A0A5K4FCW7_SCHMA Loading...

Methyltransferase-like protein 17, mitochondrial AlphaSync

Mitochondrial ribosome (mitoribosome) assembly factor. Binds at the interface of the head and body domains of the mitochondrial small ribosomal subunit (mt-SSU), occluding the mRNA channel and preventing compaction of the head domain towards the body. Probable inactive methyltransferase: retains the characteristic folding and ability to bind S-adenosyl-L-methionine, but it probably lost its methyltransferase activity.

AlphaFold DB , UniProt , Accession A0A5K4FCW7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 487 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	A	31.1	Very low	46.8	Very low	155 Å²	155	117.3 Å²	117.3	100%	1.281	68%	0.682	S	S	*	*				0	105.7	0	0	0	0	0	0	109.3
2	S	34.1	Very low	49.5	Very low	115 Å²	115	111.7 Å²	111.7	80%	0.804	67%	0.668	S	S	*	*			trans	179.4	76.3	151.8	58.7	0	0	0	0	105.7	G4	S2-G4 PolarHBondContact O-N 3.26Å
3	R	34	Very low	52.2	Low	252 Å²	252	113.4 Å²	113.4	95%	0.951	66%	0.656	S	S	*	*			trans	-52.9	114.7	161.3	-84.2	178.8	168.1	172.5	-4.1	105	K5	R3-K5 PolarHBondContact O-N 2.99Å
4	G	34.8	Very low	54.8	Low	64 Å²	64	108.1 Å²	108.1	66%	0.66	62%	0.624	S	S	*	*			trans	-47.1	130.9	-176.6	0	0	0	0	0	108.6	S2 T6	S2-G4 PolarHBondContact O-N 3.26Å; G4-T6 PolarHBondContact O-N 2.68Å
5	K	32.6	Very low	57.3	Low	206 Å²	206	102.2 Å²	102.2	90%	0.896	59%	0.589	S	S	*	*			trans	-43.1	106.6	174.4	-73.3	177.4	176.2	178.3	0	107.1	R3 V7	R3-K5 PolarHBondContact O-N 2.99Å; K5-V7 PolarHBondContact O-N 3.42Å; K5-V7 VanDerWaalsContact O-N 3.14Å
6	T	36.2	Very low	59.4	Low	124 Å²	124	96.8 Å²	96.8	76%	0.761	56%	0.557	S	S	*	*			trans	-49.8	123.2	169.4	22.4	0	0	0	0	105.5	G4 V8	G4-T6 PolarHBondContact O-N 2.68Å; T6-V8 PolarHBondContact O-N 3.29Å
7	V	42.5	Very low	61.3	Low	106 Å²	106	91.1 Å²	91.1	64%	0.642	52%	0.524	S	S	*	.			trans	-49.1	113	169.9	175.7	0	0	0	0	105.1	K5 D9	K5-V7 PolarHBondContact O-N 3.42Å; K5-V7 VanDerWaalsContact O-N 3.14Å; V7-D9 PolarHBondContact O-N 2.91Å
8	V	50.6	Low	62.9	Low	86 Å²	86	87.4 Å²	87.4	52%	0.521	51%	0.505	S	S	.	.			trans	-60.5	113.9	-177.2	177.2	0	0	0	0	105.5	T6 F10	T6-V8 PolarHBondContact O-N 3.29Å; V8-F10 PolarHBondContact O-N 3.19Å
9	D	71.2	Confident	64.4	Low	99 Å²	99	87.3 Å²	87.3	53%	0.529	50%	0.502	S	S	.	.			trans	-62.2	108.1	173.7	-173.7	-10.7	0	0	0	107.4	V7 T11 G12	V7-D9 PolarHBondContact O-N 2.91Å; D9-T11 PolarHBondContact O-N 2.98Å; D9-T11 VanDerWaalsContact O-N 3.1Å; D9-T11 WeakPolarHBondContact OD1-CB 3.47Å; D9-T11 WeakPolarHBondContact OD1-CG2 3.32Å; D9-T11 PolarHBondContact OD1-N 3.49Å; D9-T11 PolarHBondContact OD1-OG1 3.4Å; D9-T11 PolarHBondContact OD2-OG1 3.24Å; D9-T11 VanDerWaalsContact OD2-OG1 3.08Å; D9-G12 PolarHBondContact O-N 2.93Å
10	F	73.1	Confident	65.7	Low	28 Å²	28	84.3 Å²	84.3	12%	0.123	48%	0.482	C	S	.	.	G	3₁₀ helix	trans	-61	-20.7	-177.9	68.4	-90.4	0	0	0	111.8	V8 G12 R13 D424 V432	V8-F10 PolarHBondContact O-N 3.19Å; F10-G12 PolarHBondContact O-N 3.14Å; F10-R13 PolarHBondContact O-N 2.89Å; F10-D424 HydrophobicContact CE2-CB 4Å; F10-V432 HydrophobicContact CB-CB 4.42Å; F10-V432 WeakPolarHBondContact CB-O 3.32Å; F10-V432 HydrophobicContact CD1-CB 4.06Å; F10-V432 HydrophobicContact CD1-CG1 4.13Å; F10-V432 HydrophobicContact CD2-CB 4.29Å; F10-V432 HydrophobicContact CD2-CG1 3.65Å; F10-V432 HydrophobicContact CE1-CB 4.45Å; F10-V432 HydrophobicContact CE1-CG1 4.2Å; F10-V432 HydrophobicContact CE2-CG1 3.74Å; F10-V432 HydrophobicContact CG-CB 3.99Å; F10-V432 HydrophobicContact CG-CG1 3.87Å; F10-V432 HydrophobicContact CZ-CG1 4.02Å
11	T	75	Confident	67	Low	55 Å²	55	80.6 Å²	80.6	34%	0.337	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-71.1	-20.2	178.6	69.8	0	0	0	0	113	D9 R13	D9-T11 PolarHBondContact O-N 2.98Å; D9-T11 VanDerWaalsContact O-N 3.1Å; D9-T11 WeakPolarHBondContact OD1-CB 3.47Å; D9-T11 WeakPolarHBondContact OD1-CG2 3.32Å; D9-T11 PolarHBondContact OD1-N 3.49Å; D9-T11 PolarHBondContact OD1-OG1 3.4Å; D9-T11 PolarHBondContact OD2-OG1 3.24Å; D9-T11 VanDerWaalsContact OD2-OG1 3.08Å; T11-R13 VanDerWaalsContact C-N 3.32Å; T11-R13 PolarHBondContact O-N 2.8Å
12	G	78.6	Confident	69.8	Low	50 Å²	50	80.1 Å²	80.1	52%	0.515	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-81.6	-2	178.9	0	0	0	0	0	114.9	D9 F10 C475	D9-G12 PolarHBondContact O-N 2.93Å; F10-G12 PolarHBondContact O-N 3.14Å; G12-C475 PolarHBondContact O-SG 3.13Å
13	R	84.7	Confident	72.4	Confident	134 Å²	134	75.1 Å²	75.1	51%	0.506	39%	0.39	S	S	.	.			trans	-127.6	127.8	178.1	-63.9	-177.5	-174.6	178.5	0.3	110.2	F10 T11	F10-R13 PolarHBondContact O-N 2.89Å; T11-R13 VanDerWaalsContact C-N 3.32Å; T11-R13 PolarHBondContact O-N 2.8Å
14	L	89.3	Confident	74.9	Confident	39 Å²	39	63.7 Å²	63.7	20%	0.204	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.2	174.6	-172	63.8	0	0	0	110.2	I422 R434 L436 I473	L14-I422 HydrophobicContact CD1-CG2 4.44Å; L14-R434 HydrophobicContact CD1-CG 3.73Å; L14-L436 HydrophobicContact CD1-CB 3.99Å; L14-L436 HydrophobicContact CD2-CB 4.21Å; L14-L436 HydrophobicContact CD2-CD2 4.36Å; L14-L436 HydrophobicContact CG-CB 4.18Å; L14-I473 HydrophobicContact CD2-CD1 4.22Å; L14-I473 HydrophobicContact CG-CD1 4.27Å; L14-I473 PolarHBondContact O-N 2.9Å
15	I	91.6	Very high	77.4	Confident	20 Å²	20	66.9 Å²	66.9	10%	0.103	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	138.7	-179.3	-58.1	-172.2	0	0	0	109.9	G17 R20 E433 R434 V435 L436 H471	I15-G17 PolarHBondContact O-N 3.39Å; I15-R20 HydrophobicContact CG2-CB 3.8Å; I15-R20 HydrophobicContact CG2-CG 4.02Å; I15-E433 HydrophobicContact CD1-CB 3.61Å; I15-E433 HydrophobicContact CD1-CG 4.26Å; I15-R434 PolarHBondContact N-O 3.06Å; I15-V435 HydrophobicContact CB-CG2 4.28Å; I15-V435 WeakPolarHBondContact O-CA 3.3Å; I15-L436 PolarHBondContact O-N 3.19Å; I15-H471 WeakPolarHBondContact CA-O 3.45Å; I15-H471 HydrophobicContact CG2-CB 3.72Å
16	N	91.4	Very high	79.8	Confident	15 Å²	15	60.4 Å²	60.4	8%	0.08	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	108.3	169.7	-169	-7.9	0	0	0	110.8	S18 L19 R20 P438 Q441 H471 I473	N16-S18 VanDerWaalsContact C-N 3.29Å; N16-S18 PolarHBondContact ND2-OG 3.41Å; N16-S18 PolarHBondContact O-N 3.09Å; N16-S18 PolarHBondContact OD1-N 3.2Å; N16-S18 PolarHBondContact OD1-OG 2.87Å; N16-L19 HydrophobicContact CB-CD1 4.22Å; N16-L19 HydrophobicContact CB-CG 4.37Å; N16-L19 PolarHBondContact O-N 3.34Å; N16-R20 WeakPolarHBondContact O-CB 3.5Å; N16-R20 PolarHBondContact O-N 3.36Å; N16-R20 VanDerWaalsContact O-N 3.16Å; N16-P438 VanDerWaalsContact OD1-CD 3.28Å; N16-P438 WeakPolarHBondContact OD1-CD 3.46Å; N16-P438 WeakPolarHBondContact OD1-CG 3.08Å; N16-Q441 PolarHBondContact ND2-OE1 3.06Å; N16-H471 PolarHBondContact N-O 3.39Å; N16-I473 HydrophobicContact CB-CD1 4.05Å; N16-I473 HydrophobicContact CB-CG1 3.96Å
17	G	92.1	Very high	82.2	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.4	-29.1	-177.6	0	0	0	0	0	114.2	I15 L19 R20 Y21 L436	I15-G17 PolarHBondContact O-N 3.39Å; G17-L19 PolarHBondContact O-N 3.18Å; G17-R20 PolarHBondContact O-N 3.16Å; G17-Y21 WeakPolarHBondContact O-CB 3.14Å; G17-Y21 PolarHBondContact O-N 2.93Å; G17-L436 WeakPolarHBondContact CA-O 3.45Å; G17-L436 PolarHBondContact N-O 3.2Å
18	S	89.9	Confident	84.3	Confident	26 Å²	26	53.2 Å²	53.2	18%	0.182	27%	0.274	C	S	.	.	H	α-helix	trans	-67.2	-26.9	178.2	63.1	0	0	0	0	113.3	N16 Q441	N16-S18 VanDerWaalsContact C-N 3.29Å; N16-S18 PolarHBondContact ND2-OG 3.41Å; N16-S18 PolarHBondContact O-N 3.09Å; N16-S18 PolarHBondContact OD1-N 3.2Å; N16-S18 PolarHBondContact OD1-OG 2.87Å; S18-Q441 VanDerWaalsContact CB-O 3.28Å; S18-Q441 WeakPolarHBondContact CB-O 3.42Å; S18-Q441 WeakPolarHBondContact OG-CB 3.48Å; S18-Q441 PolarHBondContact OG-OE1 2.67Å
19	L	90.2	Very high	86	Confident	85 Å²	85	52.6 Å²	52.6	45%	0.445	27%	0.274	S	S	.	.	H	α-helix	trans	-91.7	-30.7	178	-57.2	178.1	0	0	0	111.4	N16 G17 H471	N16-L19 HydrophobicContact CB-CD1 4.22Å; N16-L19 HydrophobicContact CB-CG 4.37Å; N16-L19 PolarHBondContact O-N 3.34Å; G17-L19 PolarHBondContact O-N 3.18Å; L19-H471 WeakPolarHBondContact CB-ND1 3.48Å; L19-H471 PolarHBondContact O-CE1 3.44Å
20	R	91.1	Very high	86.6	Confident	27 Å²	27	49.3 Å²	49.3	10%	0.102	26%	0.258	C	S	.	.	H	α-helix	trans	-83.7	-31.5	-175.9	-179	57.6	165.7	-174	-14.2	113.7	I15 N16 G17 E433 V464	I15-R20 HydrophobicContact CG2-CB 3.8Å; I15-R20 HydrophobicContact CG2-CG 4.02Å; N16-R20 WeakPolarHBondContact O-CB 3.5Å; N16-R20 PolarHBondContact O-N 3.36Å; N16-R20 VanDerWaalsContact O-N 3.16Å; G17-R20 PolarHBondContact O-N 3.16Å; R20-E433 IonicContact CZ-OE2 3.58Å; R20-E433 IonicContact NE-OE1 3.41Å; R20-E433 PolarHBondContact NE-OE1 3.35Å; R20-E433 IonicContact NE-OE2 3.34Å; R20-E433 PolarHBondContact NE-OE2 3.24Å; R20-E433 IonicContact NH2-OE2 3.36Å; R20-E433 PolarHBondContact NH2-OE2 2.87Å; R20-V464 PolarHBondContact NH1-O 3.19Å; R20-V464 PolarHBondContact O-N 3.39Å
21	Y	93.1	Very high	87.1	Confident	6 Å²	6	49 Å²	49	2%	0.024	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123.7	-171.9	-65.7	-87.4	0	0	0	111.4	G17 P408 I425 E433 V435 F437 V459 A461 E462 V463	G17-Y21 WeakPolarHBondContact O-CB 3.14Å; G17-Y21 PolarHBondContact O-N 2.93Å; Y21-P408 HydrophobicContact CE1-CG 4.08Å; Y21-I425 HydrophobicContact CE1-CD1 4.34Å; Y21-I425 HydrophobicContact CE2-CD1 4.01Å; Y21-I425 WeakPolarHBondContact OH-CD1 3.47Å; Y21-I425 WeakPolarHBondContact OH-CG2 3.38Å; Y21-E433 WeakPolarHBondContact CE2-OE1 3.49Å; Y21-E433 VanDerWaalsContact CZ-OE1 3.3Å; Y21-E433 PolarHBondContact OH-OE1 2.87Å; Y21-V435 HydrophobicContact CD2-CG1 4.13Å; Y21-V435 HydrophobicContact CE2-CB 4.38Å; Y21-V435 HydrophobicContact CE2-CG1 3.74Å; Y21-V435 HydrophobicContact CE2-CG2 3.93Å; Y21-F437 AromaticContact CD2-CE1 3.94Å; Y21-F437 HydrophobicContact CD2-CE1 3.94Å; Y21-F437 AromaticContact CD2-CZ 3.81Å; Y21-F437 HydrophobicContact CD2-CZ 3.81Å; Y21-F437 HydrophobicContact CE2-CZ 4.2Å; Y21-F437 HydrophobicContact CG-CE1 4.25Å; Y21-F437 HydrophobicContact CG-CZ 4.3Å; Y21-V459 HydrophobicContact CD1-CG1 3.88Å; Y21-V459 HydrophobicContact CE1-CG1 4.02Å; Y21-A461 HydrophobicContact CD1-CB 4.05Å; Y21-A461 HydrophobicContact CG-CB 4.41Å; Y21-E462 WeakPolarHBondContact CA-O 3.3Å; Y21-V463 HydrophobicContact CE1-CG2 4.18Å
22	R	90.3	Very high	87.2	Confident	146 Å²	146	50.4 Å²	50.4	55%	0.551	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.4	172.1	-173.4	-176.4	-65.6	128.9	-1.2	110	S24 A461 E462 V464	R22-S24 PolarHBondContact O-N 3.37Å; R22-A461 CarbonylContact O-C 3.47Å; R22-A461 WeakPolarHBondContact O-CA 3.5Å; R22-A461 WeakPolarHBondContact O-CB 3.48Å; R22-E462 PolarHBondContact N-O 3.41Å; R22-E462 PolarHBondContact O-N 2.99Å; R22-V464 HydrophobicContact CB-CG2 4.13Å
23	T	88.5	Confident	86.9	Confident	10 Å²	10	52.2 Å²	52.2	6%	0.061	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.3	133	176.1	-50.3	0	0	0	0	111.4	L27 Q28 D443 C445 L446	T23-L27 HydrophobicContact CG2-CB 3.88Å; T23-L27 HydrophobicContact CG2-CD2 3.63Å; T23-L27 HydrophobicContact CG2-CG 4.09Å; T23-Q28 HydrophobicContact CG2-CG 3.71Å; T23-D443 WeakPolarHBondContact CG2-OD1 3.35Å; T23-D443 WeakPolarHBondContact OG1-CB 3.36Å; T23-D443 PolarHBondContact OG1-OD1 3.24Å; T23-C445 HydrophobicContact CG2-CB 4.4Å; T23-L446 HydrophobicContact CG2-CB 4.27Å; T23-L446 VanDerWaalsContact OG1-CB 3.32Å; T23-L446 WeakPolarHBondContact OG1-CB 3.5Å
24	S	86.9	Confident	86.1	Confident	12 Å²	12	50.8 Å²	50.8	8%	0.084	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-69.7	149.4	172.5	56.3	0	0	0	0	112.5	R22 E26 L27 Q28 P460	R22-S24 PolarHBondContact O-N 3.37Å; S24-E26 PolarHBondContact O-N 3.1Å; S24-L27 PolarHBondContact O-N 3.11Å; S24-L27 VanDerWaalsContact O-N 3.11Å; S24-L27 WeakPolarHBondContact OG-CB 3.32Å; S24-L27 PolarHBondContact OG-N 2.98Å; S24-Q28 PolarHBondContact O-N 3.36Å; S24-P460 VanDerWaalsContact CB-O 3.29Å; S24-P460 WeakPolarHBondContact CB-O 3.28Å; S24-P460 PolarHBondContact N-O 2.98Å; S24-P460 PolarHBondContact OG-O 2.98Å
25	D	86.1	Confident	85.1	Confident	130 Å²	130	50.2 Å²	50.2	70%	0.695	28%	0.276	S	S	*	.	H	α-helix	trans	-57.9	-35	175.2	-63.5	-21.8	0	0	0	111.9	Q28 S29	D25-Q28 PolarHBondContact O-N 3.48Å; D25-S29 WeakPolarHBondContact O-CB 3.46Å; D25-S29 PolarHBondContact O-N 3.47Å; D25-S29 PolarHBondContact O-OG 3.06Å
26	E	84.1	Confident	83.8	Confident	70 Å²	70	52.4 Å²	52.4	33%	0.327	29%	0.292	S	S	.	.	H	α-helix	trans	-61.8	-45.9	176.1	-173	-176.1	-179	0	0	111.3	S24 S29 T30 L60 P61	S24-E26 PolarHBondContact O-N 3.1Å; E26-S29 PolarHBondContact O-N 2.84Å; E26-S29 PolarHBondContact O-OG 3.33Å; E26-T30 WeakPolarHBondContact O-CB 3.19Å; E26-T30 PolarHBondContact O-N 2.69Å; E26-T30 PolarHBondContact O-OG1 2.94Å; E26-L60 HydrophobicContact CG-CD2 4.48Å; E26-P61 WeakPolarHBondContact OE1-CD 3.16Å
27	L	86.8	Confident	82.1	Confident	1 Å²	1	61 Å²	61	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-64.5	-44	177.3	-169.6	68.9	0	0	0	110.5	T23 S24 S29 T30 F31 L60 C445 L446 Y449 P460	T23-L27 HydrophobicContact CG2-CB 3.88Å; T23-L27 HydrophobicContact CG2-CD2 3.63Å; T23-L27 HydrophobicContact CG2-CG 4.09Å; S24-L27 PolarHBondContact O-N 3.11Å; S24-L27 VanDerWaalsContact O-N 3.11Å; S24-L27 WeakPolarHBondContact OG-CB 3.32Å; S24-L27 PolarHBondContact OG-N 2.98Å; L27-S29 PolarHBondContact O-N 3.32Å; L27-T30 PolarHBondContact O-N 2.9Å; L27-F31 HydrophobicContact CD1-CD2 3.87Å; L27-F31 HydrophobicContact CD1-CE2 3.64Å; L27-F31 HydrophobicContact CG-CD2 4.19Å; L27-F31 HydrophobicContact CG-CE2 4.41Å; L27-F31 VanDerWaalsContact O-CD2 3.31Å; L27-F31 WeakPolarHBondContact O-CD2 3.43Å; L27-F31 PolarHBondContact O-N 2.92Å; L27-F31 VanDerWaalsContact O-N 3.17Å; L27-L60 HydrophobicContact CD1-CD1 3.52Å; L27-C445 HydrophobicContact CD2-CB 4.29Å; L27-C445 HydrophobicContact CG-CB 4.15Å; L27-L446 HydrophobicContact CD2-CB 4.26Å; L27-L446 HydrophobicContact CD2-CD1 4.35Å; L27-Y449 HydrophobicContact CD1-CD2 3.96Å; L27-Y449 HydrophobicContact CD1-CG 4.43Å; L27-P460 HydrophobicContact CD1-CG 4.2Å; L27-P460 HydrophobicContact CD2-CB 4.38Å; L27-P460 HydrophobicContact CD2-CG 3.73Å; L27-P460 HydrophobicContact CG-CG 4.44Å
28	Q	86.7	Confident	80.2	Confident	79 Å²	79	66.8 Å²	66.8	37%	0.369	36%	0.362	S	S	.	.	H	α-helix	trans	-59.4	-46.5	175.7	-68.8	-176	-9.4	0	0	111.6	T23 S24 D25 T30 F31 S32	T23-Q28 HydrophobicContact CG2-CG 3.71Å; S24-Q28 PolarHBondContact O-N 3.36Å; D25-Q28 PolarHBondContact O-N 3.48Å; Q28-T30 VanDerWaalsContact C-N 3.32Å; Q28-T30 PolarHBondContact O-N 3.48Å; Q28-F31 CarbonylContact O-C 3.56Å; Q28-F31 PolarHBondContact O-N 3.19Å; Q28-F31 VanDerWaalsContact O-N 3.1Å; Q28-S32 WeakPolarHBondContact O-CB 3.39Å; Q28-S32 PolarHBondContact O-N 3.02Å; Q28-S32 PolarHBondContact O-OG 2.69Å
29	S	85.9	Confident	78.3	Confident	73 Å²	73	67.7 Å²	67.7	51%	0.51	37%	0.369	S	S	.	.	H	α-helix	trans	-60.6	-41.1	-179.8	75	0	0	0	0	112.4	D25 E26 L27 F31 S32	D25-S29 WeakPolarHBondContact O-CB 3.46Å; D25-S29 PolarHBondContact O-N 3.47Å; D25-S29 PolarHBondContact O-OG 3.06Å; E26-S29 PolarHBondContact O-N 2.84Å; E26-S29 PolarHBondContact O-OG 3.33Å; L27-S29 PolarHBondContact O-N 3.32Å; S29-F31 PolarHBondContact O-N 3.21Å; S29-S32 PolarHBondContact O-N 3.49Å
30	T	83.8	Confident	76.2	Confident	30 Å²	30	75 Å²	75	18%	0.184	39%	0.391	C	S	.	.	H	α-helix	trans	-62.2	-35.1	177.5	-59.3	0	0	0	0	111.6	E26 L27 Q28 R56 L60	E26-T30 WeakPolarHBondContact O-CB 3.19Å; E26-T30 PolarHBondContact O-N 2.69Å; E26-T30 PolarHBondContact O-OG1 2.94Å; L27-T30 PolarHBondContact O-N 2.9Å; Q28-T30 VanDerWaalsContact C-N 3.32Å; Q28-T30 PolarHBondContact O-N 3.48Å; T30-R56 HydrophobicContact CG2-CB 3.81Å; T30-R56 WeakPolarHBondContact O-CD 3.44Å; T30-R56 PolarHBondContact O-NH1 2.97Å; T30-L60 HydrophobicContact CG2-CD2 4.02Å; T30-L60 HydrophobicContact CG2-CG 4.29Å; T30-L60 WeakPolarHBondContact OG1-CD2 2.92Å
31	F	82.4	Confident	73.8	Confident	20 Å²	20	81.5 Å²	81.5	9%	0.088	42%	0.419	C	S	.	.	H	α-helix	trans	-99.6	5.2	-178.2	-71.6	-85.8	0	0	0	115.1	L27 Q28 S29 W53 L57 L60 C445 Y448	L27-F31 HydrophobicContact CD1-CD2 3.87Å; L27-F31 HydrophobicContact CD1-CE2 3.64Å; L27-F31 HydrophobicContact CG-CD2 4.19Å; L27-F31 HydrophobicContact CG-CE2 4.41Å; L27-F31 VanDerWaalsContact O-CD2 3.31Å; L27-F31 WeakPolarHBondContact O-CD2 3.43Å; L27-F31 PolarHBondContact O-N 2.92Å; L27-F31 VanDerWaalsContact O-N 3.17Å; Q28-F31 CarbonylContact O-C 3.56Å; Q28-F31 PolarHBondContact O-N 3.19Å; Q28-F31 VanDerWaalsContact O-N 3.1Å; S29-F31 PolarHBondContact O-N 3.21Å; F31-W53 VanDerWaalsContact CA-CZ3 3.48Å; F31-W53 HydrophobicContact CB-CH2 4.15Å; F31-W53 HydrophobicContact CB-CZ3 3.94Å; F31-W53 AromaticContact CD1-CD2 3.75Å; F31-W53 HydrophobicContact CD1-CD2 3.75Å; F31-W53 AromaticContact CD1-CE3 3.05Å; F31-W53 HydrophobicContact CD1-CE3 3.05Å; F31-W53 AromaticContact CD1-CH2 3.86Å; F31-W53 HydrophobicContact CD1-CH2 3.86Å; F31-W53 HydrophobicContact CD1-CZ2 4.4Å; F31-W53 AromaticContact CD1-CZ3 3.19Å; F31-W53 HydrophobicContact CD1-CZ3 3.19Å; F31-W53 HydrophobicContact CE1-CB 4.25Å; F31-W53 AromaticContact CE1-CD2 3.83Å; F31-W53 HydrophobicContact CE1-CD2 3.83Å; F31-W53 AromaticContact CE1-CE3 3.28Å; F31-W53 HydrophobicContact CE1-CE3 3.28Å; F31-W53 HydrophobicContact CE1-CG 4.31Å; F31-W53 AromaticContact CE1-CZ3 3.92Å; F31-W53 HydrophobicContact CE1-CZ3 3.92Å; F31-W53 HydrophobicContact CG-CE3 4.09Å; F31-W53 HydrophobicContact CG-CH2 4.45Å; F31-W53 AromaticContact CG-CZ3 3.85Å; F31-W53 HydrophobicContact CG-CZ3 3.85Å; F31-W53 HydrophobicContact CZ-CE3 4.46Å; F31-W53 WeakPolarHBondContact O-CH2 3.38Å; F31-L57 HydrophobicContact CZ-CD1 4.46Å; F31-L60 HydrophobicContact CE2-CD1 4.35Å; F31-C445 HydrophobicContact CB-CB 3.93Å; F31-C445 WeakPolarHBondContact CB-SG 3.38Å; F31-C445 HydrophobicContact CD2-CB 4.15Å; F31-C445 HydrophobicContact CG-CB 4.16Å; F31-Y448 HydrophobicContact CD1-CD1 4.48Å; F31-Y448 AromaticContact CE1-CD1 3.48Å; F31-Y448 HydrophobicContact CE1-CD1 3.48Å; F31-Y448 VanDerWaalsContact CE1-CD1 3.48Å; F31-Y448 AromaticContact CE1-CE1 3.71Å; F31-Y448 HydrophobicContact CE1-CE1 3.71Å; F31-Y448 HydrophobicContact CE1-CG 4.42Å; F31-Y448 AromaticContact CZ-CD1 3.59Å; F31-Y448 HydrophobicContact CZ-CD1 3.59Å; F31-Y448 AromaticContact CZ-CE1 3.85Å; F31-Y448 HydrophobicContact CZ-CE1 3.85Å
32	S	78.4	Confident	71.3	Confident	86 Å²	86	92.2 Å²	92.2	60%	0.601	46%	0.46	S	S	*	.	S	Bend	trans	-74.9	-32	-175.1	-68.6	0	0	0	0	114.4	Q28 S29	Q28-S32 WeakPolarHBondContact O-CB 3.39Å; Q28-S32 PolarHBondContact O-N 3.02Å; Q28-S32 PolarHBondContact O-OG 2.69Å; S29-S32 PolarHBondContact O-N 3.49Å
33	T	72.8	Confident	68.8	Low	88 Å²	88	92 Å²	92	54%	0.54	47%	0.469	S	S	.	.	S	Bend	trans	-101	116.9	179.6	34.5	0	0	0	0	110.9	W53 R56	T33-W53 WeakPolarHBondContact O-CH2 3.39Å; T33-R56 PolarHBondContact O-NH1 3.38Å; T33-R56 PolarHBondContact O-NH2 3.3Å; T33-R56 PolarHBondContact OG1-NH1 2.97Å
34	P	67.7	Low	66.8	Low	104 Å²	104	100.4 Å²	100.4	68%	0.675	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-61.9	145.9	176.3	21.2	-28.8	0	0	0	111.7
35	P	67	Low	64.6	Low	26 Å²	26	107.2 Å²	107.2	17%	0.169	54%	0.54	C	S	.	.	P	Polyproline II helix	trans	-54.2	145.5	167.8	-24.6	32.9	0	0	0	111.2	Q37 K51 W53	P35-Q37 PolarHBondContact O-N 2.79Å; P35-K51 WeakPolarHBondContact CB-O 3.49Å; P35-K51 WeakPolarHBondContact CG-O 3.43Å; P35-W53 VanDerWaalsContact CD-CE2 3.46Å; P35-W53 HydrophobicContact CG-CD2 4.01Å; P35-W53 HydrophobicContact CG-CG 4.17Å; P35-W53 HydrophobicContact CG-CZ2 4.41Å
36	P	63.9	Low	62.4	Low	67 Å²	67	104.9 Å²	104.9	44%	0.435	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-56.2	139.8	169.8	-23.5	35.2	0	0	0	111.1	D38 S39 K51	P36-D38 PolarHBondContact O-N 2.87Å; P36-S39 PolarHBondContact O-N 3.29Å; P36-K51 HydrophobicContact CG-CD 4.06Å
37	Q	56.6	Low	60.7	Low	195 Å²	195	109.1 Å²	109.1	91%	0.911	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-25.8	-171.6	-72.8	-173.8	-18.6	0	0	114.2	P35 S39	P35-Q37 PolarHBondContact O-N 2.79Å; Q37-S39 PolarHBondContact O-N 3.35Å
38	D	51.7	Low	58.6	Low	122 Å²	122	112.5 Å²	112.5	65%	0.652	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	5.8	-176.8	-80.2	-44	0	0	0	115.6	P36 R40 K41	P36-D38 PolarHBondContact O-N 2.87Å; D38-R40 PolarHBondContact O-N 3.06Å; D38-K41 PolarHBondContact O-N 3.43Å
39	S	50.3	Low	56.4	Low	45 Å²	45	113.5 Å²	113.5	32%	0.315	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.2	5.5	-176.3	81.2	0	0	0	0	115.6	P36 Q37	P36-S39 PolarHBondContact O-N 3.29Å; Q37-S39 PolarHBondContact O-N 3.35Å
40	R	46.4	Very low	54.9	Low	239 Å²	239	112.9 Å²	112.9	90%	0.902	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-16.9	172.5	-68.2	-175.1	-174.8	173.9	3	113	D38 R42	D38-R40 PolarHBondContact O-N 3.06Å; R40-R42 PolarHBondContact O-N 2.98Å
41	K	41.3	Very low	54.1	Low	163 Å²	163	114.6 Å²	114.6	71%	0.709	59%	0.59	S	S	*	*	S	Bend	trans	-86.7	113.4	176.3	-78.3	-178.7	178.8	172.2	0	109.5	D38 D43	D38-K41 PolarHBondContact O-N 3.43Å; K41-D43 PolarHBondContact O-N 2.97Å; K41-D43 VanDerWaalsContact O-N 3.1Å
42	R	39	Very low	54.1	Low	231 Å²	231	116 Å²	116	87%	0.872	60%	0.6	S	S	*	*			trans	-83.1	78.5	-171.9	-165.8	-178.4	-174.5	-174.1	2.2	110	R40	R40-R42 PolarHBondContact O-N 2.98Å
43	D	39.3	Very low	54.4	Low	140 Å²	140	115.7 Å²	115.7	75%	0.749	59%	0.586	S	S	*	*			trans	-79.8	125.6	165	-100.2	-31.9	0	0	0	109.8	K41 N45	K41-D43 PolarHBondContact O-N 2.97Å; K41-D43 VanDerWaalsContact O-N 3.1Å; D43-N45 PolarHBondContact O-N 3.14Å
44	K	46.6	Very low	55	Low	188 Å²	188	113.8 Å²	113.8	82%	0.817	58%	0.579	S	S	*	*	S	Bend	trans	-73.4	-2.6	-169.8	-81.4	-176.4	177.5	176.8	0	114.6
45	N	40	Very low	55.8	Low	154 Å²	154	109.6 Å²	109.6	82%	0.824	55%	0.553	S	S	*	*	S	Bend	trans	-133.7	86	-174.2	-76.9	-15.4	0	0	0	111.3	D43	D43-N45 PolarHBondContact O-N 3.14Å
46	S	40.7	Very low	56.8	Low	82 Å²	82	109.9 Å²	109.9	57%	0.573	55%	0.55	S	S	*	*	S	Bend	trans	172.7	158.4	149.5	46.2	0	0	0	0	109.9	E48	S46-E48 PolarHBondContact O-N 3.45Å
47	D	47	Very low	58	Low	158 Å²	158	106.8 Å²	106.8	85%	0.845	53%	0.53	S	S	*	.	S	Bend	trans	-62.1	25.4	-178	-80.4	-40.3	0	0	0	115.9	C49 S50	D47-C49 PolarHBondContact O-N 2.81Å; D47-C49 VanDerWaalsContact O-N 3.15Å; D47-S50 PolarHBondContact O-OG 3.36Å
48	E	42.5	Very low	59.6	Low	72 Å²	72	103.3 Å²	103.3	34%	0.336	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-68	-8.1	178.2	-67.4	-153	132.8	0	0	114.7	S46 S50 K51	S46-E48 PolarHBondContact O-N 3.45Å; E48-S50 PolarHBondContact O-N 2.72Å; E48-S50 VanDerWaalsContact O-N 3.08Å; E48-K51 HydrophobicContact CB-CD 4.02Å; E48-K51 HydrophobicContact CG-CD 4Å; E48-K51 VanDerWaalsContact O-CB 3.32Å; E48-K51 WeakPolarHBondContact O-CB 3.44Å; E48-K51 WeakPolarHBondContact O-CG 3.47Å; E48-K51 PolarHBondContact O-N 3.26Å; E48-K51 IonicContact OE1-NZ 2.9Å; E48-K51 PolarHBondContact OE1-NZ 3.27Å
49	C	42	Very low	61.3	Low	100 Å²	100	103.5 Å²	103.5	68%	0.676	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-56.1	-29.6	177.7	-168.4	0	0	0	0	112	D47 K51 S55	D47-C49 PolarHBondContact O-N 2.81Å; D47-C49 VanDerWaalsContact O-N 3.15Å; C49-K51 PolarHBondContact O-N 3.16Å; C49-S55 WeakPolarHBondContact O-CB 3.47Å; C49-S55 PolarHBondContact O-OG 2.92Å
50	S	53.7	Low	63.2	Low	60 Å²	60	101.5 Å²	101.5	42%	0.42	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-66.9	-10.8	176.9	63.3	0	0	0	0	114.9	D47 E48	D47-S50 PolarHBondContact O-OG 3.36Å; E48-S50 PolarHBondContact O-N 2.72Å; E48-S50 VanDerWaalsContact O-N 3.08Å
51	K	67.7	Low	65.2	Low	66 Å²	66	91.9 Å²	91.9	29%	0.287	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-87.6	-21.9	-167.9	-63.9	178.3	177.6	-177.4	0	114.6	P35 P36 E48 C49	P35-K51 WeakPolarHBondContact CB-O 3.49Å; P35-K51 WeakPolarHBondContact CG-O 3.43Å; P36-K51 HydrophobicContact CG-CD 4.06Å; E48-K51 HydrophobicContact CB-CD 4.02Å; E48-K51 HydrophobicContact CG-CD 4Å; E48-K51 VanDerWaalsContact O-CB 3.32Å; E48-K51 WeakPolarHBondContact O-CB 3.44Å; E48-K51 WeakPolarHBondContact O-CG 3.47Å; E48-K51 PolarHBondContact O-N 3.26Å; E48-K51 IonicContact OE1-NZ 2.9Å; E48-K51 PolarHBondContact OE1-NZ 3.27Å; C49-K51 PolarHBondContact O-N 3.16Å
52	T	82.3	Confident	67.6	Low	49 Å²	49	84.6 Å²	84.6	30%	0.301	43%	0.433	S	S	.	.	S	Bend	trans	-83.3	151	-176.1	68	0	0	0	0	113	A54 S55 R56	T52-A54 PolarHBondContact O-N 3.17Å; T52-S55 WeakPolarHBondContact O-CB 3.45Å; T52-S55 PolarHBondContact O-N 2.86Å; T52-S55 WeakPolarHBondContact OG1-CB 3.26Å; T52-S55 PolarHBondContact OG1-N 2.85Å; T52-R56 PolarHBondContact O-N 3.24Å; T52-R56 VanDerWaalsContact O-N 3.11Å
53	W	83.1	Confident	70.2	Confident	80 Å²	80	75 Å²	75	30%	0.303	40%	0.397	S	S	.	.	H	α-helix	trans	-53.8	-40.4	173.5	-70.4	131.8	0	0	0	113.5	F31 T33 P35 S55 R56 L57 Y448	F31-W53 VanDerWaalsContact CA-CZ3 3.48Å; F31-W53 HydrophobicContact CB-CH2 4.15Å; F31-W53 HydrophobicContact CB-CZ3 3.94Å; F31-W53 AromaticContact CD1-CD2 3.75Å; F31-W53 HydrophobicContact CD1-CD2 3.75Å; F31-W53 AromaticContact CD1-CE3 3.05Å; F31-W53 HydrophobicContact CD1-CE3 3.05Å; F31-W53 AromaticContact CD1-CH2 3.86Å; F31-W53 HydrophobicContact CD1-CH2 3.86Å; F31-W53 HydrophobicContact CD1-CZ2 4.4Å; F31-W53 AromaticContact CD1-CZ3 3.19Å; F31-W53 HydrophobicContact CD1-CZ3 3.19Å; F31-W53 HydrophobicContact CE1-CB 4.25Å; F31-W53 AromaticContact CE1-CD2 3.83Å; F31-W53 HydrophobicContact CE1-CD2 3.83Å; F31-W53 AromaticContact CE1-CE3 3.28Å; F31-W53 HydrophobicContact CE1-CE3 3.28Å; F31-W53 HydrophobicContact CE1-CG 4.31Å; F31-W53 AromaticContact CE1-CZ3 3.92Å; F31-W53 HydrophobicContact CE1-CZ3 3.92Å; F31-W53 HydrophobicContact CG-CE3 4.09Å; F31-W53 HydrophobicContact CG-CH2 4.45Å; F31-W53 AromaticContact CG-CZ3 3.85Å; F31-W53 HydrophobicContact CG-CZ3 3.85Å; F31-W53 HydrophobicContact CZ-CE3 4.46Å; F31-W53 WeakPolarHBondContact O-CH2 3.38Å; T33-W53 WeakPolarHBondContact O-CH2 3.39Å; P35-W53 VanDerWaalsContact CD-CE2 3.46Å; P35-W53 HydrophobicContact CG-CD2 4.01Å; P35-W53 HydrophobicContact CG-CG 4.17Å; P35-W53 HydrophobicContact CG-CZ2 4.41Å; W53-S55 VanDerWaalsContact C-N 3.29Å; W53-S55 PolarHBondContact O-N 2.53Å; W53-R56 PolarHBondContact O-N 3.33Å; W53-L57 WeakPolarHBondContact O-CB 3.28Å; W53-L57 PolarHBondContact O-N 2.94Å; W53-Y448 HydrophobicContact CB-CE1 4.01Å
54	A	85.8	Confident	72.9	Confident	48 Å²	48	68.3 Å²	68.3	40%	0.397	36%	0.361	S	S	.	.	H	α-helix	trans	-65.5	-31.4	178	0	0	0	0	0	113	T52 K58	T52-A54 PolarHBondContact O-N 3.17Å; A54-K58 WeakPolarHBondContact O-CG 3.28Å; A54-K58 PolarHBondContact O-N 3.38Å
55	S	86	Confident	75.1	Confident	17 Å²	17	60.8 Å²	60.8	12%	0.119	33%	0.329	C	S	.	.	H	α-helix	trans	-73.9	-44.3	176.6	-172.3	0	0	0	0	111.7	C49 T52 W53 L57 K58 Q59	C49-S55 WeakPolarHBondContact O-CB 3.47Å; C49-S55 PolarHBondContact O-OG 2.92Å; T52-S55 WeakPolarHBondContact O-CB 3.45Å; T52-S55 PolarHBondContact O-N 2.86Å; T52-S55 WeakPolarHBondContact OG1-CB 3.26Å; T52-S55 PolarHBondContact OG1-N 2.85Å; W53-S55 VanDerWaalsContact C-N 3.29Å; W53-S55 PolarHBondContact O-N 2.53Å; S55-L57 VanDerWaalsContact C-N 3.3Å; S55-L57 PolarHBondContact O-N 3.37Å; S55-K58 WeakPolarHBondContact O-CB 3.38Å; S55-K58 PolarHBondContact O-N 2.99Å; S55-K58 VanDerWaalsContact O-N 3.09Å; S55-Q59 PolarHBondContact O-N 2.75Å
56	R	88	Confident	77.7	Confident	31 Å²	31	55.7 Å²	55.7	12%	0.117	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-40.1	175.4	-62.9	-170.4	-168.8	-178.3	8.6	112.1	T30 T33 T52 W53 K58 Q59 L60	T30-R56 HydrophobicContact CG2-CB 3.81Å; T30-R56 WeakPolarHBondContact O-CD 3.44Å; T30-R56 PolarHBondContact O-NH1 2.97Å; T33-R56 PolarHBondContact O-NH1 3.38Å; T33-R56 PolarHBondContact O-NH2 3.3Å; T33-R56 PolarHBondContact OG1-NH1 2.97Å; T52-R56 PolarHBondContact O-N 3.24Å; T52-R56 VanDerWaalsContact O-N 3.11Å; W53-R56 PolarHBondContact O-N 3.33Å; R56-K58 VanDerWaalsContact C-N 3.29Å; R56-K58 PolarHBondContact O-N 3.23Å; R56-Q59 WeakPolarHBondContact O-CB 3.4Å; R56-Q59 PolarHBondContact O-N 3.33Å; R56-Q59 VanDerWaalsContact O-N 3.1Å; R56-L60 PolarHBondContact O-N 2.81Å
57	L	88.8	Confident	80.3	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-56.1	-42.6	173.8	-173.1	70	0	0	0	112	F31 W53 S55 Q59 L60 Y63 Y449 Q452	F31-L57 HydrophobicContact CZ-CD1 4.46Å; W53-L57 WeakPolarHBondContact O-CB 3.28Å; W53-L57 PolarHBondContact O-N 2.94Å; S55-L57 VanDerWaalsContact C-N 3.3Å; S55-L57 PolarHBondContact O-N 3.37Å; L57-Q59 VanDerWaalsContact C-N 3.26Å; L57-Q59 PolarHBondContact O-N 2.86Å; L57-L60 HydrophobicContact CD1-CD1 4.16Å; L57-L60 WeakPolarHBondContact O-CB 3.4Å; L57-L60 PolarHBondContact O-N 3.36Å; L57-Y63 HydrophobicContact CD1-CD2 3.85Å; L57-Y63 HydrophobicContact CD1-CE2 4.24Å; L57-Y63 HydrophobicContact CD1-CG 4.28Å; L57-Y63 HydrophobicContact CD2-CD2 3.85Å; L57-Y63 HydrophobicContact CD2-CE1 4.22Å; L57-Y63 HydrophobicContact CD2-CE2 3.39Å; L57-Y63 HydrophobicContact CD2-CG 4.44Å; L57-Y63 HydrophobicContact CG-CD1 4.14Å; L57-Y63 HydrophobicContact CG-CD2 3.58Å; L57-Y63 HydrophobicContact CG-CE1 4.19Å; L57-Y63 HydrophobicContact CG-CE2 3.68Å; L57-Y63 HydrophobicContact CG-CG 3.8Å; L57-Y63 WeakPolarHBondContact O-CB 3.42Å; L57-Y449 HydrophobicContact CD1-CD2 3.39Å; L57-Y449 HydrophobicContact CD1-CE2 3.86Å; L57-Y449 HydrophobicContact CD1-CG 4.26Å; L57-Q452 HydrophobicContact CD2-CB 3.53Å; L57-Q452 HydrophobicContact CD2-CG 4.02Å
58	K	89.9	Confident	82.6	Confident	121 Å²	121	49.8 Å²	49.8	53%	0.526	27%	0.27	S	S	.	.	H	α-helix	trans	-67.1	-25	179.2	-69.8	172	-177.2	179.9	0	113.8	A54 S55 R56 Y63 K196	A54-K58 WeakPolarHBondContact O-CG 3.28Å; A54-K58 PolarHBondContact O-N 3.38Å; S55-K58 WeakPolarHBondContact O-CB 3.38Å; S55-K58 PolarHBondContact O-N 2.99Å; S55-K58 VanDerWaalsContact O-N 3.09Å; R56-K58 VanDerWaalsContact C-N 3.29Å; R56-K58 PolarHBondContact O-N 3.23Å; K58-Y63 HydrophobicContact CG-CD1 4.35Å; K58-Y63 HydrophobicContact CG-CE1 4.06Å; K58-K196 PolarHBondContact O-NZ 3.26Å
59	Q	87.7	Confident	85.2	Confident	126 Å²	126	47.7 Å²	47.7	59%	0.589	26%	0.261	S	S	*	.	H	α-helix	trans	-76	-26.7	178.6	-66.2	173.7	-1.8	0	0	112.1	S55 R56 L57	S55-Q59 PolarHBondContact O-N 2.75Å; R56-Q59 WeakPolarHBondContact O-CB 3.4Å; R56-Q59 PolarHBondContact O-N 3.33Å; R56-Q59 VanDerWaalsContact O-N 3.1Å; L57-Q59 VanDerWaalsContact C-N 3.26Å; L57-Q59 PolarHBondContact O-N 2.86Å
60	L	89.6	Confident	87.7	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.021	25%	0.253	C	S	.	.	S	Bend	trans	-60.4	132.6	-179.3	-69.8	173.1	0	0	0	112	E26 L27 T30 F31 R56 L57 C62 Y63 K196 Y449	E26-L60 HydrophobicContact CG-CD2 4.48Å; L27-L60 HydrophobicContact CD1-CD1 3.52Å; T30-L60 HydrophobicContact CG2-CD2 4.02Å; T30-L60 HydrophobicContact CG2-CG 4.29Å; T30-L60 WeakPolarHBondContact OG1-CD2 2.92Å; F31-L60 HydrophobicContact CE2-CD1 4.35Å; R56-L60 PolarHBondContact O-N 2.81Å; L57-L60 HydrophobicContact CD1-CD1 4.16Å; L57-L60 WeakPolarHBondContact O-CB 3.4Å; L57-L60 PolarHBondContact O-N 3.36Å; L60-C62 PolarHBondContact O-N 3.43Å; L60-Y63 PolarHBondContact O-N 2.86Å; L60-K196 WeakPolarHBondContact O-CE 3.44Å; L60-K196 PolarHBondContact O-NZ 3.3Å; L60-Y449 HydrophobicContact CD1-CD2 4.05Å; L60-Y449 HydrophobicContact CD1-CE2 4.13Å
61	P	89.2	Confident	89.7	Confident	36 Å²	36	44.4 Å²	44.4	23%	0.234	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-32.7	176.6	-26.9	35.5	0	0	0	113.7	E26 V400	E26-P61 WeakPolarHBondContact OE1-CD 3.16Å; P61-V400 HydrophobicContact CB-CG1 4.36Å; P61-V400 HydrophobicContact CG-CG1 4.13Å; P61-V400 HydrophobicContact CG-CG2 4.4Å
62	C	91.6	Very high	91	Very high	11 Å²	11	42.9 Å²	42.9	7%	0.074	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-19.1	-177.9	61.3	0	0	0	0	114.5	L60 Y449 I458 P460	L60-C62 PolarHBondContact O-N 3.43Å; C62-Y449 PolarHBondContact O-OH 3.2Å; C62-Y449 VanDerWaalsContact SG-CE2 3.55Å; C62-I458 HydrophobicContact CB-CB 3.88Å; C62-I458 HydrophobicContact CB-CG2 4.3Å; C62-I458 WeakPolarHBondContact CB-O 3.08Å; C62-I458 PolarHBondContact O-N 3Å; C62-P460 HydrophobicContact CB-CB 4.36Å
63	Y	93.6	Very high	91.5	Very high	28 Å²	28	44.5 Å²	44.5	11%	0.11	25%	0.253	C	S	.	.			trans	-92.3	110.5	-179.3	-171.6	-99.4	0	0	0	110.7	L57 K58 L60 Q65 K196 Y449	L57-Y63 HydrophobicContact CD1-CD2 3.85Å; L57-Y63 HydrophobicContact CD1-CE2 4.24Å; L57-Y63 HydrophobicContact CD1-CG 4.28Å; L57-Y63 HydrophobicContact CD2-CD2 3.85Å; L57-Y63 HydrophobicContact CD2-CE1 4.22Å; L57-Y63 HydrophobicContact CD2-CE2 3.39Å; L57-Y63 HydrophobicContact CD2-CG 4.44Å; L57-Y63 HydrophobicContact CG-CD1 4.14Å; L57-Y63 HydrophobicContact CG-CD2 3.58Å; L57-Y63 HydrophobicContact CG-CE1 4.19Å; L57-Y63 HydrophobicContact CG-CE2 3.68Å; L57-Y63 HydrophobicContact CG-CG 3.8Å; L57-Y63 WeakPolarHBondContact O-CB 3.42Å; K58-Y63 HydrophobicContact CG-CD1 4.35Å; K58-Y63 HydrophobicContact CG-CE1 4.06Å; L60-Y63 PolarHBondContact O-N 2.86Å; Y63-Q65 HydrophobicContact CD1-CB 4.47Å; Y63-Q65 HydrophobicContact CE1-CB 3.75Å; Y63-Q65 HydrophobicContact CE1-CG 4.31Å; Y63-Q65 HydrophobicContact CE2-CB 4.33Å; Y63-Q65 HydrophobicContact CE2-CG 3.99Å; Y63-K196 WeakPolarHBondContact O-CE 3.4Å; Y63-K196 PolarHBondContact O-NZ 2.8Å; Y63-Y449 HydrophobicContact CD2-CE2 4.17Å
64	L	95	Very high	91.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.263	C	S	.	.			trans	-113	5.1	-166.5	-61.1	169.4	0	0	0	112.6	R189 E193 K196 G456 D457 I458	L64-R189 PolarHBondContact O-NE 3.16Å; L64-R189 PolarHBondContact O-NH2 2.82Å; L64-E193 HydrophobicContact CD1-CG 3.96Å; L64-E193 HydrophobicContact CD2-CB 4.47Å; L64-E193 HydrophobicContact CD2-CG 4.07Å; L64-K196 HydrophobicContact CD2-CD 4.1Å; L64-K196 HydrophobicContact CD2-CG 4.46Å; L64-G456 VanDerWaalsContact CD1-O 3.29Å; L64-G456 WeakPolarHBondContact CD1-O 3.28Å; L64-D457 WeakPolarHBondContact CA-OD1 3.36Å; L64-D457 PolarHBondContact N-OD1 3.14Å; L64-I458 HydrophobicContact CD1-CD1 4.15Å; L64-I458 HydrophobicContact CD1-CG1 4.15Å
65	Q	93.1	Very high	92.4	Very high	30 Å²	30	44.9 Å²	44.9	14%	0.14	24%	0.244	C	C	.	.			trans	-68.2	140.7	178	-57	-54.3	-49.8	0	0	112.3	Y63 H454 S455 D457	Y63-Q65 HydrophobicContact CD1-CB 4.47Å; Y63-Q65 HydrophobicContact CE1-CB 3.75Å; Y63-Q65 HydrophobicContact CE1-CG 4.31Å; Y63-Q65 HydrophobicContact CE2-CB 4.33Å; Y63-Q65 HydrophobicContact CE2-CG 3.99Å; Q65-H454 HydrophobicContact CG-CB 4.34Å; Q65-S455 PolarHBondContact NE2-O 2.92Å; Q65-D457 VanDerWaalsContact CG-OD2 3.26Å; Q65-D457 WeakPolarHBondContact CG-OD2 3.41Å; Q65-D457 PolarHBondContact N-OD1 2.86Å; Q65-D457 PolarHBondContact NE2-OD1 3.32Å; Q65-D457 PolarHBondContact NE2-OD2 3.28Å
66	L	94.9	Very high	92.7	Very high	47 Å²	47	45.8 Å²	45.8	25%	0.246	25%	0.247	C	C	.	.			trans	-114.4	149.7	173.6	-71	175.7	0	0	0	110	I69 R189 Y192	L66-I69 HydrophobicContact CD1-CD1 3.94Å; L66-R189 HydrophobicContact CD1-CB 4.3Å; L66-Y192 HydrophobicContact CD1-CD1 3.92Å; L66-Y192 HydrophobicContact CD1-CG 3.88Å; L66-Y192 HydrophobicContact CD2-CD1 3.77Å; L66-Y192 HydrophobicContact CD2-CD2 4.07Å; L66-Y192 HydrophobicContact CD2-CE1 3.65Å; L66-Y192 HydrophobicContact CD2-CE2 3.96Å; L66-Y192 HydrophobicContact CD2-CG 3.97Å; L66-Y192 HydrophobicContact CG-CD1 3.88Å; L66-Y192 HydrophobicContact CG-CE1 4.1Å; L66-Y192 HydrophobicContact CG-CG 4.24Å
67	P	94.6	Very high	93	Very high	85 Å²	85	46.4 Å²	46.4	55%	0.552	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-60.9	164.9	165.4	30.5	-35.6	0	0	0	110.5	I69	P67-I69 PolarHBondContact O-N 2.65Å
68	P	95.8	Very high	93.2	Very high	31 Å²	31	46.6 Å²	46.6	20%	0.201	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-53.8	126.5	174.3	-23.9	33.2	0	0	0	112	R364 Y366 P377	P68-R364 WeakPolarHBondContact CA-O 3.48Å; P68-R364 HydrophobicContact CB-CB 4.03Å; P68-R364 HydrophobicContact CG-CB 3.95Å; P68-Y366 HydrophobicContact CB-CD2 4.12Å; P68-Y366 HydrophobicContact CB-CE2 3.7Å; P68-P377 HydrophobicContact CB-CB 3.59Å; P68-P377 HydrophobicContact CB-CG 4.37Å; P68-P377 HydrophobicContact CG-CB 3.67Å; P68-P377 HydrophobicContact CG-CG 3.9Å
69	I	96.3	Very high	93.5	Very high	29 Å²	29	40.8 Å²	40.8	15%	0.149	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-89.3	130.7	-174.7	-59.1	172	0	0	0	109.6	L66 P67 F184 A185 C188 R364 Y365 Y366	L66-I69 HydrophobicContact CD1-CD1 3.94Å; P67-I69 PolarHBondContact O-N 2.65Å; I69-F184 HydrophobicContact CG2-CD1 3.84Å; I69-F184 HydrophobicContact CG2-CE1 3.55Å; I69-A185 HydrophobicContact CB-CB 3.84Å; I69-A185 HydrophobicContact CD1-CB 4.15Å; I69-A185 WeakPolarHBondContact CD1-O 3.3Å; I69-A185 HydrophobicContact CG1-CB 4.5Å; I69-A185 HydrophobicContact CG2-CB 4.22Å; I69-C188 HydrophobicContact CD1-CB 3.78Å; I69-R364 PolarHBondContact N-O 3Å; I69-Y365 CarbonylContact O-C 3.56Å; I69-Y365 WeakPolarHBondContact O-CA 3.48Å; I69-Y365 WeakPolarHBondContact O-CB 3.45Å; I69-Y366 PolarHBondContact O-N 3.39Å
70	S	95	Very high	93.8	Very high	74 Å²	74	36.9 Å²	36.9	52%	0.517	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-98.9	154.8	169.7	60.3	0	0	0	0	110.7	F184	S70-F184 VanDerWaalsContact O-CE1 3.31Å; S70-F184 WeakPolarHBondContact O-CE1 3.5Å
71	L	95.5	Very high	93.9	Very high	16 Å²	16	39 Å²	39	8%	0.084	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-60	147.3	168.2	-68.6	168.9	0	0	0	110.4	A73 L75 D76 L180 A181 F184 F368	L71-A73 PolarHBondContact O-N 2.91Å; L71-L75 HydrophobicContact CD2-CD2 3.7Å; L71-L75 HydrophobicContact CD2-CG 4.36Å; L71-D76 HydrophobicContact CB-CB 4.11Å; L71-L180 HydrophobicContact CD1-CD2 4.01Å; L71-L180 HydrophobicContact CD1-CG 4.08Å; L71-L180 HydrophobicContact CD2-CG 3.96Å; L71-A181 HydrophobicContact CD1-CB 4.12Å; L71-A181 HydrophobicContact CG-CB 4.21Å; L71-F184 HydrophobicContact CD2-CB 3.69Å; L71-F184 HydrophobicContact CD2-CD1 4.01Å; L71-F184 HydrophobicContact CD2-CD2 4.49Å; L71-F184 HydrophobicContact CD2-CG 3.81Å; L71-F368 HydrophobicContact CD1-CB 4.15Å; L71-F368 HydrophobicContact CD1-CD2 3.81Å; L71-F368 HydrophobicContact CD1-CG 4.43Å
72	P	94.4	Very high	94.2	Very high	35 Å²	35	38.6 Å²	38.6	23%	0.227	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-56.9	136	167.2	-22.9	34.7	0	0	0	109.5	R74 L75 D76 F184 W218	P72-R74 PolarHBondContact O-N 3.08Å; P72-L75 HydrophobicContact CB-CB 4.22Å; P72-L75 HydrophobicContact CG-CB 4.39Å; P72-L75 WeakPolarHBondContact O-CA 3.1Å; P72-L75 WeakPolarHBondContact O-CB 3.43Å; P72-L75 PolarHBondContact O-N 3.46Å; P72-D76 PolarHBondContact O-N 2.98Å; P72-F184 HydrophobicContact CG-CE1 4.38Å; P72-F184 HydrophobicContact CG-CE2 3.84Å; P72-F184 HydrophobicContact CG-CZ 3.59Å; P72-W218 HydrophobicContact CG-CE3 4.44Å
73	A	92.9	Very high	94.3	Very high	83 Å²	83	38.6 Å²	38.6	69%	0.686	22%	0.222	S	C	*	.	H	α-helix	trans	-53	-36.4	-174.3	0	0	0	0	0	113.5	L71 A77	L71-A73 PolarHBondContact O-N 2.91Å; A73-A77 WeakPolarHBondContact O-CB 3.48Å; A73-A77 PolarHBondContact O-N 2.99Å
74	R	92.8	Very high	94.2	Very high	135 Å²	135	45.8 Å²	45.8	51%	0.509	25%	0.249	S	C	.	.	H	α-helix	trans	-64	-46.5	174	176.1	179.8	-74.5	166.1	-3.4	112.4	P72 D76 A77 V78 W218	P72-R74 PolarHBondContact O-N 3.08Å; R74-D76 VanDerWaalsContact C-N 3.31Å; R74-A77 PolarHBondContact O-N 3.15Å; R74-V78 HydrophobicContact CG-CG2 4.36Å; R74-V78 WeakPolarHBondContact O-CB 3.33Å; R74-V78 WeakPolarHBondContact O-CG2 3.38Å; R74-V78 PolarHBondContact O-N 3.05Å; R74-W218 HydrophobicContact CG-CH2 4.13Å
