicContact CG1-CD1 3.54Å; V844-F919 HydrophobicContact CG1-CE1 3.57Å
845	T	91.8	Very high	71.7	Confident	28 Å²	28	77.3 Å²	77.3	17%	0.172	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	130.3	177.7	-53.2	0	0	0	0	110.6	L889 V890 D891 D920	T845-L889 HydrophobicContact CG2-CB 3.9Å; T845-L889 HydrophobicContact CG2-CD2 4.04Å; T845-L889 HydrophobicContact CG2-CG 4.37Å; T845-V890 WeakPolarHBondContact CA-O 3.25Å; T845-D891 WeakPolarHBondContact CB-OD1 3.46Å; T845-D891 WeakPolarHBondContact CG2-OD1 3.42Å; T845-D891 PolarHBondContact OG1-OD1 3.44Å; T845-D920 HydrophobicContact CG2-CB 3.99Å; T845-D920 PolarHBondContact O-N 3.12Å
846	V	93.7	Very high	74	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.3	170.5	177.6	0	0	0	0	108.3	V890 F892 A898 L902 L917 H918 F919	V846-V890 PolarHBondContact N-O 2.93Å; V846-V890 PolarHBondContact O-N 3.21Å; V846-F892 HydrophobicContact CB-CD2 4.16Å; V846-F892 HydrophobicContact CB-CE2 3.81Å; V846-F892 HydrophobicContact CG2-CD2 3.65Å; V846-F892 HydrophobicContact CG2-CE2 3.66Å; V846-A898 HydrophobicContact CG2-CB 3.55Å; V846-L902 HydrophobicContact CG1-CD2 4.22Å; V846-L902 HydrophobicContact CG1-CG 4.34Å; V846-L917 HydrophobicContact CG1-CB 4.16Å; V846-L917 HydrophobicContact CG1-CD2 4.15Å; V846-L917 HydrophobicContact CG1-CG 4.3Å; V846-H918 WeakPolarHBondContact CG1-O 3.47Å; V846-F919 HydrophobicContact CG2-CD1 4.42Å
847	F	94.2	Very high	76.4	Confident	20 Å²	20	68.9 Å²	68.9	9%	0.088	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	138.8	169.5	175.1	-87.8	0	0	0	110.1	E887 L889 L917 H918 D920	F847-E887 HydrophobicContact CE2-CB 3.87Å; F847-E887 HydrophobicContact CE2-CG 3.96Å; F847-E887 WeakPolarHBondContact CE2-OE2 3.33Å; F847-E887 HydrophobicContact CZ-CB 3.94Å; F847-E887 VanDerWaalsContact CZ-CD 3.46Å; F847-E887 HydrophobicContact CZ-CG 3.61Å; F847-L889 HydrophobicContact CB-CD2 4.13Å; F847-L889 HydrophobicContact CD2-CD2 3.92Å; F847-L917 VanDerWaalsContact O-CA 3.31Å; F847-L917 WeakPolarHBondContact O-CA 3.43Å; F847-H918 AromaticContact CD1-CD2 3.61Å; F847-H918 AromaticContact CD1-CE1 3.64Å; F847-H918 AromaticContact CD1-NE2 3.13Å; F847-H918 WeakPolarHBondContact CD1-NE2 3.45Å; F847-H918 AromaticContact CE1-NE2 3.64Å; F847-H918 AromaticContact CG-CE1 3.65Å; F847-H918 AromaticContact CG-NE2 3.65Å; F847-H918 PolarHBondContact N-O 3.19Å; F847-H918 PolarHBondContact O-N 2.99Å; F847-H918 VanDerWaalsContact O-N 3.16Å; F847-D920 HydrophobicContact CB-CB 4.46Å
848	V	94.1	Very high	78.8	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	103.8	-180	-168.7	0	0	0	0	108.6	L851 L860 M864 E887 A888 V890 L915 L917	V848-L851 HydrophobicContact CB-CD1 4.47Å; V848-L851 HydrophobicContact CG1-CD1 4.25Å; V848-L851 HydrophobicContact CG1-CD2 4.16Å; V848-L851 HydrophobicContact CG1-CG 4.24Å; V848-L860 HydrophobicContact CG1-CD1 4.42Å; V848-M864 HydrophobicContact CG1-CE 4.13Å; V848-M864 HydrophobicContact CG2-CE 3.6Å; V848-E887 CarbonylContact O-C 3.6Å; V848-E887 VanDerWaalsContact O-CA 3.29Å; V848-E887 WeakPolarHBondContact O-CA 3.4Å; V848-A888 HydrophobicContact CB-CB 4.3Å; V848-A888 PolarHBondContact N-O 3.28Å; V848-A888 PolarHBondContact O-N 3.24Å; V848-V890 HydrophobicContact CG2-CG2 3.89Å; V848-L915 HydrophobicContact CG1-CD2 4.45Å; V848-L917 HydrophobicContact CG1-CD1 4.06Å; V848-L917 HydrophobicContact CG1-CG 4.31Å; V848-L917 HydrophobicContact CG2-CG 4.31Å
849	G	93	Very high	81.2	Confident	4 Å²	4	59.1 Å²	59.1	4%	0.041	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	170.6	179.6	0	0	0	0	0	114.1	L851 G886 V916	G849-L851 VanDerWaalsContact C-N 3.27Å; G849-L851 PolarHBondContact O-N 3.14Å; G849-G886 CarbonylContact C-O 3.58Å; G849-V916 PolarHBondContact N-O 3.48Å; G849-V916 PolarHBondContact O-N 3.27Å
850	N	92.6	Very high	83.8	Confident	52 Å²	52	53 Å²	53	28%	0.278	31%	0.307	S	S	.	.	S	Bend	trans	61.7	27.6	179.4	-163.1	32.2	0	0	0	114.8	G886 R913 P914 V916	N850-G886 PolarHBondContact N-O 3.46Å; N850-R913 VanDerWaalsContact OD1-CZ 3.29Å; N850-R913 PolarHBondContact OD1-NE 3.4Å; N850-R913 PolarHBondContact OD1-NH2 3.37Å; N850-P914 WeakPolarHBondContact CB-O 3.42Å; N850-P914 PolarHBondContact ND2-O 3.38Å; N850-V916 HydrophobicContact CB-CG2 4.23Å
851	L	90.9	Very high	86.1	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.026	29%	0.287	C	S	.	.			trans	-64.9	144.1	172.8	-68.5	159.7	0	0	0	110.5	V848 G849 C855 L860 L876 G886 A888 L915	V848-L851 HydrophobicContact CB-CD1 4.47Å; V848-L851 HydrophobicContact CG1-CD1 4.25Å; V848-L851 HydrophobicContact CG1-CD2 4.16Å; V848-L851 HydrophobicContact CG1-CG 4.24Å; G849-L851 VanDerWaalsContact C-N 3.27Å; G849-L851 PolarHBondContact O-N 3.14Å; L851-C855 HydrophobicContact CB-CB 4.36Å; L851-L860 HydrophobicContact CD1-CD2 4.12Å; L851-L860 HydrophobicContact CD2-CD1 3.96Å; L851-L860 HydrophobicContact CD2-CD2 4.29Å; L851-L876 HydrophobicContact CD1-CD2 4.44Å; L851-G886 PolarHBondContact N-O 2.97Å; L851-G886 WeakPolarHBondContact O-CA 3.17Å; L851-A888 HydrophobicContact CD1-CB 3.59Å; L851-L915 HydrophobicContact CD2-CD2 3.52Å; L851-L915 HydrophobicContact CG-CD2 4.2Å
852	P	85.8	Confident	87.9	Confident	14 Å²	14	47.2 Å²	47.2	9%	0.091	28%	0.28	C	S	.	.			trans	-58.3	145.2	169.4	-24.4	34.2	0	0	0	111.9	A854 C855 V910 A911	P852-A854 PolarHBondContact O-N 3.27Å; P852-A854 VanDerWaalsContact O-N 3.12Å; P852-C855 HydrophobicContact CB-CB 4.34Å; P852-C855 WeakPolarHBondContact O-CB 3.35Å; P852-C855 PolarHBondContact O-N 3.22Å; P852-V910 HydrophobicContact CG-CB 4.16Å; P852-V910 HydrophobicContact CG-CG1 3.98Å; P852-V910 WeakPolarHBondContact CG-O 3.44Å; P852-A911 HydrophobicContact CB-CB 4.32Å; P852-A911 HydrophobicContact CG-CB 3.85Å
853	P	77.9	Confident	89	Confident	89 Å²	89	41.5 Å²	41.5	58%	0.578	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.4	179.2	26.4	-34.8	0	0	0	113.8
