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E3 ubiquitin-protein ligase TRIM34A

Functions as antiviral protein and contributes to the defense against retroviral infections (By similarity). Acts as a capsid-specific restriction factor with the help of TRIM5 and prevents infection from non-host-adapted retroviruses. During influenza A virus infection, promotes programmed cell death by targeting ZBP1 for 'Lys-63'-linked polyubiquitination. In turn, promotes ZBP1 recruitment of RIPK3 to mediate virus-induced programmed necrosis (By similarity). Negatively regulates the function of mitochondria by enhancing mitochondrial depolarization leading to cytochrome c release and mitochondria-dependent apoptosis. Also promotes the formation of multinucleated giant cells by means of cell fusion and phagocytosis in epithelial cells (By similarity). Plays an essential role in sustaining the integrity of the inner mucus layer in the colon by controlling the exocytosis of the major component of colonic mucus MUC2 from colonic goblet cells¹.

AlphaFold DB (E9PYZ4), UniProt , Accession Q99PP6, Species MOUSE (Mus musculus, Mouse), Gene Trim34a, Length 485 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.6	Very low	51.9	Low	230 Å²	230	103.8 Å²	103.8	100%	1.133	60%	0.595	S	S	*	*				0	-0	0	-71.7	-165.2	161.7	0	0	115
2	A	42.6	Very low	53	Low	84 Å²	84	105.1 Å²	105.1	69%	0.694	59%	0.589	S	S	*	*			trans	-86.7	-20.8	-179.7	0	0	0	0	0	115.4
3	S	45.8	Very low	54.3	Low	97 Å²	97	97.4 Å²	97.4	68%	0.678	55%	0.546	S	S	*	.	H	α-helix	trans	-76.1	-32.4	-176.2	173.7	0	0	0	0	113.7	G5 T7	S3-G5 VanDerWaalsContact C-N 3.29Å; S3-G5 PolarHBondContact O-N 3.09Å; S3-T7 PolarHBondContact O-OG1 3.04Å
4	T	43.9	Very low	56.1	Low	104 Å²	104	93.4 Å²	93.4	64%	0.638	53%	0.525	S	S	*	.	H	α-helix	trans	-72.4	-18.8	175.5	27.6	0	0	0	0	113.7	T7	T4-T7 PolarHBondContact O-OG1 3.24Å
5	G	49.1	Very low	57.7	Low	37 Å²	37	87.1 Å²	87.1	38%	0.381	49%	0.49	S	S	.	.	H	α-helix	trans	-77.9	-36.1	176.2	0	0	0	0	0	113.5	S3 I9	S3-G5 VanDerWaalsContact C-N 3.29Å; S3-G5 PolarHBondContact O-N 3.09Å; G5-I9 WeakPolarHBondContact O-CD1 3.39Å; G5-I9 VanDerWaalsContact O-CG1 3.28Å; G5-I9 WeakPolarHBondContact O-CG1 3.36Å; G5-I9 PolarHBondContact O-N 3.33Å
6	L	52.4	Low	59.1	Low	109 Å²	109	86 Å²	86	57%	0.571	49%	0.487	S	S	*	.	H	α-helix	trans	-73.1	-40.3	-178.3	-92.2	150	0	0	0	112.9	N8 I9 Q10	L6-N8 VanDerWaalsContact C-N 3.34Å; L6-N8 PolarHBondContact O-N 2.66Å; L6-I9 PolarHBondContact O-N 2.87Å; L6-Q10 PolarHBondContact O-N 3.41Å; L6-Q10 VanDerWaalsContact O-N 3.07Å
7	T	53.8	Low	60.4	Low	79 Å²	79	84.7 Å²	84.7	49%	0.485	48%	0.481	S	S	.	.	H	α-helix	trans	-63.1	-40.8	175.8	45.9	0	0	0	0	111.8	S3 T4 I9 Q10 E11	S3-T7 PolarHBondContact O-OG1 3.04Å; T4-T7 PolarHBondContact O-OG1 3.24Å; T7-I9 VanDerWaalsContact C-N 3.3Å; T7-I9 PolarHBondContact O-N 3.21Å; T7-Q10 PolarHBondContact O-N 3.34Å; T7-E11 PolarHBondContact O-N 3.32Å; T7-E11 VanDerWaalsContact O-N 3.11Å
8	N	56.2	Low	61.4	Low	78 Å²	78	82.6 Å²	82.6	42%	0.417	47%	0.472	S	S	.	.	H	α-helix	trans	-69.1	-26	179.6	-152.7	-29.9	0	0	0	113	L6 K12	L6-N8 VanDerWaalsContact C-N 3.34Å; L6-N8 PolarHBondContact O-N 2.66Å; N8-K12 VanDerWaalsContact O-CD 3.31Å; N8-K12 WeakPolarHBondContact O-CD 3.4Å; N8-K12 VanDerWaalsContact O-CG 3.27Å; N8-K12 WeakPolarHBondContact O-CG 3.44Å; N8-K12 WeakPolarHBondContact OD1-CE 3.42Å; N8-K12 PolarHBondContact OD1-NZ 3.39Å
9	I	61.9	Low	62.3	Low	78 Å²	78	86.9 Å²	86.9	40%	0.4	49%	0.488	S	S	.	.	H	α-helix	trans	-80.7	-35.2	173.7	-67.8	166.6	0	0	0	110.9	G5 L6 T7 K12 T13 L80	G5-I9 WeakPolarHBondContact O-CD1 3.39Å; G5-I9 VanDerWaalsContact O-CG1 3.28Å; G5-I9 WeakPolarHBondContact O-CG1 3.36Å; G5-I9 PolarHBondContact O-N 3.33Å; L6-I9 PolarHBondContact O-N 2.87Å; T7-I9 VanDerWaalsContact C-N 3.3Å; T7-I9 PolarHBondContact O-N 3.21Å; I9-K12 PolarHBondContact O-N 3.11Å; I9-T13 HydrophobicContact CG2-CG2 4.39Å; I9-T13 WeakPolarHBondContact O-CB 3.35Å; I9-T13 WeakPolarHBondContact O-CG2 3.37Å; I9-T13 PolarHBondContact O-N 3.36Å; I9-T13 VanDerWaalsContact O-N 3.16Å; I9-T13 PolarHBondContact O-OG1 3.47Å; I9-L80 HydrophobicContact CG2-CD1 3.64Å; I9-L80 HydrophobicContact CG2-CD2 4.39Å
10	Q	61.7	Low	63.2	Low	90 Å²	90	89.1 Å²	89.1	42%	0.421	49%	0.494	S	S	.	.	H	α-helix	trans	-69.2	-41.9	180	-163.9	166.9	-16.6	0	0	111.9	L6 T7 K12 T13 T14 K84	L6-Q10 PolarHBondContact O-N 3.41Å; L6-Q10 VanDerWaalsContact O-N 3.07Å; T7-Q10 PolarHBondContact O-N 3.34Å; Q10-K12 VanDerWaalsContact C-N 3.25Å; Q10-K12 PolarHBondContact O-N 3.03Å; Q10-T13 PolarHBondContact O-N 3.31Å; Q10-T13 PolarHBondContact O-OG1 3.27Å; Q10-T14 WeakPolarHBondContact O-CB 3.15Å; Q10-T14 PolarHBondContact O-N 3.44Å; Q10-T14 VanDerWaalsContact O-N 3.11Å; Q10-T14 PolarHBondContact O-OG1 3.11Å; Q10-K84 VanDerWaalsContact NE2-NZ 3.16Å
11	E	61.6	Low	64	Low	156 Å²	156	87 Å²	87	73%	0.729	48%	0.482	S	S	*	.	H	α-helix	trans	-60.4	-34	172	-73.3	179.3	171.8	0	0	112.9	T7 T13	T7-E11 PolarHBondContact O-N 3.32Å; T7-E11 VanDerWaalsContact O-N 3.11Å; E11-T13 VanDerWaalsContact C-N 3.34Å
12	K	65.6	Low	65.6	Low	119 Å²	119	76.2 Å²	76.2	52%	0.517	43%	0.429	S	S	.	.	H	α-helix	trans	-82	-11.6	-179	-70.4	175.5	-175.5	165.9	0	114.1	N8 I9 Q10	N8-K12 VanDerWaalsContact O-CD 3.31Å; N8-K12 WeakPolarHBondContact O-CD 3.4Å; N8-K12 VanDerWaalsContact O-CG 3.27Å; N8-K12 WeakPolarHBondContact O-CG 3.44Å; N8-K12 WeakPolarHBondContact OD1-CE 3.42Å; N8-K12 PolarHBondContact OD1-NZ 3.39Å; I9-K12 PolarHBondContact O-N 3.11Å; Q10-K12 VanDerWaalsContact C-N 3.25Å; Q10-K12 PolarHBondContact O-N 3.03Å
13	T	70	Confident	67	Low	5 Å²	5	76.5 Å²	76.5	3%	0.031	42%	0.422	C	S	.	.	H	α-helix	trans	-116.6	-3	-175.9	52.6	0	0	0	0	113.6	I9 Q10 E11 L22 V76 V77 L80	I9-T13 HydrophobicContact CG2-CG2 4.39Å; I9-T13 WeakPolarHBondContact O-CB 3.35Å; I9-T13 WeakPolarHBondContact O-CG2 3.37Å; I9-T13 PolarHBondContact O-N 3.36Å; I9-T13 VanDerWaalsContact O-N 3.16Å; I9-T13 PolarHBondContact O-OG1 3.47Å; Q10-T13 PolarHBondContact O-N 3.31Å; Q10-T13 PolarHBondContact O-OG1 3.27Å; E11-T13 VanDerWaalsContact C-N 3.34Å; T13-L22 WeakPolarHBondContact O-CB 3.46Å; T13-L22 WeakPolarHBondContact O-CG 3.4Å; T13-L22 PolarHBondContact O-N 3.38Å; T13-V76 HydrophobicContact CG2-CG1 4.08Å; T13-V77 HydrophobicContact CG2-CG2 4.09Å; T13-L80 HydrophobicContact CG2-CD1 3.83Å
14	T	78.8	Confident	68.1	Low	41 Å²	41	79.1 Å²	79.1	25%	0.252	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-92.9	138.7	174	-65.1	0	0	0	0	111.5	Q10 Q19 E20	Q10-T14 WeakPolarHBondContact O-CB 3.15Å; Q10-T14 PolarHBondContact O-N 3.44Å; Q10-T14 VanDerWaalsContact O-N 3.11Å; Q10-T14 PolarHBondContact O-OG1 3.11Å; T14-Q19 VanDerWaalsContact CG2-C 3.46Å; T14-Q19 VanDerWaalsContact CG2-O 3.31Å; T14-Q19 WeakPolarHBondContact CG2-O 3.37Å; T14-E20 CarbonylContact C-O 3.57Å; T14-E20 WeakPolarHBondContact CA-O 3Å
15	C	80.8	Confident	69.7	Low	0 Å²	0	74.2 Å²	74.2	0%	0	39%	0.391	C	S	.	.			trans	-75.2	125.1	175	-177.4	0	0	0	0	109.8	V17 C18 Q19 E20 L22 C35	C15-V17 PolarHBondContact O-N 3.38Å; C15-V17 VanDerWaalsContact O-N 3.14Å; C15-C18 WeakPolarHBondContact CB-SG 3.5Å; C15-C18 VanDerWaalsContact SG-SG 3.65Å; C15-Q19 WeakPolarHBondContact O-CA 3.36Å; C15-Q19 PolarHBondContact O-N 2.71Å; C15-E20 WeakPolarHBondContact CB-O 3.42Å; C15-E20 PolarHBondContact N-O 3.36Å; C15-L22 HydrophobicContact CB-CD2 3.63Å; C15-L22 HydrophobicContact CB-CG 4.14Å; C15-C35 VanDerWaalsContact CB-SG 3.59Å; C15-C35 VanDerWaalsContact SG-SG 3.69Å
16	P	79.7	Confident	71	Confident	69 Å²	69	73.1 Å²	73.1	45%	0.448	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-11.3	179.7	28.2	-34.5	0	0	0	113.5	R33 V34 V57	P16-R33 WeakPolarHBondContact CD-O 3.22Å; P16-V34 HydrophobicContact CG-CG1 4.07Å; P16-V57 HydrophobicContact CB-CG2 4.15Å; P16-V57 HydrophobicContact CG-CG2 3.56Å
17	V	80.6	Confident	72.2	Confident	64 Å²	64	69.9 Å²	69.9	39%	0.388	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-50.4	-178.5	-176.3	0	0	0	0	111.9	C15 V34 C38 P56	C15-V17 PolarHBondContact O-N 3.38Å; C15-V17 VanDerWaalsContact O-N 3.14Å; V17-V34 HydrophobicContact CG2-CG1 3.93Å; V17-C38 HydrophobicContact CB-CB 4.05Å; V17-C38 HydrophobicContact CG1-CB 3.96Å; V17-P56 HydrophobicContact CG2-CB 3.94Å; V17-P56 HydrophobicContact CG2-CG 3.85Å
18	C	80	Confident	73.3	Confident	47 Å²	47	66.4 Å²	66.4	32%	0.318	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-7.1	179.2	62.4	0	0	0	0	113.9	C15 E20 C38	C15-C18 WeakPolarHBondContact CB-SG 3.5Å; C15-C18 VanDerWaalsContact SG-SG 3.65Å; C18-E20 PolarHBondContact O-N 3.05Å; C18-E20 VanDerWaalsContact O-N 3.09Å; C18-C38 VanDerWaalsContact SG-SG 3.68Å
19	Q	78.4	Confident	73.9	Confident	165 Å²	165	66.6 Å²	66.6	77%	0.771	36%	0.362	S	S	*	.	S	Bend	trans	59.9	13.2	-176.5	-55.8	-175.8	-6.4	0	0	115	T14 C15	T14-Q19 VanDerWaalsContact CG2-C 3.46Å; T14-Q19 VanDerWaalsContact CG2-O 3.31Å; T14-Q19 WeakPolarHBondContact CG2-O 3.37Å; C15-Q19 WeakPolarHBondContact O-CA 3.36Å; C15-Q19 PolarHBondContact O-N 2.71Å
20	E	79.4	Confident	74.6	Confident	130 Å²	130	65 Å²	65	61%	0.607	36%	0.357	S	S	*	.	S	Bend	trans	-99.3	169	174	-62.5	-179.5	170.6	0	0	111.9	T14 C15 C18 L22	T14-E20 CarbonylContact C-O 3.57Å; T14-E20 WeakPolarHBondContact CA-O 3Å; C15-E20 WeakPolarHBondContact CB-O 3.42Å; C15-E20 PolarHBondContact N-O 3.36Å; C18-E20 PolarHBondContact O-N 3.05Å; C18-E20 VanDerWaalsContact O-N 3.09Å; E20-L22 PolarHBondContact O-N 3.45Å
21	L	79.1	Confident	75.1	Confident	46 Å²	46	63.2 Å²	63.2	24%	0.241	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-58.7	136.2	173.4	-74.4	173	0	0	0	111.2	T23 V77	L21-T23 PolarHBondContact O-N 3.19Å; L21-V77 HydrophobicContact CB-CG1 3.94Å
22	L	76.3	Confident	76	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.016	34%	0.341	C	S	.	.			trans	-63.5	101.9	-174.6	-79.9	164.4	0	0	0	112.3	T13 C15 E20 A25 R33 V34 L73 V77	T13-L22 WeakPolarHBondContact O-CB 3.46Å; T13-L22 WeakPolarHBondContact O-CG 3.4Å; T13-L22 PolarHBondContact O-N 3.38Å; C15-L22 HydrophobicContact CB-CD2 3.63Å; C15-L22 HydrophobicContact CB-CG 4.14Å; E20-L22 PolarHBondContact O-N 3.45Å; L22-A25 HydrophobicContact CB-CB 3.89Å; L22-A25 HydrophobicContact CD1-CB 4.36Å; L22-A25 HydrophobicContact CD2-CB 4.29Å; L22-A25 HydrophobicContact CG-CB 4.42Å; L22-R33 HydrophobicContact CD1-CB 3.88Å; L22-V34 VanDerWaalsContact CD2-C 3.5Å; L22-L73 HydrophobicContact CB-CD2 4.2Å; L22-L73 HydrophobicContact CD1-CD2 3.43Å; L22-L73 VanDerWaalsContact CD1-CD2 3.43Å; L22-L73 HydrophobicContact CG-CD2 4.45Å; L22-V77 HydrophobicContact CB-CG2 4.27Å
23	T	71.1	Confident	76.7	Confident	89 Å²	89	57.9 Å²	57.9	55%	0.546	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	124	172.3	35.4	0	0	0	0	110.6	L21 A25 C35	L21-T23 PolarHBondContact O-N 3.19Å; T23-A25 PolarHBondContact O-N 3.44Å; T23-C35 PolarHBondContact N-SG 3.37Å
24	K	70.3	Confident	77.2	Confident	152 Å²	152	57.7 Å²	57.7	66%	0.661	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	58.7	-173.2	-64.3	-179.7	179.8	177.4	0	111.4	L26 Q36	K24-L26 PolarHBondContact O-N 3.3Å; K24-Q36 HydrophobicContact CB-CB 4.25Å; K24-Q36 PolarHBondContact O-N 3.2Å
25	A	76.4	Confident	77.4	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.008	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	124.6	-176	0	0	0	0	0	112	L22 T23 N70 L73	L22-A25 HydrophobicContact CB-CB 3.89Å; L22-A25 HydrophobicContact CD1-CB 4.36Å; L22-A25 HydrophobicContact CD2-CB 4.29Å; L22-A25 HydrophobicContact CG-CB 4.42Å; T23-A25 PolarHBondContact O-N 3.44Å; A25-N70 PolarHBondContact O-N 3.02Å; A25-L73 HydrophobicContact CB-CB 4.45Å; A25-L73 HydrophobicContact CB-CD2 3.84Å
26	L	77.1	Confident	77.4	Confident	15 Å²	15	59.7 Å²	59.7	8%	0.079	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.1	170.9	-62.5	177.5	0	0	0	109.3	K24 R33 V34 Q36 L39 L67 A69	K24-L26 PolarHBondContact O-N 3.3Å; L26-R33 WeakPolarHBondContact O-CA 3.39Å; L26-V34 PolarHBondContact N-O 2.94Å; L26-V34 PolarHBondContact O-N 3.44Å; L26-Q36 HydrophobicContact CD1-CB 3.9Å; L26-Q36 HydrophobicContact CD1-CG 4.02Å; L26-Q36 HydrophobicContact CG-CB 4.16Å; L26-L39 HydrophobicContact CD1-CD2 3.87Å; L26-L67 HydrophobicContact CD1-CD1 4.13Å; L26-A69 HydrophobicContact CD2-CB 4.38Å
27	S	78.4	Confident	77.3	Confident	41 Å²	41	59.4 Å²	59.4	29%	0.287	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.1	170.8	-53.4	0	0	0	0	108.5
28	L	75.4	Confident	77.2	Confident	6 Å²	6	57.4 Å²	57.4	3%	0.031	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-81.8	154.2	174.6	-58.6	177.2	0	0	0	109.8	C30 G31 H32 V34 L39 C55 F62 L67	L28-C30 PolarHBondContact O-N 3.16Å; L28-G31 PolarHBondContact O-N 3.16Å; L28-H32 PolarHBondContact N-O 2.73Å; L28-V34 HydrophobicContact CD1-CG2 4.16Å; L28-V34 HydrophobicContact CG-CG2 4.46Å; L28-L39 HydrophobicContact CD1-CD1 4.47Å; L28-L39 HydrophobicContact CD2-CD1 4.47Å; L28-L39 HydrophobicContact CD2-CD2 4.14Å; L28-C55 HydrophobicContact CD1-CB 3.95Å; L28-C55 VanDerWaalsContact CD1-SG 3.56Å; L28-F62 HydrophobicContact CD1-CE1 4.2Å; L28-F62 HydrophobicContact CD2-CD1 4.16Å; L28-F62 HydrophobicContact CD2-CD2 4.2Å; L28-F62 HydrophobicContact CD2-CE1 3.85Å; L28-F62 HydrophobicContact CD2-CE2 3.94Å; L28-F62 HydrophobicContact CD2-CG 4.34Å; L28-F62 HydrophobicContact CD2-CZ 3.77Å; L28-L67 HydrophobicContact CD2-CD1 4.24Å; L28-L67 HydrophobicContact CD2-CD2 3.7Å
29	G	68.8	Low	77.1	Confident	82 Å²	82	56 Å²	56	85%	0.845	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-17.9	-179.8	0	0	0	0	0	114.8	G31	G29-G31 VanDerWaalsContact C-N 3.32Å
30	C	77.1	Confident	76.8	Confident	45 Å²	45	51.9 Å²	51.9	30%	0.304	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	3.9	173.5	66.9	0	0	0	0	114.1	L28 H32 C58 T60	L28-C30 PolarHBondContact O-N 3.16Å; C30-H32 PolarHBondContact O-N 3.42Å; C30-H32 PolarHBondContact SG-ND1 3.32Å; C30-C58 VanDerWaalsContact SG-SG 3.67Å; C30-T60 HydrophobicContact CB-CG2 4.21Å
31	G	72.1	Confident	76.4	Confident	51 Å²	51	50.4 Å²	50.4	53%	0.526	30%	0.304	S	S	.	.	S	Bend	trans	87.2	-10	178.5	0	0	0	0	0	116	L28 G29	L28-G31 PolarHBondContact O-N 3.16Å; G29-G31 VanDerWaalsContact C-N 3.32Å
32	H	79.8	Confident	75.8	Confident	63 Å²	63	53 Å²	53	29%	0.292	31%	0.313	S	S	.	.			trans	-73.7	140.2	175.9	-70.2	116.1	0	0	0	111.8	L28 C30 V57 C58	L28-H32 PolarHBondContact N-O 2.73Å; C30-H32 PolarHBondContact O-N 3.42Å; C30-H32 PolarHBondContact SG-ND1 3.32Å; H32-V57 HydrophobicContact CB-CG2 4.35Å; H32-C58 PolarHBondContact ND1-SG 2.92Å
33	R	81.3	Confident	75.3	Confident	101 Å²	101	58.3 Å²	58.3	38%	0.381	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.6	177.9	-58.6	-178.7	-172.5	89.8	5	109.7	P16 L22 L26	P16-R33 WeakPolarHBondContact CD-O 3.22Å; L22-R33 HydrophobicContact CD1-CB 3.88Å; L26-R33 WeakPolarHBondContact O-CA 3.39Å
34	V	81	Confident	74.5	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	156.1	-178.5	-64.1	0	0	0	0	110.8	P16 V17 L22 L26 L28 L39 P56 V57	P16-V34 HydrophobicContact CG-CG1 4.07Å; V17-V34 HydrophobicContact CG2-CG1 3.93Å; L22-V34 VanDerWaalsContact CD2-C 3.5Å; L26-V34 PolarHBondContact N-O 2.94Å; L26-V34 PolarHBondContact O-N 3.44Å; L28-V34 HydrophobicContact CD1-CG2 4.16Å; L28-V34 HydrophobicContact CG-CG2 4.46Å; V34-L39 HydrophobicContact CG2-CB 4.36Å; V34-L39 HydrophobicContact CG2-CD1 4.2Å; V34-P56 HydrophobicContact CG1-CG 3.9Å; V34-P56 HydrophobicContact CG2-CG 4.39Å; V34-V57 HydrophobicContact CG1-CG2 4.21Å
35	C	83	Confident	73.8	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.014	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	140.4	173	-56.3	0	0	0	0	110.1	C15 T23 A37 C38 L39	C15-C35 VanDerWaalsContact CB-SG 3.59Å; C15-C35 VanDerWaalsContact SG-SG 3.69Å; T23-C35 PolarHBondContact N-SG 3.37Å; C35-A37 PolarHBondContact O-N 2.89Å; C35-C38 HydrophobicContact CB-CB 4.23Å; C35-C38 PolarHBondContact O-N 3.4Å; C35-C38 VanDerWaalsContact O-N 3.09Å; C35-L39 PolarHBondContact O-N 3.45Å; C35-L39 VanDerWaalsContact O-N 3.15Å
36	Q	79.8	Confident	72.7	Confident	82 Å²	82	60.6 Å²	60.6	38%	0.383	37%	0.366	S	S	.	.	H	α-helix	trans	-53.7	-41.2	175.4	179.1	175	6	0	0	112	K24 L26 L39 I40	K24-Q36 HydrophobicContact CB-CB 4.25Å; K24-Q36 PolarHBondContact O-N 3.2Å; L26-Q36 HydrophobicContact CD1-CB 3.9Å; L26-Q36 HydrophobicContact CD1-CG 4.02Å; L26-Q36 HydrophobicContact CG-CB 4.16Å; Q36-L39 PolarHBondContact O-N 2.8Å; Q36-I40 HydrophobicContact CG-CD1 3.88Å; Q36-I40 WeakPolarHBondContact O-CG1 3.45Å; Q36-I40 PolarHBondContact O-N 3.21Å; Q36-I40 VanDerWaalsContact O-N 3.11Å
37	A	78.7	Confident	71.3	Confident	62 Å²	62	67.8 Å²	67.8	51%	0.512	40%	0.403	S	S	.	.	H	α-helix	trans	-61.5	-46.3	176.9	0	0	0	0	0	112.2	C35 L39 I40 T41	C35-A37 PolarHBondContact O-N 2.89Å; A37-L39 PolarHBondContact O-N 3.45Å; A37-I40 PolarHBondContact O-N 3.09Å; A37-I40 VanDerWaalsContact O-N 3.15Å; A37-T41 PolarHBondContact O-N 3.01Å; A37-T41 PolarHBondContact O-OG1 2.95Å
38	C	78.7	Confident	69.9	Low	23 Å²	23	71.2 Å²	71.2	16%	0.155	42%	0.418	C	S	.	.	H	α-helix	trans	-61.9	-32.8	179	-62.8	0	0	0	0	112.8	V17 C18 C35 K42	V17-C38 HydrophobicContact CB-CB 4.05Å; V17-C38 HydrophobicContact CG1-CB 3.96Å; C18-C38 VanDerWaalsContact SG-SG 3.68Å; C35-C38 HydrophobicContact CB-CB 4.23Å; C35-C38 PolarHBondContact O-N 3.4Å; C35-C38 VanDerWaalsContact O-N 3.09Å; C38-K42 PolarHBondContact O-N 3.4Å
39	L	76.8	Confident	68.7	Low	16 Å²	16	76.9 Å²	76.9	8%	0.084	46%	0.455	C	S	.	.	H	α-helix	trans	-71.1	-41.6	175.6	-164.5	68.5	0	0	0	111.9	L26 L28 V34 C35 Q36 A37 K43 P56 F62 L67	L26-L39 HydrophobicContact CD1-CD2 3.87Å; L28-L39 HydrophobicContact CD1-CD1 4.47Å; L28-L39 HydrophobicContact CD2-CD1 4.47Å; L28-L39 HydrophobicContact CD2-CD2 4.14Å; V34-L39 HydrophobicContact CG2-CB 4.36Å; V34-L39 HydrophobicContact CG2-CD1 4.2Å; C35-L39 PolarHBondContact O-N 3.45Å; C35-L39 VanDerWaalsContact O-N 3.15Å; Q36-L39 PolarHBondContact O-N 2.8Å; A37-L39 PolarHBondContact O-N 3.45Å; L39-K43 PolarHBondContact O-N 2.74Å; L39-K43 VanDerWaalsContact O-N 3.13Å; L39-P56 HydrophobicContact CD1-CG 4.22Å; L39-F62 HydrophobicContact CD1-CE1 4.32Å; L39-F62 HydrophobicContact CD1-CZ 3.87Å; L39-F62 HydrophobicContact CD2-CE2 4.33Å; L39-F62 HydrophobicContact CD2-CZ 3.98Å; L39-F62 HydrophobicContact CG-CZ 4.32Å; L39-L67 HydrophobicContact CD2-CD1 3.79Å
40	I	72.9	Confident	67.9	Low	80 Å²	80	84.5 Å²	84.5	41%	0.41	46%	0.458	S	S	.	.	H	α-helix	trans	-67.7	-43.6	179	-66.6	166.4	0	0	0	110.9	Q36 A37 K42 K43 N44	Q36-I40 HydrophobicContact CG-CD1 3.88Å; Q36-I40 WeakPolarHBondContact O-CG1 3.45Å; Q36-I40 PolarHBondContact O-N 3.21Å; Q36-I40 VanDerWaalsContact O-N 3.11Å; A37-I40 PolarHBondContact O-N 3.09Å; A37-I40 VanDerWaalsContact O-N 3.15Å; I40-K42 VanDerWaalsContact C-N 3.34Å; I40-K42 PolarHBondContact O-N 2.76Å; I40-K43 WeakPolarHBondContact O-CB 3.32Å; I40-K43 PolarHBondContact O-N 3.26Å; I40-K43 VanDerWaalsContact O-N 3.15Å; I40-N44 PolarHBondContact O-N 3.33Å
41	T	70.6	Confident	66.9	Low	99 Å²	99	88.2 Å²	88.2	61%	0.607	47%	0.471	S	S	*	.	H	α-helix	trans	-61.1	-41.8	178.9	-54.1	0	0	0	0	111.7	A37 N44 A45	A37-T41 PolarHBondContact O-N 3.01Å; A37-T41 PolarHBondContact O-OG1 2.95Å; T41-N44 PolarHBondContact O-N 2.92Å; T41-A45 PolarHBondContact O-N 3.19Å