75	L	94.9	Very high	94	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-40.1	-178.8	178.6	65.8	0	0	0	110.4	L71 P72 A79 L180 F184 W218 M248	L71-L75 HydrophobicContact CD2-CD2 3.7Å; L71-L75 HydrophobicContact CD2-CG 4.36Å; P72-L75 HydrophobicContact CB-CB 4.22Å; P72-L75 HydrophobicContact CG-CB 4.39Å; P72-L75 WeakPolarHBondContact O-CA 3.1Å; P72-L75 WeakPolarHBondContact O-CB 3.43Å; P72-L75 PolarHBondContact O-N 3.46Å; L75-A79 VanDerWaalsContact O-CB 3.32Å; L75-A79 WeakPolarHBondContact O-CB 3.33Å; L75-A79 PolarHBondContact O-N 3.28Å; L75-A79 VanDerWaalsContact O-N 3.13Å; L75-L180 HydrophobicContact CD1-CD1 4.39Å; L75-L180 HydrophobicContact CD2-CD1 4.23Å; L75-L180 HydrophobicContact CG-CD1 4.48Å; L75-L180 HydrophobicContact CG-CD2 4.47Å; L75-F184 HydrophobicContact CD2-CD2 4.25Å; L75-W218 HydrophobicContact CB-CD2 4.2Å; L75-W218 HydrophobicContact CB-CE3 3.95Å; L75-W218 HydrophobicContact CB-CH2 4.29Å; L75-W218 HydrophobicContact CB-CZ3 3.99Å; L75-W218 HydrophobicContact CD1-CD2 3.72Å; L75-W218 HydrophobicContact CD1-CE3 4.34Å; L75-W218 HydrophobicContact CD1-CG 3.93Å; L75-W218 HydrophobicContact CD1-CZ2 3.99Å; L75-W218 HydrophobicContact CD2-CB 3.93Å; L75-W218 HydrophobicContact CD2-CD2 3.94Å; L75-W218 HydrophobicContact CD2-CE3 4.23Å; L75-W218 HydrophobicContact CD2-CG 3.8Å; L75-W218 HydrophobicContact CG-CD2 4.19Å; L75-W218 HydrophobicContact CG-CE3 4.42Å; L75-W218 HydrophobicContact CG-CG 4.44Å; L75-M248 HydrophobicContact CD1-CE 3.23Å; L75-M248 HydrophobicContact CG-CE 4.16Å; L75-M248 WeakPolarHBondContact O-CE 3.46Å
76	D	94	Very high	94	Very high	35 Å²	35	54.7 Å²	54.7	19%	0.187	29%	0.291	C	S	.	.	H	α-helix	trans	-62.6	-49.9	175.3	-165	61.4	0	0	0	111.6	L71 P72 R74 A79 I80 F368	L71-D76 HydrophobicContact CB-CB 4.11Å; P72-D76 PolarHBondContact O-N 2.98Å; R74-D76 VanDerWaalsContact C-N 3.31Å; D76-A79 PolarHBondContact O-N 2.81Å; D76-I80 WeakPolarHBondContact O-CG1 3.28Å; D76-I80 PolarHBondContact O-N 3.07Å; D76-I80 VanDerWaalsContact O-N 3.07Å; D76-F368 VanDerWaalsContact OD1-CD2 3.3Å; D76-F368 WeakPolarHBondContact OD1-CD2 3.41Å
77	A	92.9	Very high	93.8	Very high	44 Å²	44	53.4 Å²	53.4	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-60.4	-48.9	179	0	0	0	0	0	112.8	A73 R74 A79 I80 D81	A73-A77 WeakPolarHBondContact O-CB 3.48Å; A73-A77 PolarHBondContact O-N 2.99Å; R74-A77 PolarHBondContact O-N 3.15Å; A77-A79 VanDerWaalsContact C-N 3.28Å; A77-A79 PolarHBondContact O-N 3.34Å; A77-I80 WeakPolarHBondContact O-CB 3.39Å; A77-I80 PolarHBondContact O-N 2.94Å; A77-I80 VanDerWaalsContact O-N 3.15Å; A77-D81 PolarHBondContact O-N 3.04Å
78	V	94.3	Very high	93.7	Very high	7 Å²	7	57.7 Å²	57.7	4%	0.042	30%	0.303	C	S	.	.	H	α-helix	trans	-65	-33.2	-179.3	174.9	0	0	0	0	111.6	R74 D81 Y82 F247 M248 Q252	R74-V78 HydrophobicContact CG-CG2 4.36Å; R74-V78 WeakPolarHBondContact O-CB 3.33Å; R74-V78 WeakPolarHBondContact O-CG2 3.38Å; R74-V78 PolarHBondContact O-N 3.05Å; V78-D81 PolarHBondContact O-N 3.27Å; V78-Y82 WeakPolarHBondContact O-CB 3.25Å; V78-Y82 PolarHBondContact O-N 3.44Å; V78-F247 HydrophobicContact CG1-CD1 3.71Å; V78-F247 HydrophobicContact CG1-CE1 3.69Å; V78-M248 HydrophobicContact CB-CE 4.02Å; V78-M248 HydrophobicContact CB-SD 4.44Å; V78-M248 HydrophobicContact CG1-CE 3.99Å; V78-M248 HydrophobicContact CG1-SD 3.82Å; V78-Q252 HydrophobicContact CG2-CG 4.11Å
79	A	95	Very high	93.4	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-68.7	-37.6	176	0	0	0	0	0	111.7	L75 D76 A77 L83 L176 L180 M248 F368	L75-A79 VanDerWaalsContact O-CB 3.32Å; L75-A79 WeakPolarHBondContact O-CB 3.33Å; L75-A79 PolarHBondContact O-N 3.28Å; L75-A79 VanDerWaalsContact O-N 3.13Å; D76-A79 PolarHBondContact O-N 2.81Å; A77-A79 VanDerWaalsContact C-N 3.28Å; A77-A79 PolarHBondContact O-N 3.34Å; A79-L83 WeakPolarHBondContact O-CG 3.34Å; A79-L83 PolarHBondContact O-N 2.74Å; A79-L176 HydrophobicContact CB-CD1 4.14Å; A79-L176 HydrophobicContact CB-CD2 4.09Å; A79-L176 HydrophobicContact CB-CG 4.44Å; A79-L180 HydrophobicContact CB-CD2 3.7Å; A79-M248 HydrophobicContact CB-CE 3.62Å; A79-M248 HydrophobicContact CB-SD 4.08Å; A79-F368 HydrophobicContact CB-CD2 4.39Å; A79-F368 HydrophobicContact CB-CE2 3.49Å; A79-F368 VanDerWaalsContact CB-CE2 3.49Å; A79-F368 HydrophobicContact CB-CZ 3.69Å
80	I	93.7	Very high	93.1	Very high	43 Å²	43	60.1 Å²	60.1	22%	0.221	32%	0.321	C	S	.	.	H	α-helix	trans	-65.7	-45.5	173.4	-68.3	167.2	0	0	0	110.4	D76 A77 L83 R84 F368	D76-I80 WeakPolarHBondContact O-CG1 3.28Å; D76-I80 PolarHBondContact O-N 3.07Å; D76-I80 VanDerWaalsContact O-N 3.07Å; A77-I80 WeakPolarHBondContact O-CB 3.39Å; A77-I80 PolarHBondContact O-N 2.94Å; A77-I80 VanDerWaalsContact O-N 3.15Å; I80-L83 PolarHBondContact O-N 3.13Å; I80-R84 PolarHBondContact O-N 3.39Å; I80-F368 HydrophobicContact CG1-CE2 3.77Å; I80-F368 HydrophobicContact CG1-CZ 3.73Å
81	D	92.9	Very high	92.8	Very high	48 Å²	48	60 Å²	60	26%	0.257	32%	0.319	S	S	.	.	H	α-helix	trans	-64.7	-42.7	-179	-68.4	-27.7	0	0	0	111.3	A77 V78 L83 R84 E85	A77-D81 PolarHBondContact O-N 3.04Å; V78-D81 PolarHBondContact O-N 3.27Å; D81-L83 VanDerWaalsContact C-N 3.31Å; D81-L83 PolarHBondContact O-N 3.3Å; D81-R84 PolarHBondContact O-N 2.79Å; D81-R84 VanDerWaalsContact O-N 3.13Å; D81-R84 IonicContact OD1-CZ 3.72Å; D81-R84 IonicContact OD1-NH1 2.87Å; D81-R84 PolarHBondContact OD1-NH1 3.01Å; D81-E85 WeakPolarHBondContact O-CB 3.49Å; D81-E85 WeakPolarHBondContact O-CG 3.43Å; D81-E85 PolarHBondContact O-N 2.93Å
82	Y	94.2	Very high	92.5	Very high	29 Å²	29	64.5 Å²	64.5	11%	0.114	34%	0.337	C	S	.	.	H	α-helix	trans	-53.5	-49.4	172.9	179.2	-92.3	0	0	0	111.7	V78 R84 E85 H86 E173 L176 L244 F247	V78-Y82 WeakPolarHBondContact O-CB 3.25Å; V78-Y82 PolarHBondContact O-N 3.44Å; Y82-R84 VanDerWaalsContact C-N 3.33Å; Y82-R84 PolarHBondContact O-N 3.33Å; Y82-E85 PolarHBondContact O-N 3.42Å; Y82-H86 AromaticContact CD2-CD2 3.41Å; Y82-H86 VanDerWaalsContact CD2-CD2 3.41Å; Y82-H86 WeakPolarHBondContact CD2-CD2 3.35Å; Y82-H86 HydrophobicContact CE1-CB 4.22Å; Y82-H86 HydrophobicContact CE2-CB 4.21Å; Y82-H86 AromaticContact CE2-CD2 3.44Å; Y82-H86 VanDerWaalsContact CE2-CD2 3.44Å; Y82-H86 WeakPolarHBondContact CE2-CD2 3.24Å; Y82-H86 AromaticContact CE2-CG 3.94Å; Y82-H86 WeakPolarHBondContact O-CB 3.35Å; Y82-H86 PolarHBondContact O-CD2 2.73Å; Y82-H86 PolarHBondContact O-N 3.33Å; Y82-E173 HydrophobicContact CE1-CG 4.13Å; Y82-L176 HydrophobicContact CD1-CD1 4.39Å; Y82-L244 HydrophobicContact CD1-CD1 3.44Å; Y82-L244 VanDerWaalsContact CD1-CD1 3.44Å; Y82-L244 HydrophobicContact CD2-CD1 3.49Å; Y82-L244 VanDerWaalsContact CD2-CD1 3.49Å; Y82-L244 HydrophobicContact CE1-CD1 3.51Å; Y82-L244 HydrophobicContact CE1-CD2 4.3Å; Y82-L244 HydrophobicContact CE1-CG 4.46Å; Y82-L244 HydrophobicContact CE2-CD1 3.55Å; Y82-L244 HydrophobicContact CG-CD1 3.43Å; Y82-L244 VanDerWaalsContact CG-CD1 3.43Å; Y82-F247 HydrophobicContact CD2-CB 4.17Å; Y82-F247 AromaticContact CD2-CD1 3.7Å; Y82-F247 HydrophobicContact CD2-CD1 3.7Å; Y82-F247 HydrophobicContact CD2-CD2 4.02Å; Y82-F247 HydrophobicContact CD2-CE1 4.04Å; Y82-F247 HydrophobicContact CD2-CE2 4.31Å; Y82-F247 AromaticContact CD2-CG 3.7Å; Y82-F247 HydrophobicContact CD2-CG 3.7Å; Y82-F247 HydrophobicContact CD2-CZ 4.32Å; Y82-F247 HydrophobicContact CE2-CG 4.47Å; Y82-F247 HydrophobicContact CG-CD1 4.19Å; Y82-F247 HydrophobicContact CG-CE1 4.3Å
83	L	94.4	Very high	92.4	Very high	10 Å²	10	64.2 Å²	64.2	5%	0.052	34%	0.338	C	S	.	.	H	α-helix	trans	-68.6	-33.5	-178.7	-70.8	173.2	0	0	0	112.1	A79 I80 D81 E85 S87 I94 E173 L176 V177 F368 L370	A79-L83 WeakPolarHBondContact O-CG 3.34Å; A79-L83 PolarHBondContact O-N 2.74Å; I80-L83 PolarHBondContact O-N 3.13Å; D81-L83 VanDerWaalsContact C-N 3.31Å; D81-L83 PolarHBondContact O-N 3.3Å; L83-E85 VanDerWaalsContact C-N 3.34Å; L83-S87 WeakPolarHBondContact O-CB 3.29Å; L83-S87 PolarHBondContact O-N 3.17Å; L83-S87 VanDerWaalsContact O-N 3.13Å; L83-I94 HydrophobicContact CD2-CD1 4.48Å; L83-E173 HydrophobicContact CD2-CB 3.75Å; L83-E173 HydrophobicContact CD2-CG 3.81Å; L83-L176 HydrophobicContact CD1-CD2 3.65Å; L83-L176 HydrophobicContact CG-CD2 4.38Å; L83-V177 HydrophobicContact CD1-CG2 3.65Å; L83-F368 HydrophobicContact CD1-CE1 3.74Å; L83-F368 HydrophobicContact CD1-CZ 4.11Å; L83-L370 HydrophobicContact CB-CD2 4.4Å; L83-L370 HydrophobicContact CD1-CD1 3.97Å; L83-L370 HydrophobicContact CD1-CD2 3.62Å; L83-L370 HydrophobicContact CD1-CG 4.21Å
84	R	91.5	Very high	92.3	Very high	179 Å²	179	60.5 Å²	60.5	68%	0.675	31%	0.307	S	S	*	.	H	α-helix	trans	-65.8	-38.5	174.2	-172.8	-173.9	-65.8	134.1	5.5	111.9	I80 D81 Y82	I80-R84 PolarHBondContact O-N 3.39Å; D81-R84 PolarHBondContact O-N 2.79Å; D81-R84 VanDerWaalsContact O-N 3.13Å; D81-R84 IonicContact OD1-CZ 3.72Å; D81-R84 IonicContact OD1-NH1 2.87Å; D81-R84 PolarHBondContact OD1-NH1 3.01Å; Y82-R84 VanDerWaalsContact C-N 3.33Å; Y82-R84 PolarHBondContact O-N 3.33Å
85	E	91.2	Very high	92.2	Very high	126 Å²	126	55.7 Å²	55.7	59%	0.589	29%	0.29	S	S	*	.	H	α-helix	trans	-84.3	-34.9	-174.2	-70.7	175.3	-166.6	0	0	113.2	D81 Y82 L83	D81-E85 WeakPolarHBondContact O-CB 3.49Å; D81-E85 WeakPolarHBondContact O-CG 3.43Å; D81-E85 PolarHBondContact O-N 2.93Å; Y82-E85 PolarHBondContact O-N 3.42Å; L83-E85 VanDerWaalsContact C-N 3.34Å
86	H	92.2	Very high	91.9	Very high	92 Å²	92	58.6 Å²	58.6	43%	0.426	31%	0.306	S	S	.	.	H	α-helix	trans	-114.4	-24.7	-169.1	-64.3	-69.3	0	0	0	114.9	Y82 L88 F247	Y82-H86 AromaticContact CD2-CD2 3.41Å; Y82-H86 VanDerWaalsContact CD2-CD2 3.41Å; Y82-H86 WeakPolarHBondContact CD2-CD2 3.35Å; Y82-H86 HydrophobicContact CE1-CB 4.22Å; Y82-H86 HydrophobicContact CE2-CB 4.21Å; Y82-H86 AromaticContact CE2-CD2 3.44Å; Y82-H86 VanDerWaalsContact CE2-CD2 3.44Å; Y82-H86 WeakPolarHBondContact CE2-CD2 3.24Å; Y82-H86 AromaticContact CE2-CG 3.94Å; Y82-H86 WeakPolarHBondContact O-CB 3.35Å; Y82-H86 PolarHBondContact O-CD2 2.73Å; Y82-H86 PolarHBondContact O-N 3.33Å; H86-L88 PolarHBondContact O-N 3.11Å; H86-F247 AromaticContact NE2-CE2 3.79Å
87	S	92.4	Very high	91.8	Very high	20 Å²	20	61.7 Å²	61.7	14%	0.14	32%	0.315	C	S	.	.			trans	-74	124.5	-177.3	176.1	0	0	0	0	111.7	L83 S89 I94	L83-S87 WeakPolarHBondContact O-CB 3.29Å; L83-S87 PolarHBondContact O-N 3.17Å; L83-S87 VanDerWaalsContact O-N 3.13Å; S87-S89 VanDerWaalsContact C-N 3.3Å; S87-S89 PolarHBondContact OG-N 3.41Å; S87-S89 VanDerWaalsContact OG-N 3.1Å; S87-S89 PolarHBondContact OG-O 3.03Å; S87-I94 WeakPolarHBondContact OG-CD1 3.5Å
88	L	91.5	Very high	91.8	Very high	175 Å²	175	59.9 Å²	59.9	92%	0.916	30%	0.3	S	S	*	.			trans	-79.8	-13.9	171.1	-58.7	178.1	0	0	0	112.9	H86	H86-L88 PolarHBondContact O-N 3.11Å
89	S	89.8	Confident	91.6	Very high	26 Å²	26	63.6 Å²	63.6	18%	0.182	32%	0.315	C	S	.	.	S	Bend	trans	-93.4	142.2	-178.9	-68.2	0	0	0	0	111.6	S87 I94 H170	S87-S89 VanDerWaalsContact C-N 3.3Å; S87-S89 PolarHBondContact OG-N 3.41Å; S87-S89 VanDerWaalsContact OG-N 3.1Å; S87-S89 PolarHBondContact OG-O 3.03Å; S89-I94 WeakPolarHBondContact O-CD1 3.49Å; S89-H170 PolarHBondContact OG-CE1 2.81Å
90	P	90.2	Very high	91.4	Very high	85 Å²	85	64.6 Å²	64.6	55%	0.552	32%	0.32	S	S	*	.			trans	-65.5	149.1	174.5	27.1	-33	0	0	0	110.7	K92 A93 I94	P90-K92 PolarHBondContact O-N 2.79Å; P90-A93 HydrophobicContact CG-CB 3.76Å; P90-A93 WeakPolarHBondContact O-CB 3.36Å; P90-A93 PolarHBondContact O-N 3.23Å; P90-I94 PolarHBondContact O-N 2.97Å
91	P	89	Confident	91.3	Very high	71 Å²	71	62.6 Å²	62.6	46%	0.461	31%	0.31	S	S	.	.	H	α-helix	trans	-51.6	-39.7	-173.3	-30.5	35.2	0	0	0	114.3	A93 I94 E95 L370 T371	P91-A93 PolarHBondContact O-N 2.88Å; P91-I94 PolarHBondContact O-N 2.81Å; P91-E95 PolarHBondContact O-N 2.78Å; P91-L370 HydrophobicContact CB-CB 4.4Å; P91-T371 HydrophobicContact CB-CG2 4.37Å
92	K	89.1	Confident	91.2	Very high	110 Å²	110	62 Å²	62	48%	0.478	31%	0.308	S	S	.	.	H	α-helix	trans	-64.7	-39.4	179.2	-173.8	55.2	177.3	140.8	0	112.8	P90 E95 D96	P90-K92 PolarHBondContact O-N 2.79Å; K92-E95 PolarHBondContact O-N 3.47Å; K92-D96 VanDerWaalsContact CE-OD2 3.3Å; K92-D96 WeakPolarHBondContact CE-OD2 3.41Å; K92-D96 IonicContact NZ-OD1 2.84Å; K92-D96 PolarHBondContact NZ-OD1 3.01Å; K92-D96 IonicContact NZ-OD2 3.1Å; K92-D96 PolarHBondContact NZ-OD2 3.44Å; K92-D96 VanDerWaalsContact NZ-OD2 3.1Å; K92-D96 PolarHBondContact O-N 3.25Å
93	A	90.8	Very high	91.1	Very high	30 Å²	30	64.2 Å²	64.2	25%	0.248	32%	0.322	C	S	.	.	H	α-helix	trans	-69.3	-38.9	178.2	0	0	0	0	0	111.9	P90 P91 D96 R97	P90-A93 HydrophobicContact CG-CB 3.76Å; P90-A93 WeakPolarHBondContact O-CB 3.36Å; P90-A93 PolarHBondContact O-N 3.23Å; P91-A93 PolarHBondContact O-N 2.88Å; A93-D96 PolarHBondContact O-N 2.79Å; A93-R97 WeakPolarHBondContact O-CB 3.22Å; A93-R97 WeakPolarHBondContact O-CG 3.32Å; A93-R97 PolarHBondContact O-N 3.3Å
94	I	91.9	Very high	90.8	Very high	4 Å²	4	63.8 Å²	63.8	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-47.1	173.8	-54.2	173.2	0	0	0	109.7	L83 S87 S89 P90 P91 D96 R97 S98 L174 V177 L370	L83-I94 HydrophobicContact CD2-CD1 4.48Å; S87-I94 WeakPolarHBondContact OG-CD1 3.5Å; S89-I94 WeakPolarHBondContact O-CD1 3.49Å; P90-I94 PolarHBondContact O-N 2.97Å; P91-I94 PolarHBondContact O-N 2.81Å; I94-D96 PolarHBondContact O-N 3.09Å; I94-R97 PolarHBondContact O-N 3.24Å; I94-S98 WeakPolarHBondContact O-CB 3.15Å; I94-S98 PolarHBondContact O-N 2.76Å; I94-S98 PolarHBondContact O-OG 2.97Å; I94-L174 HydrophobicContact CB-CD2 4.49Å; I94-L174 HydrophobicContact CG2-CD2 3.88Å; I94-V177 HydrophobicContact CG2-CB 4.24Å; I94-V177 HydrophobicContact CG2-CG2 3.54Å; I94-L370 HydrophobicContact CB-CD1 4.43Å; I94-L370 HydrophobicContact CD1-CD1 4.5Å; I94-L370 HydrophobicContact CG2-CD1 4.35Å
95	E	89.6	Confident	90.8	Very high	34 Å²	34	55.5 Å²	55.5	16%	0.159	29%	0.289	C	S	.	.	H	α-helix	trans	-59.3	-45.9	-179.8	-161.7	-161.4	131.6	0	0	111.6	P91 K92 S98 K99 T371	P91-E95 PolarHBondContact O-N 2.78Å; K92-E95 PolarHBondContact O-N 3.47Å; E95-S98 PolarHBondContact O-N 2.94Å; E95-S98 PolarHBondContact O-OG 2.86Å; E95-K99 PolarHBondContact O-N 3.29Å; E95-K99 IonicContact OE1-NZ 3.06Å; E95-K99 PolarHBondContact OE1-NZ 3.14Å; E95-T371 PolarHBondContact OE2-OG1 3.26Å; E95-T371 VanDerWaalsContact OE2-OG1 3.09Å
96	D	89.6	Confident	90.8	Very high	63 Å²	63	54.2 Å²	54.2	34%	0.337	28%	0.279	S	S	.	.	H	α-helix	trans	-71.4	-38.8	-178	-65.4	-25.3	0	0	0	112.1	K92 A93 I94 S98 K99	K92-D96 VanDerWaalsContact CE-OD2 3.3Å; K92-D96 WeakPolarHBondContact CE-OD2 3.41Å; K92-D96 IonicContact NZ-OD1 2.84Å; K92-D96 PolarHBondContact NZ-OD1 3.01Å; K92-D96 IonicContact NZ-OD2 3.1Å; K92-D96 PolarHBondContact NZ-OD2 3.44Å; K92-D96 VanDerWaalsContact NZ-OD2 3.1Å; K92-D96 PolarHBondContact O-N 3.25Å; A93-D96 PolarHBondContact O-N 2.79Å; I94-D96 PolarHBondContact O-N 3.09Å; D96-S98 VanDerWaalsContact C-N 3.34Å; D96-K99 PolarHBondContact O-N 2.89Å; D96-K99 IonicContact OD1-NZ 3.21Å; D96-K99 PolarHBondContact OD1-NZ 3.38Å
97	R	92.2	Very high	90.5	Very high	99 Å²	99	52.1 Å²	52.1	37%	0.374	27%	0.274	S	S	.	.	H	α-helix	trans	-67.9	-32	172.3	-71.5	179.3	-178.3	-179.7	1.5	112.8	A93 I94 K99 I100 L101 L142 H170 L174	A93-R97 WeakPolarHBondContact O-CB 3.22Å; A93-R97 WeakPolarHBondContact O-CG 3.32Å; A93-R97 PolarHBondContact O-N 3.3Å; I94-R97 PolarHBondContact O-N 3.24Å; R97-K99 VanDerWaalsContact C-N 3.3Å; R97-K99 PolarHBondContact O-N 3.47Å; R97-I100 WeakPolarHBondContact O-CB 3.25Å; R97-I100 PolarHBondContact O-N 2.88Å; R97-L101 PolarHBondContact O-N 3.01Å; R97-L101 VanDerWaalsContact O-N 3.07Å; R97-L142 HydrophobicContact CG-CD2 4.26Å; R97-H170 PolarHBondContact NH1-NE2 2.95Å; R97-L174 HydrophobicContact CB-CD1 3.94Å; R97-L174 HydrophobicContact CB-CD2 3.51Å; R97-L174 HydrophobicContact CB-CG 4.39Å
98	S	92.3	Very high	90.3	Very high	7 Å²	7	51.3 Å²	51.3	5%	0.049	27%	0.268	C	S	.	.	H	α-helix	trans	-65.4	-34.3	177.7	78.2	0	0	0	0	111.9	I94 E95 D96 I100 L101 T102	I94-S98 WeakPolarHBondContact O-CB 3.15Å; I94-S98 PolarHBondContact O-N 2.76Å; I94-S98 PolarHBondContact O-OG 2.97Å; E95-S98 PolarHBondContact O-N 2.94Å; E95-S98 PolarHBondContact O-OG 2.86Å; D96-S98 VanDerWaalsContact C-N 3.34Å; S98-I100 VanDerWaalsContact C-N 3.34Å; S98-I100 PolarHBondContact O-N 2.81Å; S98-L101 PolarHBondContact O-N 3.45Å; S98-T102 PolarHBondContact O-N 3.36Å; S98-T102 PolarHBondContact O-OG1 3.09Å; S98-T102 VanDerWaalsContact O-OG1 3.08Å
99	K	90.3	Very high	90.1	Very high	84 Å²	84	43.7 Å²	43.7	37%	0.365	23%	0.229	S	C	.	.	H	α-helix	trans	-63.5	-40.8	174.4	-68	165.2	-169	153.1	0	111.6	E95 D96 R97 L101 T102 N103	E95-K99 PolarHBondContact O-N 3.29Å; E95-K99 IonicContact OE1-NZ 3.06Å; E95-K99 PolarHBondContact OE1-NZ 3.14Å; D96-K99 PolarHBondContact O-N 2.89Å; D96-K99 IonicContact OD1-NZ 3.21Å; D96-K99 PolarHBondContact OD1-NZ 3.38Å; R97-K99 VanDerWaalsContact C-N 3.3Å; R97-K99 PolarHBondContact O-N 3.47Å; K99-L101 VanDerWaalsContact C-N 3.34Å; K99-T102 WeakPolarHBondContact O-CB 3.37Å; K99-T102 PolarHBondContact O-N 2.81Å; K99-N103 PolarHBondContact O-N 3.28Å
100	I	90.4	Very high	89.9	Confident	22 Å²	22	43.8 Å²	43.8	11%	0.113	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-45.4	175	-65	168.8	0	0	0	110.1	R97 S98 T102 N103 Y104 A141 L142 F145 T146	R97-I100 WeakPolarHBondContact O-CB 3.25Å; R97-I100 PolarHBondContact O-N 2.88Å; S98-I100 VanDerWaalsContact C-N 3.34Å; S98-I100 PolarHBondContact O-N 2.81Å; I100-T102 PolarHBondContact O-N 3.3Å; I100-N103 PolarHBondContact O-N 2.67Å; I100-Y104 PolarHBondContact O-N 3.46Å; I100-A141 HydrophobicContact CG2-CB 4.27Å; I100-L142 HydrophobicContact CD1-CD2 3.93Å; I100-L142 HydrophobicContact CG2-CD2 4.25Å; I100-F145 HydrophobicContact CG2-CB 3.88Å; I100-T146 HydrophobicContact CD1-CG2 3.67Å
101	L	91.7	Very high	89.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.8	-42.4	175.7	-179.2	62.3	0	0	0	112	R97 S98 K99 N103 Y104 L105 L165 L174	R97-L101 PolarHBondContact O-N 3.01Å; R97-L101 VanDerWaalsContact O-N 3.07Å; S98-L101 PolarHBondContact O-N 3.45Å; K99-L101 VanDerWaalsContact C-N 3.34Å; L101-N103 PolarHBondContact O-N 3.42Å; L101-Y104 HydrophobicContact CD1-CD1 4.49Å; L101-Y104 WeakPolarHBondContact O-CB 3.34Å; L101-Y104 PolarHBondContact O-N 2.78Å; L101-L105 HydrophobicContact CD1-CD1 4.35Å; L101-L105 HydrophobicContact CD1-CG 4.19Å; L101-L105 HydrophobicContact CG-CD1 4.11Å; L101-L105 HydrophobicContact CG-CG 4.38Å; L101-L105 WeakPolarHBondContact O-CG 3.5Å; L101-L105 PolarHBondContact O-N 2.83Å; L101-L165 HydrophobicContact CD1-CD1 3.91Å; L101-L165 HydrophobicContact CD1-CD2 4.3Å; L101-L174 HydrophobicContact CD2-CB 3.67Å
102	T	92	Very high	89	Confident	37 Å²	37	40 Å²	40	23%	0.227	20%	0.203	C	C	.	.	H	α-helix	trans	-56.1	-49.4	174.4	-60.9	0	0	0	0	111.3	S98 K99 I100 Y104 L105 W106 S178	S98-T102 PolarHBondContact O-N 3.36Å; S98-T102 PolarHBondContact O-OG1 3.09Å; S98-T102 VanDerWaalsContact O-OG1 3.08Å; K99-T102 WeakPolarHBondContact O-CB 3.37Å; K99-T102 PolarHBondContact O-N 2.81Å; I100-T102 PolarHBondContact O-N 3.3Å; T102-Y104 VanDerWaalsContact C-N 3.29Å; T102-Y104 PolarHBondContact O-N 2.87Å; T102-L105 PolarHBondContact O-N 2.87Å; T102-W106 VanDerWaalsContact O-CB 3.32Å; T102-W106 WeakPolarHBondContact O-CB 3.43Å; T102-W106 PolarHBondContact O-N 2.88Å; T102-S178 WeakPolarHBondContact OG1-CB 3.46Å
103	N	90.6	Very high	88.3	Confident	74 Å²	74	39 Å²	39	40%	0.396	20%	0.201	S	C	.	.	H	α-helix	trans	-62.4	-39.3	179.5	-69.1	-10.8	0	0	0	111.6	K99 I100 L101 W106 S107 F145	K99-N103 PolarHBondContact O-N 3.28Å; I100-N103 PolarHBondContact O-N 2.67Å; L101-N103 PolarHBondContact O-N 3.42Å; N103-W106 PolarHBondContact O-N 2.87Å; N103-S107 WeakPolarHBondContact O-CB 3.37Å; N103-S107 PolarHBondContact O-N 2.81Å; N103-S107 PolarHBondContact O-OG 2.7Å; N103-F145 HydrophobicContact CB-CD1 3.89Å
104	Y	88.9	Confident	87.2	Confident	1 Å²	1	39.6 Å²	39.6	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-51.5	175.3	-179	-116.5	0	0	0	112	I100 L101 T102 W106 S107 R108 F140 A141 F145 S161 K163 L165	I100-Y104 PolarHBondContact O-N 3.46Å; L101-Y104 HydrophobicContact CD1-CD1 4.49Å; L101-Y104 WeakPolarHBondContact O-CB 3.34Å; L101-Y104 PolarHBondContact O-N 2.78Å; T102-Y104 VanDerWaalsContact C-N 3.29Å; T102-Y104 PolarHBondContact O-N 2.87Å; Y104-W106 VanDerWaalsContact C-N 3.3Å; Y104-W106 PolarHBondContact O-N 2.84Å; Y104-S107 PolarHBondContact O-N 3.15Å; Y104-S107 PolarHBondContact O-OG 3.21Å; Y104-R108 PolarHBondContact O-N 3.1Å; Y104-R108 PolarHBondContact OH-NH1 2.74Å; Y104-F140 HydrophobicContact CD2-CD1 4.31Å; Y104-F140 AromaticContact CE2-CD1 3.61Å; Y104-F140 HydrophobicContact CE2-CD1 3.61Å; Y104-F140 AromaticContact CE2-CE1 3.87Å; Y104-F140 HydrophobicContact CE2-CE1 3.87Å; Y104-A141 HydrophobicContact CD1-CB 4.04Å; Y104-A141 HydrophobicContact CD2-CB 3.98Å; Y104-A141 HydrophobicContact CG-CB 3.6Å; Y104-F145 HydrophobicContact CD2-CD2 4.2Å; Y104-F145 AromaticContact CD2-CE2 3.57Å; Y104-F145 HydrophobicContact CD2-CE2 3.57Å; Y104-F145 AromaticContact CD2-CZ 3.98Å; Y104-F145 HydrophobicContact CD2-CZ 3.98Å; Y104-F145 HydrophobicContact CE2-CE2 4.33Å; Y104-S161 WeakPolarHBondContact CE2-O 3.43Å; Y104-S161 PolarHBondContact OH-O 2.84Å; Y104-K163 PolarHBondContact OH-N 2.99Å; Y104-K163 PolarHBondContact OH-O 3.47Å; Y104-L165 HydrophobicContact CD1-CD1 4.47Å; Y104-L165 HydrophobicContact CD1-CD2 4.47Å; Y104-L165 HydrophobicContact CE1-CD1 4.41Å; Y104-L165 HydrophobicContact CE1-CD2 4.21Å; Y104-L165 HydrophobicContact CE1-CG 4.19Å
105	L	91.5	Very high	86.1	Confident	6 Å²	6	42.1 Å²	42.1	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-60.3	-39.7	177.9	-69.3	175.5	0	0	0	111.7	L101 T102 S107 R108 L165 Y175 R179 Q316	L101-L105 HydrophobicContact CD1-CD1 4.35Å; L101-L105 HydrophobicContact CD1-CG 4.19Å; L101-L105 HydrophobicContact CG-CD1 4.11Å; L101-L105 HydrophobicContact CG-CG 4.38Å; L101-L105 WeakPolarHBondContact O-CG 3.5Å; L101-L105 PolarHBondContact O-N 2.83Å; T102-L105 PolarHBondContact O-N 2.87Å; L105-S107 VanDerWaalsContact C-N 3.35Å; L105-R108 WeakPolarHBondContact O-CB 3.42Å; L105-R108 PolarHBondContact O-N 3.31Å; L105-L165 HydrophobicContact CD2-CD1 3.74Å; L105-Y175 HydrophobicContact CD1-CD2 4Å; L105-Y175 HydrophobicContact CD1-CE2 3.95Å; L105-R179 HydrophobicContact CD1-CG 3.92Å; L105-Q316 PolarHBondContact O-NE2 3.36Å
106	W	89.8	Confident	84.8	Confident	99 Å²	99	42.4 Å²	42.4	38%	0.375	22%	0.224	S	C	.	.	H	α-helix	trans	-65.2	-38	176.8	-174.2	-90.8	0	0	0	112.5	T102 N103 Y104 R108 Q316 T318 E380 L381	T102-W106 VanDerWaalsContact O-CB 3.32Å; T102-W106 WeakPolarHBondContact O-CB 3.43Å; T102-W106 PolarHBondContact O-N 2.88Å; N103-W106 PolarHBondContact O-N 2.87Å; Y104-W106 VanDerWaalsContact C-N 3.3Å; Y104-W106 PolarHBondContact O-N 2.84Å; W106-R108 PolarHBondContact O-N 3.05Å; W106-Q316 HydrophobicContact CE3-CB 4.27Å; W106-Q316 HydrophobicContact CE3-CG 4.4Å; W106-Q316 VanDerWaalsContact CE3-OE1 3.27Å; W106-Q316 HydrophobicContact CZ3-CB 4.42Å; W106-T318 HydrophobicContact CD2-CG2 3.62Å; W106-T318 VanDerWaalsContact CE2-CG2 3.49Å; W106-T318 HydrophobicContact CE3-CG2 4.07Å; W106-T318 HydrophobicContact CG-CG2 4.03Å; W106-T318 HydrophobicContact CH2-CG2 4.35Å; W106-T318 HydrophobicContact CZ2-CG2 3.89Å; W106-T318 HydrophobicContact CZ3-CG2 4.39Å; W106-T318 WeakPolarHBondContact O-CG2 3.29Å; W106-E380 VanDerWaalsContact CZ3-OE1 3.25Å; W106-E380 WeakPolarHBondContact CZ3-OE1 3.31Å; W106-L381 HydrophobicContact CH2-CB 3.88Å; W106-L381 HydrophobicContact CH2-CD1 4.04Å; W106-L381 HydrophobicContact CH2-CG 4.29Å; W106-L381 HydrophobicContact CZ2-CD1 4.36Å
107	S	87.9	Confident	83.6	Confident	48 Å²	48	44.7 Å²	44.7	34%	0.336	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-2.8	179.3	75.2	0	0	0	0	114.6	N103 Y104 L105 F145	N103-S107 WeakPolarHBondContact O-CB 3.37Å; N103-S107 PolarHBondContact O-N 2.81Å; N103-S107 PolarHBondContact O-OG 2.7Å; Y104-S107 PolarHBondContact O-N 3.15Å; Y104-S107 PolarHBondContact O-OG 3.21Å; L105-S107 VanDerWaalsContact C-N 3.35Å; S107-F145 WeakPolarHBondContact OG-CE1 3.49Å; S107-F145 WeakPolarHBondContact OG-CZ 3.37Å
108	R	86.7	Confident	82.3	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.008	25%	0.249	C	C	.	.			trans	-59.8	126.7	-172.6	-82.9	-163.7	-179.8	-76.2	15.3	112	Y104 L105 W106 K163 E289 S320	Y104-R108 PolarHBondContact O-N 3.1Å; Y104-R108 PolarHBondContact OH-NH1 2.74Å; L105-R108 WeakPolarHBondContact O-CB 3.42Å; L105-R108 PolarHBondContact O-N 3.31Å; W106-R108 PolarHBondContact O-N 3.05Å; R108-K163 PolarHBondContact NH1-O 2.99Å; R108-K163 PolarHBondContact NH2-O 2.93Å; R108-E289 WeakPolarHBondContact CD-OE1 3.27Å; R108-E289 IonicContact CZ-OE1 3.44Å; R108-E289 IonicContact CZ-OE2 3.32Å; R108-E289 IonicContact NE-OE1 2.92Å; R108-E289 PolarHBondContact NE-OE1 2.91Å; R108-E289 IonicContact NE-OE2 2.72Å; R108-E289 PolarHBondContact NE-OE2 2.88Å; R108-E289 IonicContact NH2-OE1 3.94Å; R108-E289 PolarHBondContact NH2-OE1 3.29Å; R108-E289 IonicContact NH2-OE2 3.02Å; R108-E289 PolarHBondContact NH2-OE2 3.44Å; R108-S320 WeakPolarHBondContact O-CB 3.28Å; R108-S320 PolarHBondContact O-OG 2.8Å
109	P	86.9	Confident	80.8	Confident	15 Å²	15	51.7 Å²	51.7	10%	0.097	26%	0.262	C	S	.	.			trans	-78.9	150.4	173.7	33.6	-36.4	0	0	0	111	I111 W162 S320	P109-I111 PolarHBondContact O-N 3.3Å; P109-W162 HydrophobicContact CG-CB 3.98Å; P109-S320 WeakPolarHBondContact CA-OG 3.38Å
110	L	87.5	Confident	79.3	Confident	29 Å²	29	51 Å²	51	15%	0.152	27%	0.268	C	S	.	.			trans	-78.3	114	162.8	-176.1	67.8	0	0	0	109	L288 R296 S320 Q323 A324	L110-L288 HydrophobicContact CB-CD2 4.12Å; L110-L288 HydrophobicContact CD1-CD2 3.95Å; L110-R296 VanDerWaalsContact CD1-CZ 3.45Å; L110-S320 PolarHBondContact N-OG 3.08Å; L110-Q323 HydrophobicContact CD2-CB 3.64Å; L110-A324 HydrophobicContact CD1-CB 3.92Å; L110-A324 HydrophobicContact CD2-CB 4.41Å
111	I	81.9	Confident	77.7	Confident	18 Å²	18	53.3 Å²	53.3	9%	0.092	29%	0.287	C	S	.	.			trans	-82.2	136	-178.4	-56.9	164.8	0	0	0	111.5	P109 K115 V116 W162 P291 R296	P109-I111 PolarHBondContact O-N 3.3Å; I111-K115 HydrophobicContact CG2-CB 3.85Å; I111-V116 HydrophobicContact CG2-CG2 3.47Å; I111-V116 VanDerWaalsContact CG2-CG2 3.47Å; I111-W162 HydrophobicContact CD1-CB 3.64Å; I111-W162 VanDerWaalsContact CD1-CD1 3.46Å; I111-W162 HydrophobicContact CD1-CD2 3.1Å; I111-W162 HydrophobicContact CD1-CE3 3.54Å; I111-W162 HydrophobicContact CD1-CG 3.12Å; I111-W162 HydrophobicContact CD1-CZ2 4.25Å; I111-W162 HydrophobicContact CD1-CZ3 4.29Å; I111-W162 HydrophobicContact CG1-CB 4.03Å; I111-W162 HydrophobicContact CG1-CD2 4.24Å; I111-W162 HydrophobicContact CG1-CG 3.77Å; I111-P291 VanDerWaalsContact CB-O 3.23Å; I111-P291 WeakPolarHBondContact CB-O 3.38Å; I111-P291 WeakPolarHBondContact CG2-O 3.1Å; I111-R296 PolarHBondContact O-NH1 3.11Å; I111-R296 PolarHBondContact O-NH2 3.24Å
112	S	78.1	Confident	75.8	Confident	59 Å²	59	60.3 Å²	60.3	41%	0.413	32%	0.317	S	S	.	.			trans	-94.4	157.7	169.4	66.1	0	0	0	0	112.3	G114 K115 V116	S112-G114 VanDerWaalsContact C-N 3.33Å; S112-G114 PolarHBondContact O-N 3.37Å; S112-K115 WeakPolarHBondContact O-CB 3.3Å; S112-K115 PolarHBondContact O-N 3.34Å; S112-V116 PolarHBondContact O-N 3.5Å
113	E	73.8	Confident	73.9	Confident	89 Å²	89	63.1 Å²	63.1	42%	0.416	33%	0.33	S	S	.	.	H	α-helix	trans	-57.1	-42.8	-177.4	-62.3	-173.4	155.3	0	0	113.3	K115 V116 I117 C292 K293 S294	E113-K115 PolarHBondContact O-N 3.04Å; E113-V116 WeakPolarHBondContact O-CB 3.3Å; E113-V116 PolarHBondContact O-N 3.27Å; E113-I117 WeakPolarHBondContact O-CG1 3.32Å; E113-I117 PolarHBondContact O-N 3.02Å; E113-C292 HydrophobicContact CG-CB 4.46Å; E113-K293 HydrophobicContact CG-CB 4.06Å; E113-S294 WeakPolarHBondContact OE1-CB 3.37Å; E113-S294 PolarHBondContact OE1-N 3.16Å; E113-S294 VanDerWaalsContact OE1-N 3.15Å; E113-S294 PolarHBondContact OE1-OG 2.94Å
114	G	68.5	Low	71.6	Confident	42 Å²	42	66.8 Å²	66.8	43%	0.433	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-30.8	177.2	0	0	0	0	0	113.5	S112 R118	S112-G114 VanDerWaalsContact C-N 3.33Å; S112-G114 PolarHBondContact O-N 3.37Å; G114-R118 WeakPolarHBondContact O-CG 3.43Å; G114-R118 PolarHBondContact O-N 3.35Å
115	K	67.4	Low	69.1	Low	57 Å²	57	73.9 Å²	73.9	25%	0.248	38%	0.382	C	S	.	.	H	α-helix	trans	-72.5	-35.9	173.3	-76	-172.1	174.6	-164.9	0	111.5	I111 S112 E113 K119 D158 L159	I111-K115 HydrophobicContact CG2-CB 3.85Å; S112-K115 WeakPolarHBondContact O-CB 3.3Å; S112-K115 PolarHBondContact O-N 3.34Å; E113-K115 PolarHBondContact O-N 3.04Å; K115-K119 PolarHBondContact O-N 2.86Å; K115-D158 PolarHBondContact NZ-O 3.43Å; K115-D158 IonicContact NZ-OD1 2.69Å; K115-D158 IonicContact NZ-OD2 3.63Å; K115-D158 PolarHBondContact NZ-OD2 3.33Å; K115-L159 HydrophobicContact CG-CD2 4.3Å
116	V	63.2	Low	66.5	Low	39 Å²	39	77.3 Å²	77.3	24%	0.236	41%	0.407	C	S	.	.	H	α-helix	trans	-64.9	-50.3	175.9	-178.3	0	0	0	0	111.3	I111 S112 E113 R118 K119 S120 P291 C292	I111-V116 HydrophobicContact CG2-CG2 3.47Å; I111-V116 VanDerWaalsContact CG2-CG2 3.47Å; S112-V116 PolarHBondContact O-N 3.5Å; E113-V116 WeakPolarHBondContact O-CB 3.3Å; E113-V116 PolarHBondContact O-N 3.27Å; V116-R118 VanDerWaalsContact C-N 3.33Å; V116-R118 PolarHBondContact O-N 3.33Å; V116-K119 WeakPolarHBondContact O-CA 3.36Å; V116-K119 WeakPolarHBondContact O-CB 3.25Å; V116-K119 PolarHBondContact O-N 2.81Å; V116-S120 PolarHBondContact O-N 2.87Å; V116-S120 PolarHBondContact O-OG 2.92Å; V116-P291 WeakPolarHBondContact CG2-O 3.41Å; V116-C292 HydrophobicContact CG2-CB 4.01Å
117	I	64.4	Low	63.5	Low	111 Å²	111	83 Å²	83	57%	0.569	43%	0.428	S	S	*	.	H	α-helix	trans	-56.9	-47.4	-178.7	-64.5	167.9	0	0	0	110.5	E113 K119 S120 S121	E113-I117 WeakPolarHBondContact O-CG1 3.32Å; E113-I117 PolarHBondContact O-N 3.02Å; I117-K119 PolarHBondContact O-N 3.37Å; I117-S120 PolarHBondContact O-N 2.9Å; I117-S121 PolarHBondContact O-N 3.32Å; I117-S121 VanDerWaalsContact O-N 3.07Å; I117-S121 PolarHBondContact O-OG 3.35Å; I117-S121 VanDerWaalsContact O-OG 3.14Å
118	R	64.7	Low	60.8	Low	176 Å²	176	88.2 Å²	88.2	66%	0.664	45%	0.452	S	S	*	.	H	α-helix	trans	-59.5	-28.1	176	-73.4	178.3	-176.1	179.5	1.8	113.6	G114 V116 K122	G114-R118 WeakPolarHBondContact O-CG 3.43Å; G114-R118 PolarHBondContact O-N 3.35Å; V116-R118 VanDerWaalsContact C-N 3.33Å; V116-R118 PolarHBondContact O-N 3.33Å; R118-K122 WeakPolarHBondContact O-CG 3.14Å
119	K	61.3	Low	58.2	Low	77 Å²	77	96 Å²	96	34%	0.335	49%	0.493	S	S	.	.	H	α-helix	trans	-80.4	-45.2	177.5	-167.8	179.4	-179.7	-174.4	0	111.1	K115 V116 I117 S121 K122 I123 W162	K115-K119 PolarHBondContact O-N 2.86Å; V116-K119 WeakPolarHBondContact O-CA 3.36Å; V116-K119 WeakPolarHBondContact O-CB 3.25Å; V116-K119 PolarHBondContact O-N 2.81Å; I117-K119 PolarHBondContact O-N 3.37Å; K119-S121 VanDerWaalsContact C-N 3.27Å; K119-S121 PolarHBondContact O-N 3.3Å; K119-K122 PolarHBondContact O-N 3.02Å; K119-I123 HydrophobicContact CG-CD1 4.03Å; K119-I123 WeakPolarHBondContact O-CG1 3.42Å; K119-I123 PolarHBondContact O-N 3.45Å; K119-I123 VanDerWaalsContact O-N 3.09Å; K119-W162 PolarHBondContact NZ-O 3.12Å
120	S	58.6	Low	55.6	Low	70 Å²	70	102.3 Å²	102.3	49%	0.49	53%	0.527	S	S	.	.	H	α-helix	trans	-57.5	-39.9	176.1	-59.9	0	0	0	0	112.1	V116 I117 K122 I123	V116-S120 PolarHBondContact O-N 2.87Å; V116-S120 PolarHBondContact O-OG 2.92Å; I117-S120 PolarHBondContact O-N 2.9Å; S120-K122 VanDerWaalsContact C-N 3.29Å; S120-K122 PolarHBondContact O-N 3.35Å; S120-I123 PolarHBondContact O-N 2.76Å
121	S	56	Low	53.1	Low	71 Å²	71	105.8 Å²	105.8	50%	0.497	55%	0.553	S	S	.	*	H	α-helix	trans	-66.7	-25.7	175.3	-54.3	0	0	0	0	114.1	I117 K119	I117-S121 PolarHBondContact O-N 3.32Å; I117-S121 VanDerWaalsContact O-N 3.07Å; I117-S121 PolarHBondContact O-OG 3.35Å; I117-S121 VanDerWaalsContact O-OG 3.14Å; K119-S121 VanDerWaalsContact C-N 3.27Å; K119-S121 PolarHBondContact O-N 3.3Å
122	K	52.8	Low	51.2	Low	147 Å²	147	110 Å²	110	64%	0.639	58%	0.583	S	S	*	*	H	α-helix	trans	-86.7	-28.2	178.9	-74.6	-177.4	178.4	-168.9	0	113.6	R118 K119 S120 Q124 D125	R118-K122 WeakPolarHBondContact O-CG 3.14Å; K119-K122 PolarHBondContact O-N 3.02Å; S120-K122 VanDerWaalsContact C-N 3.29Å; S120-K122 PolarHBondContact O-N 3.35Å; K122-Q124 PolarHBondContact O-N 2.88Å; K122-D125 PolarHBondContact O-N 2.98Å
123	I	50.8	Low	49.9	Very low	96 Å²	96	115.2 Å²	115.2	49%	0.492	61%	0.606	S	S	.	*	H	α-helix	trans	-70.9	-25.7	178.3	-68.5	166.4	0	0	0	110.8	K119 S120 D125 S126	K119-I123 HydrophobicContact CG-CD1 4.03Å; K119-I123 WeakPolarHBondContact O-CG1 3.42Å; K119-I123 PolarHBondContact O-N 3.45Å; K119-I123 VanDerWaalsContact O-N 3.09Å; S120-I123 PolarHBondContact O-N 2.76Å; I123-D125 PolarHBondContact O-N 3.1Å; I123-D125 VanDerWaalsContact O-N 3.11Å; I123-S126 PolarHBondContact O-N 2.64Å; I123-S126 VanDerWaalsContact O-N 3.11Å
124	Q	42.9	Very low	49.6	Very low	150 Å²	150	117.3 Å²	117.3	70%	0.701	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-16.7	176.1	-143.4	167.3	-2.7	0	0	113.2	K122	K122-Q124 PolarHBondContact O-N 2.88Å
125	D	37.4	Very low	49.9	Very low	151 Å²	151	115.4 Å²	115.4	81%	0.807	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	5.4	177.5	-69.4	-24.7	0	0	0	114.1	K122 I123	K122-D125 PolarHBondContact O-N 2.98Å; I123-D125 PolarHBondContact O-N 3.1Å; I123-D125 VanDerWaalsContact O-N 3.11Å
126	S	35.1	Very low	50.5	Low	78 Å²	78	118.9 Å²	118.9	55%	0.545	61%	0.613	S	S	.	*			trans	-133.9	85.6	-176.2	173.3	0	0	0	0	110.2	I123	I123-S126 PolarHBondContact O-N 2.64Å; I123-S126 VanDerWaalsContact O-N 3.11Å
127	W	28.3	Very low	51.1	Low	217 Å²	217	117 Å²	117	82%	0.822	60%	0.602	S	S	*	*			trans	-104.4	73.9	167.3	-70.7	-9.8	0	0	0	109.6
128	D	31.3	Very low	51.9	Low	158 Å²	158	112.2 Å²	112.2	85%	0.845	58%	0.577	S	S	*	*			trans	-101	91.2	158.4	-74.8	-34.1	0	0	0	107.1	D130	D128-D130 PolarHBondContact O-N 3.01Å
129	L	30.4	Very low	52.7	Low	166 Å²	166	105.4 Å²	105.4	87%	0.869	56%	0.555	S	S	*	*			trans	-88	87.2	169.4	-106	149.7	0	0	0	106.7
130	D	32.6	Very low	53.6	Low	148 Å²	148	102.7 Å²	102.7	79%	0.791	54%	0.544	S	S	*	.			trans	-145.2	117.1	166.2	-135.1	-4.3	0	0	0	114.2	D128	D128-D130 PolarHBondContact O-N 3.01Å
131	S	36.6	Very low	54.5	Low	102 Å²	102	99.4 Å²	99.4	71%	0.713	52%	0.52	S	S	*	.			trans	73.5	134.1	148.1	77	0	0	0	0	121.8
132	C	40.6	Very low	55.7	Low	107 Å²	107	98.4 Å²	98.4	72%	0.723	51%	0.509	S	S	*	.			trans	72.4	136.7	167.3	-87.9	0	0	0	0	118.8	E134	C132-E134 HydrophobicContact CB-CG 4.23Å; C132-E134 PolarHBondContact O-N 3.26Å
133	D	52.3	Low	57	Low	167 Å²	167	98.8 Å²	98.8	89%	0.893	51%	0.511	S	S	*	.			trans	-60.4	33.5	172.4	-75.4	-46.5	0	0	0	114
134	E	65.5	Low	58.1	Low	133 Å²	133	96.8 Å²	96.8	62%	0.621	50%	0.501	S	S	*	.			trans	-80.2	127.8	177.4	-69.3	-169.2	178.1	0	0	110.3	C132 E136 V139	C132-E134 HydrophobicContact CB-CG 4.23Å; C132-E134 PolarHBondContact O-N 3.26Å; E134-E136 PolarHBondContact O-N 2.89Å; E134-V139 HydrophobicContact CB-CG2 3.84Å; E134-V139 WeakPolarHBondContact OE2-CG2 3.08Å
135	D	75.3	Confident	59.7	Low	3 Å²	3	91 Å²	91	2%	0.016	47%	0.474	C	S	.	.			trans	-66.3	106.5	174.6	-178	-31.4	0	0	0	109.2	G137 L138 V139 L165 S166 Y167 T171	D135-G137 PolarHBondContact O-N 2.97Å; D135-G137 VanDerWaalsContact O-N 3.12Å; D135-G137 WeakPolarHBondContact OD1-CA 3.43Å; D135-G137 PolarHBondContact OD1-N 3.2Å; D135-L138 HydrophobicContact CB-CB 3.76Å; D135-L138 CarbonylContact O-C 3.56Å; D135-L138 WeakPolarHBondContact O-CA 3.07Å; D135-L138 WeakPolarHBondContact O-CB 3.47Å; D135-L138 PolarHBondContact O-N 3.11Å; D135-L138 PolarHBondContact OD1-N 3.34Å; D135-L138 VanDerWaalsContact OD1-N 3.11Å; D135-V139 WeakPolarHBondContact O-CG2 3.44Å; D135-V139 PolarHBondContact O-N 3.36Å; D135-L165 WeakPolarHBondContact OD1-CA 3.44Å; D135-L165 WeakPolarHBondContact OD1-CD2 3.31Å; D135-S166 WeakPolarHBondContact CA-OG 3.4Å; D135-S166 VanDerWaalsContact CB-OG 3.28Å; D135-S166 WeakPolarHBondContact CB-OG 3.17Å; D135-S166 VanDerWaalsContact CG-N 3.29Å; D135-S166 PolarHBondContact OD1-N 2.82Å; D135-S166 PolarHBondContact OD2-N 2.81Å; D135-S166 PolarHBondContact OD2-OG 2.86Å; D135-Y167 PolarHBondContact OD2-N 2.86Å; D135-T171 WeakPolarHBondContact CB-OG1 3.27Å; D135-T171 WeakPolarHBondContact OD2-CG2 3.48Å; D135-T171 PolarHBondContact OD2-OG1 2.91Å
136	E	80	Confident	61.1	Low	129 Å²	129	88.2 Å²	88.2	60%	0.603	46%	0.462	S	S	*	.	H	α-helix	trans	-53.5	-35.7	-178.5	-76.9	-167	-149.7	0	0	113.5	E134 F140 K163	E134-E136 PolarHBondContact O-N 2.89Å; E136-F140 WeakPolarHBondContact O-CB 3.32Å; E136-F140 PolarHBondContact O-N 2.9Å; E136-K163 HydrophobicContact CB-CD 4.26Å; E136-K163 IonicContact OE2-NZ 3.54Å; E136-K163 PolarHBondContact OE2-NZ 2.91Å
137	G	77.5	Confident	62.3	Low	0 Å²	0	87.9 Å²	87.9	0%	0	46%	0.46	C	S	.	.	H	α-helix	trans	-67.6	-41.2	176.9	0	0	0	0	0	111.1	D135 F140 A141	D135-G137 PolarHBondContact O-N 2.97Å; D135-G137 VanDerWaalsContact O-N 3.12Å; D135-G137 WeakPolarHBondContact OD1-CA 3.43Å; D135-G137 PolarHBondContact OD1-N 3.2Å; G137-F140 PolarHBondContact O-N 3.17Å; G137-A141 WeakPolarHBondContact O-CB 3.35Å; G137-A141 PolarHBondContact O-N 3.4Å
138	L	80.4	Confident	63.2	Low	11 Å²	11	86.9 Å²	86.9	6%	0.058	46%	0.464	C	S	.	.	H	α-helix	trans	-67.8	-44.7	174.7	-177.8	61.6	0	0	0	111.9	D135 F140 A141 L142 L165 T171 L174	D135-L138 HydrophobicContact CB-CB 3.76Å; D135-L138 CarbonylContact O-C 3.56Å; D135-L138 WeakPolarHBondContact O-CA 3.07Å; D135-L138 WeakPolarHBondContact O-CB 3.47Å; D135-L138 PolarHBondContact O-N 3.11Å; D135-L138 PolarHBondContact OD1-N 3.34Å; D135-L138 VanDerWaalsContact OD1-N 3.11Å; L138-F140 PolarHBondContact O-N 3.08Å; L138-A141 WeakPolarHBondContact O-CB 3.47Å; L138-A141 PolarHBondContact O-N 3.24Å; L138-A141 VanDerWaalsContact O-N 3.13Å; L138-L142 HydrophobicContact CD1-CD1 4.43Å; L138-L142 HydrophobicContact CD1-CG 4.29Å; L138-L142 HydrophobicContact CG-CD1 4.08Å; L138-L142 HydrophobicContact CG-CG 4.38Å; L138-L142 WeakPolarHBondContact O-CB 2.96Å; L138-L142 WeakPolarHBondContact O-CG 3.25Å; L138-L142 PolarHBondContact O-N 3.44Å; L138-L165 HydrophobicContact CB-CD2 4.34Å; L138-T171 WeakPolarHBondContact CD2-OG1 3.46Å; L138-L174 HydrophobicContact CD1-CD1 3.69Å; L138-L174 HydrophobicContact CD2-CD1 3.91Å; L138-L174 HydrophobicContact CG-CD1 4.46Å
139	V	82.1	Confident	63.8	Low	33 Å²	33	84 Å²	84	20%	0.2	45%	0.445	C	S	.	.	H	α-helix	trans	-58.7	-42.5	176.2	173	0	0	0	0	110.2	E134 D135 L142 K143	E134-V139 HydrophobicContact CB-CG2 3.84Å; E134-V139 WeakPolarHBondContact OE2-CG2 3.08Å; D135-V139 WeakPolarHBondContact O-CG2 3.44Å; D135-V139 PolarHBondContact O-N 3.36Å; V139-L142 PolarHBondContact O-N 3.44Å; V139-K143 HydrophobicContact CG1-CD 4.09Å; V139-K143 WeakPolarHBondContact O-CB 3.5Å; V139-K143 WeakPolarHBondContact O-CG 3.17Å; V139-K143 PolarHBondContact O-N 3.05Å