854	A	81.5	Confident	89.4	Confident	79 Å²	79	36.9 Å²	36.9	65%	0.653	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.5	5.9	173.6	0	0	0	0	0	113.9	P852 T856	P852-A854 PolarHBondContact O-N 3.27Å; P852-A854 VanDerWaalsContact O-N 3.12Å; A854-T856 PolarHBondContact O-N 3.16Å
855	C	85.2	Confident	89.4	Confident	5 Å²	5	43.7 Å²	43.7	3%	0.034	25%	0.25	C	S	.	.			trans	-73.3	119.9	-177.8	-167.6	0	0	0	0	111	L851 P852	L851-C855 HydrophobicContact CB-CB 4.36Å; P852-C855 HydrophobicContact CB-CB 4.34Å; P852-C855 WeakPolarHBondContact O-CB 3.35Å; P852-C855 PolarHBondContact O-N 3.22Å
856	T	89.1	Confident	89.2	Confident	58 Å²	58	48.2 Å²	48.2	36%	0.356	27%	0.273	S	S	.	.			trans	-90.6	163.7	177.7	68.8	0	0	0	0	112	A854 D858 Q859 L860	A854-T856 PolarHBondContact O-N 3.16Å; T856-D858 PolarHBondContact O-N 3.15Å; T856-Q859 PolarHBondContact O-N 2.95Å; T856-Q859 WeakPolarHBondContact OG1-CG 3.49Å; T856-Q859 PolarHBondContact OG1-N 2.72Å; T856-L860 PolarHBondContact O-N 3.03Å; T856-L860 VanDerWaalsContact O-N 3.11Å
857	V	90.7	Very high	89.1	Confident	63 Å²	63	50.1 Å²	50.1	38%	0.382	28%	0.281	S	S	.	.	H	α-helix	trans	-55.9	-41.2	173.4	177.9	0	0	0	0	110.7	L860 A861 I874 L876	V857-L860 PolarHBondContact O-N 3.38Å; V857-A861 WeakPolarHBondContact O-CB 3.48Å; V857-A861 PolarHBondContact O-N 3.17Å; V857-I874 HydrophobicContact CG1-CB 4.11Å; V857-I874 HydrophobicContact CG1-CG2 4.1Å; V857-L876 HydrophobicContact CG2-CD1 3.71Å; V857-L876 HydrophobicContact CG2-CG 3.9Å
858	D	89.5	Confident	88.7	Confident	127 Å²	127	53.5 Å²	53.5	68%	0.679	29%	0.294	S	S	*	.	H	α-helix	trans	-67.6	-36.8	-179.4	-52.9	-68.6	0	0	0	113.2	T856 G862	T856-D858 PolarHBondContact O-N 3.15Å; D858-G862 PolarHBondContact O-N 3.3Å
859	Q	88.4	Confident	88.6	Confident	99 Å²	99	55 Å²	55	46%	0.463	30%	0.3	S	S	.	.	H	α-helix	trans	-64.9	-46.2	174.5	-72.8	175	9	0	0	110.9	T856 G862 I863	T856-Q859 PolarHBondContact O-N 2.95Å; T856-Q859 WeakPolarHBondContact OG1-CG 3.49Å; T856-Q859 PolarHBondContact OG1-N 2.72Å; Q859-G862 PolarHBondContact O-N 2.96Å; Q859-I863 WeakPolarHBondContact O-CG1 3.5Å; Q859-I863 PolarHBondContact O-N 3.39Å; Q859-I863 VanDerWaalsContact O-N 3.11Å
860	L	91.1	Very high	88.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.4	-40.3	177.3	-172.2	56	0	0	0	111.8	V848 L851 T856 V857 G862 I863 M864 I874 L876 A888	V848-L860 HydrophobicContact CG1-CD1 4.42Å; L851-L860 HydrophobicContact CD1-CD2 4.12Å; L851-L860 HydrophobicContact CD2-CD1 3.96Å; L851-L860 HydrophobicContact CD2-CD2 4.29Å; T856-L860 PolarHBondContact O-N 3.03Å; T856-L860 VanDerWaalsContact O-N 3.11Å; V857-L860 PolarHBondContact O-N 3.38Å; L860-G862 VanDerWaalsContact C-N 3.28Å; L860-G862 PolarHBondContact O-N 2.91Å; L860-I863 PolarHBondContact O-N 2.89Å; L860-M864 HydrophobicContact CD1-CE 4Å; L860-M864 HydrophobicContact CD1-CG 4.12Å; L860-M864 HydrophobicContact CD1-SD 3.95Å; L860-M864 HydrophobicContact CG-SD 4.12Å; L860-M864 WeakPolarHBondContact O-CB 3.1Å; L860-M864 WeakPolarHBondContact O-CG 3.36Å; L860-M864 PolarHBondContact O-N 3.14Å; L860-I874 HydrophobicContact CD2-CG2 3.86Å; L860-I874 HydrophobicContact CG-CD1 4.48Å; L860-I874 HydrophobicContact CG-CG2 4.46Å; L860-L876 HydrophobicContact CD2-CD2 4.24Å; L860-A888 HydrophobicContact CD2-CB 3.81Å
861	A	91.6	Very high	88	Confident	23 Å²	23	59.5 Å²	59.5	19%	0.19	33%	0.33	C	S	.	.	H	α-helix	trans	-62.3	-33.6	173.2	0	0	0	0	0	112.8	V857 R865 F869 I874	V857-A861 WeakPolarHBondContact O-CB 3.48Å; V857-A861 PolarHBondContact O-N 3.17Å; A861-R865 WeakPolarHBondContact O-CB 3.37Å; A861-R865 PolarHBondContact O-N 2.79Å; A861-R865 VanDerWaalsContact O-N 3.13Å; A861-F869 HydrophobicContact CB-CZ 3.94Å; A861-I874 HydrophobicContact CB-CD1 3.77Å
862	G	89.6	Confident	87.7	Confident	35 Å²	35	63 Å²	63	36%	0.361	37%	0.368	S	S	.	.	H	α-helix	trans	-64.9	-47.8	173	0	0	0	0	0	112.2	D858 Q859 L860 R865	D858-G862 PolarHBondContact O-N 3.3Å; Q859-G862 PolarHBondContact O-N 2.96Å; L860-G862 VanDerWaalsContact C-N 3.28Å; L860-G862 PolarHBondContact O-N 2.91Å; G862-R865 WeakPolarHBondContact O-CB 3.45Å
863	I	88.9	Confident	87.8	Confident	34 Å²	34	62.7 Å²	62.7	17%	0.174	37%	0.366	C	S	.	.	H	α-helix	trans	-66.5	-37	178.6	-63.7	157.7	0	0	0	111.6	Q859 L860 L905 Y908 V910	Q859-I863 WeakPolarHBondContact O-CG1 3.5Å; Q859-I863 PolarHBondContact O-N 3.39Å; Q859-I863 VanDerWaalsContact O-N 3.11Å; L860-I863 PolarHBondContact O-N 2.89Å; I863-L905 HydrophobicContact CG2-CD1 4.31Å; I863-L905 HydrophobicContact CG2-CD2 3.7Å; I863-Y908 HydrophobicContact CD1-CE1 4.47Å; I863-Y908 HydrophobicContact CG1-CE1 4.32Å; I863-Y908 HydrophobicContact CG2-CD1 4.05Å; I863-Y908 HydrophobicContact CG2-CE1 3.9Å; I863-V910 HydrophobicContact CD1-CG1 4.06Å; I863-V910 HydrophobicContact CD1-CG2 3.55Å
864	M	89.7	Confident	88.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-1.2	-176.3	-65.8	-166.3	154.9	0	0	114.5	V848 L860 D866 Y867 F869 V890 L905 L917	V848-M864 HydrophobicContact CG1-CE 4.13Å; V848-M864 HydrophobicContact CG2-CE 3.6Å; L860-M864 HydrophobicContact CD1-CE 4Å; L860-M864 HydrophobicContact CD1-CG 4.12Å; L860-M864 HydrophobicContact CD1-SD 3.95Å; L860-M864 HydrophobicContact CG-SD 4.12Å; L860-M864 WeakPolarHBondContact O-CB 3.1Å; L860-M864 WeakPolarHBondContact O-CG 3.36Å; L860-M864 PolarHBondContact O-N 3.14Å; M864-D866 PolarHBondContact O-N 3.06Å; M864-D866 VanDerWaalsContact O-N 3.14Å; M864-Y867 PolarHBondContact O-N 2.78Å; M864-F869 HydrophobicContact CB-CD1 3.68Å; M864-F869 HydrophobicContact CB-CE1 3.8Å; M864-F869 WeakPolarHBondContact O-CD1 3.5Å; M864-V890 HydrophobicContact SD-CB 4.37Å; M864-V890 HydrophobicContact SD-CG1 4.12Å; M864-V890 HydrophobicContact SD-CG2 3.83Å; M864-L905 HydrophobicContact CE-CD1 3.8Å; M864-L905 HydrophobicContact CG-CD1 3.68Å; M864-L917 HydrophobicContact CE-CD2 3.95Å