42	K	67.1	Low	66.3	Low	101 Å²	101	93 Å²	93	44%	0.439	48%	0.477	S	S	.	.	H	α-helix	trans	-69.1	-32.5	176.2	-160.5	177.8	-171.5	176	0	112.5	C38 I40 A45 P56	C38-K42 PolarHBondContact O-N 3.4Å; I40-K42 VanDerWaalsContact C-N 3.34Å; I40-K42 PolarHBondContact O-N 2.76Å; K42-A45 PolarHBondContact O-N 2.87Å; K42-P56 HydrophobicContact CD-CB 3.47Å; K42-P56 VanDerWaalsContact CD-CB 3.47Å; K42-P56 VanDerWaalsContact NZ-CA 3.3Å; K42-P56 PolarHBondContact NZ-O 3.07Å
43	K	64.4	Low	65.9	Low	114 Å²	114	91.2 Å²	91.2	50%	0.496	47%	0.472	S	S	.	.	H	α-helix	trans	-64.4	-44.5	174.5	-175.6	-175.7	176.4	-176.4	0	111.7	L39 I40 A45 V46	L39-K43 PolarHBondContact O-N 2.74Å; L39-K43 VanDerWaalsContact O-N 3.13Å; I40-K43 WeakPolarHBondContact O-CB 3.32Å; I40-K43 PolarHBondContact O-N 3.26Å; I40-K43 VanDerWaalsContact O-N 3.15Å; K43-A45 PolarHBondContact O-N 3.26Å; K43-V46 PolarHBondContact O-N 2.99Å; K43-V46 VanDerWaalsContact O-N 3.07Å
44	N	55.9	Low	65.7	Low	124 Å²	124	89.3 Å²	89.3	66%	0.663	48%	0.475	S	S	*	.	H	α-helix	trans	-67.9	-18	-179.4	-68.4	-13	0	0	0	113.2	I40 T41 V46	I40-N44 PolarHBondContact O-N 3.33Å; T41-N44 PolarHBondContact O-N 2.92Å; N44-V46 VanDerWaalsContact C-N 3.32Å
45	A	53.7	Low	65.5	Low	79 Å²	79	89.4 Å²	89.4	65%	0.653	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-11.5	173.2	0	0	0	0	0	113.6	T41 K42 K43	T41-A45 PolarHBondContact O-N 3.19Å; K42-A45 PolarHBondContact O-N 2.87Å; K43-A45 PolarHBondContact O-N 3.26Å
46	V	53.7	Low	65.1	Low	86 Å²	86	90.2 Å²	90.2	52%	0.521	48%	0.48	S	S	.	.	S	Bend	trans	-107.6	107.1	177.7	-175	0	0	0	0	108.7	K43 N44 N48	K43-V46 PolarHBondContact O-N 2.99Å; K43-V46 VanDerWaalsContact O-N 3.07Å; N44-V46 VanDerWaalsContact C-N 3.32Å; V46-N48 PolarHBondContact O-N 2.61Å
47	I	47.3	Very low	65.1	Low	166 Å²	166	89.5 Å²	89.5	85%	0.851	48%	0.481	S	S	*	.			trans	-69.7	3.9	-164.8	-63.4	169.9	0	0	0	114.1
48	N	50.8	Low	65.1	Low	113 Å²	113	89.5 Å²	89.5	60%	0.604	48%	0.477	S	S	*	.			trans	-113.3	111.2	-172.7	-122.7	-24.6	0	0	0	113.7	V46 R50	V46-N48 PolarHBondContact O-N 2.61Å; N48-R50 VanDerWaalsContact C-N 3.26Å; N48-R50 PolarHBondContact O-N 3.24Å
49	P	50.3	Low	64.8	Low	126 Å²	126	90.5 Å²	90.5	82%	0.818	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	2.9	-172.9	29	-34.8	0	0	0	115.6
50	R	50.1	Low	64.9	Low	242 Å²	242	93.3 Å²	93.3	91%	0.913	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	1.3	-178.5	-68.9	-171.5	-173.2	-162.2	2.4	115.2	N48	N48-R50 VanDerWaalsContact C-N 3.26Å; N48-R50 PolarHBondContact O-N 3.24Å
51	E	56.5	Low	65.1	Low	123 Å²	123	98.2 Å²	98.2	58%	0.575	52%	0.523	S	S	*	.	S	Bend	trans	-93.1	137.8	179.1	-98.2	-174	144.6	0	0	113.4	S53	E51-S53 PolarHBondContact O-N 3.23Å
52	K	60.1	Low	65	Low	150 Å²	150	94.6 Å²	94.6	65%	0.652	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-59.6	130.4	171.2	-65.8	-179.5	179.7	-179.9	0	109.2
53	S	70.6	Confident	65	Low	27 Å²	27	92.9 Å²	92.9	19%	0.189	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	143.4	-177.1	-59.3	0	0	0	0	111.9	E51 R61 F62 L64	E51-S53 PolarHBondContact O-N 3.23Å; S53-R61 CarbonylContact O-C 3.51Å; S53-R61 WeakPolarHBondContact O-CA 3.3Å; S53-F62 WeakPolarHBondContact O-CD1 3.38Å; S53-F62 PolarHBondContact O-N 3.5Å; S53-L64 WeakPolarHBondContact OG-CD1 3.26Å
54	S	76.9	Confident	65	Low	61 Å²	61	91.5 Å²	91.5	43%	0.427	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	144.8	-179.8	57.6	0	0	0	0	111.9	G59 T60 F62	S54-G59 WeakPolarHBondContact CB-O 3.29Å; S54-T60 CarbonylContact C-O 3.57Å; S54-T60 WeakPolarHBondContact CA-O 3.29Å; S54-F62 VanDerWaalsContact C-CE1 3.47Å
55	C	77.6	Confident	65.1	Low	1 Å²	1	94.4 Å²	94.4	1%	0.007	51%	0.506	C	S	.	.			trans	-59.3	129.5	177.6	177.1	0	0	0	0	109.8	L28 V57 G59 T60	L28-C55 HydrophobicContact CD1-CB 3.95Å; L28-C55 VanDerWaalsContact CD1-SG 3.56Å; C55-V57 PolarHBondContact O-N 2.91Å; C55-V57 VanDerWaalsContact O-N 3.14Å; C55-V57 PolarHBondContact SG-N 3.31Å; C55-G59 VanDerWaalsContact O-CA 3.3Å; C55-G59 WeakPolarHBondContact O-CA 3.44Å; C55-G59 PolarHBondContact O-N 3.16Å; C55-T60 PolarHBondContact N-O 2.87Å
56	P	75.4	Confident	65.2	Low	19 Å²	19	97.2 Å²	97.2	12%	0.123	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-17.3	-177.4	27.7	-36.2	0	0	0	113.5	V17 V34 L39 K42	V17-P56 HydrophobicContact CG2-CB 3.94Å; V17-P56 HydrophobicContact CG2-CG 3.85Å; V34-P56 HydrophobicContact CG1-CG 3.9Å; V34-P56 HydrophobicContact CG2-CG 4.39Å; L39-P56 HydrophobicContact CD1-CG 4.22Å; K42-P56 HydrophobicContact CD-CB 3.47Å; K42-P56 VanDerWaalsContact CD-CB 3.47Å; K42-P56 VanDerWaalsContact NZ-CA 3.3Å; K42-P56 PolarHBondContact NZ-O 3.07Å
57	V	79.3	Confident	65.8	Low	67 Å²	67	95.1 Å²	95.1	41%	0.406	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-45.7	-176.9	-172.9	0	0	0	0	111.8	P16 H32 V34 C55	P16-V57 HydrophobicContact CB-CG2 4.15Å; P16-V57 HydrophobicContact CG-CG2 3.56Å; H32-V57 HydrophobicContact CB-CG2 4.35Å; V34-V57 HydrophobicContact CG1-CG2 4.21Å; C55-V57 PolarHBondContact O-N 2.91Å; C55-V57 VanDerWaalsContact O-N 3.14Å; C55-V57 PolarHBondContact SG-N 3.31Å
58	C	79.3	Confident	66.5	Low	62 Å²	62	95 Å²	95	42%	0.419	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	-0.8	-172.9	65.8	0	0	0	0	115.2	C30 H32 T60	C30-C58 VanDerWaalsContact SG-SG 3.67Å; H32-C58 PolarHBondContact ND1-SG 2.92Å; C58-T60 PolarHBondContact O-N 3.43Å; C58-T60 PolarHBondContact SG-OG1 3.26Å
59	G	72.4	Confident	67.2	Low	45 Å²	45	92.3 Å²	92.3	46%	0.464	49%	0.485	S	S	.	.			trans	76.6	-3.4	176.6	0	0	0	0	0	116	S54 C55 R61	S54-G59 WeakPolarHBondContact CB-O 3.29Å; C55-G59 VanDerWaalsContact O-CA 3.3Å; C55-G59 WeakPolarHBondContact O-CA 3.44Å; C55-G59 PolarHBondContact O-N 3.16Å; G59-R61 PolarHBondContact O-N 3.27Å
60	T	77.9	Confident	68	Low	74 Å²	74	88.3 Å²	88.3	45%	0.454	46%	0.457	S	S	.	.			trans	-59.9	130.4	179.1	-48.5	0	0	0	0	111.5	C30 S54 C55 C58	C30-T60 HydrophobicContact CB-CG2 4.21Å; S54-T60 CarbonylContact C-O 3.57Å; S54-T60 WeakPolarHBondContact CA-O 3.29Å; C55-T60 PolarHBondContact N-O 2.87Å; C58-T60 PolarHBondContact O-N 3.43Å; C58-T60 PolarHBondContact SG-OG1 3.26Å
61	R	76.6	Confident	68.8	Low	184 Å²	184	84.7 Å²	84.7	69%	0.694	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	136.7	-179.7	-67	178	173.4	168.6	-4.8	111.2	S53 G59	S53-R61 CarbonylContact O-C 3.51Å; S53-R61 WeakPolarHBondContact O-CA 3.3Å; G59-R61 PolarHBondContact O-N 3.27Å
62	F	69.8	Low	69.2	Low	22 Å²	22	86.3 Å²	86.3	10%	0.096	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	158	177	68	-91.7	0	0	0	111.4	L28 L39 S53 S54 L64 L67	L28-F62 HydrophobicContact CD1-CE1 4.2Å; L28-F62 HydrophobicContact CD2-CD1 4.16Å; L28-F62 HydrophobicContact CD2-CD2 4.2Å; L28-F62 HydrophobicContact CD2-CE1 3.85Å; L28-F62 HydrophobicContact CD2-CE2 3.94Å; L28-F62 HydrophobicContact CD2-CG 4.34Å; L28-F62 HydrophobicContact CD2-CZ 3.77Å; L39-F62 HydrophobicContact CD1-CE1 4.32Å; L39-F62 HydrophobicContact CD1-CZ 3.87Å; L39-F62 HydrophobicContact CD2-CE2 4.33Å; L39-F62 HydrophobicContact CD2-CZ 3.98Å; L39-F62 HydrophobicContact CG-CZ 4.32Å; S53-F62 WeakPolarHBondContact O-CD1 3.38Å; S53-F62 PolarHBondContact O-N 3.5Å; S54-F62 VanDerWaalsContact C-CE1 3.47Å; F62-L64 HydrophobicContact CE2-CD1 3.92Å; F62-L64 HydrophobicContact CZ-CD1 4.49Å; F62-L67 HydrophobicContact CD2-CD1 4.33Å; F62-L67 HydrophobicContact CD2-CD2 4.19Å; F62-L67 HydrophobicContact CD2-CG 4.48Å; F62-L67 HydrophobicContact CE2-CD1 3.78Å; F62-L67 HydrophobicContact CE2-CD2 4.38Å; F62-L67 HydrophobicContact CE2-CG 4.4Å
63	S	66.5	Low	69.5	Low	65 Å²	65	80.4 Å²	80.4	46%	0.455	43%	0.43	S	S	.	.			trans	-93.6	133.2	173.9	-62.8	0	0	0	0	110.6	E65	S63-E65 VanDerWaalsContact C-N 3.28Å; S63-E65 PolarHBondContact O-N 3.12Å
64	L	64	Low	69.2	Low	86 Å²	86	80.9 Å²	80.9	45%	0.45	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-69.9	-25.5	-177	-129.8	99.8	0	0	0	113.1	S53 F62 N66 L67	S53-L64 WeakPolarHBondContact OG-CD1 3.26Å; F62-L64 HydrophobicContact CE2-CD1 3.92Å; F62-L64 HydrophobicContact CZ-CD1 4.49Å; L64-N66 PolarHBondContact O-N 3.15Å; L64-N66 VanDerWaalsContact O-N 3.13Å; L64-L67 HydrophobicContact CG-CD1 4.17Å; L64-L67 PolarHBondContact O-N 3.45Å
65	E	57.8	Low	68.6	Low	184 Å²	184	82.6 Å²	82.6	86%	0.86	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-65.7	-13.9	-174.1	-69.5	172.1	171.7	0	0	113.7	S63	S63-E65 VanDerWaalsContact C-N 3.28Å; S63-E65 PolarHBondContact O-N 3.12Å
66	N	57.3	Low	68.3	Low	139 Å²	139	85.9 Å²	85.9	74%	0.743	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-116	17.5	-177.6	-67.3	-29.9	0	0	0	114.3	L64 Q68	L64-N66 PolarHBondContact O-N 3.15Å; L64-N66 VanDerWaalsContact O-N 3.13Å; N66-Q68 PolarHBondContact O-N 3.13Å
67	L	65.8	Low	67.8	Low	41 Å²	41	85.7 Å²	85.7	22%	0.215	46%	0.459	C	S	.	.			trans	-82.1	109.6	179.3	-67.1	-178	0	0	0	111.7	L26 L28 L39 F62 L64	L26-L67 HydrophobicContact CD1-CD1 4.13Å; L28-L67 HydrophobicContact CD2-CD1 4.24Å; L28-L67 HydrophobicContact CD2-CD2 3.7Å; L39-L67 HydrophobicContact CD2-CD1 3.79Å; F62-L67 HydrophobicContact CD2-CD1 4.33Å; F62-L67 HydrophobicContact CD2-CD2 4.19Å; F62-L67 HydrophobicContact CD2-CG 4.48Å; F62-L67 HydrophobicContact CE2-CD1 3.78Å; F62-L67 HydrophobicContact CE2-CD2 4.38Å; F62-L67 HydrophobicContact CE2-CG 4.4Å; L64-L67 HydrophobicContact CG-CD1 4.17Å; L64-L67 PolarHBondContact O-N 3.45Å
68	Q	61.6	Low	67.2	Low	165 Å²	165	88.2 Å²	88.2	77%	0.771	47%	0.466	S	S	*	.			trans	-93.6	131.2	170.5	-69.4	-174.1	-21.2	0	0	111	N66 N70	N66-Q68 PolarHBondContact O-N 3.13Å; Q68-N70 PolarHBondContact O-N 3.09Å
69	A	65.9	Low	66.4	Low	55 Å²	55	94 Å²	94	46%	0.455	48%	0.479	S	S	.	.	B	Isolated β-bridge	trans	-64.8	129.9	169.9	0	0	0	0	0	109.9	L26 K71	L26-A69 HydrophobicContact CD2-CB 4.38Å; A69-K71 PolarHBondContact O-N 3.43Å
70	N	66.8	Low	66	Low	42 Å²	42	93.5 Å²	93.5	23%	0.225	47%	0.466	C	S	.	.			trans	-79.8	90.3	178.7	-167.8	-34.5	0	0	0	109.8	A25 Q68 H72 L73 A74	A25-N70 PolarHBondContact O-N 3.02Å; Q68-N70 PolarHBondContact O-N 3.09Å; N70-H72 VanDerWaalsContact C-N 3.27Å; N70-H72 PolarHBondContact O-N 3.23Å; N70-H72 PolarHBondContact OD1-N 3.42Å; N70-L73 HydrophobicContact CB-CB 4.05Å; N70-L73 PolarHBondContact O-N 2.55Å; N70-L73 VanDerWaalsContact O-N 3.15Å; N70-L73 PolarHBondContact OD1-N 3.08Å; N70-L73 VanDerWaalsContact OD1-N 3.08Å; N70-A74 PolarHBondContact O-N 3.22Å; N70-A74 VanDerWaalsContact O-N 3.09Å
71	K	65.9	Low	65	Low	167 Å²	167	90.7 Å²	90.7	73%	0.726	45%	0.451	S	S	*	.	H	α-helix	trans	-61.5	-32.1	-178.2	-64	-175	-179.6	-179	0	113	A69 A74 N75	A69-K71 PolarHBondContact O-N 3.43Å; K71-A74 WeakPolarHBondContact O-CB 2.98Å; K71-A74 PolarHBondContact O-N 2.78Å; K71-N75 PolarHBondContact O-N 3.2Å; K71-N75 VanDerWaalsContact O-N 3.16Å
72	H	64.9	Low	64	Low	157 Å²	157	87.5 Å²	87.5	73%	0.727	44%	0.444	S	S	*	.	H	α-helix	trans	-66.5	-39.4	175.5	-70.3	-70.1	0	0	0	112	N70 A74 N75 V76	N70-H72 VanDerWaalsContact C-N 3.27Å; N70-H72 PolarHBondContact O-N 3.23Å; N70-H72 PolarHBondContact OD1-N 3.42Å; H72-A74 VanDerWaalsContact C-N 3.35Å; H72-N75 PolarHBondContact O-N 3.36Å; H72-V76 WeakPolarHBondContact O-CG2 3.38Å; H72-V76 PolarHBondContact O-N 3.35Å
73	L	67.8	Low	63.3	Low	25 Å²	25	92 Å²	92	13%	0.131	47%	0.473	C	S	.	.	H	α-helix	trans	-69.5	-35	176.1	-136.1	104.5	0	0	0	111.7	L22 A25 N70 V76 V77	L22-L73 HydrophobicContact CB-CD2 4.2Å; L22-L73 HydrophobicContact CD1-CD2 3.43Å; L22-L73 VanDerWaalsContact CD1-CD2 3.43Å; L22-L73 HydrophobicContact CG-CD2 4.45Å; A25-L73 HydrophobicContact CB-CB 4.45Å; A25-L73 HydrophobicContact CB-CD2 3.84Å; N70-L73 HydrophobicContact CB-CB 4.05Å; N70-L73 PolarHBondContact O-N 2.55Å; N70-L73 VanDerWaalsContact O-N 3.15Å; N70-L73 PolarHBondContact OD1-N 3.08Å; N70-L73 VanDerWaalsContact OD1-N 3.08Å; L73-V76 PolarHBondContact O-N 3.17Å; L73-V77 WeakPolarHBondContact O-CB 3.46Å; L73-V77 VanDerWaalsContact O-CG2 3.26Å; L73-V77 WeakPolarHBondContact O-CG2 3.49Å; L73-V77 PolarHBondContact O-N 3.18Å
74	A	64.1	Low	62.5	Low	37 Å²	37	94.7 Å²	94.7	31%	0.306	48%	0.476	S	S	.	.	H	α-helix	trans	-59.4	-46.9	174.6	0	0	0	0	0	111.4	N70 K71 H72 V76 V77 E78	N70-A74 PolarHBondContact O-N 3.22Å; N70-A74 VanDerWaalsContact O-N 3.09Å; K71-A74 WeakPolarHBondContact O-CB 2.98Å; K71-A74 PolarHBondContact O-N 2.78Å; H72-A74 VanDerWaalsContact C-N 3.35Å; A74-V76 VanDerWaalsContact C-N 3.34Å; A74-V76 PolarHBondContact O-N 2.95Å; A74-V77 PolarHBondContact O-N 2.87Å; A74-E78 VanDerWaalsContact O-CB 3.29Å; A74-E78 WeakPolarHBondContact O-CB 3.46Å; A74-E78 PolarHBondContact O-N 2.88Å
75	N	64.8	Low	61.5	Low	97 Å²	97	97.1 Å²	97.1	52%	0.519	49%	0.489	S	S	.	.	H	α-helix	trans	-64.6	-35.3	176.9	-73.7	8	0	0	0	112.8	K71 H72 R79	K71-N75 PolarHBondContact O-N 3.2Å; K71-N75 VanDerWaalsContact O-N 3.16Å; H72-N75 PolarHBondContact O-N 3.36Å; N75-R79 WeakPolarHBondContact O-CB 3.45Å; N75-R79 VanDerWaalsContact O-CG 3.26Å; N75-R79 WeakPolarHBondContact O-CG 3.39Å; N75-R79 PolarHBondContact O-N 3.27Å; N75-R79 VanDerWaalsContact O-N 3.07Å
76	V	70.1	Confident	60.6	Low	70 Å²	70	97 Å²	97	42%	0.424	49%	0.486	S	S	.	.	H	α-helix	trans	-72.1	-40.7	177.5	174	0	0	0	0	111.3	T13 H72 L73 A74 R79 L80	T13-V76 HydrophobicContact CG2-CG1 4.08Å; H72-V76 WeakPolarHBondContact O-CG2 3.38Å; H72-V76 PolarHBondContact O-N 3.35Å; L73-V76 PolarHBondContact O-N 3.17Å; A74-V76 VanDerWaalsContact C-N 3.34Å; A74-V76 PolarHBondContact O-N 2.95Å; V76-R79 PolarHBondContact O-N 3.33Å; V76-L80 HydrophobicContact CG1-CD1 3.86Å; V76-L80 WeakPolarHBondContact O-CB 3.48Å; V76-L80 WeakPolarHBondContact O-CD1 3.41Å; V76-L80 WeakPolarHBondContact O-CG 3.38Å; V76-L80 PolarHBondContact O-N 3.03Å
77	V	65.3	Low	59.8	Low	15 Å²	15	93.6 Å²	93.6	9%	0.091	47%	0.472	C	S	.	.	H	α-helix	trans	-65.9	-39.2	175.3	170.5	0	0	0	0	111.2	T13 L21 L22 L73 A74 L80 G81	T13-V77 HydrophobicContact CG2-CG2 4.09Å; L21-V77 HydrophobicContact CB-CG1 3.94Å; L22-V77 HydrophobicContact CB-CG2 4.27Å; L73-V77 WeakPolarHBondContact O-CB 3.46Å; L73-V77 VanDerWaalsContact O-CG2 3.26Å; L73-V77 WeakPolarHBondContact O-CG2 3.49Å; L73-V77 PolarHBondContact O-N 3.18Å; A74-V77 PolarHBondContact O-N 2.87Å; V77-L80 PolarHBondContact O-N 2.96Å; V77-G81 PolarHBondContact O-N 3.45Å
78	E	65.8	Low	58.5	Low	120 Å²	120	99 Å²	99	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-63	-47.8	175.8	-171.1	170.9	-148.1	0	0	111	A74 L80 G81 E82	A74-E78 VanDerWaalsContact O-CB 3.29Å; A74-E78 WeakPolarHBondContact O-CB 3.46Å; A74-E78 PolarHBondContact O-N 2.88Å; E78-L80 PolarHBondContact O-N 3.06Å; E78-G81 CarbonylContact O-C 3.45Å; E78-G81 WeakPolarHBondContact O-CA 3.47Å; E78-G81 PolarHBondContact O-N 3.07Å; E78-G81 VanDerWaalsContact O-N 3.09Å; E78-E82 WeakPolarHBondContact O-CG 3.46Å; E78-E82 PolarHBondContact O-N 2.82Å
79	R	64.1	Low	57.6	Low	184 Å²	184	99 Å²	99	69%	0.694	50%	0.504	S	S	*	.	H	α-helix	trans	-66.2	-32.6	176	-67	-177.7	97.8	-169	6.8	113.3	N75 V76 V83	N75-R79 WeakPolarHBondContact O-CB 3.45Å; N75-R79 VanDerWaalsContact O-CG 3.26Å; N75-R79 WeakPolarHBondContact O-CG 3.39Å; N75-R79 PolarHBondContact O-N 3.27Å; N75-R79 VanDerWaalsContact O-N 3.07Å; V76-R79 PolarHBondContact O-N 3.33Å; R79-V83 VanDerWaalsContact O-CG2 3.31Å; R79-V83 WeakPolarHBondContact O-CG2 3.45Å; R79-V83 PolarHBondContact O-N 3.4Å
80	L	62.4	Low	56.7	Low	35 Å²	35	98.3 Å²	98.3	18%	0.183	50%	0.502	C	S	.	.	H	α-helix	trans	-71	-34.3	170.8	-81.5	158.7	0	0	0	112.1	I9 T13 V76 V77 E78 V83 K84	I9-L80 HydrophobicContact CG2-CD1 3.64Å; I9-L80 HydrophobicContact CG2-CD2 4.39Å; T13-L80 HydrophobicContact CG2-CD1 3.83Å; V76-L80 HydrophobicContact CG1-CD1 3.86Å; V76-L80 WeakPolarHBondContact O-CB 3.48Å; V76-L80 WeakPolarHBondContact O-CD1 3.41Å; V76-L80 WeakPolarHBondContact O-CG 3.38Å; V76-L80 PolarHBondContact O-N 3.03Å; V77-L80 PolarHBondContact O-N 2.96Å; E78-L80 PolarHBondContact O-N 3.06Å; L80-V83 PolarHBondContact O-N 3.37Å; L80-K84 PolarHBondContact O-N 3.48Å
81	G	58.6	Low	55.7	Low	14 Å²	14	101.4 Å²	101.4	14%	0.144	52%	0.523	C	S	.	.	H	α-helix	trans	-61.1	-46.3	171.1	0	0	0	0	0	111.1	V77 E78 V83 K84 L85	V77-G81 PolarHBondContact O-N 3.45Å; E78-G81 CarbonylContact O-C 3.45Å; E78-G81 WeakPolarHBondContact O-CA 3.47Å; E78-G81 PolarHBondContact O-N 3.07Å; E78-G81 VanDerWaalsContact O-N 3.09Å; G81-V83 VanDerWaalsContact C-N 3.29Å; G81-V83 PolarHBondContact O-N 3.23Å; G81-K84 CarbonylContact O-C 3.55Å; G81-K84 PolarHBondContact O-N 3.05Å; G81-K84 VanDerWaalsContact O-N 3.16Å; G81-L85 WeakPolarHBondContact O-CB 3.17Å; G81-L85 WeakPolarHBondContact O-CD1 3.4Å; G81-L85 WeakPolarHBondContact O-CG 3.22Å; G81-L85 PolarHBondContact O-N 3.33Å
82	E	55.1	Low	54.9	Low	118 Å²	118	102.6 Å²	102.6	55%	0.551	53%	0.528	S	S	*	.	H	α-helix	trans	-61.3	-34.2	175.1	-70.8	177	165	0	0	113	E78	E78-E82 WeakPolarHBondContact O-CG 3.46Å; E78-E82 PolarHBondContact O-N 2.82Å
83	V	55	Low	54.4	Low	115 Å²	115	105.4 Å²	105.4	70%	0.697	53%	0.532	S	S	*	.	H	α-helix	trans	-75.4	-30.2	176	174.6	0	0	0	0	112.3	R79 L80 G81	R79-V83 VanDerWaalsContact O-CG2 3.31Å; R79-V83 WeakPolarHBondContact O-CG2 3.45Å; R79-V83 PolarHBondContact O-N 3.4Å; L80-V83 PolarHBondContact O-N 3.37Å; G81-V83 VanDerWaalsContact C-N 3.29Å; G81-V83 PolarHBondContact O-N 3.23Å
84	K	49.7	Very low	54.5	Low	122 Å²	122	108.9 Å²	108.9	53%	0.53	55%	0.551	S	S	.	*	H	α-helix	trans	-86.1	-17.6	174	-80.1	-175	175.4	179.8	0	114.1	Q10 L80 G81	Q10-K84 VanDerWaalsContact NE2-NZ 3.16Å; L80-K84 PolarHBondContact O-N 3.48Å; G81-K84 CarbonylContact O-C 3.55Å; G81-K84 PolarHBondContact O-N 3.05Å; G81-K84 VanDerWaalsContact O-N 3.16Å
85	L	43.3	Very low	55.2	Low	137 Å²	137	110.3 Å²	110.3	72%	0.717	55%	0.553	S	S	*	*	S	Bend	trans	-102.1	14.5	-176.3	-69.7	169.3	0	0	0	114.5	G81 P87	G81-L85 WeakPolarHBondContact O-CB 3.17Å; G81-L85 WeakPolarHBondContact O-CD1 3.4Å; G81-L85 WeakPolarHBondContact O-CG 3.22Å; G81-L85 PolarHBondContact O-N 3.33Å; L85-P87 WeakPolarHBondContact O-CD 3.44Å
86	K	37.6	Very low	56.1	Low	181 Å²	181	106.2 Å²	106.2	79%	0.787	53%	0.532	S	S	*	.			trans	-100	76.1	153.7	-69.5	-171.6	-180	-176.8	0	109.5	D88	K86-D88 PolarHBondContact O-N 3.23Å
87	P	40.8	Very low	56.7	Low	69 Å²	69	109.6 Å²	109.6	45%	0.448	55%	0.552	S	S	.	*			trans	-60.6	137	148	30.2	-26.5	0	0	0	105.9	L85 I89	L85-P87 WeakPolarHBondContact O-CD 3.44Å; P87-I89 VanDerWaalsContact C-N 3.34Å; P87-I89 WeakPolarHBondContact O-CG1 3.43Å; P87-I89 PolarHBondContact O-N 3.48Å
88	D	38.1	Very low	57.4	Low	155 Å²	155	116.3 Å²	116.3	83%	0.829	58%	0.582	S	S	*	*			trans	-47.8	96.9	168.7	-154	11	0	0	0	108.7	K86 G90	K86-D88 PolarHBondContact O-N 3.23Å; D88-G90 PolarHBondContact O-N 3.35Å
89	I	44.2	Very low	58.2	Low	164 Å²	164	114.4 Å²	114.4	84%	0.841	57%	0.573	S	S	*	*			trans	-78.5	85.6	178.9	-65.8	167.5	0	0	0	105.6	P87	P87-I89 VanDerWaalsContact C-N 3.34Å; P87-I89 WeakPolarHBondContact O-CG1 3.43Å; P87-I89 PolarHBondContact O-N 3.48Å
90	G	45.8	Very low	59	Low	40 Å²	40	108 Å²	108	41%	0.412	56%	0.564	S	S	.	*	S	Bend	trans	162.6	118.9	173.6	0	0	0	0	0	109.6	D88	D88-G90 PolarHBondContact O-N 3.35Å
91	T	46.2	Very low	60	Low	107 Å²	107	110.2 Å²	110.2	66%	0.656	57%	0.574	S	S	*	*	S	Bend	trans	93.4	-8.7	154.7	-0.7	0	0	0	0	121.5