140	F	80.2	Confident	64.6	Low	20 Å²	20	83.2 Å²	83.2	9%	0.088	44%	0.438	C	S	.	.	H	α-helix	trans	-64.1	-43.1	175.1	179.5	-90.1	0	0	0	112.4	Y104 E136 G137 L138 K143 N144 F145 L157 K160 K163	Y104-F140 HydrophobicContact CD2-CD1 4.31Å; Y104-F140 AromaticContact CE2-CD1 3.61Å; Y104-F140 HydrophobicContact CE2-CD1 3.61Å; Y104-F140 AromaticContact CE2-CE1 3.87Å; Y104-F140 HydrophobicContact CE2-CE1 3.87Å; E136-F140 WeakPolarHBondContact O-CB 3.32Å; E136-F140 PolarHBondContact O-N 2.9Å; G137-F140 PolarHBondContact O-N 3.17Å; L138-F140 PolarHBondContact O-N 3.08Å; F140-K143 PolarHBondContact O-N 3.29Å; F140-N144 VanDerWaalsContact CD2-ND2 3.28Å; F140-N144 WeakPolarHBondContact CD2-ND2 3.32Å; F140-N144 WeakPolarHBondContact CE2-ND2 3.23Å; F140-N144 WeakPolarHBondContact CZ-ND2 3.49Å; F140-N144 PolarHBondContact O-N 2.95Å; F140-N144 VanDerWaalsContact O-N 3.12Å; F140-N144 PolarHBondContact O-ND2 2.99Å; F140-F145 HydrophobicContact CE1-CE2 4.37Å; F140-L157 HydrophobicContact CE1-CD2 4.09Å; F140-L157 HydrophobicContact CE2-CD2 4.34Å; F140-L157 HydrophobicContact CZ-CD2 3.39Å; F140-K160 HydrophobicContact CE2-CB 4.43Å; F140-K160 WeakPolarHBondContact CE2-O 3.46Å; F140-K160 WeakPolarHBondContact CZ-O 3.15Å; F140-K163 HydrophobicContact CB-CD 3.72Å; F140-K163 HydrophobicContact CB-CG 4.42Å; F140-K163 HydrophobicContact CD2-CD 4.18Å; F140-K163 HydrophobicContact CG-CD 4Å; F140-K163 HydrophobicContact CG-CG 4.32Å
141	A	76.8	Confident	65.2	Low	0 Å²	0	80.9 Å²	80.9	0%	0	44%	0.439	C	S	.	.	H	α-helix	trans	-58.9	-50.6	174.6	0	0	0	0	0	111	I100 Y104 G137 L138 K143 N144 F145	I100-A141 HydrophobicContact CG2-CB 4.27Å; Y104-A141 HydrophobicContact CD1-CB 4.04Å; Y104-A141 HydrophobicContact CD2-CB 3.98Å; Y104-A141 HydrophobicContact CG-CB 3.6Å; G137-A141 WeakPolarHBondContact O-CB 3.35Å; G137-A141 PolarHBondContact O-N 3.4Å; L138-A141 WeakPolarHBondContact O-CB 3.47Å; L138-A141 PolarHBondContact O-N 3.24Å; L138-A141 VanDerWaalsContact O-N 3.13Å; A141-K143 VanDerWaalsContact C-N 3.3Å; A141-K143 PolarHBondContact O-N 3.26Å; A141-N144 PolarHBondContact O-N 2.82Å; A141-F145 VanDerWaalsContact O-CB 3.32Å; A141-F145 WeakPolarHBondContact O-CB 3.42Å; A141-F145 WeakPolarHBondContact O-CD2 3.36Å; A141-F145 PolarHBondContact O-N 2.96Å
142	L	81.4	Confident	65.6	Low	51 Å²	51	83 Å²	83	27%	0.267	44%	0.438	S	S	.	.	H	α-helix	trans	-58.9	-37.8	179.4	-72.6	171.7	0	0	0	112.7	R97 I100 L138 V139 T146	R97-L142 HydrophobicContact CG-CD2 4.26Å; I100-L142 HydrophobicContact CD1-CD2 3.93Å; I100-L142 HydrophobicContact CG2-CD2 4.25Å; L138-L142 HydrophobicContact CD1-CD1 4.43Å; L138-L142 HydrophobicContact CD1-CG 4.29Å; L138-L142 HydrophobicContact CG-CD1 4.08Å; L138-L142 HydrophobicContact CG-CG 4.38Å; L138-L142 WeakPolarHBondContact O-CB 2.96Å; L138-L142 WeakPolarHBondContact O-CG 3.25Å; L138-L142 PolarHBondContact O-N 3.44Å; V139-L142 PolarHBondContact O-N 3.44Å; L142-T146 WeakPolarHBondContact O-CB 3.36Å; L142-T146 WeakPolarHBondContact O-CG2 3.38Å; L142-T146 PolarHBondContact O-OG1 2.86Å
143	K	79.2	Confident	65.9	Low	155 Å²	155	80 Å²	80	67%	0.674	41%	0.413	S	S	*	.	H	α-helix	trans	-73	-36.7	178.6	-74.6	175.3	-179.9	176.7	0	113.7	V139 F140 A141	V139-K143 HydrophobicContact CG1-CD 4.09Å; V139-K143 WeakPolarHBondContact O-CB 3.5Å; V139-K143 WeakPolarHBondContact O-CG 3.17Å; V139-K143 PolarHBondContact O-N 3.05Å; F140-K143 PolarHBondContact O-N 3.29Å; A141-K143 VanDerWaalsContact C-N 3.3Å; A141-K143 PolarHBondContact O-N 3.26Å
144	N	75	Confident	65.9	Low	53 Å²	53	76.6 Å²	76.6	28%	0.283	40%	0.403	S	S	.	.	H	α-helix	trans	-103.4	-16.5	-169.4	-64	-74.4	0	0	0	114.4	F140 A141 I153	F140-N144 VanDerWaalsContact CD2-ND2 3.28Å; F140-N144 WeakPolarHBondContact CD2-ND2 3.32Å; F140-N144 WeakPolarHBondContact CE2-ND2 3.23Å; F140-N144 WeakPolarHBondContact CZ-ND2 3.49Å; F140-N144 PolarHBondContact O-N 2.95Å; F140-N144 VanDerWaalsContact O-N 3.12Å; F140-N144 PolarHBondContact O-ND2 2.99Å; A141-N144 PolarHBondContact O-N 2.82Å; N144-I153 VanDerWaalsContact O-CD1 3.3Å; N144-I153 WeakPolarHBondContact O-CD1 3.38Å
145	F	74.9	Confident	65	Low	30 Å²	30	81.4 Å²	81.4	13%	0.132	42%	0.415	C	S	.	.	S	Bend	trans	-118.3	9.6	-174	-65.3	-100	0	0	0	113.2	I100 N103 Y104 S107 F140 A141	I100-F145 HydrophobicContact CG2-CB 3.88Å; N103-F145 HydrophobicContact CB-CD1 3.89Å; Y104-F145 HydrophobicContact CD2-CD2 4.2Å; Y104-F145 AromaticContact CD2-CE2 3.57Å; Y104-F145 HydrophobicContact CD2-CE2 3.57Å; Y104-F145 AromaticContact CD2-CZ 3.98Å; Y104-F145 HydrophobicContact CD2-CZ 3.98Å; Y104-F145 HydrophobicContact CE2-CE2 4.33Å; S107-F145 WeakPolarHBondContact OG-CE1 3.49Å; S107-F145 WeakPolarHBondContact OG-CZ 3.37Å; F140-F145 HydrophobicContact CE1-CE2 4.37Å; A141-F145 VanDerWaalsContact O-CB 3.32Å; A141-F145 WeakPolarHBondContact O-CB 3.42Å; A141-F145 WeakPolarHBondContact O-CD2 3.36Å; A141-F145 PolarHBondContact O-N 2.96Å
146	T	68	Low	63.5	Low	91 Å²	91	89.8 Å²	89.8	56%	0.558	45%	0.454	S	S	*	.	S	Bend	trans	-78.4	-38.2	174.1	18	0	0	0	0	113	I100 L142	I100-T146 HydrophobicContact CD1-CG2 3.67Å; L142-T146 WeakPolarHBondContact O-CB 3.36Å; L142-T146 WeakPolarHBondContact O-CG2 3.38Å; L142-T146 PolarHBondContact O-OG1 2.86Å
147	S	59	Low	62	Low	72 Å²	72	84.9 Å²	84.9	50%	0.503	43%	0.432	S	S	.	.	S	Bend	trans	-91.8	140.9	178.1	58.3	0	0	0	0	110.3	H149	S147-H149 PolarHBondContact O-N 2.82Å
148	Q	47.2	Very low	60.9	Low	195 Å²	195	89.2 Å²	89.2	91%	0.911	46%	0.456	S	S	*	.			trans	-67.2	39.3	178.6	-66.8	-180	-18.1	0	0	113.2	E150	Q148-E150 PolarHBondContact O-N 2.75Å; Q148-E150 VanDerWaalsContact O-N 3.13Å
149	H	43.8	Very low	59.3	Low	97 Å²	97	93.2 Å²	93.2	45%	0.449	48%	0.477	S	S	.	.			trans	-86.4	38.5	179.7	-128.7	-62	0	0	0	111.9	S147 A151 Q152 I153	S147-H149 PolarHBondContact O-N 2.82Å; H149-A151 PolarHBondContact O-N 2.93Å; H149-Q152 PolarHBondContact CE1-OE1 2.85Å; H149-Q152 VanDerWaalsContact ND1-CB 3.29Å; H149-Q152 WeakPolarHBondContact ND1-CB 3.12Å; H149-Q152 PolarHBondContact O-N 3.14Å; H149-I153 HydrophobicContact CB-CD1 4.13Å; H149-I153 HydrophobicContact CB-CG1 4.44Å; H149-I153 VanDerWaalsContact O-CD1 3.23Å; H149-I153 WeakPolarHBondContact O-CD1 3.32Å; H149-I153 WeakPolarHBondContact O-CG1 3.27Å; H149-I153 PolarHBondContact O-N 3.03Å
150	E	47.8	Very low	57.9	Low	151 Å²	151	99.4 Å²	99.4	71%	0.706	50%	0.501	S	S	*	.	H	α-helix	trans	-53.7	-32	-175	-69.1	-178.2	163	0	0	112.8	Q148	Q148-E150 PolarHBondContact O-N 2.75Å; Q148-E150 VanDerWaalsContact O-N 3.13Å
151	A	45.9	Very low	57	Low	99 Å²	99	99 Å²	99	82%	0.818	50%	0.5	S	S	*	.	H	α-helix	trans	-77.9	-30.6	-175.2	0	0	0	0	0	115	H149	H149-A151 PolarHBondContact O-N 2.93Å
152	Q	45.1	Very low	56.5	Low	147 Å²	147	100.3 Å²	100.3	69%	0.687	51%	0.505	S	S	*	.	H	α-helix	trans	-97.4	-20.1	-173.1	-153.7	149.2	-13.4	0	0	112.8	H149 S154	H149-Q152 PolarHBondContact CE1-OE1 2.85Å; H149-Q152 VanDerWaalsContact ND1-CB 3.29Å; H149-Q152 WeakPolarHBondContact ND1-CB 3.12Å; H149-Q152 PolarHBondContact O-N 3.14Å; Q152-S154 VanDerWaalsContact C-N 3.3Å; Q152-S154 PolarHBondContact O-N 3.02Å
153	I	47.2	Very low	56.2	Low	42 Å²	42	100.6 Å²	100.6	22%	0.215	50%	0.504	C	S	.	.	H	α-helix	trans	-63.5	-29.8	179.6	-78.5	172.7	0	0	0	112.4	N144 H149 R155 L157	N144-I153 VanDerWaalsContact O-CD1 3.3Å; N144-I153 WeakPolarHBondContact O-CD1 3.38Å; H149-I153 HydrophobicContact CB-CD1 4.13Å; H149-I153 HydrophobicContact CB-CG1 4.44Å; H149-I153 VanDerWaalsContact O-CD1 3.23Å; H149-I153 WeakPolarHBondContact O-CD1 3.32Å; H149-I153 WeakPolarHBondContact O-CG1 3.27Å; H149-I153 PolarHBondContact O-N 3.03Å; I153-R155 VanDerWaalsContact C-N 3.34Å; I153-R155 PolarHBondContact O-N 2.96Å; I153-R155 VanDerWaalsContact O-N 3.17Å; I153-L157 HydrophobicContact CB-CD1 3.88Å; I153-L157 HydrophobicContact CG1-CD1 4.2Å; I153-L157 HydrophobicContact CG2-CD1 3.14Å; I153-L157 WeakPolarHBondContact O-CB 3.38Å; I153-L157 WeakPolarHBondContact O-CD1 3.02Å
154	S	50.6	Low	56.1	Low	96 Å²	96	96.6 Å²	96.6	67%	0.671	50%	0.496	S	S	*	.	H	α-helix	trans	-67.6	-19.9	-168.9	-70.8	0	0	0	0	116.3	Q152	Q152-S154 VanDerWaalsContact C-N 3.3Å; Q152-S154 PolarHBondContact O-N 3.02Å
155	R	46.8	Very low	56.6	Low	234 Å²	234	94.4 Å²	94.4	88%	0.883	48%	0.484	S	S	*	.	H	α-helix	trans	-99.6	-36.2	-174.3	-83.2	-176.8	179.6	149.2	0.6	115.5	I153	I153-R155 VanDerWaalsContact C-N 3.34Å; I153-R155 PolarHBondContact O-N 2.96Å; I153-R155 VanDerWaalsContact O-N 3.17Å
156	E	44.2	Very low	56.9	Low	179 Å²	179	96.3 Å²	96.3	84%	0.836	50%	0.501	S	S	*	.	H	α-helix	trans	-92.4	-14.3	-173.5	-70.8	-173.7	166.7	0	0	114	D158	E156-D158 PolarHBondContact O-N 3.01Å
157	L	49.2	Very low	58	Low	26 Å²	26	93.4 Å²	93.4	14%	0.136	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-10.8	-172.6	-89.3	163.6	0	0	0	114.6	F140 I153 L159 K160 S161	F140-L157 HydrophobicContact CE1-CD2 4.09Å; F140-L157 HydrophobicContact CE2-CD2 4.34Å; F140-L157 HydrophobicContact CZ-CD2 3.39Å; I153-L157 HydrophobicContact CB-CD1 3.88Å; I153-L157 HydrophobicContact CG1-CD1 4.2Å; I153-L157 HydrophobicContact CG2-CD1 3.14Å; I153-L157 WeakPolarHBondContact O-CB 3.38Å; I153-L157 WeakPolarHBondContact O-CD1 3.02Å; L157-L159 PolarHBondContact O-N 3.5Å; L157-K160 PolarHBondContact O-N 3.37Å; L157-K160 VanDerWaalsContact O-N 3.14Å; L157-S161 WeakPolarHBondContact O-CA 3.49Å; L157-S161 WeakPolarHBondContact O-CB 3.48Å; L157-S161 PolarHBondContact O-N 3.4Å; L157-S161 PolarHBondContact O-OG 3.47Å
158	D	53.3	Low	59.4	Low	92 Å²	92	91.1 Å²	91.1	49%	0.492	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-12.1	-164.2	-140.7	42.7	0	0	0	116.1	K115 E156	K115-D158 PolarHBondContact NZ-O 3.43Å; K115-D158 IonicContact NZ-OD1 2.69Å; K115-D158 IonicContact NZ-OD2 3.63Å; K115-D158 PolarHBondContact NZ-OD2 3.33Å; E156-D158 PolarHBondContact O-N 3.01Å
159	L	47.5	Very low	61.5	Low	95 Å²	95	82.8 Å²	82.8	50%	0.497	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-31.6	172.8	-68.8	170.3	0	0	0	114.1	K115 L157	K115-L159 HydrophobicContact CG-CD2 4.3Å; L157-L159 PolarHBondContact O-N 3.5Å
160	K	53.6	Low	63.9	Low	163 Å²	163	80.3 Å²	80.3	71%	0.709	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-18.5	179.5	-73.4	-175.2	178.9	179	0	113.2	F140 L157	F140-K160 HydrophobicContact CE2-CB 4.43Å; F140-K160 WeakPolarHBondContact CE2-O 3.46Å; F140-K160 WeakPolarHBondContact CZ-O 3.15Å; L157-K160 PolarHBondContact O-N 3.37Å; L157-K160 VanDerWaalsContact O-N 3.14Å
161	S	60.7	Low	66	Low	10 Å²	10	73.1 Å²	73.1	7%	0.07	39%	0.385	C	S	.	.	S	Bend	trans	-68.9	-36.7	-170.1	57.6	0	0	0	0	114.7	Y104 L157 K163	Y104-S161 WeakPolarHBondContact CE2-O 3.43Å; Y104-S161 PolarHBondContact OH-O 2.84Å; L157-S161 WeakPolarHBondContact O-CA 3.49Å; L157-S161 WeakPolarHBondContact O-CB 3.48Å; L157-S161 PolarHBondContact O-N 3.4Å; L157-S161 PolarHBondContact O-OG 3.47Å; S161-K163 PolarHBondContact O-N 3.36Å; S161-K163 VanDerWaalsContact O-N 3.16Å
162	W	66	Low	68.4	Low	28 Å²	28	68.4 Å²	68.4	11%	0.106	35%	0.346	C	S	.	.			trans	-82.5	104.2	-178.9	-161.7	100.7	0	0	0	109.8	P109 I111 K119 L288 P291	P109-W162 HydrophobicContact CG-CB 3.98Å; I111-W162 HydrophobicContact CD1-CB 3.64Å; I111-W162 VanDerWaalsContact CD1-CD1 3.46Å; I111-W162 HydrophobicContact CD1-CD2 3.1Å; I111-W162 HydrophobicContact CD1-CE3 3.54Å; I111-W162 HydrophobicContact CD1-CG 3.12Å; I111-W162 HydrophobicContact CD1-CZ2 4.25Å; I111-W162 HydrophobicContact CD1-CZ3 4.29Å; I111-W162 HydrophobicContact CG1-CB 4.03Å; I111-W162 HydrophobicContact CG1-CD2 4.24Å; I111-W162 HydrophobicContact CG1-CG 3.77Å; K119-W162 PolarHBondContact NZ-O 3.12Å; W162-L288 PolarHBondContact NE1-O 3.34Å; W162-L288 VanDerWaalsContact NE1-O 3.12Å; W162-P291 HydrophobicContact CH2-CB 3.73Å; W162-P291 HydrophobicContact CH2-CG 4.39Å; W162-P291 HydrophobicContact CZ2-CB 4.14Å; W162-P291 HydrophobicContact CZ3-CB 4.16Å
163	K	75.5	Confident	70.8	Confident	58 Å²	58	62.1 Å²	62.1	25%	0.252	32%	0.317	S	S	.	.			trans	-117.5	140.4	164.1	-67.4	-157.1	179.1	-161.8	0	108.3	Y104 R108 E136 F140 S161	Y104-K163 PolarHBondContact OH-N 2.99Å; Y104-K163 PolarHBondContact OH-O 3.47Å; R108-K163 PolarHBondContact NH1-O 2.99Å; R108-K163 PolarHBondContact NH2-O 2.93Å; E136-K163 HydrophobicContact CB-CD 4.26Å; E136-K163 IonicContact OE2-NZ 3.54Å; E136-K163 PolarHBondContact OE2-NZ 2.91Å; F140-K163 HydrophobicContact CB-CD 3.72Å; F140-K163 HydrophobicContact CB-CG 4.42Å; F140-K163 HydrophobicContact CD2-CD 4.18Å; F140-K163 HydrophobicContact CG-CD 4Å; F140-K163 HydrophobicContact CG-CG 4.32Å; S161-K163 PolarHBondContact O-N 3.36Å; S161-K163 VanDerWaalsContact O-N 3.16Å
164	S	77.5	Confident	73.1	Confident	71 Å²	71	60.1 Å²	60.1	50%	0.497	31%	0.307	S	S	.	.			trans	-66.5	136.6	171.8	-166	0	0	0	0	107.8
165	L	83.7	Confident	75.3	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.031	28%	0.278	C	S	.	.			trans	-77.7	133.3	162.4	-70.8	165.1	0	0	0	106.8	L101 Y104 L105 D135 L138 Y167 T171	L101-L165 HydrophobicContact CD1-CD1 3.91Å; L101-L165 HydrophobicContact CD1-CD2 4.3Å; Y104-L165 HydrophobicContact CD1-CD1 4.47Å; Y104-L165 HydrophobicContact CD1-CD2 4.47Å; Y104-L165 HydrophobicContact CE1-CD1 4.41Å; Y104-L165 HydrophobicContact CE1-CD2 4.21Å; Y104-L165 HydrophobicContact CE1-CG 4.19Å; L105-L165 HydrophobicContact CD2-CD1 3.74Å; D135-L165 WeakPolarHBondContact OD1-CA 3.44Å; D135-L165 WeakPolarHBondContact OD1-CD2 3.31Å; L138-L165 HydrophobicContact CB-CD2 4.34Å; L165-Y167 HydrophobicContact CB-CD1 4.22Å; L165-Y167 HydrophobicContact CB-CD2 3.98Å; L165-Y167 HydrophobicContact CB-CE1 4.07Å; L165-Y167 HydrophobicContact CB-CE2 3.8Å; L165-Y167 HydrophobicContact CB-CG 4.2Å; L165-Y167 HydrophobicContact CD1-CE1 3.81Å; L165-T171 HydrophobicContact CD2-CG2 4.15Å
166	S	83.2	Confident	77.6	Confident	71 Å²	71	45.4 Å²	45.4	50%	0.497	24%	0.237	S	C	.	.			trans	-76.8	-17.7	169.9	63.4	0	0	0	0	111.3	D135	D135-S166 WeakPolarHBondContact CA-OG 3.4Å; D135-S166 VanDerWaalsContact CB-OG 3.28Å; D135-S166 WeakPolarHBondContact CB-OG 3.17Å; D135-S166 VanDerWaalsContact CG-N 3.29Å; D135-S166 PolarHBondContact OD1-N 2.82Å; D135-S166 PolarHBondContact OD2-N 2.81Å; D135-S166 PolarHBondContact OD2-OG 2.86Å
167	Y	89.7	Confident	80.1	Confident	30 Å²	30	37.7 Å²	37.7	12%	0.118	20%	0.202	C	C	.	.			trans	54.1	57.2	-174.2	-64	-74.8	0	0	0	110.6	D135 L165 T171 C172 Y175 S238 H240 M241	D135-Y167 PolarHBondContact OD2-N 2.86Å; L165-Y167 HydrophobicContact CB-CD1 4.22Å; L165-Y167 HydrophobicContact CB-CD2 3.98Å; L165-Y167 HydrophobicContact CB-CE1 4.07Å; L165-Y167 HydrophobicContact CB-CE2 3.8Å; L165-Y167 HydrophobicContact CB-CG 4.2Å; L165-Y167 HydrophobicContact CD1-CE1 3.81Å; Y167-T171 HydrophobicContact CD1-CG2 3.92Å; Y167-C172 PolarHBondContact O-SG 2.64Å; Y167-Y175 AromaticContact CE1-CD2 3.81Å; Y167-Y175 HydrophobicContact CE1-CD2 3.81Å; Y167-Y175 HydrophobicContact CE1-CE2 4.19Å; Y167-Y175 HydrophobicContact CE1-CG 4.44Å; Y167-S238 PolarHBondContact O-OG 3.36Å; Y167-H240 WeakPolarHBondContact O-CB 3.49Å; Y167-M241 HydrophobicContact CD1-CE 3.23Å; Y167-M241 HydrophobicContact CE1-CE 3.71Å; Y167-M241 HydrophobicContact CG-CE 3.91Å; Y167-M241 HydrophobicContact CG-CG 4.45Å
168	S	89.6	Confident	82.2	Confident	24 Å²	24	37 Å²	37	17%	0.168	20%	0.199	C	C	.	.			trans	-58.7	169.7	168.2	72.2	0	0	0	0	111.3	H170 T171 C172	S168-H170 VanDerWaalsContact C-N 3.29Å; S168-H170 PolarHBondContact O-N 2.93Å; S168-T171 PolarHBondContact O-N 3.43Å; S168-T171 VanDerWaalsContact O-N 3.12Å; S168-T171 PolarHBondContact OG-N 3.03Å; S168-T171 PolarHBondContact OG-OG1 2.95Å; S168-C172 PolarHBondContact O-N 3.38Å; S168-C172 PolarHBondContact O-SG 3.25Å
169	G	91.1	Very high	84.2	Confident	19 Å²	19	32.9 Å²	32.9	20%	0.196	18%	0.177	C	C	.	.	H	α-helix	trans	-50.5	-48.5	177.2	0	0	0	0	0	112.7	C172 E173	G169-C172 WeakPolarHBondContact O-CB 3.47Å; G169-C172 PolarHBondContact O-N 3.48Å; G169-E173 WeakPolarHBondContact O-CG 3.45Å; G169-E173 PolarHBondContact O-N 3.43Å; G169-E173 VanDerWaalsContact O-N 3.14Å
170	H	93	Very high	86.6	Confident	46 Å²	46	28.5 Å²	28.5	21%	0.213	15%	0.154	C	C	.	.	H	α-helix	trans	-66.4	-42.6	177.5	-171.9	51.5	0	0	0	112.9	S89 R97 S168 C172 E173 L174	S89-H170 PolarHBondContact OG-CE1 2.81Å; R97-H170 PolarHBondContact NH1-NE2 2.95Å; S168-H170 VanDerWaalsContact C-N 3.29Å; S168-H170 PolarHBondContact O-N 2.93Å; H170-C172 PolarHBondContact O-N 2.86Å; H170-E173 IonicContact CE1-OE2 3.96Å; H170-E173 IonicContact CG-OE2 2.83Å; H170-E173 IonicContact ND1-OE2 3Å; H170-E173 PolarHBondContact ND1-OE2 3.16Å; H170-E173 WeakPolarHBondContact O-CB 3.42Å; H170-E173 PolarHBondContact O-N 3.41Å; H170-L174 WeakPolarHBondContact O-CG 3.34Å; H170-L174 PolarHBondContact O-N 3.33Å
171	T	93.7	Very high	88.6	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.9	-36.7	175.1	-55.7	0	0	0	0	111.4	D135 L138 L165 Y167 S168 L174 Y175	D135-T171 WeakPolarHBondContact CB-OG1 3.27Å; D135-T171 WeakPolarHBondContact OD2-CG2 3.48Å; D135-T171 PolarHBondContact OD2-OG1 2.91Å; L138-T171 WeakPolarHBondContact CD2-OG1 3.46Å; L165-T171 HydrophobicContact CD2-CG2 4.15Å; Y167-T171 HydrophobicContact CD1-CG2 3.92Å; S168-T171 PolarHBondContact O-N 3.43Å; S168-T171 VanDerWaalsContact O-N 3.12Å; S168-T171 PolarHBondContact OG-N 3.03Å; S168-T171 PolarHBondContact OG-OG1 2.95Å; T171-L174 PolarHBondContact O-N 3.27Å; T171-Y175 WeakPolarHBondContact O-CB 3.02Å; T171-Y175 PolarHBondContact O-N 3.39Å
172	C	95.7	Very high	90.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.3	-39.3	176.6	-66.1	0	0	0	0	112.3	Y167 S168 G169 H170 Y175 L176 H240 M241 L244	Y167-C172 PolarHBondContact O-SG 2.64Å; S168-C172 PolarHBondContact O-N 3.38Å; S168-C172 PolarHBondContact O-SG 3.25Å; G169-C172 WeakPolarHBondContact O-CB 3.47Å; G169-C172 PolarHBondContact O-N 3.48Å; H170-C172 PolarHBondContact O-N 2.86Å; C172-Y175 PolarHBondContact O-N 3.29Å; C172-L176 WeakPolarHBondContact O-CB 3.5Å; C172-L176 PolarHBondContact O-N 3.23Å; C172-H240 WeakPolarHBondContact SG-CB 3.34Å; C172-M241 HydrophobicContact CB-CE 4.22Å; C172-M241 HydrophobicContact CB-SD 4.31Å; C172-L244 HydrophobicContact CB-CD2 4.01Å
173	E	95.4	Very high	91.9	Very high	15 Å²	15	19.5 Å²	19.5	7%	0.07	12%	0.115	C	C	.	.	H	α-helix	trans	-61.3	-47.2	173.1	-64.6	161.3	179.5	0	0	111.2	Y82 L83 G169 H170 Y175 L176 V177	Y82-E173 HydrophobicContact CE1-CG 4.13Å; L83-E173 HydrophobicContact CD2-CB 3.75Å; L83-E173 HydrophobicContact CD2-CG 3.81Å; G169-E173 WeakPolarHBondContact O-CG 3.45Å; G169-E173 PolarHBondContact O-N 3.43Å; G169-E173 VanDerWaalsContact O-N 3.14Å; H170-E173 IonicContact CE1-OE2 3.96Å; H170-E173 IonicContact CG-OE2 2.83Å; H170-E173 IonicContact ND1-OE2 3Å; H170-E173 PolarHBondContact ND1-OE2 3.16Å; H170-E173 WeakPolarHBondContact O-CB 3.42Å; H170-E173 PolarHBondContact O-N 3.41Å; E173-Y175 VanDerWaalsContact C-N 3.3Å; E173-Y175 PolarHBondContact O-N 2.91Å; E173-L176 WeakPolarHBondContact O-CB 3.4Å; E173-L176 PolarHBondContact O-N 2.98Å; E173-V177 WeakPolarHBondContact O-CG2 3.34Å; E173-V177 PolarHBondContact O-N 2.82Å
174	L	95.2	Very high	93	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.4	-40.6	176.4	-61.8	-177.1	0	0	0	111.4	I94 R97 L101 L138 H170 T171 V177 S178	I94-L174 HydrophobicContact CB-CD2 4.49Å; I94-L174 HydrophobicContact CG2-CD2 3.88Å; R97-L174 HydrophobicContact CB-CD1 3.94Å; R97-L174 HydrophobicContact CB-CD2 3.51Å; R97-L174 HydrophobicContact CB-CG 4.39Å; L101-L174 HydrophobicContact CD2-CB 3.67Å; L138-L174 HydrophobicContact CD1-CD1 3.69Å; L138-L174 HydrophobicContact CD2-CD1 3.91Å; L138-L174 HydrophobicContact CG-CD1 4.46Å; H170-L174 WeakPolarHBondContact O-CG 3.34Å; H170-L174 PolarHBondContact O-N 3.33Å; T171-L174 PolarHBondContact O-N 3.27Å; L174-V177 PolarHBondContact O-N 3.48Å; L174-S178 WeakPolarHBondContact O-CB 3.44Å; L174-S178 PolarHBondContact O-N 3.31Å; L174-S178 PolarHBondContact O-OG 2.96Å
175	Y	96.1	Very high	94	Very high	19 Å²	19	13.5 Å²	13.5	8%	0.075	8%	0.08	C	C	.	.	H	α-helix	trans	-65.7	-41	176.7	-171.9	-84.8	0	0	0	111.5	L105 Y167 T171 C172 E173 V177 S178 R179 N183 L213 M241	L105-Y175 HydrophobicContact CD1-CD2 4Å; L105-Y175 HydrophobicContact CD1-CE2 3.95Å; Y167-Y175 AromaticContact CE1-CD2 3.81Å; Y167-Y175 HydrophobicContact CE1-CD2 3.81Å; Y167-Y175 HydrophobicContact CE1-CE2 4.19Å; Y167-Y175 HydrophobicContact CE1-CG 4.44Å; T171-Y175 WeakPolarHBondContact O-CB 3.02Å; T171-Y175 PolarHBondContact O-N 3.39Å; C172-Y175 PolarHBondContact O-N 3.29Å; E173-Y175 VanDerWaalsContact C-N 3.3Å; E173-Y175 PolarHBondContact O-N 2.91Å; Y175-V177 PolarHBondContact O-N 3.49Å; Y175-S178 WeakPolarHBondContact CA-OG 3.26Å; Y175-S178 PolarHBondContact O-N 2.83Å; Y175-S178 PolarHBondContact O-OG 3.39Å; Y175-R179 HydrophobicContact CD1-CB 3.96Å; Y175-R179 HydrophobicContact CD1-CG 4.37Å; Y175-R179 HydrophobicContact CD2-CB 4.3Å; Y175-R179 HydrophobicContact CD2-CG 3.82Å; Y175-R179 HydrophobicContact CE1-CB 3.65Å; Y175-R179 HydrophobicContact CE1-CG 4.2Å; Y175-R179 HydrophobicContact CE2-CB 4.06Å; Y175-R179 HydrophobicContact CE2-CG 3.66Å; Y175-R179 HydrophobicContact CG-CB 4.26Å; Y175-R179 HydrophobicContact CG-CG 4.18Å; Y175-R179 WeakPolarHBondContact O-CA 3.29Å; Y175-R179 VanDerWaalsContact O-CB 3.26Å; Y175-R179 WeakPolarHBondContact O-CB 3.49Å; Y175-R179 PolarHBondContact O-N 2.83Å; Y175-N183 PolarHBondContact OH-ND2 3.27Å; Y175-L213 HydrophobicContact CD1-CD1 3.95Å; Y175-L213 HydrophobicContact CD1-CD2 4.45Å; Y175-L213 HydrophobicContact CD1-CG 4.08Å; Y175-L213 HydrophobicContact CE1-CD1 4.19Å; Y175-L213 HydrophobicContact CE1-CG 4.22Å; Y175-M241 HydrophobicContact CD1-CE 3.65Å; Y175-M241 HydrophobicContact CD1-SD 4.37Å; Y175-M241 HydrophobicContact CD2-CE 4.18Å; Y175-M241 HydrophobicContact CE1-CE 4.34Å; Y175-M241 HydrophobicContact CG-CE 3.58Å
176	L	96.5	Very high	94.7	Very high	1 Å²	1	13.2 Å²	13.2	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-56.9	-51.7	174.1	178.5	164.2	0	0	0	110.7	A79 Y82 L83 C172 E173 S178 L180 L213 L244 F368	A79-L176 HydrophobicContact CB-CD1 4.14Å; A79-L176 HydrophobicContact CB-CD2 4.09Å; A79-L176 HydrophobicContact CB-CG 4.44Å; Y82-L176 HydrophobicContact CD1-CD1 4.39Å; L83-L176 HydrophobicContact CD1-CD2 3.65Å; L83-L176 HydrophobicContact CG-CD2 4.38Å; C172-L176 WeakPolarHBondContact O-CB 3.5Å; C172-L176 PolarHBondContact O-N 3.23Å; E173-L176 WeakPolarHBondContact O-CB 3.4Å; E173-L176 PolarHBondContact O-N 2.98Å; L176-S178 VanDerWaalsContact C-N 3.34Å; L176-S178 PolarHBondContact O-N 3.07Å; L176-L180 HydrophobicContact CD2-CD2 4.37Å; L176-L180 HydrophobicContact CG-CD2 4.26Å; L176-L180 WeakPolarHBondContact O-CB 3.42Å; L176-L180 PolarHBondContact O-N 3.21Å; L176-L180 VanDerWaalsContact O-N 3.12Å; L176-L213 HydrophobicContact CB-CD1 4.09Å; L176-L213 HydrophobicContact CG-CD1 4.41Å; L176-L244 HydrophobicContact CB-CD2 4.25Å; L176-L244 HydrophobicContact CD1-CD1 3.91Å; L176-L244 HydrophobicContact CD1-CD2 3.99Å; L176-L244 HydrophobicContact CD1-CG 4.35Å; L176-F368 HydrophobicContact CD2-CD1 3.97Å; L176-F368 HydrophobicContact CD2-CE1 3.5Å; L176-F368 VanDerWaalsContact CD2-CE1 3.5Å; L176-F368 HydrophobicContact CD2-CZ 3.84Å
177	V	94.9	Very high	95.5	Very high	17 Å²	17	9.9 Å²	9.9	10%	0.103	6%	0.056	C	C	.	.	H	α-helix	trans	-64.1	-40.1	-178	176.7	0	0	0	0	112.1	L83 I94 E173 L174 Y175 F368 L370	L83-V177 HydrophobicContact CD1-CG2 3.65Å; I94-V177 HydrophobicContact CG2-CB 4.24Å; I94-V177 HydrophobicContact CG2-CG2 3.54Å; E173-V177 WeakPolarHBondContact O-CG2 3.34Å; E173-V177 PolarHBondContact O-N 2.82Å; L174-V177 PolarHBondContact O-N 3.48Å; Y175-V177 PolarHBondContact O-N 3.49Å; V177-F368 HydrophobicContact CB-CD1 4.47Å; V177-F368 HydrophobicContact CG2-CD1 4.27Å; V177-F368 HydrophobicContact CG2-CE1 4.11Å; V177-L370 HydrophobicContact CG1-CD1 4.25Å; V177-L370 HydrophobicContact CG2-CD1 3.56Å; V177-L370 HydrophobicContact CG2-CG 4.32Å
178	S	93.5	Very high	95.9	Very high	12 Å²	12	8.8 Å²	8.8	8%	0.084	5%	0.052	C	C	.	.	H	α-helix	trans	-80.9	-36.2	-176.7	49.8	0	0	0	0	114.2	T102 L174 Y175 L176 P182	T102-S178 WeakPolarHBondContact OG1-CB 3.46Å; L174-S178 WeakPolarHBondContact O-CB 3.44Å; L174-S178 PolarHBondContact O-N 3.31Å; L174-S178 PolarHBondContact O-OG 2.96Å; Y175-S178 WeakPolarHBondContact CA-OG 3.26Å; Y175-S178 PolarHBondContact O-N 2.83Å; Y175-S178 PolarHBondContact O-OG 3.39Å; L176-S178 VanDerWaalsContact C-N 3.34Å; L176-S178 PolarHBondContact O-N 3.07Å; S178-P182 WeakPolarHBondContact O-CG 3.29Å
179	R	96.4	Very high	96.3	Very high	6 Å²	6	7.9 Å²	7.9	2%	0.023	5%	0.045	C	C	.	.	H	α-helix	trans	-117.5	-19.4	-163.3	-59.2	-49.4	-54.1	162.2	0.6	115.3	L105 Y175 A181 P182 N183 E380	L105-R179 HydrophobicContact CD1-CG 3.92Å; Y175-R179 HydrophobicContact CD1-CB 3.96Å; Y175-R179 HydrophobicContact CD1-CG 4.37Å; Y175-R179 HydrophobicContact CD2-CB 4.3Å; Y175-R179 HydrophobicContact CD2-CG 3.82Å; Y175-R179 HydrophobicContact CE1-CB 3.65Å; Y175-R179 HydrophobicContact CE1-CG 4.2Å; Y175-R179 HydrophobicContact CE2-CB 4.06Å; Y175-R179 HydrophobicContact CE2-CG 3.66Å; Y175-R179 HydrophobicContact CG-CB 4.26Å; Y175-R179 HydrophobicContact CG-CG 4.18Å; Y175-R179 WeakPolarHBondContact O-CA 3.29Å; Y175-R179 VanDerWaalsContact O-CB 3.26Å; Y175-R179 WeakPolarHBondContact O-CB 3.49Å; Y175-R179 PolarHBondContact O-N 2.83Å; R179-A181 PolarHBondContact O-N 3.3Å; R179-P182 WeakPolarHBondContact O-CD 3.27Å; R179-N183 PolarHBondContact NE-OD1 2.94Å; R179-N183 PolarHBondContact NH2-OD1 3.45Å; R179-N183 WeakPolarHBondContact O-CB 3.49Å; R179-N183 PolarHBondContact O-N 2.99Å; R179-N183 PolarHBondContact O-OD1 2.99Å; R179-E380 IonicContact CZ-OE2 3.99Å; R179-E380 IonicContact NH1-OE2 3.63Å; R179-E380 PolarHBondContact NH1-OE2 3.49Å; R179-E380 IonicContact NH2-OE2 3.07Å; R179-E380 PolarHBondContact NH2-OE2 3.47Å
180	L	97.6	Very high	96.7	Very high	2 Å²	2	7 Å²	7	1%	0.01	4%	0.036	C	C	.	.	H	α-helix	trans	-56.4	-53.9	-176.3	179.7	60.1	0	0	0	112.2	L71 L75 A79 L176 F184 L213 T215	L71-L180 HydrophobicContact CD1-CD2 4.01Å; L71-L180 HydrophobicContact CD1-CG 4.08Å; L71-L180 HydrophobicContact CD2-CG 3.96Å; L75-L180 HydrophobicContact CD1-CD1 4.39Å; L75-L180 HydrophobicContact CD2-CD1 4.23Å; L75-L180 HydrophobicContact CG-CD1 4.48Å; L75-L180 HydrophobicContact CG-CD2 4.47Å; A79-L180 HydrophobicContact CB-CD2 3.7Å; L176-L180 HydrophobicContact CD2-CD2 4.37Å; L176-L180 HydrophobicContact CG-CD2 4.26Å; L176-L180 WeakPolarHBondContact O-CB 3.42Å; L176-L180 PolarHBondContact O-N 3.21Å; L176-L180 VanDerWaalsContact O-N 3.12Å; L180-F184 VanDerWaalsContact O-CB 3.24Å; L180-F184 WeakPolarHBondContact O-CB 3.31Å; L180-F184 PolarHBondContact O-N 3.15Å; L180-L213 HydrophobicContact CB-CD1 4.12Å; L180-L213 HydrophobicContact CD1-CD1 4.05Å; L180-T215 HydrophobicContact CD1-CG2 4.43Å
181	A	96.5	Very high	96.9	Very high	4 Å²	4	4.8 Å²	4.8	3%	0.033	3%	0.025	C	C	.	.	H	α-helix	trans	-65.1	-52.4	-179.2	0	0	0	0	0	114.5	L71 R179 N183 F184 A185 Y365 Y366 F368	L71-A181 HydrophobicContact CD1-CB 4.12Å; L71-A181 HydrophobicContact CG-CB 4.21Å; R179-A181 PolarHBondContact O-N 3.3Å; A181-N183 PolarHBondContact O-N 2.76Å; A181-F184 PolarHBondContact O-N 2.72Å; A181-A185 PolarHBondContact O-N 3.27Å; A181-Y365 HydrophobicContact CB-CD2 3.84Å; A181-Y365 HydrophobicContact CB-CE2 4.13Å; A181-Y366 WeakPolarHBondContact CB-O 3.44Å; A181-F368 HydrophobicContact CB-CB 4.22Å
182	P	97.2	Very high	97.1	Very high	2 Å²	2	7.9 Å²	7.9	1%	0.013	4%	0.038	C	C	.	.	H	α-helix	trans	-65.2	-39.2	178.6	22.8	-32	0	0	0	112.4	S178 R179 F184 A185 T186 Y365 E380	S178-P182 WeakPolarHBondContact O-CG 3.29Å; R179-P182 WeakPolarHBondContact O-CD 3.27Å; P182-F184 VanDerWaalsContact C-N 3.33Å; P182-F184 PolarHBondContact O-N 3.41Å; P182-A185 PolarHBondContact O-N 2.9Å; P182-T186 WeakPolarHBondContact O-CB 3.48Å; P182-T186 WeakPolarHBondContact O-CG2 3.35Å; P182-T186 PolarHBondContact O-N 2.92Å; P182-T186 PolarHBondContact O-OG1 2.85Å; P182-Y365 HydrophobicContact CB-CD1 4.3Å; P182-Y365 HydrophobicContact CB-CD2 4.44Å; P182-Y365 HydrophobicContact CB-CE1 3.84Å; P182-Y365 HydrophobicContact CB-CE2 4Å; P182-Y365 HydrophobicContact CG-CE2 4.21Å; P182-E380 HydrophobicContact CB-CB 4.27Å; P182-E380 HydrophobicContact CB-CG 4.12Å; P182-E380 VanDerWaalsContact CB-OE2 3.23Å; P182-E380 WeakPolarHBondContact CB-OE2 2.95Å
183	N	98.5	Very high	97.2	Very high	7 Å²	7	7.9 Å²	7.9	4%	0.037	4%	0.038	C	C	.	.	H	α-helix	trans	-63.7	-40.9	176.8	-70	1.8	0	0	0	111	Y175 R179 A181 T186 V187 T215 N285	Y175-N183 PolarHBondContact OH-ND2 3.27Å; R179-N183 PolarHBondContact NE-OD1 2.94Å; R179-N183 PolarHBondContact NH2-OD1 3.45Å; R179-N183 WeakPolarHBondContact O-CB 3.49Å; R179-N183 PolarHBondContact O-N 2.99Å; R179-N183 PolarHBondContact O-OD1 2.99Å; A181-N183 PolarHBondContact O-N 2.76Å; N183-T186 WeakPolarHBondContact CA-OG1 3.22Å; N183-T186 PolarHBondContact O-OG1 3.39Å; N183-V187 WeakPolarHBondContact O-CB 3.43Å; N183-V187 WeakPolarHBondContact O-CG2 3.35Å; N183-V187 PolarHBondContact O-N 3.4Å; N183-V187 VanDerWaalsContact O-N 3.08Å; N183-T215 HydrophobicContact CB-CG2 3.91Å; N183-N285 PolarHBondContact OD1-ND2 2.76Å
184	F	98.6	Very high	97.3	Very high	2 Å²	2	7.1 Å²	7.1	1%	0.009	3%	0.034	C	C	.	.	H	α-helix	trans	-61.2	-48.8	176.6	176.4	-98.1	0	0	0	111.7	I69 S70 L71 P72 L75 L180 A181 P182 C188 T215 W218 A219 T222	I69-F184 HydrophobicContact CG2-CD1 3.84Å; I69-F184 HydrophobicContact CG2-CE1 3.55Å; S70-F184 VanDerWaalsContact O-CE1 3.31Å; S70-F184 WeakPolarHBondContact O-CE1 3.5Å; L71-F184 HydrophobicContact CD2-CB 3.69Å; L71-F184 HydrophobicContact CD2-CD1 4.01Å; L71-F184 HydrophobicContact CD2-CD2 4.49Å; L71-F184 HydrophobicContact CD2-CG 3.81Å; P72-F184 HydrophobicContact CG-CE1 4.38Å; P72-F184 HydrophobicContact CG-CE2 3.84Å; P72-F184 HydrophobicContact CG-CZ 3.59Å; L75-F184 HydrophobicContact CD2-CD2 4.25Å; L180-F184 VanDerWaalsContact O-CB 3.24Å; L180-F184 WeakPolarHBondContact O-CB 3.31Å; L180-F184 PolarHBondContact O-N 3.15Å; A181-F184 PolarHBondContact O-N 2.72Å; P182-F184 VanDerWaalsContact C-N 3.33Å; P182-F184 PolarHBondContact O-N 3.41Å; F184-C188 VanDerWaalsContact CZ-SG 3.53Å; F184-C188 WeakPolarHBondContact O-CB 3.19Å; F184-C188 PolarHBondContact O-N 2.98Å; F184-C188 PolarHBondContact O-SG 3.15Å; F184-T215 VanDerWaalsContact CA-CG2 3.42Å; F184-T215 HydrophobicContact CB-CG2 3.68Å; F184-T215 HydrophobicContact CD2-CG2 4.49Å; F184-T215 VanDerWaalsContact N-CG2 3.27Å; F184-W218 HydrophobicContact CD2-CB 4.16Å; F184-W218 HydrophobicContact CE2-CB 4.14Å; F184-A219 HydrophobicContact CD2-CB 4.02Å; F184-A219 HydrophobicContact CE2-CB 4.14Å; F184-T222 WeakPolarHBondContact CE2-OG1 3.34Å; F184-T222 HydrophobicContact CZ-CG2 3.98Å; F184-T222 WeakPolarHBondContact CZ-OG1 3.46Å
185	A	98.5	Very high	97.3	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-64.6	-43.3	-178.3	0	0	0	0	0	112.5	I69 A181 P182 C188 R189 V363 Y365	I69-A185 HydrophobicContact CB-CB 3.84Å; I69-A185 HydrophobicContact CD1-CB 4.15Å; I69-A185 WeakPolarHBondContact CD1-O 3.3Å; I69-A185 HydrophobicContact CG1-CB 4.5Å; I69-A185 HydrophobicContact CG2-CB 4.22Å; A181-A185 PolarHBondContact O-N 3.27Å; P182-A185 PolarHBondContact O-N 2.9Å; A185-C188 WeakPolarHBondContact O-CB 3.31Å; A185-C188 PolarHBondContact O-N 3.2Å; A185-R189 WeakPolarHBondContact O-CB 3.44Å; A185-R189 PolarHBondContact O-N 3.02Å; A185-V363 HydrophobicContact CB-CG1 3.96Å; A185-Y365 VanDerWaalsContact CB-CB 3.49Å; A185-Y365 HydrophobicContact CB-CG 4.29Å
186	T	98.5	Very high	97.3	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.006	6%	0.059	C	C	.	.	H	α-helix	trans	-65.7	-44.5	-179.1	52.1	0	0	0	0	111.9	P182 N183 R189 V190 V363 E380 I382	P182-T186 WeakPolarHBondContact O-CB 3.48Å; P182-T186 WeakPolarHBondContact O-CG2 3.35Å; P182-T186 PolarHBondContact O-N 2.92Å; P182-T186 PolarHBondContact O-OG1 2.85Å; N183-T186 WeakPolarHBondContact CA-OG1 3.22Å; N183-T186 PolarHBondContact O-OG1 3.39Å; T186-R189 PolarHBondContact O-N 3.29Å; T186-V190 WeakPolarHBondContact O-CG2 3.44Å; T186-V190 PolarHBondContact O-N 2.99Å; T186-V363 HydrophobicContact CG2-CB 3.96Å; T186-V363 HydrophobicContact CG2-CG1 4.26Å; T186-V363 HydrophobicContact CG2-CG2 3.99Å; T186-E380 HydrophobicContact CG2-CB 4.14Å; T186-E380 HydrophobicContact CG2-CG 3.74Å; T186-I382 HydrophobicContact CG2-CD1 4.18Å; T186-I382 HydrophobicContact CG2-CG2 3.29Å
187	V	98.8	Very high	97.2	Very high	1 Å²	1	14 Å²	14	1%	0.006	6%	0.061	C	C	.	.	H	α-helix	trans	-62.6	-45.5	174	179.4	0	0	0	0	110.4	N183 R189 V190 L191 V216 A219 A284 I314	N183-V187 WeakPolarHBondContact O-CB 3.43Å; N183-V187 WeakPolarHBondContact O-CG2 3.35Å; N183-V187 PolarHBondContact O-N 3.4Å; N183-V187 VanDerWaalsContact O-N 3.08Å; V187-R189 VanDerWaalsContact C-N 3.31Å; V187-R189 PolarHBondContact O-N 3.4Å; V187-V190 PolarHBondContact O-N 2.85Å; V187-L191 HydrophobicContact CG1-CD1 3.47Å; V187-L191 VanDerWaalsContact CG1-CD1 3.47Å; V187-L191 HydrophobicContact CG1-CG 3.94Å; V187-L191 WeakPolarHBondContact O-CB 3.24Å; V187-L191 VanDerWaalsContact O-CG 3.27Å; V187-L191 WeakPolarHBondContact O-CG 3.41Å; V187-L191 PolarHBondContact O-N 3.09Å; V187-V216 HydrophobicContact CG1-CB 4.46Å; V187-V216 HydrophobicContact CG1-CG1 4.2Å; V187-V216 HydrophobicContact CG1-CG2 4.37Å; V187-V216 HydrophobicContact CG2-CG2 3.98Å; V187-A219 HydrophobicContact CB-CB 3.67Å; V187-A219 HydrophobicContact CG1-CB 3.44Å; V187-A219 VanDerWaalsContact CG1-CB 3.44Å; V187-A284 HydrophobicContact CG2-CB 4.35Å; V187-I314 HydrophobicContact CB-CD1 4.36Å; V187-I314 HydrophobicContact CG2-CD1 3.91Å
188	C	98.5	Very high	97.2	Very high	6 Å²	6	13.2 Å²	13.2	4%	0.041	6%	0.056	C	C	.	.	H	α-helix	trans	-55.8	-45.2	175.3	-74.3	0	0	0	0	112	I69 F184 A185 V190 Y192 A219 V223	I69-C188 HydrophobicContact CD1-CB 3.78Å; F184-C188 VanDerWaalsContact CZ-SG 3.53Å; F184-C188 WeakPolarHBondContact O-CB 3.19Å; F184-C188 PolarHBondContact O-N 2.98Å; F184-C188 PolarHBondContact O-SG 3.15Å; A185-C188 WeakPolarHBondContact O-CB 3.31Å; A185-C188 PolarHBondContact O-N 3.2Å; C188-V190 PolarHBondContact O-N 3.18Å; C188-Y192 WeakPolarHBondContact O-CB 3.31Å; C188-Y192 PolarHBondContact O-N 3.34Å; C188-A219 VanDerWaalsContact SG-CB 3.57Å; C188-V223 HydrophobicContact CB-CG2 4.33Å
189	R	98.1	Very high	97.3	Very high	5 Å²	5	15.8 Å²	15.8	2%	0.019	7%	0.073	C	C	.	.	H	α-helix	trans	-63.5	-40.5	-180	173.2	57.8	-174.4	82	-1.9	112.8	L64 L66 A185 T186 V187 E193 I361 V363 G456	L64-R189 PolarHBondContact O-NE 3.16Å; L64-R189 PolarHBondContact O-NH2 2.82Å; L66-R189 HydrophobicContact CD1-CB 4.3Å; A185-R189 WeakPolarHBondContact O-CB 3.44Å; A185-R189 PolarHBondContact O-N 3.02Å; T186-R189 PolarHBondContact O-N 3.29Å; V187-R189 VanDerWaalsContact C-N 3.31Å; V187-R189 PolarHBondContact O-N 3.4Å; R189-E193 IonicContact NH1-OE2 3.41Å; R189-E193 PolarHBondContact NH1-OE2 3.33Å; R189-I361 HydrophobicContact CG-CD1 4.21Å; R189-V363 HydrophobicContact CB-CG1 4.01Å; R189-V363 HydrophobicContact CB-CG2 4.04Å; R189-V363 HydrophobicContact CG-CG2 3.9Å; R189-G456 PolarHBondContact NH2-O 3.15Å
190	V	98.6	Very high	97.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-71.6	-46.8	178.9	173.8	0	0	0	0	110.8	T186 V187 C188 Y192 E193 V312 I314 I382 Y384 V386	T186-V190 WeakPolarHBondContact O-CG2 3.44Å; T186-V190 PolarHBondContact O-N 2.99Å; V187-V190 PolarHBondContact O-N 2.85Å; C188-V190 PolarHBondContact O-N 3.18Å; V190-Y192 VanDerWaalsContact C-N 3.33Å; V190-Y192 PolarHBondContact O-N 2.99Å; V190-E193 WeakPolarHBondContact O-CB 3.42Å; V190-E193 PolarHBondContact O-N 3.26Å; V190-V312 HydrophobicContact CG1-CG1 3.65Å; V190-I314 HydrophobicContact CB-CD1 3.95Å; V190-I314 HydrophobicContact CG1-CD1 4.27Å; V190-I314 HydrophobicContact CG2-CD1 3.84Å; V190-I314 HydrophobicContact CG2-CG1 4.16Å; V190-I382 HydrophobicContact CG2-CD1 3.81Å; V190-Y384 HydrophobicContact CB-CD2 4.35Å; V190-Y384 HydrophobicContact CG1-CD2 3.68Å; V190-Y384 HydrophobicContact CG1-CE2 4.1Å; V190-Y384 HydrophobicContact CG1-CG 4.45Å; V190-Y384 HydrophobicContact CG2-CD1 4.26Å; V190-Y384 HydrophobicContact CG2-CD2 3.73Å; V190-Y384 HydrophobicContact CG2-CE2 4.23Å; V190-Y384 HydrophobicContact CG2-CG 3.74Å; V190-V386 HydrophobicContact CG1-CG2 3.63Å
191	L	98.6	Very high	97.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-67.1	-33.3	179	-64.6	-179.3	0	0	0	112.4	V187 E193 I194 R195 T220 V223 W224 L280 V312	V187-L191 HydrophobicContact CG1-CD1 3.47Å; V187-L191 VanDerWaalsContact CG1-CD1 3.47Å; V187-L191 HydrophobicContact CG1-CG 3.94Å; V187-L191 WeakPolarHBondContact O-CB 3.24Å; V187-L191 VanDerWaalsContact O-CG 3.27Å; V187-L191 WeakPolarHBondContact O-CG 3.41Å; V187-L191 PolarHBondContact O-N 3.09Å; L191-E193 VanDerWaalsContact C-N 3.25Å; L191-E193 PolarHBondContact O-N 3.44Å; L191-I194 HydrophobicContact CD2-CD1 4.08Å; L191-I194 WeakPolarHBondContact O-CB 3.2Å; L191-I194 PolarHBondContact O-N 3.35Å; L191-I194 VanDerWaalsContact O-N 3.15Å; L191-R195 PolarHBondContact O-N 3.02Å; L191-T220 WeakPolarHBondContact CD1-OG1 3.45Å; L191-V223 HydrophobicContact CB-CB 4.21Å; L191-V223 HydrophobicContact CB-CG1 4.05Å; L191-V223 HydrophobicContact CB-CG2 3.96Å; L191-W224 HydrophobicContact CB-CH2 3.96Å; L191-W224 HydrophobicContact CB-CZ3 3.79Å; L191-W224 HydrophobicContact CD1-CZ3 4.01Å; L191-W224 HydrophobicContact CD2-CH2 4.14Å; L191-W224 HydrophobicContact CD2-CZ3 4.04Å; L191-W224 HydrophobicContact CG-CZ3 4.15Å; L191-L280 HydrophobicContact CD2-CD1 4.15Å; L191-L280 HydrophobicContact CD2-CD2 3.88Å; L191-V312 HydrophobicContact CD2-CG2 4.3Å
192	Y	97.5	Very high	97.3	Very high	65 Å²	65	21.3 Å²	21.3	26%	0.255	11%	0.105	S	C	.	.	H	α-helix	trans	-58	-38.4	173.7	172.1	-103.4	0	0	0	112.1	L66 C188 V190 I194 R195 K196	L66-Y192 HydrophobicContact CD1-CD1 3.92Å; L66-Y192 HydrophobicContact CD1-CG 3.88Å; L66-Y192 HydrophobicContact CD2-CD1 3.77Å; L66-Y192 HydrophobicContact CD2-CD2 4.07Å; L66-Y192 HydrophobicContact CD2-CE1 3.65Å; L66-Y192 HydrophobicContact CD2-CE2 3.96Å; L66-Y192 HydrophobicContact CD2-CG 3.97Å; L66-Y192 HydrophobicContact CG-CD1 3.88Å; L66-Y192 HydrophobicContact CG-CE1 4.1Å; L66-Y192 HydrophobicContact CG-CG 4.24Å; C188-Y192 WeakPolarHBondContact O-CB 3.31Å; C188-Y192 PolarHBondContact O-N 3.34Å; V190-Y192 VanDerWaalsContact C-N 3.33Å; V190-Y192 PolarHBondContact O-N 2.99Å; Y192-I194 VanDerWaalsContact C-N 3.34Å; Y192-I194 PolarHBondContact O-N 3.19Å; Y192-R195 PolarHBondContact O-N 3.14Å; Y192-K196 HydrophobicContact CE1-CB 4.39Å; Y192-K196 HydrophobicContact CE1-CD 3.78Å; Y192-K196 VanDerWaalsContact O-CB 3.25Å; Y192-K196 WeakPolarHBondContact O-CB 3.47Å; Y192-K196 PolarHBondContact O-N 3.07Å; Y192-K196 WeakPolarHBondContact OH-CD 3.23Å