865	R	87.3	Confident	89	Confident	182 Å²	182	60.6 Å²	60.6	69%	0.687	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-53.2	-38.5	-173	-172.1	172.3	-70.7	167.5	-2.3	113.6	A861 G862 Y867	A861-R865 WeakPolarHBondContact O-CB 3.37Å; A861-R865 PolarHBondContact O-N 2.79Å; A861-R865 VanDerWaalsContact O-N 3.13Å; G862-R865 WeakPolarHBondContact O-CB 3.45Å; R865-Y867 PolarHBondContact O-N 3.03Å
866	D	88.5	Confident	89.3	Confident	123 Å²	123	62 Å²	62	66%	0.658	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-81.1	-1.2	-175.4	-57.5	-24.9	0	0	0	114	M864 Y868	M864-D866 PolarHBondContact O-N 3.06Å; M864-D866 VanDerWaalsContact O-N 3.14Å; D866-Y868 WeakPolarHBondContact O-CE2 3.17Å
867	Y	91	Very high	89.3	Confident	41 Å²	41	65 Å²	65	16%	0.161	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-109	6.3	-174.4	-60.7	-87.2	0	0	0	114.4	M864 R865 F869 F892 R900 A901 G904 L905	M864-Y867 PolarHBondContact O-N 2.78Å; R865-Y867 PolarHBondContact O-N 3.03Å; Y867-F869 VanDerWaalsContact C-N 3.34Å; Y867-F869 PolarHBondContact O-N 2.94Å; Y867-F892 WeakPolarHBondContact O-CE1 3.37Å; Y867-R900 HydrophobicContact CD1-CG 4.12Å; Y867-R900 HydrophobicContact CE1-CG 4.28Å; Y867-R900 WeakPolarHBondContact CE1-O 3.2Å; Y867-A901 HydrophobicContact CD1-CB 3.97Å; Y867-A901 HydrophobicContact CG-CB 4.12Å; Y867-G904 WeakPolarHBondContact OH-CA 3.33Å; Y867-L905 HydrophobicContact CD2-CD1 3.72Å; Y867-L905 HydrophobicContact CD2-CG 4.14Å; Y867-L905 HydrophobicContact CE1-CG 4.43Å; Y867-L905 HydrophobicContact CE2-CD1 3.63Å; Y867-L905 HydrophobicContact CE2-CD2 3.69Å; Y867-L905 HydrophobicContact CE2-CG 3.54Å; Y867-L905 HydrophobicContact CG-CD1 4.38Å
868	Y	87	Confident	89	Confident	91 Å²	91	68.8 Å²	68.8	36%	0.357	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	37.6	171.8	-53	-92.1	0	0	0	115	G66 D866	G66-Y868 PolarHBondContact O-OH 2.81Å; D866-Y868 WeakPolarHBondContact O-CE2 3.17Å
869	F	91.5	Very high	88.8	Confident	31 Å²	31	65.4 Å²	65.4	14%	0.136	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-62.2	155.2	168.9	71.2	-84.8	0	0	0	111.5	A861 M864 Y867 P871 I874 V890 F892	A861-F869 HydrophobicContact CB-CZ 3.94Å; M864-F869 HydrophobicContact CB-CD1 3.68Å; M864-F869 HydrophobicContact CB-CE1 3.8Å; M864-F869 WeakPolarHBondContact O-CD1 3.5Å; Y867-F869 VanDerWaalsContact C-N 3.34Å; Y867-F869 PolarHBondContact O-N 2.94Å; F869-P871 WeakPolarHBondContact O-CD 3.44Å; F869-I874 HydrophobicContact CD2-CD1 4.11Å; F869-I874 HydrophobicContact CD2-CG1 3.93Å; F869-I874 HydrophobicContact CE2-CD1 3.54Å; F869-I874 HydrophobicContact CE2-CG1 3.75Å; F869-I874 HydrophobicContact CZ-CD1 3.79Å; F869-I874 HydrophobicContact CZ-CG1 4.48Å; F869-V890 HydrophobicContact CB-CG1 3.5Å; F869-V890 VanDerWaalsContact CB-CG1 3.5Å; F869-V890 HydrophobicContact CD2-CG1 4.16Å; F869-V890 HydrophobicContact CG-CG1 3.97Å; F869-F892 HydrophobicContact CB-CD1 4.08Å; F869-F892 HydrophobicContact CB-CE1 3.73Å; F869-F892 HydrophobicContact CB-CE2 4.49Å; F869-F892 HydrophobicContact CB-CZ 3.96Å
870	V	89.8	Confident	88.4	Confident	53 Å²	53	67 Å²	67	32%	0.321	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-66	119.9	178.7	175	0	0	0	0	109.7	G872 S873 D891	V870-G872 PolarHBondContact O-N 3.49Å; V870-S873 WeakPolarHBondContact O-CB 3.42Å; V870-S873 PolarHBondContact O-N 2.82Å; V870-S873 PolarHBondContact O-OG 3.14Å; V870-D891 WeakPolarHBondContact CB-O 3.48Å; V870-D891 WeakPolarHBondContact CG2-O 3.33Å; V870-D891 PolarHBondContact N-O 2.67Å
871	P	82.4	Confident	87.8	Confident	97 Å²	97	74 Å²	74	63%	0.63	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	126.2	-177.9	-27	36	0	0	0	112.2	F869	F869-P871 WeakPolarHBondContact O-CD 3.44Å
872	G	84.4	Confident	87	Confident	80 Å²	80	74.4 Å²	74.4	83%	0.825	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	0.6	-175.2	0	0	0	0	0	115.4	V870 I874	V870-G872 PolarHBondContact O-N 3.49Å; G872-I874 VanDerWaalsContact C-N 3.34Å
873	S	89.4	Confident	86.2	Confident	6 Å²	6	79 Å²	79	4%	0.042	40%	0.402	C	S	.	.			trans	-78.8	-12.7	178.3	74.5	0	0	0	0	115	V870 R875 D891	V870-S873 WeakPolarHBondContact O-CB 3.42Å; V870-S873 PolarHBondContact O-N 2.82Å; V870-S873 PolarHBondContact O-OG 3.14Å; S873-R875 PolarHBondContact O-N 3.3Å; S873-R875 VanDerWaalsContact O-N 3.15Å; S873-R875 PolarHBondContact O-NH1 3.03Å; S873-D891 PolarHBondContact OG-N 3.33Å; S873-D891 PolarHBondContact OG-O 3.09Å; S873-D891 VanDerWaalsContact OG-O 3.11Å
874	I	92.3	Very high	86	Confident	16 Å²	16	80.8 Å²	80.8	8%	0.082	41%	0.409	C	S	.	.			trans	-67.2	111.7	-178.5	-58.2	179.6	0	0	0	110.1	V857 L860 A861 F869 G872 L876 L889 V890	V857-I874 HydrophobicContact CG1-CB 4.11Å; V857-I874 HydrophobicContact CG1-CG2 4.1Å; L860-I874 HydrophobicContact CD2-CG2 3.86Å; L860-I874 HydrophobicContact CG-CD1 4.48Å; L860-I874 HydrophobicContact CG-CG2 4.46Å; A861-I874 HydrophobicContact CB-CD1 3.77Å; F869-I874 HydrophobicContact CD2-CD1 4.11Å; F869-I874 HydrophobicContact CD2-CG1 3.93Å; F869-I874 HydrophobicContact CE2-CD1 3.54Å; F869-I874 HydrophobicContact CE2-CG1 3.75Å; F869-I874 HydrophobicContact CZ-CD1 3.79Å; F869-I874 HydrophobicContact CZ-CG1 4.48Å; G872-I874 VanDerWaalsContact C-N 3.34Å; I874-L876 HydrophobicContact CG2-CD2 4.48Å; I874-L889 WeakPolarHBondContact CA-O 3.34Å; I874-V890 HydrophobicContact CG1-CG1 4.2Å; I874-V890 HydrophobicContact CG1-CG2 4.06Å; I874-V890 HydrophobicContact CG2-CG2 4.42Å
875	R	91.4	Very high	85.8	Confident	109 Å²	109	83.9 Å²	83.9	41%	0.411	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	107.6	177.4	-65.8	177.8	-65.7	-83.3	7.2	109.8	S873 A888 L889 D891	S873-R875 PolarHBondContact O-N 3.3Å; S873-R875 VanDerWaalsContact O-N 3.15Å; S873-R875 PolarHBondContact O-NH1 3.03Å; R875-A888 CarbonylContact O-C 3.57Å; R875-A888 WeakPolarHBondContact O-CA 3.24Å; R875-L889 HydrophobicContact CB-CB 4.43Å; R875-L889 PolarHBondContact N-O 2.75Å; R875-L889 PolarHBondContact O-N 2.96Å; R875-D891 IonicContact CZ-OD1 3.66Å; R875-D891 IonicContact CZ-OD2 3.25Å; R875-D891 IonicContact NH1-OD1 2.98Å; R875-D891 IonicContact NH1-OD2 3.24Å; R875-D891 PolarHBondContact NH1-OD2 3.07Å; R875-D891 IonicContact NH2-OD1 3.55Å; R875-D891 PolarHBondContact NH2-OD1 3.36Å; R875-D891 IonicContact NH2-OD2 2.67Å; R875-D891 PolarHBondContact NH2-OD2 3.17Å