92	K	49.9	Very low	61.3	Low	192 Å²	192	115.4 Å²	115.4	84%	0.835	59%	0.592	S	S	*	*	S	Bend	trans	-115	-12.7	179.4	-83.8	-171.9	179.4	179.6	0	118.6
93	R	52.9	Low	62.7	Low	216 Å²	216	111.6 Å²	111.6	82%	0.815	58%	0.576	S	S	*	*	S	Bend	trans	-93.7	-6.8	177.7	-71.6	-172.8	-177.3	-175.4	1.2	114.6
94	D	70.1	Confident	64.1	Low	99 Å²	99	110.1 Å²	110.1	53%	0.529	56%	0.563	S	S	.	*	S	Bend	trans	-106.2	16.4	-176	-48.4	-37.5	0	0	0	112.2	K102 L103	D94-K102 CarbonylContact O-C 3.35Å; D94-K102 VanDerWaalsContact O-CA 3.23Å; D94-K102 WeakPolarHBondContact O-CA 3.28Å; D94-L103 PolarHBondContact O-N 2.46Å
95	L	79.4	Confident	65.9	Low	67 Å²	67	105.3 Å²	105.3	35%	0.351	54%	0.543	S	S	.	.	B	Isolated β-bridge	trans	-109.2	138.7	-179	-58.6	177.7	0	0	0	111.2	V97 E101 K102	L95-V97 PolarHBondContact O-N 3.3Å; L95-E101 CarbonylContact C-O 3.44Å; L95-E101 WeakPolarHBondContact CA-O 3.26Å; L95-K102 HydrophobicContact CD2-CG 3.84Å
96	C	83.1	Confident	68.1	Low	10 Å²	10	101.4 Å²	101.4	7%	0.068	52%	0.521	C	S	.	.			trans	-67.4	126.6	176.6	-180	0	0	0	0	110	H98 H99 G100 E101 L103 C115	C96-H98 PolarHBondContact O-N 3.44Å; C96-H99 HydrophobicContact CB-CB 4.34Å; C96-H99 PolarHBondContact O-N 3.23Å; C96-H99 PolarHBondContact SG-ND1 3.15Å; C96-G100 WeakPolarHBondContact O-CA 3.35Å; C96-G100 PolarHBondContact O-N 3.21Å; C96-E101 WeakPolarHBondContact CB-O 3.46Å; C96-E101 PolarHBondContact N-O 3.01Å; C96-L103 HydrophobicContact CB-CD2 3.69Å; C96-L103 HydrophobicContact CB-CG 4.44Å; C96-C115 HydrophobicContact CB-CB 3.82Å; C96-C115 VanDerWaalsContact SG-SG 3.65Å
97	V	82.8	Confident	70.6	Confident	141 Å²	141	92.8 Å²	92.8	86%	0.855	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-30.3	-179	-176.3	0	0	0	0	112.2	L95	L95-V97 PolarHBondContact O-N 3.3Å
98	H	80.9	Confident	72.7	Confident	156 Å²	156	94.7 Å²	94.7	72%	0.722	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-31.9	-177.6	-66.5	-69.2	0	0	0	113.9	C96	C96-H98 PolarHBondContact O-N 3.44Å
99	H	82.6	Confident	75.1	Confident	80 Å²	80	91.4 Å²	91.4	37%	0.37	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-10.5	-169.5	-55.6	112.7	0	0	0	113.9	C96 E101 V117 C118	C96-H99 HydrophobicContact CB-CB 4.34Å; C96-H99 PolarHBondContact O-N 3.23Å; C96-H99 PolarHBondContact SG-ND1 3.15Å; H99-E101 HydrophobicContact CB-CB 4.34Å; H99-E101 HydrophobicContact CB-CG 4.25Å; H99-E101 PolarHBondContact O-N 2.98Å; H99-E101 VanDerWaalsContact O-N 3.13Å; H99-V117 HydrophobicContact CB-CB 4.24Å; H99-V117 HydrophobicContact CB-CG2 4.35Å; H99-V117 VanDerWaalsContact CD2-CG1 3.5Å; H99-V117 WeakPolarHBondContact CD2-CG1 3.31Å; H99-C118 PolarHBondContact CE1-SG 2.93Å; H99-C118 PolarHBondContact ND1-SG 3.46Å
100	G	79.3	Confident	77.1	Confident	49 Å²	49	86.3 Å²	86.3	51%	0.505	44%	0.439	S	S	.	.			trans	68.2	3.3	-175	0	0	0	0	0	114.5	C96	C96-G100 WeakPolarHBondContact O-CA 3.35Å; C96-G100 PolarHBondContact O-N 3.21Å
101	E	84.5	Confident	78.9	Confident	82 Å²	82	92.4 Å²	92.4	38%	0.383	45%	0.454	S	S	.	.			trans	-89	155.3	-176.1	-73.4	-61.5	157	0	0	112.8	L95 C96 H99 L103 C115 V117	L95-E101 CarbonylContact C-O 3.44Å; L95-E101 WeakPolarHBondContact CA-O 3.26Å; C96-E101 WeakPolarHBondContact CB-O 3.46Å; C96-E101 PolarHBondContact N-O 3.01Å; H99-E101 HydrophobicContact CB-CB 4.34Å; H99-E101 HydrophobicContact CB-CG 4.25Å; H99-E101 PolarHBondContact O-N 2.98Å; H99-E101 VanDerWaalsContact O-N 3.13Å; E101-L103 PolarHBondContact O-N 3.29Å; E101-C115 HydrophobicContact CB-CB 3.72Å; E101-V117 HydrophobicContact CG-CG2 4.11Å
102	K	84.8	Confident	80.8	Confident	124 Å²	124	93.1 Å²	93.1	54%	0.539	45%	0.448	S	S	.	.	B	Isolated β-bridge	trans	-64.4	135.2	-179.3	-66.6	-177.3	179.8	179.9	0	112.7	D94 L95 L104 C115	D94-K102 CarbonylContact O-C 3.35Å; D94-K102 VanDerWaalsContact O-CA 3.23Å; D94-K102 WeakPolarHBondContact O-CA 3.28Å; L95-K102 HydrophobicContact CD2-CG 3.84Å; K102-L104 VanDerWaalsContact C-N 3.33Å; K102-L104 HydrophobicContact CB-CD1 4.1Å; K102-L104 HydrophobicContact CB-CD2 4.33Å; K102-L104 HydrophobicContact CB-CG 3.83Å; K102-L104 PolarHBondContact O-N 3.5Å; K102-L104 VanDerWaalsContact O-N 3.08Å; K102-C115 WeakPolarHBondContact O-CA 3.42Å; K102-C115 VanDerWaalsContact O-CB 3.3Å; K102-C115 WeakPolarHBondContact O-CB 3.45Å
103	L	85.8	Confident	82.5	Confident	38 Å²	38	85.8 Å²	85.8	20%	0.199	42%	0.423	C	S	.	.			trans	-81.1	74.5	175.9	-63.8	177.1	0	0	0	110.3	D94 C96 E101 A113 I114 C115	D94-L103 PolarHBondContact O-N 2.46Å; C96-L103 HydrophobicContact CB-CD2 3.69Å; C96-L103 HydrophobicContact CB-CG 4.44Å; E101-L103 PolarHBondContact O-N 3.29Å; L103-A113 HydrophobicContact CB-CB 4.16Å; L103-I114 CarbonylContact C-O 3.5Å; L103-I114 WeakPolarHBondContact CA-O 3.34Å; L103-I114 VanDerWaalsContact CD2-C 3.48Å; L103-C115 HydrophobicContact CD2-CB 4.35Å
104	L	84.9	Confident	84.2	Confident	83 Å²	83	75.8 Å²	75.8	44%	0.435	39%	0.385	S	S	.	.			trans	-100.2	-0.2	-177.3	-60.8	176.9	0	0	0	113.5	K102 I114 W132	K102-L104 VanDerWaalsContact C-N 3.33Å; K102-L104 HydrophobicContact CB-CD1 4.1Å; K102-L104 HydrophobicContact CB-CD2 4.33Å; K102-L104 HydrophobicContact CB-CG 3.83Å; K102-L104 PolarHBondContact O-N 3.5Å; K102-L104 VanDerWaalsContact O-N 3.08Å; L104-I114 PolarHBondContact N-O 3.17Å; L104-W132 VanDerWaalsContact O-CB 3.24Å; L104-W132 WeakPolarHBondContact O-CB 3.45Å; L104-W132 PolarHBondContact O-N 3.47Å
105	L	87.2	Confident	85.1	Confident	22 Å²	22	71 Å²	71	12%	0.115	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	150.4	-179.5	-59.4	173.9	0	0	0	110.1	A113 I114 W116 E119 F130 L131	L105-A113 CarbonylContact O-C 3.48Å; L105-A113 VanDerWaalsContact O-CA 3.23Å; L105-A113 WeakPolarHBondContact O-CA 3.43Å; L105-I114 HydrophobicContact CB-CG1 3.82Å; L105-I114 PolarHBondContact N-O 3.42Å; L105-I114 PolarHBondContact O-N 3.23Å; L105-W116 HydrophobicContact CD1-CB 4.46Å; L105-E119 HydrophobicContact CD1-CB 3.9Å; L105-E119 HydrophobicContact CD1-CG 4.34Å; L105-E119 WeakPolarHBondContact CD1-OE2 3.23Å; L105-F130 CarbonylContact C-O 3.29Å; L105-F130 VanDerWaalsContact CA-O 3.3Å; L105-F130 WeakPolarHBondContact CA-O 3.35Å; L105-L131 HydrophobicContact CD2-CD2 3.96Å
106	F	89.4	Confident	85.3	Confident	54 Å²	54	74.3 Å²	74.3	24%	0.237	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	121.7	173.6	178.1	-99.9	0	0	0	109.8	K111 K112 T129 F130 A135	F106-K111 VanDerWaalsContact CE2-C 3.5Å; F106-K111 HydrophobicContact CZ-CB 4.3Å; F106-K112 WeakPolarHBondContact CA-O 3.37Å; F106-T129 WeakPolarHBondContact O-CA 3.35Å; F106-F130 PolarHBondContact N-O 2.78Å; F106-F130 PolarHBondContact O-N 3.09Å; F106-A135 HydrophobicContact CB-CB 3.6Å; F106-A135 HydrophobicContact CD1-CB 3.75Å; F106-A135 HydrophobicContact CG-CB 3.77Å
107	C	88.6	Confident	85.5	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	121.8	171.5	176.7	0	0	0	0	109.8	D110 K111 K112 I114 H127 T129	C107-D110 HydrophobicContact CB-CB 4.25Å; C107-D110 PolarHBondContact SG-OD2 3.33Å; C107-K111 VanDerWaalsContact O-CA 3.32Å; C107-K111 WeakPolarHBondContact O-CA 3.43Å; C107-K111 PolarHBondContact O-N 3.11Å; C107-K112 PolarHBondContact N-O 3.03Å; C107-K112 PolarHBondContact O-N 2.7Å; C107-I114 HydrophobicContact CB-CD1 4.07Å; C107-I114 HydrophobicContact CB-CG2 4.46Å; C107-H127 VanDerWaalsContact SG-CB 3.52Å; C107-H127 PolarHBondContact SG-ND1 3.47Å; C107-H127 VanDerWaalsContact SG-ND1 3.42Å; C107-T129 HydrophobicContact CB-CG2 4.46Å
108	K	85.9	Confident	85.7	Confident	109 Å²	109	69.6 Å²	69.6	47%	0.474	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-41.2	-174.8	-176.2	171.5	-178.3	167.7	0	113	K111 H128 F130	K108-K111 WeakPolarHBondContact O-CG 3.44Å; K108-H128 HydrophobicContact CB-CB 4.4Å; K108-H128 PolarHBondContact N-O 2.91Å; K108-F130 HydrophobicContact CB-CD2 4.39Å; K108-F130 HydrophobicContact CB-CE2 3.98Å; K108-F130 HydrophobicContact CD-CE2 3.87Å; K108-F130 HydrophobicContact CD-CZ 4.45Å
109	E	89.3	Confident	86	Confident	86 Å²	86	65.4 Å²	65.4	40%	0.402	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-47.1	179.4	-69.4	77.5	-175.6	0	0	110.9	H127 H128	E109-H127 WeakPolarHBondContact OE2-CB 3.29Å; E109-H128 IonicContact OE1-CE1 3.77Å; E109-H128 IonicContact OE1-CG 3.59Å; E109-H128 PolarHBondContact OE1-N 3Å; E109-H128 IonicContact OE1-ND1 2.73Å; E109-H128 PolarHBondContact OE1-ND1 3.22Å; E109-H128 PolarHBondContact OE2-N 3.25Å
110	D	84.6	Confident	86.1	Confident	58 Å²	58	71.1 Å²	71.1	31%	0.31	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-11.1	-177.1	-61.1	-50.2	0	0	0	113.6	C107 K112 H124 H127	C107-D110 HydrophobicContact CB-CB 4.25Å; C107-D110 PolarHBondContact SG-OD2 3.33Å; D110-K112 VanDerWaalsContact C-N 3.26Å; D110-K112 HydrophobicContact CB-CD 4.39Å; D110-K112 WeakPolarHBondContact O-CG 3.32Å; D110-K112 PolarHBondContact O-N 3.21Å; D110-H124 IonicContact OD2-CE1 3.77Å; D110-H124 PolarHBondContact OD2-CE1 3Å; D110-H124 IonicContact OD2-CG 3.78Å; D110-H124 IonicContact OD2-ND1 3.84Å; D110-H124 PolarHBondContact OD2-ND1 3.16Å; D110-H127 IonicContact OD1-CE1 2.78Å; D110-H127 IonicContact OD1-ND1 3.16Å; D110-H127 IonicContact OD2-CE1 2.72Å; D110-H127 PolarHBondContact OD2-CE1 2.73Å; D110-H127 IonicContact OD2-ND1 3.98Å; D110-H127 PolarHBondContact OD2-ND1 3.08Å
111	K	84.3	Confident	86.5	Confident	167 Å²	167	70.2 Å²	70.2	73%	0.726	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	42.2	-176.5	-59.4	179.9	-178.7	175.6	0	113	F106 C107 K108	F106-K111 VanDerWaalsContact CE2-C 3.5Å; F106-K111 HydrophobicContact CZ-CB 4.3Å; C107-K111 VanDerWaalsContact O-CA 3.32Å; C107-K111 WeakPolarHBondContact O-CA 3.43Å; C107-K111 PolarHBondContact O-N 3.11Å; K108-K111 WeakPolarHBondContact O-CG 3.44Å
112	K	85.7	Confident	86.5	Confident	122 Å²	122	74.9 Å²	74.9	53%	0.53	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.6	-174.9	-74.8	169.9	-171.6	175.4	0	111.4	F106 C107 D110 I114	F106-K112 WeakPolarHBondContact CA-O 3.37Å; C107-K112 PolarHBondContact N-O 3.03Å; C107-K112 PolarHBondContact O-N 2.7Å; D110-K112 VanDerWaalsContact C-N 3.26Å; D110-K112 HydrophobicContact CB-CD 4.39Å; D110-K112 WeakPolarHBondContact O-CG 3.32Å; D110-K112 PolarHBondContact O-N 3.21Å; K112-I114 HydrophobicContact CB-CG2 4.41Å
113	A	87.3	Confident	86.5	Confident	38 Å²	38	75.2 Å²	75.2	31%	0.314	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	131.1	165.3	0	0	0	0	0	109.1	L103 L105	L103-A113 HydrophobicContact CB-CB 4.16Å; L105-A113 CarbonylContact O-C 3.48Å; L105-A113 VanDerWaalsContact O-CA 3.23Å; L105-A113 WeakPolarHBondContact O-CA 3.43Å
114	I	88.3	Confident	86.4	Confident	6 Å²	6	73.9 Å²	73.9	3%	0.031	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	161.2	-176.2	69.4	171.2	0	0	0	110.1	L103 L104 L105 C107 K112 C118 E119 H124 T129	L103-I114 CarbonylContact C-O 3.5Å; L103-I114 WeakPolarHBondContact CA-O 3.34Å; L103-I114 VanDerWaalsContact CD2-C 3.48Å; L104-I114 PolarHBondContact N-O 3.17Å; L105-I114 HydrophobicContact CB-CG1 3.82Å; L105-I114 PolarHBondContact N-O 3.42Å; L105-I114 PolarHBondContact O-N 3.23Å; C107-I114 HydrophobicContact CB-CD1 4.07Å; C107-I114 HydrophobicContact CB-CG2 4.46Å; K112-I114 HydrophobicContact CB-CG2 4.41Å; I114-C118 HydrophobicContact CB-CB 3.84Å; I114-C118 HydrophobicContact CD1-CB 4.4Å; I114-E119 HydrophobicContact CD1-CB 4.14Å; I114-H124 HydrophobicContact CD1-CB 4.32Å; I114-T129 HydrophobicContact CD1-CG2 3.84Å
115	C	88.2	Confident	86.3	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	36%	0.358	C	S	.	.			trans	-95.3	169	172.4	70.3	0	0	0	0	111.3	C96 E101 K102 L103 V117 C118 E119	C96-C115 HydrophobicContact CB-CB 3.82Å; C96-C115 VanDerWaalsContact SG-SG 3.65Å; E101-C115 HydrophobicContact CB-CB 3.72Å; K102-C115 WeakPolarHBondContact O-CA 3.42Å; K102-C115 VanDerWaalsContact O-CB 3.3Å; K102-C115 WeakPolarHBondContact O-CB 3.45Å; L103-C115 HydrophobicContact CD2-CB 4.35Å; C115-V117 PolarHBondContact O-N 2.87Å; C115-V117 VanDerWaalsContact O-N 3.17Å; C115-C118 WeakPolarHBondContact O-CB 3.42Å; C115-C118 PolarHBondContact O-N 3.49Å; C115-C118 VanDerWaalsContact SG-SG 3.62Å; C115-E119 PolarHBondContact O-N 3.25Å; C115-E119 VanDerWaalsContact O-N 3.14Å
116	W	83.7	Confident	86	Confident	136 Å²	136	81.9 Å²	81.9	52%	0.515	39%	0.389	S	S	.	.	H	α-helix	trans	-60	-26.3	179.4	74.4	-91.5	0	0	0	113.8	L105	L105-W116 HydrophobicContact CD1-CB 4.46Å
117	V	88	Confident	86.1	Confident	41 Å²	41	82.2 Å²	82.2	25%	0.248	39%	0.391	C	S	.	.	H	α-helix	trans	-73.9	-40.1	175.5	-171.9	0	0	0	0	110.9	H99 E101 C115 R120 S121	H99-V117 HydrophobicContact CB-CB 4.24Å; H99-V117 HydrophobicContact CB-CG2 4.35Å; H99-V117 VanDerWaalsContact CD2-CG1 3.5Å; H99-V117 WeakPolarHBondContact CD2-CG1 3.31Å; E101-V117 HydrophobicContact CG-CG2 4.11Å; C115-V117 PolarHBondContact O-N 2.87Å; C115-V117 VanDerWaalsContact O-N 3.17Å; V117-R120 PolarHBondContact O-N 3.49Å; V117-S121 PolarHBondContact O-N 3.41Å
118	C	87	Confident	86	Confident	10 Å²	10	87.8 Å²	87.8	7%	0.068	42%	0.416	C	S	.	.	H	α-helix	trans	-63.7	-40.1	175.9	-73.5	0	0	0	0	111.9	H99 I114 C115 R120 S121 H124	H99-C118 PolarHBondContact CE1-SG 2.93Å; H99-C118 PolarHBondContact ND1-SG 3.46Å; I114-C118 HydrophobicContact CB-CB 3.84Å; I114-C118 HydrophobicContact CD1-CB 4.4Å; C115-C118 WeakPolarHBondContact O-CB 3.42Å; C115-C118 PolarHBondContact O-N 3.49Å; C115-C118 VanDerWaalsContact SG-SG 3.62Å; C118-R120 PolarHBondContact O-N 2.9Å; C118-S121 VanDerWaalsContact O-CB 3.29Å; C118-S121 WeakPolarHBondContact O-CB 3.27Å; C118-S121 PolarHBondContact O-N 3.06Å; C118-S121 PolarHBondContact O-OG 3.25Å; C118-H124 PolarHBondContact O-CD2 3.36Å
119	E	86.4	Confident	86.1	Confident	69 Å²	69	84.5 Å²	84.5	32%	0.322	41%	0.405	S	S	.	.	H	α-helix	trans	-56.6	-34.7	177.3	174.5	179.6	-122.6	0	0	112.6	L105 I114 C115 T129	L105-E119 HydrophobicContact CD1-CB 3.9Å; L105-E119 HydrophobicContact CD1-CG 4.34Å; L105-E119 WeakPolarHBondContact CD1-OE2 3.23Å; I114-E119 HydrophobicContact CD1-CB 4.14Å; C115-E119 PolarHBondContact O-N 3.25Å; C115-E119 VanDerWaalsContact O-N 3.14Å; E119-T129 HydrophobicContact CG-CG2 4.08Å; E119-T129 VanDerWaalsContact OE1-CB 3.3Å; E119-T129 WeakPolarHBondContact OE1-CB 3.47Å; E119-T129 PolarHBondContact OE1-OG1 2.78Å
120	R	85.9	Confident	85.9	Confident	199 Å²	199	83.6 Å²	83.6	75%	0.751	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-5	179.6	-61.3	179.9	68.5	157.4	2.3	113.5	V117 C118	V117-R120 PolarHBondContact O-N 3.49Å; C118-R120 PolarHBondContact O-N 2.9Å
121	S	87	Confident	86	Confident	31 Å²	31	84.8 Å²	84.8	22%	0.217	41%	0.406	C	S	.	.	S	Bend	trans	-70.8	162.9	178.1	88.4	0	0	0	0	110.4	V117 C118 E123 R125	V117-S121 PolarHBondContact O-N 3.41Å; C118-S121 VanDerWaalsContact O-CB 3.29Å; C118-S121 WeakPolarHBondContact O-CB 3.27Å; C118-S121 PolarHBondContact O-N 3.06Å; C118-S121 PolarHBondContact O-OG 3.25Å; S121-E123 PolarHBondContact O-N 2.97Å; S121-E123 VanDerWaalsContact OG-CB 3.32Å; S121-E123 WeakPolarHBondContact OG-CB 3.22Å; S121-E123 PolarHBondContact OG-N 3.29Å; S121-E123 VanDerWaalsContact OG-N 3.09Å; S121-R125 PolarHBondContact O-N 2.88Å
122	Q	84.9	Confident	85.7	Confident	180 Å²	180	82.4 Å²	82.4	84%	0.841	39%	0.393	S	S	*	.	S	Bend	trans	-64.3	-21.7	172.4	-71	-171.9	-10.4	0	0	112.5
123	E	83.8	Confident	85.5	Confident	131 Å²	131	81.1 Å²	81.1	61%	0.612	39%	0.389	S	S	*	.	S	Bend	trans	-69.5	-37.3	-176.2	-169.6	179	178.4	0	0	112.5	S121	S121-E123 PolarHBondContact O-N 2.97Å; S121-E123 VanDerWaalsContact OG-CB 3.32Å; S121-E123 WeakPolarHBondContact OG-CB 3.22Å; S121-E123 PolarHBondContact OG-N 3.29Å; S121-E123 VanDerWaalsContact OG-N 3.09Å
124	H	84.2	Confident	85.4	Confident	10 Å²	10	84 Å²	84	5%	0.046	40%	0.396	C	S	.	.	S	Bend	trans	-110.9	13.6	-178.8	-59.4	-68.2	0	0	0	113.1	D110 I114 C118 G126 H127	D110-H124 IonicContact OD2-CE1 3.77Å; D110-H124 PolarHBondContact OD2-CE1 3Å; D110-H124 IonicContact OD2-CG 3.78Å; D110-H124 IonicContact OD2-ND1 3.84Å; D110-H124 PolarHBondContact OD2-ND1 3.16Å; I114-H124 HydrophobicContact CD1-CB 4.32Å; C118-H124 PolarHBondContact O-CD2 3.36Å; H124-G126 PolarHBondContact O-N 3.48Å; H124-G126 VanDerWaalsContact O-N 3.15Å; H124-H127 AromaticContact ND1-ND1 3.94Å; H124-H127 WeakPolarHBondContact O-CB 3.49Å; H124-H127 PolarHBondContact O-N 2.93Å; H124-H127 VanDerWaalsContact O-N 3.1Å
125	R	83.4	Confident	85.2	Confident	199 Å²	199	84.3 Å²	84.3	75%	0.751	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	117	-174	-171.2	178.1	-175.9	-173.8	1.3	111.1	S121 H127	S121-R125 PolarHBondContact O-N 2.88Å; R125-H127 VanDerWaalsContact C-N 3.33Å
126	G	80.5	Confident	85.1	Confident	74 Å²	74	86.2 Å²	86.2	76%	0.763	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	5.1	-179.9	0	0	0	0	0	114.3	H124	H124-G126 PolarHBondContact O-N 3.48Å; H124-G126 VanDerWaalsContact O-N 3.15Å
127	H	90.9	Very high	85.3	Confident	61 Å²	61	86.7 Å²	86.7	28%	0.282	41%	0.412	S	S	.	.			trans	-76.6	155.7	168.9	-67.8	-173.7	0	0	0	110.8	C107 E109 D110 H124 R125 T129	C107-H127 VanDerWaalsContact SG-CB 3.52Å; C107-H127 PolarHBondContact SG-ND1 3.47Å; C107-H127 VanDerWaalsContact SG-ND1 3.42Å; E109-H127 WeakPolarHBondContact OE2-CB 3.29Å; D110-H127 IonicContact OD1-CE1 2.78Å; D110-H127 IonicContact OD1-ND1 3.16Å; D110-H127 IonicContact OD2-CE1 2.72Å; D110-H127 PolarHBondContact OD2-CE1 2.73Å; D110-H127 IonicContact OD2-ND1 3.98Å; D110-H127 PolarHBondContact OD2-ND1 3.08Å; H124-H127 AromaticContact ND1-ND1 3.94Å; H124-H127 WeakPolarHBondContact O-CB 3.49Å; H124-H127 PolarHBondContact O-N 2.93Å; H124-H127 VanDerWaalsContact O-N 3.1Å; R125-H127 VanDerWaalsContact C-N 3.33Å; H127-T129 PolarHBondContact O-N 3.24Å
128	H	87.2	Confident	85.3	Confident	117 Å²	117	89 Å²	89	54%	0.542	42%	0.42	S	S	.	.			trans	-83.1	114	176.2	-63.1	84.3	0	0	0	109.7	K108 E109 F130	K108-H128 HydrophobicContact CB-CB 4.4Å; K108-H128 PolarHBondContact N-O 2.91Å; E109-H128 IonicContact OE1-CE1 3.77Å; E109-H128 IonicContact OE1-CG 3.59Å; E109-H128 PolarHBondContact OE1-N 3Å; E109-H128 IonicContact OE1-ND1 2.73Å; E109-H128 PolarHBondContact OE1-ND1 3.22Å; E109-H128 PolarHBondContact OE2-N 3.25Å; H128-F130 HydrophobicContact CB-CE2 3.84Å; H128-F130 HydrophobicContact CB-CZ 4.25Å
129	T	87.8	Confident	85.3	Confident	39 Å²	39	91.8 Å²	91.8	24%	0.239	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	136.5	177.9	50	0	0	0	0	110.4	F106 C107 I114 E119 H127	F106-T129 WeakPolarHBondContact O-CA 3.35Å; C107-T129 HydrophobicContact CB-CG2 4.46Å; I114-T129 HydrophobicContact CD1-CG2 3.84Å; E119-T129 HydrophobicContact CG-CG2 4.08Å; E119-T129 VanDerWaalsContact OE1-CB 3.3Å; E119-T129 WeakPolarHBondContact OE1-CB 3.47Å; E119-T129 PolarHBondContact OE1-OG1 2.78Å; H127-T129 PolarHBondContact O-N 3.24Å
130	F	85.6	Confident	85.5	Confident	67 Å²	67	94.2 Å²	94.2	29%	0.294	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	155.3	178.4	-61.4	-88	0	0	0	109.2	L105 F106 K108 H128 W132 A135	L105-F130 CarbonylContact C-O 3.29Å; L105-F130 VanDerWaalsContact CA-O 3.3Å; L105-F130 WeakPolarHBondContact CA-O 3.35Å; F106-F130 PolarHBondContact N-O 2.78Å; F106-F130 PolarHBondContact O-N 3.09Å; K108-F130 HydrophobicContact CB-CD2 4.39Å; K108-F130 HydrophobicContact CB-CE2 3.98Å; K108-F130 HydrophobicContact CD-CE2 3.87Å; K108-F130 HydrophobicContact CD-CZ 4.45Å; H128-F130 HydrophobicContact CB-CE2 3.84Å; H128-F130 HydrophobicContact CB-CZ 4.25Å; F130-W132 PolarHBondContact O-N 2.93Å; F130-A135 HydrophobicContact CB-CB 4.41Å