193	E	97.2	Very high	97.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64.1	-40.4	177	179.5	168.9	160.6	0	0	111.8	L64 R189 V190 L191 K196 R197 F343 S344 Y384 R409	L64-E193 HydrophobicContact CD1-CG 3.96Å; L64-E193 HydrophobicContact CD2-CB 4.47Å; L64-E193 HydrophobicContact CD2-CG 4.07Å; R189-E193 IonicContact NH1-OE2 3.41Å; R189-E193 PolarHBondContact NH1-OE2 3.33Å; V190-E193 WeakPolarHBondContact O-CB 3.42Å; V190-E193 PolarHBondContact O-N 3.26Å; L191-E193 VanDerWaalsContact C-N 3.25Å; L191-E193 PolarHBondContact O-N 3.44Å; E193-K196 PolarHBondContact O-N 3.2Å; E193-R197 WeakPolarHBondContact O-CB 3.45Å; E193-R197 PolarHBondContact O-N 2.89Å; E193-R197 IonicContact OE1-NH1 3.98Å; E193-R197 PolarHBondContact OE1-NH1 3.24Å; E193-F343 HydrophobicContact CG-CE1 4.33Å; E193-S344 WeakPolarHBondContact OE1-CB 3.43Å; E193-Y384 PolarHBondContact OE2-OH 2.93Å; E193-R409 VanDerWaalsContact CD-NH2 3.31Å; E193-R409 IonicContact OE1-CZ 3.86Å; E193-R409 IonicContact OE1-NH1 3.93Å; E193-R409 PolarHBondContact OE1-NH1 2.82Å; E193-R409 IonicContact OE1-NH2 2.61Å; E193-R409 PolarHBondContact OE1-NH2 3.07Å; E193-R409 VanDerWaalsContact OE1-NH2 3.14Å; E193-R409 IonicContact OE2-CZ 3.41Å; E193-R409 IonicContact OE2-NH1 2.69Å; E193-R409 IonicContact OE2-NH2 2.71Å; E193-R409 PolarHBondContact OE2-NH2 2.94Å
194	I	97.7	Very high	97.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.6	-53.4	172.6	-56.7	175.4	0	0	0	109.3	L191 Y192 K196 R197 C198 F201 W224 F310 V312 F343 V386	L191-I194 HydrophobicContact CD2-CD1 4.08Å; L191-I194 WeakPolarHBondContact O-CB 3.2Å; L191-I194 PolarHBondContact O-N 3.35Å; L191-I194 VanDerWaalsContact O-N 3.15Å; Y192-I194 VanDerWaalsContact C-N 3.34Å; Y192-I194 PolarHBondContact O-N 3.19Å; I194-K196 VanDerWaalsContact C-N 3.3Å; I194-K196 PolarHBondContact O-N 3.28Å; I194-R197 PolarHBondContact O-N 3.34Å; I194-C198 WeakPolarHBondContact O-CA 3.41Å; I194-C198 VanDerWaalsContact O-CB 3.27Å; I194-C198 WeakPolarHBondContact O-CB 3.15Å; I194-C198 PolarHBondContact O-N 3.25Å; I194-F201 HydrophobicContact CG2-CD1 3.76Å; I194-F201 HydrophobicContact CG2-CE1 4.18Å; I194-W224 HydrophobicContact CB-CH2 4.3Å; I194-W224 HydrophobicContact CB-CZ2 4.33Å; I194-W224 HydrophobicContact CG2-CH2 4.38Å; I194-W224 HydrophobicContact CG2-CZ2 4.15Å; I194-F310 HydrophobicContact CD1-CB 4.34Å; I194-F310 HydrophobicContact CD1-CD1 4.33Å; I194-F310 HydrophobicContact CD1-CG 4.25Å; I194-F310 HydrophobicContact CG2-CD1 4.44Å; I194-F310 HydrophobicContact CG2-CD2 3.91Å; I194-F310 HydrophobicContact CG2-CE1 4.25Å; I194-F310 HydrophobicContact CG2-CE2 3.71Å; I194-F310 HydrophobicContact CG2-CG 4.28Å; I194-F310 HydrophobicContact CG2-CZ 3.89Å; I194-V312 HydrophobicContact CD1-CG2 3.92Å; I194-F343 HydrophobicContact CB-CE1 4.32Å; I194-F343 HydrophobicContact CG1-CD1 4.32Å; I194-F343 HydrophobicContact CG1-CE1 3.82Å; I194-V386 HydrophobicContact CD1-CG1 3.76Å; I194-V386 HydrophobicContact CD1-CG2 4.44Å; I194-V386 HydrophobicContact CG1-CG1 4.05Å
195	R	96.3	Very high	97.2	Very high	109 Å²	109	26.4 Å²	26.4	41%	0.411	13%	0.128	S	C	.	.	H	α-helix	trans	-59.1	-39.5	-179.5	178.3	173.5	174	177.7	0.8	112.8	L191 Y192 C198 P199 V223 W224	L191-R195 PolarHBondContact O-N 3.02Å; Y192-R195 PolarHBondContact O-N 3.14Å; R195-C198 CarbonylContact O-C 3.6Å; R195-P199 WeakPolarHBondContact O-CA 3.12Å; R195-V223 HydrophobicContact CB-CG1 3.89Å; R195-V223 WeakPolarHBondContact CD-O 3.35Å; R195-V223 PolarHBondContact NH1-O 3.35Å; R195-W224 HydrophobicContact CB-CZ2 4Å
196	K	94.5	Very high	97.2	Very high	41 Å²	41	26.4 Å²	26.4	18%	0.178	13%	0.128	C	C	.	.	H	α-helix	trans	-71.7	-41.1	-176.8	178.5	157.7	176.3	172	0	112.3	K58 L60 Y63 L64 Y192 E193 I194	K58-K196 PolarHBondContact O-NZ 3.26Å; L60-K196 WeakPolarHBondContact O-CE 3.44Å; L60-K196 PolarHBondContact O-NZ 3.3Å; Y63-K196 WeakPolarHBondContact O-CE 3.4Å; Y63-K196 PolarHBondContact O-NZ 2.8Å; L64-K196 HydrophobicContact CD2-CD 4.1Å; L64-K196 HydrophobicContact CD2-CG 4.46Å; Y192-K196 HydrophobicContact CE1-CB 4.39Å; Y192-K196 HydrophobicContact CE1-CD 3.78Å; Y192-K196 VanDerWaalsContact O-CB 3.25Å; Y192-K196 WeakPolarHBondContact O-CB 3.47Å; Y192-K196 PolarHBondContact O-N 3.07Å; Y192-K196 WeakPolarHBondContact OH-CD 3.23Å; E193-K196 PolarHBondContact O-N 3.2Å; I194-K196 VanDerWaalsContact C-N 3.3Å; I194-K196 PolarHBondContact O-N 3.28Å
197	R	94.5	Very high	97.2	Very high	14 Å²	14	26.3 Å²	26.3	5%	0.053	13%	0.128	C	C	.	.	H	α-helix	trans	-86.6	-26.9	-179.5	-70.7	167.7	60.7	-163.6	-8.2	113	E193 I194 P199 F343 Q396 S404	E193-R197 WeakPolarHBondContact O-CB 3.45Å; E193-R197 PolarHBondContact O-N 2.89Å; E193-R197 IonicContact OE1-NH1 3.98Å; E193-R197 PolarHBondContact OE1-NH1 3.24Å; I194-R197 PolarHBondContact O-N 3.34Å; R197-P199 WeakPolarHBondContact O-CD 3.45Å; R197-F343 HydrophobicContact CB-CE2 4.28Å; R197-F343 HydrophobicContact CB-CZ 3.79Å; R197-F343 PolarHBondContact NH1-O 2.73Å; R197-F343 PolarHBondContact NH2-O 3.46Å; R197-Q396 WeakPolarHBondContact O-CG 3.48Å; R197-S404 PolarHBondContact NE-OG 2.81Å; R197-S404 PolarHBondContact NH2-OG 3.41Å
198	C	96	Very high	97.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.128	C	C	.	.			trans	-123	66.6	-179.8	-63	0	0	0	0	111.1	I194 R195 S200 F201 F310 F343 H395	I194-C198 WeakPolarHBondContact O-CA 3.41Å; I194-C198 VanDerWaalsContact O-CB 3.27Å; I194-C198 WeakPolarHBondContact O-CB 3.15Å; I194-C198 PolarHBondContact O-N 3.25Å; R195-C198 CarbonylContact O-C 3.6Å; C198-S200 VanDerWaalsContact C-N 3.27Å; C198-S200 PolarHBondContact O-N 3.49Å; C198-F201 HydrophobicContact CB-CB 4.07Å; C198-F201 WeakPolarHBondContact O-CB 3.38Å; C198-F201 PolarHBondContact O-N 3.05Å; C198-F310 HydrophobicContact CB-CZ 4.49Å; C198-F343 VanDerWaalsContact SG-CE2 3.53Å; C198-H395 CarbonylContact C-O 3.51Å; C198-H395 WeakPolarHBondContact CA-O 3.41Å; C198-H395 HydrophobicContact CB-CB 3.72Å
199	P	94.6	Very high	97.2	Very high	66 Å²	66	27.4 Å²	27.4	43%	0.429	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-23.5	-174.2	26.8	-38.5	0	0	0	114.8	R195 R197 F201 I397	R195-P199 WeakPolarHBondContact O-CA 3.12Å; R197-P199 WeakPolarHBondContact O-CD 3.45Å; P199-F201 VanDerWaalsContact C-N 3.33Å; P199-I397 WeakPolarHBondContact CG-O 3.4Å
200	S	96	Very high	97.1	Very high	48 Å²	48	28 Å²	28	34%	0.336	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-8.7	175.1	64.4	0	0	0	0	113.3	C198 I202 H395	C198-S200 VanDerWaalsContact C-N 3.27Å; C198-S200 PolarHBondContact O-N 3.49Å; S200-I202 PolarHBondContact O-N 2.78Å; S200-H395 PolarHBondContact N-O 3.35Å; S200-H395 WeakPolarHBondContact OG-CA 3.23Å; S200-H395 PolarHBondContact OG-O 2.87Å
201	F	97.4	Very high	97.1	Very high	5 Å²	5	28.3 Å²	28.3	2%	0.022	14%	0.142	C	C	.	.			trans	-75.5	115.9	172	178	-113.9	0	0	0	111	I194 C198 P199 P203 W224 N279 D309 F310 H395	I194-F201 HydrophobicContact CG2-CD1 3.76Å; I194-F201 HydrophobicContact CG2-CE1 4.18Å; C198-F201 HydrophobicContact CB-CB 4.07Å; C198-F201 WeakPolarHBondContact O-CB 3.38Å; C198-F201 PolarHBondContact O-N 3.05Å; P199-F201 VanDerWaalsContact C-N 3.33Å; F201-P203 HydrophobicContact CE1-CB 4.05Å; F201-P203 HydrophobicContact CE1-CG 4.05Å; F201-P203 HydrophobicContact CE2-CB 4.5Å; F201-P203 HydrophobicContact CZ-CB 3.75Å; F201-P203 HydrophobicContact CZ-CG 4.26Å; F201-W224 AromaticContact CD1-CZ2 3.86Å; F201-W224 HydrophobicContact CD1-CZ2 3.86Å; F201-W224 HydrophobicContact CE1-CH2 4.34Å; F201-W224 HydrophobicContact CE1-CZ2 4.02Å; F201-W224 PolarHBondContact O-NE1 3.13Å; F201-N279 HydrophobicContact CE2-CB 4.11Å; F201-N279 HydrophobicContact CZ-CB 4.17Å; F201-D309 HydrophobicContact CD2-CB 4.16Å; F201-D309 HydrophobicContact CE2-CB 3.46Å; F201-D309 VanDerWaalsContact CE2-CB 3.46Å; F201-D309 HydrophobicContact CZ-CB 4.04Å; F201-F310 HydrophobicContact CB-CE2 4.34Å; F201-F310 AromaticContact CD1-CD2 3.83Å; F201-F310 HydrophobicContact CD1-CD2 3.83Å; F201-F310 AromaticContact CD1-CE2 3.8Å; F201-F310 HydrophobicContact CD1-CE2 3.8Å; F201-F310 HydrophobicContact CD2-CD2 4.2Å; F201-F310 HydrophobicContact CD2-CE2 4.06Å; F201-F310 AromaticContact CE1-CD2 3.58Å; F201-F310 HydrophobicContact CE1-CD2 3.58Å; F201-F310 HydrophobicContact CE1-CE2 4.06Å; F201-F310 AromaticContact CE2-CD2 3.99Å; F201-F310 HydrophobicContact CE2-CD2 3.99Å; F201-F310 HydrophobicContact CE2-CE2 4.32Å; F201-F310 HydrophobicContact CG-CD2 4.12Å; F201-F310 AromaticContact CG-CE2 3.79Å; F201-F310 HydrophobicContact CG-CE2 3.79Å; F201-F310 AromaticContact CZ-CD2 3.66Å; F201-F310 HydrophobicContact CZ-CD2 3.66Å; F201-F310 HydrophobicContact CZ-CE2 4.31Å; F201-H395 HydrophobicContact CB-CB 3.81Å; F201-H395 AromaticContact CD2-CE1 3.98Å; F201-H395 AromaticContact CD2-NE2 3.85Å
202	I	97.1	Very high	97	Very high	75 Å²	75	28.6 Å²	28.6	39%	0.385	15%	0.145	S	C	.	.			trans	-126.6	102.1	173.6	-55.4	175.9	0	0	0	108.3	S200 K204 C228	S200-I202 PolarHBondContact O-N 2.78Å; I202-K204 PolarHBondContact O-N 2.78Å; I202-C228 HydrophobicContact CG2-CB 3.53Å; I202-C228 VanDerWaalsContact CG2-SG 3.6Å
203	P	97.8	Very high	96.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.134	C	C	.	.			trans	-64	133.3	-178.8	25.4	-31.5	0	0	0	110.6	F201 W224 C228 V229 N279 L280	F201-P203 HydrophobicContact CE1-CB 4.05Å; F201-P203 HydrophobicContact CE1-CG 4.05Å; F201-P203 HydrophobicContact CE2-CB 4.5Å; F201-P203 HydrophobicContact CZ-CB 3.75Å; F201-P203 HydrophobicContact CZ-CG 4.26Å; P203-W224 HydrophobicContact CG-CD2 3.71Å; P203-W224 HydrophobicContact CG-CE3 3.79Å; P203-W224 HydrophobicContact CG-CG 4.07Å; P203-W224 HydrophobicContact CG-CZ2 4.46Å; P203-W224 HydrophobicContact CG-CZ3 4.18Å; P203-C228 CarbonylContact O-C 3.56Å; P203-V229 HydrophobicContact CB-CG2 4.48Å; P203-V229 HydrophobicContact CG-CG2 4.12Å; P203-V229 WeakPolarHBondContact O-CG2 3.39Å; P203-N279 HydrophobicContact CB-CB 4.09Å; P203-L280 HydrophobicContact CB-CB 4.02Å; P203-L280 HydrophobicContact CG-CD2 4.49Å
204	K	97.3	Very high	97	Very high	104 Å²	104	25.7 Å²	25.7	45%	0.452	13%	0.134	S	C	.	.	S	Bend	trans	-99.3	-25.8	174.1	-54.1	-51.7	-179	-173.8	0	112.1	I202 C228 R230 Q231 N279	I202-K204 PolarHBondContact O-N 2.78Å; K204-C228 WeakPolarHBondContact CD-O 3.37Å; K204-R230 PolarHBondContact O-N 2.76Å; K204-Q231 PolarHBondContact O-N 3.44Å; K204-N279 WeakPolarHBondContact CB-OD1 3.49Å; K204-N279 PolarHBondContact N-OD1 3.07Å
205	S	97.9	Very high	97	Very high	14 Å²	14	26 Å²	26	10%	0.098	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	135.6	178.9	58.5	0	0	0	0	111.3	Q231 Y278 N279 L280	S205-Q231 WeakPolarHBondContact CA-O 3.45Å; S205-Y278 VanDerWaalsContact OG-CA 3.28Å; S205-Y278 WeakPolarHBondContact OG-CA 3.33Å; S205-N279 PolarHBondContact N-OD1 3.28Å; S205-N279 PolarHBondContact O-N 2.83Å; S205-N279 PolarHBondContact OG-N 2.93Å; S205-N279 VanDerWaalsContact OG-N 3.09Å; S205-L280 PolarHBondContact O-N 2.88Å; S205-L280 VanDerWaalsContact O-N 3.12Å
206	L	98.4	Very high	97.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	133.6	176.9	171.8	68.5	0	0	0	109.4	V216 A217 T220 V229 Q231 Y233 L280 V282	L206-V216 HydrophobicContact CD1-CG1 4.14Å; L206-V216 HydrophobicContact CD2-CG1 4.27Å; L206-A217 HydrophobicContact CD2-CB 3.93Å; L206-T220 HydrophobicContact CD2-CG2 4.48Å; L206-V229 HydrophobicContact CB-CG1 4.05Å; L206-Q231 PolarHBondContact N-O 2.88Å; L206-Y233 PolarHBondContact O-N 3.19Å; L206-L280 CarbonylContact C-O 3.59Å; L206-L280 WeakPolarHBondContact CA-O 3.42Å; L206-L280 HydrophobicContact CD1-CB 4.28Å; L206-L280 HydrophobicContact CD1-CD2 3.96Å; L206-L280 HydrophobicContact CD1-CG 3.9Å; L206-V282 HydrophobicContact CD1-CG2 3.87Å
207	F	98.6	Very high	97.2	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.4	164.1	-169	-84.1	0	0	0	109.2	F209 Y233 V235 M271 P272 Y278 L280 V281 V282 L303 K306	F207-F209 HydrophobicContact CD1-CB 4.44Å; F207-F209 HydrophobicContact CE1-CB 4.05Å; F207-F209 HydrophobicContact CE1-CD2 4.34Å; F207-Y233 WeakPolarHBondContact CA-O 3.49Å; F207-Y233 AromaticContact CD2-CD1 3.55Å; F207-Y233 HydrophobicContact CD2-CD1 3.55Å; F207-Y233 HydrophobicContact CD2-CE1 4.34Å; F207-Y233 AromaticContact CD2-CG 3.97Å; F207-Y233 HydrophobicContact CD2-CG 3.97Å; F207-Y233 AromaticContact CE2-CD1 3.26Å; F207-Y233 HydrophobicContact CE2-CD1 3.26Å; F207-Y233 AromaticContact CE2-CE1 3.63Å; F207-Y233 HydrophobicContact CE2-CE1 3.63Å; F207-Y233 HydrophobicContact CE2-CG 4.09Å; F207-Y233 HydrophobicContact CZ-CD1 4.14Å; F207-Y233 HydrophobicContact CZ-CE1 4.35Å; F207-V235 HydrophobicContact CE1-CG2 4.06Å; F207-V235 HydrophobicContact CE2-CG2 4.05Å; F207-V235 HydrophobicContact CZ-CG2 3.51Å; F207-M271 HydrophobicContact CE1-CE 4.1Å; F207-M271 HydrophobicContact CE1-SD 3.84Å; F207-M271 HydrophobicContact CZ-CE 4.09Å; F207-M271 HydrophobicContact CZ-SD 3.48Å; F207-M271 WeakPolarHBondContact CZ-SD 3.26Å; F207-P272 HydrophobicContact CE2-CG 4.02Å; F207-P272 HydrophobicContact CZ-CG 4.39Å; F207-Y278 HydrophobicContact CB-CD1 3.98Å; F207-Y278 HydrophobicContact CB-CD2 3.79Å; F207-Y278 HydrophobicContact CB-CE1 4.44Å; F207-Y278 HydrophobicContact CB-CE2 4.27Å; F207-Y278 HydrophobicContact CB-CG 3.66Å; F207-Y278 AromaticContact CD2-CD2 3.82Å; F207-Y278 HydrophobicContact CD2-CD2 3.82Å; F207-Y278 HydrophobicContact CD2-CE1 4.2Å; F207-Y278 AromaticContact CD2-CE2 3.45Å; F207-Y278 HydrophobicContact CD2-CE2 3.45Å; F207-Y278 VanDerWaalsContact CD2-CE2 3.45Å; F207-Y278 HydrophobicContact CD2-CG 4.37Å; F207-Y278 AromaticContact CD2-CZ 3.67Å; F207-Y278 HydrophobicContact CE2-CE2 4.18Å; F207-Y278 HydrophobicContact CG-CD2 4.16Å; F207-Y278 HydrophobicContact CG-CE2 4.24Å; F207-Y278 HydrophobicContact CG-CG 4.48Å; F207-L280 PolarHBondContact N-O 3.15Å; F207-V281 HydrophobicContact CB-CB 4.5Å; F207-V281 HydrophobicContact CB-CG1 4.31Å; F207-V281 HydrophobicContact CB-CG2 4.11Å; F207-V281 HydrophobicContact CD1-CG1 4.06Å; F207-V281 CarbonylContact O-C 3.56Å; F207-V281 WeakPolarHBondContact O-CA 3.41Å; F207-V282 PolarHBondContact O-N 3.26Å; F207-L303 HydrophobicContact CD1-CD2 3.98Å; F207-L303 HydrophobicContact CE1-CD2 3.76Å; F207-K306 HydrophobicContact CD2-CD 4.19Å; F207-K306 HydrophobicContact CE1-CD 4.19Å; F207-K306 HydrophobicContact CE2-CD 3.78Å; F207-K306 HydrophobicContact CZ-CD 3.79Å
208	D	98.7	Very high	97.4	Very high	1 Å²	1	19 Å²	19	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	111.4	-178.2	-175.8	21.9	0	0	0	109.4	S211 V216 Y233 L234 V235	D208-S211 VanDerWaalsContact OD2-CA 3.25Å; D208-S211 WeakPolarHBondContact OD2-CA 3.42Å; D208-S211 WeakPolarHBondContact OD2-CB 3.25Å; D208-V216 HydrophobicContact CB-CB 4.43Å; D208-V216 WeakPolarHBondContact OD1-CG2 3.31Å; D208-V216 WeakPolarHBondContact OD2-CB 3.49Å; D208-Y233 PolarHBondContact N-O 2.66Å; D208-L234 HydrophobicContact CB-CD2 3.71Å; D208-V235 PolarHBondContact O-N 3.3Å
209	F	98.3	Very high	97.5	Very high	28 Å²	28	19 Å²	19	12%	0.123	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	124.8	-178.2	-176.3	-93.2	0	0	0	111	F207 V235 M271 V282 T286 I290 V299 L303	F207-F209 HydrophobicContact CD1-CB 4.44Å; F207-F209 HydrophobicContact CE1-CB 4.05Å; F207-F209 HydrophobicContact CE1-CD2 4.34Å; F209-V235 HydrophobicContact CD2-CB 4.25Å; F209-V235 HydrophobicContact CD2-CG1 4.09Å; F209-V235 HydrophobicContact CE2-CG1 4.23Å; F209-M271 HydrophobicContact CD2-CE 4.48Å; F209-M271 HydrophobicContact CD2-SD 3.8Å; F209-M271 HydrophobicContact CE2-CB 4.45Å; F209-M271 HydrophobicContact CE2-SD 3.96Å; F209-V282 PolarHBondContact N-O 2.79Å; F209-T286 HydrophobicContact CD1-CG2 3.88Å; F209-T286 HydrophobicContact CE1-CG2 3.84Å; F209-T286 PolarHBondContact O-OG1 3.45Å; F209-I290 HydrophobicContact CE1-CD1 4.24Å; F209-V299 HydrophobicContact CD1-CG1 3.84Å; F209-V299 HydrophobicContact CE1-CG1 3.47Å; F209-V299 VanDerWaalsContact CE1-CG1 3.47Å; F209-V299 HydrophobicContact CE1-CG2 4.21Å; F209-V299 HydrophobicContact CE2-CG1 4.46Å; F209-V299 HydrophobicContact CG-CG1 4.49Å; F209-V299 HydrophobicContact CZ-CG1 3.81Å; F209-V299 HydrophobicContact CZ-CG2 3.89Å; F209-L303 HydrophobicContact CB-CD1 4.38Å; F209-L303 HydrophobicContact CB-CD2 3.65Å; F209-L303 HydrophobicContact CD1-CD1 4.49Å; F209-L303 HydrophobicContact CD2-CD2 4.35Å; F209-L303 HydrophobicContact CG-CD1 4.48Å; F209-L303 HydrophobicContact CG-CD2 4.02Å
210	G	96.6	Very high	97.6	Very high	18 Å²	18	15.9 Å²	15.9	19%	0.186	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	45.6	-167.1	0	0	0	0	0	110.5	G212 V235	G210-G212 PolarHBondContact O-N 3.29Å; G210-V235 WeakPolarHBondContact CA-O 3.26Å; G210-V235 PolarHBondContact N-O 2.86Å
211	S	97.9	Very high	97.7	Very high	7 Å²	7	14 Å²	14	5%	0.049	8%	0.075	C	C	.	.			trans	-65.4	-22.2	-168	57.7	0	0	0	0	113.7	D208 L213 G214 V235 E236	D208-S211 VanDerWaalsContact OD2-CA 3.25Å; D208-S211 WeakPolarHBondContact OD2-CA 3.42Å; D208-S211 WeakPolarHBondContact OD2-CB 3.25Å; S211-L213 PolarHBondContact O-N 2.76Å; S211-L213 VanDerWaalsContact O-N 3.08Å; S211-G214 WeakPolarHBondContact O-CA 3.37Å; S211-G214 PolarHBondContact O-N 3.12Å; S211-V235 PolarHBondContact N-O 2.83Å; S211-V235 PolarHBondContact OG-N 2.78Å; S211-V235 PolarHBondContact OG-O 3.04Å; S211-E236 WeakPolarHBondContact OG-CB 3.06Å
212	G	96.4	Very high	97.6	Very high	6 Å²	6	17.1 Å²	17.1	6%	0.062	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	-115.5	-179.9	0	0	0	0	0	111.8	G210 G214 E236	G210-G212 PolarHBondContact O-N 3.29Å; G212-G214 PolarHBondContact O-N 3.4Å; G212-E236 VanDerWaalsContact CA-OE2 3.28Å; G212-E236 WeakPolarHBondContact CA-OE2 3.38Å; G212-E236 PolarHBondContact N-OE2 2.95Å
213	L	96.9	Very high	97.6	Very high	4 Å²	4	14.1 Å²	14.1	2%	0.021	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-4.2	178.4	-50.5	177.6	0	0	0	113.9	Y175 L176 L180 S211 M241 L244 S245	Y175-L213 HydrophobicContact CD1-CD1 3.95Å; Y175-L213 HydrophobicContact CD1-CD2 4.45Å; Y175-L213 HydrophobicContact CD1-CG 4.08Å; Y175-L213 HydrophobicContact CE1-CD1 4.19Å; Y175-L213 HydrophobicContact CE1-CG 4.22Å; L176-L213 HydrophobicContact CB-CD1 4.09Å; L176-L213 HydrophobicContact CG-CD1 4.41Å; L180-L213 HydrophobicContact CB-CD1 4.12Å; L180-L213 HydrophobicContact CD1-CD1 4.05Å; S211-L213 PolarHBondContact O-N 2.76Å; S211-L213 VanDerWaalsContact O-N 3.08Å; L213-M241 HydrophobicContact CD2-SD 3.58Å; L213-M241 VanDerWaalsContact CD2-SD 3.58Å; L213-M241 HydrophobicContact CG-SD 4.28Å; L213-L244 HydrophobicContact CD2-CB 4.47Å; L213-L244 HydrophobicContact CD2-CD2 3.37Å; L213-L244 HydrophobicContact CD2-CG 3.76Å; L213-S245 VanDerWaalsContact C-OG 3.24Å; L213-S245 WeakPolarHBondContact O-CB 3.31Å; L213-S245 PolarHBondContact O-OG 3.12Å
214	G	97.7	Very high	97.5	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	21.5	-171.9	0	0	0	0	0	113.5	S211 G212 V216 A217 W218 S245	S211-G214 WeakPolarHBondContact O-CA 3.37Å; S211-G214 PolarHBondContact O-N 3.12Å; G212-G214 PolarHBondContact O-N 3.4Å; G214-V216 VanDerWaalsContact C-N 3.26Å; G214-V216 PolarHBondContact O-N 3.03Å; G214-A217 PolarHBondContact O-N 3.29Å; G214-A217 VanDerWaalsContact O-N 3.12Å; G214-W218 PolarHBondContact O-N 3.15Å; G214-S245 PolarHBondContact N-OG 3.48Å
215	T	98.2	Very high	96.8	Very high	7 Å²	7	12.8 Å²	12.8	4%	0.043	8%	0.08	C	C	.	.	H	α-helix	trans	-60.1	-33.3	-174	-53.3	0	0	0	0	113	L180 N183 F184 A217 W218 A219	L180-T215 HydrophobicContact CD1-CG2 4.43Å; N183-T215 HydrophobicContact CB-CG2 3.91Å; F184-T215 VanDerWaalsContact CA-CG2 3.42Å; F184-T215 HydrophobicContact CB-CG2 3.68Å; F184-T215 HydrophobicContact CD2-CG2 4.49Å; F184-T215 VanDerWaalsContact N-CG2 3.27Å; T215-A217 VanDerWaalsContact C-N 3.34Å; T215-A217 PolarHBondContact O-N 2.98Å; T215-W218 PolarHBondContact O-N 2.76Å; T215-A219 PolarHBondContact O-N 2.83Å
216	V	98.6	Very high	95.6	Very high	7 Å²	7	17.4 Å²	17.4	4%	0.042	11%	0.108	C	C	.	.	H	α-helix	trans	-64.5	-39.5	177.5	175.5	0	0	0	0	111.3	V187 L206 D208 G214 W218 A219 T220 V282 A284	V187-V216 HydrophobicContact CG1-CB 4.46Å; V187-V216 HydrophobicContact CG1-CG1 4.2Å; V187-V216 HydrophobicContact CG1-CG2 4.37Å; V187-V216 HydrophobicContact CG2-CG2 3.98Å; L206-V216 HydrophobicContact CD1-CG1 4.14Å; L206-V216 HydrophobicContact CD2-CG1 4.27Å; D208-V216 HydrophobicContact CB-CB 4.43Å; D208-V216 WeakPolarHBondContact OD1-CG2 3.31Å; D208-V216 WeakPolarHBondContact OD2-CB 3.49Å; G214-V216 VanDerWaalsContact C-N 3.26Å; G214-V216 PolarHBondContact O-N 3.03Å; V216-W218 VanDerWaalsContact C-N 3.35Å; V216-W218 PolarHBondContact O-N 3.31Å; V216-A219 PolarHBondContact O-N 3.44Å; V216-T220 VanDerWaalsContact O-CB 3.28Å; V216-T220 WeakPolarHBondContact O-CB 3.14Å; V216-T220 PolarHBondContact O-N 2.81Å; V216-T220 PolarHBondContact O-OG1 3.17Å; V216-V282 HydrophobicContact CG1-CB 3.75Å; V216-V282 HydrophobicContact CG1-CG1 3.76Å; V216-V282 HydrophobicContact CG1-CG2 3.75Å; V216-V282 HydrophobicContact CG2-CG1 3.93Å; V216-A284 HydrophobicContact CG2-CB 4.11Å
217	A	97.5	Very high	94.9	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-65.7	-38.3	176.7	0	0	0	0	0	111.8	L206 G214 T215 T220 N221 L234 F249	L206-A217 HydrophobicContact CD2-CB 3.93Å; G214-A217 PolarHBondContact O-N 3.29Å; G214-A217 VanDerWaalsContact O-N 3.12Å; T215-A217 VanDerWaalsContact C-N 3.34Å; T215-A217 PolarHBondContact O-N 2.98Å; A217-T220 PolarHBondContact O-N 3.49Å; A217-N221 PolarHBondContact O-N 3.28Å; A217-N221 PolarHBondContact O-ND2 3.1Å; A217-L234 HydrophobicContact CB-CD2 4.11Å; A217-F249 HydrophobicContact CB-CE1 4.3Å; A217-F249 HydrophobicContact CB-CZ 3.82Å
218	W	97.4	Very high	94.6	Very high	10 Å²	10	19.3 Å²	19.3	4%	0.038	12%	0.122	C	C	.	.	H	α-helix	trans	-62.8	-46.2	172.3	-77	97.2	0	0	0	112.9	P72 R74 L75 F184 G214 T215 V216 N221 T222 M248 F249 V261 F262	P72-W218 HydrophobicContact CG-CE3 4.44Å; R74-W218 HydrophobicContact CG-CH2 4.13Å; L75-W218 HydrophobicContact CB-CD2 4.2Å; L75-W218 HydrophobicContact CB-CE3 3.95Å; L75-W218 HydrophobicContact CB-CH2 4.29Å; L75-W218 HydrophobicContact CB-CZ3 3.99Å; L75-W218 HydrophobicContact CD1-CD2 3.72Å; L75-W218 HydrophobicContact CD1-CE3 4.34Å; L75-W218 HydrophobicContact CD1-CG 3.93Å; L75-W218 HydrophobicContact CD1-CZ2 3.99Å; L75-W218 HydrophobicContact CD2-CB 3.93Å; L75-W218 HydrophobicContact CD2-CD2 3.94Å; L75-W218 HydrophobicContact CD2-CE3 4.23Å; L75-W218 HydrophobicContact CD2-CG 3.8Å; L75-W218 HydrophobicContact CG-CD2 4.19Å; L75-W218 HydrophobicContact CG-CE3 4.42Å; L75-W218 HydrophobicContact CG-CG 4.44Å; F184-W218 HydrophobicContact CD2-CB 4.16Å; F184-W218 HydrophobicContact CE2-CB 4.14Å; G214-W218 PolarHBondContact O-N 3.15Å; T215-W218 PolarHBondContact O-N 2.76Å; V216-W218 VanDerWaalsContact C-N 3.35Å; V216-W218 PolarHBondContact O-N 3.31Å; W218-N221 PolarHBondContact O-N 3.45Å; W218-T222 PolarHBondContact O-N 3.31Å; W218-T222 PolarHBondContact O-OG1 3Å; W218-M248 WeakPolarHBondContact CZ2-O 3.4Å; W218-F249 AromaticContact CD1-CE1 3.63Å; W218-F249 AromaticContact CD1-CZ 3.62Å; W218-F249 HydrophobicContact CD2-CE1 4.42Å; W218-F249 AromaticContact CE2-CE1 3.74Å; W218-F249 HydrophobicContact CG-CE1 4.35Å; W218-F249 HydrophobicContact CZ2-CD1 4.16Å; W218-F249 HydrophobicContact CZ2-CE1 4.31Å; W218-F249 AromaticContact NE1-CD1 3.7Å; W218-F249 AromaticContact NE1-CE1 3.18Å; W218-F249 AromaticContact NE1-CZ 3.46Å; W218-V261 HydrophobicContact CH2-CB 4.36Å; W218-V261 HydrophobicContact CH2-CG1 3.79Å; W218-V261 HydrophobicContact CH2-CG2 4.33Å; W218-V261 HydrophobicContact CZ2-CG1 4.39Å; W218-V261 HydrophobicContact CZ3-CG1 4.28Å; W218-F262 AromaticContact CD2-CE2 3.89Å; W218-F262 HydrophobicContact CD2-CE2 3.89Å; W218-F262 HydrophobicContact CD2-CZ 4.12Å; W218-F262 AromaticContact CE3-CE2 3.98Å; W218-F262 HydrophobicContact CE3-CE2 3.98Å; W218-F262 AromaticContact CE3-CZ 3.71Å; W218-F262 HydrophobicContact CE3-CZ 3.71Å; W218-F262 HydrophobicContact CG-CE2 4.31Å; W218-F262 HydrophobicContact CH2-CZ 4.45Å; W218-F262 HydrophobicContact CZ3-CE2 4.37Å; W218-F262 AromaticContact CZ3-CZ 3.9Å; W218-F262 HydrophobicContact CZ3-CZ 3.9Å
219	A	98	Very high	94.4	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.5	-41	177.1	0	0	0	0	0	111.5	F184 V187 C188 T215 V216 N221 T222 V223	F184-A219 HydrophobicContact CD2-CB 4.02Å; F184-A219 HydrophobicContact CE2-CB 4.14Å; V187-A219 HydrophobicContact CB-CB 3.67Å; V187-A219 HydrophobicContact CG1-CB 3.44Å; V187-A219 VanDerWaalsContact CG1-CB 3.44Å; C188-A219 VanDerWaalsContact SG-CB 3.57Å; T215-A219 PolarHBondContact O-N 2.83Å; V216-A219 PolarHBondContact O-N 3.44Å; A219-N221 PolarHBondContact O-N 3.34Å; A219-T222 WeakPolarHBondContact O-CB 3.5Å; A219-T222 PolarHBondContact O-N 3.39Å; A219-T222 VanDerWaalsContact O-N 3.11Å; A219-V223 WeakPolarHBondContact O-CG2 3.46Å; A219-V223 PolarHBondContact O-N 3.33Å
220	T	98	Very high	94.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.9	-44.9	177.9	-56.7	0	0	0	0	111.2	L191 L206 V216 A217 T222 V223 W224 V229 L280	L191-T220 WeakPolarHBondContact CD1-OG1 3.45Å; L206-T220 HydrophobicContact CD2-CG2 4.48Å; V216-T220 VanDerWaalsContact O-CB 3.28Å; V216-T220 WeakPolarHBondContact O-CB 3.14Å; V216-T220 PolarHBondContact O-N 2.81Å; V216-T220 PolarHBondContact O-OG1 3.17Å; A217-T220 PolarHBondContact O-N 3.49Å; T220-T222 PolarHBondContact O-N 2.65Å; T220-V223 PolarHBondContact O-N 3.37Å; T220-W224 HydrophobicContact CG2-CE3 3.88Å; T220-W224 HydrophobicContact CG2-CZ3 4.21Å; T220-W224 PolarHBondContact O-N 2.67Å; T220-V229 HydrophobicContact CG2-CG2 3.77Å; T220-L280 HydrophobicContact CG2-CD2 4Å
221	N	96.5	Very high	94.2	Very high	9 Å²	9	27.8 Å²	27.8	5%	0.048	15%	0.151	C	C	.	.	H	α-helix	trans	-73.7	-13.1	176.7	-76.1	-83	0	0	0	113.8	A217 W218 A219 W224 H232 F262	A217-N221 PolarHBondContact O-N 3.28Å; A217-N221 PolarHBondContact O-ND2 3.1Å; W218-N221 PolarHBondContact O-N 3.45Å; A219-N221 PolarHBondContact O-N 3.34Å; N221-W224 CarbonylContact C-O 3.48Å; N221-W224 WeakPolarHBondContact CA-O 3.43Å; N221-H232 PolarHBondContact ND2-NE2 3.41Å; N221-F262 HydrophobicContact CB-CD1 4.12Å; N221-F262 HydrophobicContact CB-CD2 4.47Å; N221-F262 HydrophobicContact CB-CE1 3.57Å; N221-F262 HydrophobicContact CB-CE2 3.96Å; N221-F262 HydrophobicContact CB-CZ 3.5Å; N221-F262 VanDerWaalsContact CB-CZ 3.5Å
222	T	96	Very high	94.2	Very high	69 Å²	69	27.5 Å²	27.5	42%	0.423	15%	0.149	S	C	.	.	H	α-helix	trans	-81.9	-42.7	169.2	-57.3	0	0	0	0	110.5	F184 W218 A219 T220	F184-T222 WeakPolarHBondContact CE2-OG1 3.34Å; F184-T222 HydrophobicContact CZ-CG2 3.98Å; F184-T222 WeakPolarHBondContact CZ-OG1 3.46Å; W218-T222 PolarHBondContact O-N 3.31Å; W218-T222 PolarHBondContact O-OG1 3Å; A219-T222 WeakPolarHBondContact O-CB 3.5Å; A219-T222 PolarHBondContact O-N 3.39Å; A219-T222 VanDerWaalsContact O-N 3.11Å; T220-T222 PolarHBondContact O-N 2.65Å
223	V	97.1	Very high	94.2	Very high	12 Å²	12	28.4 Å²	28.4	7%	0.073	15%	0.151	C	C	.	.	H	α-helix	trans	-76.4	-39.9	-179.2	174.8	0	0	0	0	112	C188 L191 R195 A219 T220	C188-V223 HydrophobicContact CB-CG2 4.33Å; L191-V223 HydrophobicContact CB-CB 4.21Å; L191-V223 HydrophobicContact CB-CG1 4.05Å; L191-V223 HydrophobicContact CB-CG2 3.96Å; R195-V223 HydrophobicContact CB-CG1 3.89Å; R195-V223 WeakPolarHBondContact CD-O 3.35Å; R195-V223 PolarHBondContact NH1-O 3.35Å; A219-V223 WeakPolarHBondContact O-CG2 3.46Å; A219-V223 PolarHBondContact O-N 3.33Å; T220-V223 PolarHBondContact O-N 3.37Å
224	W	96.5	Very high	94.3	Very high	6 Å²	6	28.2 Å²	28.2	2%	0.023	15%	0.15	C	C	.	.	S	Bend	trans	-114.6	109.2	170.6	-67.2	-87.9	0	0	0	108.2	L191 I194 R195 F201 P203 T220 N221 C228 L280	L191-W224 HydrophobicContact CB-CH2 3.96Å; L191-W224 HydrophobicContact CB-CZ3 3.79Å; L191-W224 HydrophobicContact CD1-CZ3 4.01Å; L191-W224 HydrophobicContact CD2-CH2 4.14Å; L191-W224 HydrophobicContact CD2-CZ3 4.04Å; L191-W224 HydrophobicContact CG-CZ3 4.15Å; I194-W224 HydrophobicContact CB-CH2 4.3Å; I194-W224 HydrophobicContact CB-CZ2 4.33Å; I194-W224 HydrophobicContact CG2-CH2 4.38Å; I194-W224 HydrophobicContact CG2-CZ2 4.15Å; R195-W224 HydrophobicContact CB-CZ2 4Å; F201-W224 AromaticContact CD1-CZ2 3.86Å; F201-W224 HydrophobicContact CD1-CZ2 3.86Å; F201-W224 HydrophobicContact CE1-CH2 4.34Å; F201-W224 HydrophobicContact CE1-CZ2 4.02Å; F201-W224 PolarHBondContact O-NE1 3.13Å; P203-W224 HydrophobicContact CG-CD2 3.71Å; P203-W224 HydrophobicContact CG-CE3 3.79Å; P203-W224 HydrophobicContact CG-CG 4.07Å; P203-W224 HydrophobicContact CG-CZ2 4.46Å; P203-W224 HydrophobicContact CG-CZ3 4.18Å; T220-W224 HydrophobicContact CG2-CE3 3.88Å; T220-W224 HydrophobicContact CG2-CZ3 4.21Å; T220-W224 PolarHBondContact O-N 2.67Å; N221-W224 CarbonylContact C-O 3.48Å; N221-W224 WeakPolarHBondContact CA-O 3.43Å; W224-C228 HydrophobicContact CB-CB 3.96Å; W224-L280 HydrophobicContact CH2-CD2 4.43Å; W224-L280 HydrophobicContact CZ3-CD2 3.96Å
225	P	81.5	Confident	94.3	Very high	70 Å²	70	28.3 Å²	28.3	46%	0.455	15%	0.15	S	C	.	.			trans	-53.8	159.9	-170.1	-28.8	34.4	0	0	0	114.8	G227 C228	P225-G227 PolarHBondContact O-N 2.83Å; P225-C228 WeakPolarHBondContact O-CB 3.24Å; P225-C228 PolarHBondContact O-N 3.01Å; P225-C228 VanDerWaalsContact O-N 3.12Å; P225-C228 PolarHBondContact O-SG 3.26Å
226	V	73.2	Confident	94.3	Very high	112 Å²	112	28.7 Å²	28.7	68%	0.679	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.6	125.3	-170.1	-179.6	0	0	0	0	112
227	G	82.5	Confident	94	Very high	11 Å²	11	32.1 Å²	32.1	11%	0.113	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.4	-0.4	178.4	0	0	0	0	0	115.5	P225 R230	P225-G227 PolarHBondContact O-N 2.83Å; G227-R230 PolarHBondContact O-NE 3.23Å; G227-R230 PolarHBondContact O-NH1 2.89Å; G227-R230 PolarHBondContact O-NH2 2.83Å
228	C	92.2	Very high	93.9	Very high	28 Å²	28	32.8 Å²	32.8	19%	0.189	18%	0.179	C	C	.	.	S	Bend	trans	-66	-52.6	164	-69	0	0	0	0	110.9	I202 P203 K204 W224 P225	I202-C228 HydrophobicContact CG2-CB 3.53Å; I202-C228 VanDerWaalsContact CG2-SG 3.6Å; P203-C228 CarbonylContact O-C 3.56Å; K204-C228 WeakPolarHBondContact CD-O 3.37Å; W224-C228 HydrophobicContact CB-CB 3.96Å; P225-C228 WeakPolarHBondContact O-CB 3.24Å; P225-C228 PolarHBondContact O-N 3.01Å; P225-C228 VanDerWaalsContact O-N 3.12Å; P225-C228 PolarHBondContact O-SG 3.26Å
229	V	95.6	Very high	93.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.195	C	C	.	.			trans	-88.8	125.3	178.8	-168.6	0	0	0	0	109.4	P203 L206 T220 Q231 H232	P203-V229 HydrophobicContact CB-CG2 4.48Å; P203-V229 HydrophobicContact CG-CG2 4.12Å; P203-V229 WeakPolarHBondContact O-CG2 3.39Å; L206-V229 HydrophobicContact CB-CG1 4.05Å; T220-V229 HydrophobicContact CG2-CG2 3.77Å; V229-Q231 WeakPolarHBondContact CG1-O 3.29Å; V229-H232 VanDerWaalsContact CG1-NE2 3.29Å; V229-H232 WeakPolarHBondContact CG1-NE2 3.15Å
230	R	94.3	Very high	93.6	Very high	155 Å²	155	39.7 Å²	39.7	59%	0.585	21%	0.213	S	C	*	.			trans	-109.3	-15.3	-177.7	-59.7	-60.4	-172.4	-161.2	-4.2	113.3	K204 G227 G264	K204-R230 PolarHBondContact O-N 2.76Å; G227-R230 PolarHBondContact O-NE 3.23Å; G227-R230 PolarHBondContact O-NH1 2.89Å; G227-R230 PolarHBondContact O-NH2 2.83Å; R230-G264 WeakPolarHBondContact O-CA 3.3Å
231	Q	96.1	Very high	93.5	Very high	71 Å²	71	39.8 Å²	39.8	33%	0.332	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	124.3	-179.5	-176	175.8	25.1	0	0	109.6	K204 S205 L206 V229 G264 Y266	K204-Q231 PolarHBondContact O-N 3.44Å; S205-Q231 WeakPolarHBondContact CA-O 3.45Å; L206-Q231 PolarHBondContact N-O 2.88Å; V229-Q231 WeakPolarHBondContact CG1-O 3.29Å; Q231-G264 CarbonylContact C-O 3.5Å; Q231-G264 WeakPolarHBondContact CA-O 3.37Å; Q231-Y266 HydrophobicContact CG-CD2 4.15Å; Q231-Y266 HydrophobicContact CG-CE2 4.02Å
232	H	97.4	Very high	93.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	106.6	176.6	-49.4	80.3	0	0	0	107.3	N221 V229 L234 P263 G264 V265 Y266	N221-H232 PolarHBondContact ND2-NE2 3.41Å; V229-H232 VanDerWaalsContact CG1-NE2 3.29Å; V229-H232 WeakPolarHBondContact CG1-NE2 3.15Å; H232-L234 HydrophobicContact CB-CD2 4.23Å; H232-P263 PolarHBondContact CE1-O 3.26Å; H232-P263 PolarHBondContact ND1-O 3.27Å; H232-G264 PolarHBondContact N-O 3.24Å; H232-V265 HydrophobicContact CB-CG2 4.14Å; H232-Y266 PolarHBondContact O-N 2.92Å
233	Y	97.6	Very high	93.5	Very high	25 Å²	25	43.9 Å²	43.9	10%	0.098	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	104.4	-179.7	-160.4	-80.3	0	0	0	108.9	L206 F207 D208 V235 R268 P272 Y278	L206-Y233 PolarHBondContact O-N 3.19Å; F207-Y233 WeakPolarHBondContact CA-O 3.49Å; F207-Y233 AromaticContact CD2-CD1 3.55Å; F207-Y233 HydrophobicContact CD2-CD1 3.55Å; F207-Y233 HydrophobicContact CD2-CE1 4.34Å; F207-Y233 AromaticContact CD2-CG 3.97Å; F207-Y233 HydrophobicContact CD2-CG 3.97Å; F207-Y233 AromaticContact CE2-CD1 3.26Å; F207-Y233 HydrophobicContact CE2-CD1 3.26Å; F207-Y233 AromaticContact CE2-CE1 3.63Å; F207-Y233 HydrophobicContact CE2-CE1 3.63Å; F207-Y233 HydrophobicContact CE2-CG 4.09Å; F207-Y233 HydrophobicContact CZ-CD1 4.14Å; F207-Y233 HydrophobicContact CZ-CE1 4.35Å; D208-Y233 PolarHBondContact N-O 2.66Å; Y233-V235 HydrophobicContact CD1-CG2 3.79Å; Y233-V235 HydrophobicContact CE1-CG2 3.72Å; Y233-R268 HydrophobicContact CD1-CG 4.46Å; Y233-R268 HydrophobicContact CE1-CB 4.02Å; Y233-R268 HydrophobicContact CE1-CG 3.7Å; Y233-R268 HydrophobicContact CE2-CG 4.05Å; Y233-R268 VanDerWaalsContact CZ-CG 3.49Å; Y233-R268 WeakPolarHBondContact OH-CG 3.44Å; Y233-P272 HydrophobicContact CE1-CG 3.71Å; Y233-P272 WeakPolarHBondContact OH-CB 3.43Å; Y233-P272 WeakPolarHBondContact OH-CG 2.89Å; Y233-Y278 HydrophobicContact CD2-CE1 4.49Å; Y233-Y278 VanDerWaalsContact CD2-OH 3.32Å; Y233-Y278 WeakPolarHBondContact CD2-OH 3.17Å; Y233-Y278 HydrophobicContact CG-CE1 4.26Å
234	L	98.3	Very high	93.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	112.7	-169.4	-51.8	-172.1	0	0	0	109.4	D208 A217 H232 F249 V265 Y266 H267 R268	D208-L234 HydrophobicContact CB-CD2 3.71Å; A217-L234 HydrophobicContact CB-CD2 4.11Å; H232-L234 HydrophobicContact CB-CD2 4.23Å; L234-F249 HydrophobicContact CD1-CD2 4.41Å; L234-F249 HydrophobicContact CD1-CE2 3.6Å; L234-F249 HydrophobicContact CD1-CZ 4.13Å; L234-V265 HydrophobicContact CD1-CG1 3.8Å; L234-V265 HydrophobicContact CG-CG1 4.45Å; L234-Y266 PolarHBondContact N-O 2.91Å; L234-H267 CarbonylContact O-C 3.57Å; L234-H267 WeakPolarHBondContact O-CA 3.32Å; L234-R268 PolarHBondContact O-N 3.34Å
235	V	98.1	Very high	93.5	Very high	3 Å²	3	43 Å²	43	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	112.8	-179.2	-177.5	0	0	0	0	110.4	F207 D208 F209 G210 S211 Y233 R268	F207-V235 HydrophobicContact CE1-CG2 4.06Å; F207-V235 HydrophobicContact CE2-CG2 4.05Å; F207-V235 HydrophobicContact CZ-CG2 3.51Å; D208-V235 PolarHBondContact O-N 3.3Å; F209-V235 HydrophobicContact CD2-CB 4.25Å; F209-V235 HydrophobicContact CD2-CG1 4.09Å; F209-V235 HydrophobicContact CE2-CG1 4.23Å; G210-V235 WeakPolarHBondContact CA-O 3.26Å; G210-V235 PolarHBondContact N-O 2.86Å; S211-V235 PolarHBondContact N-O 2.83Å; S211-V235 PolarHBondContact OG-N 2.78Å; S211-V235 PolarHBondContact OG-O 3.04Å; Y233-V235 HydrophobicContact CD1-CG2 3.79Å; Y233-V235 HydrophobicContact CE1-CG2 3.72Å; V235-R268 CarbonylContact C-O 3.55Å; V235-R268 VanDerWaalsContact CA-O 3.25Å; V235-R268 WeakPolarHBondContact CA-O 3.08Å; V235-R268 HydrophobicContact CG2-CB 4.47Å
236	E	97.2	Very high	94.1	Very high	14 Å²	14	44.3 Å²	44.3	7%	0.065	22%	0.217	C	C	.	.			trans	-142.1	116.6	-179.3	174.3	49.7	-122.7	0	0	111	S211 G212 S238 M241 R268 R269	S211-E236 WeakPolarHBondContact OG-CB 3.06Å; G212-E236 VanDerWaalsContact CA-OE2 3.28Å; G212-E236 WeakPolarHBondContact CA-OE2 3.38Å; G212-E236 PolarHBondContact N-OE2 2.95Å; E236-S238 VanDerWaalsContact OE1-CB 3.23Å; E236-S238 WeakPolarHBondContact OE1-CB 3.33Å; E236-S238 PolarHBondContact OE1-N 3.26Å; E236-M241 HydrophobicContact CG-CB 3.56Å; E236-R268 PolarHBondContact N-O 2.82Å; E236-R269 WeakPolarHBondContact O-CA 3.45Å
237	P	93.6	Very high	95.1	Very high	80 Å²	80	40.3 Å²	40.3	52%	0.519	19%	0.191	S	C	.	.	S	Bend	trans	-68.1	-32.2	-180	26.4	-35.4	0	0	0	114.1	L239 R269	P237-L239 PolarHBondContact O-N 3.48Å; P237-R269 WeakPolarHBondContact CA-O 3.42Å
238	S	94	Very high	95.7	Very high	13 Å²	13	39.9 Å²	39.9	9%	0.091	19%	0.186	C	C	.	.			trans	-73.6	122.2	-179.4	172.7	0	0	0	0	111.5	Y167 E236 H240 M241 T242	Y167-S238 PolarHBondContact O-OG 3.36Å; E236-S238 VanDerWaalsContact OE1-CB 3.23Å; E236-S238 WeakPolarHBondContact OE1-CB 3.33Å; E236-S238 PolarHBondContact OE1-N 3.26Å; S238-H240 VanDerWaalsContact C-N 3.31Å; S238-H240 PolarHBondContact O-N 3.23Å; S238-H240 PolarHBondContact OG-N 2.76Å; S238-M241 PolarHBondContact O-N 3.09Å; S238-M241 PolarHBondContact OG-N 2.81Å; S238-T242 WeakPolarHBondContact O-CB 3.27Å; S238-T242 PolarHBondContact O-N 2.87Å; S238-T242 PolarHBondContact O-OG1 3.43Å
239	L	94.5	Very high	95.8	Very high	75 Å²	75	38.8 Å²	38.8	39%	0.393	18%	0.178	S	C	.	.	H	α-helix	trans	-65.3	-34.7	174.8	-73.7	174.8	0	0	0	112.1	P237 T242 R243 R269	P237-L239 PolarHBondContact O-N 3.48Å; L239-T242 PolarHBondContact O-N 2.93Å; L239-R243 WeakPolarHBondContact O-CB 3.1Å; L239-R243 VanDerWaalsContact O-CG 3.29Å; L239-R243 WeakPolarHBondContact O-CG 3.34Å; L239-R243 PolarHBondContact O-N 2.74Å; L239-R269 HydrophobicContact CD2-CG 4.29Å
240	H	95.5	Very high	95.6	Very high	80 Å²	80	42.4 Å²	42.4	37%	0.37	20%	0.195	S	C	.	.	H	α-helix	trans	-70.8	-41.9	179	-66.7	-77.5	0	0	0	111.5	Y167 C172 S238 T242 R243 L244	Y167-H240 WeakPolarHBondContact O-CB 3.49Å; C172-H240 WeakPolarHBondContact SG-CB 3.34Å; S238-H240 VanDerWaalsContact C-N 3.31Å; S238-H240 PolarHBondContact O-N 3.23Å; S238-H240 PolarHBondContact OG-N 2.76Å; H240-T242 VanDerWaalsContact C-N 3.32Å; H240-T242 PolarHBondContact O-N 2.61Å; H240-R243 PolarHBondContact O-N 3Å; H240-L244 WeakPolarHBondContact O-CB 3.43Å; H240-L244 PolarHBondContact O-N 2.83Å
241	M	96.8	Very high	95	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.015	18%	0.183	C	C	.	.	H	α-helix	trans	-60.9	-43.7	172.4	-76.9	-67.7	177.4	0	0	111.5	Y167 C172 Y175 L213 E236 S238 L244 S245	Y167-M241 HydrophobicContact CD1-CE 3.23Å; Y167-M241 HydrophobicContact CE1-CE 3.71Å; Y167-M241 HydrophobicContact CG-CE 3.91Å; Y167-M241 HydrophobicContact CG-CG 4.45Å; C172-M241 HydrophobicContact CB-CE 4.22Å; C172-M241 HydrophobicContact CB-SD 4.31Å; Y175-M241 HydrophobicContact CD1-CE 3.65Å; Y175-M241 HydrophobicContact CD1-SD 4.37Å; Y175-M241 HydrophobicContact CD2-CE 4.18Å; Y175-M241 HydrophobicContact CE1-CE 4.34Å; Y175-M241 HydrophobicContact CG-CE 3.58Å; L213-M241 HydrophobicContact CD2-SD 3.58Å; L213-M241 VanDerWaalsContact CD2-SD 3.58Å; L213-M241 HydrophobicContact CG-SD 4.28Å; E236-M241 HydrophobicContact CG-CB 3.56Å; S238-M241 PolarHBondContact O-N 3.09Å; S238-M241 PolarHBondContact OG-N 2.81Å; M241-L244 PolarHBondContact O-N 2.89Å; M241-S245 WeakPolarHBondContact O-CB 3.46Å; M241-S245 PolarHBondContact O-N 3.16Å
242	T	96.3	Very high	94	Very high	11 Å²	11	40.2 Å²	40.2	7%	0.067	19%	0.19	C	C	.	.	H	α-helix	trans	-60.3	-49.4	178.1	-61.3	0	0	0	0	111.4	S238 L239 H240 L244 S245 E246 H267	S238-T242 WeakPolarHBondContact O-CB 3.27Å; S238-T242 PolarHBondContact O-N 2.87Å; S238-T242 PolarHBondContact O-OG1 3.43Å; L239-T242 PolarHBondContact O-N 2.93Å; H240-T242 VanDerWaalsContact C-N 3.32Å; H240-T242 PolarHBondContact O-N 2.61Å; T242-L244 VanDerWaalsContact C-N 3.34Å; T242-L244 PolarHBondContact O-N 3.18Å; T242-S245 WeakPolarHBondContact O-CB 3.42Å; T242-S245 PolarHBondContact O-N 3.41Å; T242-S245 VanDerWaalsContact O-N 3.16Å; T242-E246 HydrophobicContact CG2-CG 4.42Å; T242-E246 WeakPolarHBondContact O-CG 3.42Å; T242-E246 PolarHBondContact O-N 3.29Å; T242-H267 HydrophobicContact CG2-CB 3.8Å