876	L	91.4	Very high	85.8	Confident	34 Å²	34	75.7 Å²	75.7	18%	0.178	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	128.4	172.3	-59.6	-179.3	0	0	0	110.1	L851 V857 L860 I874 F884 A888	L851-L876 HydrophobicContact CD1-CD2 4.44Å; V857-L876 HydrophobicContact CG2-CD1 3.71Å; V857-L876 HydrophobicContact CG2-CG 3.9Å; L860-L876 HydrophobicContact CD2-CD2 4.24Å; I874-L876 HydrophobicContact CG2-CD2 4.48Å; L876-F884 HydrophobicContact CB-CD1 3.92Å; L876-F884 HydrophobicContact CB-CE1 3.85Å; L876-F884 HydrophobicContact CD1-CD1 3.98Å; L876-F884 HydrophobicContact CD1-CE1 3.51Å; L876-F884 HydrophobicContact CD1-CZ 4.17Å; L876-F884 HydrophobicContact CG-CE1 4.34Å; L876-A888 HydrophobicContact CD2-CB 3.72Å
877	R	89	Confident	86	Confident	120 Å²	120	72 Å²	72	45%	0.453	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	129.2	176.7	-168.3	-176.2	176.9	-169.7	-8.7	110	V885 E887	R877-V885 HydrophobicContact CG-CG2 4.32Å; R877-V885 PolarHBondContact O-N 2.86Å; R877-E887 HydrophobicContact CB-CB 4.01Å; R877-E887 WeakPolarHBondContact CB-O 3.49Å; R877-E887 WeakPolarHBondContact CD-OE2 3.35Å; R877-E887 IonicContact CZ-OE2 2.67Å; R877-E887 PolarHBondContact N-O 2.95Å; R877-E887 IonicContact NE-OE2 3.52Å; R877-E887 IonicContact NH1-OE1 3.63Å; R877-E887 PolarHBondContact NH1-OE1 3.37Å; R877-E887 IonicContact NH1-OE2 3.36Å; R877-E887 PolarHBondContact NH1-OE2 2.93Å
878	R	86	Confident	86.1	Confident	144 Å²	144	70.1 Å²	70.1	54%	0.543	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	154.3	172.1	-64.7	174.6	-176.2	-118.1	13.5	110.7	G882 Q883 F884	R878-G882 WeakPolarHBondContact CD-O 3.3Å; R878-G882 PolarHBondContact NH1-O 2.95Å; R878-Q883 CarbonylContact C-O 3.51Å; R878-Q883 WeakPolarHBondContact CA-O 3.38Å; R878-Q883 WeakPolarHBondContact CB-O 3.44Å; R878-F884 HydrophobicContact CG-CD1 3.88Å; R878-F884 HydrophobicContact CG-CE1 4.12Å; R878-F884 VanDerWaalsContact CZ-CZ 3.42Å
879	D	83.8	Confident	86.4	Confident	56 Å²	56	68 Å²	68	30%	0.299	37%	0.366	S	S	.	.			trans	-77.6	171.8	168.5	71	4	0	0	0	110.8	Q881 G882 Q883 V885	D879-Q881 PolarHBondContact O-N 2.92Å; D879-Q881 VanDerWaalsContact O-N 3.11Å; D879-Q881 VanDerWaalsContact OD1-C 3.23Å; D879-Q881 WeakPolarHBondContact OD1-CA 3.44Å; D879-Q881 WeakPolarHBondContact OD1-CB 3.4Å; D879-Q881 PolarHBondContact OD1-N 3.27Å; D879-Q881 PolarHBondContact OD2-OE1 2.81Å; D879-G882 PolarHBondContact O-N 2.83Å; D879-G882 PolarHBondContact OD1-N 3.31Å; D879-Q883 PolarHBondContact N-O 2.96Å; D879-Q883 PolarHBondContact OD1-N 2.94Å; D879-V885 HydrophobicContact CB-CG2 4.08Å
880	P	81.4	Confident	86.5	Confident	133 Å²	133	66.5 Å²	66.5	86%	0.864	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-17.8	175.1	-26.6	36.7	0	0	0	114.7
881	Q	76.7	Confident	86.7	Confident	146 Å²	146	64.6 Å²	64.6	68%	0.682	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-1.9	176.7	-62.5	81.4	-10	0	0	112.6	D879	D879-Q881 PolarHBondContact O-N 2.92Å; D879-Q881 VanDerWaalsContact O-N 3.11Å; D879-Q881 VanDerWaalsContact OD1-C 3.23Å; D879-Q881 WeakPolarHBondContact OD1-CA 3.44Å; D879-Q881 WeakPolarHBondContact OD1-CB 3.4Å; D879-Q881 PolarHBondContact OD1-N 3.27Å; D879-Q881 PolarHBondContact OD2-OE1 2.81Å
882	G	75.7	Confident	87.2	Confident	31 Å²	31	60 Å²	60	32%	0.32	32%	0.317	S	S	.	.	S	Bend	trans	84.9	1.1	177.8	0	0	0	0	0	115.6	R878 D879	R878-G882 WeakPolarHBondContact CD-O 3.3Å; R878-G882 PolarHBondContact NH1-O 2.95Å; D879-G882 PolarHBondContact O-N 2.83Å; D879-G882 PolarHBondContact OD1-N 3.31Å
883	Q	73.7	Confident	87.3	Confident	131 Å²	131	63.5 Å²	63.5	61%	0.612	31%	0.31	S	S	*	.			trans	-77.2	146.2	177.9	-63.7	-65.9	-26.6	0	0	111.3	R878 D879 V885	R878-Q883 CarbonylContact C-O 3.51Å; R878-Q883 WeakPolarHBondContact CA-O 3.38Å; R878-Q883 WeakPolarHBondContact CB-O 3.44Å; D879-Q883 PolarHBondContact N-O 2.96Å; D879-Q883 PolarHBondContact OD1-N 2.94Å; Q883-V885 PolarHBondContact O-N 3.04Å
884	F	83	Confident	87.2	Confident	73 Å²	73	65.8 Å²	65.8	32%	0.32	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	125.1	178.8	-64.8	-72.4	0	0	0	111.5	L876 R878 G886	L876-F884 HydrophobicContact CB-CD1 3.92Å; L876-F884 HydrophobicContact CB-CE1 3.85Å; L876-F884 HydrophobicContact CD1-CD1 3.98Å; L876-F884 HydrophobicContact CD1-CE1 3.51Å; L876-F884 HydrophobicContact CD1-CZ 4.17Å; L876-F884 HydrophobicContact CG-CE1 4.34Å; R878-F884 HydrophobicContact CG-CD1 3.88Å; R878-F884 HydrophobicContact CG-CE1 4.12Å; R878-F884 VanDerWaalsContact CZ-CZ 3.42Å; F884-G886 PolarHBondContact O-N 2.87Å
885	V	85.4	Confident	87	Confident	65 Å²	65	68.7 Å²	68.7	39%	0.394	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	-8.4	-176.3	-173.7	0	0	0	0	112.4	R877 D879 Q883 E887	R877-V885 HydrophobicContact CG-CG2 4.32Å; R877-V885 PolarHBondContact O-N 2.86Å; D879-V885 HydrophobicContact CB-CG2 4.08Å; Q883-V885 PolarHBondContact O-N 3.04Å; V885-E887 HydrophobicContact CG1-CG 4.33Å
886	G	89.1	Confident	87	Confident	10 Å²	10	70.5 Å²	70.5	10%	0.103	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80	23.9	-172.4	0	0	0	0	0	113.3	G849 N850 L851 F884	G849-G886 CarbonylContact C-O 3.58Å; N850-G886 PolarHBondContact N-O 3.46Å; L851-G886 PolarHBondContact N-O 2.97Å; L851-G886 WeakPolarHBondContact O-CA 3.17Å; F884-G886 PolarHBondContact O-N 2.87Å