131	L	86.3	Confident	85.9	Confident	83 Å²	83	89.4 Å²	89.4	44%	0.435	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	140.9	168.5	-69.8	172.5	0	0	0	109.1	L105 E133 E134 A135	L105-L131 HydrophobicContact CD2-CD2 3.96Å; L131-E133 PolarHBondContact O-N 3.44Å; L131-E134 HydrophobicContact CB-CB 4.43Å; L131-E134 HydrophobicContact CB-CG 4.06Å; L131-E134 WeakPolarHBondContact O-CB 3.46Å; L131-E134 PolarHBondContact O-N 3.04Å; L131-A135 PolarHBondContact O-N 2.81Å
132	W	78.3	Confident	86.1	Confident	117 Å²	117	91.5 Å²	91.5	44%	0.443	45%	0.445	S	S	.	.	H	α-helix	trans	-51	-44.1	178.8	155.1	-97.6	0	0	0	111.4	L104 F130 E134 A135 V136	L104-W132 VanDerWaalsContact O-CB 3.24Å; L104-W132 WeakPolarHBondContact O-CB 3.45Å; L104-W132 PolarHBondContact O-N 3.47Å; F130-W132 PolarHBondContact O-N 2.93Å; W132-E134 VanDerWaalsContact C-N 3.29Å; W132-E134 PolarHBondContact O-N 3.04Å; W132-A135 PolarHBondContact O-N 3.42Å; W132-V136 HydrophobicContact CD2-CG2 3.71Å; W132-V136 HydrophobicContact CE3-CG2 3.83Å; W132-V136 HydrophobicContact CG-CG2 4.46Å; W132-V136 HydrophobicContact CH2-CG2 3.67Å; W132-V136 HydrophobicContact CZ2-CG2 3.54Å; W132-V136 HydrophobicContact CZ3-CG2 3.81Å; W132-V136 WeakPolarHBondContact O-CB 3.33Å; W132-V136 VanDerWaalsContact O-CG2 3.25Å; W132-V136 WeakPolarHBondContact O-CG2 3.41Å; W132-V136 PolarHBondContact O-N 2.82Å
133	E	80.9	Confident	86.6	Confident	96 Å²	96	87.9 Å²	87.9	45%	0.449	43%	0.431	S	S	.	.	H	α-helix	trans	-64.5	-33.4	-179.7	-61.7	79.3	-169.5	0	0	112.6	L131 R137	L131-E133 PolarHBondContact O-N 3.44Å; E133-R137 VanDerWaalsContact O-CB 3.28Å; E133-R137 WeakPolarHBondContact O-CB 3.47Å; E133-R137 PolarHBondContact O-N 3.34Å; E133-R137 VanDerWaalsContact O-N 3.09Å
134	E	85.3	Confident	87.2	Confident	98 Å²	98	87.1 Å²	87.1	46%	0.458	43%	0.428	S	S	.	.	H	α-helix	trans	-74	-46	178	-64.3	175.6	161.3	0	0	110.8	L131 W132 V136 R137 E138	L131-E134 HydrophobicContact CB-CB 4.43Å; L131-E134 HydrophobicContact CB-CG 4.06Å; L131-E134 WeakPolarHBondContact O-CB 3.46Å; L131-E134 PolarHBondContact O-N 3.04Å; W132-E134 VanDerWaalsContact C-N 3.29Å; W132-E134 PolarHBondContact O-N 3.04Å; E134-V136 PolarHBondContact O-N 3.27Å; E134-R137 WeakPolarHBondContact O-CB 3.47Å; E134-R137 PolarHBondContact O-N 2.8Å; E134-E138 PolarHBondContact O-N 2.95Å
135	A	84.6	Confident	87.8	Confident	13 Å²	13	92.6 Å²	92.6	11%	0.107	45%	0.451	C	S	.	.	H	α-helix	trans	-64	-39.3	177.2	0	0	0	0	0	112.2	F106 F130 L131 W132 C139	F106-A135 HydrophobicContact CB-CB 3.6Å; F106-A135 HydrophobicContact CD1-CB 3.75Å; F106-A135 HydrophobicContact CG-CB 3.77Å; F130-A135 HydrophobicContact CB-CB 4.41Å; L131-A135 PolarHBondContact O-N 2.81Å; W132-A135 PolarHBondContact O-N 3.42Å; A135-C139 VanDerWaalsContact O-CB 3.29Å; A135-C139 WeakPolarHBondContact O-CB 3.14Å; A135-C139 PolarHBondContact O-N 3.25Å
136	V	85.2	Confident	88.4	Confident	40 Å²	40	84.7 Å²	84.7	24%	0.242	43%	0.429	C	S	.	.	H	α-helix	trans	-64.4	-43.2	173.6	168.9	0	0	0	0	110.9	W132 E134 C139 Q140	W132-V136 HydrophobicContact CD2-CG2 3.71Å; W132-V136 HydrophobicContact CE3-CG2 3.83Å; W132-V136 HydrophobicContact CG-CG2 4.46Å; W132-V136 HydrophobicContact CH2-CG2 3.67Å; W132-V136 HydrophobicContact CZ2-CG2 3.54Å; W132-V136 HydrophobicContact CZ3-CG2 3.81Å; W132-V136 WeakPolarHBondContact O-CB 3.33Å; W132-V136 VanDerWaalsContact O-CG2 3.25Å; W132-V136 WeakPolarHBondContact O-CG2 3.41Å; W132-V136 PolarHBondContact O-N 2.82Å; E134-V136 PolarHBondContact O-N 3.27Å; V136-C139 PolarHBondContact O-N 3.18Å; V136-Q140 HydrophobicContact CG1-CG 4.27Å; V136-Q140 WeakPolarHBondContact O-CB 3.42Å; V136-Q140 VanDerWaalsContact O-CG 3.27Å; V136-Q140 WeakPolarHBondContact O-CG 3.44Å; V136-Q140 PolarHBondContact O-N 3.23Å
137	R	88.5	Confident	89.2	Confident	146 Å²	146	85 Å²	85	55%	0.551	41%	0.413	S	S	*	.	H	α-helix	trans	-62.3	-46.8	177.7	-167.4	-173	-45.2	-173.2	7.6	111.5	E133 E134 C139 Q140 E141	E133-R137 VanDerWaalsContact O-CB 3.28Å; E133-R137 WeakPolarHBondContact O-CB 3.47Å; E133-R137 PolarHBondContact O-N 3.34Å; E133-R137 VanDerWaalsContact O-N 3.09Å; E134-R137 WeakPolarHBondContact O-CB 3.47Å; E134-R137 PolarHBondContact O-N 2.8Å; R137-C139 VanDerWaalsContact C-N 3.33Å; R137-C139 PolarHBondContact O-N 2.91Å; R137-Q140 PolarHBondContact O-N 3.29Å; R137-E141 WeakPolarHBondContact O-CG 3.24Å; R137-E141 PolarHBondContact O-N 2.89Å
138	E	87.9	Confident	89.5	Confident	89 Å²	89	85.2 Å²	85.2	42%	0.416	42%	0.418	S	S	.	.	H	α-helix	trans	-60.3	-43	175.9	-172.1	-174.8	171.6	0	0	111.4	E134 E141 N142	E134-E138 PolarHBondContact O-N 2.95Å; E138-E141 PolarHBondContact O-N 3.47Å; E138-N142 WeakPolarHBondContact O-CB 3.41Å; E138-N142 VanDerWaalsContact O-CG 3.25Å; E138-N142 PolarHBondContact O-N 2.95Å; E138-N142 PolarHBondContact O-ND2 2.82Å
139	C	86	Confident	90.1	Very high	68 Å²	68	87.1 Å²	87.1	46%	0.459	42%	0.42	S	S	.	.	H	α-helix	trans	-62.7	-45.3	176.5	-173.7	0	0	0	0	112	A135 V136 R137 N142 L143	A135-C139 VanDerWaalsContact O-CB 3.29Å; A135-C139 WeakPolarHBondContact O-CB 3.14Å; A135-C139 PolarHBondContact O-N 3.25Å; V136-C139 PolarHBondContact O-N 3.18Å; R137-C139 VanDerWaalsContact C-N 3.33Å; R137-C139 PolarHBondContact O-N 2.91Å; C139-N142 PolarHBondContact O-N 2.86Å; C139-L143 WeakPolarHBondContact O-CB 3.39Å; C139-L143 WeakPolarHBondContact O-CG 3.37Å; C139-L143 PolarHBondContact O-N 2.94Å
140	Q	91.1	Very high	90.5	Very high	121 Å²	121	90 Å²	90	57%	0.565	43%	0.434	S	S	*	.	H	α-helix	trans	-61.8	-42.8	176.1	-75.4	175.4	-12.1	0	0	111.7	V136 R137 L143 Q144	V136-Q140 HydrophobicContact CG1-CG 4.27Å; V136-Q140 WeakPolarHBondContact O-CB 3.42Å; V136-Q140 VanDerWaalsContact O-CG 3.27Å; V136-Q140 WeakPolarHBondContact O-CG 3.44Å; V136-Q140 PolarHBondContact O-N 3.23Å; R137-Q140 PolarHBondContact O-N 3.29Å; Q140-L143 PolarHBondContact O-N 3.25Å; Q140-Q144 WeakPolarHBondContact O-CB 3.35Å; Q140-Q144 PolarHBondContact O-N 2.99Å
141	E	94.4	Very high	91.1	Very high	97 Å²	97	93.9 Å²	93.9	45%	0.453	45%	0.447	S	S	.	.	H	α-helix	trans	-62.3	-43.8	174.7	-75.5	-179.9	-162.7	0	0	112	R137 E138 Q144 K145	R137-E141 WeakPolarHBondContact O-CG 3.24Å; R137-E141 PolarHBondContact O-N 2.89Å; E138-E141 PolarHBondContact O-N 3.47Å; E141-Q144 PolarHBondContact O-N 3.08Å; E141-K145 WeakPolarHBondContact O-CB 3.17Å; E141-K145 VanDerWaalsContact O-CG 3.28Å; E141-K145 WeakPolarHBondContact O-CG 3.46Å; E141-K145 PolarHBondContact O-N 3Å
142	N	92.3	Very high	91.6	Very high	75 Å²	75	96 Å²	96	40%	0.401	45%	0.452	S	S	.	.	H	α-helix	trans	-65.2	-40.4	178	-74	-26.1	0	0	0	112	E138 C139 Q144 K145 A146	E138-N142 WeakPolarHBondContact O-CB 3.41Å; E138-N142 VanDerWaalsContact O-CG 3.25Å; E138-N142 PolarHBondContact O-N 2.95Å; E138-N142 PolarHBondContact O-ND2 2.82Å; C139-N142 PolarHBondContact O-N 2.86Å; N142-Q144 VanDerWaalsContact C-N 3.35Å; N142-K145 PolarHBondContact O-N 3.01Å; N142-A146 WeakPolarHBondContact O-CB 3.25Å; N142-A146 PolarHBondContact O-N 2.78Å
143	L	94.6	Very high	92.5	Very high	104 Å²	104	94.3 Å²	94.3	55%	0.545	45%	0.449	S	S	.	.	H	α-helix	trans	-61.4	-43.8	172	-76	171.7	0	0	0	111.2	C139 Q140 A146 L147	C139-L143 WeakPolarHBondContact O-CB 3.39Å; C139-L143 WeakPolarHBondContact O-CG 3.37Å; C139-L143 PolarHBondContact O-N 2.94Å; Q140-L143 PolarHBondContact O-N 3.25Å; L143-A146 PolarHBondContact O-N 2.96Å; L143-L147 WeakPolarHBondContact O-CB 3.31Å; L143-L147 WeakPolarHBondContact O-CG 3.45Å; L143-L147 PolarHBondContact O-N 3.2Å
144	Q	96	Very high	93.3	Very high	115 Å²	115	95.3 Å²	95.3	54%	0.537	45%	0.454	S	S	.	.	H	α-helix	trans	-66	-39.8	178.9	-157	73.2	-21	0	0	112	Q140 E141 N142 L147 T148	Q140-Q144 WeakPolarHBondContact O-CB 3.35Å; Q140-Q144 PolarHBondContact O-N 2.99Å; E141-Q144 PolarHBondContact O-N 3.08Å; N142-Q144 VanDerWaalsContact C-N 3.35Å; Q144-L147 PolarHBondContact O-N 3.03Å; Q144-T148 WeakPolarHBondContact O-CB 3.45Å; Q144-T148 PolarHBondContact O-N 3.34Å; Q144-T148 PolarHBondContact O-OG1 3.45Å
145	K	96.9	Very high	93.8	Very high	126 Å²	126	96.3 Å²	96.3	55%	0.548	46%	0.459	S	S	.	.	H	α-helix	trans	-60.7	-45.6	172.1	-73.3	168.8	-171.3	164.6	0	111	E141 N142 T148 R149	E141-K145 WeakPolarHBondContact O-CB 3.17Å; E141-K145 VanDerWaalsContact O-CG 3.28Å; E141-K145 WeakPolarHBondContact O-CG 3.46Å; E141-K145 PolarHBondContact O-N 3Å; N142-K145 PolarHBondContact O-N 3.01Å; K145-T148 PolarHBondContact O-N 3.47Å; K145-R149 WeakPolarHBondContact O-CB 3.18Å; K145-R149 PolarHBondContact O-N 3.39Å
146	A	96.5	Very high	94.5	Very high	33 Å²	33	100.9 Å²	100.9	27%	0.273	48%	0.476	S	S	.	.	H	α-helix	trans	-64	-45.1	178.1	0	0	0	0	0	112.2	N142 L143 R149 L150	N142-A146 WeakPolarHBondContact O-CB 3.25Å; N142-A146 PolarHBondContact O-N 2.78Å; L143-A146 PolarHBondContact O-N 2.96Å; A146-R149 PolarHBondContact O-N 3.44Å; A146-L150 WeakPolarHBondContact O-CG 3.47Å; A146-L150 PolarHBondContact O-N 3.33Å
147	L	97.6	Very high	95.1	Very high	81 Å²	81	102.7 Å²	102.7	42%	0.424	49%	0.487	S	S	.	.	H	α-helix	trans	-61.2	-44.6	176.1	-75.8	172.7	0	0	0	111.8	L143 Q144 R149 L150 R151	L143-L147 WeakPolarHBondContact O-CB 3.31Å; L143-L147 WeakPolarHBondContact O-CG 3.45Å; L143-L147 PolarHBondContact O-N 3.2Å; Q144-L147 PolarHBondContact O-N 3.03Å; L147-R149 VanDerWaalsContact C-N 3.33Å; L147-R149 PolarHBondContact O-N 3.07Å; L147-L150 PolarHBondContact O-N 3.21Å; L147-R151 WeakPolarHBondContact O-CG 3.32Å; L147-R151 PolarHBondContact O-N 2.94Å
148	T	97.6	Very high	95.5	Very high	65 Å²	65	101.2 Å²	101.2	40%	0.399	49%	0.486	S	S	.	.	H	α-helix	trans	-62.6	-42	177.6	-55.3	0	0	0	0	111.2	Q144 K145 K152	Q144-T148 WeakPolarHBondContact O-CB 3.45Å; Q144-T148 PolarHBondContact O-N 3.34Å; Q144-T148 PolarHBondContact O-OG1 3.45Å; K145-T148 PolarHBondContact O-N 3.47Å; T148-K152 WeakPolarHBondContact O-CG 3.47Å; T148-K152 PolarHBondContact O-N 3.45Å
149	R	98	Very high	95.9	Very high	156 Å²	156	100.8 Å²	100.8	59%	0.589	49%	0.49	S	S	*	.	H	α-helix	trans	-61.3	-49.3	174.6	-173.7	-173.5	71.4	-159	1.8	111.4	K145 A146 L147 R151 K152 E153	K145-R149 WeakPolarHBondContact O-CB 3.18Å; K145-R149 PolarHBondContact O-N 3.39Å; A146-R149 PolarHBondContact O-N 3.44Å; L147-R149 VanDerWaalsContact C-N 3.33Å; L147-R149 PolarHBondContact O-N 3.07Å; R149-R151 VanDerWaalsContact C-N 3.35Å; R149-R151 PolarHBondContact O-N 3Å; R149-K152 WeakPolarHBondContact O-CB 3.17Å; R149-K152 PolarHBondContact O-N 3.42Å; R149-E153 PolarHBondContact O-N 3.3Å
150	L	97.8	Very high	96.5	Very high	101 Å²	101	102.4 Å²	102.4	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-65.8	-35.5	-177.5	-71.4	174	0	0	0	112.7	A146 L147 E153 Q154	A146-L150 WeakPolarHBondContact O-CG 3.47Å; A146-L150 PolarHBondContact O-N 3.33Å; L147-L150 PolarHBondContact O-N 3.21Å; L150-E153 PolarHBondContact O-N 3.45Å; L150-Q154 PolarHBondContact O-N 3.35Å
151	R	97.4	Very high	96.8	Very high	148 Å²	148	101.4 Å²	101.4	56%	0.558	49%	0.489	S	S	*	.	H	α-helix	trans	-61.8	-41.9	172.3	-74.6	175.3	-179.4	161.2	0.4	112.1	L147 R149 E153 Q154 E155	L147-R151 WeakPolarHBondContact O-CG 3.32Å; L147-R151 PolarHBondContact O-N 2.94Å; R149-R151 VanDerWaalsContact C-N 3.35Å; R149-R151 PolarHBondContact O-N 3Å; R151-E153 PolarHBondContact O-N 2.99Å; R151-Q154 WeakPolarHBondContact O-CB 3.45Å; R151-Q154 PolarHBondContact O-N 2.9Å; R151-E155 PolarHBondContact O-N 3.33Å; R151-E155 VanDerWaalsContact O-N 3.07Å
152	K	97.4	Very high	97	Very high	126 Å²	126	99.3 Å²	99.3	55%	0.548	49%	0.488	S	S	.	.	H	α-helix	trans	-63.7	-39.2	173.7	-70.4	-179.2	178.9	-173.2	0	112.5	T148 R149 Q154 E155 K156	T148-K152 WeakPolarHBondContact O-CG 3.47Å; T148-K152 PolarHBondContact O-N 3.45Å; R149-K152 WeakPolarHBondContact O-CB 3.17Å; R149-K152 PolarHBondContact O-N 3.42Å; K152-Q154 VanDerWaalsContact C-N 3.31Å; K152-E155 PolarHBondContact O-N 2.84Å; K152-K156 WeakPolarHBondContact O-CG 3.41Å; K152-K156 PolarHBondContact O-N 3.04Å
153	E	97.1	Very high	97.3	Very high	83 Å²	83	99.2 Å²	99.2	39%	0.388	49%	0.488	S	S	.	.	H	α-helix	trans	-66.3	-34.8	174.4	-64.1	-52.2	131.9	0	0	111.8	R149 L150 R151 K156 V157	R149-E153 PolarHBondContact O-N 3.3Å; L150-E153 PolarHBondContact O-N 3.45Å; R151-E153 PolarHBondContact O-N 2.99Å; E153-K156 WeakPolarHBondContact O-CB 3.35Å; E153-K156 PolarHBondContact O-N 3.39Å; E153-K156 IonicContact OE1-NZ 3.97Å; E153-K156 PolarHBondContact OE1-NZ 3.46Å; E153-K156 WeakPolarHBondContact OE2-CD 3.41Å; E153-K156 IonicContact OE2-NZ 2.7Å; E153-K156 PolarHBondContact OE2-NZ 2.89Å; E153-V157 WeakPolarHBondContact O-CG2 3.46Å; E153-V157 PolarHBondContact O-N 3.07Å
154	Q	96.9	Very high	97.4	Very high	116 Å²	116	99.2 Å²	99.2	54%	0.542	49%	0.487	S	S	.	.	H	α-helix	trans	-63	-44.6	174.2	-175.6	177	3.8	0	0	112.1	L150 R151 K152 K156 V157 E158	L150-Q154 PolarHBondContact O-N 3.35Å; R151-Q154 WeakPolarHBondContact O-CB 3.45Å; R151-Q154 PolarHBondContact O-N 2.9Å; K152-Q154 VanDerWaalsContact C-N 3.31Å; Q154-K156 VanDerWaalsContact C-N 3.29Å; Q154-K156 PolarHBondContact O-N 3.04Å; Q154-V157 WeakPolarHBondContact O-CB 3.35Å; Q154-V157 PolarHBondContact O-N 3.31Å; Q154-V157 VanDerWaalsContact O-N 3.11Å; Q154-E158 PolarHBondContact O-N 3.5Å
155	E	97.1	Very high	97.5	Very high	120 Å²	120	98.4 Å²	98.4	56%	0.561	48%	0.482	S	S	*	.	H	α-helix	trans	-60	-38.4	175	-70.1	169.2	-174.7	0	0	112.1	R151 K152 E158 T159	R151-E155 PolarHBondContact O-N 3.33Å; R151-E155 VanDerWaalsContact O-N 3.07Å; K152-E155 PolarHBondContact O-N 2.84Å; E155-E158 PolarHBondContact O-N 2.94Å; E155-T159 PolarHBondContact O-N 3.35Å; E155-T159 PolarHBondContact O-OG1 2.74Å
156	K	97.8	Very high	97.6	Very high	109 Å²	109	98.8 Å²	98.8	47%	0.474	49%	0.485	S	S	.	.	H	α-helix	trans	-63.8	-39.9	173.4	-68.8	174.5	-174.3	171.4	0	112.4	K152 E153 Q154 E158 T159 L160	K152-K156 WeakPolarHBondContact O-CG 3.41Å; K152-K156 PolarHBondContact O-N 3.04Å; E153-K156 WeakPolarHBondContact O-CB 3.35Å; E153-K156 PolarHBondContact O-N 3.39Å; E153-K156 IonicContact OE1-NZ 3.97Å; E153-K156 PolarHBondContact OE1-NZ 3.46Å; E153-K156 WeakPolarHBondContact OE2-CD 3.41Å; E153-K156 IonicContact OE2-NZ 2.7Å; E153-K156 PolarHBondContact OE2-NZ 2.89Å; Q154-K156 VanDerWaalsContact C-N 3.29Å; Q154-K156 PolarHBondContact O-N 3.04Å; K156-E158 VanDerWaalsContact C-N 3.34Å; K156-T159 PolarHBondContact O-N 3.09Å; K156-L160 WeakPolarHBondContact O-CG 3.45Å; K156-L160 PolarHBondContact O-N 2.92Å
157	V	97.8	Very high	97.6	Very high	78 Å²	78	102.2 Å²	102.2	47%	0.473	50%	0.5	S	S	.	.	H	α-helix	trans	-61.5	-45.3	176.2	170.6	0	0	0	0	110.2	E153 Q154 T159 L160 E161	E153-V157 WeakPolarHBondContact O-CG2 3.46Å; E153-V157 PolarHBondContact O-N 3.07Å; Q154-V157 WeakPolarHBondContact O-CB 3.35Å; Q154-V157 PolarHBondContact O-N 3.31Å; Q154-V157 VanDerWaalsContact O-N 3.11Å; V157-T159 VanDerWaalsContact C-N 3.29Å; V157-T159 PolarHBondContact O-N 2.72Å; V157-L160 PolarHBondContact O-N 3.01Å; V157-E161 HydrophobicContact CG1-CG 4.38Å; V157-E161 WeakPolarHBondContact O-CB 3.45Å; V157-E161 WeakPolarHBondContact O-CG 3.35Å; V157-E161 PolarHBondContact O-N 3.43Å
158	E	97	Very high	97.6	Very high	114 Å²	114	104.7 Å²	104.7	53%	0.533	50%	0.503	S	S	.	.	H	α-helix	trans	-61.5	-38.6	177.7	-69.5	175.3	-173.3	0	0	112.2	Q154 E155 K156 E161 A162	Q154-E158 PolarHBondContact O-N 3.5Å; E155-E158 PolarHBondContact O-N 2.94Å; K156-E158 VanDerWaalsContact C-N 3.34Å; E158-E161 PolarHBondContact O-N 2.8Å; E158-A162 PolarHBondContact O-N 3.46Å; E158-A162 VanDerWaalsContact O-N 3.1Å
159	T	97.6	Very high	97.6	Very high	80 Å²	80	106.8 Å²	106.8	49%	0.491	51%	0.511	S	S	.	.	H	α-helix	trans	-64.7	-50.7	175.4	-53.1	0	0	0	0	111	E155 K156 V157 E161 A162 D163	E155-T159 PolarHBondContact O-N 3.35Å; E155-T159 PolarHBondContact O-OG1 2.74Å; K156-T159 PolarHBondContact O-N 3.09Å; V157-T159 VanDerWaalsContact C-N 3.29Å; V157-T159 PolarHBondContact O-N 2.72Å; T159-E161 VanDerWaalsContact C-N 3.29Å; T159-E161 PolarHBondContact O-N 3.49Å; T159-A162 WeakPolarHBondContact O-CA 3.49Å; T159-A162 WeakPolarHBondContact O-CB 3.19Å; T159-A162 PolarHBondContact O-N 2.99Å; T159-D163 PolarHBondContact O-N 3.44Å
160	L	98	Very high	97.6	Very high	102 Å²	102	102 Å²	102	53%	0.534	50%	0.502	S	S	.	.	H	α-helix	trans	-62.7	-35	178.2	-70.9	171.7	0	0	0	112.4	K156 V157 A162 D163 I164	K156-L160 WeakPolarHBondContact O-CG 3.45Å; K156-L160 PolarHBondContact O-N 2.92Å; V157-L160 PolarHBondContact O-N 3.01Å; L160-A162 VanDerWaalsContact C-N 3.32Å; L160-D163 PolarHBondContact O-N 3.01Å; L160-I164 WeakPolarHBondContact O-CB 3.31Å; L160-I164 VanDerWaalsContact O-CG1 3.23Å; L160-I164 WeakPolarHBondContact O-CG1 3.47Å; L160-I164 PolarHBondContact O-N 3.14Å
161	E	97.9	Very high	97.6	Very high	100 Å²	100	105.2 Å²	105.2	47%	0.467	51%	0.507	S	S	.	.	H	α-helix	trans	-64.6	-37.2	173.6	-79.3	-170	-179.7	0	0	112.4	V157 E158 T159 K165	V157-E161 HydrophobicContact CG1-CG 4.38Å; V157-E161 WeakPolarHBondContact O-CB 3.45Å; V157-E161 WeakPolarHBondContact O-CG 3.35Å; V157-E161 PolarHBondContact O-N 3.43Å; E158-E161 PolarHBondContact O-N 2.8Å; T159-E161 VanDerWaalsContact C-N 3.29Å; T159-E161 PolarHBondContact O-N 3.49Å; E161-K165 WeakPolarHBondContact O-CB 3.4Å; E161-K165 WeakPolarHBondContact O-CD 3.48Å; E161-K165 WeakPolarHBondContact O-CG 3.29Å; E161-K165 PolarHBondContact O-N 2.85Å; E161-K165 VanDerWaalsContact O-N 3.12Å; E161-K165 IonicContact OE2-NZ 3.2Å
162	A	97.8	Very high	97.6	Very high	53 Å²	53	104.5 Å²	104.5	44%	0.438	51%	0.508	S	S	.	.	H	α-helix	trans	-66.6	-46.6	174.4	0	0	0	0	0	110.6	E158 T159 L160 I164 K165 E166	E158-A162 PolarHBondContact O-N 3.46Å; E158-A162 VanDerWaalsContact O-N 3.1Å; T159-A162 WeakPolarHBondContact O-CA 3.49Å; T159-A162 WeakPolarHBondContact O-CB 3.19Å; T159-A162 PolarHBondContact O-N 2.99Å; L160-A162 VanDerWaalsContact C-N 3.32Å; A162-I164 PolarHBondContact O-N 2.82Å; A162-K165 WeakPolarHBondContact O-CB 3.41Å; A162-K165 PolarHBondContact O-N 3.36Å; A162-K165 VanDerWaalsContact O-N 3.1Å; A162-E166 PolarHBondContact O-N 3.33Å
163	D	98	Very high	97.6	Very high	74 Å²	74	102.4 Å²	102.4	40%	0.396	51%	0.508	S	S	.	.	H	α-helix	trans	-58	-48	177.6	-63.1	-17.5	0	0	0	111.2	T159 L160 K165 E166 D167	T159-D163 PolarHBondContact O-N 3.44Å; L160-D163 PolarHBondContact O-N 3.01Å; D163-K165 VanDerWaalsContact C-N 3.29Å; D163-K165 PolarHBondContact O-N 3.01Å; D163-E166 WeakPolarHBondContact O-CB 3.44Å; D163-E166 PolarHBondContact O-N 2.94Å; D163-E166 VanDerWaalsContact O-N 3.14Å; D163-D167 WeakPolarHBondContact O-CB 3.25Å; D163-D167 PolarHBondContact O-N 2.95Å
164	I	97.6	Very high	97.5	Very high	103 Å²	103	103.4 Å²	103.4	53%	0.528	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-36.2	177.7	-69	166.7	0	0	0	111.6	L160 A162 R168	L160-I164 WeakPolarHBondContact O-CB 3.31Å; L160-I164 VanDerWaalsContact O-CG1 3.23Å; L160-I164 WeakPolarHBondContact O-CG1 3.47Å; L160-I164 PolarHBondContact O-N 3.14Å; A162-I164 PolarHBondContact O-N 2.82Å; I164-R168 VanDerWaalsContact O-CB 3.3Å; I164-R168 WeakPolarHBondContact O-CB 3.47Å; I164-R168 PolarHBondContact O-N 2.85Å