243	R	95.1	Very high	92.8	Very high	153 Å²	153	44.2 Å²	44.2	58%	0.577	23%	0.232	S	C	*	.	H	α-helix	trans	-59.8	-43.3	177.7	-74.7	172.4	-179.3	172.1	1.2	112.3	L239 H240 E246 F247	L239-R243 WeakPolarHBondContact O-CB 3.1Å; L239-R243 VanDerWaalsContact O-CG 3.29Å; L239-R243 WeakPolarHBondContact O-CG 3.34Å; L239-R243 PolarHBondContact O-N 2.74Å; H240-R243 PolarHBondContact O-N 3Å; R243-E246 PolarHBondContact O-N 2.76Å; R243-F247 PolarHBondContact O-N 2.79Å
244	L	95.7	Very high	91.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.9	-44.2	175.5	178.2	50.4	0	0	0	110.9	Y82 C172 L176 L213 H240 M241 T242 E246 F247 M248	Y82-L244 HydrophobicContact CD1-CD1 3.44Å; Y82-L244 VanDerWaalsContact CD1-CD1 3.44Å; Y82-L244 HydrophobicContact CD2-CD1 3.49Å; Y82-L244 VanDerWaalsContact CD2-CD1 3.49Å; Y82-L244 HydrophobicContact CE1-CD1 3.51Å; Y82-L244 HydrophobicContact CE1-CD2 4.3Å; Y82-L244 HydrophobicContact CE1-CG 4.46Å; Y82-L244 HydrophobicContact CE2-CD1 3.55Å; Y82-L244 HydrophobicContact CG-CD1 3.43Å; Y82-L244 VanDerWaalsContact CG-CD1 3.43Å; C172-L244 HydrophobicContact CB-CD2 4.01Å; L176-L244 HydrophobicContact CB-CD2 4.25Å; L176-L244 HydrophobicContact CD1-CD1 3.91Å; L176-L244 HydrophobicContact CD1-CD2 3.99Å; L176-L244 HydrophobicContact CD1-CG 4.35Å; L213-L244 HydrophobicContact CD2-CB 4.47Å; L213-L244 HydrophobicContact CD2-CD2 3.37Å; L213-L244 HydrophobicContact CD2-CG 3.76Å; H240-L244 WeakPolarHBondContact O-CB 3.43Å; H240-L244 PolarHBondContact O-N 2.83Å; M241-L244 PolarHBondContact O-N 2.89Å; T242-L244 VanDerWaalsContact C-N 3.34Å; T242-L244 PolarHBondContact O-N 3.18Å; L244-E246 PolarHBondContact O-N 2.98Å; L244-F247 WeakPolarHBondContact O-CB 3.49Å; L244-F247 PolarHBondContact O-N 3.38Å; L244-M248 HydrophobicContact CD1-CG 4.44Å; L244-M248 HydrophobicContact CD1-SD 4.45Å; L244-M248 VanDerWaalsContact O-CG 3.28Å; L244-M248 WeakPolarHBondContact O-CG 3.32Å; L244-M248 PolarHBondContact O-N 3.09Å
245	S	97	Very high	90.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.7	-44.3	175.3	-173.1	0	0	0	0	112.3	L213 G214 M241 T242 F247 M248 F249 H267	L213-S245 VanDerWaalsContact C-OG 3.24Å; L213-S245 WeakPolarHBondContact O-CB 3.31Å; L213-S245 PolarHBondContact O-OG 3.12Å; G214-S245 PolarHBondContact N-OG 3.48Å; M241-S245 WeakPolarHBondContact O-CB 3.46Å; M241-S245 PolarHBondContact O-N 3.16Å; T242-S245 WeakPolarHBondContact O-CB 3.42Å; T242-S245 PolarHBondContact O-N 3.41Å; T242-S245 VanDerWaalsContact O-N 3.16Å; S245-F247 VanDerWaalsContact C-N 3.33Å; S245-F247 PolarHBondContact O-N 3.49Å; S245-M248 WeakPolarHBondContact O-CB 3.43Å; S245-M248 PolarHBondContact O-N 3.02Å; S245-M248 VanDerWaalsContact O-N 3.16Å; S245-F249 WeakPolarHBondContact O-CD2 3.45Å; S245-F249 PolarHBondContact O-N 2.85Å; S245-F249 VanDerWaalsContact OG-CE2 3.31Å; S245-F249 WeakPolarHBondContact OG-CE2 3.16Å; S245-H267 WeakPolarHBondContact CB-NE2 3.33Å; S245-H267 PolarHBondContact OG-NE2 3.26Å
246	E	95.3	Very high	88.8	Confident	96 Å²	96	55.5 Å²	55.5	45%	0.449	31%	0.306	S	S	.	.	H	α-helix	trans	-58	-45	174.9	-73.3	169.8	164.9	0	0	111.3	T242 R243 L244 M248 F249 Q250	T242-E246 HydrophobicContact CG2-CG 4.42Å; T242-E246 WeakPolarHBondContact O-CG 3.42Å; T242-E246 PolarHBondContact O-N 3.29Å; R243-E246 PolarHBondContact O-N 2.76Å; L244-E246 PolarHBondContact O-N 2.98Å; E246-M248 PolarHBondContact O-N 3.15Å; E246-F249 PolarHBondContact O-N 3.14Å; E246-Q250 PolarHBondContact O-N 3.49Å
247	F	94.3	Very high	87.2	Confident	29 Å²	29	58.4 Å²	58.4	13%	0.127	33%	0.326	C	S	.	.	H	α-helix	trans	-58.4	-46.2	173.5	-172.6	-80.9	0	0	0	111.6	V78 Y82 H86 R243 L244 S245 F249 Q250	V78-F247 HydrophobicContact CG1-CD1 3.71Å; V78-F247 HydrophobicContact CG1-CE1 3.69Å; Y82-F247 HydrophobicContact CD2-CB 4.17Å; Y82-F247 AromaticContact CD2-CD1 3.7Å; Y82-F247 HydrophobicContact CD2-CD1 3.7Å; Y82-F247 HydrophobicContact CD2-CD2 4.02Å; Y82-F247 HydrophobicContact CD2-CE1 4.04Å; Y82-F247 HydrophobicContact CD2-CE2 4.31Å; Y82-F247 AromaticContact CD2-CG 3.7Å; Y82-F247 HydrophobicContact CD2-CG 3.7Å; Y82-F247 HydrophobicContact CD2-CZ 4.32Å; Y82-F247 HydrophobicContact CE2-CG 4.47Å; Y82-F247 HydrophobicContact CG-CD1 4.19Å; Y82-F247 HydrophobicContact CG-CE1 4.3Å; H86-F247 AromaticContact NE2-CE2 3.79Å; R243-F247 PolarHBondContact O-N 2.79Å; L244-F247 WeakPolarHBondContact O-CB 3.49Å; L244-F247 PolarHBondContact O-N 3.38Å; S245-F247 VanDerWaalsContact C-N 3.33Å; S245-F247 PolarHBondContact O-N 3.49Å; F247-F249 VanDerWaalsContact C-N 3.25Å; F247-F249 PolarHBondContact O-N 2.89Å; F247-Q250 WeakPolarHBondContact O-CB 3.46Å; F247-Q250 PolarHBondContact O-N 3.45Å; F247-Q250 VanDerWaalsContact O-N 3.16Å
248	M	94.8	Very high	86.1	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-59.8	-35.8	177.6	-65.4	-50.4	-62.3	0	0	112.5	L75 V78 A79 W218 L244 S245 E246	L75-M248 HydrophobicContact CD1-CE 3.23Å; L75-M248 HydrophobicContact CG-CE 4.16Å; L75-M248 WeakPolarHBondContact O-CE 3.46Å; V78-M248 HydrophobicContact CB-CE 4.02Å; V78-M248 HydrophobicContact CB-SD 4.44Å; V78-M248 HydrophobicContact CG1-CE 3.99Å; V78-M248 HydrophobicContact CG1-SD 3.82Å; A79-M248 HydrophobicContact CB-CE 3.62Å; A79-M248 HydrophobicContact CB-SD 4.08Å; W218-M248 WeakPolarHBondContact CZ2-O 3.4Å; L244-M248 HydrophobicContact CD1-CG 4.44Å; L244-M248 HydrophobicContact CD1-SD 4.45Å; L244-M248 VanDerWaalsContact O-CG 3.28Å; L244-M248 WeakPolarHBondContact O-CG 3.32Å; L244-M248 PolarHBondContact O-N 3.09Å; S245-M248 WeakPolarHBondContact O-CB 3.43Å; S245-M248 PolarHBondContact O-N 3.02Å; S245-M248 VanDerWaalsContact O-N 3.16Å; E246-M248 PolarHBondContact O-N 3.15Å
249	F	94.6	Very high	85.6	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.018	36%	0.355	C	S	.	.	H	α-helix	trans	-85.7	-9.2	179.4	-75.7	-62.3	0	0	0	114.5	A217 W218 L234 S245 E246 F247 K251 S260 V261 F262 V265 H267	A217-F249 HydrophobicContact CB-CE1 4.3Å; A217-F249 HydrophobicContact CB-CZ 3.82Å; W218-F249 AromaticContact CD1-CE1 3.63Å; W218-F249 AromaticContact CD1-CZ 3.62Å; W218-F249 HydrophobicContact CD2-CE1 4.42Å; W218-F249 AromaticContact CE2-CE1 3.74Å; W218-F249 HydrophobicContact CG-CE1 4.35Å; W218-F249 HydrophobicContact CZ2-CD1 4.16Å; W218-F249 HydrophobicContact CZ2-CE1 4.31Å; W218-F249 AromaticContact NE1-CD1 3.7Å; W218-F249 AromaticContact NE1-CE1 3.18Å; W218-F249 AromaticContact NE1-CZ 3.46Å; L234-F249 HydrophobicContact CD1-CD2 4.41Å; L234-F249 HydrophobicContact CD1-CE2 3.6Å; L234-F249 HydrophobicContact CD1-CZ 4.13Å; S245-F249 WeakPolarHBondContact O-CD2 3.45Å; S245-F249 PolarHBondContact O-N 2.85Å; S245-F249 VanDerWaalsContact OG-CE2 3.31Å; S245-F249 WeakPolarHBondContact OG-CE2 3.16Å; E246-F249 PolarHBondContact O-N 3.14Å; F247-F249 VanDerWaalsContact C-N 3.25Å; F247-F249 PolarHBondContact O-N 2.89Å; F249-K251 PolarHBondContact O-N 2.78Å; F249-S260 CarbonylContact O-C 3.5Å; F249-S260 VanDerWaalsContact O-CA 3.29Å; F249-S260 WeakPolarHBondContact O-CA 3.45Å; F249-S260 PolarHBondContact O-OG 2.7Å; F249-V261 WeakPolarHBondContact O-CG2 3.21Å; F249-V261 PolarHBondContact O-N 3.4Å; F249-F262 AromaticContact CD1-CD2 3.95Å; F249-F262 HydrophobicContact CD1-CD2 3.95Å; F249-F262 HydrophobicContact CD1-CE2 4.27Å; F249-F262 AromaticContact CE1-CD2 3.58Å; F249-F262 HydrophobicContact CE1-CD2 3.58Å; F249-F262 AromaticContact CE1-CE2 3.72Å; F249-F262 HydrophobicContact CE1-CE2 3.72Å; F249-V265 HydrophobicContact CD1-CG2 4.45Å; F249-V265 HydrophobicContact CD2-CG1 4.09Å; F249-V265 HydrophobicContact CE2-CG1 4.34Å; F249-V265 HydrophobicContact CG-CG1 4.34Å; F249-H267 AromaticContact CD2-CE1 3.83Å; F249-H267 AromaticContact CD2-NE2 3.93Å
250	Q	90.8	Very high	85.4	Confident	76 Å²	76	65 Å²	65	36%	0.355	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-69.2	132.4	-179.6	-167.3	175.9	14.9	0	0	110.5	E246 F247 Q252 P257	E246-Q250 PolarHBondContact O-N 3.49Å; F247-Q250 WeakPolarHBondContact O-CB 3.46Å; F247-Q250 PolarHBondContact O-N 3.45Å; F247-Q250 VanDerWaalsContact O-N 3.16Å; Q250-Q252 PolarHBondContact O-N 3.38Å; Q250-P257 PolarHBondContact NE2-O 3.41Å
251	K	81.6	Confident	85.2	Confident	78 Å²	78	62.1 Å²	62.1	34%	0.339	34%	0.336	S	S	.	.			trans	-78.5	103.4	175	-170.9	-179.2	173.3	-166.1	0	110	F249 G253 S254 E259	F249-K251 PolarHBondContact O-N 2.78Å; K251-G253 PolarHBondContact O-N 3.17Å; K251-S254 PolarHBondContact O-N 3.36Å; K251-E259 HydrophobicContact CB-CB 4.46Å; K251-E259 VanDerWaalsContact CB-O 3.26Å; K251-E259 WeakPolarHBondContact CB-O 3.47Å; K251-E259 HydrophobicContact CD-CB 4.49Å; K251-E259 VanDerWaalsContact CD-CD 3.48Å; K251-E259 HydrophobicContact CD-CG 4.13Å; K251-E259 WeakPolarHBondContact CD-OE2 3.44Å; K251-E259 PolarHBondContact N-O 2.83Å; K251-E259 IonicContact NZ-OE1 2.72Å; K251-E259 PolarHBondContact NZ-OE1 2.82Å; K251-E259 IonicContact NZ-OE2 2.9Å; K251-E259 PolarHBondContact NZ-OE2 3.35Å
252	Q	75	Confident	85	Confident	102 Å²	102	62.6 Å²	62.6	48%	0.477	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	132.9	176.1	-59.8	-58.3	-25.8	0	0	111.2	V78 Q250 S254	V78-Q252 HydrophobicContact CG2-CG 4.11Å; Q250-Q252 PolarHBondContact O-N 3.38Å; Q252-S254 VanDerWaalsContact C-N 3.34Å; Q252-S254 PolarHBondContact O-N 3.36Å
253	G	73.2	Confident	84.7	Confident	85 Å²	85	64.9 Å²	64.9	88%	0.876	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	7.9	179.4	0	0	0	0	0	116.3	K251	K251-G253 PolarHBondContact O-N 3.17Å
254	S	69.8	Low	84.6	Confident	33 Å²	33	58.6 Å²	58.6	23%	0.231	34%	0.335	C	S	.	.			trans	-72.9	139.8	171.5	-171.2	0	0	0	0	111.1	K251 Q252 Q256 E259	K251-S254 PolarHBondContact O-N 3.36Å; Q252-S254 VanDerWaalsContact C-N 3.34Å; Q252-S254 PolarHBondContact O-N 3.36Å; S254-Q256 PolarHBondContact O-N 2.92Å; S254-Q256 PolarHBondContact OG-N 3.09Å; S254-E259 WeakPolarHBondContact CB-OE2 3Å; S254-E259 PolarHBondContact OG-OE2 3.09Å
255	A	69.9	Low	84.5	Confident	102 Å²	102	59.8 Å²	59.8	84%	0.843	34%	0.343	S	S	*	.	S	Bend	trans	-64.9	-19.4	170.8	0	0	0	0	0	112.4
256	Q	70.7	Confident	84.5	Confident	130 Å²	130	64.6 Å²	64.6	61%	0.607	36%	0.362	S	S	*	.	S	Bend	trans	-100	110.4	176	-66.5	-65.9	-10.5	0	0	109.2	S254 F258 E259	S254-Q256 PolarHBondContact O-N 2.92Å; S254-Q256 PolarHBondContact OG-N 3.09Å; Q256-F258 PolarHBondContact O-N 3.01Å; Q256-E259 HydrophobicContact CB-CB 4.32Å; Q256-E259 PolarHBondContact O-N 2.88Å
257	P	63.7	Low	84.5	Confident	74 Å²	74	61.5 Å²	61.5	48%	0.481	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-16.6	-173	20.7	-30.5	0	0	0	114.3	Q250	Q250-P257 PolarHBondContact NE2-O 3.41Å
258	F	70.6	Confident	84.6	Confident	195 Å²	195	65.2 Å²	65.2	86%	0.855	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	10.5	-176.1	-55	-69.4	0	0	0	114.2	Q256 S260	Q256-F258 PolarHBondContact O-N 3.01Å; F258-S260 PolarHBondContact O-N 3.43Å
259	E	83.4	Confident	84.5	Confident	77 Å²	77	70.6 Å²	70.6	36%	0.36	38%	0.38	S	S	.	.			trans	-74	118.6	177.4	-162.1	-172.9	168.7	0	0	110.5	K251 S254 Q256	K251-E259 HydrophobicContact CB-CB 4.46Å; K251-E259 VanDerWaalsContact CB-O 3.26Å; K251-E259 WeakPolarHBondContact CB-O 3.47Å; K251-E259 HydrophobicContact CD-CB 4.49Å; K251-E259 VanDerWaalsContact CD-CD 3.48Å; K251-E259 HydrophobicContact CD-CG 4.13Å; K251-E259 WeakPolarHBondContact CD-OE2 3.44Å; K251-E259 PolarHBondContact N-O 2.83Å; K251-E259 IonicContact NZ-OE1 2.72Å; K251-E259 PolarHBondContact NZ-OE1 2.82Å; K251-E259 IonicContact NZ-OE2 2.9Å; K251-E259 PolarHBondContact NZ-OE2 3.35Å; S254-E259 WeakPolarHBondContact CB-OE2 3Å; S254-E259 PolarHBondContact OG-OE2 3.09Å; Q256-E259 HydrophobicContact CB-CB 4.32Å; Q256-E259 PolarHBondContact O-N 2.88Å
260	S	89.4	Confident	84.3	Confident	36 Å²	36	77.2 Å²	77.2	25%	0.252	41%	0.409	S	S	.	.	B	Isolated β-bridge	trans	-83.1	149.6	174.5	-176.6	0	0	0	0	111.6	F249 F258 F262	F249-S260 CarbonylContact O-C 3.5Å; F249-S260 VanDerWaalsContact O-CA 3.29Å; F249-S260 WeakPolarHBondContact O-CA 3.45Å; F249-S260 PolarHBondContact O-OG 2.7Å; F258-S260 PolarHBondContact O-N 3.43Å; S260-F262 WeakPolarHBondContact CB-O 3.44Å; S260-F262 PolarHBondContact O-N 3.11Å; S260-F262 PolarHBondContact OG-N 3.39Å; S260-F262 PolarHBondContact OG-O 3.02Å
261	V	91.5	Very high	84.2	Confident	19 Å²	19	76.2 Å²	76.2	12%	0.115	41%	0.406	C	S	.	.	S	Bend	trans	-56	-32.9	172.8	169.6	0	0	0	0	112.2	W218 F249	W218-V261 HydrophobicContact CH2-CB 4.36Å; W218-V261 HydrophobicContact CH2-CG1 3.79Å; W218-V261 HydrophobicContact CH2-CG2 4.33Å; W218-V261 HydrophobicContact CZ2-CG1 4.39Å; W218-V261 HydrophobicContact CZ3-CG1 4.28Å; F249-V261 WeakPolarHBondContact O-CG2 3.21Å; F249-V261 PolarHBondContact O-N 3.4Å
262	F	92.1	Very high	84.5	Confident	12 Å²	12	73.5 Å²	73.5	5%	0.053	40%	0.396	C	S	.	.	S	Bend	trans	-119.5	144.4	175.7	-53.4	-48.9	0	0	0	110.6	W218 N221 F249 S260 V265	W218-F262 AromaticContact CD2-CE2 3.89Å; W218-F262 HydrophobicContact CD2-CE2 3.89Å; W218-F262 HydrophobicContact CD2-CZ 4.12Å; W218-F262 AromaticContact CE3-CE2 3.98Å; W218-F262 HydrophobicContact CE3-CE2 3.98Å; W218-F262 AromaticContact CE3-CZ 3.71Å; W218-F262 HydrophobicContact CE3-CZ 3.71Å; W218-F262 HydrophobicContact CG-CE2 4.31Å; W218-F262 HydrophobicContact CH2-CZ 4.45Å; W218-F262 HydrophobicContact CZ3-CE2 4.37Å; W218-F262 AromaticContact CZ3-CZ 3.9Å; W218-F262 HydrophobicContact CZ3-CZ 3.9Å; N221-F262 HydrophobicContact CB-CD1 4.12Å; N221-F262 HydrophobicContact CB-CD2 4.47Å; N221-F262 HydrophobicContact CB-CE1 3.57Å; N221-F262 HydrophobicContact CB-CE2 3.96Å; N221-F262 HydrophobicContact CB-CZ 3.5Å; N221-F262 VanDerWaalsContact CB-CZ 3.5Å; F249-F262 AromaticContact CD1-CD2 3.95Å; F249-F262 HydrophobicContact CD1-CD2 3.95Å; F249-F262 HydrophobicContact CD1-CE2 4.27Å; F249-F262 AromaticContact CE1-CD2 3.58Å; F249-F262 HydrophobicContact CE1-CD2 3.58Å; F249-F262 AromaticContact CE1-CE2 3.72Å; F249-F262 HydrophobicContact CE1-CE2 3.72Å; S260-F262 WeakPolarHBondContact CB-O 3.44Å; S260-F262 PolarHBondContact O-N 3.11Å; S260-F262 PolarHBondContact OG-N 3.39Å; S260-F262 PolarHBondContact OG-O 3.02Å; F262-V265 HydrophobicContact CB-CG2 3.97Å; F262-V265 WeakPolarHBondContact O-CG2 3.28Å
263	P	89.4	Confident	85	Confident	60 Å²	60	74.6 Å²	74.6	39%	0.39	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	146.8	174.6	28.3	-34.1	0	0	0	111.4	H232 V265	H232-P263 PolarHBondContact CE1-O 3.26Å; H232-P263 PolarHBondContact ND1-O 3.27Å; P263-V265 PolarHBondContact O-N 2.86Å
264	G	93.1	Very high	85.6	Confident	20 Å²	20	73.6 Å²	73.6	21%	0.206	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	39.6	170.3	0	0	0	0	0	114.5	R230 Q231 H232 Y266	R230-G264 WeakPolarHBondContact O-CA 3.3Å; Q231-G264 CarbonylContact C-O 3.5Å; Q231-G264 WeakPolarHBondContact CA-O 3.37Å; H232-G264 PolarHBondContact N-O 3.24Å; G264-Y266 WeakPolarHBondContact O-CD2 3.45Å; G264-Y266 WeakPolarHBondContact O-CE2 3.44Å
265	V	95.2	Very high	86.5	Confident	25 Å²	25	79.6 Å²	79.6	15%	0.152	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	122.2	170.9	180	0	0	0	0	109.5	H232 L234 F249 F262 P263	H232-V265 HydrophobicContact CB-CG2 4.14Å; L234-V265 HydrophobicContact CD1-CG1 3.8Å; L234-V265 HydrophobicContact CG-CG1 4.45Å; F249-V265 HydrophobicContact CD1-CG2 4.45Å; F249-V265 HydrophobicContact CD2-CG1 4.09Å; F249-V265 HydrophobicContact CE2-CG1 4.34Å; F249-V265 HydrophobicContact CG-CG1 4.34Å; F262-V265 HydrophobicContact CB-CG2 3.97Å; F262-V265 WeakPolarHBondContact O-CG2 3.28Å; P263-V265 PolarHBondContact O-N 2.86Å
266	Y	95.7	Very high	87.6	Confident	102 Å²	102	78.9 Å²	78.9	40%	0.4	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	104.7	-177.4	-57	-75.1	0	0	0	110.5	Q231 H232 L234 G264	Q231-Y266 HydrophobicContact CG-CD2 4.15Å; Q231-Y266 HydrophobicContact CG-CE2 4.02Å; H232-Y266 PolarHBondContact O-N 2.92Å; L234-Y266 PolarHBondContact N-O 2.91Å; G264-Y266 WeakPolarHBondContact O-CD2 3.45Å; G264-Y266 WeakPolarHBondContact O-CE2 3.44Å
267	H	96.8	Very high	88.9	Confident	31 Å²	31	77.8 Å²	77.8	14%	0.144	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	137.7	172.2	-63	77.1	0	0	0	111.6	L234 T242 S245 F249	L234-H267 CarbonylContact O-C 3.57Å; L234-H267 WeakPolarHBondContact O-CA 3.32Å; T242-H267 HydrophobicContact CG2-CB 3.8Å; S245-H267 WeakPolarHBondContact CB-NE2 3.33Å; S245-H267 PolarHBondContact OG-NE2 3.26Å; F249-H267 AromaticContact CD2-CE1 3.83Å; F249-H267 AromaticContact CD2-NE2 3.93Å
268	R	95.8	Very high	90.6	Very high	107 Å²	107	74.4 Å²	74.4	40%	0.404	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	136	-177.8	-65.6	-71.6	-174.1	-87.6	2.8	110.1	Y233 L234 V235 E236	Y233-R268 HydrophobicContact CD1-CG 4.46Å; Y233-R268 HydrophobicContact CE1-CB 4.02Å; Y233-R268 HydrophobicContact CE1-CG 3.7Å; Y233-R268 HydrophobicContact CE2-CG 4.05Å; Y233-R268 VanDerWaalsContact CZ-CG 3.49Å; Y233-R268 WeakPolarHBondContact OH-CG 3.44Å; L234-R268 PolarHBondContact O-N 3.34Å; V235-R268 CarbonylContact C-O 3.55Å; V235-R268 VanDerWaalsContact CA-O 3.25Å; V235-R268 WeakPolarHBondContact CA-O 3.08Å; V235-R268 HydrophobicContact CG2-CB 4.47Å; E236-R268 PolarHBondContact N-O 2.82Å
269	R	92.9	Very high	91.9	Very high	115 Å²	115	66.9 Å²	66.9	43%	0.434	34%	0.337	S	S	.	.	S	Bend	trans	-77	-27.7	-179	-66.3	-177	68.9	-164	-2.9	114.3	E236 P237 L239	E236-R269 WeakPolarHBondContact O-CA 3.45Å; P237-R269 WeakPolarHBondContact CA-O 3.42Å; L239-R269 HydrophobicContact CD2-CG 4.29Å
270	F	89.9	Confident	92.6	Very high	142 Å²	142	63.2 Å²	63.2	62%	0.623	32%	0.32	S	S	*	.	S	Bend	trans	-132.6	151.9	-169.7	-54.2	-66	0	0	0	111.1
271	M	89	Confident	93.1	Very high	56 Å²	56	61.5 Å²	61.5	28%	0.276	31%	0.308	S	S	.	.			trans	-57.2	122.5	172	-168.7	63.4	158.2	0	0	109.3	F207 F209 S302 L303 K306	F207-M271 HydrophobicContact CE1-CE 4.1Å; F207-M271 HydrophobicContact CE1-SD 3.84Å; F207-M271 HydrophobicContact CZ-CE 4.09Å; F207-M271 HydrophobicContact CZ-SD 3.48Å; F207-M271 WeakPolarHBondContact CZ-SD 3.26Å; F209-M271 HydrophobicContact CD2-CE 4.48Å; F209-M271 HydrophobicContact CD2-SD 3.8Å; F209-M271 HydrophobicContact CE2-CB 4.45Å; F209-M271 HydrophobicContact CE2-SD 3.96Å; M271-S302 VanDerWaalsContact CE-OG 3.24Å; M271-S302 WeakPolarHBondContact CE-OG 3.44Å; M271-L303 HydrophobicContact CE-CD2 3.81Å; M271-L303 HydrophobicContact CE-CG 4.3Å; M271-K306 HydrophobicContact CE-CD 3.73Å; M271-K306 HydrophobicContact SD-CD 4.48Å
272	P	87.9	Confident	93.4	Very high	20 Å²	20	60.6 Å²	60.6	13%	0.13	30%	0.302	C	S	.	.			trans	-71.1	139.2	-179.3	27.6	-33.1	0	0	0	110.9	F207 Y233 T274 K306	F207-P272 HydrophobicContact CE2-CG 4.02Å; F207-P272 HydrophobicContact CZ-CG 4.39Å; Y233-P272 HydrophobicContact CE1-CG 3.71Å; Y233-P272 WeakPolarHBondContact OH-CB 3.43Å; Y233-P272 WeakPolarHBondContact OH-CG 2.89Å; P272-T274 PolarHBondContact O-N 3.48Å; P272-K306 PolarHBondContact O-NZ 3.2Å; P272-K306 VanDerWaalsContact O-NZ 3.13Å
273	S	85.9	Confident	93.7	Very high	125 Å²	125	60 Å²	60	87%	0.874	30%	0.3	S	S	*	.	S	Bend	trans	-68.2	-19.5	173.1	56.4	0	0	0	0	113.1
274	T	86	Confident	94.2	Very high	64 Å²	64	57.5 Å²	57.5	39%	0.393	28%	0.284	S	S	.	.	S	Bend	trans	-65.8	144.3	176.7	61.1	0	0	0	0	111	P272 N276 K306	P272-T274 PolarHBondContact O-N 3.48Å; T274-N276 PolarHBondContact O-N 3.3Å; T274-K306 PolarHBondContact O-NZ 3.05Å
275	K	86.7	Confident	94.4	Very high	159 Å²	159	57.6 Å²	57.6	69%	0.691	28%	0.28	S	S	*	.			trans	-90.6	29.1	177.8	-61.9	-171.9	177.1	-172	0	112.9	Q277	K275-Q277 PolarHBondContact O-N 2.89Å
276	N	94.7	Very high	94.5	Very high	87 Å²	87	57 Å²	57	47%	0.465	28%	0.277	S	S	.	.			trans	-58.8	138.3	177.4	-67.2	-6.6	0	0	0	109.7	T274 Y278 K306	T274-N276 PolarHBondContact O-N 3.3Å; N276-Y278 HydrophobicContact CB-CE2 4.07Å; N276-Y278 VanDerWaalsContact O-CE2 3.31Å; N276-Y278 WeakPolarHBondContact O-CE2 3.47Å; N276-K306 WeakPolarHBondContact O-CG 3.33Å
277	Q	97.4	Very high	94.5	Very high	108 Å²	108	52.2 Å²	52.2	51%	0.505	26%	0.258	S	S	.	.			trans	-107.8	152.4	-177.6	-65.5	-177.7	-23.3	0	0	111.9	K275 E305 K306 T308	K275-Q277 PolarHBondContact O-N 2.89Å; Q277-E305 PolarHBondContact NE2-O 3.48Å; Q277-K306 CarbonylContact C-O 3.6Å; Q277-K306 VanDerWaalsContact CA-O 3.26Å; Q277-K306 WeakPolarHBondContact CA-O 3.45Å; Q277-T308 HydrophobicContact CB-CG2 3.57Å; Q277-T308 HydrophobicContact CG-CG2 4.27Å; Q277-T308 VanDerWaalsContact OE1-CG2 3.27Å
278	Y	98.4	Very high	94.4	Very high	2 Å²	2	51 Å²	51	1%	0.008	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145.4	-173.7	-57.8	-101	0	0	0	109.8	S205 F207 Y233 N276 K306 T308	S205-Y278 VanDerWaalsContact OG-CA 3.28Å; S205-Y278 WeakPolarHBondContact OG-CA 3.33Å; F207-Y278 HydrophobicContact CB-CD1 3.98Å; F207-Y278 HydrophobicContact CB-CD2 3.79Å; F207-Y278 HydrophobicContact CB-CE1 4.44Å; F207-Y278 HydrophobicContact CB-CE2 4.27Å; F207-Y278 HydrophobicContact CB-CG 3.66Å; F207-Y278 AromaticContact CD2-CD2 3.82Å; F207-Y278 HydrophobicContact CD2-CD2 3.82Å; F207-Y278 HydrophobicContact CD2-CE1 4.2Å; F207-Y278 AromaticContact CD2-CE2 3.45Å; F207-Y278 HydrophobicContact CD2-CE2 3.45Å; F207-Y278 VanDerWaalsContact CD2-CE2 3.45Å; F207-Y278 HydrophobicContact CD2-CG 4.37Å; F207-Y278 AromaticContact CD2-CZ 3.67Å; F207-Y278 HydrophobicContact CE2-CE2 4.18Å; F207-Y278 HydrophobicContact CG-CD2 4.16Å; F207-Y278 HydrophobicContact CG-CE2 4.24Å; F207-Y278 HydrophobicContact CG-CG 4.48Å; Y233-Y278 HydrophobicContact CD2-CE1 4.49Å; Y233-Y278 VanDerWaalsContact CD2-OH 3.32Å; Y233-Y278 WeakPolarHBondContact CD2-OH 3.17Å; Y233-Y278 HydrophobicContact CG-CE1 4.26Å; N276-Y278 HydrophobicContact CB-CE2 4.07Å; N276-Y278 VanDerWaalsContact O-CE2 3.31Å; N276-Y278 WeakPolarHBondContact O-CE2 3.47Å; Y278-K306 HydrophobicContact CD2-CB 4.28Å; Y278-K306 PolarHBondContact N-O 3.49Å; Y278-T308 PolarHBondContact O-N 3.44Å; Y278-T308 PolarHBondContact O-OG1 3.48Å
279	N	98.4	Very high	94.2	Very high	37 Å²	37	47.8 Å²	47.8	20%	0.198	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	-46.1	178.7	-62.5	127.5	0	0	0	110.9	F201 P203 K204 S205 T308 D309 F310	F201-N279 HydrophobicContact CE2-CB 4.11Å; F201-N279 HydrophobicContact CZ-CB 4.17Å; P203-N279 HydrophobicContact CB-CB 4.09Å; K204-N279 WeakPolarHBondContact CB-OD1 3.49Å; K204-N279 PolarHBondContact N-OD1 3.07Å; S205-N279 PolarHBondContact N-OD1 3.28Å; S205-N279 PolarHBondContact O-N 2.83Å; S205-N279 PolarHBondContact OG-N 2.93Å; S205-N279 VanDerWaalsContact OG-N 3.09Å; N279-T308 VanDerWaalsContact CA-OG1 3.23Å; N279-T308 WeakPolarHBondContact CA-OG1 3.23Å; N279-T308 PolarHBondContact N-OG1 3.5Å; N279-T308 PolarHBondContact ND2-OG1 2.79Å; N279-D309 PolarHBondContact ND2-OD2 3.08Å; N279-D309 WeakPolarHBondContact O-CB 3.3Å; N279-D309 PolarHBondContact O-N 3.35Å; N279-F310 PolarHBondContact O-N 2.94Å
280	L	98.8	Very high	94	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.8	-179.8	-178.6	60.4	0	0	0	109.7	L191 P203 S205 L206 F207 T220 W224 V282 F310 V312	L191-L280 HydrophobicContact CD2-CD1 4.15Å; L191-L280 HydrophobicContact CD2-CD2 3.88Å; P203-L280 HydrophobicContact CB-CB 4.02Å; P203-L280 HydrophobicContact CG-CD2 4.49Å; S205-L280 PolarHBondContact O-N 2.88Å; S205-L280 VanDerWaalsContact O-N 3.12Å; L206-L280 CarbonylContact C-O 3.59Å; L206-L280 WeakPolarHBondContact CA-O 3.42Å; L206-L280 HydrophobicContact CD1-CB 4.28Å; L206-L280 HydrophobicContact CD1-CD2 3.96Å; L206-L280 HydrophobicContact CD1-CG 3.9Å; F207-L280 PolarHBondContact N-O 3.15Å; T220-L280 HydrophobicContact CG2-CD2 4Å; W224-L280 HydrophobicContact CH2-CD2 4.43Å; W224-L280 HydrophobicContact CZ3-CD2 3.96Å; L280-V282 HydrophobicContact CD1-CG2 4.09Å; L280-V282 HydrophobicContact CD2-CG2 4.33Å; L280-V282 HydrophobicContact CG-CG2 3.88Å; L280-F310 HydrophobicContact CD1-CB 3.98Å; L280-V312 HydrophobicContact CD1-CG2 3.88Å
281	V	98.8	Very high	93.6	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.6	172.6	-177.7	0	0	0	0	108.3	F207 L303 K306 T307 F310 L311 V312	F207-V281 HydrophobicContact CB-CB 4.5Å; F207-V281 HydrophobicContact CB-CG1 4.31Å; F207-V281 HydrophobicContact CB-CG2 4.11Å; F207-V281 HydrophobicContact CD1-CG1 4.06Å; F207-V281 CarbonylContact O-C 3.56Å; F207-V281 WeakPolarHBondContact O-CA 3.41Å; V281-L303 HydrophobicContact CG1-CB 4.04Å; V281-L303 HydrophobicContact CG1-CD2 3.71Å; V281-L303 HydrophobicContact CG1-CG 4.39Å; V281-K306 HydrophobicContact CG2-CB 4.41Å; V281-T307 WeakPolarHBondContact CB-OG1 3.22Å; V281-T307 VanDerWaalsContact CG2-OG1 3.27Å; V281-T307 WeakPolarHBondContact CG2-OG1 3.34Å; V281-F310 PolarHBondContact N-O 2.94Å; V281-L311 HydrophobicContact CB-CD1 3.78Å; V281-L311 HydrophobicContact CG1-CD1 3.57Å; V281-L311 CarbonylContact O-C 3.57Å; V281-L311 WeakPolarHBondContact O-CA 3.29Å; V281-V312 PolarHBondContact O-N 3.15Å
282	V	98.9	Very high	93.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	141.7	-176.4	-173.1	0	0	0	0	110.2	L206 F207 F209 V216 L280 A284 V312	L206-V282 HydrophobicContact CD1-CG2 3.87Å; F207-V282 PolarHBondContact O-N 3.26Å; F209-V282 PolarHBondContact N-O 2.79Å; V216-V282 HydrophobicContact CG1-CB 3.75Å; V216-V282 HydrophobicContact CG1-CG1 3.76Å; V216-V282 HydrophobicContact CG1-CG2 3.75Å; V216-V282 HydrophobicContact CG2-CG1 3.93Å; L280-V282 HydrophobicContact CD1-CG2 4.09Å; L280-V282 HydrophobicContact CD2-CG2 4.33Å; L280-V282 HydrophobicContact CG-CG2 3.88Å; V282-A284 HydrophobicContact CG1-CB 4.12Å; V282-V312 CarbonylContact C-O 3.26Å; V282-V312 WeakPolarHBondContact CA-O 3.48Å; V282-V312 HydrophobicContact CG1-CB 4.29Å; V282-V312 HydrophobicContact CG1-CG1 4.41Å; V282-V312 HydrophobicContact CG2-CB 4.19Å
283	C	98.8	Very high	93.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	99.3	172.6	177.9	0	0	0	0	107.5	L303 V312 F313 I314	C283-L303 HydrophobicContact CB-CD1 3.77Å; C283-V312 PolarHBondContact N-O 2.81Å; C283-F313 HydrophobicContact CB-CD1 3.66Å; C283-F313 HydrophobicContact CB-CE1 3.8Å; C283-F313 VanDerWaalsContact O-CA 3.3Å; C283-F313 WeakPolarHBondContact O-CA 3.44Å; C283-I314 PolarHBondContact O-N 2.89Å; C283-I314 VanDerWaalsContact O-N 3.09Å
284	A	98.6	Very high	93.6	Very high	8 Å²	8	37.9 Å²	37.9	7%	0.066	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	120.1	-169.3	0	0	0	0	0	111.7	V187 V216 V282 T286 I314	V187-A284 HydrophobicContact CG2-CB 4.35Å; V216-A284 HydrophobicContact CG2-CB 4.11Å; V282-A284 HydrophobicContact CG1-CB 4.12Å; A284-T286 PolarHBondContact O-OG1 2.71Å; A284-I314 CarbonylContact C-O 3.15Å; A284-I314 WeakPolarHBondContact CA-O 3.22Å; A284-I314 HydrophobicContact CB-CB 4.05Å; A284-I314 HydrophobicContact CB-CD1 4.45Å
285	N	97.6	Very high	93.8	Very high	21 Å²	21	36.5 Å²	36.5	11%	0.112	19%	0.19	C	C	.	.	S	Bend	trans	57.3	47.5	-176.5	-48.4	-75.4	0	0	0	111.9	N183 I314	N183-N285 PolarHBondContact OD1-ND2 2.76Å; N285-I314 PolarHBondContact N-O 2.81Å
286	T	96.8	Very high	94.2	Very high	14 Å²	14	29.1 Å²	29.1	9%	0.086	16%	0.157	C	C	.	.			trans	-133.4	-33.3	-170.7	-47.1	0	0	0	0	112.5	F209 A284 L288 E289 I290 E315	F209-T286 HydrophobicContact CD1-CG2 3.88Å; F209-T286 HydrophobicContact CE1-CG2 3.84Å; F209-T286 PolarHBondContact O-OG1 3.45Å; A284-T286 PolarHBondContact O-OG1 2.71Å; T286-L288 PolarHBondContact O-N 3.43Å; T286-E289 WeakPolarHBondContact O-CB 3.48Å; T286-E289 PolarHBondContact O-N 3.41Å; T286-I290 PolarHBondContact O-N 3.38Å; T286-E315 PolarHBondContact N-OE1 3.34Å
287	L	96.5	Very high	94.3	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-62	-35.2	-178.7	-64.6	178.6	0	0	0	111.6	E289 I290 R296 I300 F313 E315 A324 A328	L287-E289 VanDerWaalsContact C-N 3.26Å; L287-E289 PolarHBondContact O-N 2.82Å; L287-I290 HydrophobicContact CD2-CD1 4.33Å; L287-I290 PolarHBondContact O-N 2.72Å; L287-R296 VanDerWaalsContact O-CD 3.24Å; L287-R296 WeakPolarHBondContact O-CD 3.36Å; L287-I300 HydrophobicContact CD2-CG1 4.35Å; L287-F313 HydrophobicContact CD1-CD1 3.8Å; L287-F313 HydrophobicContact CD1-CE1 4.41Å; L287-F313 HydrophobicContact CD1-CG 4.44Å; L287-F313 HydrophobicContact CD2-CD1 4.35Å; L287-F313 HydrophobicContact CD2-CE1 4.32Å; L287-F313 HydrophobicContact CG-CD1 4.25Å; L287-E315 WeakPolarHBondContact CA-OE1 3.48Å; L287-E315 HydrophobicContact CB-CG 4.41Å; L287-E315 VanDerWaalsContact CB-OE1 3.31Å; L287-E315 WeakPolarHBondContact CB-OE1 3.47Å; L287-E315 PolarHBondContact N-OE1 3.34Å; L287-A324 HydrophobicContact CB-CB 4.12Å; L287-A324 HydrophobicContact CD1-CB 4.32Å; L287-A328 HydrophobicContact CD1-CB 4.23Å
288	L	93.9	Very high	94.1	Very high	5 Å²	5	28.9 Å²	28.9	3%	0.026	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-70.8	-19.7	176	-66.9	178.7	0	0	0	113.7	L110 W162 T286 I290 E315 A324	L110-L288 HydrophobicContact CB-CD2 4.12Å; L110-L288 HydrophobicContact CD1-CD2 3.95Å; W162-L288 PolarHBondContact NE1-O 3.34Å; W162-L288 VanDerWaalsContact NE1-O 3.12Å; T286-L288 PolarHBondContact O-N 3.43Å; L288-I290 VanDerWaalsContact C-N 3.3Å; L288-E315 WeakPolarHBondContact CD1-OE2 3.43Å; L288-E315 WeakPolarHBondContact CG-OE2 3.12Å; L288-A324 HydrophobicContact CD2-CB 4.16Å
289	E	91.6	Very high	94	Very high	40 Å²	40	30 Å²	30	19%	0.187	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-83.1	-9.7	173.7	-57.4	-61.7	151.1	0	0	111.9	R108 T286 L287	R108-E289 WeakPolarHBondContact CD-OE1 3.27Å; R108-E289 IonicContact CZ-OE1 3.44Å; R108-E289 IonicContact CZ-OE2 3.32Å; R108-E289 IonicContact NE-OE1 2.92Å; R108-E289 PolarHBondContact NE-OE1 2.91Å; R108-E289 IonicContact NE-OE2 2.72Å; R108-E289 PolarHBondContact NE-OE2 2.88Å; R108-E289 IonicContact NH2-OE1 3.94Å; R108-E289 PolarHBondContact NH2-OE1 3.29Å; R108-E289 IonicContact NH2-OE2 3.02Å; R108-E289 PolarHBondContact NH2-OE2 3.44Å; T286-E289 WeakPolarHBondContact O-CB 3.48Å; T286-E289 PolarHBondContact O-N 3.41Å; L287-E289 VanDerWaalsContact C-N 3.26Å; L287-E289 PolarHBondContact O-N 2.82Å
290	I	90.1	Very high	94	Very high	22 Å²	22	28.3 Å²	28.3	11%	0.113	15%	0.147	C	C	.	.	S	Bend	trans	-93.5	117.9	178.3	-57.9	167.5	0	0	0	110	F209 T286 L287 L288 C292 R296 V299	F209-I290 HydrophobicContact CE1-CD1 4.24Å; T286-I290 PolarHBondContact O-N 3.38Å; L287-I290 HydrophobicContact CD2-CD1 4.33Å; L287-I290 PolarHBondContact O-N 2.72Å; L288-I290 VanDerWaalsContact C-N 3.3Å; I290-C292 PolarHBondContact O-N 3.01Å; I290-R296 HydrophobicContact CB-CG 3.57Å; I290-R296 HydrophobicContact CD1-CG 4.2Å; I290-R296 HydrophobicContact CG1-CG 4.49Å; I290-R296 HydrophobicContact CG2-CB 4.4Å; I290-R296 HydrophobicContact CG2-CG 3.51Å; I290-R296 PolarHBondContact O-NH1 3.43Å; I290-R296 VanDerWaalsContact O-NH1 3.09Å; I290-V299 HydrophobicContact CD1-CB 4.24Å; I290-V299 HydrophobicContact CD1-CG1 4.2Å; I290-V299 HydrophobicContact CD1-CG2 4.07Å
291	P	80.4	Confident	93.9	Very high	51 Å²	51	30.4 Å²	30.4	33%	0.331	16%	0.162	S	C	.	.			trans	-71.2	-25.2	-162.6	24.5	-35	0	0	0	115.6	I111 V116 W162	I111-P291 VanDerWaalsContact CB-O 3.23Å; I111-P291 WeakPolarHBondContact CB-O 3.38Å; I111-P291 WeakPolarHBondContact CG2-O 3.1Å; V116-P291 WeakPolarHBondContact CG2-O 3.41Å; W162-P291 HydrophobicContact CH2-CB 3.73Å; W162-P291 HydrophobicContact CH2-CG 4.39Å; W162-P291 HydrophobicContact CZ2-CB 4.14Å; W162-P291 HydrophobicContact CZ3-CB 4.16Å
292	C	83.4	Confident	93.8	Very high	19 Å²	19	31.9 Å²	31.9	13%	0.128	17%	0.172	C	C	.	.	S	Bend	trans	-133.5	152	-176.8	68.1	0	0	0	0	113.1	E113 V116 I290 S294 S295 R296	E113-C292 HydrophobicContact CG-CB 4.46Å; V116-C292 HydrophobicContact CG2-CB 4.01Å; I290-C292 PolarHBondContact O-N 3.01Å; C292-S294 PolarHBondContact O-N 3.06Å; C292-S295 PolarHBondContact O-N 3.36Å; C292-S295 WeakPolarHBondContact SG-CB 3.16Å; C292-S295 PolarHBondContact SG-N 2.76Å; C292-S295 PolarHBondContact SG-OG 3.17Å; C292-R296 PolarHBondContact O-N 2.96Å
293	K	89.6	Confident	93.8	Very high	107 Å²	107	31.9 Å²	31.9	47%	0.465	17%	0.172	S	C	.	.	H	α-helix	trans	-58.7	-44.7	-179	179.5	168.5	-177.5	-177.8	0	112.8	E113 S295 R296 S297	E113-K293 HydrophobicContact CG-CB 4.06Å; K293-S295 PolarHBondContact O-N 3.35Å; K293-R296 PolarHBondContact O-N 3.11Å; K293-S297 WeakPolarHBondContact O-CB 3.25Å; K293-S297 PolarHBondContact O-N 3.05Å; K293-S297 PolarHBondContact O-OG 3.01Å
294	S	90	Very high	93.7	Very high	51 Å²	51	33 Å²	33	36%	0.357	18%	0.176	S	C	.	.	H	α-helix	trans	-60.1	-41.9	175.8	35.9	0	0	0	0	112.9	E113 C292 S297 R298	E113-S294 WeakPolarHBondContact OE1-CB 3.37Å; E113-S294 PolarHBondContact OE1-N 3.16Å; E113-S294 VanDerWaalsContact OE1-N 3.15Å; E113-S294 PolarHBondContact OE1-OG 2.94Å; C292-S294 PolarHBondContact O-N 3.06Å; S294-S297 PolarHBondContact O-N 3.13Å; S294-R298 WeakPolarHBondContact O-CB 3.34Å; S294-R298 PolarHBondContact O-N 2.91Å
295	S	90.9	Very high	93.6	Very high	34 Å²	34	36.7 Å²	36.7	24%	0.238	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-42	175.5	-68.5	0	0	0	0	112	C292 K293 S297 R298 V299	C292-S295 PolarHBondContact O-N 3.36Å; C292-S295 WeakPolarHBondContact SG-CB 3.16Å; C292-S295 PolarHBondContact SG-N 2.76Å; C292-S295 PolarHBondContact SG-OG 3.17Å; K293-S295 PolarHBondContact O-N 3.35Å; S295-S297 VanDerWaalsContact C-N 3.35Å; S295-S297 PolarHBondContact O-N 3.13Å; S295-R298 PolarHBondContact O-N 3.2Å; S295-V299 WeakPolarHBondContact O-CG2 3.45Å; S295-V299 PolarHBondContact O-N 3.37Å
296	R	95.1	Very high	93.6	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.015	19%	0.188	C	C	.	.	H	α-helix	trans	-58.7	-47.6	172.9	-72.5	-173.2	-56.3	-98.9	9.5	111.2	L110 I111 L287 I290 C292 K293 R298 V299 I300 E327	L110-R296 VanDerWaalsContact CD1-CZ 3.45Å; I111-R296 PolarHBondContact O-NH1 3.11Å; I111-R296 PolarHBondContact O-NH2 3.24Å; L287-R296 VanDerWaalsContact O-CD 3.24Å; L287-R296 WeakPolarHBondContact O-CD 3.36Å; I290-R296 HydrophobicContact CB-CG 3.57Å; I290-R296 HydrophobicContact CD1-CG 4.2Å; I290-R296 HydrophobicContact CG1-CG 4.49Å; I290-R296 HydrophobicContact CG2-CB 4.4Å; I290-R296 HydrophobicContact CG2-CG 3.51Å; I290-R296 PolarHBondContact O-NH1 3.43Å; I290-R296 VanDerWaalsContact O-NH1 3.09Å; C292-R296 PolarHBondContact O-N 2.96Å; K293-R296 PolarHBondContact O-N 3.11Å; R296-R298 VanDerWaalsContact C-N 3.33Å; R296-R298 PolarHBondContact O-N 2.69Å; R296-V299 PolarHBondContact O-N 2.83Å; R296-V299 VanDerWaalsContact O-N 3.16Å; R296-I300 HydrophobicContact CB-CD1 4.47Å; R296-I300 WeakPolarHBondContact O-CD1 3.14Å; R296-I300 VanDerWaalsContact O-CG1 3.22Å; R296-I300 WeakPolarHBondContact O-CG1 3.39Å; R296-I300 PolarHBondContact O-N 3.12Å; R296-E327 WeakPolarHBondContact CB-OE1 3.45Å; R296-E327 IonicContact CZ-OE1 3.21Å; R296-E327 IonicContact CZ-OE2 2.75Å; R296-E327 IonicContact NE-OE1 2.76Å; R296-E327 PolarHBondContact NE-OE1 2.91Å; R296-E327 IonicContact NE-OE2 3.49Å; R296-E327 IonicContact NH2-OE1 3.34Å; R296-E327 PolarHBondContact NH2-OE1 3.18Å; R296-E327 IonicContact NH2-OE2 2.76Å; R296-E327 PolarHBondContact NH2-OE2 3.06Å
297	S	95.7	Very high	93.7	Very high	23 Å²	23	35.2 Å²	35.2	16%	0.161	18%	0.184	C	C	.	.	H	α-helix	trans	-58.8	-42.5	177.7	-58.3	0	0	0	0	111.9	K293 S294 S295 I300 S301 F331	K293-S297 WeakPolarHBondContact O-CB 3.25Å; K293-S297 PolarHBondContact O-N 3.05Å; K293-S297 PolarHBondContact O-OG 3.01Å; S294-S297 PolarHBondContact O-N 3.13Å; S295-S297 VanDerWaalsContact C-N 3.35Å; S295-S297 PolarHBondContact O-N 3.13Å; S297-I300 PolarHBondContact O-N 3.24Å; S297-S301 WeakPolarHBondContact O-CB 3.32Å; S297-S301 PolarHBondContact O-N 3.3Å; S297-F331 WeakPolarHBondContact O-CZ 3.28Å
298	R	94.2	Very high	93.8	Very high	168 Å²	168	37.2 Å²	37.2	63%	0.634	20%	0.196	S	C	*	.	H	α-helix	trans	-63	-43.8	175.2	-172.7	-175.6	-62.9	126.6	-0.1	112	S294 S295 R296 S301 S302	S294-R298 WeakPolarHBondContact O-CB 3.34Å; S294-R298 PolarHBondContact O-N 2.91Å; S295-R298 PolarHBondContact O-N 3.2Å; R296-R298 VanDerWaalsContact C-N 3.33Å; R296-R298 PolarHBondContact O-N 2.69Å; R298-S301 PolarHBondContact O-N 2.63Å; R298-S302 WeakPolarHBondContact O-CB 3.42Å; R298-S302 PolarHBondContact O-N 3.2Å
299	V	96.1	Very high	94	Very high	26 Å²	26	37.7 Å²	37.7	16%	0.158	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-49.5	175.6	167.3	0	0	0	0	110.3	F209 I290 S295 R296 S301 S302 L303	F209-V299 HydrophobicContact CD1-CG1 3.84Å; F209-V299 HydrophobicContact CE1-CG1 3.47Å; F209-V299 VanDerWaalsContact CE1-CG1 3.47Å; F209-V299 HydrophobicContact CE1-CG2 4.21Å; F209-V299 HydrophobicContact CE2-CG1 4.46Å; F209-V299 HydrophobicContact CG-CG1 4.49Å; F209-V299 HydrophobicContact CZ-CG1 3.81Å; F209-V299 HydrophobicContact CZ-CG2 3.89Å; I290-V299 HydrophobicContact CD1-CB 4.24Å; I290-V299 HydrophobicContact CD1-CG1 4.2Å; I290-V299 HydrophobicContact CD1-CG2 4.07Å; S295-V299 WeakPolarHBondContact O-CG2 3.45Å; S295-V299 PolarHBondContact O-N 3.37Å; R296-V299 PolarHBondContact O-N 2.83Å; R296-V299 VanDerWaalsContact O-N 3.16Å; V299-S301 VanDerWaalsContact C-N 3.32Å; V299-S301 PolarHBondContact O-N 2.97Å; V299-S302 PolarHBondContact O-N 3.3Å; V299-S302 VanDerWaalsContact O-N 3.12Å; V299-L303 HydrophobicContact CG1-CD1 3.72Å; V299-L303 HydrophobicContact CG1-CG 4.13Å; V299-L303 VanDerWaalsContact O-CG 3.27Å; V299-L303 WeakPolarHBondContact O-CG 3.43Å; V299-L303 PolarHBondContact O-N 3.15Å
300	I	98	Very high	94.4	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-57.1	-45.9	178.4	-65.8	155	0	0	0	110.7	L287 R296 S297 S302 L303 W304 F313 A328 F331 L332	L287-I300 HydrophobicContact CD2-CG1 4.35Å; R296-I300 HydrophobicContact CB-CD1 4.47Å; R296-I300 WeakPolarHBondContact O-CD1 3.14Å; R296-I300 VanDerWaalsContact O-CG1 3.22Å; R296-I300 WeakPolarHBondContact O-CG1 3.39Å; R296-I300 PolarHBondContact O-N 3.12Å; S297-I300 PolarHBondContact O-N 3.24Å; I300-S302 PolarHBondContact O-N 3.08Å; I300-L303 PolarHBondContact O-N 3.5Å; I300-W304 WeakPolarHBondContact O-CB 3.35Å; I300-W304 PolarHBondContact O-N 2.87Å; I300-F313 HydrophobicContact CB-CZ 4.47Å; I300-F313 HydrophobicContact CG1-CE1 4.1Å; I300-F313 HydrophobicContact CG1-CZ 4.07Å; I300-F313 HydrophobicContact CG2-CZ 4.11Å; I300-A328 HydrophobicContact CD1-CB 3.8Å; I300-A328 HydrophobicContact CG1-CB 4.23Å; I300-F331 HydrophobicContact CB-CD1 4.05Å; I300-F331 HydrophobicContact CB-CE1 4.33Å; I300-F331 HydrophobicContact CG2-CD1 3.4Å; I300-F331 VanDerWaalsContact CG2-CD1 3.4Å; I300-F331 HydrophobicContact CG2-CE1 3.94Å; I300-F331 HydrophobicContact CG2-CG 4.21Å; I300-L332 HydrophobicContact CG2-CD1 4.36Å; I300-L332 HydrophobicContact CG2-CD2 3.86Å; I300-L332 HydrophobicContact CG2-CG 3.86Å
301	S	96.9	Very high	94.8	Very high	44 Å²	44	34.8 Å²	34.8	31%	0.308	18%	0.184	S	C	.	.	H	α-helix	trans	-58.1	-47.6	175.5	-164.9	0	0	0	0	111.9	S297 R298 V299 L303 W304 E305	S297-S301 WeakPolarHBondContact O-CB 3.32Å; S297-S301 PolarHBondContact O-N 3.3Å; R298-S301 PolarHBondContact O-N 2.63Å; V299-S301 VanDerWaalsContact C-N 3.32Å; V299-S301 PolarHBondContact O-N 2.97Å; S301-L303 PolarHBondContact O-N 2.82Å; S301-W304 PolarHBondContact O-N 2.81Å; S301-E305 WeakPolarHBondContact O-CG 3.32Å; S301-E305 PolarHBondContact O-N 3.27Å