887	E	91.1	Very high	87	Confident	45 Å²	45	70.6 Å²	70.6	21%	0.21	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	149.6	178.5	-58.2	-180	178	0	0	110.9	F847 V848 R877 V885	F847-E887 HydrophobicContact CE2-CB 3.87Å; F847-E887 HydrophobicContact CE2-CG 3.96Å; F847-E887 WeakPolarHBondContact CE2-OE2 3.33Å; F847-E887 HydrophobicContact CZ-CB 3.94Å; F847-E887 VanDerWaalsContact CZ-CD 3.46Å; F847-E887 HydrophobicContact CZ-CG 3.61Å; V848-E887 CarbonylContact O-C 3.6Å; V848-E887 VanDerWaalsContact O-CA 3.29Å; V848-E887 WeakPolarHBondContact O-CA 3.4Å; R877-E887 HydrophobicContact CB-CB 4.01Å; R877-E887 WeakPolarHBondContact CB-O 3.49Å; R877-E887 WeakPolarHBondContact CD-OE2 3.35Å; R877-E887 IonicContact CZ-OE2 2.67Å; R877-E887 PolarHBondContact N-O 2.95Å; R877-E887 IonicContact NE-OE2 3.52Å; R877-E887 IonicContact NH1-OE1 3.63Å; R877-E887 PolarHBondContact NH1-OE1 3.37Å; R877-E887 IonicContact NH1-OE2 3.36Å; R877-E887 PolarHBondContact NH1-OE2 2.93Å; V885-E887 HydrophobicContact CG1-CG 4.33Å
888	A	93.2	Very high	87.2	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.008	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	158.7	173.3	0	0	0	0	0	112.2	V848 L851 L860 R875 L876	V848-A888 HydrophobicContact CB-CB 4.3Å; V848-A888 PolarHBondContact N-O 3.28Å; V848-A888 PolarHBondContact O-N 3.24Å; L851-A888 HydrophobicContact CD1-CB 3.59Å; L860-A888 HydrophobicContact CD2-CB 3.81Å; R875-A888 CarbonylContact O-C 3.57Å; R875-A888 WeakPolarHBondContact O-CA 3.24Å; L876-A888 HydrophobicContact CD2-CB 3.72Å
889	L	93.5	Very high	87.6	Confident	47 Å²	47	60.3 Å²	60.3	25%	0.246	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	139.1	167.6	-61.5	177.7	0	0	0	109.2	T845 F847 I874 R875 D920	T845-L889 HydrophobicContact CG2-CB 3.9Å; T845-L889 HydrophobicContact CG2-CD2 4.04Å; T845-L889 HydrophobicContact CG2-CG 4.37Å; F847-L889 HydrophobicContact CB-CD2 4.13Å; F847-L889 HydrophobicContact CD2-CD2 3.92Å; I874-L889 WeakPolarHBondContact CA-O 3.34Å; R875-L889 HydrophobicContact CB-CB 4.43Å; R875-L889 PolarHBondContact N-O 2.75Å; R875-L889 PolarHBondContact O-N 2.96Å; L889-D920 HydrophobicContact CD2-CB 4.29Å; L889-D920 WeakPolarHBondContact CD2-OD2 3.4Å
890	V	93.9	Very high	88	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	122.8	-179.4	-176.5	0	0	0	0	108.8	T845 V846 V848 M864 F869 I874 F892	T845-V890 WeakPolarHBondContact CA-O 3.25Å; V846-V890 PolarHBondContact N-O 2.93Å; V846-V890 PolarHBondContact O-N 3.21Å; V848-V890 HydrophobicContact CG2-CG2 3.89Å; M864-V890 HydrophobicContact SD-CB 4.37Å; M864-V890 HydrophobicContact SD-CG1 4.12Å; M864-V890 HydrophobicContact SD-CG2 3.83Å; F869-V890 HydrophobicContact CB-CG1 3.5Å; F869-V890 VanDerWaalsContact CB-CG1 3.5Å; F869-V890 HydrophobicContact CD2-CG1 4.16Å; F869-V890 HydrophobicContact CG-CG1 3.97Å; I874-V890 HydrophobicContact CG1-CG1 4.2Å; I874-V890 HydrophobicContact CG1-CG2 4.06Å; I874-V890 HydrophobicContact CG2-CG2 4.42Å; V890-F892 HydrophobicContact CB-CE2 4.06Å; V890-F892 HydrophobicContact CG1-CD2 4.44Å; V890-F892 HydrophobicContact CG1-CE2 3.72Å; V890-F892 HydrophobicContact CG1-CZ 3.98Å
891	D	93.1	Very high	88.6	Confident	12 Å²	12	55.8 Å²	55.8	6%	0.064	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	133.4	-179.8	-51.8	-37.6	0	0	0	110.9	F843 T845 V870 S873 R875	F843-D891 HydrophobicContact CB-CB 4.15Å; F843-D891 HydrophobicContact CG-CB 4.44Å; T845-D891 WeakPolarHBondContact CB-OD1 3.46Å; T845-D891 WeakPolarHBondContact CG2-OD1 3.42Å; T845-D891 PolarHBondContact OG1-OD1 3.44Å; V870-D891 WeakPolarHBondContact CB-O 3.48Å; V870-D891 WeakPolarHBondContact CG2-O 3.33Å; V870-D891 PolarHBondContact N-O 2.67Å; S873-D891 PolarHBondContact OG-N 3.33Å; S873-D891 PolarHBondContact OG-O 3.09Å; S873-D891 VanDerWaalsContact OG-O 3.11Å; R875-D891 IonicContact CZ-OD1 3.66Å; R875-D891 IonicContact CZ-OD2 3.25Å; R875-D891 IonicContact NH1-OD1 2.98Å; R875-D891 IonicContact NH1-OD2 3.24Å; R875-D891 PolarHBondContact NH1-OD2 3.07Å; R875-D891 IonicContact NH2-OD1 3.55Å; R875-D891 PolarHBondContact NH2-OD1 3.36Å; R875-D891 IonicContact NH2-OD2 2.67Å; R875-D891 PolarHBondContact NH2-OD2 3.17Å
892	F	93.1	Very high	89.4	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	149.9	174	-66.7	-94.9	0	0	0	110.2	F843 V844 V846 Y867 F869 V890 T894 E897 A898 A901	F843-F892 CarbonylContact C-O 3.56Å; F843-F892 VanDerWaalsContact CA-O 3.25Å; F843-F892 WeakPolarHBondContact CA-O 3.35Å; F843-F892 WeakPolarHBondContact CB-O 3.4Å; V844-F892 PolarHBondContact N-O 3.24Å; V844-F892 PolarHBondContact O-N 3.31Å; V846-F892 HydrophobicContact CB-CD2 4.16Å; V846-F892 HydrophobicContact CB-CE2 3.81Å; V846-F892 HydrophobicContact CG2-CD2 3.65Å; V846-F892 HydrophobicContact CG2-CE2 3.66Å; Y867-F892 WeakPolarHBondContact O-CE1 3.37Å; F869-F892 HydrophobicContact CB-CD1 4.08Å; F869-F892 HydrophobicContact CB-CE1 3.73Å; F869-F892 HydrophobicContact CB-CE2 4.49Å; F869-F892 HydrophobicContact CB-CZ 3.96Å; V890-F892 HydrophobicContact CB-CE2 4.06Å; V890-F892 HydrophobicContact CG1-CD2 4.44Å; V890-F892 HydrophobicContact CG1-CE2 3.72Å; V890-F892 HydrophobicContact CG1-CZ 3.98Å; F892-T894 VanDerWaalsContact C-N 3.28Å; F892-T894 PolarHBondContact O-N 3.38Å; F892-E897 HydrophobicContact CB-CB 4.28Å; F892-E897 HydrophobicContact CD1-CB 3.85Å; F892-E897 HydrophobicContact CG-CB 4.47Å; F892-A898 HydrophobicContact CB-CB 4.02Å; F892-A898 HydrophobicContact CD2-CB 4.02Å; F892-A898 HydrophobicContact CG-CB 4Å; F892-A901 HydrophobicContact CE1-CB 3.81Å; F892-A901 HydrophobicContact CE2-CB 4.33Å; F892-A901 HydrophobicContact CZ-CB 3.56Å
893	K	87	Confident	90.2	Very high	155 Å²	155	57.6 Å²	57.6	67%	0.674	27%	0.271	S	S	*	.	S	Bend	trans	-72.8	-24.4	-179.3	-173	-177.5	175.6	-170.9	0	112.2	E897	K893-E897 WeakPolarHBondContact CB-OE2 3.33Å; K893-E897 PolarHBondContact N-OE2 3.41Å
894	T	88.5	Confident	91	Very high	54 Å²	54	53.1 Å²	53.1	33%	0.331	26%	0.261	S	S	.	.	S	Bend	trans	-138.1	154.6	180	66.2	0	0	0	0	112.1	F892 Y896 E897 A898	F892-T894 VanDerWaalsContact C-N 3.28Å; F892-T894 PolarHBondContact O-N 3.38Å; T894-Y896 PolarHBondContact O-N 2.86Å; T894-E897 WeakPolarHBondContact CB-OE2 3.39Å; T894-E897 PolarHBondContact N-OE2 3.42Å; T894-E897 PolarHBondContact O-N 2.99Å; T894-E897 VanDerWaalsContact OG1-CG 3.24Å; T894-E897 WeakPolarHBondContact OG1-CG 3.35Å; T894-E897 PolarHBondContact OG1-N 3.3Å; T894-E897 VanDerWaalsContact OG1-N 3.15Å; T894-E897 PolarHBondContact OG1-OE2 3.23Å; T894-A898 PolarHBondContact O-N 2.82Å