165	K	98	Very high	97.4	Very high	99 Å²	99	101.4 Å²	101.4	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-66.8	-41.6	175.9	-75.8	164.9	-171.3	157.4	0	110.5	E161 A162 D163 L169	E161-K165 WeakPolarHBondContact O-CB 3.4Å; E161-K165 WeakPolarHBondContact O-CD 3.48Å; E161-K165 WeakPolarHBondContact O-CG 3.29Å; E161-K165 PolarHBondContact O-N 2.85Å; E161-K165 VanDerWaalsContact O-N 3.12Å; E161-K165 IonicContact OE2-NZ 3.2Å; A162-K165 WeakPolarHBondContact O-CB 3.41Å; A162-K165 PolarHBondContact O-N 3.36Å; A162-K165 VanDerWaalsContact O-N 3.1Å; D163-K165 VanDerWaalsContact C-N 3.29Å; D163-K165 PolarHBondContact O-N 3.01Å; K165-L169 WeakPolarHBondContact O-CG 3.39Å; K165-L169 PolarHBondContact O-N 3.35Å; K165-L169 VanDerWaalsContact O-N 3.14Å
166	E	98.1	Very high	97.5	Very high	133 Å²	133	99.5 Å²	99.5	62%	0.621	50%	0.499	S	S	*	.	H	α-helix	trans	-64.3	-50.3	175.7	-177.1	170.1	-174.6	0	0	111.3	A162 D163 R168 L169 S170	A162-E166 PolarHBondContact O-N 3.33Å; D163-E166 WeakPolarHBondContact O-CB 3.44Å; D163-E166 PolarHBondContact O-N 2.94Å; D163-E166 VanDerWaalsContact O-N 3.14Å; E166-R168 PolarHBondContact O-N 2.96Å; E166-L169 CarbonylContact O-C 3.58Å; E166-L169 WeakPolarHBondContact O-CA 3.33Å; E166-L169 WeakPolarHBondContact O-CB 3.28Å; E166-L169 PolarHBondContact O-N 2.79Å; E166-S170 WeakPolarHBondContact O-CB 3.4Å; E166-S170 PolarHBondContact O-N 2.9Å
167	D	97.7	Very high	97.4	Very high	106 Å²	106	97 Å²	97	57%	0.567	49%	0.494	S	S	*	.	H	α-helix	trans	-54.6	-42.6	176.3	-79.2	-16.7	0	0	0	111.6	D163 L169 S170 W171	D163-D167 WeakPolarHBondContact O-CB 3.25Å; D163-D167 PolarHBondContact O-N 2.95Å; D167-L169 PolarHBondContact O-N 2.79Å; D167-S170 PolarHBondContact O-N 3.37Å; D167-W171 VanDerWaalsContact O-CB 3.3Å; D167-W171 WeakPolarHBondContact O-CB 3.49Å; D167-W171 PolarHBondContact O-N 2.89Å
168	R	97.9	Very high	97.1	Very high	133 Å²	133	97.5 Å²	97.5	50%	0.502	49%	0.491	S	S	.	.	H	α-helix	trans	-64.3	-38.4	176.9	-176.6	175.9	64.3	-141.7	0.9	112.5	I164 E166 K172	I164-R168 VanDerWaalsContact O-CB 3.3Å; I164-R168 WeakPolarHBondContact O-CB 3.47Å; I164-R168 PolarHBondContact O-N 2.85Å; E166-R168 PolarHBondContact O-N 2.96Å; R168-K172 WeakPolarHBondContact O-CG 3.35Å; R168-K172 PolarHBondContact O-N 2.84Å
169	L	97.8	Very high	97.1	Very high	108 Å²	108	98.7 Å²	98.7	57%	0.565	49%	0.49	S	S	*	.	H	α-helix	trans	-70.7	-45.1	176.2	-70.4	172.5	0	0	0	110.7	K165 E166 D167 W171 K172 C173	K165-L169 WeakPolarHBondContact O-CG 3.39Å; K165-L169 PolarHBondContact O-N 3.35Å; K165-L169 VanDerWaalsContact O-N 3.14Å; E166-L169 CarbonylContact O-C 3.58Å; E166-L169 WeakPolarHBondContact O-CA 3.33Å; E166-L169 WeakPolarHBondContact O-CB 3.28Å; E166-L169 PolarHBondContact O-N 2.79Å; D167-L169 PolarHBondContact O-N 2.79Å; L169-W171 PolarHBondContact O-N 2.82Å; L169-K172 WeakPolarHBondContact O-CB 3.09Å; L169-K172 PolarHBondContact O-N 3.07Å; L169-C173 PolarHBondContact O-N 2.85Å; L169-C173 PolarHBondContact O-SG 2.97Å; L169-C173 VanDerWaalsContact O-SG 3.38Å
170	S	97.8	Very high	97.1	Very high	57 Å²	57	99.8 Å²	99.8	40%	0.399	49%	0.49	S	S	.	.	H	α-helix	trans	-56	-50.2	175.6	-179.1	0	0	0	0	111.4	E166 D167 K172 C173 Q174	E166-S170 WeakPolarHBondContact O-CB 3.4Å; E166-S170 PolarHBondContact O-N 2.9Å; D167-S170 PolarHBondContact O-N 3.37Å; S170-K172 PolarHBondContact O-N 2.9Å; S170-C173 WeakPolarHBondContact O-CB 3.37Å; S170-C173 PolarHBondContact O-N 3.46Å; S170-C173 VanDerWaalsContact O-N 3.11Å; S170-Q174 WeakPolarHBondContact O-CG 3.44Å; S170-Q174 PolarHBondContact O-N 3.34Å
171	W	96.9	Very high	96.9	Very high	167 Å²	167	102.3 Å²	102.3	63%	0.633	49%	0.492	S	S	*	.	H	α-helix	trans	-58.7	-43.9	176.4	179.3	-111.3	0	0	0	112.6	D167 L169 C173 Q174 V175	D167-W171 VanDerWaalsContact O-CB 3.3Å; D167-W171 WeakPolarHBondContact O-CB 3.49Å; D167-W171 PolarHBondContact O-N 2.89Å; L169-W171 PolarHBondContact O-N 2.82Å; W171-C173 VanDerWaalsContact C-N 3.32Å; W171-C173 PolarHBondContact O-N 2.98Å; W171-Q174 PolarHBondContact O-N 2.87Å; W171-V175 HydrophobicContact CD2-CG2 4.21Å; W171-V175 HydrophobicContact CZ2-CG2 3.94Å; W171-V175 WeakPolarHBondContact O-CG2 3.24Å; W171-V175 PolarHBondContact O-N 3.44Å
172	K	97.6	Very high	96.6	Very high	134 Å²	134	102.5 Å²	102.5	58%	0.583	50%	0.496	S	S	*	.	H	α-helix	trans	-60.3	-42.1	175	-79	-178.4	177.1	-173.8	0	111.9	R168 L169 S170 Q176	R168-K172 WeakPolarHBondContact O-CG 3.35Å; R168-K172 PolarHBondContact O-N 2.84Å; L169-K172 WeakPolarHBondContact O-CB 3.09Å; L169-K172 PolarHBondContact O-N 3.07Å; S170-K172 PolarHBondContact O-N 2.9Å; K172-Q176 WeakPolarHBondContact O-CB 3.48Å; K172-Q176 PolarHBondContact O-N 3.22Å
173	C	97	Very high	96.5	Very high	81 Å²	81	104.5 Å²	104.5	55%	0.547	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-41.4	176.2	-70.9	0	0	0	0	112.1	L169 S170 W171 Q176 T177	L169-C173 PolarHBondContact O-N 2.85Å; L169-C173 PolarHBondContact O-SG 2.97Å; L169-C173 VanDerWaalsContact O-SG 3.38Å; S170-C173 WeakPolarHBondContact O-CB 3.37Å; S170-C173 PolarHBondContact O-N 3.46Å; S170-C173 VanDerWaalsContact O-N 3.11Å; W171-C173 VanDerWaalsContact C-N 3.32Å; W171-C173 PolarHBondContact O-N 2.98Å; C173-Q176 PolarHBondContact O-N 2.86Å; C173-T177 WeakPolarHBondContact O-CB 3.39Å; C173-T177 PolarHBondContact O-N 3.24Å; C173-T177 PolarHBondContact O-OG1 2.96Å
174	Q	95	Very high	96.4	Very high	105 Å²	105	105.3 Å²	105.3	49%	0.491	50%	0.504	S	S	.	.	H	α-helix	trans	-60.6	-51.2	175.5	-72.9	179.6	-6.5	0	0	111.3	S170 W171 Q176 T177 E178	S170-Q174 WeakPolarHBondContact O-CG 3.44Å; S170-Q174 PolarHBondContact O-N 3.34Å; W171-Q174 PolarHBondContact O-N 2.87Å; Q174-Q176 VanDerWaalsContact C-N 3.3Å; Q174-Q176 PolarHBondContact O-N 2.79Å; Q174-T177 WeakPolarHBondContact O-CB 3.47Å; Q174-T177 PolarHBondContact O-N 3.02Å; Q174-T177 VanDerWaalsContact O-N 3.15Å; Q174-E178 PolarHBondContact O-N 2.74Å
175	V	96.1	Very high	96	Very high	73 Å²	73	101.9 Å²	101.9	44%	0.442	49%	0.493	S	S	.	.	H	α-helix	trans	-59.5	-41.5	178.3	172.2	0	0	0	0	111.5	W171 E178 R179	W171-V175 HydrophobicContact CD2-CG2 4.21Å; W171-V175 HydrophobicContact CZ2-CG2 3.94Å; W171-V175 WeakPolarHBondContact O-CG2 3.24Å; W171-V175 PolarHBondContact O-N 3.44Å; V175-E178 PolarHBondContact O-N 3.29Å; V175-R179 WeakPolarHBondContact O-CB 3.23Å; V175-R179 PolarHBondContact O-N 3.15Å
176	Q	97.6	Very high	95.7	Very high	80 Å²	80	102.6 Å²	102.6	37%	0.374	50%	0.496	S	S	.	.	H	α-helix	trans	-67.6	-37.9	178.3	-175.8	60.9	18.4	0	0	112.2	K172 C173 Q174 R179 Q180	K172-Q176 WeakPolarHBondContact O-CB 3.48Å; K172-Q176 PolarHBondContact O-N 3.22Å; C173-Q176 PolarHBondContact O-N 2.86Å; Q174-Q176 VanDerWaalsContact C-N 3.3Å; Q174-Q176 PolarHBondContact O-N 2.79Å; Q176-R179 PolarHBondContact O-N 3.3Å; Q176-Q180 WeakPolarHBondContact O-CG 3.3Å; Q176-Q180 PolarHBondContact O-N 3.35Å
177	T	95.5	Very high	95.6	Very high	58 Å²	58	99.7 Å²	99.7	36%	0.356	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-47	175	-58.8	0	0	0	0	110.6	C173 Q174 R179 Q180 R181	C173-T177 WeakPolarHBondContact O-CB 3.39Å; C173-T177 PolarHBondContact O-N 3.24Å; C173-T177 PolarHBondContact O-OG1 2.96Å; Q174-T177 WeakPolarHBondContact O-CB 3.47Å; Q174-T177 PolarHBondContact O-N 3.02Å; Q174-T177 VanDerWaalsContact O-N 3.15Å; T177-R179 VanDerWaalsContact C-N 3.34Å; T177-R179 PolarHBondContact O-N 3.45Å; T177-Q180 PolarHBondContact O-N 3.03Å; T177-Q180 VanDerWaalsContact O-N 3.16Å; T177-R181 WeakPolarHBondContact O-CG 3.46Å; T177-R181 PolarHBondContact O-N 3.2Å
178	E	93.1	Very high	95.4	Very high	87 Å²	87	100.4 Å²	100.4	41%	0.407	49%	0.485	S	S	.	.	H	α-helix	trans	-63.2	-39.6	176.8	-70.3	-49.7	133.1	0	0	112.2	Q174 V175 Q180 R181 I182	Q174-E178 PolarHBondContact O-N 2.74Å; V175-E178 PolarHBondContact O-N 3.29Å; E178-Q180 VanDerWaalsContact C-N 3.32Å; E178-Q180 PolarHBondContact O-N 3.34Å; E178-R181 WeakPolarHBondContact O-CB 3.24Å; E178-R181 PolarHBondContact O-N 2.86Å; E178-R181 WeakPolarHBondContact OE1-CD 3.28Å; E178-R181 IonicContact OE1-CZ 4Å; E178-R181 IonicContact OE1-NE 2.73Å; E178-R181 IonicContact OE1-NH1 3.42Å; E178-R181 PolarHBondContact OE1-NH1 2.83Å; E178-I182 VanDerWaalsContact O-CG1 3.31Å; E178-I182 WeakPolarHBondContact O-CG1 3.44Å; E178-I182 PolarHBondContact O-N 2.99Å
179	R	97.3	Very high	95.1	Very high	139 Å²	139	98.2 Å²	98.2	53%	0.525	48%	0.483	S	S	.	.	H	α-helix	trans	-57.3	-45.4	172.4	175.6	179.7	158.4	-177	-2.2	111.8	V175 Q176 T177 I182 Q183	V175-R179 WeakPolarHBondContact O-CB 3.23Å; V175-R179 PolarHBondContact O-N 3.15Å; Q176-R179 PolarHBondContact O-N 3.3Å; T177-R179 VanDerWaalsContact C-N 3.34Å; T177-R179 PolarHBondContact O-N 3.45Å; R179-I182 PolarHBondContact O-N 3.25Å; R179-Q183 VanDerWaalsContact O-CG 3.3Å; R179-Q183 WeakPolarHBondContact O-CG 3.47Å; R179-Q183 PolarHBondContact O-N 3.46Å
180	Q	96.6	Very high	94.9	Very high	104 Å²	104	100 Å²	100	49%	0.486	48%	0.482	S	S	.	.	H	α-helix	trans	-65.9	-39.3	177	-74.1	177.7	-20.8	0	0	112.2	Q176 T177 E178 Q183 T184	Q176-Q180 WeakPolarHBondContact O-CG 3.3Å; Q176-Q180 PolarHBondContact O-N 3.35Å; T177-Q180 PolarHBondContact O-N 3.03Å; T177-Q180 VanDerWaalsContact O-N 3.16Å; E178-Q180 VanDerWaalsContact C-N 3.32Å; E178-Q180 PolarHBondContact O-N 3.34Å; Q180-Q183 PolarHBondContact O-N 3.28Å; Q180-T184 VanDerWaalsContact O-CB 3.3Å; Q180-T184 WeakPolarHBondContact O-CB 2.99Å; Q180-T184 PolarHBondContact O-N 3.37Å; Q180-T184 PolarHBondContact O-OG1 3.01Å
181	R	94.1	Very high	94.8	Very high	155 Å²	155	105.7 Å²	105.7	59%	0.585	50%	0.495	S	S	*	.	H	α-helix	trans	-60.4	-48.5	175	-74.4	173.5	174.5	-176	-4.5	111.4	T177 E178 Q183 T184 G185	T177-R181 WeakPolarHBondContact O-CG 3.46Å; T177-R181 PolarHBondContact O-N 3.2Å; E178-R181 WeakPolarHBondContact O-CB 3.24Å; E178-R181 PolarHBondContact O-N 2.86Å; E178-R181 WeakPolarHBondContact OE1-CD 3.28Å; E178-R181 IonicContact OE1-CZ 4Å; E178-R181 IonicContact OE1-NE 2.73Å; E178-R181 IonicContact OE1-NH1 3.42Å; E178-R181 PolarHBondContact OE1-NH1 2.83Å; R181-Q183 PolarHBondContact O-N 3.35Å; R181-T184 PolarHBondContact O-N 3.02Å; R181-G185 PolarHBondContact O-N 2.94Å
182	I	91.1	Very high	94.5	Very high	104 Å²	104	101.7 Å²	101.7	53%	0.533	49%	0.485	S	S	.	.	H	α-helix	trans	-57.5	-52.1	176.2	-68	166.5	0	0	0	110.1	E178 R179 T184 G185 F186	E178-I182 VanDerWaalsContact O-CG1 3.31Å; E178-I182 WeakPolarHBondContact O-CG1 3.44Å; E178-I182 PolarHBondContact O-N 2.99Å; R179-I182 PolarHBondContact O-N 3.25Å; I182-T184 VanDerWaalsContact C-N 3.33Å; I182-T184 PolarHBondContact O-N 3.23Å; I182-G185 PolarHBondContact O-N 3.44Å; I182-F186 HydrophobicContact CG2-CD2 3.86Å; I182-F186 HydrophobicContact CG2-CE2 4.02Å; I182-F186 WeakPolarHBondContact O-CD2 3.5Å; I182-F186 PolarHBondContact O-N 3.19Å
183	Q	96.8	Very high	94.3	Very high	95 Å²	95	99.3 Å²	99.3	44%	0.444	48%	0.479	S	S	.	.	H	α-helix	trans	-59.7	-42.9	-179.6	-72.4	178	-26.7	0	0	112.4	R179 Q180 R181 N187	R179-Q183 VanDerWaalsContact O-CG 3.3Å; R179-Q183 WeakPolarHBondContact O-CG 3.47Å; R179-Q183 PolarHBondContact O-N 3.46Å; Q180-Q183 PolarHBondContact O-N 3.28Å; R181-Q183 PolarHBondContact O-N 3.35Å; Q183-N187 WeakPolarHBondContact O-CB 3.48Å; Q183-N187 PolarHBondContact O-N 2.95Å; Q183-N187 PolarHBondContact O-ND2 2.95Å
184	T	94.7	Very high	94.2	Very high	91 Å²	91	99.7 Å²	99.7	56%	0.558	48%	0.475	S	S	*	.	H	α-helix	trans	-64.5	-45.9	178.5	-57.4	0	0	0	0	111.2	Q180 R181 I182 F186 N187 Q188	Q180-T184 VanDerWaalsContact O-CB 3.3Å; Q180-T184 WeakPolarHBondContact O-CB 2.99Å; Q180-T184 PolarHBondContact O-N 3.37Å; Q180-T184 PolarHBondContact O-OG1 3.01Å; R181-T184 PolarHBondContact O-N 3.02Å; I182-T184 VanDerWaalsContact C-N 3.33Å; I182-T184 PolarHBondContact O-N 3.23Å; T184-F186 PolarHBondContact O-N 2.96Å; T184-N187 PolarHBondContact O-N 3.34Å; T184-Q188 PolarHBondContact O-N 3.28Å
185	G	90.2	Very high	94.2	Very high	30 Å²	30	101.7 Å²	101.7	31%	0.309	48%	0.482	S	S	.	.	H	α-helix	trans	-59.6	-46.5	177.1	0	0	0	0	0	112.6	R181 I182 N187 Q188 L189	R181-G185 PolarHBondContact O-N 2.94Å; I182-G185 PolarHBondContact O-N 3.44Å; G185-N187 PolarHBondContact O-N 3Å; G185-Q188 WeakPolarHBondContact O-CB 3.37Å; G185-Q188 PolarHBondContact O-N 3.33Å; G185-L189 WeakPolarHBondContact O-CG 3.42Å; G185-L189 PolarHBondContact O-N 2.85Å
186	F	91.8	Very high	94	Very high	114 Å²	114	101.9 Å²	101.9	50%	0.5	48%	0.478	S	S	.	.	H	α-helix	trans	-66.3	-35.9	176.6	-86.9	-84.3	0	0	0	113.1	I182 T184 Q188 L189 R190	I182-F186 HydrophobicContact CG2-CD2 3.86Å; I182-F186 HydrophobicContact CG2-CE2 4.02Å; I182-F186 WeakPolarHBondContact O-CD2 3.5Å; I182-F186 PolarHBondContact O-N 3.19Å; T184-F186 PolarHBondContact O-N 2.96Å; F186-Q188 VanDerWaalsContact C-N 3.31Å; F186-L189 HydrophobicContact CD1-CD1 4.49Å; F186-L189 PolarHBondContact O-N 3.47Å; F186-R190 WeakPolarHBondContact O-CG 3.42Å; F186-R190 PolarHBondContact O-N 3.49Å
187	N	95.2	Very high	93.7	Very high	73 Å²	73	103.4 Å²	103.4	39%	0.39	49%	0.485	S	S	.	.	H	α-helix	trans	-65.9	-35.7	174.2	-74.7	-21.6	0	0	0	112	Q183 T184 G185 R190 R191	Q183-N187 WeakPolarHBondContact O-CB 3.48Å; Q183-N187 PolarHBondContact O-N 2.95Å; Q183-N187 PolarHBondContact O-ND2 2.95Å; T184-N187 PolarHBondContact O-N 3.34Å; G185-N187 PolarHBondContact O-N 3Å; N187-R190 PolarHBondContact OD1-NH1 2.89Å; N187-R191 WeakPolarHBondContact O-CG 3.2Å; N187-R191 PolarHBondContact O-N 2.88Å; N187-R191 VanDerWaalsContact O-N 3.1Å
188	Q	93.8	Very high	93.7	Very high	121 Å²	121	105.7 Å²	105.7	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-65.1	-43.9	172.9	-175.8	175.9	3.8	0	0	111.6	T184 G185 F186 R190 R191 I192	T184-Q188 PolarHBondContact O-N 3.28Å; G185-Q188 WeakPolarHBondContact O-CB 3.37Å; G185-Q188 PolarHBondContact O-N 3.33Å; F186-Q188 VanDerWaalsContact C-N 3.31Å; Q188-R190 PolarHBondContact O-N 3.33Å; Q188-R191 PolarHBondContact O-N 3.42Å; Q188-I192 HydrophobicContact CG-CD1 4.26Å; Q188-I192 WeakPolarHBondContact O-CG1 3.46Å; Q188-I192 PolarHBondContact O-N 2.91Å
189	L	90.8	Very high	93.8	Very high	87 Å²	87	107.8 Å²	107.8	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-59.5	-45.8	176.1	-70.2	173.8	0	0	0	111.9	G185 F186 R191 I192 L193	G185-L189 WeakPolarHBondContact O-CG 3.42Å; G185-L189 PolarHBondContact O-N 2.85Å; F186-L189 HydrophobicContact CD1-CD1 4.49Å; F186-L189 PolarHBondContact O-N 3.47Å; L189-R191 PolarHBondContact O-N 2.93Å; L189-I192 PolarHBondContact O-N 3.27Å; L189-I192 VanDerWaalsContact O-N 3.13Å; L189-L193 WeakPolarHBondContact O-CG 3.49Å; L189-L193 PolarHBondContact O-N 3.02Å
190	R	93.9	Very high	93.5	Very high	144 Å²	144	103.6 Å²	103.6	54%	0.543	48%	0.483	S	S	.	.	H	α-helix	trans	-55.9	-49.2	174.5	-71.1	171.3	-172	148.8	-2.3	111.5	F186 N187 Q188 I192 L193 D194	F186-R190 WeakPolarHBondContact O-CG 3.42Å; F186-R190 PolarHBondContact O-N 3.49Å; N187-R190 PolarHBondContact OD1-NH1 2.89Å; Q188-R190 PolarHBondContact O-N 3.33Å; R190-I192 VanDerWaalsContact C-N 3.25Å; R190-I192 PolarHBondContact O-N 3.45Å; R190-L193 PolarHBondContact O-N 2.9Å; R190-L193 VanDerWaalsContact O-N 3.08Å; R190-D194 PolarHBondContact O-N 3.14Å
191	R	95.6	Very high	93.4	Very high	178 Å²	178	102 Å²	102	67%	0.672	48%	0.477	S	S	*	.	H	α-helix	trans	-58.5	-34.7	177.2	-72.5	173.4	179.6	178.8	0.2	113.5	N187 Q188 L189 K195	N187-R191 WeakPolarHBondContact O-CG 3.2Å; N187-R191 PolarHBondContact O-N 2.88Å; N187-R191 VanDerWaalsContact O-N 3.1Å; Q188-R191 PolarHBondContact O-N 3.42Å; L189-R191 PolarHBondContact O-N 2.93Å; R191-K195 WeakPolarHBondContact O-CB 3.43Å; R191-K195 VanDerWaalsContact O-CG 3.26Å; R191-K195 WeakPolarHBondContact O-CG 3.39Å; R191-K195 PolarHBondContact O-N 3.12Å
192	I	91.9	Very high	93.4	Very high	83 Å²	83	100 Å²	100	43%	0.426	47%	0.473	S	S	.	.	H	α-helix	trans	-69.1	-47.6	175.9	-67.9	165.5	0	0	0	109.6	Q188 L189 R190 D194 K195 E196	Q188-I192 HydrophobicContact CG-CD1 4.26Å; Q188-I192 WeakPolarHBondContact O-CG1 3.46Å; Q188-I192 PolarHBondContact O-N 2.91Å; L189-I192 PolarHBondContact O-N 3.27Å; L189-I192 VanDerWaalsContact O-N 3.13Å; R190-I192 VanDerWaalsContact C-N 3.25Å; R190-I192 PolarHBondContact O-N 3.45Å; I192-D194 PolarHBondContact O-N 3.39Å; I192-K195 WeakPolarHBondContact O-CB 2.83Å; I192-K195 PolarHBondContact O-N 3.24Å; I192-K195 VanDerWaalsContact O-N 3.17Å; I192-E196 PolarHBondContact O-N 2.65Å
193	L	92.1	Very high	93.4	Very high	84 Å²	84	100 Å²	100	44%	0.44	47%	0.466	S	S	.	.	H	α-helix	trans	-60.7	-44.5	178.3	-66.5	173.9	0	0	0	111.7	L189 R190 K195 E196 E197 L282	L189-L193 WeakPolarHBondContact O-CG 3.49Å; L189-L193 PolarHBondContact O-N 3.02Å; R190-L193 PolarHBondContact O-N 2.9Å; R190-L193 VanDerWaalsContact O-N 3.08Å; L193-K195 VanDerWaalsContact C-N 3.27Å; L193-K195 PolarHBondContact O-N 3.36Å; L193-E196 PolarHBondContact O-N 3.05Å; L193-E197 WeakPolarHBondContact O-CB 3.4Å; L193-E197 PolarHBondContact O-N 3.16Å; L193-L282 HydrophobicContact CD1-CD1 4.17Å; L193-L282 HydrophobicContact CD2-CD1 3.74Å
194	D	95.6	Very high	93.1	Very high	88 Å²	88	99.3 Å²	99.3	47%	0.471	47%	0.465	S	S	.	.	H	α-helix	trans	-58.7	-41.4	175.9	-60	-21.5	0	0	0	110.8	R190 I192 Q198	R190-D194 PolarHBondContact O-N 3.14Å; I192-D194 PolarHBondContact O-N 3.39Å; D194-Q198 WeakPolarHBondContact O-CB 3.37Å; D194-Q198 VanDerWaalsContact O-CG 3.24Å; D194-Q198 WeakPolarHBondContact O-CG 3.17Å; D194-Q198 PolarHBondContact O-N 2.88Å
195	K	94.5	Very high	93	Very high	147 Å²	147	100.9 Å²	100.9	64%	0.639	46%	0.46	S	S	*	.	H	α-helix	trans	-66.4	-42.1	177.4	-78.5	176.9	179.3	-173.7	0	112.6	R191 I192 L193 Q198 R199	R191-K195 WeakPolarHBondContact O-CB 3.43Å; R191-K195 VanDerWaalsContact O-CG 3.26Å; R191-K195 WeakPolarHBondContact O-CG 3.39Å; R191-K195 PolarHBondContact O-N 3.12Å; I192-K195 WeakPolarHBondContact O-CB 2.83Å; I192-K195 PolarHBondContact O-N 3.24Å; I192-K195 VanDerWaalsContact O-N 3.17Å; L193-K195 VanDerWaalsContact C-N 3.27Å; L193-K195 PolarHBondContact O-N 3.36Å; K195-Q198 PolarHBondContact O-N 2.89Å; K195-R199 WeakPolarHBondContact O-CB 3.48Å; K195-R199 PolarHBondContact O-N 3.04Å
196	E	91.4	Very high	93.1	Very high	78 Å²	78	104.2 Å²	104.2	36%	0.364	47%	0.468	S	S	.	.	H	α-helix	trans	-68.3	-40.4	178	-68.9	-50.9	131.7	0	0	111.3	I192 L193 Q198 R199 E200	I192-E196 PolarHBondContact O-N 2.65Å; L193-E196 PolarHBondContact O-N 3.05Å; E196-Q198 PolarHBondContact O-N 2.92Å; E196-R199 WeakPolarHBondContact O-CB 3.4Å; E196-R199 PolarHBondContact O-N 2.91Å; E196-R199 IonicContact OE1-CZ 3.52Å; E196-R199 IonicContact OE1-NE 3.72Å; E196-R199 PolarHBondContact OE1-NE 3.22Å; E196-R199 IonicContact OE1-NH2 3.93Å; E196-R199 PolarHBondContact OE1-NH2 2.79Å; E196-R199 IonicContact OE2-CZ 3.71Å; E196-R199 IonicContact OE2-NE 2.67Å; E196-R199 PolarHBondContact OE2-NE 2.86Å; E196-R199 IonicContact OE2-NH2 2.82Å; E196-E200 WeakPolarHBondContact O-CG 3.37Å; E196-E200 PolarHBondContact O-N 3.39Å