302	S	96.7	Very high	95.7	Very high	31 Å²	31	32.3 Å²	32.3	22%	0.217	17%	0.168	C	C	.	.	H	α-helix	trans	-68	-36.6	-178.8	-166.1	0	0	0	0	112.4	M271 R298 V299 I300 E305 K306	M271-S302 VanDerWaalsContact CE-OG 3.24Å; M271-S302 WeakPolarHBondContact CE-OG 3.44Å; R298-S302 WeakPolarHBondContact O-CB 3.42Å; R298-S302 PolarHBondContact O-N 3.2Å; V299-S302 PolarHBondContact O-N 3.3Å; V299-S302 VanDerWaalsContact O-N 3.12Å; I300-S302 PolarHBondContact O-N 3.08Å; S302-E305 PolarHBondContact O-N 2.88Å; S302-K306 WeakPolarHBondContact O-CG 3.14Å; S302-K306 PolarHBondContact O-N 3.01Å
303	L	98.2	Very high	96.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.5	-42.3	173.8	-66.9	173.8	0	0	0	111.1	F207 F209 M271 V281 C283 V299 I300 S301 E305 K306 T307 L311 F313	F207-L303 HydrophobicContact CD1-CD2 3.98Å; F207-L303 HydrophobicContact CE1-CD2 3.76Å; F209-L303 HydrophobicContact CB-CD1 4.38Å; F209-L303 HydrophobicContact CB-CD2 3.65Å; F209-L303 HydrophobicContact CD1-CD1 4.49Å; F209-L303 HydrophobicContact CD2-CD2 4.35Å; F209-L303 HydrophobicContact CG-CD1 4.48Å; F209-L303 HydrophobicContact CG-CD2 4.02Å; M271-L303 HydrophobicContact CE-CD2 3.81Å; M271-L303 HydrophobicContact CE-CG 4.3Å; V281-L303 HydrophobicContact CG1-CB 4.04Å; V281-L303 HydrophobicContact CG1-CD2 3.71Å; V281-L303 HydrophobicContact CG1-CG 4.39Å; C283-L303 HydrophobicContact CB-CD1 3.77Å; V299-L303 HydrophobicContact CG1-CD1 3.72Å; V299-L303 HydrophobicContact CG1-CG 4.13Å; V299-L303 VanDerWaalsContact O-CG 3.27Å; V299-L303 WeakPolarHBondContact O-CG 3.43Å; V299-L303 PolarHBondContact O-N 3.15Å; I300-L303 PolarHBondContact O-N 3.5Å; S301-L303 PolarHBondContact O-N 2.82Å; L303-E305 VanDerWaalsContact C-N 3.34Å; L303-E305 PolarHBondContact O-N 3.45Å; L303-K306 CarbonylContact O-C 3.53Å; L303-K306 PolarHBondContact O-N 3.36Å; L303-K306 VanDerWaalsContact O-N 3.08Å; L303-T307 PolarHBondContact O-N 2.91Å; L303-T307 VanDerWaalsContact O-N 3.11Å; L303-T307 PolarHBondContact O-OG1 2.77Å; L303-L311 HydrophobicContact CB-CD1 3.94Å; L303-L311 HydrophobicContact CB-CD2 4.46Å; L303-F313 HydrophobicContact CD1-CE1 3.97Å; L303-F313 HydrophobicContact CD1-CZ 4.32Å
304	W	98	Very high	96.8	Very high	22 Å²	22	26.3 Å²	26.3	8%	0.083	14%	0.14	C	C	.	.	H	α-helix	trans	-62	-38.5	176.4	-177.5	-120.2	0	0	0	113.6	I300 S301 K306 T307 L311 L332 G336 D339 V340 V387 K389	I300-W304 WeakPolarHBondContact O-CB 3.35Å; I300-W304 PolarHBondContact O-N 2.87Å; S301-W304 PolarHBondContact O-N 2.81Å; W304-K306 PolarHBondContact O-N 2.81Å; W304-T307 PolarHBondContact O-N 2.7Å; W304-L311 HydrophobicContact CB-CD2 4.35Å; W304-L311 HydrophobicContact CE3-CB 4.44Å; W304-L311 HydrophobicContact CE3-CD2 3.91Å; W304-L332 HydrophobicContact CB-CD2 3.82Å; W304-L332 HydrophobicContact CD2-CD2 3.94Å; W304-L332 HydrophobicContact CE3-CD2 4.16Å; W304-L332 HydrophobicContact CG-CD2 3.8Å; W304-G336 PolarHBondContact NE1-O 3.31Å; W304-D339 HydrophobicContact CZ2-CB 4.28Å; W304-V340 HydrophobicContact CH2-CG2 3.93Å; W304-V340 HydrophobicContact CZ2-CB 4.41Å; W304-V340 HydrophobicContact CZ2-CG2 3.44Å; W304-V340 VanDerWaalsContact CZ2-CG2 3.44Å; W304-V387 HydrophobicContact CH2-CG1 4.05Å; W304-V387 HydrophobicContact CZ3-CB 4.5Å; W304-V387 HydrophobicContact CZ3-CG1 3.8Å; W304-K389 HydrophobicContact CH2-CB 3.49Å; W304-K389 VanDerWaalsContact CH2-CB 3.49Å; W304-K389 HydrophobicContact CH2-CD 4.18Å; W304-K389 HydrophobicContact CH2-CG 3.57Å; W304-K389 HydrophobicContact CZ2-CB 4.16Å; W304-K389 HydrophobicContact CZ2-CD 4.12Å; W304-K389 HydrophobicContact CZ2-CG 3.69Å; W304-K389 HydrophobicContact CZ3-CB 3.79Å; W304-K389 HydrophobicContact CZ3-CD 4.43Å; W304-K389 HydrophobicContact CZ3-CG 4.18Å; W304-K389 PolarHBondContact O-NZ 2.87Å
305	E	97	Very high	97.2	Very high	87 Å²	87	24 Å²	24	41%	0.407	12%	0.124	S	C	.	.	H	α-helix	trans	-62.8	-33.7	173.6	-74.1	179.1	-166.4	0	0	112.2	Q277 S301 S302 L303	Q277-E305 PolarHBondContact NE2-O 3.48Å; S301-E305 WeakPolarHBondContact O-CG 3.32Å; S301-E305 PolarHBondContact O-N 3.27Å; S302-E305 PolarHBondContact O-N 2.88Å; L303-E305 VanDerWaalsContact C-N 3.34Å; L303-E305 PolarHBondContact O-N 3.45Å
306	K	97.8	Very high	97.5	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.017	11%	0.114	C	C	.	.	H	α-helix	trans	-83	-8.9	178.4	-66.4	-178.5	-168.6	-59.7	0	113.7	F207 M271 P272 T274 N276 Q277 Y278 V281 S302 L303 W304	F207-K306 HydrophobicContact CD2-CD 4.19Å; F207-K306 HydrophobicContact CE1-CD 4.19Å; F207-K306 HydrophobicContact CE2-CD 3.78Å; F207-K306 HydrophobicContact CZ-CD 3.79Å; M271-K306 HydrophobicContact CE-CD 3.73Å; M271-K306 HydrophobicContact SD-CD 4.48Å; P272-K306 PolarHBondContact O-NZ 3.2Å; P272-K306 VanDerWaalsContact O-NZ 3.13Å; T274-K306 PolarHBondContact O-NZ 3.05Å; N276-K306 WeakPolarHBondContact O-CG 3.33Å; Q277-K306 CarbonylContact C-O 3.6Å; Q277-K306 VanDerWaalsContact CA-O 3.26Å; Q277-K306 WeakPolarHBondContact CA-O 3.45Å; Y278-K306 HydrophobicContact CD2-CB 4.28Å; Y278-K306 PolarHBondContact N-O 3.49Å; V281-K306 HydrophobicContact CG2-CB 4.41Å; S302-K306 WeakPolarHBondContact O-CG 3.14Å; S302-K306 PolarHBondContact O-N 3.01Å; L303-K306 CarbonylContact O-C 3.53Å; L303-K306 PolarHBondContact O-N 3.36Å; L303-K306 VanDerWaalsContact O-N 3.08Å; W304-K306 PolarHBondContact O-N 2.81Å
307	T	98.4	Very high	97.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	140.7	179	-55.7	0	0	0	0	111.7	V281 L303 W304 F310 L311 K389	V281-T307 WeakPolarHBondContact CB-OG1 3.22Å; V281-T307 VanDerWaalsContact CG2-OG1 3.27Å; V281-T307 WeakPolarHBondContact CG2-OG1 3.34Å; L303-T307 PolarHBondContact O-N 2.91Å; L303-T307 VanDerWaalsContact O-N 3.11Å; L303-T307 PolarHBondContact O-OG1 2.77Å; W304-T307 PolarHBondContact O-N 2.7Å; T307-F310 VanDerWaalsContact CG2-C 3.41Å; T307-F310 WeakPolarHBondContact CG2-O 3.49Å; T307-L311 HydrophobicContact CG2-CB 4.05Å; T307-K389 HydrophobicContact CG2-CB 4.28Å; T307-K389 WeakPolarHBondContact O-CD 3.26Å; T307-K389 PolarHBondContact O-NZ 3.3Å
308	T	98.2	Very high	97.4	Very high	42 Å²	42	22.3 Å²	22.3	26%	0.258	11%	0.111	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-38.5	166.1	45.2	0	0	0	0	113.4	Q277 Y278 N279 R394	Q277-T308 HydrophobicContact CB-CG2 3.57Å; Q277-T308 HydrophobicContact CG-CG2 4.27Å; Q277-T308 VanDerWaalsContact OE1-CG2 3.27Å; Y278-T308 PolarHBondContact O-N 3.44Å; Y278-T308 PolarHBondContact O-OG1 3.48Å; N279-T308 VanDerWaalsContact CA-OG1 3.23Å; N279-T308 WeakPolarHBondContact CA-OG1 3.23Å; N279-T308 PolarHBondContact N-OG1 3.5Å; N279-T308 PolarHBondContact ND2-OG1 2.79Å; T308-R394 PolarHBondContact O-NH2 3.12Å
309	D	98.5	Very high	97.4	Very high	16 Å²	16	20.4 Å²	20.4	9%	0.086	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	-60.2	-178.5	-59.9	-81.2	0	0	0	113.1	F201 N279 S388 K389 R394 H395	F201-D309 HydrophobicContact CD2-CB 4.16Å; F201-D309 HydrophobicContact CE2-CB 3.46Å; F201-D309 VanDerWaalsContact CE2-CB 3.46Å; F201-D309 HydrophobicContact CZ-CB 4.04Å; N279-D309 PolarHBondContact ND2-OD2 3.08Å; N279-D309 WeakPolarHBondContact O-CB 3.3Å; N279-D309 PolarHBondContact O-N 3.35Å; D309-S388 CarbonylContact O-C 3.55Å; D309-S388 WeakPolarHBondContact O-CA 3.37Å; D309-S388 PolarHBondContact O-OG 2.66Å; D309-K389 PolarHBondContact O-N 3.08Å; D309-R394 IonicContact OD1-CZ 2.69Å; D309-R394 IonicContact OD1-NE 3.87Å; D309-R394 IonicContact OD1-NH2 2.84Å; D309-R394 PolarHBondContact OD1-NH2 3.13Å; D309-H395 IonicContact OD1-CD2 2.76Å; D309-H395 IonicContact OD1-CE1 3.29Å; D309-H395 IonicContact OD1-NE2 3.02Å; D309-H395 PolarHBondContact OD1-NE2 3.24Å
310	F	98.8	Very high	97.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	134.3	-175.5	-70.2	-78.8	0	0	0	113.1	I194 C198 F201 N279 L280 V281 T307 F343 V386 V387 W392	I194-F310 HydrophobicContact CD1-CB 4.34Å; I194-F310 HydrophobicContact CD1-CD1 4.33Å; I194-F310 HydrophobicContact CD1-CG 4.25Å; I194-F310 HydrophobicContact CG2-CD1 4.44Å; I194-F310 HydrophobicContact CG2-CD2 3.91Å; I194-F310 HydrophobicContact CG2-CE1 4.25Å; I194-F310 HydrophobicContact CG2-CE2 3.71Å; I194-F310 HydrophobicContact CG2-CG 4.28Å; I194-F310 HydrophobicContact CG2-CZ 3.89Å; C198-F310 HydrophobicContact CB-CZ 4.49Å; F201-F310 HydrophobicContact CB-CE2 4.34Å; F201-F310 AromaticContact CD1-CD2 3.83Å; F201-F310 HydrophobicContact CD1-CD2 3.83Å; F201-F310 AromaticContact CD1-CE2 3.8Å; F201-F310 HydrophobicContact CD1-CE2 3.8Å; F201-F310 HydrophobicContact CD2-CD2 4.2Å; F201-F310 HydrophobicContact CD2-CE2 4.06Å; F201-F310 AromaticContact CE1-CD2 3.58Å; F201-F310 HydrophobicContact CE1-CD2 3.58Å; F201-F310 HydrophobicContact CE1-CE2 4.06Å; F201-F310 AromaticContact CE2-CD2 3.99Å; F201-F310 HydrophobicContact CE2-CD2 3.99Å; F201-F310 HydrophobicContact CE2-CE2 4.32Å; F201-F310 HydrophobicContact CG-CD2 4.12Å; F201-F310 AromaticContact CG-CE2 3.79Å; F201-F310 HydrophobicContact CG-CE2 3.79Å; F201-F310 AromaticContact CZ-CD2 3.66Å; F201-F310 HydrophobicContact CZ-CD2 3.66Å; F201-F310 HydrophobicContact CZ-CE2 4.31Å; N279-F310 PolarHBondContact O-N 2.94Å; L280-F310 HydrophobicContact CD1-CB 3.98Å; V281-F310 PolarHBondContact N-O 2.94Å; T307-F310 VanDerWaalsContact CG2-C 3.41Å; T307-F310 WeakPolarHBondContact CG2-O 3.49Å; F310-F343 HydrophobicContact CE1-CB 4.3Å; F310-F343 HydrophobicContact CE1-CD1 4.26Å; F310-F343 AromaticContact CE1-CD2 3.93Å; F310-F343 HydrophobicContact CE1-CD2 3.93Å; F310-F343 HydrophobicContact CE1-CE2 4.25Å; F310-F343 AromaticContact CE1-CG 3.9Å; F310-F343 HydrophobicContact CE1-CG 3.9Å; F310-F343 HydrophobicContact CZ-CE2 4.48Å; F310-V386 HydrophobicContact CD1-CG1 3.7Å; F310-V386 HydrophobicContact CE1-CG1 4.37Å; F310-V387 WeakPolarHBondContact CA-O 3.19Å; F310-W392 HydrophobicContact CE1-CB 4.16Å; F310-W392 HydrophobicContact CZ-CB 4.01Å
311	L	98.9	Very high	97.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	123.5	169.9	177.1	56.7	0	0	0	109.1	V281 L303 W304 T307 F313 L332 V386 V387	V281-L311 HydrophobicContact CB-CD1 3.78Å; V281-L311 HydrophobicContact CG1-CD1 3.57Å; V281-L311 CarbonylContact O-C 3.57Å; V281-L311 WeakPolarHBondContact O-CA 3.29Å; L303-L311 HydrophobicContact CB-CD1 3.94Å; L303-L311 HydrophobicContact CB-CD2 4.46Å; W304-L311 HydrophobicContact CB-CD2 4.35Å; W304-L311 HydrophobicContact CE3-CB 4.44Å; W304-L311 HydrophobicContact CE3-CD2 3.91Å; T307-L311 HydrophobicContact CG2-CB 4.05Å; L311-F313 HydrophobicContact CD1-CE2 4.02Å; L311-F313 HydrophobicContact CD1-CZ 3.97Å; L311-F313 HydrophobicContact CD2-CE2 3.54Å; L311-F313 HydrophobicContact CD2-CZ 3.74Å; L311-F313 HydrophobicContact CG-CD2 4.26Å; L311-F313 HydrophobicContact CG-CE2 3.49Å; L311-F313 VanDerWaalsContact CG-CE2 3.49Å; L311-F313 HydrophobicContact CG-CZ 3.89Å; L311-L332 HydrophobicContact CD2-CD1 4.03Å; L311-L332 HydrophobicContact CD2-CD2 4.41Å; L311-V386 WeakPolarHBondContact O-CA 3.46Å; L311-V387 PolarHBondContact N-O 3.18Å; L311-V387 PolarHBondContact O-N 2.9Å
312	V	98.9	Very high	97.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	127	-174.4	-178.6	0	0	0	0	110.3	V190 L191 I194 L280 V281 V282 C283 I314 L385 V386	V190-V312 HydrophobicContact CG1-CG1 3.65Å; L191-V312 HydrophobicContact CD2-CG2 4.3Å; I194-V312 HydrophobicContact CD1-CG2 3.92Å; L280-V312 HydrophobicContact CD1-CG2 3.88Å; V281-V312 PolarHBondContact O-N 3.15Å; V282-V312 CarbonylContact C-O 3.26Å; V282-V312 WeakPolarHBondContact CA-O 3.48Å; V282-V312 HydrophobicContact CG1-CB 4.29Å; V282-V312 HydrophobicContact CG1-CG1 4.41Å; V282-V312 HydrophobicContact CG2-CB 4.19Å; C283-V312 PolarHBondContact N-O 2.81Å; V312-I314 HydrophobicContact CG1-CD1 4.14Å; V312-I314 HydrophobicContact CG1-CG1 3.93Å; V312-L385 CarbonylContact C-O 3.54Å; V312-L385 WeakPolarHBondContact CA-O 3.1Å; V312-V386 HydrophobicContact CG1-CG2 4.32Å; V312-V386 HydrophobicContact CG2-CG1 4.17Å; V312-V386 HydrophobicContact CG2-CG2 4.19Å
313	F	98.9	Very high	97.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.2	168.5	-61.7	-84.8	0	0	0	109.9	C283 L287 I300 L303 L311 I325 A328 L332 Y384 L385	C283-F313 HydrophobicContact CB-CD1 3.66Å; C283-F313 HydrophobicContact CB-CE1 3.8Å; C283-F313 VanDerWaalsContact O-CA 3.3Å; C283-F313 WeakPolarHBondContact O-CA 3.44Å; L287-F313 HydrophobicContact CD1-CD1 3.8Å; L287-F313 HydrophobicContact CD1-CE1 4.41Å; L287-F313 HydrophobicContact CD1-CG 4.44Å; L287-F313 HydrophobicContact CD2-CD1 4.35Å; L287-F313 HydrophobicContact CD2-CE1 4.32Å; L287-F313 HydrophobicContact CG-CD1 4.25Å; I300-F313 HydrophobicContact CB-CZ 4.47Å; I300-F313 HydrophobicContact CG1-CE1 4.1Å; I300-F313 HydrophobicContact CG1-CZ 4.07Å; I300-F313 HydrophobicContact CG2-CZ 4.11Å; L303-F313 HydrophobicContact CD1-CE1 3.97Å; L303-F313 HydrophobicContact CD1-CZ 4.32Å; L311-F313 HydrophobicContact CD1-CE2 4.02Å; L311-F313 HydrophobicContact CD1-CZ 3.97Å; L311-F313 HydrophobicContact CD2-CE2 3.54Å; L311-F313 HydrophobicContact CD2-CZ 3.74Å; L311-F313 HydrophobicContact CG-CD2 4.26Å; L311-F313 HydrophobicContact CG-CE2 3.49Å; L311-F313 VanDerWaalsContact CG-CE2 3.49Å; L311-F313 HydrophobicContact CG-CZ 3.89Å; F313-I325 HydrophobicContact CB-CD1 3.61Å; F313-A328 HydrophobicContact CD2-CB 4.27Å; F313-A328 HydrophobicContact CE2-CB 4.29Å; F313-A328 HydrophobicContact CG-CB 4.39Å; F313-A328 HydrophobicContact CZ-CB 4.45Å; F313-L332 HydrophobicContact CE2-CD1 3.94Å; F313-Y384 CarbonylContact O-C 3.45Å; F313-Y384 WeakPolarHBondContact O-CA 3.49Å; F313-Y384 VanDerWaalsContact O-CB 3.29Å; F313-Y384 WeakPolarHBondContact O-CB 3.32Å; F313-L385 HydrophobicContact CB-CB 4.41Å; F313-L385 HydrophobicContact CD2-CD2 4.14Å; F313-L385 PolarHBondContact N-O 2.8Å; F313-L385 PolarHBondContact O-N 2.99Å
314	I	98.8	Very high	97	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	131.3	175.5	-55.7	175.2	0	0	0	107.7	V187 V190 C283 A284 N285 V312 I382	V187-I314 HydrophobicContact CB-CD1 4.36Å; V187-I314 HydrophobicContact CG2-CD1 3.91Å; V190-I314 HydrophobicContact CB-CD1 3.95Å; V190-I314 HydrophobicContact CG1-CD1 4.27Å; V190-I314 HydrophobicContact CG2-CD1 3.84Å; V190-I314 HydrophobicContact CG2-CG1 4.16Å; C283-I314 PolarHBondContact O-N 2.89Å; C283-I314 VanDerWaalsContact O-N 3.09Å; A284-I314 CarbonylContact C-O 3.15Å; A284-I314 WeakPolarHBondContact CA-O 3.22Å; A284-I314 HydrophobicContact CB-CB 4.05Å; A284-I314 HydrophobicContact CB-CD1 4.45Å; N285-I314 PolarHBondContact N-O 2.81Å; V312-I314 HydrophobicContact CG1-CD1 4.14Å; V312-I314 HydrophobicContact CG1-CG1 3.93Å; I314-I382 HydrophobicContact CG2-CB 4.3Å; I314-I382 HydrophobicContact CG2-CD1 4.31Å; I314-I382 HydrophobicContact CG2-CG2 4.28Å
315	E	98.3	Very high	97	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.009	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	163.1	171.8	-72.7	-61.4	157.8	0	0	109.5	T286 L287 L288 A324 I325 I382 S383	T286-E315 PolarHBondContact N-OE1 3.34Å; L287-E315 WeakPolarHBondContact CA-OE1 3.48Å; L287-E315 HydrophobicContact CB-CG 4.41Å; L287-E315 VanDerWaalsContact CB-OE1 3.31Å; L287-E315 WeakPolarHBondContact CB-OE1 3.47Å; L287-E315 PolarHBondContact N-OE1 3.34Å; L288-E315 WeakPolarHBondContact CD1-OE2 3.43Å; L288-E315 WeakPolarHBondContact CG-OE2 3.12Å; E315-A324 HydrophobicContact CG-CB 4.31Å; E315-I325 HydrophobicContact CB-CD1 4.28Å; E315-I325 HydrophobicContact CB-CG1 4.16Å; E315-I325 HydrophobicContact CG-CD1 4.07Å; E315-I325 HydrophobicContact CG-CG1 4.29Å; E315-I382 WeakPolarHBondContact O-CA 3.21Å; E315-S383 PolarHBondContact N-O 3.33Å; E315-S383 PolarHBondContact O-N 3.42Å
316	Q	96.1	Very high	97	Very high	10 Å²	10	16.9 Å²	16.9	5%	0.047	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	144	171.2	-68.7	173.2	86.3	0	0	110.2	L105 W106 T318 G321	L105-Q316 PolarHBondContact O-NE2 3.36Å; W106-Q316 HydrophobicContact CE3-CB 4.27Å; W106-Q316 HydrophobicContact CE3-CG 4.4Å; W106-Q316 VanDerWaalsContact CE3-OE1 3.27Å; W106-Q316 HydrophobicContact CZ3-CB 4.42Å; Q316-T318 HydrophobicContact CB-CG2 4.18Å; Q316-T318 PolarHBondContact O-N 2.85Å; Q316-G321 WeakPolarHBondContact O-CA 3.46Å
317	G	95.1	Very high	97	Very high	1 Å²	1	18 Å²	18	1%	0.01	9%	0.09	C	C	.	.	S	Bend	trans	-74.5	34.6	-174.9	0	0	0	0	0	114	N358 N360 L381	G317-N358 PolarHBondContact O-ND2 3.49Å; G317-N360 PolarHBondContact O-ND2 3.26Å; G317-L381 WeakPolarHBondContact CA-O 3.47Å; G317-L381 PolarHBondContact N-O 3.47Å
318	T	94.1	Very high	97	Very high	15 Å²	15	18 Å²	18	9%	0.092	9%	0.09	C	C	.	.	S	Bend	trans	-89.4	168.5	176.7	70.3	0	0	0	0	110.5	W106 Q316 S320 G321 F322	W106-T318 HydrophobicContact CD2-CG2 3.62Å; W106-T318 VanDerWaalsContact CE2-CG2 3.49Å; W106-T318 HydrophobicContact CE3-CG2 4.07Å; W106-T318 HydrophobicContact CG-CG2 4.03Å; W106-T318 HydrophobicContact CH2-CG2 4.35Å; W106-T318 HydrophobicContact CZ2-CG2 3.89Å; W106-T318 HydrophobicContact CZ3-CG2 4.39Å; W106-T318 WeakPolarHBondContact O-CG2 3.29Å; Q316-T318 HydrophobicContact CB-CG2 4.18Å; Q316-T318 PolarHBondContact O-N 2.85Å; T318-S320 VanDerWaalsContact C-N 3.25Å; T318-S320 PolarHBondContact O-N 3.48Å; T318-G321 PolarHBondContact O-N 2.96Å; T318-G321 PolarHBondContact OG1-N 3.25Å; T318-G321 VanDerWaalsContact OG1-N 3.15Å; T318-F322 WeakPolarHBondContact O-CB 3.49Å; T318-F322 PolarHBondContact O-N 2.96Å
319	K	92.9	Very high	96.9	Very high	127 Å²	127	16.2 Å²	16.2	55%	0.552	8%	0.079	S	C	*	.	H	α-helix	trans	-57	-41.9	174.4	-173.1	176.1	-178.3	175.8	0	111.5	Q323	K319-Q323 WeakPolarHBondContact O-CB 3.25Å; K319-Q323 VanDerWaalsContact O-CG 3.23Å; K319-Q323 WeakPolarHBondContact O-CG 3.34Å; K319-Q323 PolarHBondContact O-N 3Å
320	S	93.6	Very high	96.9	Very high	23 Å²	23	18.3 Å²	18.3	16%	0.161	9%	0.09	C	C	.	.	H	α-helix	trans	-64.2	-46.6	177.1	-56.2	0	0	0	0	112.1	R108 P109 L110 T318 Q323 A324	R108-S320 WeakPolarHBondContact O-CB 3.28Å; R108-S320 PolarHBondContact O-OG 2.8Å; P109-S320 WeakPolarHBondContact CA-OG 3.38Å; L110-S320 PolarHBondContact N-OG 3.08Å; T318-S320 VanDerWaalsContact C-N 3.25Å; T318-S320 PolarHBondContact O-N 3.48Å; S320-Q323 PolarHBondContact O-N 3.32Å; S320-A324 PolarHBondContact O-N 3Å
321	G	96.4	Very high	96.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-63.5	-43.9	178.7	0	0	0	0	0	111.9	Q316 T318 Q323 A324 I325	Q316-G321 WeakPolarHBondContact O-CA 3.46Å; T318-G321 PolarHBondContact O-N 2.96Å; T318-G321 PolarHBondContact OG1-N 3.25Å; T318-G321 VanDerWaalsContact OG1-N 3.15Å; G321-Q323 VanDerWaalsContact C-N 3.35Å; G321-Q323 PolarHBondContact O-N 3.45Å; G321-A324 WeakPolarHBondContact O-CB 3.41Å; G321-A324 PolarHBondContact O-N 3.34Å; G321-A324 VanDerWaalsContact O-N 3.15Å; G321-I325 WeakPolarHBondContact O-CG1 3.44Å; G321-I325 PolarHBondContact O-N 3.02Å
322	F	96.4	Very high	96.8	Very high	9 Å²	9	20.2 Å²	20.2	4%	0.039	10%	0.098	C	C	.	.	H	α-helix	trans	-60.6	-41.8	173.7	178	-124.1	0	0	0	112.8	T318 A324 I325 L326 K354 N358 C359	T318-F322 WeakPolarHBondContact O-CB 3.49Å; T318-F322 PolarHBondContact O-N 2.96Å; F322-A324 VanDerWaalsContact C-N 3.32Å; F322-A324 PolarHBondContact O-N 2.93Å; F322-I325 PolarHBondContact O-N 3.37Å; F322-L326 HydrophobicContact CD1-CD1 4.12Å; F322-L326 HydrophobicContact CD2-CG 4.26Å; F322-L326 HydrophobicContact CE1-CD1 3.52Å; F322-L326 HydrophobicContact CE1-CG 4.16Å; F322-L326 HydrophobicContact CE2-CD1 4.05Å; F322-L326 HydrophobicContact CE2-CD2 3.93Å; F322-L326 HydrophobicContact CE2-CG 3.76Å; F322-L326 HydrophobicContact CZ-CD1 3.49Å; F322-L326 VanDerWaalsContact CZ-CD1 3.49Å; F322-L326 HydrophobicContact CZ-CD2 3.91Å; F322-L326 HydrophobicContact CZ-CG 3.73Å; F322-L326 WeakPolarHBondContact O-CG 3.05Å; F322-L326 PolarHBondContact O-N 3.22Å; F322-K354 HydrophobicContact CE1-CB 4.49Å; F322-K354 WeakPolarHBondContact CE1-O 3.36Å; F322-K354 HydrophobicContact CZ-CB 4.17Å; F322-N358 VanDerWaalsContact CB-OD1 3.31Å; F322-N358 WeakPolarHBondContact CB-OD1 3.37Å; F322-C359 HydrophobicContact CD2-CB 3.79Å; F322-C359 HydrophobicContact CE1-CB 4.41Å; F322-C359 HydrophobicContact CE2-CB 3.37Å; F322-C359 HydrophobicContact CG-CB 4.48Å; F322-C359 HydrophobicContact CZ-CB 3.7Å
323	Q	95.7	Very high	96.6	Very high	78 Å²	78	25.4 Å²	25.4	36%	0.364	12%	0.118	S	C	.	.	H	α-helix	trans	-62.7	-37.8	174.6	-75.2	174.8	-11.4	0	0	112.5	L110 K319 S320 G321 I325 L326 E327	L110-Q323 HydrophobicContact CD2-CB 3.64Å; K319-Q323 WeakPolarHBondContact O-CB 3.25Å; K319-Q323 VanDerWaalsContact O-CG 3.23Å; K319-Q323 WeakPolarHBondContact O-CG 3.34Å; K319-Q323 PolarHBondContact O-N 3Å; S320-Q323 PolarHBondContact O-N 3.32Å; G321-Q323 VanDerWaalsContact C-N 3.35Å; G321-Q323 PolarHBondContact O-N 3.45Å; Q323-I325 VanDerWaalsContact C-N 3.34Å; Q323-L326 PolarHBondContact O-N 3.02Å; Q323-E327 WeakPolarHBondContact O-CB 3.25Å; Q323-E327 PolarHBondContact O-N 3.44Å
324	A	97	Very high	96.5	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-64.2	-41.8	175.7	0	0	0	0	0	111.3	L110 L287 L288 E315 S320 G321 F322 E327 A328	L110-A324 HydrophobicContact CD1-CB 3.92Å; L110-A324 HydrophobicContact CD2-CB 4.41Å; L287-A324 HydrophobicContact CB-CB 4.12Å; L287-A324 HydrophobicContact CD1-CB 4.32Å; L288-A324 HydrophobicContact CD2-CB 4.16Å; E315-A324 HydrophobicContact CG-CB 4.31Å; S320-A324 PolarHBondContact O-N 3Å; G321-A324 WeakPolarHBondContact O-CB 3.41Å; G321-A324 PolarHBondContact O-N 3.34Å; G321-A324 VanDerWaalsContact O-N 3.15Å; F322-A324 VanDerWaalsContact C-N 3.32Å; F322-A324 PolarHBondContact O-N 2.93Å; A324-E327 WeakPolarHBondContact O-CB 3.37Å; A324-E327 PolarHBondContact O-N 2.81Å; A324-A328 PolarHBondContact O-N 3.47Å
325	I	98	Very high	96.4	Very high	7 Å²	7	35.5 Å²	35.5	4%	0.036	17%	0.171	C	C	.	.	H	α-helix	trans	-64.8	-41.8	175.4	-65.9	-61.4	0	0	0	111.5	F313 E315 G321 F322 Q323 A328 R329 L385	F313-I325 HydrophobicContact CB-CD1 3.61Å; E315-I325 HydrophobicContact CB-CD1 4.28Å; E315-I325 HydrophobicContact CB-CG1 4.16Å; E315-I325 HydrophobicContact CG-CD1 4.07Å; E315-I325 HydrophobicContact CG-CG1 4.29Å; G321-I325 WeakPolarHBondContact O-CG1 3.44Å; G321-I325 PolarHBondContact O-N 3.02Å; F322-I325 PolarHBondContact O-N 3.37Å; Q323-I325 VanDerWaalsContact C-N 3.34Å; I325-A328 PolarHBondContact O-N 3.01Å; I325-R329 VanDerWaalsContact O-CB 3.32Å; I325-R329 WeakPolarHBondContact O-CB 3.41Å; I325-R329 PolarHBondContact O-N 2.94Å; I325-L385 HydrophobicContact CG2-CB 3.75Å
326	L	96.9	Very high	96.2	Very high	20 Å²	20	35.9 Å²	35.9	11%	0.105	18%	0.175	C	C	.	.	H	α-helix	trans	-63.7	-40.5	173.6	-74.9	-178.8	0	0	0	112	F322 Q323 A328 R329 D330 C352 K355	F322-L326 HydrophobicContact CD1-CD1 4.12Å; F322-L326 HydrophobicContact CD2-CG 4.26Å; F322-L326 HydrophobicContact CE1-CD1 3.52Å; F322-L326 HydrophobicContact CE1-CG 4.16Å; F322-L326 HydrophobicContact CE2-CD1 4.05Å; F322-L326 HydrophobicContact CE2-CD2 3.93Å; F322-L326 HydrophobicContact CE2-CG 3.76Å; F322-L326 HydrophobicContact CZ-CD1 3.49Å; F322-L326 VanDerWaalsContact CZ-CD1 3.49Å; F322-L326 HydrophobicContact CZ-CD2 3.91Å; F322-L326 HydrophobicContact CZ-CG 3.73Å; F322-L326 WeakPolarHBondContact O-CG 3.05Å; F322-L326 PolarHBondContact O-N 3.22Å; Q323-L326 PolarHBondContact O-N 3.02Å; L326-A328 VanDerWaalsContact C-N 3.34Å; L326-A328 PolarHBondContact O-N 3.37Å; L326-R329 PolarHBondContact O-N 3.49Å; L326-D330 WeakPolarHBondContact O-CB 3.36Å; L326-D330 PolarHBondContact O-N 2.72Å; L326-C352 HydrophobicContact CD2-CB 3.85Å; L326-K355 HydrophobicContact CD1-CB 4.24Å
327	E	96.8	Very high	96.2	Very high	28 Å²	28	38 Å²	38	13%	0.131	20%	0.2	C	C	.	.	H	α-helix	trans	-58.8	-46.3	175.4	-172.3	-177.9	115.2	0	0	110.9	R296 Q323 A324 F331	R296-E327 WeakPolarHBondContact CB-OE1 3.45Å; R296-E327 IonicContact CZ-OE1 3.21Å; R296-E327 IonicContact CZ-OE2 2.75Å; R296-E327 IonicContact NE-OE1 2.76Å; R296-E327 PolarHBondContact NE-OE1 2.91Å; R296-E327 IonicContact NE-OE2 3.49Å; R296-E327 IonicContact NH2-OE1 3.34Å; R296-E327 PolarHBondContact NH2-OE1 3.18Å; R296-E327 IonicContact NH2-OE2 2.76Å; R296-E327 PolarHBondContact NH2-OE2 3.06Å; Q323-E327 WeakPolarHBondContact O-CB 3.25Å; Q323-E327 PolarHBondContact O-N 3.44Å; A324-E327 WeakPolarHBondContact O-CB 3.37Å; A324-E327 PolarHBondContact O-N 2.81Å; E327-F331 VanDerWaalsContact O-CB 3.25Å; E327-F331 WeakPolarHBondContact O-CB 3.43Å; E327-F331 PolarHBondContact O-N 3.03Å
328	A	98.2	Very high	96.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-44.2	175.7	0	0	0	0	0	112.6	L287 I300 F313 A324 I325 L326 F331 L332 L385	L287-A328 HydrophobicContact CD1-CB 4.23Å; I300-A328 HydrophobicContact CD1-CB 3.8Å; I300-A328 HydrophobicContact CG1-CB 4.23Å; F313-A328 HydrophobicContact CD2-CB 4.27Å; F313-A328 HydrophobicContact CE2-CB 4.29Å; F313-A328 HydrophobicContact CG-CB 4.39Å; F313-A328 HydrophobicContact CZ-CB 4.45Å; A324-A328 PolarHBondContact O-N 3.47Å; I325-A328 PolarHBondContact O-N 3.01Å; L326-A328 VanDerWaalsContact C-N 3.34Å; L326-A328 PolarHBondContact O-N 3.37Å; A328-F331 PolarHBondContact O-N 3.24Å; A328-L332 WeakPolarHBondContact O-CG 3.23Å; A328-L332 PolarHBondContact O-N 3.31Å; A328-L385 HydrophobicContact CB-CD2 4.48Å
329	R	97.8	Very high	96.3	Very high	3 Å²	3	46.3 Å²	46.3	1%	0.011	25%	0.252	C	S	.	.	H	α-helix	trans	-59	-50.5	177.9	-175.8	179.8	176.6	-85.2	0.7	111.9	I325 L326 L332 R333 I342 H348 A349 Q350 L385	I325-R329 VanDerWaalsContact O-CB 3.32Å; I325-R329 WeakPolarHBondContact O-CB 3.41Å; I325-R329 PolarHBondContact O-N 2.94Å; L326-R329 PolarHBondContact O-N 3.49Å; R329-L332 PolarHBondContact O-N 3.23Å; R329-R333 WeakPolarHBondContact O-CB 3.1Å; R329-R333 PolarHBondContact O-N 3.46Å; R329-I342 HydrophobicContact CG-CD1 4.21Å; R329-H348 PolarHBondContact NH2-CE1 2.82Å; R329-H348 PolarHBondContact NH2-ND1 2.93Å; R329-H348 PolarHBondContact NH2-O 2.82Å; R329-A349 VanDerWaalsContact NH2-C 3.29Å; R329-A349 PolarHBondContact NH2-O 3.07Å; R329-Q350 VanDerWaalsContact CZ-O 3.29Å; R329-Q350 PolarHBondContact NH1-O 3.28Å; R329-Q350 PolarHBondContact NH2-O 3.02Å; R329-L385 HydrophobicContact CB-CD1 4.36Å; R329-L385 HydrophobicContact CB-CD2 3.79Å; R329-L385 HydrophobicContact CG-CD1 4.2Å; R329-L385 HydrophobicContact CG-CD2 4.39Å
330	D	96.5	Very high	96.5	Very high	61 Å²	61	41.6 Å²	41.6	33%	0.326	23%	0.234	S	C	.	.	H	α-helix	trans	-69.9	-37.6	-177.8	-73.3	-21.6	0	0	0	111.3	L326 R333 I334	L326-D330 WeakPolarHBondContact O-CB 3.36Å; L326-D330 PolarHBondContact O-N 2.72Å; D330-R333 PolarHBondContact O-N 3.4Å; D330-R333 IonicContact OD1-NE 2.93Å; D330-I334 WeakPolarHBondContact O-CB 3.31Å; D330-I334 WeakPolarHBondContact O-CD1 3.37Å; D330-I334 VanDerWaalsContact O-CG1 3.26Å; D330-I334 WeakPolarHBondContact O-CG1 3.31Å; D330-I334 PolarHBondContact O-N 2.98Å
331	F	97.7	Very high	96.6	Very high	39 Å²	39	43.3 Å²	43.3	17%	0.171	24%	0.239	C	C	.	.	H	α-helix	trans	-57.7	-50	173.3	179.5	-86.3	0	0	0	111.5	S297 I300 E327 A328 I334 N335	S297-F331 WeakPolarHBondContact O-CZ 3.28Å; I300-F331 HydrophobicContact CB-CD1 4.05Å; I300-F331 HydrophobicContact CB-CE1 4.33Å; I300-F331 HydrophobicContact CG2-CD1 3.4Å; I300-F331 VanDerWaalsContact CG2-CD1 3.4Å; I300-F331 HydrophobicContact CG2-CE1 3.94Å; I300-F331 HydrophobicContact CG2-CG 4.21Å; E327-F331 VanDerWaalsContact O-CB 3.25Å; E327-F331 WeakPolarHBondContact O-CB 3.43Å; E327-F331 PolarHBondContact O-N 3.03Å; A328-F331 PolarHBondContact O-N 3.24Å; F331-I334 PolarHBondContact O-N 3.12Å; F331-N335 WeakPolarHBondContact CD2-ND2 3.49Å; F331-N335 HydrophobicContact CE1-CB 4.22Å; F331-N335 HydrophobicContact CE2-CB 4.43Å; F331-N335 HydrophobicContact CZ-CB 4.11Å; F331-N335 WeakPolarHBondContact O-CB 3.41Å; F331-N335 PolarHBondContact O-N 2.89Å; F331-N335 PolarHBondContact O-ND2 2.9Å
332	L	98	Very high	96.6	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-66	-41.9	-179.7	-70.9	171.2	0	0	0	111.7	I300 W304 L311 F313 A328 R329 I334 G336 V340 V387	I300-L332 HydrophobicContact CG2-CD1 4.36Å; I300-L332 HydrophobicContact CG2-CD2 3.86Å; I300-L332 HydrophobicContact CG2-CG 3.86Å; W304-L332 HydrophobicContact CB-CD2 3.82Å; W304-L332 HydrophobicContact CD2-CD2 3.94Å; W304-L332 HydrophobicContact CE3-CD2 4.16Å; W304-L332 HydrophobicContact CG-CD2 3.8Å; L311-L332 HydrophobicContact CD2-CD1 4.03Å; L311-L332 HydrophobicContact CD2-CD2 4.41Å; F313-L332 HydrophobicContact CE2-CD1 3.94Å; A328-L332 WeakPolarHBondContact O-CG 3.23Å; A328-L332 PolarHBondContact O-N 3.31Å; R329-L332 PolarHBondContact O-N 3.23Å; L332-I334 PolarHBondContact O-N 3.46Å; L332-G336 VanDerWaalsContact O-CA 3.28Å; L332-G336 WeakPolarHBondContact O-CA 3.37Å; L332-G336 PolarHBondContact O-N 2.98Å; L332-V340 HydrophobicContact CB-CG1 4.34Å; L332-V340 WeakPolarHBondContact O-CG2 3.46Å; L332-V387 HydrophobicContact CD1-CB 4.3Å; L332-V387 HydrophobicContact CD1-CG1 4.46Å; L332-V387 HydrophobicContact CD1-CG2 3.73Å
333	R	95.6	Very high	96.6	Very high	109 Å²	109	43.8 Å²	43.8	41%	0.411	24%	0.242	S	C	.	.	H	α-helix	trans	-59.1	-36.4	176.9	-173.4	-178.9	68.3	83	-0.1	112.8	R329 D330 A349	R329-R333 WeakPolarHBondContact O-CB 3.1Å; R329-R333 PolarHBondContact O-N 3.46Å; D330-R333 PolarHBondContact O-N 3.4Å; D330-R333 IonicContact OD1-NE 2.93Å; R333-A349 WeakPolarHBondContact CD-O 3.23Å
334	I	96.1	Very high	96.7	Very high	112 Å²	112	40 Å²	40	57%	0.574	22%	0.224	S	C	*	.	H	α-helix	trans	-85.4	-41.3	-177.3	-65.8	166.9	0	0	0	111.5	D330 F331 L332	D330-I334 WeakPolarHBondContact O-CB 3.31Å; D330-I334 WeakPolarHBondContact O-CD1 3.37Å; D330-I334 VanDerWaalsContact O-CG1 3.26Å; D330-I334 WeakPolarHBondContact O-CG1 3.31Å; D330-I334 PolarHBondContact O-N 2.98Å; F331-I334 PolarHBondContact O-N 3.12Å; L332-I334 PolarHBondContact O-N 3.46Å
335	N	97.2	Very high	96.6	Very high	101 Å²	101	40.8 Å²	40.8	54%	0.54	23%	0.229	S	C	.	.	H	α-helix	trans	-112.9	-10.6	-167.2	-54.9	-74.8	0	0	0	114.5	F331	F331-N335 WeakPolarHBondContact CD2-ND2 3.49Å; F331-N335 HydrophobicContact CE1-CB 4.22Å; F331-N335 HydrophobicContact CE2-CB 4.43Å; F331-N335 HydrophobicContact CZ-CB 4.11Å; F331-N335 WeakPolarHBondContact O-CB 3.41Å; F331-N335 PolarHBondContact O-N 2.89Å; F331-N335 PolarHBondContact O-ND2 2.9Å
336	G	95.2	Very high	96.4	Very high	10 Å²	10	41.2 Å²	41.2	10%	0.103	23%	0.233	C	C	.	.	S	Bend	trans	-83.5	-7.8	-172.8	0	0	0	0	0	115.1	W304 L332 V340	W304-G336 PolarHBondContact NE1-O 3.31Å; L332-G336 VanDerWaalsContact O-CA 3.28Å; L332-G336 WeakPolarHBondContact O-CA 3.37Å; L332-G336 PolarHBondContact O-N 2.98Å; G336-V340 VanDerWaalsContact C-CG2 3.44Å
337	G	95.1	Very high	96.3	Very high	54 Å²	54	40.9 Å²	40.9	56%	0.557	23%	0.231	S	C	*	.			trans	82.9	-167.8	178.1	0	0	0	0	0	114.4	D339 V340	G337-D339 PolarHBondContact O-N 2.97Å; G337-V340 PolarHBondContact O-N 3.02Å
338	S	94.9	Very high	96.1	Very high	111 Å²	111	40 Å²	40	78%	0.776	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-19.5	-177.6	51.4	0	0	0	0	114.2	V340	S338-V340 PolarHBondContact O-N 3.44Å
339	D	95.5	Very high	95.9	Very high	79 Å²	79	42.5 Å²	42.5	42%	0.422	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-1.3	-177.8	-64.5	-25.6	0	0	0	113.1	W304 G337 H341 S388 K389 G390	W304-D339 HydrophobicContact CZ2-CB 4.28Å; G337-D339 PolarHBondContact O-N 2.97Å; D339-H341 PolarHBondContact O-CD2 3.12Å; D339-H341 PolarHBondContact O-N 2.82Å; D339-S388 VanDerWaalsContact O-O 3.09Å; D339-K389 HydrophobicContact CB-CG 3.93Å; D339-K389 CarbonylContact O-C 3.35Å; D339-K389 WeakPolarHBondContact O-CA 3.5Å; D339-G390 PolarHBondContact O-N 3.5Å
340	V	97.4	Very high	95.6	Very high	28 Å²	28	47.7 Å²	47.7	17%	0.17	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	109.8	-176.4	176.8	0	0	0	0	110.7	W304 L332 G336 G337 S338 I342 V387	W304-V340 HydrophobicContact CH2-CG2 3.93Å; W304-V340 HydrophobicContact CZ2-CB 4.41Å; W304-V340 HydrophobicContact CZ2-CG2 3.44Å; W304-V340 VanDerWaalsContact CZ2-CG2 3.44Å; L332-V340 HydrophobicContact CB-CG1 4.34Å; L332-V340 WeakPolarHBondContact O-CG2 3.46Å; G336-V340 VanDerWaalsContact C-CG2 3.44Å; G337-V340 PolarHBondContact O-N 3.02Å; S338-V340 PolarHBondContact O-N 3.44Å; V340-I342 HydrophobicContact CG1-CD1 4.42Å; V340-V387 HydrophobicContact CG1-CG1 3.86Å
341	H	96.6	Very high	95.4	Very high	59 Å²	59	49.2 Å²	49.2	27%	0.273	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.6	170.5	-67.8	-101.1	0	0	0	110.5	D339 F343 V387 S388 G390	D339-H341 PolarHBondContact O-CD2 3.12Å; D339-H341 PolarHBondContact O-N 2.82Å; H341-F343 PolarHBondContact O-N 3.46Å; H341-V387 CarbonylContact O-C 3.59Å; H341-V387 WeakPolarHBondContact O-CA 3.44Å; H341-V387 WeakPolarHBondContact O-CG1 3.34Å; H341-S388 PolarHBondContact N-O 3.37Å; H341-S388 PolarHBondContact O-N 3.4Å; H341-G390 PolarHBondContact CD2-O 2.89Å
342	I	96.6	Very high	95.2	Very high	15 Å²	15	47.8 Å²	47.8	8%	0.077	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	116.1	171.9	-53.1	-58	0	0	0	108.1	R329 V340 C346 A349 L385 V387	R329-I342 HydrophobicContact CG-CD1 4.21Å; V340-I342 HydrophobicContact CG1-CD1 4.42Å; I342-C346 HydrophobicContact CG2-CB 4.06Å; I342-A349 HydrophobicContact CG1-CB 4.34Å; I342-L385 HydrophobicContact CD1-CD1 4.25Å; I342-L385 HydrophobicContact CG2-CD1 4.12Å; I342-V387 HydrophobicContact CD1-CG2 4.03Å
343	F	96.8	Very high	94.9	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.018	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-44.8	-177.2	176.6	-99.9	0	0	0	112.1	E193 I194 R197 C198 F310 H341 V386 W392	E193-F343 HydrophobicContact CG-CE1 4.33Å; I194-F343 HydrophobicContact CB-CE1 4.32Å; I194-F343 HydrophobicContact CG1-CD1 4.32Å; I194-F343 HydrophobicContact CG1-CE1 3.82Å; R197-F343 HydrophobicContact CB-CE2 4.28Å; R197-F343 HydrophobicContact CB-CZ 3.79Å; R197-F343 PolarHBondContact NH1-O 2.73Å; R197-F343 PolarHBondContact NH2-O 3.46Å; C198-F343 VanDerWaalsContact SG-CE2 3.53Å; F310-F343 HydrophobicContact CE1-CB 4.3Å; F310-F343 HydrophobicContact CE1-CD1 4.26Å; F310-F343 AromaticContact CE1-CD2 3.93Å; F310-F343 HydrophobicContact CE1-CD2 3.93Å; F310-F343 HydrophobicContact CE1-CE2 4.25Å; F310-F343 AromaticContact CE1-CG 3.9Å; F310-F343 HydrophobicContact CE1-CG 3.9Å; F310-F343 HydrophobicContact CZ-CE2 4.48Å; H341-F343 PolarHBondContact O-N 3.46Å; F343-V386 HydrophobicContact CB-CB 4.22Å; F343-V386 HydrophobicContact CB-CG1 3.99Å; F343-V386 WeakPolarHBondContact CB-O 3.48Å; F343-V386 HydrophobicContact CD1-CB 3.89Å; F343-V386 HydrophobicContact CD1-CG1 3.61Å; F343-V386 HydrophobicContact CE1-CG1 4.49Å; F343-V386 HydrophobicContact CG-CG1 4.15Å; F343-V386 PolarHBondContact N-O 2.73Å; F343-W392 HydrophobicContact CD2-CB 4.04Å; F343-W392 AromaticContact CD2-CD1 3.95Å; F343-W392 AromaticContact CD2-CD2 3.65Å; F343-W392 HydrophobicContact CD2-CD2 3.65Å; F343-W392 HydrophobicContact CD2-CE3 4.09Å; F343-W392 AromaticContact CD2-CG 3.61Å; F343-W392 HydrophobicContact CD2-CG 3.61Å; F343-W392 HydrophobicContact CE2-CB 4.45Å; F343-W392 AromaticContact CE2-CD2 3.84Å; F343-W392 HydrophobicContact CE2-CD2 3.84Å; F343-W392 AromaticContact CE2-CE3 3.77Å; F343-W392 HydrophobicContact CE2-CE3 3.77Å; F343-W392 HydrophobicContact CE2-CG 4.14Å; F343-W392 HydrophobicContact CE2-CZ3 4.36Å
344	S	96.7	Very high	94.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	162.3	178	59.8	0	0	0	0	111.7	E193 Y384 V386	E193-S344 WeakPolarHBondContact OE1-CB 3.43Å; S344-Y384 WeakPolarHBondContact OG-CE2 3.44Å; S344-V386 PolarHBondContact N-O 3.29Å; S344-V386 PolarHBondContact O-N 2.95Å; S344-V386 WeakPolarHBondContact OG-CB 3.39Å; S344-V386 VanDerWaalsContact OG-CG2 3.26Å; S344-V386 WeakPolarHBondContact OG-CG2 3.41Å
345	P	94.7	Very high	94.3	Very high	17 Å²	17	44.1 Å²	44.1	11%	0.11	27%	0.271	C	S	.	.	S	Bend	cis	-73.9	-22.4	-6.9	29	-34.2	0	0	0	113.5	Y384 R409	P345-Y384 HydrophobicContact CB-CE1 3.86Å; P345-Y384 HydrophobicContact CB-CE2 4.43Å; P345-Y384 WeakPolarHBondContact CD-O 3.44Å; P345-Y384 HydrophobicContact CG-CD1 4.49Å; P345-Y384 HydrophobicContact CG-CE1 4.09Å; P345-R409 WeakPolarHBondContact O-CD 3.28Å; P345-R409 WeakPolarHBondContact O-CG 3.2Å; P345-R409 PolarHBondContact O-NH1 3.43Å
346	C	94.8	Very high	93.8	Very high	16 Å²	16	44.9 Å²	44.9	11%	0.108	28%	0.275	C	S	.	.			trans	-71.2	131.8	-173.8	-56.8	0	0	0	0	111	I342 H348	I342-C346 HydrophobicContact CG2-CB 4.06Å; C346-H348 PolarHBondContact O-N 3.06Å; C346-H348 VanDerWaalsContact O-N 3.17Å
347	P	93.4	Very high	93.5	Very high	12 Å²	12	46.4 Å²	46.4	8%	0.078	28%	0.284	C	S	.	.	S	Bend	trans	-78.7	15.1	171.5	34.2	-36	0	0	0	112.4	L407 R409	P347-L407 WeakPolarHBondContact CB-O 3.36Å; P347-R409 HydrophobicContact CG-CB 4.32Å
348	H	94	Very high	93.2	Very high	11 Å²	11	46 Å²	46	5%	0.051	27%	0.269	C	S	.	.			trans	-151.9	157.1	-170.5	69.4	85.6	0	0	0	112.6	R329 C346 Q350 C426 M427 P428	R329-H348 PolarHBondContact NH2-CE1 2.82Å; R329-H348 PolarHBondContact NH2-ND1 2.93Å; R329-H348 PolarHBondContact NH2-O 2.82Å; C346-H348 PolarHBondContact O-N 3.06Å; C346-H348 VanDerWaalsContact O-N 3.17Å; H348-Q350 HydrophobicContact CB-CG 4.49Å; H348-Q350 PolarHBondContact CE1-O 2.81Å; H348-Q350 VanDerWaalsContact CE1-O 3.3Å; H348-Q350 PolarHBondContact ND1-N 3.37Å; H348-Q350 VanDerWaalsContact ND1-N 3.14Å; H348-Q350 PolarHBondContact ND1-O 3.11Å; H348-Q350 VanDerWaalsContact ND1-O 3.16Å; H348-C426 PolarHBondContact NE2-SG 3.1Å; H348-C426 VanDerWaalsContact NE2-SG 3.38Å; H348-M427 PolarHBondContact CD2-O 3.06Å; H348-M427 VanDerWaalsContact CD2-O 3.27Å; H348-P428 WeakPolarHBondContact CB-O 3.47Å
349	A	92.7	Very high	93.1	Very high	51 Å²	51	41.5 Å²	41.5	42%	0.421	24%	0.238	S	C	.	.	S	Bend	trans	-95.5	-5.4	168.9	0	0	0	0	0	113.4	R329 R333 I342	R329-A349 VanDerWaalsContact NH2-C 3.29Å; R329-A349 PolarHBondContact NH2-O 3.07Å; R333-A349 WeakPolarHBondContact CD-O 3.23Å; I342-A349 HydrophobicContact CG1-CB 4.34Å
350	Q	92	Very high	93.1	Very high	112 Å²	112	39.2 Å²	39.2	52%	0.523	23%	0.225	S	C	.	.	S	Bend	trans	-64.5	170.1	-178.9	-54.3	-54	-29.6	0	0	113.5	R329 H348 C352	R329-Q350 VanDerWaalsContact CZ-O 3.29Å; R329-Q350 PolarHBondContact NH1-O 3.28Å; R329-Q350 PolarHBondContact NH2-O 3.02Å; H348-Q350 HydrophobicContact CB-CG 4.49Å; H348-Q350 PolarHBondContact CE1-O 2.81Å; H348-Q350 VanDerWaalsContact CE1-O 3.3Å; H348-Q350 PolarHBondContact ND1-N 3.37Å; H348-Q350 VanDerWaalsContact ND1-N 3.14Å; H348-Q350 PolarHBondContact ND1-O 3.11Å; H348-Q350 VanDerWaalsContact ND1-O 3.16Å; Q350-C352 PolarHBondContact O-N 3.46Å
351	T	92.3	Very high	93	Very high	94 Å²	94	38.2 Å²	38.2	58%	0.577	22%	0.219	S	C	*	.	P	Polyproline II helix	trans	-55	133.2	170.4	-56.3	0	0	0	0	110.4	G353	T351-G353 PolarHBondContact O-N 2.99Å
352	C	94.2	Very high	93	Very high	9 Å²	9	37.7 Å²	37.7	6%	0.061	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-72.1	121.2	-177.4	-175.8	0	0	0	0	111.4	L326 Q350 K354 K355	L326-C352 HydrophobicContact CD2-CB 3.85Å; Q350-C352 PolarHBondContact O-N 3.46Å; C352-K354 PolarHBondContact O-N 3.29Å; C352-K354 VanDerWaalsContact O-N 3.16Å; C352-K354 PolarHBondContact SG-N 2.98Å; C352-K354 VanDerWaalsContact SG-N 3.42Å; C352-K355 WeakPolarHBondContact O-CB 3.09Å; C352-K355 PolarHBondContact O-N 3.47Å; C352-K355 VanDerWaalsContact O-N 3.14Å