895	S	88.1	Confident	91.5	Very high	77 Å²	77	49.9 Å²	49.9	54%	0.538	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-27.1	171.3	51.7	0	0	0	0	113	D899	S895-D899 WeakPolarHBondContact O-CB 3.47Å; S895-D899 PolarHBondContact O-N 2.81Å
896	Y	90.9	Very high	91.8	Very high	147 Å²	147	51 Å²	51	58%	0.576	25%	0.25	S	S	*	.	H	α-helix	trans	-73.1	-41.6	179.4	173.7	-111.4	0	0	0	112.9	T894 A898 D899 R900	T894-Y896 PolarHBondContact O-N 2.86Å; Y896-A898 VanDerWaalsContact C-N 3.34Å; Y896-D899 PolarHBondContact O-N 3.49Å; Y896-R900 WeakPolarHBondContact O-CB 3.45Å; Y896-R900 PolarHBondContact O-N 3.44Å; Y896-R900 PolarHBondContact OH-NH2 2.83Å
897	E	91.4	Very high	91.8	Very high	35 Å²	35	52.6 Å²	52.6	16%	0.164	27%	0.267	C	S	.	.	H	α-helix	trans	-64.2	-41.4	172.5	-68.5	154.1	152.2	0	0	110.9	F892 K893 T894 R900 A901	F892-E897 HydrophobicContact CB-CB 4.28Å; F892-E897 HydrophobicContact CD1-CB 3.85Å; F892-E897 HydrophobicContact CG-CB 4.47Å; K893-E897 WeakPolarHBondContact CB-OE2 3.33Å; K893-E897 PolarHBondContact N-OE2 3.41Å; T894-E897 WeakPolarHBondContact CB-OE2 3.39Å; T894-E897 PolarHBondContact N-OE2 3.42Å; T894-E897 PolarHBondContact O-N 2.99Å; T894-E897 VanDerWaalsContact OG1-CG 3.24Å; T894-E897 WeakPolarHBondContact OG1-CG 3.35Å; T894-E897 PolarHBondContact OG1-N 3.3Å; T894-E897 VanDerWaalsContact OG1-N 3.15Å; T894-E897 PolarHBondContact OG1-OE2 3.23Å; E897-R900 WeakPolarHBondContact O-CB 3.13Å; E897-R900 PolarHBondContact O-N 3.23Å; E897-A901 PolarHBondContact O-N 3.35Å
898	A	92.9	Very high	91.8	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.6	-45.7	174.9	0	0	0	0	0	112.9	V844 V846 F892 T894 Y896 R900 A901 L902 F919	V844-A898 HydrophobicContact CB-CB 4.28Å; V844-A898 HydrophobicContact CG1-CB 3.85Å; V846-A898 HydrophobicContact CG2-CB 3.55Å; F892-A898 HydrophobicContact CB-CB 4.02Å; F892-A898 HydrophobicContact CD2-CB 4.02Å; F892-A898 HydrophobicContact CG-CB 4Å; T894-A898 PolarHBondContact O-N 2.82Å; Y896-A898 VanDerWaalsContact C-N 3.34Å; A898-R900 VanDerWaalsContact C-N 3.31Å; A898-R900 PolarHBondContact O-N 2.78Å; A898-A901 PolarHBondContact O-N 3.23Å; A898-L902 WeakPolarHBondContact O-CB 3.31Å; A898-L902 WeakPolarHBondContact O-CD1 3.16Å; A898-L902 VanDerWaalsContact O-CG 3.28Å; A898-L902 WeakPolarHBondContact O-CG 3.45Å; A898-L902 PolarHBondContact O-N 2.9Å; A898-F919 HydrophobicContact CB-CD1 4.35Å; A898-F919 HydrophobicContact CB-CE1 3.59Å; A898-F919 HydrophobicContact CB-CZ 4.41Å
899	D	93.6	Very high	91.6	Very high	49 Å²	49	64.1 Å²	64.1	26%	0.262	31%	0.309	S	S	.	.	H	α-helix	trans	-63.1	-35.7	174.8	-178.6	77.9	0	0	0	111.9	S895 Y896 L902 R903 F919	S895-D899 WeakPolarHBondContact O-CB 3.47Å; S895-D899 PolarHBondContact O-N 2.81Å; Y896-D899 PolarHBondContact O-N 3.49Å; D899-L902 WeakPolarHBondContact O-CB 3.49Å; D899-L902 PolarHBondContact O-N 3.16Å; D899-R903 WeakPolarHBondContact O-CG 3.39Å; D899-R903 PolarHBondContact O-N 2.88Å; D899-R903 IonicContact OD1-CZ 3.95Å; D899-R903 IonicContact OD1-NE 3.29Å; D899-R903 PolarHBondContact OD1-NE 2.92Å; D899-R903 IonicContact OD1-NH2 2.72Å; D899-R903 PolarHBondContact OD1-NH2 2.98Å; D899-R903 IonicContact OD2-CZ 3.46Å; D899-R903 IonicContact OD2-NE 3.24Å; D899-R903 PolarHBondContact OD2-NE 3.23Å; D899-R903 IonicContact OD2-NH2 3.41Å; D899-R903 PolarHBondContact OD2-NH2 3.05Å; D899-R903 VanDerWaalsContact OD2-NH2 3.12Å; D899-F919 HydrophobicContact CB-CZ 4.32Å
900	R	93.6	Very high	91.2	Very high	93 Å²	93	62.7 Å²	62.7	35%	0.351	30%	0.302	S	S	.	.	H	α-helix	trans	-64.5	-44.5	172.3	-169.3	-169.2	-66.4	176.5	-5.5	111.9	Y867 Y896 E897 A898 L902 R903 G904	Y867-R900 HydrophobicContact CD1-CG 4.12Å; Y867-R900 HydrophobicContact CE1-CG 4.28Å; Y867-R900 WeakPolarHBondContact CE1-O 3.2Å; Y896-R900 WeakPolarHBondContact O-CB 3.45Å; Y896-R900 PolarHBondContact O-N 3.44Å; Y896-R900 PolarHBondContact OH-NH2 2.83Å; E897-R900 WeakPolarHBondContact O-CB 3.13Å; E897-R900 PolarHBondContact O-N 3.23Å; A898-R900 VanDerWaalsContact C-N 3.31Å; A898-R900 PolarHBondContact O-N 2.78Å; R900-L902 VanDerWaalsContact C-N 3.34Å; R900-R903 PolarHBondContact O-N 3.42Å; R900-G904 PolarHBondContact O-N 3.46Å
901	A	93.8	Very high	90.8	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.5	-43.1	175	0	0	0	0	0	111.7	Y867 F892 E897 A898 G904 L905	Y867-A901 HydrophobicContact CD1-CB 3.97Å; Y867-A901 HydrophobicContact CG-CB 4.12Å; F892-A901 HydrophobicContact CE1-CB 3.81Å; F892-A901 HydrophobicContact CE2-CB 4.33Å; F892-A901 HydrophobicContact CZ-CB 3.56Å; E897-A901 PolarHBondContact O-N 3.35Å; A898-A901 PolarHBondContact O-N 3.23Å; A901-G904 PolarHBondContact O-N 2.89Å; A901-L905 WeakPolarHBondContact O-CB 3.43Å; A901-L905 PolarHBondContact O-N 3.44Å
902	L	93.9	Very high	90.4	Very high	22 Å²	22	68.9 Å²	68.9	12%	0.115	36%	0.36	C	S	.	.	H	α-helix	trans	-58.9	-46.5	175	-77.2	159.3	0	0	0	112.2	V846 A898 D899 R900 N906 L917 H918 F919	V846-L902 HydrophobicContact CG1-CD2 4.22Å; V846-L902 HydrophobicContact CG1-CG 4.34Å; A898-L902 WeakPolarHBondContact O-CB 3.31Å; A898-L902 WeakPolarHBondContact O-CD1 3.16Å; A898-L902 VanDerWaalsContact O-CG 3.28Å; A898-L902 WeakPolarHBondContact O-CG 3.45Å; A898-L902 PolarHBondContact O-N 2.9Å; D899-L902 WeakPolarHBondContact O-CB 3.49Å; D899-L902 PolarHBondContact O-N 3.16Å; R900-L902 VanDerWaalsContact C-N 3.34Å; L902-N906 WeakPolarHBondContact O-CB 3.43Å; L902-N906 PolarHBondContact O-N 3.31Å; L902-L917 HydrophobicContact CD2-CB 3.57Å; L902-L917 VanDerWaalsContact CD2-O 3.25Å; L902-L917 WeakPolarHBondContact CD2-O 3.5Å; L902-L917 HydrophobicContact CG-CB 4.48Å; L902-H918 VanDerWaalsContact CD2-CA 3.41Å; L902-F919 HydrophobicContact CD1-CD1 3.97Å; L902-F919 HydrophobicContact CD1-CD2 3.63Å; L902-F919 HydrophobicContact CD1-CE1 3.7Å; L902-F919 HydrophobicContact CD1-CE2 3.32Å; L902-F919 HydrophobicContact CD1-CG 3.94Å; L902-F919 HydrophobicContact CD1-CZ 3.37Å