197	E	93	Very high	93.1	Very high	112 Å²	112	100 Å²	100	52%	0.523	45%	0.45	S	S	.	.	H	α-helix	trans	-57.2	-49.5	171.4	-178.7	-178.1	-160.5	0	0	111.3	L193 R199 E200 L201	L193-E197 WeakPolarHBondContact O-CB 3.4Å; L193-E197 PolarHBondContact O-N 3.16Å; E197-R199 VanDerWaalsContact C-N 3.29Å; E197-R199 PolarHBondContact O-N 2.84Å; E197-E200 PolarHBondContact O-N 3.15Å; E197-L201 HydrophobicContact CG-CD1 4.03Å; E197-L201 HydrophobicContact CG-CG 4.48Å; E197-L201 WeakPolarHBondContact O-CB 3.34Å; E197-L201 WeakPolarHBondContact O-CG 3.44Å; E197-L201 PolarHBondContact O-N 2.86Å
198	Q	95.6	Very high	92.8	Very high	105 Å²	105	102 Å²	102	49%	0.491	46%	0.457	S	S	.	.	H	α-helix	trans	-64	-33.8	178.8	-69.8	-56.8	-33.2	0	0	113	D194 K195 E196 K202	D194-Q198 WeakPolarHBondContact O-CB 3.37Å; D194-Q198 VanDerWaalsContact O-CG 3.24Å; D194-Q198 WeakPolarHBondContact O-CG 3.17Å; D194-Q198 PolarHBondContact O-N 2.88Å; K195-Q198 PolarHBondContact O-N 2.89Å; E196-Q198 PolarHBondContact O-N 2.92Å; Q198-K202 WeakPolarHBondContact O-CB 3.48Å; Q198-K202 PolarHBondContact O-N 2.85Å
199	R	93.6	Very high	92.8	Very high	131 Å²	131	101 Å²	101	49%	0.494	45%	0.452	S	S	.	.	H	α-helix	trans	-63.6	-48.7	175.2	-174.7	-160.5	-56.4	-83.6	-0.2	110.8	K195 E196 E197 K202 R203	K195-R199 WeakPolarHBondContact O-CB 3.48Å; K195-R199 PolarHBondContact O-N 3.04Å; E196-R199 WeakPolarHBondContact O-CB 3.4Å; E196-R199 PolarHBondContact O-N 2.91Å; E196-R199 IonicContact OE1-CZ 3.52Å; E196-R199 IonicContact OE1-NE 3.72Å; E196-R199 PolarHBondContact OE1-NE 3.22Å; E196-R199 IonicContact OE1-NH2 3.93Å; E196-R199 PolarHBondContact OE1-NH2 2.79Å; E196-R199 IonicContact OE2-CZ 3.71Å; E196-R199 IonicContact OE2-NE 2.67Å; E196-R199 PolarHBondContact OE2-NE 2.86Å; E196-R199 IonicContact OE2-NH2 2.82Å; E197-R199 VanDerWaalsContact C-N 3.29Å; E197-R199 PolarHBondContact O-N 2.84Å; R199-K202 PolarHBondContact O-N 2.9Å; R199-R203 PolarHBondContact O-N 3.36Å
200	E	91.4	Very high	92.8	Very high	52 Å²	52	103.1 Å²	103.1	24%	0.243	46%	0.461	C	S	.	.	H	α-helix	trans	-67.6	-42	-178.9	-66.2	-54.2	127.3	0	0	111.8	E196 E197 K202 R203 L204 F277	E196-E200 WeakPolarHBondContact O-CG 3.37Å; E196-E200 PolarHBondContact O-N 3.39Å; E197-E200 PolarHBondContact O-N 3.15Å; E200-K202 VanDerWaalsContact C-N 3.34Å; E200-K202 PolarHBondContact O-N 2.82Å; E200-R203 PolarHBondContact O-N 3.23Å; E200-R203 IonicContact OE1-CZ 3.81Å; E200-R203 IonicContact OE1-NE 3.69Å; E200-R203 IonicContact OE1-NH2 3.24Å; E200-R203 PolarHBondContact OE1-NH2 3.34Å; E200-R203 IonicContact OE2-CZ 3.46Å; E200-R203 IonicContact OE2-NE 3.91Å; E200-R203 IonicContact OE2-NH2 3.17Å; E200-L204 PolarHBondContact O-N 3.02Å; E200-F277 HydrophobicContact CB-CD2 4.26Å; E200-F277 HydrophobicContact CG-CD2 3.87Å; E200-F277 HydrophobicContact CG-CE2 3.9Å
201	L	93.6	Very high	92.6	Very high	70 Å²	70	98.4 Å²	98.4	37%	0.366	45%	0.446	S	S	.	.	H	α-helix	trans	-63.4	-38.8	174.2	-70.6	175.9	0	0	0	112.6	E197 L204 R205	E197-L201 HydrophobicContact CG-CD1 4.03Å; E197-L201 HydrophobicContact CG-CG 4.48Å; E197-L201 WeakPolarHBondContact O-CB 3.34Å; E197-L201 WeakPolarHBondContact O-CG 3.44Å; E197-L201 PolarHBondContact O-N 2.86Å; L201-L204 PolarHBondContact O-N 2.76Å; L201-R205 WeakPolarHBondContact O-CG 3.23Å; L201-R205 PolarHBondContact O-N 2.85Å; L201-R205 VanDerWaalsContact O-N 3.07Å
202	K	94.3	Very high	92.4	Very high	114 Å²	114	94.1 Å²	94.1	50%	0.496	44%	0.436	S	S	.	.	H	α-helix	trans	-63.9	-46.1	176.2	179.1	176.8	168.5	178.1	0	111.1	Q198 R199 E200 L204 R205 E206	Q198-K202 WeakPolarHBondContact O-CB 3.48Å; Q198-K202 PolarHBondContact O-N 2.85Å; R199-K202 PolarHBondContact O-N 2.9Å; E200-K202 VanDerWaalsContact C-N 3.34Å; E200-K202 PolarHBondContact O-N 2.82Å; K202-L204 VanDerWaalsContact C-N 3.28Å; K202-L204 PolarHBondContact O-N 3.4Å; K202-R205 PolarHBondContact O-N 3.29Å; K202-E206 WeakPolarHBondContact CE-OE1 3.28Å; K202-E206 IonicContact NZ-OE1 2.8Å; K202-E206 WeakPolarHBondContact O-CG 3.2Å; K202-E206 PolarHBondContact O-N 3.32Å
203	R	91.3	Very high	92.4	Very high	102 Å²	102	94.6 Å²	94.6	39%	0.385	44%	0.44	S	S	.	.	H	α-helix	trans	-57.8	-43.2	177.4	-166.6	-166	-50.7	-139.8	6.6	111.4	R199 E200 E206 E207	R199-R203 PolarHBondContact O-N 3.36Å; E200-R203 PolarHBondContact O-N 3.23Å; E200-R203 IonicContact OE1-CZ 3.81Å; E200-R203 IonicContact OE1-NE 3.69Å; E200-R203 IonicContact OE1-NH2 3.24Å; E200-R203 PolarHBondContact OE1-NH2 3.34Å; E200-R203 IonicContact OE2-CZ 3.46Å; E200-R203 IonicContact OE2-NE 3.91Å; E200-R203 IonicContact OE2-NH2 3.17Å; R203-E206 PolarHBondContact O-N 3.23Å; R203-E207 PolarHBondContact O-N 2.97Å
204	L	91.6	Very high	92.3	Very high	81 Å²	81	93.5 Å²	93.5	42%	0.424	44%	0.439	S	S	.	.	H	α-helix	trans	-63.6	-43.3	177.6	-175.7	61.9	0	0	0	112.2	E200 L201 K202 E206 E207 E208 L273	E200-L204 PolarHBondContact O-N 3.02Å; L201-L204 PolarHBondContact O-N 2.76Å; K202-L204 VanDerWaalsContact C-N 3.28Å; K202-L204 PolarHBondContact O-N 3.4Å; L204-E206 VanDerWaalsContact C-N 3.33Å; L204-E206 PolarHBondContact O-N 2.81Å; L204-E207 PolarHBondContact O-N 3.35Å; L204-E208 WeakPolarHBondContact O-CB 3.36Å; L204-E208 PolarHBondContact O-N 2.97Å; L204-L273 HydrophobicContact CD1-CD2 3.72Å
205	R	92.8	Very high	92.1	Very high	125 Å²	125	92.7 Å²	92.7	47%	0.472	43%	0.434	S	S	.	.	H	α-helix	trans	-62.1	-39.2	175.4	-74.1	-171.7	-63.1	-94.4	1.9	112.6	L201 K202 E208 Q209	L201-R205 WeakPolarHBondContact O-CG 3.23Å; L201-R205 PolarHBondContact O-N 2.85Å; L201-R205 VanDerWaalsContact O-N 3.07Å; K202-R205 PolarHBondContact O-N 3.29Å; R205-E208 PolarHBondContact O-N 3.44Å; R205-Q209 WeakPolarHBondContact O-CB 3.45Å; R205-Q209 PolarHBondContact O-N 3.34Å
206	E	92.4	Very high	92	Very high	99 Å²	99	88.1 Å²	88.1	46%	0.463	42%	0.424	S	S	.	.	H	α-helix	trans	-65.5	-42.6	177.2	-71.9	170.3	172.3	0	0	111.3	K202 R203 L204 Q209 M210	K202-E206 WeakPolarHBondContact CE-OE1 3.28Å; K202-E206 IonicContact NZ-OE1 2.8Å; K202-E206 WeakPolarHBondContact O-CG 3.2Å; K202-E206 PolarHBondContact O-N 3.32Å; R203-E206 PolarHBondContact O-N 3.23Å; L204-E206 VanDerWaalsContact C-N 3.33Å; L204-E206 PolarHBondContact O-N 2.81Å; E206-Q209 PolarHBondContact O-N 3Å; E206-M210 WeakPolarHBondContact O-CG 3.49Å; E206-M210 PolarHBondContact O-N 3.06Å
207	E	90.1	Very high	92.1	Very high	27 Å²	27	86.5 Å²	86.5	13%	0.126	43%	0.428	C	S	.	.	H	α-helix	trans	-65.6	-42.5	175.3	-172.1	171.1	-176.3	0	0	112.1	R203 L204 M210 I211 S274	R203-E207 PolarHBondContact O-N 2.97Å; L204-E207 PolarHBondContact O-N 3.35Å; E207-M210 PolarHBondContact O-N 2.74Å; E207-I211 HydrophobicContact CG-CD1 4.12Å; E207-I211 WeakPolarHBondContact O-CG1 3.48Å; E207-I211 PolarHBondContact O-N 3.49Å; E207-S274 WeakPolarHBondContact OE1-CB 3.49Å; E207-S274 PolarHBondContact OE1-N 2.95Å; E207-S274 PolarHBondContact OE1-OG 3.36Å; E207-S274 PolarHBondContact OE2-OG 2.85Å; E207-S274 VanDerWaalsContact OE2-OG 3.08Å
208	E	90.3	Very high	92	Very high	113 Å²	113	82.1 Å²	82.1	53%	0.528	41%	0.411	S	S	.	.	H	α-helix	trans	-56.6	-50.7	173.2	178.5	177.7	-152.8	0	0	111.2	L204 R205 M210 I211 L212	L204-E208 WeakPolarHBondContact O-CB 3.36Å; L204-E208 PolarHBondContact O-N 2.97Å; R205-E208 PolarHBondContact O-N 3.44Å; E208-M210 PolarHBondContact O-N 2.82Å; E208-I211 PolarHBondContact O-N 3.47Å; E208-L212 HydrophobicContact CG-CD1 3.97Å; E208-L212 HydrophobicContact CG-CG 4.45Å; E208-L212 WeakPolarHBondContact O-CG 3.42Å; E208-L212 PolarHBondContact O-N 3.4Å
209	Q	92.6	Very high	91.9	Very high	101 Å²	101	83.7 Å²	83.7	47%	0.472	42%	0.418	S	S	.	.	H	α-helix	trans	-61.4	-45	179.9	-171.8	63.8	54	0	0	111.9	R205 E206 I211 L212 D213	R205-Q209 WeakPolarHBondContact O-CB 3.45Å; R205-Q209 PolarHBondContact O-N 3.34Å; E206-Q209 PolarHBondContact O-N 3Å; Q209-I211 VanDerWaalsContact C-N 3.3Å; Q209-I211 PolarHBondContact O-N 3.47Å; Q209-L212 PolarHBondContact O-N 3.17Å; Q209-D213 PolarHBondContact NE2-OD1 3.49Å; Q209-D213 WeakPolarHBondContact O-CB 3.44Å; Q209-D213 VanDerWaalsContact O-CG 3.24Å; Q209-D213 PolarHBondContact O-N 2.95Å
210	M	90.5	Very high	91.9	Very high	131 Å²	131	79.9 Å²	79.9	65%	0.645	42%	0.415	S	S	*	.	H	α-helix	trans	-60.2	-39.4	177.8	-75.3	-163.1	-59	0	0	112.5	E206 E207 E208 S214	E206-M210 WeakPolarHBondContact O-CG 3.49Å; E206-M210 PolarHBondContact O-N 3.06Å; E207-M210 PolarHBondContact O-N 2.74Å; E208-M210 PolarHBondContact O-N 2.82Å; M210-S214 WeakPolarHBondContact O-CB 3.37Å; M210-S214 PolarHBondContact O-N 2.83Å; M210-S214 VanDerWaalsContact O-N 3.16Å
211	I	89.8	Confident	92	Very high	46 Å²	46	81.4 Å²	81.4	24%	0.236	42%	0.422	C	S	.	.	H	α-helix	trans	-68.8	-45.2	177.4	-68.3	169.9	0	0	0	110.4	E207 E208 Q209 S214 L215 V269	E207-I211 HydrophobicContact CG-CD1 4.12Å; E207-I211 WeakPolarHBondContact O-CG1 3.48Å; E207-I211 PolarHBondContact O-N 3.49Å; E208-I211 PolarHBondContact O-N 3.47Å; Q209-I211 VanDerWaalsContact C-N 3.3Å; Q209-I211 PolarHBondContact O-N 3.47Å; I211-S214 PolarHBondContact O-N 3.08Å; I211-L215 HydrophobicContact CG2-CD1 4Å; I211-L215 HydrophobicContact CG2-CG 4.45Å; I211-L215 WeakPolarHBondContact O-CG 3.39Å; I211-L215 PolarHBondContact O-N 3.23Å; I211-V269 HydrophobicContact CG2-CG1 4.18Å
212	L	91.9	Very high	92	Very high	88 Å²	88	81.9 Å²	81.9	46%	0.461	42%	0.424	S	S	.	.	H	α-helix	trans	-61.1	-44.5	178.4	-71.9	175.5	0	0	0	112	E208 Q209 S214 L215 A216	E208-L212 HydrophobicContact CG-CD1 3.97Å; E208-L212 HydrophobicContact CG-CG 4.45Å; E208-L212 WeakPolarHBondContact O-CG 3.42Å; E208-L212 PolarHBondContact O-N 3.4Å; Q209-L212 PolarHBondContact O-N 3.17Å; L212-S214 VanDerWaalsContact C-N 3.32Å; L212-S214 PolarHBondContact O-N 3.19Å; L212-L215 PolarHBondContact O-N 2.98Å; L212-A216 WeakPolarHBondContact O-CB 3.42Å; L212-A216 PolarHBondContact O-N 3.13Å
213	D	92.4	Very high	92	Very high	93 Å²	93	79.4 Å²	79.4	50%	0.497	43%	0.425	S	S	.	.	H	α-helix	trans	-62.4	-40.7	177.6	-69.1	-18.8	0	0	0	111.4	Q209 L215 A216 G217	Q209-D213 PolarHBondContact NE2-OD1 3.49Å; Q209-D213 WeakPolarHBondContact O-CB 3.44Å; Q209-D213 VanDerWaalsContact O-CG 3.24Å; Q209-D213 PolarHBondContact O-N 2.95Å; D213-L215 VanDerWaalsContact C-N 3.33Å; D213-L215 PolarHBondContact O-N 2.79Å; D213-A216 PolarHBondContact O-N 3.4Å; D213-G217 PolarHBondContact O-N 3.32Å
214	S	90.3	Very high	92.1	Very high	60 Å²	60	80.7 Å²	80.7	42%	0.42	44%	0.435	S	S	.	.	H	α-helix	trans	-66.6	-34.5	176.3	-173.3	0	0	0	0	112.7	M210 I211 L212 A218 V269	M210-S214 WeakPolarHBondContact O-CB 3.37Å; M210-S214 PolarHBondContact O-N 2.83Å; M210-S214 VanDerWaalsContact O-N 3.16Å; I211-S214 PolarHBondContact O-N 3.08Å; L212-S214 VanDerWaalsContact C-N 3.32Å; L212-S214 PolarHBondContact O-N 3.19Å; S214-A218 PolarHBondContact O-N 3.03Å; S214-V269 VanDerWaalsContact OG-CG2 3.26Å; S214-V269 WeakPolarHBondContact OG-CG2 3.41Å
215	L	90.8	Very high	92.2	Very high	71 Å²	71	77.9 Å²	77.9	37%	0.372	42%	0.42	S	S	.	.	H	α-helix	trans	-72	-45	176	-72.1	171.8	0	0	0	111.2	I211 L212 D213 G217 A218 E219 V269	I211-L215 HydrophobicContact CG2-CD1 4Å; I211-L215 HydrophobicContact CG2-CG 4.45Å; I211-L215 WeakPolarHBondContact O-CG 3.39Å; I211-L215 PolarHBondContact O-N 3.23Å; L212-L215 PolarHBondContact O-N 2.98Å; D213-L215 VanDerWaalsContact C-N 3.33Å; D213-L215 PolarHBondContact O-N 2.79Å; L215-G217 VanDerWaalsContact C-N 3.26Å; L215-G217 PolarHBondContact O-N 2.78Å; L215-A218 WeakPolarHBondContact O-CB 3.49Å; L215-A218 PolarHBondContact O-N 3.32Å; L215-E219 WeakPolarHBondContact O-CG 3.3Å; L215-E219 PolarHBondContact O-N 3.14Å; L215-V269 HydrophobicContact CD2-CB 4.07Å; L215-V269 HydrophobicContact CD2-CG2 3.94Å; L215-V269 HydrophobicContact CG-CG2 4.45Å
216	A	93.3	Very high	92.3	Very high	52 Å²	52	74.6 Å²	74.6	43%	0.43	42%	0.416	S	S	.	.	H	α-helix	trans	-58.3	-39.5	175.5	0	0	0	0	0	111.7	L212 D213 E219 A220	L212-A216 WeakPolarHBondContact O-CB 3.42Å; L212-A216 PolarHBondContact O-N 3.13Å; D213-A216 PolarHBondContact O-N 3.4Å; A216-E219 PolarHBondContact O-N 3.48Å; A216-A220 WeakPolarHBondContact O-CB 3.32Å; A216-A220 PolarHBondContact O-N 3.33Å
217	G	92	Very high	92.4	Very high	43 Å²	43	75.2 Å²	75.2	44%	0.443	42%	0.419	S	S	.	.	H	α-helix	trans	-62.1	-41.3	172.8	0	0	0	0	0	113.3	D213 L215 A220 E221	D213-G217 PolarHBondContact O-N 3.32Å; L215-G217 VanDerWaalsContact C-N 3.26Å; L215-G217 PolarHBondContact O-N 2.78Å; G217-A220 PolarHBondContact O-N 3.3Å; G217-E221 PolarHBondContact O-N 3Å
218	A	91.6	Very high	92.5	Very high	20 Å²	20	78.6 Å²	78.6	17%	0.165	44%	0.437	C	S	.	.	H	α-helix	trans	-68.7	-37.1	176.7	0	0	0	0	0	112.6	S214 L215 L222 P266	S214-A218 PolarHBondContact O-N 3.03Å; L215-A218 WeakPolarHBondContact O-CB 3.49Å; L215-A218 PolarHBondContact O-N 3.32Å; A218-L222 WeakPolarHBondContact O-CB 3.26Å; A218-L222 PolarHBondContact O-N 3.17Å; A218-P266 HydrophobicContact CB-CB 3.75Å; A218-P266 HydrophobicContact CB-CG 4.48Å
219	E	92.6	Very high	92.6	Very high	139 Å²	139	74.8 Å²	74.8	65%	0.65	42%	0.422	S	S	*	.	H	α-helix	trans	-64	-43.8	173.6	-72.7	176.4	169.8	0	0	111.3	L215 A216 L222 A223	L215-E219 WeakPolarHBondContact O-CG 3.3Å; L215-E219 PolarHBondContact O-N 3.14Å; A216-E219 PolarHBondContact O-N 3.48Å; E219-L222 PolarHBondContact O-N 3.28Å; E219-A223 WeakPolarHBondContact O-CB 3.3Å; E219-A223 PolarHBondContact O-N 2.83Å
220	A	94.1	Very high	92.6	Very high	50 Å²	50	75.4 Å²	75.4	41%	0.413	43%	0.425	S	S	.	.	H	α-helix	trans	-63.7	-41.7	176.8	0	0	0	0	0	112.5	A216 G217 L222 A223 Q224	A216-A220 WeakPolarHBondContact O-CB 3.32Å; A216-A220 PolarHBondContact O-N 3.33Å; G217-A220 PolarHBondContact O-N 3.3Å; A220-L222 VanDerWaalsContact C-N 3.32Å; A220-L222 PolarHBondContact O-N 2.8Å; A220-A223 PolarHBondContact O-N 2.82Å; A220-Q224 WeakPolarHBondContact O-CG 3.33Å; A220-Q224 PolarHBondContact O-N 2.67Å
221	E	93.5	Very high	92.7	Very high	85 Å²	85	74.1 Å²	74.1	40%	0.397	42%	0.417	S	S	.	.	H	α-helix	trans	-61.6	-41.4	174.7	-174.3	-179.1	-178.2	0	0	111.4	G217 Q225	G217-E221 PolarHBondContact O-N 3Å; E221-Q225 WeakPolarHBondContact O-CG 3.33Å; E221-Q225 PolarHBondContact O-N 2.83Å; E221-Q225 VanDerWaalsContact O-N 3.12Å
222	L	93.9	Very high	92.7	Very high	80 Å²	80	73.4 Å²	73.4	42%	0.419	41%	0.414	S	S	.	.	H	α-helix	trans	-68.7	-39.5	178	-169.8	65.5	0	0	0	111.9	A218 E219 A220 Q225 S226 L263 P266	A218-L222 WeakPolarHBondContact O-CB 3.26Å; A218-L222 PolarHBondContact O-N 3.17Å; E219-L222 PolarHBondContact O-N 3.28Å; A220-L222 VanDerWaalsContact C-N 3.32Å; A220-L222 PolarHBondContact O-N 2.8Å; L222-Q225 PolarHBondContact O-N 2.81Å; L222-S226 PolarHBondContact O-N 3Å; L222-L263 HydrophobicContact CD1-CD1 4.07Å; L222-P266 HydrophobicContact CB-CG 4.38Å
223	A	94.4	Very high	92.7	Very high	61 Å²	61	73.1 Å²	73.1	50%	0.504	41%	0.412	S	S	.	.	H	α-helix	trans	-61.4	-43.3	176.2	0	0	0	0	0	111.8	E219 A220 Q225 S226 Q227	E219-A223 WeakPolarHBondContact O-CB 3.3Å; E219-A223 PolarHBondContact O-N 2.83Å; A220-A223 PolarHBondContact O-N 2.82Å; A223-Q225 PolarHBondContact O-N 3.44Å; A223-S226 WeakPolarHBondContact O-CB 3.34Å; A223-S226 PolarHBondContact O-N 2.86Å; A223-Q227 PolarHBondContact O-N 3.12Å
224	Q	93.6	Very high	92.7	Very high	130 Å²	130	72 Å²	72	61%	0.607	41%	0.411	S	S	*	.	H	α-helix	trans	-62.1	-42.8	174.7	-72.2	177	7.7	0	0	112.1	A220 S226 Q227 L228	A220-Q224 WeakPolarHBondContact O-CG 3.33Å; A220-Q224 PolarHBondContact O-N 2.67Å; Q224-S226 VanDerWaalsContact C-N 3.35Å; Q224-Q227 PolarHBondContact O-N 3.45Å; Q224-L228 WeakPolarHBondContact O-CG 3.38Å; Q224-L228 PolarHBondContact O-N 3.08Å; Q224-L228 VanDerWaalsContact O-N 3.13Å
225	Q	93.8	Very high	92.6	Very high	21 Å²	21	71.3 Å²	71.3	10%	0.098	40%	0.403	C	S	.	.	H	α-helix	trans	-64.7	-38.4	175.7	-72.8	-174.7	62.8	0	0	112.2	E221 L222 A223 L228 V229 L263 K264	E221-Q225 WeakPolarHBondContact O-CG 3.33Å; E221-Q225 PolarHBondContact O-N 2.83Å; E221-Q225 VanDerWaalsContact O-N 3.12Å; L222-Q225 PolarHBondContact O-N 2.81Å; A223-Q225 PolarHBondContact O-N 3.44Å; Q225-L228 PolarHBondContact O-N 2.68Å; Q225-V229 VanDerWaalsContact O-CG2 3.3Å; Q225-V229 WeakPolarHBondContact O-CG2 3.21Å; Q225-V229 PolarHBondContact O-N 3Å; Q225-V229 VanDerWaalsContact O-N 3.15Å; Q225-L263 HydrophobicContact CB-CD1 4.31Å; Q225-K264 PolarHBondContact NE2-O 3.37Å; Q225-K264 VanDerWaalsContact NE2-O 3.08Å; Q225-K264 PolarHBondContact OE1-O 2.89Å
226	S	94.1	Very high	92.5	Very high	56 Å²	56	70.4 Å²	70.4	39%	0.392	40%	0.398	S	S	.	.	H	α-helix	trans	-60.5	-47.7	175.8	-162.3	0	0	0	0	111.2	L222 A223 Q224 L228 V229 E230	L222-S226 PolarHBondContact O-N 3Å; A223-S226 WeakPolarHBondContact O-CB 3.34Å; A223-S226 PolarHBondContact O-N 2.86Å; Q224-S226 VanDerWaalsContact C-N 3.35Å; S226-L228 PolarHBondContact O-N 3.21Å; S226-V229 PolarHBondContact O-N 2.65Å; S226-V229 VanDerWaalsContact O-N 3.16Å; S226-E230 WeakPolarHBondContact O-CG 3.45Å; S226-E230 PolarHBondContact O-N 3.5Å; S226-E230 PolarHBondContact OG-OE1 2.9Å
227	Q	94.7	Very high	92.4	Very high	112 Å²	112	73.9 Å²	73.9	52%	0.523	41%	0.405	S	S	.	.	H	α-helix	trans	-60.4	-45.2	179.2	-173.8	-178.3	-13.8	0	0	111.9	A223 Q224 V229 E230 E231	A223-Q227 PolarHBondContact O-N 3.12Å; Q224-Q227 PolarHBondContact O-N 3.45Å; Q227-V229 VanDerWaalsContact C-N 3.25Å; Q227-V229 PolarHBondContact O-N 2.92Å; Q227-E230 PolarHBondContact O-N 3.28Å; Q227-E231 PolarHBondContact NE2-OE1 2.88Å; Q227-E231 WeakPolarHBondContact O-CG 3.28Å; Q227-E231 PolarHBondContact O-N 2.9Å
228	L	91.9	Very high	92.2	Very high	98 Å²	98	76.9 Å²	76.9	51%	0.513	41%	0.411	S	S	.	.	H	α-helix	trans	-61.1	-34.9	177.7	-71.1	171.5	0	0	0	112.6	Q224 Q225 S226 L232	Q224-L228 WeakPolarHBondContact O-CG 3.38Å; Q224-L228 PolarHBondContact O-N 3.08Å; Q224-L228 VanDerWaalsContact O-N 3.13Å; Q225-L228 PolarHBondContact O-N 2.68Å; S226-L228 PolarHBondContact O-N 3.21Å; L228-L232 WeakPolarHBondContact O-CB 3.17Å; L228-L232 PolarHBondContact O-N 2.95Å; L228-L232 VanDerWaalsContact O-N 3.09Å
229	V	92.9	Very high	92	Very high	33 Å²	33	77.5 Å²	77.5	20%	0.2	41%	0.409	C	S	.	.	H	α-helix	trans	-72	-44.1	175.9	173.6	0	0	0	0	111.3	Q225 S226 Q227 E231 L232 I233 W261	Q225-V229 VanDerWaalsContact O-CG2 3.3Å; Q225-V229 WeakPolarHBondContact O-CG2 3.21Å; Q225-V229 PolarHBondContact O-N 3Å; Q225-V229 VanDerWaalsContact O-N 3.15Å; S226-V229 PolarHBondContact O-N 2.65Å; S226-V229 VanDerWaalsContact O-N 3.16Å; Q227-V229 VanDerWaalsContact C-N 3.25Å; Q227-V229 PolarHBondContact O-N 2.92Å; V229-E231 VanDerWaalsContact C-N 3.3Å; V229-E231 PolarHBondContact O-N 3.34Å; V229-L232 PolarHBondContact O-N 3.19Å; V229-I233 HydrophobicContact CG1-CD1 3.61Å; V229-I233 HydrophobicContact CG1-CG1 4.14Å; V229-I233 WeakPolarHBondContact O-CB 3.24Å; V229-I233 VanDerWaalsContact O-CG1 3.26Å; V229-I233 WeakPolarHBondContact O-CG1 3.48Å; V229-I233 PolarHBondContact O-N 2.85Å; V229-W261 HydrophobicContact CB-CH2 4.45Å; V229-W261 HydrophobicContact CB-CZ2 4.42Å; V229-W261 HydrophobicContact CG2-CD2 3.84Å; V229-W261 HydrophobicContact CG2-CE3 3.93Å; V229-W261 HydrophobicContact CG2-CH2 3.04Å; V229-W261 HydrophobicContact CG2-CZ2 2.91Å; V229-W261 HydrophobicContact CG2-CZ3 3.55Å