353	G	91.8	Very high	93	Very high	34 Å²	34	37.3 Å²	37.3	35%	0.351	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.9	174.1	0	0	0	0	0	114.2	T351 G430	T351-G353 PolarHBondContact O-N 2.99Å; G353-G430 WeakPolarHBondContact CA-O 3.28Å; G353-G430 PolarHBondContact N-O 3.26Å
354	K	90.9	Very high	93	Very high	7 Å²	7	43.1 Å²	43.1	3%	0.03	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	6.5	176.2	-65.6	-159.1	63.3	171.6	0	114.4	F322 C352 D356 S357 N358 C359 V411 V432	F322-K354 HydrophobicContact CE1-CB 4.49Å; F322-K354 WeakPolarHBondContact CE1-O 3.36Å; F322-K354 HydrophobicContact CZ-CB 4.17Å; C352-K354 PolarHBondContact O-N 3.29Å; C352-K354 VanDerWaalsContact O-N 3.16Å; C352-K354 PolarHBondContact SG-N 2.98Å; C352-K354 VanDerWaalsContact SG-N 3.42Å; K354-D356 PolarHBondContact O-N 2.95Å; K354-S357 WeakPolarHBondContact CB-OG 3.32Å; K354-S357 VanDerWaalsContact CE-OG 3.25Å; K354-S357 WeakPolarHBondContact CE-OG 3.5Å; K354-S357 CarbonylContact O-C 3.57Å; K354-S357 WeakPolarHBondContact O-CA 3.49Å; K354-S357 PolarHBondContact O-N 2.89Å; K354-S357 PolarHBondContact O-OG 3Å; K354-N358 WeakPolarHBondContact CE-O 3.31Å; K354-N358 PolarHBondContact NZ-O 3.49Å; K354-C359 HydrophobicContact CB-CB 4.42Å; K354-C359 HydrophobicContact CD-CB 4.07Å; K354-V411 HydrophobicContact CD-CB 4.07Å; K354-V411 HydrophobicContact CD-CG2 3.74Å; K354-V432 HydrophobicContact CD-CG1 4.5Å; K354-V432 HydrophobicContact CD-CG2 4.38Å; K354-V432 HydrophobicContact CG-CB 4.47Å; K354-V432 HydrophobicContact CG-CG1 4.32Å; K354-V432 HydrophobicContact CG-CG2 3.55Å
355	K	88.3	Confident	93	Very high	102 Å²	102	44.1 Å²	44.1	44%	0.443	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-36.8	-169.1	83.3	-180	-171.7	178.1	0	114.7	L326 C352 S357	L326-K355 HydrophobicContact CD1-CB 4.24Å; C352-K355 WeakPolarHBondContact O-CB 3.09Å; C352-K355 PolarHBondContact O-N 3.47Å; C352-K355 VanDerWaalsContact O-N 3.14Å; K355-S357 VanDerWaalsContact C-N 3.34Å
356	D	86.3	Confident	93	Very high	118 Å²	118	47.8 Å²	47.8	63%	0.631	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	3.9	-176.8	-59.1	-50	0	0	0	112.5	K354	K354-D356 PolarHBondContact O-N 2.95Å
357	S	87.7	Confident	92.8	Very high	42 Å²	42	49.7 Å²	49.7	29%	0.294	27%	0.265	S	S	.	.	S	Bend	trans	-116.6	-145.1	-180	81.4	0	0	0	0	110.8	K354 K355	K354-S357 WeakPolarHBondContact CB-OG 3.32Å; K354-S357 VanDerWaalsContact CE-OG 3.25Å; K354-S357 WeakPolarHBondContact CE-OG 3.5Å; K354-S357 CarbonylContact O-C 3.57Å; K354-S357 WeakPolarHBondContact O-CA 3.49Å; K354-S357 PolarHBondContact O-N 2.89Å; K354-S357 PolarHBondContact O-OG 3Å; K355-S357 VanDerWaalsContact C-N 3.34Å
358	N	89.3	Confident	92.6	Very high	45 Å²	45	49.8 Å²	49.8	24%	0.241	27%	0.265	C	S	.	.			trans	-135.5	134.6	173	-172	8.9	0	0	0	110.2	G317 F322 K354 N360	G317-N358 PolarHBondContact O-ND2 3.49Å; F322-N358 VanDerWaalsContact CB-OD1 3.31Å; F322-N358 WeakPolarHBondContact CB-OD1 3.37Å; K354-N358 WeakPolarHBondContact CE-O 3.31Å; K354-N358 PolarHBondContact NZ-O 3.49Å; N358-N360 PolarHBondContact ND2-ND2 3.47Å; N358-N360 VanDerWaalsContact ND2-ND2 3.16Å
359	C	93.9	Very high	91.7	Very high	17 Å²	17	50 Å²	50	12%	0.115	27%	0.27	C	S	.	.			trans	-119.4	113.2	173.5	-168.1	0	0	0	0	110.1	F322 K354 S383	F322-C359 HydrophobicContact CD2-CB 3.79Å; F322-C359 HydrophobicContact CE1-CB 4.41Å; F322-C359 HydrophobicContact CE2-CB 3.37Å; F322-C359 HydrophobicContact CG-CB 4.48Å; F322-C359 HydrophobicContact CZ-CB 3.7Å; K354-C359 HydrophobicContact CB-CB 4.42Å; K354-C359 HydrophobicContact CD-CB 4.07Å; C359-S383 PolarHBondContact O-OG 2.85Å
360	N	95.4	Very high	90.7	Very high	30 Å²	30	49.7 Å²	49.7	16%	0.16	26%	0.261	C	S	.	.			trans	-143.2	162.7	-178.4	57.7	27.4	0	0	0	111.4	G317 N358 L381 I382	G317-N360 PolarHBondContact O-ND2 3.26Å; N358-N360 PolarHBondContact ND2-ND2 3.47Å; N358-N360 VanDerWaalsContact ND2-ND2 3.16Å; N360-L381 HydrophobicContact CB-CB 4.37Å; N360-I382 CarbonylContact C-O 3.37Å; N360-I382 WeakPolarHBondContact CA-O 3.41Å; N360-I382 VanDerWaalsContact CB-O 3.27Å; N360-I382 WeakPolarHBondContact CB-O 3.45Å
361	I	95.7	Very high	89.3	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.036	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	156.9	171.4	68.4	164.1	0	0	0	109.8	R189 V363 L381 I382 Y384 S455	R189-I361 HydrophobicContact CG-CD1 4.21Å; I361-V363 HydrophobicContact CD1-CG2 4.46Å; I361-L381 CarbonylContact O-C 3.58Å; I361-L381 VanDerWaalsContact O-CA 3.32Å; I361-L381 WeakPolarHBondContact O-CA 3.49Å; I361-I382 HydrophobicContact CD1-CD1 4.12Å; I361-I382 HydrophobicContact CD1-CG1 4.18Å; I361-I382 HydrophobicContact CG1-CD1 4.03Å; I361-I382 HydrophobicContact CG1-CG1 3.52Å; I361-I382 PolarHBondContact N-O 3.4Å; I361-I382 PolarHBondContact O-N 3.36Å; I361-Y384 HydrophobicContact CD1-CD1 4.11Å; I361-Y384 HydrophobicContact CD1-CE1 3.62Å; I361-Y384 HydrophobicContact CG1-CD1 4.22Å; I361-Y384 HydrophobicContact CG1-CE1 4.02Å; I361-Y384 HydrophobicContact CG2-CE1 4.22Å; I361-S455 WeakPolarHBondContact CA-OG 3.38Å
362	V	95.6	Very high	87.7	Confident	49 Å²	49	54.6 Å²	54.6	30%	0.297	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131.3	176.8	-174	0	0	0	0	109.3	L381	V362-L381 HydrophobicContact CB-CD2 4.4Å; V362-L381 HydrophobicContact CG2-CD2 3.54Å
363	V	97.2	Very high	86.1	Confident	6 Å²	6	62.2 Å²	62.2	4%	0.036	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.9	171.4	-174.5	0	0	0	0	109.1	A185 T186 R189 I361 S379 E380 I382	A185-V363 HydrophobicContact CB-CG1 3.96Å; T186-V363 HydrophobicContact CG2-CB 3.96Å; T186-V363 HydrophobicContact CG2-CG1 4.26Å; T186-V363 HydrophobicContact CG2-CG2 3.99Å; R189-V363 HydrophobicContact CB-CG1 4.01Å; R189-V363 HydrophobicContact CB-CG2 4.04Å; R189-V363 HydrophobicContact CG-CG2 3.9Å; I361-V363 HydrophobicContact CD1-CG2 4.46Å; V363-S379 CarbonylContact O-C 3.55Å; V363-S379 VanDerWaalsContact O-CA 3.31Å; V363-S379 WeakPolarHBondContact O-CA 3.36Å; V363-E380 PolarHBondContact N-O 3.43Å; V363-E380 PolarHBondContact O-N 3.12Å; V363-I382 HydrophobicContact CG2-CD1 3.78Å; V363-I382 HydrophobicContact CG2-CG1 4.07Å
364	R	96.4	Very high	84.7	Confident	126 Å²	126	67.3 Å²	67.3	48%	0.475	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	141.4	179.5	-59.8	-179.1	72	-173.9	5.3	110.7	P68 I69 P377 S378	P68-R364 WeakPolarHBondContact CA-O 3.48Å; P68-R364 HydrophobicContact CB-CB 4.03Å; P68-R364 HydrophobicContact CG-CB 3.95Å; I69-R364 PolarHBondContact N-O 3Å; R364-P377 VanDerWaalsContact NH2-CG 3.27Å; R364-S378 CarbonylContact C-O 3.54Å; R364-S378 VanDerWaalsContact CA-O 3.31Å; R364-S378 WeakPolarHBondContact CA-O 3.24Å
365	Y	96.2	Very high	83.9	Confident	21 Å²	21	72 Å²	72	8%	0.082	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	158.9	-177.2	68.7	-80.8	0	0	0	112	I69 A181 P182 A185 N367 P377 S378 E380	I69-Y365 CarbonylContact O-C 3.56Å; I69-Y365 WeakPolarHBondContact O-CA 3.48Å; I69-Y365 WeakPolarHBondContact O-CB 3.45Å; A181-Y365 HydrophobicContact CB-CD2 3.84Å; A181-Y365 HydrophobicContact CB-CE2 4.13Å; P182-Y365 HydrophobicContact CB-CD1 4.3Å; P182-Y365 HydrophobicContact CB-CD2 4.44Å; P182-Y365 HydrophobicContact CB-CE1 3.84Å; P182-Y365 HydrophobicContact CB-CE2 4Å; P182-Y365 HydrophobicContact CG-CE2 4.21Å; A185-Y365 VanDerWaalsContact CB-CB 3.49Å; A185-Y365 HydrophobicContact CB-CG 4.29Å; Y365-N367 VanDerWaalsContact CE2-OD1 3.29Å; Y365-N367 WeakPolarHBondContact CE2-OD1 3.33Å; Y365-P377 CarbonylContact O-C 3.49Å; Y365-P377 WeakPolarHBondContact O-CA 3.44Å; Y365-S378 PolarHBondContact N-O 3.28Å; Y365-S378 PolarHBondContact O-N 2.8Å; Y365-E380 HydrophobicContact CD1-CB 4.25Å; Y365-E380 HydrophobicContact CE1-CB 3.83Å
366	Y	94.3	Very high	83.9	Confident	94 Å²	94	74.2 Å²	74.2	37%	0.369	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-90.5	131.8	167.9	-68.4	-77.2	0	0	0	109.3	P68 I69 A181 P377	P68-Y366 HydrophobicContact CB-CD2 4.12Å; P68-Y366 HydrophobicContact CB-CE2 3.7Å; I69-Y366 PolarHBondContact O-N 3.39Å; A181-Y366 WeakPolarHBondContact CB-O 3.44Å; Y366-P377 HydrophobicContact CD1-CB 4.46Å; Y366-P377 HydrophobicContact CE1-CB 4.22Å
367	N	90.7	Very high	84.2	Confident	56 Å²	56	70.3 Å²	70.3	30%	0.299	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-62.6	148.7	179.8	-67.2	-65.4	0	0	0	111.2	Y365 G369 S378	Y365-N367 VanDerWaalsContact CE2-OD1 3.29Å; Y365-N367 WeakPolarHBondContact CE2-OD1 3.33Å; N367-G369 PolarHBondContact O-N 3.25Å; N367-S378 PolarHBondContact ND2-OG 2.77Å
368	F	89.8	Confident	84.5	Confident	15 Å²	15	70.1 Å²	70.1	7%	0.066	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-60.7	126.2	164	176.8	-110.5	0	0	0	109.2	L71 D76 A79 I80 L83 L176 V177 A181 L370	L71-F368 HydrophobicContact CD1-CB 4.15Å; L71-F368 HydrophobicContact CD1-CD2 3.81Å; L71-F368 HydrophobicContact CD1-CG 4.43Å; D76-F368 VanDerWaalsContact OD1-CD2 3.3Å; D76-F368 WeakPolarHBondContact OD1-CD2 3.41Å; A79-F368 HydrophobicContact CB-CD2 4.39Å; A79-F368 HydrophobicContact CB-CE2 3.49Å; A79-F368 VanDerWaalsContact CB-CE2 3.49Å; A79-F368 HydrophobicContact CB-CZ 3.69Å; I80-F368 HydrophobicContact CG1-CE2 3.77Å; I80-F368 HydrophobicContact CG1-CZ 3.73Å; L83-F368 HydrophobicContact CD1-CE1 3.74Å; L83-F368 HydrophobicContact CD1-CZ 4.11Å; L176-F368 HydrophobicContact CD2-CD1 3.97Å; L176-F368 HydrophobicContact CD2-CE1 3.5Å; L176-F368 VanDerWaalsContact CD2-CE1 3.5Å; L176-F368 HydrophobicContact CD2-CZ 3.84Å; V177-F368 HydrophobicContact CB-CD1 4.47Å; V177-F368 HydrophobicContact CG2-CD1 4.27Å; V177-F368 HydrophobicContact CG2-CE1 4.11Å; A181-F368 HydrophobicContact CB-CB 4.22Å; F368-L370 HydrophobicContact CD1-CG 4.32Å; F368-L370 HydrophobicContact CE1-CD1 4.47Å; F368-L370 HydrophobicContact CE1-CD2 3.65Å; F368-L370 HydrophobicContact CE1-CG 3.7Å; F368-L370 HydrophobicContact CZ-CD2 3.95Å; F368-L370 HydrophobicContact CZ-CG 4.46Å
369	G	75.6	Confident	84.8	Confident	16 Å²	16	71.4 Å²	71.4	17%	0.165	35%	0.354	C	S	.	.			trans	-105.4	107	-172.1	0	0	0	0	0	112.2	N367	N367-G369 PolarHBondContact O-N 3.25Å
370	L	71.8	Confident	84.8	Confident	44 Å²	44	71.1 Å²	71.1	23%	0.23	35%	0.351	C	S	.	.	S	Bend	trans	-88.2	-29	163.3	-72.5	-179.3	0	0	0	113	L83 P91 I94 V177 F368	L83-L370 HydrophobicContact CB-CD2 4.4Å; L83-L370 HydrophobicContact CD1-CD1 3.97Å; L83-L370 HydrophobicContact CD1-CD2 3.62Å; L83-L370 HydrophobicContact CD1-CG 4.21Å; P91-L370 HydrophobicContact CB-CB 4.4Å; I94-L370 HydrophobicContact CB-CD1 4.43Å; I94-L370 HydrophobicContact CD1-CD1 4.5Å; I94-L370 HydrophobicContact CG2-CD1 4.35Å; V177-L370 HydrophobicContact CG1-CD1 4.25Å; V177-L370 HydrophobicContact CG2-CD1 3.56Å; V177-L370 HydrophobicContact CG2-CG 4.32Å; F368-L370 HydrophobicContact CD1-CG 4.32Å; F368-L370 HydrophobicContact CE1-CD1 4.47Å; F368-L370 HydrophobicContact CE1-CD2 3.65Å; F368-L370 HydrophobicContact CE1-CG 3.7Å; F368-L370 HydrophobicContact CZ-CD2 3.95Å; F368-L370 HydrophobicContact CZ-CG 4.46Å
371	T	63.2	Low	84.9	Confident	65 Å²	65	72.2 Å²	72.2	40%	0.399	36%	0.356	S	S	.	.	S	Bend	trans	-120.2	178.7	-178.9	61.5	0	0	0	0	109	P91 E95 F373	P91-T371 HydrophobicContact CB-CG2 4.37Å; E95-T371 PolarHBondContact OE2-OG1 3.26Å; E95-T371 VanDerWaalsContact OE2-OG1 3.09Å; T371-F373 PolarHBondContact O-N 3.18Å
372	R	57.2	Low	85	Confident	244 Å²	244	72 Å²	72	92%	0.921	36%	0.355	S	S	*	.	S	Bend	trans	-45.5	127	-176	-77.1	-174.4	178.1	-179.6	0.1	111.2	K374	R372-K374 PolarHBondContact O-N 3.25Å
373	F	60.2	Low	85.1	Confident	169 Å²	169	69.7 Å²	69.7	74%	0.741	34%	0.342	S	S	*	.			trans	-46.9	126.4	-177.5	-64	-80.7	0	0	0	111.9	T371 S375	T371-F373 PolarHBondContact O-N 3.18Å; F373-S375 PolarHBondContact O-N 2.83Å
374	K	63.3	Low	85.2	Confident	141 Å²	141	69.7 Å²	69.7	61%	0.613	34%	0.341	S	S	*	.			trans	-69.8	108.8	154.1	-70.3	-176.3	178.6	-180	0	106.2	R372 E376	R372-K374 PolarHBondContact O-N 3.25Å; K374-E376 PolarHBondContact O-N 3.49Å
375	S	75.1	Confident	85.3	Confident	104 Å²	104	63.7 Å²	63.7	73%	0.727	32%	0.318	S	S	*	.			trans	-63.5	-16	175.8	48.8	0	0	0	0	112.5	F373	F373-S375 PolarHBondContact O-N 2.83Å
376	E	87.7	Confident	85.4	Confident	150 Å²	150	62.7 Å²	62.7	70%	0.701	32%	0.315	S	S	*	.	S	Bend	trans	-89.8	132.6	-179.2	-63.8	-176.8	173.2	0	0	112	K374	K374-E376 PolarHBondContact O-N 3.49Å
377	P	92.9	Very high	85.6	Confident	36 Å²	36	58.2 Å²	58.2	23%	0.234	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-70.6	139	176.2	30.6	-35.8	0	0	0	111.1	P68 R364 Y365 Y366	P68-P377 HydrophobicContact CB-CB 3.59Å; P68-P377 HydrophobicContact CB-CG 4.37Å; P68-P377 HydrophobicContact CG-CB 3.67Å; P68-P377 HydrophobicContact CG-CG 3.9Å; R364-P377 VanDerWaalsContact NH2-CG 3.27Å; Y365-P377 CarbonylContact O-C 3.49Å; Y365-P377 WeakPolarHBondContact O-CA 3.44Å; Y366-P377 HydrophobicContact CD1-CB 4.46Å; Y366-P377 HydrophobicContact CE1-CB 4.22Å
378	S	93.7	Very high	86	Confident	37 Å²	37	55.6 Å²	55.6	26%	0.259	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	170.1	168.5	-68.7	0	0	0	0	111.3	R364 Y365 N367	R364-S378 CarbonylContact C-O 3.54Å; R364-S378 VanDerWaalsContact CA-O 3.31Å; R364-S378 WeakPolarHBondContact CA-O 3.24Å; Y365-S378 PolarHBondContact N-O 3.28Å; Y365-S378 PolarHBondContact O-N 2.8Å; N367-S378 PolarHBondContact ND2-OG 2.77Å
379	S	94.5	Very high	86.3	Confident	72 Å²	72	56.6 Å²	56.6	50%	0.503	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.8	-179.4	-59.8	0	0	0	0	110.3	V363	V363-S379 CarbonylContact O-C 3.55Å; V363-S379 VanDerWaalsContact O-CA 3.31Å; V363-S379 WeakPolarHBondContact O-CA 3.36Å
380	E	95.4	Very high	87.4	Confident	11 Å²	11	56.5 Å²	56.5	5%	0.051	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.2	177.6	-178.1	69.5	-108.2	0	0	107.9	W106 R179 P182 T186 V363 Y365 I382	W106-E380 VanDerWaalsContact CZ3-OE1 3.25Å; W106-E380 WeakPolarHBondContact CZ3-OE1 3.31Å; R179-E380 IonicContact CZ-OE2 3.99Å; R179-E380 IonicContact NH1-OE2 3.63Å; R179-E380 PolarHBondContact NH1-OE2 3.49Å; R179-E380 IonicContact NH2-OE2 3.07Å; R179-E380 PolarHBondContact NH2-OE2 3.47Å; P182-E380 HydrophobicContact CB-CB 4.27Å; P182-E380 HydrophobicContact CB-CG 4.12Å; P182-E380 VanDerWaalsContact CB-OE2 3.23Å; P182-E380 WeakPolarHBondContact CB-OE2 2.95Å; T186-E380 HydrophobicContact CG2-CB 4.14Å; T186-E380 HydrophobicContact CG2-CG 3.74Å; V363-E380 PolarHBondContact N-O 3.43Å; V363-E380 PolarHBondContact O-N 3.12Å; Y365-E380 HydrophobicContact CD1-CB 4.25Å; Y365-E380 HydrophobicContact CE1-CB 3.83Å; E380-I382 HydrophobicContact CG-CG2 4.06Å
381	L	96.5	Very high	88.5	Confident	53 Å²	53	57.5 Å²	57.5	28%	0.277	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	136.1	169.5	-62.3	166.5	0	0	0	108.5	W106 G317 N360 I361 V362	W106-L381 HydrophobicContact CH2-CB 3.88Å; W106-L381 HydrophobicContact CH2-CD1 4.04Å; W106-L381 HydrophobicContact CH2-CG 4.29Å; W106-L381 HydrophobicContact CZ2-CD1 4.36Å; G317-L381 WeakPolarHBondContact CA-O 3.47Å; G317-L381 PolarHBondContact N-O 3.47Å; N360-L381 HydrophobicContact CB-CB 4.37Å; I361-L381 CarbonylContact O-C 3.58Å; I361-L381 VanDerWaalsContact O-CA 3.32Å; I361-L381 WeakPolarHBondContact O-CA 3.49Å; V362-L381 HydrophobicContact CB-CD2 4.4Å; V362-L381 HydrophobicContact CG2-CD2 3.54Å
382	I	97.8	Very high	90	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	146.5	173.5	62.8	174.1	0	0	0	112.2	T186 V190 I314 E315 N360 I361 V363 E380 Y384	T186-I382 HydrophobicContact CG2-CD1 4.18Å; T186-I382 HydrophobicContact CG2-CG2 3.29Å; V190-I382 HydrophobicContact CG2-CD1 3.81Å; I314-I382 HydrophobicContact CG2-CB 4.3Å; I314-I382 HydrophobicContact CG2-CD1 4.31Å; I314-I382 HydrophobicContact CG2-CG2 4.28Å; E315-I382 WeakPolarHBondContact O-CA 3.21Å; N360-I382 CarbonylContact C-O 3.37Å; N360-I382 WeakPolarHBondContact CA-O 3.41Å; N360-I382 VanDerWaalsContact CB-O 3.27Å; N360-I382 WeakPolarHBondContact CB-O 3.45Å; I361-I382 HydrophobicContact CD1-CD1 4.12Å; I361-I382 HydrophobicContact CD1-CG1 4.18Å; I361-I382 HydrophobicContact CG1-CD1 4.03Å; I361-I382 HydrophobicContact CG1-CG1 3.52Å; I361-I382 PolarHBondContact N-O 3.4Å; I361-I382 PolarHBondContact O-N 3.36Å; V363-I382 HydrophobicContact CG2-CD1 3.78Å; V363-I382 HydrophobicContact CG2-CG1 4.07Å; E380-I382 HydrophobicContact CG-CG2 4.06Å; I382-Y384 HydrophobicContact CD1-CD1 4.39Å
383	S	97.7	Very high	91.8	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.014	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	135	160.1	-64.7	0	0	0	0	107.1	E315 C359	E315-S383 PolarHBondContact N-O 3.33Å; E315-S383 PolarHBondContact O-N 3.42Å; C359-S383 PolarHBondContact O-OG 2.85Å
384	Y	98.6	Very high	93.5	Very high	5 Å²	5	42.5 Å²	42.5	2%	0.02	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	163.9	-177.1	76.4	-79.2	0	0	0	110.7	V190 E193 F313 S344 P345 I361 I382 V386 R409	V190-Y384 HydrophobicContact CB-CD2 4.35Å; V190-Y384 HydrophobicContact CG1-CD2 3.68Å; V190-Y384 HydrophobicContact CG1-CE2 4.1Å; V190-Y384 HydrophobicContact CG1-CG 4.45Å; V190-Y384 HydrophobicContact CG2-CD1 4.26Å; V190-Y384 HydrophobicContact CG2-CD2 3.73Å; V190-Y384 HydrophobicContact CG2-CE2 4.23Å; V190-Y384 HydrophobicContact CG2-CG 3.74Å; E193-Y384 PolarHBondContact OE2-OH 2.93Å; F313-Y384 CarbonylContact O-C 3.45Å; F313-Y384 WeakPolarHBondContact O-CA 3.49Å; F313-Y384 VanDerWaalsContact O-CB 3.29Å; F313-Y384 WeakPolarHBondContact O-CB 3.32Å; S344-Y384 WeakPolarHBondContact OG-CE2 3.44Å; P345-Y384 HydrophobicContact CB-CE1 3.86Å; P345-Y384 HydrophobicContact CB-CE2 4.43Å; P345-Y384 WeakPolarHBondContact CD-O 3.44Å; P345-Y384 HydrophobicContact CG-CD1 4.49Å; P345-Y384 HydrophobicContact CG-CE1 4.09Å; I361-Y384 HydrophobicContact CD1-CD1 4.11Å; I361-Y384 HydrophobicContact CD1-CE1 3.62Å; I361-Y384 HydrophobicContact CG1-CD1 4.22Å; I361-Y384 HydrophobicContact CG1-CE1 4.02Å; I361-Y384 HydrophobicContact CG2-CE1 4.22Å; I382-Y384 HydrophobicContact CD1-CD1 4.39Å; Y384-V386 HydrophobicContact CD2-CG2 3.99Å; Y384-V386 HydrophobicContact CE2-CG2 4.05Å; Y384-R409 PolarHBondContact OH-NH2 3.41Å
385	L	98.7	Very high	95.1	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	130.1	174.2	172.7	72.5	0	0	0	108.4	V312 F313 I325 A328 R329 I342 V387	V312-L385 CarbonylContact C-O 3.54Å; V312-L385 WeakPolarHBondContact CA-O 3.1Å; F313-L385 HydrophobicContact CB-CB 4.41Å; F313-L385 HydrophobicContact CD2-CD2 4.14Å; F313-L385 PolarHBondContact N-O 2.8Å; F313-L385 PolarHBondContact O-N 2.99Å; I325-L385 HydrophobicContact CG2-CB 3.75Å; A328-L385 HydrophobicContact CB-CD2 4.48Å; R329-L385 HydrophobicContact CB-CD1 4.36Å; R329-L385 HydrophobicContact CB-CD2 3.79Å; R329-L385 HydrophobicContact CG-CD1 4.2Å; R329-L385 HydrophobicContact CG-CD2 4.39Å; I342-L385 HydrophobicContact CD1-CD1 4.25Å; I342-L385 HydrophobicContact CG2-CD1 4.12Å; L385-V387 HydrophobicContact CD1-CG2 4Å; L385-V387 HydrophobicContact CD2-CG2 3.7Å; L385-V387 HydrophobicContact CG-CG2 3.68Å
386	V	98.7	Very high	96	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.4	167.6	-175.3	0	0	0	0	107.6	V190 I194 F310 L311 V312 F343 S344 Y384	V190-V386 HydrophobicContact CG1-CG2 3.63Å; I194-V386 HydrophobicContact CD1-CG1 3.76Å; I194-V386 HydrophobicContact CD1-CG2 4.44Å; I194-V386 HydrophobicContact CG1-CG1 4.05Å; F310-V386 HydrophobicContact CD1-CG1 3.7Å; F310-V386 HydrophobicContact CE1-CG1 4.37Å; L311-V386 WeakPolarHBondContact O-CA 3.46Å; V312-V386 HydrophobicContact CG1-CG2 4.32Å; V312-V386 HydrophobicContact CG2-CG1 4.17Å; V312-V386 HydrophobicContact CG2-CG2 4.19Å; F343-V386 HydrophobicContact CB-CB 4.22Å; F343-V386 HydrophobicContact CB-CG1 3.99Å; F343-V386 WeakPolarHBondContact CB-O 3.48Å; F343-V386 HydrophobicContact CD1-CB 3.89Å; F343-V386 HydrophobicContact CD1-CG1 3.61Å; F343-V386 HydrophobicContact CE1-CG1 4.49Å; F343-V386 HydrophobicContact CG-CG1 4.15Å; F343-V386 PolarHBondContact N-O 2.73Å; S344-V386 PolarHBondContact N-O 3.29Å; S344-V386 PolarHBondContact O-N 2.95Å; S344-V386 WeakPolarHBondContact OG-CB 3.39Å; S344-V386 VanDerWaalsContact OG-CG2 3.26Å; S344-V386 WeakPolarHBondContact OG-CG2 3.41Å; Y384-V386 HydrophobicContact CD2-CG2 3.99Å; Y384-V386 HydrophobicContact CE2-CG2 4.05Å
387	V	98.5	Very high	96.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132.9	174.9	-175.2	0	0	0	0	107.8	W304 F310 L311 L332 V340 H341 I342 L385	W304-V387 HydrophobicContact CH2-CG1 4.05Å; W304-V387 HydrophobicContact CZ3-CB 4.5Å; W304-V387 HydrophobicContact CZ3-CG1 3.8Å; F310-V387 WeakPolarHBondContact CA-O 3.19Å; L311-V387 PolarHBondContact N-O 3.18Å; L311-V387 PolarHBondContact O-N 2.9Å; L332-V387 HydrophobicContact CD1-CB 4.3Å; L332-V387 HydrophobicContact CD1-CG1 4.46Å; L332-V387 HydrophobicContact CD1-CG2 3.73Å; V340-V387 HydrophobicContact CG1-CG1 3.86Å; H341-V387 CarbonylContact O-C 3.59Å; H341-V387 WeakPolarHBondContact O-CA 3.44Å; H341-V387 WeakPolarHBondContact O-CG1 3.34Å; I342-V387 HydrophobicContact CD1-CG2 4.03Å; L385-V387 HydrophobicContact CD1-CG2 4Å; L385-V387 HydrophobicContact CD2-CG2 3.7Å; L385-V387 HydrophobicContact CG-CG2 3.68Å
388	S	98.3	Very high	96.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	144.3	169.1	-166.9	0	0	0	0	110.9	D309 D339 H341 G390	D309-S388 CarbonylContact O-C 3.55Å; D309-S388 WeakPolarHBondContact O-CA 3.37Å; D309-S388 PolarHBondContact O-OG 2.66Å; D339-S388 VanDerWaalsContact O-O 3.09Å; H341-S388 PolarHBondContact N-O 3.37Å; H341-S388 PolarHBondContact O-N 3.4Å; S388-G390 PolarHBondContact OG-O 3.3Å
389	K	98.1	Very high	95.8	Very high	36 Å²	36	36.9 Å²	36.9	16%	0.157	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	114.7	171.2	-165.6	174.4	-169.5	171.1	0	110	W304 T307 D309 D339 R394	W304-K389 HydrophobicContact CH2-CB 3.49Å; W304-K389 VanDerWaalsContact CH2-CB 3.49Å; W304-K389 HydrophobicContact CH2-CD 4.18Å; W304-K389 HydrophobicContact CH2-CG 3.57Å; W304-K389 HydrophobicContact CZ2-CB 4.16Å; W304-K389 HydrophobicContact CZ2-CD 4.12Å; W304-K389 HydrophobicContact CZ2-CG 3.69Å; W304-K389 HydrophobicContact CZ3-CB 3.79Å; W304-K389 HydrophobicContact CZ3-CD 4.43Å; W304-K389 HydrophobicContact CZ3-CG 4.18Å; W304-K389 PolarHBondContact O-NZ 2.87Å; T307-K389 HydrophobicContact CG2-CB 4.28Å; T307-K389 WeakPolarHBondContact O-CD 3.26Å; T307-K389 PolarHBondContact O-NZ 3.3Å; D309-K389 PolarHBondContact O-N 3.08Å; D339-K389 HydrophobicContact CB-CG 3.93Å; D339-K389 CarbonylContact O-C 3.35Å; D339-K389 WeakPolarHBondContact O-CA 3.5Å; K389-R394 PolarHBondContact O-NH1 2.93Å; K389-R394 PolarHBondContact O-NH2 2.81Å
390	G	96.8	Very high	95.4	Very high	14 Å²	14	35.2 Å²	35.2	14%	0.144	19%	0.185	C	C	.	.	S	Bend	trans	71.5	-178.6	-162.1	0	0	0	0	0	111.9	D339 H341 S388 W392 R394	D339-G390 PolarHBondContact O-N 3.5Å; H341-G390 PolarHBondContact CD2-O 2.89Å; S388-G390 PolarHBondContact OG-O 3.3Å; G390-W392 PolarHBondContact O-N 3.43Å; G390-R394 VanDerWaalsContact C-NH1 3.33Å
391	D	95.1	Very high	94.8	Very high	66 Å²	66	42.5 Å²	42.5	35%	0.353	22%	0.216	S	C	.	.			trans	-68.2	122.7	-177.8	-167.8	-3.6	0	0	0	111	R393 R394	D391-R393 VanDerWaalsContact C-N 3.26Å; D391-R393 PolarHBondContact O-N 3.49Å; D391-R393 WeakPolarHBondContact OD1-CB 3.37Å; D391-R393 WeakPolarHBondContact OD1-CD 3.28Å; D391-R393 VanDerWaalsContact OD1-CG 3.28Å; D391-R393 WeakPolarHBondContact OD1-CG 3.29Å; D391-R393 PolarHBondContact OD1-N 3.25Å; D391-R393 IonicContact OD1-NH1 3.14Å; D391-R393 PolarHBondContact OD1-NH1 3.41Å; D391-R393 VanDerWaalsContact OD1-NH1 3.07Å; D391-R394 WeakPolarHBondContact O-CD 3.33Å; D391-R394 VanDerWaalsContact O-CG 3.25Å; D391-R394 WeakPolarHBondContact O-CG 3.42Å; D391-R394 PolarHBondContact O-NH1 3.36Å
392	W	95.6	Very high	94.1	Very high	1 Å²	1	42 Å²	42	0%	0.004	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-72.7	-19.2	179.1	57.5	-94.6	0	0	0	112.4	F310 F343 G390 R394 H395 Q396 S404	F310-W392 HydrophobicContact CE1-CB 4.16Å; F310-W392 HydrophobicContact CZ-CB 4.01Å; F343-W392 HydrophobicContact CD2-CB 4.04Å; F343-W392 AromaticContact CD2-CD1 3.95Å; F343-W392 AromaticContact CD2-CD2 3.65Å; F343-W392 HydrophobicContact CD2-CD2 3.65Å; F343-W392 HydrophobicContact CD2-CE3 4.09Å; F343-W392 AromaticContact CD2-CG 3.61Å; F343-W392 HydrophobicContact CD2-CG 3.61Å; F343-W392 HydrophobicContact CE2-CB 4.45Å; F343-W392 AromaticContact CE2-CD2 3.84Å; F343-W392 HydrophobicContact CE2-CD2 3.84Å; F343-W392 AromaticContact CE2-CE3 3.77Å; F343-W392 HydrophobicContact CE2-CE3 3.77Å; F343-W392 HydrophobicContact CE2-CG 4.14Å; F343-W392 HydrophobicContact CE2-CZ3 4.36Å; G390-W392 PolarHBondContact O-N 3.43Å; W392-R394 PolarHBondContact O-N 2.83Å; W392-R394 VanDerWaalsContact O-N 3.15Å; W392-H395 WeakPolarHBondContact O-CB 3.46Å; W392-H395 PolarHBondContact O-N 3.07Å; W392-Q396 HydrophobicContact CZ3-CB 4.19Å; W392-Q396 HydrophobicContact CZ3-CG 4.48Å; W392-S404 VanDerWaalsContact CH2-OG 3.24Å; W392-S404 WeakPolarHBondContact CH2-OG 3.46Å
393	R	94.8	Very high	93.5	Very high	54 Å²	54	43.7 Å²	43.7	20%	0.204	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-61	-22.7	180	-68.4	168.8	-180	71.1	0.2	113.2	D391 H395 Q396 E403 D405	D391-R393 VanDerWaalsContact C-N 3.26Å; D391-R393 PolarHBondContact O-N 3.49Å; D391-R393 WeakPolarHBondContact OD1-CB 3.37Å; D391-R393 WeakPolarHBondContact OD1-CD 3.28Å; D391-R393 VanDerWaalsContact OD1-CG 3.28Å; D391-R393 WeakPolarHBondContact OD1-CG 3.29Å; D391-R393 PolarHBondContact OD1-N 3.25Å; D391-R393 IonicContact OD1-NH1 3.14Å; D391-R393 PolarHBondContact OD1-NH1 3.41Å; D391-R393 VanDerWaalsContact OD1-NH1 3.07Å; R393-H395 PolarHBondContact O-N 3.05Å; R393-Q396 PolarHBondContact O-N 3.11Å; R393-E403 WeakPolarHBondContact CD-OE1 3.19Å; R393-E403 IonicContact CZ-OE1 3.52Å; R393-E403 IonicContact CZ-OE2 2.74Å; R393-E403 VanDerWaalsContact CZ-OE2 3.29Å; R393-E403 IonicContact NE-OE1 2.81Å; R393-E403 PolarHBondContact NE-OE1 3.23Å; R393-E403 IonicContact NE-OE2 3.1Å; R393-E403 PolarHBondContact NE-OE2 3.48Å; R393-E403 IonicContact NH2-OE1 3.73Å; R393-E403 IonicContact NH2-OE2 3.82Å; R393-E403 PolarHBondContact NH2-OE2 3.25Å; R393-D405 IonicContact CZ-OD1 2.93Å; R393-D405 IonicContact CZ-OD2 2.87Å; R393-D405 IonicContact NH1-OD2 3.96Å; R393-D405 IonicContact NH2-OD1 3.38Å; R393-D405 PolarHBondContact NH2-OD1 3.31Å; R393-D405 IonicContact NH2-OD2 3.76Å; R393-D405 PolarHBondContact NH2-OD2 3.5Å
394	R	95.8	Very high	92.8	Very high	107 Å²	107	44.3 Å²	44.3	40%	0.404	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-55.1	-23.1	170.1	75.1	-171.4	-179.3	-119	9.6	112.9	T308 D309 K389 G390 D391 W392	T308-R394 PolarHBondContact O-NH2 3.12Å; D309-R394 IonicContact OD1-CZ 2.69Å; D309-R394 IonicContact OD1-NE 3.87Å; D309-R394 IonicContact OD1-NH2 2.84Å; D309-R394 PolarHBondContact OD1-NH2 3.13Å; K389-R394 PolarHBondContact O-NH1 2.93Å; K389-R394 PolarHBondContact O-NH2 2.81Å; G390-R394 VanDerWaalsContact C-NH1 3.33Å; D391-R394 WeakPolarHBondContact O-CD 3.33Å; D391-R394 VanDerWaalsContact O-CG 3.25Å; D391-R394 WeakPolarHBondContact O-CG 3.42Å; D391-R394 PolarHBondContact O-NH1 3.36Å; W392-R394 PolarHBondContact O-N 2.83Å; W392-R394 VanDerWaalsContact O-N 3.15Å
395	H	96.2	Very high	92.1	Very high	28 Å²	28	46 Å²	46	13%	0.13	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-101.7	1.6	178.9	-60.7	-56.5	0	0	0	114.2	C198 S200 F201 D309 W392 R393 I397	C198-H395 CarbonylContact C-O 3.51Å; C198-H395 WeakPolarHBondContact CA-O 3.41Å; C198-H395 HydrophobicContact CB-CB 3.72Å; S200-H395 PolarHBondContact N-O 3.35Å; S200-H395 WeakPolarHBondContact OG-CA 3.23Å; S200-H395 PolarHBondContact OG-O 2.87Å; F201-H395 HydrophobicContact CB-CB 3.81Å; F201-H395 AromaticContact CD2-CE1 3.98Å; F201-H395 AromaticContact CD2-NE2 3.85Å; D309-H395 IonicContact OD1-CD2 2.76Å; D309-H395 IonicContact OD1-CE1 3.29Å; D309-H395 IonicContact OD1-NE2 3.02Å; D309-H395 PolarHBondContact OD1-NE2 3.24Å; W392-H395 WeakPolarHBondContact O-CB 3.46Å; W392-H395 PolarHBondContact O-N 3.07Å; R393-H395 PolarHBondContact O-N 3.05Å; H395-I397 PolarHBondContact O-N 3.46Å
396	Q	94.2	Very high	91.6	Very high	10 Å²	10	51.3 Å²	51.3	5%	0.047	26%	0.262	C	S	.	.			trans	-96.8	82.1	179.9	-174.1	176.3	42.6	0	0	110.4	R197 W392 R393 P398 V399	R197-Q396 WeakPolarHBondContact O-CG 3.48Å; W392-Q396 HydrophobicContact CZ3-CB 4.19Å; W392-Q396 HydrophobicContact CZ3-CG 4.48Å; R393-Q396 PolarHBondContact O-N 3.11Å; Q396-P398 CarbonylContact C-O 3.54Å; Q396-P398 CarbonylContact O-C 3.56Å; Q396-P398 VanDerWaalsContact O-C 3.26Å; Q396-V399 PolarHBondContact O-N 3.02Å
397	I	91.6	Very high	91.3	Very high	111 Å²	111	52.2 Å²	52.2	57%	0.569	27%	0.267	S	S	*	.	S	Bend	trans	-122.4	112.7	178.2	-56.1	174.9	0	0	0	109.4	P199 H395	P199-I397 WeakPolarHBondContact CG-O 3.4Å; H395-I397 PolarHBondContact O-N 3.46Å
398	P	90.7	Very high	91.1	Very high	101 Å²	101	52.2 Å²	52.2	66%	0.656	27%	0.267	S	S	*	.	S	Bend	cis	-73	157.3	5.1	31.7	-36.2	0	0	0	113	Q396 V400	Q396-P398 CarbonylContact C-O 3.54Å; Q396-P398 CarbonylContact O-C 3.56Å; Q396-P398 VanDerWaalsContact O-C 3.26Å; P398-V400 PolarHBondContact O-N 3.3Å
399	V	88.5	Confident	91	Very high	101 Å²	101	52.6 Å²	52.6	61%	0.612	27%	0.269	S	S	*	.			trans	-67.8	130.2	174.1	179.6	0	0	0	0	109.1	Q396 K401	Q396-V399 PolarHBondContact O-N 3.02Å; V399-K401 HydrophobicContact CG1-CG 4.45Å
400	V	85.4	Confident	90.9	Very high	36 Å²	36	50.9 Å²	50.9	22%	0.218	26%	0.261	C	S	.	.			trans	-108.9	132.4	178.2	-177.6	0	0	0	0	108.9	P61 P398	P61-V400 HydrophobicContact CB-CG1 4.36Å; P61-V400 HydrophobicContact CG-CG1 4.13Å; P61-V400 HydrophobicContact CG-CG2 4.4Å; P398-V400 PolarHBondContact O-N 3.3Å
401	K	83.2	Confident	90.7	Very high	164 Å²	164	50.6 Å²	50.6	71%	0.713	26%	0.257	S	S	*	.	S	Bend	trans	-126.5	143.2	177.1	-67.8	-172.8	177.5	-176.4	0	110.6	V399	V399-K401 HydrophobicContact CG1-CG 4.45Å
402	P	83.1	Confident	90.2	Very high	43 Å²	43	48.8 Å²	48.8	28%	0.279	25%	0.248	S	C	.	.	S	Bend	cis	-65.9	158.7	-7.3	28.8	-34.5	0	0	0	111.9	L407	P402-L407 HydrophobicContact CB-CD2 4.37Å; P402-L407 HydrophobicContact CB-CG 4.46Å; P402-L407 HydrophobicContact CG-CD1 4.06Å; P402-L407 HydrophobicContact CG-CD2 3.69Å; P402-L407 HydrophobicContact CG-CG 3.99Å
403	E	83.8	Confident	89.3	Confident	37 Å²	37	51.3 Å²	51.3	17%	0.173	26%	0.26	C	S	.	.			trans	-73.3	148.7	-174.8	-60.1	178.2	148.7	0	0	110.7	R393 D405 Q406 L407	R393-E403 WeakPolarHBondContact CD-OE1 3.19Å; R393-E403 IonicContact CZ-OE1 3.52Å; R393-E403 IonicContact CZ-OE2 2.74Å; R393-E403 VanDerWaalsContact CZ-OE2 3.29Å; R393-E403 IonicContact NE-OE1 2.81Å; R393-E403 PolarHBondContact NE-OE1 3.23Å; R393-E403 IonicContact NE-OE2 3.1Å; R393-E403 PolarHBondContact NE-OE2 3.48Å; R393-E403 IonicContact NH2-OE1 3.73Å; R393-E403 IonicContact NH2-OE2 3.82Å; R393-E403 PolarHBondContact NH2-OE2 3.25Å; E403-D405 WeakPolarHBondContact CB-OD1 3.42Å; E403-D405 PolarHBondContact O-N 2.58Å; E403-D405 VanDerWaalsContact O-N 3.13Å; E403-Q406 HydrophobicContact CB-CG 4.16Å; E403-Q406 VanDerWaalsContact N-OE1 3.17Å; E403-Q406 WeakPolarHBondContact O-CA 3.38Å; E403-Q406 WeakPolarHBondContact O-CB 3.44Å; E403-Q406 PolarHBondContact O-N 3.25Å; E403-L407 PolarHBondContact O-N 3.18Å
404	S	83	Confident	88.4	Confident	15 Å²	15	54.2 Å²	54.2	11%	0.105	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.4	-174.6	49.4	0	0	0	0	115.5	R197 W392	R197-S404 PolarHBondContact NE-OG 2.81Å; R197-S404 PolarHBondContact NH2-OG 3.41Å; W392-S404 VanDerWaalsContact CH2-OG 3.24Å; W392-S404 WeakPolarHBondContact CH2-OG 3.46Å
405	D	83.6	Confident	87.3	Confident	42 Å²	42	53.3 Å²	53.3	23%	0.225	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-10.5	175.1	59.9	-23.5	0	0	0	112.9	R393 E403 L407	R393-D405 IonicContact CZ-OD1 2.93Å; R393-D405 IonicContact CZ-OD2 2.87Å; R393-D405 IonicContact NH1-OD2 3.96Å; R393-D405 IonicContact NH2-OD1 3.38Å; R393-D405 PolarHBondContact NH2-OD1 3.31Å; R393-D405 IonicContact NH2-OD2 3.76Å; R393-D405 PolarHBondContact NH2-OD2 3.5Å; E403-D405 WeakPolarHBondContact CB-OD1 3.42Å; E403-D405 PolarHBondContact O-N 2.58Å; E403-D405 VanDerWaalsContact O-N 3.13Å; D405-L407 VanDerWaalsContact C-N 3.34Å
406	Q	88.1	Confident	86.3	Confident	111 Å²	111	53.4 Å²	53.4	52%	0.519	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-15	166.9	-59.8	171.7	-19.4	0	0	111.6	E403 P428	E403-Q406 HydrophobicContact CB-CG 4.16Å; E403-Q406 VanDerWaalsContact N-OE1 3.17Å; E403-Q406 WeakPolarHBondContact O-CA 3.38Å; E403-Q406 WeakPolarHBondContact O-CB 3.44Å; E403-Q406 PolarHBondContact O-N 3.25Å; Q406-P428 WeakPolarHBondContact O-CG 3.35Å
407	L	93	Very high	85.4	Confident	19 Å²	19	62 Å²	62	10%	0.099	32%	0.318	C	S	.	.	S	Bend	trans	-97.6	143.1	-178	-69.4	-180	0	0	0	112.4	P347 P402 E403 D405 I458	P347-L407 WeakPolarHBondContact CB-O 3.36Å; P402-L407 HydrophobicContact CB-CD2 4.37Å; P402-L407 HydrophobicContact CB-CG 4.46Å; P402-L407 HydrophobicContact CG-CD1 4.06Å; P402-L407 HydrophobicContact CG-CD2 3.69Å; P402-L407 HydrophobicContact CG-CG 3.99Å; E403-L407 PolarHBondContact O-N 3.18Å; D405-L407 VanDerWaalsContact C-N 3.34Å; L407-I458 HydrophobicContact CB-CG2 3.4Å; L407-I458 VanDerWaalsContact CB-CG2 3.4Å; L407-I458 HydrophobicContact CD1-CG2 3.71Å; L407-I458 HydrophobicContact CG-CG2 4.24Å
408	P	94.8	Very high	84.8	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.006	32%	0.323	C	S	.	.			trans	-67.8	155.2	176.2	-21.7	36.3	0	0	0	113.1	Y21 I425 C426 M427 V459 V463	Y21-P408 HydrophobicContact CE1-CG 4.08Å; P408-I425 HydrophobicContact CB-CG2 3.33Å; P408-I425 HydrophobicContact CG-CG2 4.48Å; P408-C426 CarbonylContact C-O 3.51Å; P408-C426 WeakPolarHBondContact CA-O 3.33Å; P408-M427 HydrophobicContact CB-SD 3.81Å; P408-M427 HydrophobicContact CG-CE 4.24Å; P408-M427 HydrophobicContact CG-SD 3.86Å; P408-V459 HydrophobicContact CB-CB 4.16Å; P408-V459 HydrophobicContact CB-CG2 4.13Å; P408-V459 PolarHBondContact O-N 3.03Å; P408-V463 HydrophobicContact CG-CG2 3.6Å
409	R	95.6	Very high	84.4	Confident	7 Å²	7	61.6 Å²	61.6	3%	0.026	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.9	-179.9	-168.2	79.2	178.5	-120.8	0.6	111.2	E193 P345 P347 Y384 V411 I425 C426 G456 D457	E193-R409 VanDerWaalsContact CD-NH2 3.31Å; E193-R409 IonicContact OE1-CZ 3.86Å; E193-R409 IonicContact OE1-NH1 3.93Å; E193-R409 PolarHBondContact OE1-NH1 2.82Å; E193-R409 IonicContact OE1-NH2 2.61Å; E193-R409 PolarHBondContact OE1-NH2 3.07Å; E193-R409 VanDerWaalsContact OE1-NH2 3.14Å; E193-R409 IonicContact OE2-CZ 3.41Å; E193-R409 IonicContact OE2-NH1 2.69Å; E193-R409 IonicContact OE2-NH2 2.71Å; E193-R409 PolarHBondContact OE2-NH2 2.94Å; P345-R409 WeakPolarHBondContact O-CD 3.28Å; P345-R409 WeakPolarHBondContact O-CG 3.2Å; P345-R409 PolarHBondContact O-NH1 3.43Å; P347-R409 HydrophobicContact CG-CB 4.32Å; Y384-R409 PolarHBondContact OH-NH2 3.41Å; R409-V411 PolarHBondContact O-N 3.48Å; R409-I425 CarbonylContact O-C 3.59Å; R409-I425 WeakPolarHBondContact O-CA 3.47Å; R409-C426 HydrophobicContact CB-CB 4.39Å; R409-C426 PolarHBondContact N-O 3.42Å; R409-C426 PolarHBondContact O-N 3Å; R409-G456 PolarHBondContact NE-O 2.9Å; R409-G456 PolarHBondContact NH2-O 3.07Å; R409-D457 VanDerWaalsContact CD-O 3.29Å; R409-D457 WeakPolarHBondContact CD-O 3.42Å
410	I	95.5	Very high	84.4	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	122.3	170.9	-58	179.3	0	0	0	108.7	T412 H423 M450 A453 G456 D457 V459	I410-T412 WeakPolarHBondContact CG2-O 3.49Å; I410-H423 HydrophobicContact CG2-CB 4.26Å; I410-H423 VanDerWaalsContact CG2-ND1 3.31Å; I410-H423 WeakPolarHBondContact CG2-ND1 3.39Å; I410-M450 HydrophobicContact CD1-CE 3.71Å; I410-M450 HydrophobicContact CD1-SD 4.16Å; I410-M450 HydrophobicContact CG1-CE 4.23Å; I410-A453 HydrophobicContact CD1-CB 3.51Å; I410-G456 PolarHBondContact O-N 2.92Å; I410-D457 HydrophobicContact CD1-CB 4.27Å; I410-D457 PolarHBondContact N-O 3.19Å; I410-V459 HydrophobicContact CD1-CG2 4.37Å; I410-V459 HydrophobicContact CG1-CG2 3.65Å
411	V	92.4	Very high	84.6	Confident	8 Å²	8	56.8 Å²	56.8	5%	0.048	28%	0.279	C	S	.	.			trans	-115.4	-13.6	-178.2	-69.1	0	0	0	0	113.5	K354 R409 D424 C426 V432	K354-V411 HydrophobicContact CD-CB 4.07Å; K354-V411 HydrophobicContact CD-CG2 3.74Å; R409-V411 PolarHBondContact O-N 3.48Å; V411-D424 HydrophobicContact CG2-CB 3.89Å; V411-D424 WeakPolarHBondContact CG2-O 3.33Å; V411-D424 PolarHBondContact N-O 3.16Å; V411-C426 HydrophobicContact CG1-CB 3.55Å; V411-C426 HydrophobicContact CG2-CB 4.23Å; V411-V432 HydrophobicContact CG2-CG1 4.33Å
412	T	84.9	Confident	85.1	Confident	27 Å²	27	50.5 Å²	50.5	17%	0.166	25%	0.253	C	S	.	.			trans	-142.6	155.4	163.6	69.4	0	0	0	0	109.8	I410 H423 D424	I410-T412 WeakPolarHBondContact CG2-O 3.49Å; T412-H423 PolarHBondContact O-ND1 3.29Å; T412-D424 WeakPolarHBondContact CB-OD2 3.29Å; T412-D424 HydrophobicContact CG2-CB 4.02Å; T412-D424 WeakPolarHBondContact CG2-OD2 3.39Å; T412-D424 PolarHBondContact N-O 2.93Å; T412-D424 WeakPolarHBondContact OG1-CB 3.32Å; T412-D424 PolarHBondContact OG1-N 3.16Å; T412-D424 PolarHBondContact OG1-OD2 3.48Å
413	H	76.5	Confident	85.6	Confident	54 Å²	54	48.4 Å²	48.4	25%	0.25	24%	0.24	C	C	.	.			trans	-129.6	125.9	171.7	168.6	-111.7	0	0	0	108.3	H423 H454	H413-H423 AromaticContact CD2-CE1 3.31Å; H413-H423 PolarHBondContact CD2-CE1 2.83Å; H413-H423 AromaticContact CD2-ND1 3.89Å; H413-H454 AromaticContact CE1-CE1 3.93Å; H413-H454 AromaticContact ND1-ND1 3.98Å
414	K	76.9	Confident	86.1	Confident	115 Å²	115	46.9 Å²	46.9	50%	0.5	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	150.5	172.9	-64.6	-174.7	178.3	-174.7	0	108.5	I422	K414-I422 PolarHBondContact N-O 3.42Å; K414-I422 CarbonylContact O-C 3.58Å; K414-I422 PolarHBondContact O-N 2.98Å
415	L	71.9	Confident	86.6	Confident	89 Å²	89	46.2 Å²	46.2	47%	0.466	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	138.7	167.5	-63.6	173.9	0	0	0	108.5
416	S	75.3	Confident	87.2	Confident	29 Å²	29	44.4 Å²	44.4	20%	0.203	22%	0.219	C	C	.	.			trans	-71.2	170.3	171.7	81.5	0	0	0	0	111	N418 D419 Q420	S416-N418 PolarHBondContact O-N 2.99Å; S416-N418 PolarHBondContact OG-N 3.02Å; S416-D419 PolarHBondContact O-N 2.85Å; S416-Q420 WeakPolarHBondContact CB-O 3.42Å; S416-Q420 PolarHBondContact N-O 3.05Å; S416-Q420 WeakPolarHBondContact OG-CB 3.49Å; S416-Q420 PolarHBondContact OG-N 3.47Å; S416-Q420 PolarHBondContact OG-O 2.96Å
417	K	75.5	Confident	87.5	Confident	192 Å²	192	39.6 Å²	39.6	84%	0.835	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-27.5	172.5	-67.6	-178.3	-179.3	174.1	0	112.8	E478	K417-E478 IonicContact NZ-OE2 3.75Å
418	N	79.7	Confident	87.5	Confident	128 Å²	128	40.8 Å²	40.8	68%	0.684	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.8	20.5	-179	-65.1	-20	0	0	0	113.3	S416 Q420	S416-N418 PolarHBondContact O-N 2.99Å; S416-N418 PolarHBondContact OG-N 3.02Å; N418-Q420 HydrophobicContact CB-CG 4.42Å; N418-Q420 PolarHBondContact O-N 3.44Å; N418-Q420 VanDerWaalsContact O-N 3.15Å
419	D	82.7	Confident	87.3	Confident	75 Å²	75	44.5 Å²	44.5	40%	0.401	23%	0.231	S	C	.	.	S	Bend	trans	57.9	28.6	-179.3	-169.3	41.8	0	0	0	113.2	S416 K451	S416-D419 PolarHBondContact O-N 2.85Å; D419-K451 IonicContact OD1-NZ 3.96Å; D419-K451 IonicContact OD2-NZ 3.75Å; D419-K451 PolarHBondContact OD2-NZ 3.44Å