903	R	92.3	Very high	90.1	Very high	193 Å²	193	74.1 Å²	74.1	73%	0.728	38%	0.38	S	S	*	.	H	α-helix	trans	-71.7	-33.7	179	-68.5	176.6	-160.7	-92.7	-12.6	113.6	D899 R900	D899-R903 WeakPolarHBondContact O-CG 3.39Å; D899-R903 PolarHBondContact O-N 2.88Å; D899-R903 IonicContact OD1-CZ 3.95Å; D899-R903 IonicContact OD1-NE 3.29Å; D899-R903 PolarHBondContact OD1-NE 2.92Å; D899-R903 IonicContact OD1-NH2 2.72Å; D899-R903 PolarHBondContact OD1-NH2 2.98Å; D899-R903 IonicContact OD2-CZ 3.46Å; D899-R903 IonicContact OD2-NE 3.24Å; D899-R903 PolarHBondContact OD2-NE 3.23Å; D899-R903 IonicContact OD2-NH2 3.41Å; D899-R903 PolarHBondContact OD2-NH2 3.05Å; D899-R903 VanDerWaalsContact OD2-NH2 3.12Å; R900-R903 PolarHBondContact O-N 3.42Å
904	G	90.8	Very high	90.3	Very high	38 Å²	38	69 Å²	69	39%	0.392	36%	0.362	S	S	.	.	H	α-helix	trans	-87.9	-32.3	-174.4	0	0	0	0	0	115.3	Y867 R900 A901	Y867-G904 WeakPolarHBondContact OH-CA 3.33Å; R900-G904 PolarHBondContact O-N 3.46Å; A901-G904 PolarHBondContact O-N 2.89Å
905	L	92.8	Very high	90.6	Very high	4 Å²	4	66.4 Å²	66.4	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-110.6	-14.6	-173.5	-64.6	176.9	0	0	0	114.8	I863 M864 Y867 A901 G907 Y908 L917	I863-L905 HydrophobicContact CG2-CD1 4.31Å; I863-L905 HydrophobicContact CG2-CD2 3.7Å; M864-L905 HydrophobicContact CE-CD1 3.8Å; M864-L905 HydrophobicContact CG-CD1 3.68Å; Y867-L905 HydrophobicContact CD2-CD1 3.72Å; Y867-L905 HydrophobicContact CD2-CG 4.14Å; Y867-L905 HydrophobicContact CE1-CG 4.43Å; Y867-L905 HydrophobicContact CE2-CD1 3.63Å; Y867-L905 HydrophobicContact CE2-CD2 3.69Å; Y867-L905 HydrophobicContact CE2-CG 3.54Å; Y867-L905 HydrophobicContact CG-CD1 4.38Å; A901-L905 WeakPolarHBondContact O-CB 3.43Å; A901-L905 PolarHBondContact O-N 3.44Å; L905-G907 PolarHBondContact O-N 3.27Å; L905-Y908 HydrophobicContact CD2-CD2 4.39Å; L905-Y908 HydrophobicContact CD2-CG 4.16Å; L905-Y908 WeakPolarHBondContact O-CB 3.39Å; L905-Y908 PolarHBondContact O-N 3.15Å; L905-L917 HydrophobicContact CB-CD1 4.22Å; L905-L917 HydrophobicContact CB-CD2 3.88Å
906	N	91.5	Very high	90.8	Very high	88 Å²	88	66.1 Å²	66.1	47%	0.471	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	120.9	175.2	-166.7	32.9	0	0	0	109.8	L902 L915 V916 L917	L902-N906 WeakPolarHBondContact O-CB 3.43Å; L902-N906 PolarHBondContact O-N 3.31Å; N906-L915 PolarHBondContact OD1-O 2.98Å; N906-V916 WeakPolarHBondContact OD1-CA 3.28Å; N906-L917 HydrophobicContact CB-CB 4.38Å; N906-L917 PolarHBondContact OD1-N 3.48Å
907	G	89.2	Confident	91	Very high	44 Å²	44	59.5 Å²	59.5	45%	0.454	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	-9.1	-170.5	0	0	0	0	0	115.6	L905 R909 L915	L905-G907 PolarHBondContact O-N 3.27Å; G907-R909 PolarHBondContact O-N 3.42Å; G907-L915 PolarHBondContact N-O 2.9Å
908	Y	90.8	Very high	91.1	Very high	118 Å²	118	61.9 Å²	61.9	46%	0.463	33%	0.327	S	S	.	.			trans	-61	135.1	176.7	-175.9	-91.8	0	0	0	110.8	I863 L905 V910 P914 L915	I863-Y908 HydrophobicContact CD1-CE1 4.47Å; I863-Y908 HydrophobicContact CG1-CE1 4.32Å; I863-Y908 HydrophobicContact CG2-CD1 4.05Å; I863-Y908 HydrophobicContact CG2-CE1 3.9Å; L905-Y908 HydrophobicContact CD2-CD2 4.39Å; L905-Y908 HydrophobicContact CD2-CG 4.16Å; L905-Y908 WeakPolarHBondContact O-CB 3.39Å; L905-Y908 PolarHBondContact O-N 3.15Å; Y908-V910 HydrophobicContact CD1-CG2 3.94Å; Y908-V910 HydrophobicContact CE1-CG2 4.1Å; Y908-P914 CarbonylContact O-C 3.55Å; Y908-P914 WeakPolarHBondContact O-CA 3Å; Y908-L915 HydrophobicContact CD1-CD1 4.32Å; Y908-L915 WeakPolarHBondContact O-CG 3.25Å; Y908-L915 PolarHBondContact O-N 2.94Å
909	R	88.9	Confident	91.1	Very high	171 Å²	171	65 Å²	65	65%	0.645	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	120.1	-173.1	-70.1	-173.6	-178.4	-101.4	5.2	112.7	G907 G912 R913 P914	G907-R909 PolarHBondContact O-N 3.42Å; R909-G912 PolarHBondContact NH1-O 2.71Å; R909-R913 CarbonylContact C-O 3.55Å; R909-R913 WeakPolarHBondContact CA-O 3.24Å; R909-P914 HydrophobicContact CG-CB 4.42Å
910	V	86	Confident	90.8	Very high	16 Å²	16	64.1 Å²	64.1	10%	0.097	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.9	171.7	-169.9	0	0	0	0	108.4	P852 I863 Y908 G912 R913 L915	P852-V910 HydrophobicContact CG-CB 4.16Å; P852-V910 HydrophobicContact CG-CG1 3.98Å; P852-V910 WeakPolarHBondContact CG-O 3.44Å; I863-V910 HydrophobicContact CD1-CG1 4.06Å; I863-V910 HydrophobicContact CD1-CG2 3.55Å; Y908-V910 HydrophobicContact CD1-CG2 3.94Å; Y908-V910 HydrophobicContact CE1-CG2 4.1Å; V910-G912 PolarHBondContact O-N 3.25Å; V910-G912 VanDerWaalsContact O-N 3.14Å; V910-R913 PolarHBondContact N-O 2.95Å; V910-R913 PolarHBondContact O-N 2.84Å; V910-L915 HydrophobicContact CB-CD2 4.39Å; V910-L915 HydrophobicContact CG2-CD1 3.86Å; V910-L915 HydrophobicContact CG2-CD2 3.8Å; V910-L915 HydrophobicContact CG2-CG 3.83Å
911	A	84.5	Confident	89.7	Confident	93 Å²	93	67.1 Å²	67.1	77%	0.769	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	42.3	-172.6	0	0	0	0	0	113.2	P852 R913	P852-A911 HydrophobicContact CB-CB 4.32Å; P852-A911 HydrophobicContact CG-CB 3.85Å; A911-R913 VanDerWaalsContact C-N 3.29Å; A911-R913 PolarHBondContact O-N 3.3Å
912	G	84.2	Confident	88.2	Confident	50 Å²	50	75.7 Å²	75.7	52%	0.515	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	-18.3	-178.5	0	0	0	0	0	116	R909 V910	R909-G912 PolarHBondContact NH1-O 2.71Å; V910-G912 PolarHBondContact O-N 3.25Å; V910-G912 VanDerWaalsContact O-N 3.14Å