230	E	93.6	Very high	91.7	Very high	114 Å²	114	80.3 Å²	80.3	53%	0.533	41%	0.413	S	S	.	.	H	α-helix	trans	-59.9	-42.3	177	-75.8	169.4	-155.4	0	0	111.2	S226 Q227 I233 S234	S226-E230 WeakPolarHBondContact O-CG 3.45Å; S226-E230 PolarHBondContact O-N 3.5Å; S226-E230 PolarHBondContact OG-OE1 2.9Å; Q227-E230 PolarHBondContact O-N 3.28Å; E230-I233 PolarHBondContact O-N 2.92Å; E230-S234 WeakPolarHBondContact O-CB 3.49Å; E230-S234 PolarHBondContact O-N 3.43Å; E230-S234 PolarHBondContact O-OG 3.26Å
231	E	91.6	Very high	91.4	Very high	104 Å²	104	85.2 Å²	85.2	49%	0.486	43%	0.428	S	S	.	.	H	α-helix	trans	-62.2	-44.5	174.1	-73.4	173.6	-167.3	0	0	111.5	Q227 V229 S234 D235	Q227-E231 PolarHBondContact NE2-OE1 2.88Å; Q227-E231 WeakPolarHBondContact O-CG 3.28Å; Q227-E231 PolarHBondContact O-N 2.9Å; V229-E231 VanDerWaalsContact C-N 3.3Å; V229-E231 PolarHBondContact O-N 3.34Å; E231-S234 PolarHBondContact O-N 2.89Å; E231-D235 PolarHBondContact O-N 2.98Å
232	L	90.4	Very high	91.2	Very high	32 Å²	32	85 Å²	85	17%	0.168	42%	0.423	C	S	.	.	H	α-helix	trans	-65.9	-41.1	177.7	-178.9	62.6	0	0	0	112.6	L228 V229 L236 I254 W261	L228-L232 WeakPolarHBondContact O-CB 3.17Å; L228-L232 PolarHBondContact O-N 2.95Å; L228-L232 VanDerWaalsContact O-N 3.09Å; V229-L232 PolarHBondContact O-N 3.19Å; L232-L236 HydrophobicContact CG-CD1 4.37Å; L232-L236 VanDerWaalsContact O-CG 3.29Å; L232-L236 WeakPolarHBondContact O-CG 3.39Å; L232-L236 PolarHBondContact O-N 3.26Å; L232-L236 VanDerWaalsContact O-N 3.09Å; L232-I254 HydrophobicContact CD1-CD1 3.72Å; L232-I254 HydrophobicContact CD1-CG1 4.11Å; L232-W261 HydrophobicContact CD2-CB 4.21Å; L232-W261 HydrophobicContact CD2-CG 4.44Å
233	I	91.3	Very high	90.8	Very high	81 Å²	81	83.8 Å²	83.8	42%	0.415	42%	0.422	S	S	.	.	H	α-helix	trans	-61.9	-48.2	174.7	-71.4	170.5	0	0	0	109.4	V229 E230 D235 L236 E237	V229-I233 HydrophobicContact CG1-CD1 3.61Å; V229-I233 HydrophobicContact CG1-CG1 4.14Å; V229-I233 WeakPolarHBondContact O-CB 3.24Å; V229-I233 VanDerWaalsContact O-CG1 3.26Å; V229-I233 WeakPolarHBondContact O-CG1 3.48Å; V229-I233 PolarHBondContact O-N 2.85Å; E230-I233 PolarHBondContact O-N 2.92Å; I233-D235 VanDerWaalsContact C-N 3.33Å; I233-D235 PolarHBondContact O-N 2.99Å; I233-L236 PolarHBondContact O-N 3.26Å; I233-E237 HydrophobicContact CG2-CG 4.29Å; I233-E237 WeakPolarHBondContact O-CG 3.26Å; I233-E237 PolarHBondContact O-N 3.33Å
234	S	92.3	Very high	90.4	Very high	69 Å²	69	87.3 Å²	87.3	48%	0.483	43%	0.432	S	S	.	.	H	α-helix	trans	-61.1	-41.1	-179.3	-58.1	0	0	0	0	112.1	E230 E231 E237 L238	E230-S234 WeakPolarHBondContact O-CB 3.49Å; E230-S234 PolarHBondContact O-N 3.43Å; E230-S234 PolarHBondContact O-OG 3.26Å; E231-S234 PolarHBondContact O-N 2.89Å; S234-E237 PolarHBondContact O-N 3.26Å; S234-L238 WeakPolarHBondContact O-CB 3.49Å; S234-L238 PolarHBondContact O-N 2.99Å
235	D	89.1	Confident	89.8	Confident	46 Å²	46	85.6 Å²	85.6	25%	0.246	43%	0.431	C	S	.	.	H	α-helix	trans	-66	-39.9	177	-167.7	70	0	0	0	111.8	E231 I233 L238 R239 I254	E231-D235 PolarHBondContact O-N 2.98Å; I233-D235 VanDerWaalsContact C-N 3.33Å; I233-D235 PolarHBondContact O-N 2.99Å; D235-L238 PolarHBondContact O-N 3.49Å; D235-R239 WeakPolarHBondContact O-CB 3.46Å; D235-R239 VanDerWaalsContact O-CG 3.29Å; D235-R239 WeakPolarHBondContact O-CG 3.4Å; D235-R239 PolarHBondContact O-N 3.1Å; D235-R239 IonicContact OD1-NE 3.28Å; D235-R239 IonicContact OD1-NH2 2.88Å; D235-R239 IonicContact OD2-CZ 3.47Å; D235-R239 IonicContact OD2-NE 2.74Å; D235-R239 PolarHBondContact OD2-NE 3.23Å; D235-R239 IonicContact OD2-NH2 3.4Å; D235-R239 PolarHBondContact OD2-NH2 3.21Å; D235-I254 HydrophobicContact CB-CD1 4.39Å; D235-I254 WeakPolarHBondContact OD2-CD1 3.38Å; D235-I254 WeakPolarHBondContact OD2-CG1 3.19Å
236	L	88.4	Confident	89.3	Confident	52 Å²	52	89.3 Å²	89.3	27%	0.272	45%	0.448	S	S	.	.	H	α-helix	trans	-66.3	-39.8	174.6	-71.4	171.7	0	0	0	112.4	L232 I233 R240 I254	L232-L236 HydrophobicContact CG-CD1 4.37Å; L232-L236 VanDerWaalsContact O-CG 3.29Å; L232-L236 WeakPolarHBondContact O-CG 3.39Å; L232-L236 PolarHBondContact O-N 3.26Å; L232-L236 VanDerWaalsContact O-N 3.09Å; I233-L236 PolarHBondContact O-N 3.26Å; L236-R240 PolarHBondContact O-N 3.47Å; L236-R240 VanDerWaalsContact O-N 3.11Å; L236-I254 HydrophobicContact CD2-CG1 3.82Å; L236-I254 HydrophobicContact CD2-CG2 3.99Å; L236-I254 HydrophobicContact CG-CG1 4.33Å
237	E	90.2	Very high	88.7	Confident	125 Å²	125	88.9 Å²	88.9	58%	0.584	44%	0.441	S	S	*	.	H	α-helix	trans	-64.5	-41.5	175.3	-74.4	-179.7	162.2	0	0	111.8	I233 S234 R240	I233-E237 HydrophobicContact CG2-CG 4.29Å; I233-E237 WeakPolarHBondContact O-CG 3.26Å; I233-E237 PolarHBondContact O-N 3.33Å; S234-E237 PolarHBondContact O-N 3.26Å; E237-R240 WeakPolarHBondContact O-CB 3.46Å; E237-R240 PolarHBondContact O-N 3.44Å
238	L	88.9	Confident	87.9	Confident	107 Å²	107	91.1 Å²	91.1	56%	0.56	46%	0.456	S	S	*	.	H	α-helix	trans	-64	-47.3	176.6	-176.9	70.3	0	0	0	111.8	S234 D235 R240 E241 W242	S234-L238 WeakPolarHBondContact O-CB 3.49Å; S234-L238 PolarHBondContact O-N 2.99Å; D235-L238 PolarHBondContact O-N 3.49Å; L238-R240 PolarHBondContact O-N 3.02Å; L238-E241 PolarHBondContact O-N 2.91Å; L238-W242 VanDerWaalsContact O-CD1 3.26Å
239	R	87.1	Confident	87.4	Confident	33 Å²	33	94 Å²	94	13%	0.125	47%	0.467	C	S	.	.	H	α-helix	trans	-67.2	-22.4	-179.5	-70.8	177.7	-169.3	-108.5	-2.4	113.2	D235 E241 W242 D250 M251	D235-R239 WeakPolarHBondContact O-CB 3.46Å; D235-R239 VanDerWaalsContact O-CG 3.29Å; D235-R239 WeakPolarHBondContact O-CG 3.4Å; D235-R239 PolarHBondContact O-N 3.1Å; D235-R239 IonicContact OD1-NE 3.28Å; D235-R239 IonicContact OD1-NH2 2.88Å; D235-R239 IonicContact OD2-CZ 3.47Å; D235-R239 IonicContact OD2-NE 2.74Å; D235-R239 PolarHBondContact OD2-NE 3.23Å; D235-R239 IonicContact OD2-NH2 3.4Å; D235-R239 PolarHBondContact OD2-NH2 3.21Å; R239-E241 PolarHBondContact O-N 3.28Å; R239-W242 HydrophobicContact CB-CD2 4.24Å; R239-W242 HydrophobicContact CB-CE3 4.48Å; R239-W242 HydrophobicContact CG-CD2 4.04Å; R239-W242 HydrophobicContact CG-CE3 4.15Å; R239-W242 HydrophobicContact CG-CH2 3.87Å; R239-W242 HydrophobicContact CG-CZ2 3.72Å; R239-W242 HydrophobicContact CG-CZ3 4.08Å; R239-W242 WeakPolarHBondContact O-CB 3.27Å; R239-W242 PolarHBondContact O-N 2.78Å; R239-D250 IonicContact CZ-OD2 3.61Å; R239-D250 PolarHBondContact NH1-O 3.29Å; R239-D250 VanDerWaalsContact NH1-O 3.07Å; R239-D250 IonicContact NH1-OD2 2.76Å; R239-D250 PolarHBondContact NH1-OD2 2.95Å; R239-D250 IonicContact NH2-OD2 3.6Å; R239-M251 HydrophobicContact CB-SD 4.24Å
240	R	85.4	Confident	86.7	Confident	197 Å²	197	96.5 Å²	96.5	74%	0.743	48%	0.479	S	S	*	.	H	α-helix	trans	-62.1	-29.2	174.4	-174.4	-177.4	174.5	-143.5	-4.3	112.6	L236 E237 L238	L236-R240 PolarHBondContact O-N 3.47Å; L236-R240 VanDerWaalsContact O-N 3.11Å; E237-R240 WeakPolarHBondContact O-CB 3.46Å; E237-R240 PolarHBondContact O-N 3.44Å; L238-R240 PolarHBondContact O-N 3.02Å
241	E	89.4	Confident	86	Confident	153 Å²	153	92.8 Å²	92.8	72%	0.715	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	3.5	-179.6	-60	-64.6	147.3	0	0	113.1	L238 R239	L238-E241 PolarHBondContact O-N 2.91Å; R239-E241 PolarHBondContact O-N 3.28Å
242	W	88.1	Confident	85.3	Confident	81 Å²	81	92.8 Å²	92.8	31%	0.307	47%	0.473	S	S	.	.	S	Bend	trans	-73.6	163.8	179.8	-72.4	9.6	0	0	0	112.9	L238 R239 E246 L247 D250	L238-W242 VanDerWaalsContact O-CD1 3.26Å; R239-W242 HydrophobicContact CB-CD2 4.24Å; R239-W242 HydrophobicContact CB-CE3 4.48Å; R239-W242 HydrophobicContact CG-CD2 4.04Å; R239-W242 HydrophobicContact CG-CE3 4.15Å; R239-W242 HydrophobicContact CG-CH2 3.87Å; R239-W242 HydrophobicContact CG-CZ2 3.72Å; R239-W242 HydrophobicContact CG-CZ3 4.08Å; R239-W242 WeakPolarHBondContact O-CB 3.27Å; R239-W242 PolarHBondContact O-N 2.78Å; W242-E246 HydrophobicContact CB-CB 4.19Å; W242-E246 HydrophobicContact CD2-CB 4.31Å; W242-E246 HydrophobicContact CE3-CB 3.75Å; W242-E246 HydrophobicContact CZ3-CB 4.47Å; W242-L247 HydrophobicContact CB-CD1 4.24Å; W242-L247 HydrophobicContact CB-CG 4.27Å; W242-L247 WeakPolarHBondContact O-CD1 3.46Å; W242-D250 HydrophobicContact CZ3-CB 4.28Å
243	S	86.5	Confident	85	Confident	54 Å²	54	93 Å²	93	38%	0.378	48%	0.483	S	S	.	.			trans	-72.4	155.7	172.9	70.1	0	0	0	0	112.2	T245 E246 L247	S243-T245 PolarHBondContact O-N 3.03Å; S243-T245 VanDerWaalsContact O-N 3.09Å; S243-E246 WeakPolarHBondContact CB-OE2 3.2Å; S243-E246 PolarHBondContact N-OE2 3.06Å; S243-E246 PolarHBondContact O-N 2.7Å; S243-E246 VanDerWaalsContact OG-CD 3.24Å; S243-E246 WeakPolarHBondContact OG-CG 3.36Å; S243-E246 PolarHBondContact OG-OE2 2.97Å; S243-L247 PolarHBondContact O-N 3.01Å; S243-L247 VanDerWaalsContact O-N 3.11Å
244	D	84.8	Confident	84.6	Confident	135 Å²	135	90.3 Å²	90.3	72%	0.722	47%	0.469	S	S	*	.	H	α-helix	trans	-52.3	-36.5	-178.1	-66.7	-19.3	0	0	0	113.3	L248	D244-L248 WeakPolarHBondContact O-CG 3.33Å; D244-L248 PolarHBondContact O-N 2.9Å
245	T	82.3	Confident	84.2	Confident	95 Å²	95	90.6 Å²	90.6	58%	0.583	47%	0.465	S	S	*	.	H	α-helix	trans	-70.3	-38.3	-179.6	-16.2	0	0	0	0	112.8	S243 Q249	S243-T245 PolarHBondContact O-N 3.03Å; S243-T245 VanDerWaalsContact O-N 3.09Å; T245-Q249 WeakPolarHBondContact O-CG 3.33Å; T245-Q249 PolarHBondContact O-N 2.85Å
246	E	82.1	Confident	84	Confident	98 Å²	98	94.8 Å²	94.8	46%	0.458	48%	0.481	S	S	.	.	H	α-helix	trans	-74.6	-40.2	-179	-68.4	163.9	141.7	0	0	111.2	W242 S243 L248 Q249 D250	W242-E246 HydrophobicContact CB-CB 4.19Å; W242-E246 HydrophobicContact CD2-CB 4.31Å; W242-E246 HydrophobicContact CE3-CB 3.75Å; W242-E246 HydrophobicContact CZ3-CB 4.47Å; S243-E246 WeakPolarHBondContact CB-OE2 3.2Å; S243-E246 PolarHBondContact N-OE2 3.06Å; S243-E246 PolarHBondContact O-N 2.7Å; S243-E246 VanDerWaalsContact OG-CD 3.24Å; S243-E246 WeakPolarHBondContact OG-CG 3.36Å; S243-E246 PolarHBondContact OG-OE2 2.97Å; E246-L248 VanDerWaalsContact C-N 3.3Å; E246-L248 PolarHBondContact O-N 2.8Å; E246-Q249 PolarHBondContact O-N 2.82Å; E246-D250 PolarHBondContact O-N 2.93Å
247	L	80.9	Confident	83.7	Confident	48 Å²	48	101.1 Å²	101.1	25%	0.251	50%	0.501	S	S	.	.	H	α-helix	trans	-56.2	-43.4	173.1	-93.7	140.9	0	0	0	111.8	W242 S243 Q249 M251	W242-L247 HydrophobicContact CB-CD1 4.24Å; W242-L247 HydrophobicContact CB-CG 4.27Å; W242-L247 WeakPolarHBondContact O-CD1 3.46Å; S243-L247 PolarHBondContact O-N 3.01Å; S243-L247 VanDerWaalsContact O-N 3.11Å; L247-Q249 PolarHBondContact O-N 3.12Å; L247-M251 HydrophobicContact CB-CG 4.4Å; L247-M251 HydrophobicContact CD2-CE 4.27Å; L247-M251 HydrophobicContact CD2-CG 3.79Å; L247-M251 HydrophobicContact CD2-SD 4.14Å; L247-M251 HydrophobicContact CG-CG 4.47Å; L247-M251 WeakPolarHBondContact O-CB 3.42Å; L247-M251 WeakPolarHBondContact O-CG 3.33Å; L247-M251 PolarHBondContact O-N 3.3Å
248	L	79.7	Confident	83.4	Confident	158 Å²	158	97.1 Å²	97.1	83%	0.827	49%	0.488	S	S	*	.	H	α-helix	trans	-72.8	-24.8	-177.7	-71.5	172.3	0	0	0	113.8	D244 E246	D244-L248 WeakPolarHBondContact O-CG 3.33Å; D244-L248 PolarHBondContact O-N 2.9Å; E246-L248 VanDerWaalsContact C-N 3.3Å; E246-L248 PolarHBondContact O-N 2.8Å
249	Q	80	Confident	83.2	Confident	160 Å²	160	99.7 Å²	99.7	75%	0.748	50%	0.496	S	S	*	.	H	α-helix	trans	-85.1	-33	-178	-73.5	-175	-5.4	0	0	113.7	T245 E246 L247	T245-Q249 WeakPolarHBondContact O-CG 3.33Å; T245-Q249 PolarHBondContact O-N 2.85Å; E246-Q249 PolarHBondContact O-N 2.82Å; L247-Q249 PolarHBondContact O-N 3.12Å
250	D	78.4	Confident	83.2	Confident	85 Å²	85	103.4 Å²	103.4	46%	0.455	52%	0.518	S	S	.	.	H	α-helix	trans	-128.3	10.2	-168.1	-158.1	38.8	0	0	0	115.8	R239 W242 E246	R239-D250 IonicContact CZ-OD2 3.61Å; R239-D250 PolarHBondContact NH1-O 3.29Å; R239-D250 VanDerWaalsContact NH1-O 3.07Å; R239-D250 IonicContact NH1-OD2 2.76Å; R239-D250 PolarHBondContact NH1-OD2 2.95Å; R239-D250 IonicContact NH2-OD2 3.6Å; W242-D250 HydrophobicContact CZ3-CB 4.28Å; E246-D250 PolarHBondContact O-N 2.93Å
251	M	78.5	Confident	83.3	Confident	36 Å²	36	98.1 Å²	98.1	18%	0.177	50%	0.498	C	S	.	.	H	α-helix	trans	-81.2	-18.7	179.8	-82.3	-66.5	-78.9	0	0	115.9	R239 L247 G253 I254 L255	R239-M251 HydrophobicContact CB-SD 4.24Å; L247-M251 HydrophobicContact CB-CG 4.4Å; L247-M251 HydrophobicContact CD2-CE 4.27Å; L247-M251 HydrophobicContact CD2-CG 3.79Å; L247-M251 HydrophobicContact CD2-SD 4.14Å; L247-M251 HydrophobicContact CG-CG 4.47Å; L247-M251 WeakPolarHBondContact O-CB 3.42Å; L247-M251 WeakPolarHBondContact O-CG 3.33Å; L247-M251 PolarHBondContact O-N 3.3Å; M251-G253 VanDerWaalsContact C-N 3.33Å; M251-G253 PolarHBondContact O-N 2.97Å; M251-I254 HydrophobicContact CE-CG2 4.28Å; M251-I254 HydrophobicContact SD-CG2 3.64Å; M251-L255 HydrophobicContact CB-CD1 4.18Å; M251-L255 HydrophobicContact CE-CD1 3.89Å; M251-L255 HydrophobicContact CE-CD2 3.77Å; M251-L255 HydrophobicContact CE-CG 3.68Å; M251-L255 WeakPolarHBondContact O-CB 3.4Å; M251-L255 WeakPolarHBondContact O-CG 3.43Å; M251-L255 PolarHBondContact O-N 3.31Å; M251-L255 VanDerWaalsContact O-N 3.16Å
252	S	77.2	Confident	83.2	Confident	103 Å²	103	95.4 Å²	95.4	72%	0.72	49%	0.492	S	S	*	.	H	α-helix	trans	-65	-35	-170.4	69.1	0	0	0	0	113.4	K256	S252-K256 WeakPolarHBondContact O-CB 3.48Å; S252-K256 PolarHBondContact O-N 2.92Å
253	G	83.5	Confident	83.3	Confident	36 Å²	36	96.7 Å²	96.7	37%	0.371	50%	0.504	S	S	.	.	H	α-helix	trans	-71.1	-54.4	178.4	0	0	0	0	0	112.2	M251 L255 K256 W257	M251-G253 VanDerWaalsContact C-N 3.33Å; M251-G253 PolarHBondContact O-N 2.97Å; G253-L255 PolarHBondContact O-N 3.27Å; G253-K256 WeakPolarHBondContact O-CB 3.36Å; G253-K256 PolarHBondContact O-N 2.93Å; G253-W257 VanDerWaalsContact O-CD1 3.3Å; G253-W257 PolarHBondContact O-N 3.44Å
254	I	84.1	Confident	83.4	Confident	25 Å²	25	100.8 Å²	100.8	13%	0.128	52%	0.515	C	S	.	.	H	α-helix	trans	-64.1	-39.9	-174.3	-158.5	74	0	0	0	112	L232 D235 L236 M251 K256 W257 S258	L232-I254 HydrophobicContact CD1-CD1 3.72Å; L232-I254 HydrophobicContact CD1-CG1 4.11Å; D235-I254 HydrophobicContact CB-CD1 4.39Å; D235-I254 WeakPolarHBondContact OD2-CD1 3.38Å; D235-I254 WeakPolarHBondContact OD2-CG1 3.19Å; L236-I254 HydrophobicContact CD2-CG1 3.82Å; L236-I254 HydrophobicContact CD2-CG2 3.99Å; L236-I254 HydrophobicContact CG-CG1 4.33Å; M251-I254 HydrophobicContact CE-CG2 4.28Å; M251-I254 HydrophobicContact SD-CG2 3.64Å; I254-K256 VanDerWaalsContact C-N 3.35Å; I254-K256 PolarHBondContact O-N 3.42Å; I254-W257 PolarHBondContact O-N 3.45Å; I254-S258 PolarHBondContact O-N 3.49Å
255	L	83.7	Confident	83.5	Confident	75 Å²	75	103.5 Å²	103.5	39%	0.393	52%	0.521	S	S	.	.	H	α-helix	trans	-63.3	-41.9	176.1	-74.2	174.8	0	0	0	111.5	M251 G253 S258 Q259	M251-L255 HydrophobicContact CB-CD1 4.18Å; M251-L255 HydrophobicContact CE-CD1 3.89Å; M251-L255 HydrophobicContact CE-CD2 3.77Å; M251-L255 HydrophobicContact CE-CG 3.68Å; M251-L255 WeakPolarHBondContact O-CB 3.4Å; M251-L255 WeakPolarHBondContact O-CG 3.43Å; M251-L255 PolarHBondContact O-N 3.31Å; M251-L255 VanDerWaalsContact O-N 3.16Å; G253-L255 PolarHBondContact O-N 3.27Å; L255-S258 PolarHBondContact O-N 3.09Å; L255-S258 PolarHBondContact O-OG 3.41Å; L255-Q259 WeakPolarHBondContact O-CG 3.39Å; L255-Q259 PolarHBondContact O-N 3.03Å
256	K	84.8	Confident	83.6	Confident	135 Å²	135	100.3 Å²	100.3	59%	0.587	50%	0.501	S	S	*	.	H	α-helix	trans	-64.2	-41.2	176.6	-170	176	-177.9	-179.9	0	111.5	S252 G253 I254 Q259 I260	S252-K256 WeakPolarHBondContact O-CB 3.48Å; S252-K256 PolarHBondContact O-N 2.92Å; G253-K256 WeakPolarHBondContact O-CB 3.36Å; G253-K256 PolarHBondContact O-N 2.93Å; I254-K256 VanDerWaalsContact C-N 3.35Å; I254-K256 PolarHBondContact O-N 3.42Å; K256-Q259 PolarHBondContact O-N 3.16Å; K256-I260 HydrophobicContact CG-CD1 3.91Å; K256-I260 WeakPolarHBondContact O-CD1 3.17Å; K256-I260 VanDerWaalsContact O-CG1 3.22Å; K256-I260 WeakPolarHBondContact O-CG1 3.44Å; K256-I260 PolarHBondContact O-N 3.5Å; K256-I260 VanDerWaalsContact O-N 3.16Å
257	W	82.2	Confident	83.5	Confident	184 Å²	184	104.7 Å²	104.7	70%	0.697	52%	0.519	S	S	*	.	H	α-helix	trans	-63.4	-42.2	174.2	-86.4	89.4	0	0	0	112.2	G253 I254 Q259 I260 W261	G253-W257 VanDerWaalsContact O-CD1 3.3Å; G253-W257 PolarHBondContact O-N 3.44Å; I254-W257 PolarHBondContact O-N 3.45Å; W257-Q259 VanDerWaalsContact C-N 3.29Å; W257-Q259 PolarHBondContact O-N 3.39Å; W257-I260 PolarHBondContact O-N 3.04Å; W257-W261 WeakPolarHBondContact O-CB 3.43Å; W257-W261 PolarHBondContact O-N 2.75Å
258	S	84.6	Confident	83.2	Confident	42 Å²	42	107.1 Å²	107.1	29%	0.294	55%	0.546	S	S	.	.	H	α-helix	trans	-62.2	-34.2	176.5	77.7	0	0	0	0	113.6	I254 L255	I254-S258 PolarHBondContact O-N 3.49Å; L255-S258 PolarHBondContact O-N 3.09Å; L255-S258 PolarHBondContact O-OG 3.41Å
259	Q	84.8	Confident	83	Confident	160 Å²	160	101.2 Å²	101.2	75%	0.748	52%	0.516	S	S	*	.	H	α-helix	trans	-76.3	-27.8	177.3	-72.6	173.6	0.5	0	0	113	L255 K256 W257	L255-Q259 WeakPolarHBondContact O-CG 3.39Å; L255-Q259 PolarHBondContact O-N 3.03Å; K256-Q259 PolarHBondContact O-N 3.16Å; W257-Q259 VanDerWaalsContact C-N 3.29Å; W257-Q259 PolarHBondContact O-N 3.39Å
260	I	86.4	Confident	82.7	Confident	112 Å²	112	97.6 Å²	97.6	57%	0.574	51%	0.509	S	S	*	.	H	α-helix	trans	-86.1	-32.9	-179.3	-67.3	166.4	0	0	0	111.2	K256 W257 T262	K256-I260 HydrophobicContact CG-CD1 3.91Å; K256-I260 WeakPolarHBondContact O-CD1 3.17Å; K256-I260 VanDerWaalsContact O-CG1 3.22Å; K256-I260 WeakPolarHBondContact O-CG1 3.44Å; K256-I260 PolarHBondContact O-N 3.5Å; K256-I260 VanDerWaalsContact O-N 3.16Å; W257-I260 PolarHBondContact O-N 3.04Å; I260-T262 PolarHBondContact O-N 2.87Å
261	W	87.9	Confident	82.4	Confident	85 Å²	85	103.3 Å²	103.3	32%	0.322	53%	0.529	S	S	.	.			trans	-63.6	128.8	-175.8	-170.7	95.3	0	0	0	111	V229 L232 W257 L263	V229-W261 HydrophobicContact CB-CH2 4.45Å; V229-W261 HydrophobicContact CB-CZ2 4.42Å; V229-W261 HydrophobicContact CG2-CD2 3.84Å; V229-W261 HydrophobicContact CG2-CE3 3.93Å; V229-W261 HydrophobicContact CG2-CH2 3.04Å; V229-W261 HydrophobicContact CG2-CZ2 2.91Å; V229-W261 HydrophobicContact CG2-CZ3 3.55Å; L232-W261 HydrophobicContact CD2-CB 4.21Å; L232-W261 HydrophobicContact CD2-CG 4.44Å; W257-W261 WeakPolarHBondContact O-CB 3.43Å; W257-W261 PolarHBondContact O-N 2.75Å; W261-L263 VanDerWaalsContact CH2-CA 3.49Å; W261-L263 HydrophobicContact CH2-CB 3.61Å; W261-L263 HydrophobicContact CH2-CD1 3.94Å; W261-L263 HydrophobicContact CH2-CG 4.39Å; W261-L263 HydrophobicContact CZ2-CB 4.44Å; W261-L263 HydrophobicContact CZ2-CD1 4.32Å; W261-L263 HydrophobicContact CZ3-CB 4.15Å
262	T	87.6	Confident	82.3	Confident	96 Å²	96	109.7 Å²	109.7	59%	0.589	56%	0.556	S	S	*	*			trans	-142.6	137.3	177.2	46.6	0	0	0	0	109.8	I260 K264	I260-T262 PolarHBondContact O-N 2.87Å; T262-K264 PolarHBondContact O-N 3.31Å
263	L	89.9	Confident	82.2	Confident	109 Å²	109	109.2 Å²	109.2	57%	0.571	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-64.6	121.7	177.3	-174.9	68	0	0	0	109.8	L222 Q225 W261	L222-L263 HydrophobicContact CD1-CD1 4.07Å; Q225-L263 HydrophobicContact CB-CD1 4.31Å; W261-L263 VanDerWaalsContact CH2-CA 3.49Å; W261-L263 HydrophobicContact CH2-CB 3.61Å; W261-L263 HydrophobicContact CH2-CD1 3.94Å; W261-L263 HydrophobicContact CH2-CG 4.39Å; W261-L263 HydrophobicContact CZ2-CB 4.44Å; W261-L263 HydrophobicContact CZ2-CD1 4.32Å; W261-L263 HydrophobicContact CZ3-CB 4.15Å