420	Q	87.3	Confident	87.1	Confident	35 Å²	35	44.3 Å²	44.3	16%	0.164	23%	0.232	C	C	.	.			trans	-94.4	136	172.7	-62.7	-179.5	-35.2	0	0	109.6	S416 N418 I422 L436	S416-Q420 WeakPolarHBondContact CB-O 3.42Å; S416-Q420 PolarHBondContact N-O 3.05Å; S416-Q420 WeakPolarHBondContact OG-CB 3.49Å; S416-Q420 PolarHBondContact OG-N 3.47Å; S416-Q420 PolarHBondContact OG-O 2.96Å; N418-Q420 HydrophobicContact CB-CG 4.42Å; N418-Q420 PolarHBondContact O-N 3.44Å; N418-Q420 VanDerWaalsContact O-N 3.15Å; Q420-I422 PolarHBondContact O-N 3.38Å; Q420-L436 HydrophobicContact CB-CD1 3.72Å
421	P	90.7	Very high	87	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	128.4	-178.3	20.3	-21.2	0	0	0	111.3	F437 Y447 M450 K451	P421-F437 HydrophobicContact CG-CB 4.16Å; P421-F437 PolarHBondContact O-N 3.34Å; P421-F437 VanDerWaalsContact O-N 3.09Å; P421-Y447 HydrophobicContact CG-CE2 4.34Å; P421-M450 HydrophobicContact CG-CB 4.24Å; P421-K451 HydrophobicContact CG-CB 4.38Å
422	I	92.8	Very high	87	Confident	32 Å²	32	47 Å²	47	16%	0.164	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	122.7	170.2	-61.7	175.5	0	0	0	107.9	L14 K414 Q420 R434 V435 L436	L14-I422 HydrophobicContact CD1-CG2 4.44Å; K414-I422 PolarHBondContact N-O 3.42Å; K414-I422 CarbonylContact O-C 3.58Å; K414-I422 PolarHBondContact O-N 2.98Å; Q420-I422 PolarHBondContact O-N 3.38Å; I422-R434 HydrophobicContact CG2-CG 3.82Å; I422-V435 VanDerWaalsContact CA-O 3.32Å; I422-V435 WeakPolarHBondContact CA-O 3.42Å; I422-L436 HydrophobicContact CD1-CD1 4.19Å; I422-L436 HydrophobicContact CG1-CB 4.4Å; I422-L436 HydrophobicContact CG1-CD1 3.59Å
423	H	93.8	Very high	87.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	139.3	179.6	-63.8	-85.2	0	0	0	110.6	I410 T412 H413 I425 R434 V435 M450	I410-H423 HydrophobicContact CG2-CB 4.26Å; I410-H423 VanDerWaalsContact CG2-ND1 3.31Å; I410-H423 WeakPolarHBondContact CG2-ND1 3.39Å; T412-H423 PolarHBondContact O-ND1 3.29Å; H413-H423 AromaticContact CD2-CE1 3.31Å; H413-H423 PolarHBondContact CD2-CE1 2.83Å; H413-H423 AromaticContact CD2-ND1 3.89Å; H423-I425 HydrophobicContact CB-CD1 4.32Å; H423-I425 HydrophobicContact CB-CG1 3.92Å; H423-R434 WeakPolarHBondContact O-CA 3.49Å; H423-V435 PolarHBondContact N-O 3.3Å; H423-V435 PolarHBondContact O-N 3.45Å; H423-M450 HydrophobicContact CB-CE 4.42Å; H423-M450 VanDerWaalsContact CD2-CE 3.42Å; H423-M450 WeakPolarHBondContact CD2-CE 3.33Å; H423-M450 PolarHBondContact CE1-O 3.03Å; H423-M450 PolarHBondContact NE2-O 3.18Å
424	D	93.7	Very high	88.2	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.027	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	129.6	155.1	-53	-37.2	0	0	0	107.5	F10 V411 T412 V432 E433 R434	F10-D424 HydrophobicContact CE2-CB 4Å; V411-D424 HydrophobicContact CG2-CB 3.89Å; V411-D424 WeakPolarHBondContact CG2-O 3.33Å; V411-D424 PolarHBondContact N-O 3.16Å; T412-D424 WeakPolarHBondContact CB-OD2 3.29Å; T412-D424 HydrophobicContact CG2-CB 4.02Å; T412-D424 WeakPolarHBondContact CG2-OD2 3.39Å; T412-D424 PolarHBondContact N-O 2.93Å; T412-D424 WeakPolarHBondContact OG1-CB 3.32Å; T412-D424 PolarHBondContact OG1-N 3.16Å; T412-D424 PolarHBondContact OG1-OD2 3.48Å; D424-V432 HydrophobicContact CB-CG1 4.21Å; D424-E433 CarbonylContact C-O 3.52Å; D424-E433 WeakPolarHBondContact CA-O 3.29Å; D424-R434 WeakPolarHBondContact OD1-CB 3.4Å; D424-R434 IonicContact OD1-CZ 2.8Å; D424-R434 IonicContact OD1-NE 3.26Å; D424-R434 PolarHBondContact OD1-NE 3.46Å; D424-R434 IonicContact OD1-NH2 3.89Å; D424-R434 PolarHBondContact OD1-NH2 3.26Å; D424-R434 VanDerWaalsContact OD1-NH2 3.1Å; D424-R434 IonicContact OD2-NH2 3.39Å; D424-R434 PolarHBondContact OD2-NH2 2.81Å
425	I	95	Very high	89	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.1	-173.9	-60.8	177.9	0	0	0	108.7	Y21 P408 R409 H423 M427 V432 E433 V435 F437 M450 V459	Y21-I425 HydrophobicContact CE1-CD1 4.34Å; Y21-I425 HydrophobicContact CE2-CD1 4.01Å; Y21-I425 WeakPolarHBondContact OH-CD1 3.47Å; Y21-I425 WeakPolarHBondContact OH-CG2 3.38Å; P408-I425 HydrophobicContact CB-CG2 3.33Å; P408-I425 HydrophobicContact CG-CG2 4.48Å; R409-I425 CarbonylContact O-C 3.59Å; R409-I425 WeakPolarHBondContact O-CA 3.47Å; H423-I425 HydrophobicContact CB-CD1 4.32Å; H423-I425 HydrophobicContact CB-CG1 3.92Å; I425-M427 HydrophobicContact CG2-SD 3.93Å; I425-V432 VanDerWaalsContact O-CA 3.28Å; I425-V432 WeakPolarHBondContact O-CA 3.19Å; I425-E433 HydrophobicContact CB-CG 4.41Å; I425-E433 PolarHBondContact N-O 3.13Å; I425-E433 PolarHBondContact O-N 3.31Å; I425-V435 HydrophobicContact CD1-CB 3.97Å; I425-V435 HydrophobicContact CD1-CG2 3.81Å; I425-V435 HydrophobicContact CG1-CG2 4.29Å; I425-F437 HydrophobicContact CD1-CE2 4.12Å; I425-F437 HydrophobicContact CD1-CZ 4.09Å; I425-M450 HydrophobicContact CD1-CE 4.3Å; I425-V459 HydrophobicContact CD1-CG2 4.07Å; I425-V459 HydrophobicContact CG1-CG2 4.37Å; I425-V459 HydrophobicContact CG2-CG2 4.02Å
426	C	95	Very high	90	Very high	4 Å²	4	37.6 Å²	37.6	3%	0.027	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	121.3	175.4	-175.1	0	0	0	0	109.8	H348 P408 R409 V411	H348-C426 PolarHBondContact NE2-SG 3.1Å; H348-C426 VanDerWaalsContact NE2-SG 3.38Å; P408-C426 CarbonylContact C-O 3.51Å; P408-C426 WeakPolarHBondContact CA-O 3.33Å; R409-C426 HydrophobicContact CB-CB 4.39Å; R409-C426 PolarHBondContact N-O 3.42Å; R409-C426 PolarHBondContact O-N 3Å; V411-C426 HydrophobicContact CG1-CB 3.55Å; V411-C426 HydrophobicContact CG2-CB 4.23Å
427	M	94.5	Very high	90.9	Very high	10 Å²	10	36.2 Å²	36.2	5%	0.049	20%	0.196	C	C	.	.			trans	-90.8	156.7	-172.4	-57.8	-60.7	-84	0	0	111.6	H348 P408 I425 S429 G430 A431 E433 V463	H348-M427 PolarHBondContact CD2-O 3.06Å; H348-M427 VanDerWaalsContact CD2-O 3.27Å; P408-M427 HydrophobicContact CB-SD 3.81Å; P408-M427 HydrophobicContact CG-CE 4.24Å; P408-M427 HydrophobicContact CG-SD 3.86Å; I425-M427 HydrophobicContact CG2-SD 3.93Å; M427-S429 WeakPolarHBondContact CB-OG 3.44Å; M427-S429 PolarHBondContact O-N 3.33Å; M427-S429 VanDerWaalsContact O-N 3.09Å; M427-G430 PolarHBondContact O-N 3.14Å; M427-A431 WeakPolarHBondContact CB-O 3.44Å; M427-A431 PolarHBondContact N-O 2.96Å; M427-E433 HydrophobicContact CG-CG 4.2Å; M427-E433 HydrophobicContact SD-CG 4.13Å; M427-V463 HydrophobicContact CE-CB 4.15Å; M427-V463 HydrophobicContact CE-CG1 3.56Å; M427-V463 HydrophobicContact CE-CG2 3.49Å; M427-V463 VanDerWaalsContact CE-CG2 3.49Å
428	P	93.1	Very high	91.7	Very high	44 Å²	44	27.6 Å²	27.6	29%	0.286	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-22.6	169.8	-26.4	34.8	0	0	0	114.1	H348 Q406 G430	H348-P428 WeakPolarHBondContact CB-O 3.47Å; Q406-P428 WeakPolarHBondContact O-CG 3.35Å; P428-G430 PolarHBondContact O-N 3.17Å
429	S	91.8	Very high	92.2	Very high	79 Å²	79	27.9 Å²	27.9	55%	0.552	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-12.1	173.1	62.1	0	0	0	0	114	M427 A431	M427-S429 WeakPolarHBondContact CB-OG 3.44Å; M427-S429 PolarHBondContact O-N 3.33Å; M427-S429 VanDerWaalsContact O-N 3.09Å; S429-A431 VanDerWaalsContact C-N 3.27Å; S429-A431 WeakPolarHBondContact OG-CB 3.41Å; S429-A431 PolarHBondContact OG-N 3.36Å
430	G	91.4	Very high	92.5	Very high	4 Å²	4	32.1 Å²	32.1	4%	0.041	17%	0.172	C	C	.	.	S	Bend	trans	84.6	-6.9	-171	0	0	0	0	0	114.8	G353 M427 P428	G353-G430 WeakPolarHBondContact CA-O 3.28Å; G353-G430 PolarHBondContact N-O 3.26Å; M427-G430 PolarHBondContact O-N 3.14Å; P428-G430 PolarHBondContact O-N 3.17Å
431	A	92.2	Very high	92.7	Very high	50 Å²	50	36 Å²	36	41%	0.413	19%	0.19	S	C	.	.			trans	-70.6	157.5	170.6	0	0	0	0	0	111.1	M427 S429	M427-A431 WeakPolarHBondContact CB-O 3.44Å; M427-A431 PolarHBondContact N-O 2.96Å; S429-A431 VanDerWaalsContact C-N 3.27Å; S429-A431 WeakPolarHBondContact OG-CB 3.41Å; S429-A431 PolarHBondContact OG-N 3.36Å
432	V	92.9	Very high	92.7	Very high	16 Å²	16	36.4 Å²	36.4	10%	0.097	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	138.4	175.5	-176.7	0	0	0	0	107.4	F10 K354 V411 D424 I425	F10-V432 HydrophobicContact CB-CB 4.42Å; F10-V432 WeakPolarHBondContact CB-O 3.32Å; F10-V432 HydrophobicContact CD1-CB 4.06Å; F10-V432 HydrophobicContact CD1-CG1 4.13Å; F10-V432 HydrophobicContact CD2-CB 4.29Å; F10-V432 HydrophobicContact CD2-CG1 3.65Å; F10-V432 HydrophobicContact CE1-CB 4.45Å; F10-V432 HydrophobicContact CE1-CG1 4.2Å; F10-V432 HydrophobicContact CE2-CG1 3.74Å; F10-V432 HydrophobicContact CG-CB 3.99Å; F10-V432 HydrophobicContact CG-CG1 3.87Å; F10-V432 HydrophobicContact CZ-CG1 4.02Å; K354-V432 HydrophobicContact CD-CG1 4.5Å; K354-V432 HydrophobicContact CD-CG2 4.38Å; K354-V432 HydrophobicContact CG-CB 4.47Å; K354-V432 HydrophobicContact CG-CG1 4.32Å; K354-V432 HydrophobicContact CG-CG2 3.55Å; V411-V432 HydrophobicContact CG2-CG1 4.33Å; D424-V432 HydrophobicContact CB-CG1 4.21Å; I425-V432 VanDerWaalsContact O-CA 3.28Å; I425-V432 WeakPolarHBondContact O-CA 3.19Å
433	E	93.1	Very high	92.7	Very high	18 Å²	18	37.8 Å²	37.8	8%	0.084	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	145.7	177.1	48.9	-178.5	-127.2	0	0	110.6	I15 R20 Y21 D424 I425 M427 V435	I15-E433 HydrophobicContact CD1-CB 3.61Å; I15-E433 HydrophobicContact CD1-CG 4.26Å; R20-E433 IonicContact CZ-OE2 3.58Å; R20-E433 IonicContact NE-OE1 3.41Å; R20-E433 PolarHBondContact NE-OE1 3.35Å; R20-E433 IonicContact NE-OE2 3.34Å; R20-E433 PolarHBondContact NE-OE2 3.24Å; R20-E433 IonicContact NH2-OE2 3.36Å; R20-E433 PolarHBondContact NH2-OE2 2.87Å; Y21-E433 WeakPolarHBondContact CE2-OE1 3.49Å; Y21-E433 VanDerWaalsContact CZ-OE1 3.3Å; Y21-E433 PolarHBondContact OH-OE1 2.87Å; D424-E433 CarbonylContact C-O 3.52Å; D424-E433 WeakPolarHBondContact CA-O 3.29Å; I425-E433 HydrophobicContact CB-CG 4.41Å; I425-E433 PolarHBondContact N-O 3.13Å; I425-E433 PolarHBondContact O-N 3.31Å; M427-E433 HydrophobicContact CG-CG 4.2Å; M427-E433 HydrophobicContact SD-CG 4.13Å; E433-V435 HydrophobicContact CB-CG2 4.3Å; E433-V435 HydrophobicContact CG-CG2 3.88Å
434	R	92.9	Very high	92.6	Very high	50 Å²	50	41.3 Å²	41.3	19%	0.189	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	124.9	172.2	177.1	167.4	-72.2	165.2	4.2	109.5	L14 I15 I422 H423 D424	L14-R434 HydrophobicContact CD1-CG 3.73Å; I15-R434 PolarHBondContact N-O 3.06Å; I422-R434 HydrophobicContact CG2-CG 3.82Å; H423-R434 WeakPolarHBondContact O-CA 3.49Å; D424-R434 WeakPolarHBondContact OD1-CB 3.4Å; D424-R434 IonicContact OD1-CZ 2.8Å; D424-R434 IonicContact OD1-NE 3.26Å; D424-R434 PolarHBondContact OD1-NE 3.46Å; D424-R434 IonicContact OD1-NH2 3.89Å; D424-R434 PolarHBondContact OD1-NH2 3.26Å; D424-R434 VanDerWaalsContact OD1-NH2 3.1Å; D424-R434 IonicContact OD2-NH2 3.39Å; D424-R434 PolarHBondContact OD2-NH2 2.81Å
435	V	94.1	Very high	92.5	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	127.6	-167	-170.5	0	0	0	0	110.4	I15 Y21 I422 H423 I425 E433 F437	I15-V435 HydrophobicContact CB-CG2 4.28Å; I15-V435 WeakPolarHBondContact O-CA 3.3Å; Y21-V435 HydrophobicContact CD2-CG1 4.13Å; Y21-V435 HydrophobicContact CE2-CB 4.38Å; Y21-V435 HydrophobicContact CE2-CG1 3.74Å; Y21-V435 HydrophobicContact CE2-CG2 3.93Å; I422-V435 VanDerWaalsContact CA-O 3.32Å; I422-V435 WeakPolarHBondContact CA-O 3.42Å; H423-V435 PolarHBondContact N-O 3.3Å; H423-V435 PolarHBondContact O-N 3.45Å; I425-V435 HydrophobicContact CD1-CB 3.97Å; I425-V435 HydrophobicContact CD1-CG2 3.81Å; I425-V435 HydrophobicContact CG1-CG2 4.29Å; E433-V435 HydrophobicContact CB-CG2 4.3Å; E433-V435 HydrophobicContact CG-CG2 3.88Å; V435-F437 HydrophobicContact CB-CE2 4.02Å; V435-F437 HydrophobicContact CB-CZ 4.45Å; V435-F437 HydrophobicContact CG1-CD2 4.21Å; V435-F437 HydrophobicContact CG1-CE1 4.39Å; V435-F437 HydrophobicContact CG1-CE2 3.58Å; V435-F437 HydrophobicContact CG1-CZ 3.7Å
436	L	93.6	Very high	92.4	Very high	19 Å²	19	42.1 Å²	42.1	10%	0.099	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	137.3	169.7	173.9	68.6	0	0	0	109	L14 I15 G17 Q420 I422 P438 I473	L14-L436 HydrophobicContact CD1-CB 3.99Å; L14-L436 HydrophobicContact CD2-CB 4.21Å; L14-L436 HydrophobicContact CD2-CD2 4.36Å; L14-L436 HydrophobicContact CG-CB 4.18Å; I15-L436 PolarHBondContact O-N 3.19Å; G17-L436 WeakPolarHBondContact CA-O 3.45Å; G17-L436 PolarHBondContact N-O 3.2Å; Q420-L436 HydrophobicContact CB-CD1 3.72Å; I422-L436 HydrophobicContact CD1-CD1 4.19Å; I422-L436 HydrophobicContact CG1-CB 4.4Å; I422-L436 HydrophobicContact CG1-CD1 3.59Å; L436-P438 HydrophobicContact CD2-CG 4.29Å; L436-P438 HydrophobicContact CG-CG 4.28Å; L436-P438 WeakPolarHBondContact O-CD 3.49Å; L436-I473 HydrophobicContact CB-CD1 4.37Å; L436-I473 HydrophobicContact CD2-CD1 3.9Å
437	F	93.1	Very high	92.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.238	C	C	.	.			trans	-110.6	96	171.6	-66.4	-93.5	0	0	0	110.4	Y21 P421 I425 V435 T442 L446 Y447 M450	Y21-F437 AromaticContact CD2-CE1 3.94Å; Y21-F437 HydrophobicContact CD2-CE1 3.94Å; Y21-F437 AromaticContact CD2-CZ 3.81Å; Y21-F437 HydrophobicContact CD2-CZ 3.81Å; Y21-F437 HydrophobicContact CE2-CZ 4.2Å; Y21-F437 HydrophobicContact CG-CE1 4.25Å; Y21-F437 HydrophobicContact CG-CZ 4.3Å; P421-F437 HydrophobicContact CG-CB 4.16Å; P421-F437 PolarHBondContact O-N 3.34Å; P421-F437 VanDerWaalsContact O-N 3.09Å; I425-F437 HydrophobicContact CD1-CE2 4.12Å; I425-F437 HydrophobicContact CD1-CZ 4.09Å; V435-F437 HydrophobicContact CB-CE2 4.02Å; V435-F437 HydrophobicContact CB-CZ 4.45Å; V435-F437 HydrophobicContact CG1-CD2 4.21Å; V435-F437 HydrophobicContact CG1-CE1 4.39Å; V435-F437 HydrophobicContact CG1-CE2 3.58Å; V435-F437 HydrophobicContact CG1-CZ 3.7Å; F437-T442 HydrophobicContact CB-CG2 4.38Å; F437-T442 HydrophobicContact CD1-CG2 3.91Å; F437-L446 HydrophobicContact CE1-CD2 4.25Å; F437-L446 HydrophobicContact CE1-CG 4.48Å; F437-Y447 WeakPolarHBondContact O-CE2 3.42Å; F437-M450 HydrophobicContact CD1-CG 4.06Å; F437-M450 HydrophobicContact CD2-CB 4.22Å; F437-M450 HydrophobicContact CD2-CE 4.06Å; F437-M450 HydrophobicContact CD2-CG 4.11Å; F437-M450 HydrophobicContact CE1-CE 4.49Å; F437-M450 HydrophobicContact CE1-CG 4.03Å; F437-M450 HydrophobicContact CE2-CE 3.35Å; F437-M450 HydrophobicContact CE2-CG 4.1Å; F437-M450 HydrophobicContact CE2-SD 4.45Å; F437-M450 HydrophobicContact CG-CB 4.26Å; F437-M450 HydrophobicContact CG-CG 4.1Å; F437-M450 HydrophobicContact CZ-CE 3.61Å; F437-M450 HydrophobicContact CZ-CG 4.05Å; F437-M450 HydrophobicContact CZ-SD 4.32Å
438	P	92	Very high	92.1	Very high	11 Å²	11	45.8 Å²	45.8	7%	0.071	25%	0.248	C	C	.	.			trans	-69.7	132.2	179.8	-16.1	30.5	0	0	0	111.3	N16 L436 Q440 Q441 T442	N16-P438 VanDerWaalsContact OD1-CD 3.28Å; N16-P438 WeakPolarHBondContact OD1-CD 3.46Å; N16-P438 WeakPolarHBondContact OD1-CG 3.08Å; L436-P438 HydrophobicContact CD2-CG 4.29Å; L436-P438 HydrophobicContact CG-CG 4.28Å; L436-P438 WeakPolarHBondContact O-CD 3.49Å; P438-Q440 PolarHBondContact O-N 3.12Å; P438-Q441 HydrophobicContact CB-CB 4.36Å; P438-Q441 HydrophobicContact CB-CG 4.44Å; P438-Q441 PolarHBondContact O-N 3.28Å; P438-T442 VanDerWaalsContact O-CB 3.3Å; P438-T442 WeakPolarHBondContact O-CB 3.4Å; P438-T442 PolarHBondContact O-N 3.47Å; P438-T442 PolarHBondContact O-OG1 3.36Å
439	K	90.4	Very high	92.2	Very high	133 Å²	133	43.7 Å²	43.7	58%	0.578	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-43	-175	-173.7	176.4	178.3	-173.3	0	114.5	Y447	K439-Y447 HydrophobicContact CB-CD2 4.19Å; K439-Y447 HydrophobicContact CB-CE1 4.17Å; K439-Y447 HydrophobicContact CB-CE2 3.56Å; K439-Y447 HydrophobicContact CD-CE1 4.08Å; K439-Y447 HydrophobicContact CG-CD1 4.18Å; K439-Y447 HydrophobicContact CG-CD2 4.48Å; K439-Y447 HydrophobicContact CG-CE1 3.71Å; K439-Y447 HydrophobicContact CG-CE2 4.03Å
440	Q	89.8	Confident	92.3	Very high	164 Å²	164	39.9 Å²	39.9	77%	0.766	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-21.2	-175	-61.8	87.2	-9.9	0	0	113.5	P438	P438-Q440 PolarHBondContact O-N 3.12Å
441	Q	90.8	Very high	92.3	Very high	116 Å²	116	42.8 Å²	42.8	54%	0.542	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-26.1	-174.5	-59.4	179.8	18.3	0	0	112.5	N16 S18 P438	N16-Q441 PolarHBondContact ND2-OE1 3.06Å; S18-Q441 VanDerWaalsContact CB-O 3.28Å; S18-Q441 WeakPolarHBondContact CB-O 3.42Å; S18-Q441 WeakPolarHBondContact OG-CB 3.48Å; S18-Q441 PolarHBondContact OG-OE1 2.67Å; P438-Q441 HydrophobicContact CB-CB 4.36Å; P438-Q441 HydrophobicContact CB-CG 4.44Å; P438-Q441 PolarHBondContact O-N 3.28Å
442	T	91.8	Very high	92.3	Very high	9 Å²	9	43.9 Å²	43.9	6%	0.055	22%	0.216	C	C	.	.	S	Bend	trans	-82.1	136.3	179.7	-49.9	0	0	0	0	109.1	F437 P438 A444 L446	F437-T442 HydrophobicContact CB-CG2 4.38Å; F437-T442 HydrophobicContact CD1-CG2 3.91Å; P438-T442 VanDerWaalsContact O-CB 3.3Å; P438-T442 WeakPolarHBondContact O-CB 3.4Å; P438-T442 PolarHBondContact O-N 3.47Å; P438-T442 PolarHBondContact O-OG1 3.36Å; T442-A444 PolarHBondContact O-N 2.92Å; T442-L446 HydrophobicContact CG2-CB 4.07Å; T442-L446 HydrophobicContact CG2-CD2 3.96Å; T442-L446 HydrophobicContact CG2-CG 3.92Å
443	D	92	Very high	92.3	Very high	61 Å²	61	43.1 Å²	43.1	33%	0.326	21%	0.212	S	C	.	.			trans	-46.8	139	169.2	166.8	-103.4	0	0	0	111.4	T23 C445 L446 Y447	T23-D443 WeakPolarHBondContact CG2-OD1 3.35Å; T23-D443 WeakPolarHBondContact OG1-CB 3.36Å; T23-D443 PolarHBondContact OG1-OD1 3.24Å; D443-C445 VanDerWaalsContact C-N 3.28Å; D443-C445 PolarHBondContact O-N 2.8Å; D443-C445 WeakPolarHBondContact OD1-CB 3.34Å; D443-C445 VanDerWaalsContact OD1-N 3.14Å; D443-C445 PolarHBondContact OD1-N 3.42Å; D443-L446 PolarHBondContact O-N 3.49Å; D443-L446 PolarHBondContact OD1-N 3.06Å; D443-L446 VanDerWaalsContact OD1-N 3.09Å; D443-L446 HydrophobicContact CB-CB 4.29Å; D443-Y447 WeakPolarHBondContact O-CB 3.21Å; D443-Y447 PolarHBondContact O-N 3.41Å
444	A	90.8	Very high	92.4	Very high	74 Å²	74	45.9 Å²	45.9	61%	0.612	23%	0.225	S	C	*	.	H	α-helix	trans	-61.6	-36.7	-170	0	0	0	0	0	112.8	T442 Y448	T442-A444 PolarHBondContact O-N 2.92Å; A444-Y448 WeakPolarHBondContact O-CB 3.26Å; A444-Y448 PolarHBondContact O-N 2.73Å
445	C	92	Very high	92.4	Very high	21 Å²	21	44 Å²	44	14%	0.142	22%	0.219	C	C	.	.	H	α-helix	trans	-70.3	-46.2	-179.7	-50.1	0	0	0	0	110.3	T23 L27 F31 D443 Y448 Y449	T23-C445 HydrophobicContact CG2-CB 4.4Å; L27-C445 HydrophobicContact CD2-CB 4.29Å; L27-C445 HydrophobicContact CG-CB 4.15Å; F31-C445 HydrophobicContact CB-CB 3.93Å; F31-C445 WeakPolarHBondContact CB-SG 3.38Å; F31-C445 HydrophobicContact CD2-CB 4.15Å; F31-C445 HydrophobicContact CG-CB 4.16Å; D443-C445 VanDerWaalsContact C-N 3.28Å; D443-C445 PolarHBondContact O-N 2.8Å; D443-C445 WeakPolarHBondContact OD1-CB 3.34Å; D443-C445 VanDerWaalsContact OD1-N 3.14Å; D443-C445 PolarHBondContact OD1-N 3.42Å; C445-Y448 PolarHBondContact O-N 3.01Å; C445-Y449 WeakPolarHBondContact O-CB 3.49Å; C445-Y449 PolarHBondContact O-N 2.99Å
446	L	92.7	Very high	92.4	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-64.2	-43.8	176	-179.7	60.7	0	0	0	111.8	T23 L27 F437 T442 D443 Y448 Y449 M450 A461	T23-L446 HydrophobicContact CG2-CB 4.27Å; T23-L446 VanDerWaalsContact OG1-CB 3.32Å; T23-L446 WeakPolarHBondContact OG1-CB 3.5Å; L27-L446 HydrophobicContact CD2-CB 4.26Å; L27-L446 HydrophobicContact CD2-CD1 4.35Å; F437-L446 HydrophobicContact CE1-CD2 4.25Å; F437-L446 HydrophobicContact CE1-CG 4.48Å; T442-L446 HydrophobicContact CG2-CB 4.07Å; T442-L446 HydrophobicContact CG2-CD2 3.96Å; T442-L446 HydrophobicContact CG2-CG 3.92Å; D443-L446 PolarHBondContact O-N 3.49Å; D443-L446 PolarHBondContact OD1-N 3.06Å; D443-L446 VanDerWaalsContact OD1-N 3.09Å; D443-L446 HydrophobicContact CB-CB 4.29Å; L446-Y448 VanDerWaalsContact C-N 3.34Å; L446-Y448 PolarHBondContact O-N 3.06Å; L446-Y449 PolarHBondContact O-N 2.84Å; L446-M450 HydrophobicContact CD1-CG 3.87Å; L446-M450 HydrophobicContact CD1-SD 4.26Å; L446-M450 HydrophobicContact CG-CG 4.25Å; L446-M450 WeakPolarHBondContact O-CB 3.32Å; L446-M450 VanDerWaalsContact O-CG 3.3Å; L446-M450 WeakPolarHBondContact O-CG 3.49Å; L446-M450 PolarHBondContact O-N 3Å; L446-A461 HydrophobicContact CD2-CB 4.37Å; L446-A461 HydrophobicContact CD1-CB 4.15Å
447	Y	92.8	Very high	92.5	Very high	25 Å²	25	43.2 Å²	43.2	10%	0.098	22%	0.215	C	C	.	.	H	α-helix	trans	-59.2	-45.8	176.6	-178.8	-96.6	0	0	0	111.5	P421 F437 K439 D443 M450 K451	P421-Y447 HydrophobicContact CG-CE2 4.34Å; F437-Y447 WeakPolarHBondContact O-CE2 3.42Å; K439-Y447 HydrophobicContact CB-CD2 4.19Å; K439-Y447 HydrophobicContact CB-CE1 4.17Å; K439-Y447 HydrophobicContact CB-CE2 3.56Å; K439-Y447 HydrophobicContact CD-CE1 4.08Å; K439-Y447 HydrophobicContact CG-CD1 4.18Å; K439-Y447 HydrophobicContact CG-CD2 4.48Å; K439-Y447 HydrophobicContact CG-CE1 3.71Å; K439-Y447 HydrophobicContact CG-CE2 4.03Å; D443-Y447 WeakPolarHBondContact O-CB 3.21Å; D443-Y447 PolarHBondContact O-N 3.41Å; Y447-M450 PolarHBondContact O-N 2.99Å; Y447-K451 HydrophobicContact CE1-CD 4.17Å; Y447-K451 VanDerWaalsContact O-CB 3.3Å; Y447-K451 WeakPolarHBondContact O-CB 3.34Å; Y447-K451 PolarHBondContact O-N 3.16Å
448	Y	91.9	Very high	92.6	Very high	66 Å²	66	43.5 Å²	43.5	26%	0.259	22%	0.217	S	C	.	.	H	α-helix	trans	-61.2	-46.8	176.7	-179.1	-98.9	0	0	0	111.4	F31 W53 A444 C445 L446 K451 Q452	F31-Y448 HydrophobicContact CD1-CD1 4.48Å; F31-Y448 AromaticContact CE1-CD1 3.48Å; F31-Y448 HydrophobicContact CE1-CD1 3.48Å; F31-Y448 VanDerWaalsContact CE1-CD1 3.48Å; F31-Y448 AromaticContact CE1-CE1 3.71Å; F31-Y448 HydrophobicContact CE1-CE1 3.71Å; F31-Y448 HydrophobicContact CE1-CG 4.42Å; F31-Y448 AromaticContact CZ-CD1 3.59Å; F31-Y448 HydrophobicContact CZ-CD1 3.59Å; F31-Y448 AromaticContact CZ-CE1 3.85Å; F31-Y448 HydrophobicContact CZ-CE1 3.85Å; W53-Y448 HydrophobicContact CB-CE1 4.01Å; A444-Y448 WeakPolarHBondContact O-CB 3.26Å; A444-Y448 PolarHBondContact O-N 2.73Å; C445-Y448 PolarHBondContact O-N 3.01Å; L446-Y448 VanDerWaalsContact C-N 3.34Å; L446-Y448 PolarHBondContact O-N 3.06Å; Y448-K451 PolarHBondContact O-N 2.98Å; Y448-Q452 HydrophobicContact CE1-CG 4.21Å; Y448-Q452 HydrophobicContact CE2-CG 4.27Å; Y448-Q452 WeakPolarHBondContact O-CG 3.48Å; Y448-Q452 PolarHBondContact O-N 2.98Å
449	Y	93.9	Very high	92.7	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-56.7	-55.1	176.3	-177.6	-81.1	0	0	0	111.2	L27 L57 L60 C62 Y63 C445 L446 K451 Q452 A453 I458 P460	L27-Y449 HydrophobicContact CD1-CD2 3.96Å; L27-Y449 HydrophobicContact CD1-CG 4.43Å; L57-Y449 HydrophobicContact CD1-CD2 3.39Å; L57-Y449 HydrophobicContact CD1-CE2 3.86Å; L57-Y449 HydrophobicContact CD1-CG 4.26Å; L60-Y449 HydrophobicContact CD1-CD2 4.05Å; L60-Y449 HydrophobicContact CD1-CE2 4.13Å; C62-Y449 PolarHBondContact O-OH 3.2Å; C62-Y449 VanDerWaalsContact SG-CE2 3.55Å; Y63-Y449 HydrophobicContact CD2-CE2 4.17Å; C445-Y449 WeakPolarHBondContact O-CB 3.49Å; C445-Y449 PolarHBondContact O-N 2.99Å; L446-Y449 PolarHBondContact O-N 2.84Å; Y449-K451 PolarHBondContact O-N 2.66Å; Y449-K451 VanDerWaalsContact C-N 3.26Å; Y449-Q452 CarbonylContact O-C 3.58Å; Y449-Q452 PolarHBondContact O-N 2.9Å; Y449-A453 HydrophobicContact CD1-CB 3.94Å; Y449-A453 HydrophobicContact CE1-CB 3.56Å; Y449-A453 VanDerWaalsContact O-CB 3.31Å; Y449-A453 WeakPolarHBondContact O-CB 3.48Å; Y449-A453 PolarHBondContact O-N 2.72Å; Y449-I458 PolarHBondContact OH-O 3.41Å; Y449-P460 HydrophobicContact CD1-CG 3.72Å; Y449-P460 HydrophobicContact CG-CG 3.76Å; Y449-P460 HydrophobicContact CE2-CG 3.92Å; Y449-P460 HydrophobicContact CD2-CG 3.85Å; Y449-P460 HydrophobicContact CE1-CG 3.82Å
450	M	94	Very high	92.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-34.1	-176.8	-64.5	-50.6	-72.6	0	0	111.8	I410 P421 H423 I425 F437 L446 Y447 Q452 V459	I410-M450 HydrophobicContact CD1-CE 3.71Å; I410-M450 HydrophobicContact CD1-SD 4.16Å; I410-M450 HydrophobicContact CG1-CE 4.23Å; P421-M450 HydrophobicContact CG-CB 4.24Å; H423-M450 HydrophobicContact CB-CE 4.42Å; H423-M450 VanDerWaalsContact CD2-CE 3.42Å; H423-M450 WeakPolarHBondContact CD2-CE 3.33Å; H423-M450 PolarHBondContact CE1-O 3.03Å; H423-M450 PolarHBondContact NE2-O 3.18Å; I425-M450 HydrophobicContact CD1-CE 4.3Å; F437-M450 HydrophobicContact CD1-CG 4.06Å; F437-M450 HydrophobicContact CD2-CB 4.22Å; F437-M450 HydrophobicContact CD2-CE 4.06Å; F437-M450 HydrophobicContact CD2-CG 4.11Å; F437-M450 HydrophobicContact CE1-CE 4.49Å; F437-M450 HydrophobicContact CE1-CG 4.03Å; F437-M450 HydrophobicContact CE2-CE 3.35Å; F437-M450 HydrophobicContact CE2-CG 4.1Å; F437-M450 HydrophobicContact CE2-SD 4.45Å; F437-M450 HydrophobicContact CG-CB 4.26Å; F437-M450 HydrophobicContact CG-CG 4.1Å; F437-M450 HydrophobicContact CZ-CE 3.61Å; F437-M450 HydrophobicContact CZ-CG 4.05Å; F437-M450 HydrophobicContact CZ-SD 4.32Å; L446-M450 HydrophobicContact CD1-CG 3.87Å; L446-M450 HydrophobicContact CD1-SD 4.26Å; L446-M450 HydrophobicContact CG-CG 4.25Å; L446-M450 WeakPolarHBondContact O-CB 3.32Å; L446-M450 VanDerWaalsContact O-CG 3.3Å; L446-M450 WeakPolarHBondContact O-CG 3.49Å; L446-M450 PolarHBondContact O-N 3Å; Y447-M450 PolarHBondContact O-N 2.99Å; M450-Q452 PolarHBondContact O-N 3.34Å; M450-Q452 VanDerWaalsContact C-N 3.27Å; M450-V459 HydrophobicContact CE-CG2 4.41Å; M450-V459 HydrophobicContact SD-CG1 4.36Å
451	K	92.3	Very high	92.9	Very high	64 Å²	64	29.1 Å²	29.1	28%	0.278	15%	0.151	S	C	.	.	H	α-helix	trans	-65.2	-28.4	173.9	-174.9	165.6	-175.8	161.6	0	113.6	D419 P421 Y447 Y448 Y449	D419-K451 IonicContact OD1-NZ 3.96Å; D419-K451 IonicContact OD2-NZ 3.75Å; D419-K451 PolarHBondContact OD2-NZ 3.44Å; P421-K451 HydrophobicContact CG-CB 4.38Å; Y447-K451 HydrophobicContact CE1-CD 4.17Å; Y447-K451 VanDerWaalsContact O-CB 3.3Å; Y447-K451 WeakPolarHBondContact O-CB 3.34Å; Y447-K451 PolarHBondContact O-N 3.16Å; Y448-K451 PolarHBondContact O-N 2.98Å; Y449-K451 PolarHBondContact O-N 2.66Å; Y449-K451 VanDerWaalsContact C-N 3.26Å
452	Q	92.1	Very high	92.7	Very high	73 Å²	73	28.7 Å²	28.7	34%	0.341	15%	0.149	S	C	.	.	H	α-helix	trans	-98.8	-20.4	-179.4	-60.8	-54.7	-51.4	0	0	113.4	L57 Y448 Y449 M450 H454	L57-Q452 HydrophobicContact CD2-CB 3.53Å; L57-Q452 HydrophobicContact CD2-CG 4.02Å; Y448-Q452 HydrophobicContact CE1-CG 4.21Å; Y448-Q452 HydrophobicContact CE2-CG 4.27Å; Y448-Q452 WeakPolarHBondContact O-CG 3.48Å; Y448-Q452 PolarHBondContact O-N 2.98Å; Y449-Q452 CarbonylContact O-C 3.58Å; Y449-Q452 PolarHBondContact O-N 2.9Å; M450-Q452 PolarHBondContact O-N 3.34Å; M450-Q452 VanDerWaalsContact C-N 3.27Å; Q452-H454 PolarHBondContact O-ND1 3.31Å
453	A	93.2	Very high	92.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.16	C	C	.	.			trans	-73.6	149.2	-176.2	0	0	0	0	0	111.6	I410 Y449 D457	I410-A453 HydrophobicContact CD1-CB 3.51Å; Y449-A453 HydrophobicContact CD1-CB 3.94Å; Y449-A453 HydrophobicContact CE1-CB 3.56Å; Y449-A453 VanDerWaalsContact O-CB 3.31Å; Y449-A453 WeakPolarHBondContact O-CB 3.48Å; Y449-A453 PolarHBondContact O-N 2.72Å; A453-D457 WeakPolarHBondContact CA-OD2 3.43Å; A453-D457 HydrophobicContact CB-CB 4.18Å
454	H	93.3	Very high	92.2	Very high	77 Å²	77	29 Å²	29	36%	0.356	15%	0.153	S	C	.	.			trans	-128.1	176.8	179.6	-72.4	27.1	0	0	0	110.6	Q65 H413 Q452 G456 D457	Q65-H454 HydrophobicContact CG-CB 4.34Å; H413-H454 AromaticContact CE1-CE1 3.93Å; H413-H454 AromaticContact ND1-ND1 3.98Å; Q452-H454 PolarHBondContact O-ND1 3.31Å; H454-G456 PolarHBondContact O-N 3.43Å; H454-D457 PolarHBondContact O-N 3.27Å; H454-D457 WeakPolarHBondContact O-CB 3.44Å; H454-D457 PolarHBondContact N-OD2 3.19Å
455	S	93.3	Very high	91.4	Very high	10 Å²	10	31.8 Å²	31.8	7%	0.07	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	133.8	174.3	51.9	0	0	0	0	110.6	Q65 I361	Q65-S455 PolarHBondContact NE2-O 2.92Å; I361-S455 WeakPolarHBondContact CA-OG 3.38Å
456	G	93.9	Very high	90	Very high	2 Å²	2	33.9 Å²	33.9	2%	0.021	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.5	1.4	-172.3	0	0	0	0	0	114.8	L64 R189 R409 I410 H454	L64-G456 VanDerWaalsContact CD1-O 3.29Å; L64-G456 WeakPolarHBondContact CD1-O 3.28Å; R189-G456 PolarHBondContact NH2-O 3.15Å; R409-G456 PolarHBondContact NE-O 2.9Å; R409-G456 PolarHBondContact NH2-O 3.07Å; I410-G456 PolarHBondContact O-N 2.92Å; H454-G456 PolarHBondContact O-N 3.43Å
457	D	95.7	Very high	88.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-87.5	159.4	166.6	-67	-30.7	0	0	0	111.8	L64 Q65 R409 I410 A453 H454	L64-D457 WeakPolarHBondContact CA-OD1 3.36Å; L64-D457 PolarHBondContact N-OD1 3.14Å; Q65-D457 VanDerWaalsContact CG-OD2 3.26Å; Q65-D457 WeakPolarHBondContact CG-OD2 3.41Å; Q65-D457 PolarHBondContact N-OD1 2.86Å; Q65-D457 PolarHBondContact NE2-OD1 3.32Å; Q65-D457 PolarHBondContact NE2-OD2 3.28Å; R409-D457 VanDerWaalsContact CD-O 3.29Å; R409-D457 WeakPolarHBondContact CD-O 3.42Å; I410-D457 HydrophobicContact CD1-CB 4.27Å; I410-D457 PolarHBondContact N-O 3.19Å; A453-D457 WeakPolarHBondContact CA-OD2 3.43Å; A453-D457 HydrophobicContact CB-CB 4.18Å; H454-D457 PolarHBondContact O-N 3.27Å; H454-D457 WeakPolarHBondContact O-CB 3.44Å; H454-D457 PolarHBondContact N-OD2 3.19Å
458	I	95.6	Very high	86.9	Confident	6 Å²	6	43 Å²	43	3%	0.031	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-98.1	131.9	178.1	-61.1	168.5	0	0	0	108	C62 L64 L407 Y449 P460	C62-I458 HydrophobicContact CB-CB 3.88Å; C62-I458 HydrophobicContact CB-CG2 4.3Å; C62-I458 WeakPolarHBondContact CB-O 3.08Å; C62-I458 PolarHBondContact O-N 3Å; L64-I458 HydrophobicContact CD1-CD1 4.15Å; L64-I458 HydrophobicContact CD1-CG1 4.15Å; L407-I458 HydrophobicContact CB-CG2 3.4Å; L407-I458 VanDerWaalsContact CB-CG2 3.4Å; L407-I458 HydrophobicContact CD1-CG2 3.71Å; L407-I458 HydrophobicContact CG-CG2 4.24Å; Y449-I458 PolarHBondContact OH-O 3.41Å; I458-P460 VanDerWaalsContact O-CD 3.25Å; I458-P460 WeakPolarHBondContact O-CD 3.03Å
459	V	95	Very high	85.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-71.4	116.7	178.8	-176.9	0	0	0	0	108.9	Y21 P408 I410 I425 M450 A461	Y21-V459 HydrophobicContact CD1-CG1 3.88Å; Y21-V459 HydrophobicContact CE1-CG1 4.02Å; P408-V459 HydrophobicContact CB-CB 4.16Å; P408-V459 HydrophobicContact CB-CG2 4.13Å; P408-V459 PolarHBondContact O-N 3.03Å; I410-V459 HydrophobicContact CD1-CG2 4.37Å; I410-V459 HydrophobicContact CG1-CG2 3.65Å; I425-V459 HydrophobicContact CD1-CG2 4.07Å; I425-V459 HydrophobicContact CG1-CG2 4.37Å; I425-V459 HydrophobicContact CG2-CG2 4.02Å; M450-V459 HydrophobicContact CE-CG2 4.41Å; M450-V459 HydrophobicContact SD-CG1 4.36Å; V459-A461 HydrophobicContact CG1-CB 4Å; V459-A461 PolarHBondContact O-N 3.1Å
460	P	92.5	Very high	84.2	Confident	6 Å²	6	48.4 Å²	48.4	4%	0.039	27%	0.266	C	S	.	.			trans	-85.2	49.9	-176.1	36.4	-37.2	0	0	0	111.6	S24 L27 C62 Y449 I458	S24-P460 VanDerWaalsContact CB-O 3.29Å; S24-P460 WeakPolarHBondContact CB-O 3.28Å; S24-P460 PolarHBondContact N-O 2.98Å; S24-P460 PolarHBondContact OG-O 2.98Å; L27-P460 HydrophobicContact CD1-CG 4.2Å; L27-P460 HydrophobicContact CD2-CB 4.38Å; L27-P460 HydrophobicContact CD2-CG 3.73Å; L27-P460 HydrophobicContact CG-CG 4.44Å; C62-P460 HydrophobicContact CB-CB 4.36Å; Y449-P460 HydrophobicContact CD1-CG 3.72Å; Y449-P460 HydrophobicContact CG-CG 3.76Å; Y449-P460 HydrophobicContact CE2-CG 3.92Å; Y449-P460 HydrophobicContact CD2-CG 3.85Å; Y449-P460 HydrophobicContact CE1-CG 3.82Å; I458-P460 VanDerWaalsContact O-CD 3.25Å; I458-P460 WeakPolarHBondContact O-CD 3.03Å
461	A	91.4	Very high	83.3	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	145.1	-174.9	0	0	0	0	0	111.3	Y21 R22 L446 V459	Y21-A461 HydrophobicContact CD1-CB 4.05Å; Y21-A461 HydrophobicContact CG-CB 4.41Å; R22-A461 CarbonylContact O-C 3.47Å; R22-A461 WeakPolarHBondContact O-CA 3.5Å; R22-A461 WeakPolarHBondContact O-CB 3.48Å; L446-A461 HydrophobicContact CD2-CB 4.37Å; L446-A461 HydrophobicContact CD1-CB 4.15Å; V459-A461 HydrophobicContact CG1-CB 4Å; V459-A461 PolarHBondContact O-N 3.1Å
462	E	87	Confident	82.4	Confident	107 Å²	107	48.7 Å²	48.7	50%	0.5	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	140.5	171.8	-64.4	-176.7	166.5	0	0	110	Y21 R22	Y21-E462 WeakPolarHBondContact CA-O 3.3Å; R22-E462 PolarHBondContact N-O 3.41Å; R22-E462 PolarHBondContact O-N 2.99Å
463	V	88.1	Confident	81.6	Confident	45 Å²	45	47.9 Å²	47.9	27%	0.273	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	118.1	178	-175.5	0	0	0	0	108.5	Y21 P408 M427 T465	Y21-V463 HydrophobicContact CE1-CG2 4.18Å; P408-V463 HydrophobicContact CG-CG2 3.6Å; M427-V463 HydrophobicContact CE-CB 4.15Å; M427-V463 HydrophobicContact CE-CG1 3.56Å; M427-V463 HydrophobicContact CE-CG2 3.49Å; M427-V463 VanDerWaalsContact CE-CG2 3.49Å; V463-T465 PolarHBondContact O-N 3.05Å
464	V	85.4	Confident	80	Confident	31 Å²	31	52.1 Å²	52.1	19%	0.188	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-77.1	120	176.2	-176.2	0	0	0	0	109	R20 R22 T466	R20-V464 PolarHBondContact NH1-O 3.19Å; R20-V464 PolarHBondContact O-N 3.39Å; R22-V464 HydrophobicContact CB-CG2 4.13Å; V464-T466 HydrophobicContact CG1-CG2 4.17Å; V464-T466 PolarHBondContact O-N 3.48Å
465	T	72.8	Confident	77.8	Confident	133 Å²	133	51.4 Å²	51.4	82%	0.816	31%	0.307	S	S	*	.			trans	-85.7	76.3	176	49.8	0	0	0	0	110.6	V463	V463-T465 PolarHBondContact O-N 3.05Å
466	T	62.1	Low	75.1	Confident	65 Å²	65	58 Å²	58	40%	0.399	34%	0.341	S	S	.	.	S	Bend	trans	-110	167	165.8	30.9	0	0	0	0	110.1	V464 D468 H471	V464-T466 HydrophobicContact CG1-CG2 4.17Å; V464-T466 PolarHBondContact O-N 3.48Å; T466-D468 PolarHBondContact O-N 2.91Å; T466-H471 PolarHBondContact OG1-CE1 3.09Å; T466-H471 PolarHBondContact OG1-NE2 2.87Å
467	N	62.8	Low	72.3	Confident	117 Å²	117	65.4 Å²	65.4	63%	0.626	38%	0.38	S	S	*	.			trans	-55.5	129.9	-179	-77.9	-23.1	0	0	0	110	S469 D470	N467-S469 PolarHBondContact O-N 3.28Å; N467-D470 WeakPolarHBondContact O-CB 3.35Å; N467-D470 PolarHBondContact O-N 3.1Å
468	D	59.7	Low	69.5	Low	100 Å²	100	71.9 Å²	71.9	54%	0.535	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-54.1	-28.2	-177.4	-77.7	-19.3	0	0	0	112.6	T466 D470 H471 V472	T466-D468 PolarHBondContact O-N 2.91Å; D468-D470 PolarHBondContact O-N 3.27Å; D468-H471 PolarHBondContact O-N 3.3Å; D468-V472 VanDerWaalsContact O-CG2 3.32Å; D468-V472 WeakPolarHBondContact O-CG2 3.38Å
469	S	60.9	Low	66.7	Low	85 Å²	85	81 Å²	81	59%	0.594	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-57.8	-29.3	176	49.8	0	0	0	0	114	N467 H471	N467-S469 PolarHBondContact O-N 3.28Å; S469-H471 VanDerWaalsContact C-N 3.32Å; S469-H471 PolarHBondContact O-N 3.44Å
470	D	66.9	Low	63.6	Low	96 Å²	96	90.1 Å²	90.1	51%	0.513	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-82.4	-16.7	-170.4	-57.3	-11.5	0	0	0	112	N467 D468	N467-D470 WeakPolarHBondContact O-CB 3.35Å; N467-D470 PolarHBondContact O-N 3.1Å; D468-D470 PolarHBondContact O-N 3.27Å
471	H	74.5	Confident	60.5	Low	9 Å²	9	99.3 Å²	99.3	4%	0.042	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-14.7	-177.9	-51.7	-54.6	0	0	0	113.8	I15 N16 L19 T466 D468 S469 I473	I15-H471 WeakPolarHBondContact CA-O 3.45Å; I15-H471 HydrophobicContact CG2-CB 3.72Å; N16-H471 PolarHBondContact N-O 3.39Å; L19-H471 WeakPolarHBondContact CB-ND1 3.48Å; L19-H471 PolarHBondContact O-CE1 3.44Å; T466-H471 PolarHBondContact OG1-CE1 3.09Å; T466-H471 PolarHBondContact OG1-NE2 2.87Å; D468-H471 PolarHBondContact O-N 3.3Å; S469-H471 VanDerWaalsContact C-N 3.32Å; S469-H471 PolarHBondContact O-N 3.44Å; H471-I473 PolarHBondContact O-N 3.29Å
472	V	74	Confident	57.6	Low	61 Å²	61	108.1 Å²	108.1	37%	0.37	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.6	117.3	-176.9	172.6	0	0	0	0	109.1	D468 A474	D468-V472 VanDerWaalsContact O-CG2 3.32Å; D468-V472 WeakPolarHBondContact O-CG2 3.38Å; V472-A474 PolarHBondContact O-N 3.47Å
473	I	75	Confident	54.8	Low	55 Å²	55	110.7 Å²	110.7	28%	0.282	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73	118.5	163.9	-55.7	176.8	0	0	0	105.3	L14 N16 L436 H471 C475	L14-I473 HydrophobicContact CD2-CD1 4.22Å; L14-I473 HydrophobicContact CG-CD1 4.27Å; L14-I473 PolarHBondContact O-N 2.9Å; N16-I473 HydrophobicContact CB-CD1 4.05Å; N16-I473 HydrophobicContact CB-CG1 3.96Å; L436-I473 HydrophobicContact CB-CD1 4.37Å; L436-I473 HydrophobicContact CD2-CD1 3.9Å; H471-I473 PolarHBondContact O-N 3.29Å; I473-C475 PolarHBondContact O-N 3.47Å
474	A	59.2	Low	52	Low	89 Å²	89	117.9 Å²	117.9	74%	0.736	62%	0.621	S	S	*	*			trans	-51.7	115.2	173	0	0	0	0	0	108.6	V472 L476	V472-A474 PolarHBondContact O-N 3.47Å; A474-L476 PolarHBondContact O-N 2.93Å
475	C	47.9	Very low	49.7	Very low	62 Å²	62	122.2 Å²	122.2	42%	0.419	65%	0.65	S	S	.	*			trans	-58.9	130.9	-169.5	-67	0	0	0	0	111.4	G12 I473 N477	G12-C475 PolarHBondContact O-SG 3.13Å; I473-C475 PolarHBondContact O-N 3.47Å; C475-N477 PolarHBondContact O-N 2.89Å
476	L	37.5	Very low	48	Very low	149 Å²	149	121.5 Å²	121.5	78%	0.78	65%	0.65	S	S	*	*			trans	-66.4	108	162.2	-74	165.3	0	0	0	108.1	A474 E478	A474-L476 PolarHBondContact O-N 2.93Å; L476-E478 VanDerWaalsContact C-N 3.28Å; L476-E478 HydrophobicContact CB-CG 4.42Å; L476-E478 PolarHBondContact O-N 2.92Å
477	N	34	Very low	47	Very low	157 Å²	157	126.7 Å²	126.7	84%	0.84	70%	0.699	S	S	*	*			trans	-66.9	87.3	161.1	-74.2	-16	0	0	0	108.3	C475	C475-N477 PolarHBondContact O-N 2.89Å
478	E	37.1	Very low	46.2	Very low	136 Å²	136	127.2 Å²	127.2	64%	0.636	70%	0.703	S	S	*	*			trans	-120.9	7.7	175.1	-80.3	-146.9	166.4	0	0	115.5	K417 L476	K417-E478 IonicContact NZ-OE2 3.75Å; L476-E478 VanDerWaalsContact C-N 3.28Å; L476-E478 HydrophobicContact CB-CG 4.42Å; L476-E478 PolarHBondContact O-N 2.92Å
479	E	36.3	Very low	45.5	Very low	199 Å²	199	128.6 Å²	128.6	93%	0.93	71%	0.712	S	S	*	*	S	Bend	trans	-98.9	10	172.4	-73.9	-170.7	171.3	0	0	115.1
480	E	29.6	Very low	44.6	Very low	190 Å²	190	131 Å²	131	89%	0.888	72%	0.718	S	S	*	*	S	Bend	trans	-125.9	14	178.1	-82.5	-166.8	165.3	0	0	116.7
481	K	28.9	Very low	43.3	Very low	200 Å²	200	133.1 Å²	133.1	87%	0.87	73%	0.73	S	S	*	*	S	Bend	trans	-105.2	-2.4	174.8	-86.1	-169.8	178	179.7	0	117
482	E	30.6	Very low	41.4	Very low	184 Å²	184	140.8 Å²	140.8	86%	0.86	77%	0.774	S	S	*	*	S	Bend	trans	-102.8	68.8	168.2	-74.4	-174.3	168.3	0	0	110.5
483	N	28.3	Very low	39.2	Very low	161 Å²	161	146.1 Å²	146.1	86%	0.861	80%	0.8	S	S	*	*			trans	-169.5	61.3	154	-94	-25.2	0	0	0	109.4
484	K	27.9	Very low	36.6	Very low	196 Å²	196	152.6 Å²	152.6	85%	0.852	84%	0.837	S	S	*	*			trans	-114.5	116.6	150.8	-83.8	-170.2	176	-175.4	0	107	S486	K484-S486 PolarHBondContact O-N 3.13Å
485	P	38.5	Very low	34.9	Very low	123 Å²	123	157.5 Å²	157.5	80%	0.799	85%	0.845	S	S	*	*			trans	-63.3	131.4	174.1	26.2	-28.5	0	0	0	107.6	A487	P485-A487 PolarHBondContact O-N 3.36Å
486	S	37.3	Very low	33.8	Very low	117 Å²	117	165.5 Å²	165.5	82%	0.818	88%	0.881	S	S	*	*			trans	-53.2	128.7	166.4	48.1	0	0	0	0	108.7	K484	K484-S486 PolarHBondContact O-N 3.13Å
487	A	39.7	Very low	33.5	Very low	174 Å²	174	167 Å²	167	100%	1.438	89%	0.89	S	S	*	*			trans	-53.3	0	179.5	0	0	0	0	0	113.4	P485	P485-A487 PolarHBondContact O-N 3.36Å

Retrieved 487 of 487 residues in 308.3 ms (Link to these results)

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