913	R	87.9	Confident	85.5	Confident	110 Å²	110	86.7 Å²	86.7	42%	0.415	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	126.6	-178.9	-59.3	-179.4	74.5	144.4	0.1	111	N850 R909 V910 A911	N850-R913 VanDerWaalsContact OD1-CZ 3.29Å; N850-R913 PolarHBondContact OD1-NE 3.4Å; N850-R913 PolarHBondContact OD1-NH2 3.37Å; R909-R913 CarbonylContact C-O 3.55Å; R909-R913 WeakPolarHBondContact CA-O 3.24Å; V910-R913 PolarHBondContact N-O 2.95Å; V910-R913 PolarHBondContact O-N 2.84Å; A911-R913 VanDerWaalsContact C-N 3.29Å; A911-R913 PolarHBondContact O-N 3.3Å
914	P	91.7	Very high	85.2	Confident	46 Å²	46	81.4 Å²	81.4	30%	0.299	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	127.3	175.8	29.4	-33.1	0	0	0	110.7	N850 Y908 R909	N850-P914 WeakPolarHBondContact CB-O 3.42Å; N850-P914 PolarHBondContact ND2-O 3.38Å; Y908-P914 CarbonylContact O-C 3.55Å; Y908-P914 WeakPolarHBondContact O-CA 3Å; R909-P914 HydrophobicContact CG-CB 4.42Å
915	L	93.9	Very high	84.9	Confident	1 Å²	1	83.7 Å²	83.7	1%	0.005	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-65.2	142.1	174.2	-60.4	-178.2	0	0	0	110.6	V848 L851 N906 G907 Y908 V910 L917	V848-L915 HydrophobicContact CG1-CD2 4.45Å; L851-L915 HydrophobicContact CD2-CD2 3.52Å; L851-L915 HydrophobicContact CG-CD2 4.2Å; N906-L915 PolarHBondContact OD1-O 2.98Å; G907-L915 PolarHBondContact N-O 2.9Å; Y908-L915 HydrophobicContact CD1-CD1 4.32Å; Y908-L915 WeakPolarHBondContact O-CG 3.25Å; Y908-L915 PolarHBondContact O-N 2.94Å; V910-L915 HydrophobicContact CB-CD2 4.39Å; V910-L915 HydrophobicContact CG2-CD1 3.86Å; V910-L915 HydrophobicContact CG2-CD2 3.8Å; V910-L915 HydrophobicContact CG2-CG 3.83Å; L915-L917 HydrophobicContact CB-CD1 3.63Å; L915-L917 HydrophobicContact CD1-CD1 4.44Å
916	V	93.2	Very high	84.5	Confident	71 Å²	71	88.1 Å²	88.1	43%	0.43	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	112.1	174.9	179.3	0	0	0	0	108.2	G849 N850 N906	G849-V916 PolarHBondContact N-O 3.48Å; G849-V916 PolarHBondContact O-N 3.27Å; N850-V916 HydrophobicContact CB-CG2 4.23Å; N906-V916 WeakPolarHBondContact OD1-CA 3.28Å
917	L	95	Very high	84	Confident	8 Å²	8	88.1 Å²	88.1	4%	0.042	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	137.2	179.8	-74.7	72.4	0	0	0	110.9	V846 F847 V848 M864 L902 L905 N906 L915	V846-L917 HydrophobicContact CG1-CB 4.16Å; V846-L917 HydrophobicContact CG1-CD2 4.15Å; V846-L917 HydrophobicContact CG1-CG 4.3Å; F847-L917 VanDerWaalsContact O-CA 3.31Å; F847-L917 WeakPolarHBondContact O-CA 3.43Å; V848-L917 HydrophobicContact CG1-CD1 4.06Å; V848-L917 HydrophobicContact CG1-CG 4.31Å; V848-L917 HydrophobicContact CG2-CG 4.31Å; M864-L917 HydrophobicContact CE-CD2 3.95Å; L902-L917 HydrophobicContact CD2-CB 3.57Å; L902-L917 VanDerWaalsContact CD2-O 3.25Å; L902-L917 WeakPolarHBondContact CD2-O 3.5Å; L902-L917 HydrophobicContact CG-CB 4.48Å; L905-L917 HydrophobicContact CB-CD1 4.22Å; L905-L917 HydrophobicContact CB-CD2 3.88Å; N906-L917 HydrophobicContact CB-CB 4.38Å; N906-L917 PolarHBondContact OD1-N 3.48Å; L915-L917 HydrophobicContact CB-CD1 3.63Å; L915-L917 HydrophobicContact CD1-CD1 4.44Å
918	H	92.9	Very high	83.7	Confident	85 Å²	85	90.9 Å²	90.9	39%	0.394	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	158.9	166.5	63.7	77.6	0	0	0	110.7	V846 F847 L902 D920	V846-H918 WeakPolarHBondContact CG1-O 3.47Å; F847-H918 AromaticContact CD1-CD2 3.61Å; F847-H918 AromaticContact CD1-CE1 3.64Å; F847-H918 AromaticContact CD1-NE2 3.13Å; F847-H918 WeakPolarHBondContact CD1-NE2 3.45Å; F847-H918 AromaticContact CE1-NE2 3.64Å; F847-H918 AromaticContact CG-CE1 3.65Å; F847-H918 AromaticContact CG-NE2 3.65Å; F847-H918 PolarHBondContact N-O 3.19Å; F847-H918 PolarHBondContact O-N 2.99Å; F847-H918 VanDerWaalsContact O-N 3.16Å; L902-H918 VanDerWaalsContact CD2-CA 3.41Å; H918-D920 PolarHBondContact O-N 2.98Å
919	F	92.6	Very high	83.3	Confident	66 Å²	66	89.1 Å²	89.1	29%	0.289	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	137.3	169.5	-68.5	-73.5	0	0	0	110.2	V844 V846 A898 D899 L902 H921	V844-F919 HydrophobicContact CG1-CD1 3.54Å; V844-F919 HydrophobicContact CG1-CE1 3.57Å; V846-F919 HydrophobicContact CG2-CD1 4.42Å; A898-F919 HydrophobicContact CB-CD1 4.35Å; A898-F919 HydrophobicContact CB-CE1 3.59Å; A898-F919 HydrophobicContact CB-CZ 4.41Å; D899-F919 HydrophobicContact CB-CZ 4.32Å; L902-F919 HydrophobicContact CD1-CD1 3.97Å; L902-F919 HydrophobicContact CD1-CD2 3.63Å; L902-F919 HydrophobicContact CD1-CE1 3.7Å; L902-F919 HydrophobicContact CD1-CE2 3.32Å; L902-F919 HydrophobicContact CD1-CG 3.94Å; L902-F919 HydrophobicContact CD1-CZ 3.37Å; F919-H921 VanDerWaalsContact CB-CE1 3.43Å; F919-H921 WeakPolarHBondContact CB-CE1 3.47Å
920	D	87.3	Confident	82.8	Confident	30 Å²	30	83.2 Å²	83.2	16%	0.16	42%	0.423	C	S	.	.			trans	-82.7	139.8	167.5	-163.5	7.2	0	0	0	109.4	T845 F847 L889 H918 R922	T845-D920 HydrophobicContact CG2-CB 3.99Å; T845-D920 PolarHBondContact O-N 3.12Å; F847-D920 HydrophobicContact CB-CB 4.46Å; L889-D920 HydrophobicContact CD2-CB 4.29Å; L889-D920 WeakPolarHBondContact CD2-OD2 3.4Å; H918-D920 PolarHBondContact O-N 2.98Å; D920-R922 VanDerWaalsContact OD1-CG 3.3Å; D920-R922 WeakPolarHBondContact OD1-CG 3.35Å; D920-R922 PolarHBondContact OD1-N 2.72Å; D920-R922 IonicContact OD1-NE 2.69Å
921	H	71.3	Confident	82.6	Confident	156 Å²	156	88.4 Å²	88.4	72%	0.722	45%	0.448	S	S	*	.			trans	-125.2	10.9	-176	-69.4	-13.4	0	0	0	112.3	F919 K923	F919-H921 VanDerWaalsContact CB-CE1 3.43Å; F919-H921 WeakPolarHBondContact CB-CE1 3.47Å; H921-K923 PolarHBondContact O-N 3.41Å
922	R	61.9	Low	82.4	Confident	179 Å²	179	88 Å²	88	68%	0.675	42%	0.421	S	S	*	.			trans	-74.4	105.9	172.5	-61.9	170.8	-157.3	-155.8	7.2	108.8	D920	D920-R922 VanDerWaalsContact OD1-CG 3.3Å; D920-R922 WeakPolarHBondContact OD1-CG 3.35Å; D920-R922 PolarHBondContact OD1-N 2.72Å; D920-R922 IonicContact OD1-NE 2.69Å
923	K	37.5	Very low	82.3	Confident	254 Å²	254	91.5 Å²	91.5	100%	1.104	41%	0.412	S	S	*	.			trans	-91.2	0	175.1	-77.9	-175.8	175.4	173.6	0	112.2	H921	H921-K923 PolarHBondContact O-N 3.41Å

Retrieved 923 of 923 residues in 284 ms (Link to these results)

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