264	K	88.9	Confident	81.5	Confident	140 Å²	140	111.6 Å²	111.6	61%	0.609	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-93.8	120.9	174.8	-66.3	-177.6	-176	174	0	109.4	Q225 T262 P266	Q225-K264 PolarHBondContact NE2-O 3.37Å; Q225-K264 VanDerWaalsContact NE2-O 3.08Å; Q225-K264 PolarHBondContact OE1-O 2.89Å; T262-K264 PolarHBondContact O-N 3.31Å; K264-P266 WeakPolarHBondContact O-CD 3.15Å
265	K	86.4	Confident	80.8	Confident	192 Å²	192	116 Å²	116	84%	0.835	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-65.5	124.7	173.9	-171.8	175.5	-178.7	176.2	0	109.6
266	P	84.3	Confident	80.5	Confident	27 Å²	27	118.1 Å²	118.1	18%	0.175	59%	0.594	C	S	.	*	P	Polyproline II helix	trans	-58.2	156.2	174.5	-24.5	34	0	0	0	111.9	A218 L222 K264 A268	A218-P266 HydrophobicContact CB-CB 3.75Å; A218-P266 HydrophobicContact CB-CG 4.48Å; L222-P266 HydrophobicContact CB-CG 4.38Å; K264-P266 WeakPolarHBondContact O-CD 3.15Å; P266-A268 PolarHBondContact O-N 3.21Å
267	K	80.3	Confident	80.4	Confident	191 Å²	191	117.9 Å²	117.9	83%	0.83	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-56.5	133.1	179.8	-73.5	-179.2	-179.2	173.9	0	110.8	V269	K267-V269 PolarHBondContact O-N 2.89Å
268	A	74.8	Confident	80.4	Confident	99 Å²	99	117 Å²	117	82%	0.818	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-68.2	117.7	179.4	0	0	0	0	0	110.5	P266	P266-A268 PolarHBondContact O-N 3.21Å
269	V	74.6	Confident	80.3	Confident	33 Å²	33	118.8 Å²	118.8	20%	0.2	61%	0.614	C	S	.	*	P	Polyproline II helix	trans	-81.6	133.9	171.1	-172	0	0	0	0	108.8	I211 S214 L215 K267 K271	I211-V269 HydrophobicContact CG2-CG1 4.18Å; S214-V269 VanDerWaalsContact OG-CG2 3.26Å; S214-V269 WeakPolarHBondContact OG-CG2 3.41Å; L215-V269 HydrophobicContact CD2-CB 4.07Å; L215-V269 HydrophobicContact CD2-CG2 3.94Å; L215-V269 HydrophobicContact CG-CG2 4.45Å; K267-V269 PolarHBondContact O-N 2.89Å; V269-K271 PolarHBondContact O-N 2.88Å
270	S	73.6	Confident	80.3	Confident	84 Å²	84	115 Å²	115	59%	0.587	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-61.9	119.7	172.6	178.6	0	0	0	0	109.4	K272	S270-K272 VanDerWaalsContact C-N 3.29Å
271	K	71.5	Confident	80.1	Confident	205 Å²	205	114.8 Å²	114.8	89%	0.891	60%	0.603	S	S	*	*			trans	-87	0.7	179	-59.8	-175.5	179.4	-174.4	0	113.3	V269	V269-K271 PolarHBondContact O-N 2.88Å
272	K	76.6	Confident	80	Confident	171 Å²	171	114.4 Å²	114.4	74%	0.743	61%	0.607	S	S	*	*	S	Bend	trans	-103	125.2	-175.9	-168.7	177.2	178.8	-178.6	0	109.1	S270 S274	S270-K272 VanDerWaalsContact C-N 3.29Å; K272-S274 PolarHBondContact O-N 3.23Å
273	L	74.8	Confident	79.8	Confident	92 Å²	92	113.9 Å²	113.9	48%	0.482	61%	0.607	S	S	.	*			trans	-53.3	127.1	167.4	-78.8	160.2	0	0	0	109.3	L204 M275	L204-L273 HydrophobicContact CD1-CD2 3.72Å; L273-M275 VanDerWaalsContact C-N 3.29Å; L273-M275 PolarHBondContact O-N 2.69Å
274	S	70.4	Confident	79.4	Confident	86 Å²	86	109.3 Å²	109.3	60%	0.601	59%	0.586	S	S	*	*	S	Bend	trans	-69.5	-29.8	-177.3	69.3	0	0	0	0	112.2	E207 K272	E207-S274 WeakPolarHBondContact OE1-CB 3.49Å; E207-S274 PolarHBondContact OE1-N 2.95Å; E207-S274 PolarHBondContact OE1-OG 3.36Å; E207-S274 PolarHBondContact OE2-OG 2.85Å; E207-S274 VanDerWaalsContact OE2-OG 3.08Å; K272-S274 PolarHBondContact O-N 3.23Å
275	M	68.1	Low	79	Confident	117 Å²	117	105.5 Å²	105.5	58%	0.576	57%	0.571	S	S	*	*			trans	-134.6	135.2	-178.7	-64.1	-169.1	178.9	0	0	111.7	L273	L273-M275 VanDerWaalsContact C-N 3.29Å; L273-M275 PolarHBondContact O-N 2.69Å
276	V	78.2	Confident	78.8	Confident	121 Å²	121	100.3 Å²	100.3	73%	0.733	55%	0.552	S	S	*	*			trans	-108.2	120	169.3	179.4	0	0	0	0	107	Q278	V276-Q278 PolarHBondContact O-N 2.65Å
277	F	83	Confident	78.8	Confident	130 Å²	130	103.6 Å²	103.6	57%	0.57	57%	0.565	S	S	*	*			trans	-62.2	134.9	178.2	174.9	-104.2	0	0	0	110.9	E200 A279	E200-F277 HydrophobicContact CB-CD2 4.26Å; E200-F277 HydrophobicContact CG-CD2 3.87Å; E200-F277 HydrophobicContact CG-CE2 3.9Å; F277-A279 HydrophobicContact CE1-CB 3.92Å; F277-A279 HydrophobicContact CZ-CB 4.27Å
278	Q	82.8	Confident	78.7	Confident	166 Å²	166	99 Å²	99	78%	0.776	55%	0.545	S	S	*	.			trans	-122.1	119.7	171.1	-67.3	-174.5	-6.5	0	0	108.6	V276	V276-Q278 PolarHBondContact O-N 2.65Å
279	A	82.3	Confident	78.8	Confident	79 Å²	79	99 Å²	99	65%	0.653	53%	0.527	S	S	*	.			trans	-65.7	130.9	177.8	0	0	0	0	0	110.1	F277	F277-A279 HydrophobicContact CE1-CB 3.92Å; F277-A279 HydrophobicContact CZ-CB 4.27Å
280	P	82.9	Confident	79.1	Confident	81 Å²	81	104.3 Å²	104.3	53%	0.526	54%	0.543	S	S	.	.			trans	-61.6	142.8	172.2	-20.9	31.8	0	0	0	111.5	L282 M285	P280-L282 PolarHBondContact O-N 3.33Å; P280-M285 HydrophobicContact CB-CE 3.52Å
281	D	84.2	Confident	79.6	Confident	107 Å²	107	105 Å²	105	57%	0.572	54%	0.537	S	S	*	.			trans	-74.5	78	172.5	178.3	19.2	0	0	0	111	S283 G284 M285	D281-S283 PolarHBondContact O-N 2.53Å; D281-S283 WeakPolarHBondContact OD1-CB 3.42Å; D281-S283 PolarHBondContact OD1-N 3.15Å; D281-G284 PolarHBondContact O-N 3.01Å; D281-G284 PolarHBondContact OD1-N 3Å; D281-G284 WeakPolarHBondContact OD2-CA 3.41Å; D281-G284 PolarHBondContact OD2-N 3.22Å; D281-M285 VanDerWaalsContact C-CE 3.49Å; D281-M285 VanDerWaalsContact O-CE 3.29Å; D281-M285 WeakPolarHBondContact O-CE 3.47Å; D281-M285 WeakPolarHBondContact O-CG 3.31Å; D281-M285 PolarHBondContact O-N 3.39Å; D281-M285 VanDerWaalsContact O-N 3.09Å
282	L	84.9	Confident	80.2	Confident	77 Å²	77	95.4 Å²	95.4	40%	0.403	50%	0.496	S	S	.	.	H	α-helix	trans	-61.9	-31	176.6	-68.1	172.5	0	0	0	111.9	L193 P280 M285 L286	L193-L282 HydrophobicContact CD1-CD1 4.17Å; L193-L282 HydrophobicContact CD2-CD1 3.74Å; P280-L282 PolarHBondContact O-N 3.33Å; L282-M285 HydrophobicContact CD2-CE 3.98Å; L282-M285 HydrophobicContact CG-CE 4.5Å; L282-M285 PolarHBondContact O-N 3.42Å; L282-L286 VanDerWaalsContact O-CB 3.31Å; L282-L286 WeakPolarHBondContact O-CB 3.11Å; L282-L286 WeakPolarHBondContact O-CG 3.36Å; L282-L286 PolarHBondContact O-N 2.91Å
283	S	83.4	Confident	80.6	Confident	84 Å²	84	90.6 Å²	90.6	59%	0.587	48%	0.481	S	S	*	.	H	α-helix	trans	-64.8	-51.6	179.6	-172.9	0	0	0	0	110.7	D281 M285 L286 Q287	D281-S283 PolarHBondContact O-N 2.53Å; D281-S283 WeakPolarHBondContact OD1-CB 3.42Å; D281-S283 PolarHBondContact OD1-N 3.15Å; S283-M285 VanDerWaalsContact C-N 3.34Å; S283-M285 PolarHBondContact O-N 3.25Å; S283-L286 PolarHBondContact O-N 3.24Å; S283-Q287 WeakPolarHBondContact O-CB 3.39Å; S283-Q287 PolarHBondContact O-N 2.95Å
284	G	81.5	Confident	81.1	Confident	14 Å²	14	89.1 Å²	89.1	14%	0.144	48%	0.482	C	S	.	.	H	α-helix	trans	-63.1	-39.2	177.4	0	0	0	0	0	112.5	D281 Q287 K288	D281-G284 PolarHBondContact O-N 3.01Å; D281-G284 PolarHBondContact OD1-N 3Å; D281-G284 WeakPolarHBondContact OD2-CA 3.41Å; D281-G284 PolarHBondContact OD2-N 3.22Å; G284-Q287 PolarHBondContact O-N 3.21Å; G284-K288 WeakPolarHBondContact O-CG 3.34Å; G284-K288 PolarHBondContact O-N 2.91Å
285	M	80.9	Confident	82	Confident	60 Å²	60	86 Å²	86	30%	0.296	46%	0.459	S	S	.	.	H	α-helix	trans	-63.3	-45.2	174.7	-73.6	-174.5	-92.7	0	0	112.3	P280 D281 L282 S283 Q287 K288 F289	P280-M285 HydrophobicContact CB-CE 3.52Å; D281-M285 VanDerWaalsContact C-CE 3.49Å; D281-M285 VanDerWaalsContact O-CE 3.29Å; D281-M285 WeakPolarHBondContact O-CE 3.47Å; D281-M285 WeakPolarHBondContact O-CG 3.31Å; D281-M285 PolarHBondContact O-N 3.39Å; D281-M285 VanDerWaalsContact O-N 3.09Å; L282-M285 HydrophobicContact CD2-CE 3.98Å; L282-M285 HydrophobicContact CG-CE 4.5Å; L282-M285 PolarHBondContact O-N 3.42Å; S283-M285 VanDerWaalsContact C-N 3.34Å; S283-M285 PolarHBondContact O-N 3.25Å; M285-Q287 VanDerWaalsContact C-N 3.31Å; M285-Q287 PolarHBondContact O-N 3.34Å; M285-K288 PolarHBondContact O-N 2.77Å; M285-F289 WeakPolarHBondContact O-CB 3.32Å; M285-F289 PolarHBondContact O-N 3.15Å
286	L	82.6	Confident	83	Confident	82 Å²	82	84 Å²	84	43%	0.429	45%	0.446	S	S	.	.	H	α-helix	trans	-65.6	-34.6	176.2	-73.4	171.4	0	0	0	112.1	L282 S283 F289 R290	L282-L286 VanDerWaalsContact O-CB 3.31Å; L282-L286 WeakPolarHBondContact O-CB 3.11Å; L282-L286 WeakPolarHBondContact O-CG 3.36Å; L282-L286 PolarHBondContact O-N 2.91Å; S283-L286 PolarHBondContact O-N 3.24Å; L286-F289 PolarHBondContact O-N 2.89Å; L286-R290 WeakPolarHBondContact O-CG 3.38Å; L286-R290 PolarHBondContact O-N 3.18Å
287	Q	83.4	Confident	83.5	Confident	96 Å²	96	82.2 Å²	82.2	45%	0.449	44%	0.443	S	S	.	.	H	α-helix	trans	-62.2	-51.8	174	178.8	176.1	-10.8	0	0	111.3	S283 G284 M285 F289 R290 E291	S283-Q287 WeakPolarHBondContact O-CB 3.39Å; S283-Q287 PolarHBondContact O-N 2.95Å; G284-Q287 PolarHBondContact O-N 3.21Å; M285-Q287 VanDerWaalsContact C-N 3.31Å; M285-Q287 PolarHBondContact O-N 3.34Å; Q287-F289 VanDerWaalsContact C-N 3.25Å; Q287-F289 PolarHBondContact O-N 3.4Å; Q287-R290 WeakPolarHBondContact O-CB 3.45Å; Q287-R290 PolarHBondContact O-N 2.96Å; Q287-E291 WeakPolarHBondContact CG-OE1 3.44Å; Q287-E291 PolarHBondContact NE2-OE1 2.87Å; Q287-E291 WeakPolarHBondContact O-CG 3.33Å; Q287-E291 PolarHBondContact O-N 3.27Å
288	K	77.6	Confident	83.9	Confident	94 Å²	94	81 Å²	81	41%	0.409	44%	0.436	S	S	.	.	H	α-helix	trans	-57.7	-40.3	176.9	-70.2	172.1	-179.1	175.4	0	111.9	G284 M285 E291 L292 H449	G284-K288 WeakPolarHBondContact O-CG 3.34Å; G284-K288 PolarHBondContact O-N 2.91Å; M285-K288 PolarHBondContact O-N 2.77Å; K288-E291 PolarHBondContact O-N 3.42Å; K288-L292 PolarHBondContact O-N 3.4Å; K288-H449 CarbonylContact C-O 3.58Å; K288-H449 VanDerWaalsContact C-O 3.29Å
289	F	77.1	Confident	84.4	Confident	99 Å²	99	75 Å²	75	43%	0.434	41%	0.406	S	S	.	.	H	α-helix	trans	-64.4	-39.8	175.7	-177.2	-96.6	0	0	0	112.9	M285 L286 Q287 L292 T293 H449	M285-F289 WeakPolarHBondContact O-CB 3.32Å; M285-F289 PolarHBondContact O-N 3.15Å; L286-F289 PolarHBondContact O-N 2.89Å; Q287-F289 VanDerWaalsContact C-N 3.25Å; Q287-F289 PolarHBondContact O-N 3.4Å; F289-L292 PolarHBondContact O-N 3.01Å; F289-T293 WeakPolarHBondContact O-CB 3.36Å; F289-T293 PolarHBondContact O-N 3.14Å; F289-T293 PolarHBondContact O-OG1 3.46Å; F289-H449 PolarHBondContact N-O 2.99Å
290	R	80.9	Confident	84.9	Confident	145 Å²	145	72.7 Å²	72.7	55%	0.547	38%	0.382	S	S	.	.	H	α-helix	trans	-64.8	-42.5	174.2	-76	-169.9	-59.4	-89.1	2.4	111.7	L286 Q287 L292 T293 A294	L286-R290 WeakPolarHBondContact O-CG 3.38Å; L286-R290 PolarHBondContact O-N 3.18Å; Q287-R290 WeakPolarHBondContact O-CB 3.45Å; Q287-R290 PolarHBondContact O-N 2.96Å; R290-L292 VanDerWaalsContact C-N 3.34Å; R290-T293 PolarHBondContact O-N 3.07Å; R290-A294 WeakPolarHBondContact O-CB 3.19Å; R290-A294 PolarHBondContact O-N 3.25Å
291	E	83.7	Confident	85.3	Confident	99 Å²	99	72.9 Å²	72.9	46%	0.463	38%	0.379	S	S	.	.	H	α-helix	trans	-59.3	-45.7	175.4	-70.5	169	-170.3	0	0	110.8	Q287 K288 T293 A294 V295	Q287-E291 WeakPolarHBondContact CG-OE1 3.44Å; Q287-E291 PolarHBondContact NE2-OE1 2.87Å; Q287-E291 WeakPolarHBondContact O-CG 3.33Å; Q287-E291 PolarHBondContact O-N 3.27Å; K288-E291 PolarHBondContact O-N 3.42Å; E291-T293 PolarHBondContact O-N 2.98Å; E291-A294 PolarHBondContact O-N 2.95Å; E291-V295 WeakPolarHBondContact O-CG2 3.39Å; E291-V295 PolarHBondContact O-N 3.11Å
292	L	84.8	Confident	85.7	Confident	4 Å²	4	68.2 Å²	68.2	2%	0.021	35%	0.354	C	S	.	.	H	α-helix	trans	-60.2	-43.4	173.3	-177.6	66.9	0	0	0	112.4	K288 F289 R290 A294 V295 R296 Y349 L444 V446	K288-L292 PolarHBondContact O-N 3.4Å; F289-L292 PolarHBondContact O-N 3.01Å; R290-L292 VanDerWaalsContact C-N 3.34Å; L292-A294 VanDerWaalsContact C-N 3.35Å; L292-V295 PolarHBondContact O-N 3.43Å; L292-R296 WeakPolarHBondContact O-CG 3.44Å; L292-R296 PolarHBondContact O-N 3.44Å; L292-Y349 WeakPolarHBondContact CD1-OH 3.39Å; L292-L444 HydrophobicContact CD1-CB 4.43Å; L292-L444 HydrophobicContact CD1-CD1 3.8Å; L292-V446 HydrophobicContact CD1-CG2 4.44Å; L292-V446 HydrophobicContact CD2-CG1 4.47Å
293	T	84.8	Confident	86.1	Confident	69 Å²	69	66.4 Å²	66.4	42%	0.423	35%	0.346	S	S	.	.	H	α-helix	trans	-64.3	-40.7	179.1	-55.9	0	0	0	0	111.4	F289 R290 E291 V295 R296 A297	F289-T293 WeakPolarHBondContact O-CB 3.36Å; F289-T293 PolarHBondContact O-N 3.14Å; F289-T293 PolarHBondContact O-OG1 3.46Å; R290-T293 PolarHBondContact O-N 3.07Å; E291-T293 PolarHBondContact O-N 2.98Å; T293-V295 VanDerWaalsContact C-N 3.33Å; T293-V295 PolarHBondContact O-N 3.48Å; T293-R296 PolarHBondContact O-N 3.38Å; T293-A297 PolarHBondContact O-N 3.04Å
294	A	86.6	Confident	86.6	Confident	61 Å²	61	62.4 Å²	62.4	50%	0.504	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-40.1	175.5	0	0	0	0	0	111.6	R290 E291 L292 A297	R290-A294 WeakPolarHBondContact O-CB 3.19Å; R290-A294 PolarHBondContact O-N 3.25Å; E291-A294 PolarHBondContact O-N 2.95Å; L292-A294 VanDerWaalsContact C-N 3.35Å; A294-A297 VanDerWaalsContact O-CB 3.27Å; A294-A297 WeakPolarHBondContact O-CB 3.41Å; A294-A297 PolarHBondContact O-N 3.24Å
295	V	87.8	Confident	87	Confident	22 Å²	22	62.9 Å²	62.9	13%	0.133	32%	0.317	C	S	.	.	H	α-helix	trans	-68.2	-38	176.2	167.9	0	0	0	0	112	E291 L292 T293 A297 Y298 Y349 F433 L444	E291-V295 WeakPolarHBondContact O-CG2 3.39Å; E291-V295 PolarHBondContact O-N 3.11Å; L292-V295 PolarHBondContact O-N 3.43Å; T293-V295 VanDerWaalsContact C-N 3.33Å; T293-V295 PolarHBondContact O-N 3.48Å; V295-A297 PolarHBondContact O-N 2.83Å; V295-A297 VanDerWaalsContact O-N 3.14Å; V295-Y298 WeakPolarHBondContact O-CD2 3.15Å; V295-Y298 PolarHBondContact O-N 3.39Å; V295-Y349 HydrophobicContact CG1-CD1 4.35Å; V295-Y349 HydrophobicContact CG1-CD2 3.2Å; V295-Y349 HydrophobicContact CG1-CE2 3.63Å; V295-Y349 HydrophobicContact CG1-CG 3.59Å; V295-F433 HydrophobicContact CB-CD2 4.46Å; V295-F433 HydrophobicContact CG1-CB 3.82Å; V295-F433 HydrophobicContact CG1-CD1 4.47Å; V295-F433 HydrophobicContact CG1-CD2 3.47Å; V295-F433 VanDerWaalsContact CG1-CD2 3.47Å; V295-F433 HydrophobicContact CG1-CE2 4.09Å; V295-F433 HydrophobicContact CG1-CG 3.67Å; V295-F433 HydrophobicContact CG2-CD1 4.31Å; V295-F433 HydrophobicContact CG2-CD2 4.43Å; V295-F433 HydrophobicContact CG2-CE1 4.44Å; V295-F433 HydrophobicContact CG2-CG 4.29Å; V295-L444 HydrophobicContact CB-CD1 4.46Å; V295-L444 HydrophobicContact CG1-CD1 4.11Å
296	R	89.3	Confident	87.2	Confident	75 Å²	75	63 Å²	63	28%	0.283	32%	0.322	S	S	.	.	H	α-helix	trans	-61.8	-16.4	174.7	-79.7	174.6	170.9	-173	-6.3	113.9	L292 T293 Y298 W299 Y349 E351	L292-R296 WeakPolarHBondContact O-CG 3.44Å; L292-R296 PolarHBondContact O-N 3.44Å; T293-R296 PolarHBondContact O-N 3.38Å; R296-Y298 PolarHBondContact O-N 2.79Å; R296-W299 HydrophobicContact CG-CE3 4.31Å; R296-W299 HydrophobicContact CG-CZ3 4.47Å; R296-W299 WeakPolarHBondContact O-CB 3.45Å; R296-W299 PolarHBondContact O-N 3.35Å; R296-Y349 HydrophobicContact CG-CD1 4Å; R296-Y349 HydrophobicContact CG-CE1 3.52Å; R296-E351 IonicContact CZ-OE1 2.69Å; R296-E351 VanDerWaalsContact CZ-OE1 3.24Å; R296-E351 IonicContact NE-OE1 3.68Å; R296-E351 PolarHBondContact NE-OE1 3.34Å; R296-E351 IonicContact NH2-OE1 3.79Å; R296-E351 PolarHBondContact NH2-OE1 3.36Å; R296-E351 IonicContact NH2-OE2 3.06Å; R296-E351 PolarHBondContact NH2-OE2 3.13Å
297	A	88.9	Confident	87.3	Confident	82 Å²	82	67.3 Å²	67.3	68%	0.678	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.3	171.1	0	0	0	0	0	112.7	T293 A294 V295 W299	T293-A297 PolarHBondContact O-N 3.04Å; A294-A297 VanDerWaalsContact O-CB 3.27Å; A294-A297 WeakPolarHBondContact O-CB 3.41Å; A294-A297 PolarHBondContact O-N 3.24Å; V295-A297 PolarHBondContact O-N 2.83Å; V295-A297 VanDerWaalsContact O-N 3.14Å; A297-W299 VanDerWaalsContact C-N 3.3Å; A297-W299 PolarHBondContact O-N 3.38Å
298	Y	91.9	Very high	86.8	Confident	106 Å²	106	64.8 Å²	64.8	42%	0.416	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	26.8	178.2	-54.5	-74.3	0	0	0	112.6	V295 R296 D300 K347 H348 Y349 F433	V295-Y298 WeakPolarHBondContact O-CD2 3.15Å; V295-Y298 PolarHBondContact O-N 3.39Å; R296-Y298 PolarHBondContact O-N 2.79Å; Y298-D300 PolarHBondContact O-N 3.17Å; Y298-K347 HydrophobicContact CD1-CB 3.64Å; Y298-K347 HydrophobicContact CD2-CB 4.35Å; Y298-K347 HydrophobicContact CE1-CB 4Å; Y298-K347 HydrophobicContact CE1-CD 4.04Å; Y298-K347 HydrophobicContact CE2-CD 4.34Å; Y298-K347 HydrophobicContact CG-CB 3.82Å; Y298-H348 CarbonylContact O-C 3.46Å; Y298-Y349 PolarHBondContact O-N 3.21Å; Y298-F433 AromaticContact CD2-CE2 3.79Å; Y298-F433 HydrophobicContact CD2-CE2 3.79Å; Y298-F433 HydrophobicContact CD2-CZ 4.24Å; Y298-F433 HydrophobicContact CE2-CE2 4.49Å; Y298-F433 HydrophobicContact CG-CE2 4.23Å
299	W	93.8	Very high	86.7	Confident	39 Å²	39	63.7 Å²	63.7	15%	0.148	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-62.5	127	-175.1	-171	-78.3	0	0	0	112.3	R296 A297 Y349 E351 C481 P482 L483	R296-W299 HydrophobicContact CG-CE3 4.31Å; R296-W299 HydrophobicContact CG-CZ3 4.47Å; R296-W299 WeakPolarHBondContact O-CB 3.45Å; R296-W299 PolarHBondContact O-N 3.35Å; A297-W299 VanDerWaalsContact C-N 3.3Å; A297-W299 PolarHBondContact O-N 3.38Å; W299-Y349 WeakPolarHBondContact CA-O 3.27Å; W299-Y349 HydrophobicContact CD2-CD1 4.43Å; W299-Y349 AromaticContact CE3-CD1 3.58Å; W299-Y349 HydrophobicContact CE3-CD1 3.58Å; W299-Y349 AromaticContact CE3-CE1 3.73Å; W299-Y349 HydrophobicContact CE3-CE1 3.73Å; W299-Y349 AromaticContact CZ3-CD1 3.97Å; W299-Y349 HydrophobicContact CZ3-CD1 3.97Å; W299-Y349 AromaticContact CZ3-CE1 3.64Å; W299-Y349 HydrophobicContact CZ3-CE1 3.64Å; W299-E351 HydrophobicContact CH2-CB 3.82Å; W299-E351 HydrophobicContact CH2-CG 3.78Å; W299-E351 HydrophobicContact CZ3-CB 4.29Å; W299-E351 HydrophobicContact CZ3-CG 3.71Å; W299-C481 HydrophobicContact CH2-CB 4.45Å; W299-C481 VanDerWaalsContact CZ2-O 3.32Å; W299-C481 WeakPolarHBondContact CZ2-O 3.04Å; W299-P482 VanDerWaalsContact CZ2-C 3.42Å; W299-L483 HydrophobicContact CB-CD1 3.73Å; W299-L483 HydrophobicContact CD2-CB 4.08Å; W299-L483 HydrophobicContact CD2-CD1 3.48Å; W299-L483 VanDerWaalsContact CD2-CD1 3.48Å; W299-L483 HydrophobicContact CD2-CG 4.36Å; W299-L483 HydrophobicContact CE3-CD1 3.61Å; W299-L483 HydrophobicContact CG-CB 4.19Å; W299-L483 HydrophobicContact CG-CD1 3.52Å; W299-L483 HydrophobicContact CG-CG 4.31Å; W299-L483 HydrophobicContact CZ2-CB 4.41Å; W299-L483 HydrophobicContact CZ3-CD1 4.39Å
300	D	92.3	Very high	86.5	Confident	30 Å²	30	59.8 Å²	59.8	16%	0.16	31%	0.311	C	S	.	.			trans	-109.4	131.4	174.4	-111.3	-65.1	0	0	0	111.7	Y298 F302 K341 F343 H348 Y349	Y298-D300 PolarHBondContact O-N 3.17Å; D300-F302 HydrophobicContact CB-CD1 4.41Å; D300-K341 IonicContact OD1-NZ 3.73Å; D300-K341 PolarHBondContact OD1-NZ 3.47Å; D300-F343 HydrophobicContact CB-CE1 4.38Å; D300-F343 HydrophobicContact CB-CZ 4.08Å; D300-F343 WeakPolarHBondContact OD2-CE1 3.35Å; D300-H348 IonicContact OD2-CE1 3.83Å; D300-H348 IonicContact OD2-CG 2.74Å; D300-H348 IonicContact OD2-ND1 3.54Å; D300-H348 PolarHBondContact OD2-ND1 3.42Å; D300-Y349 PolarHBondContact N-O 2.73Å
301	N	90.5	Very high	86.1	Confident	85 Å²	85	60 Å²	60	46%	0.455	32%	0.323	S	S	.	.			trans	-101.5	120.4	176.3	-160.1	25.6	0	0	0	110.5	R320 K341	N301-R320 VanDerWaalsContact CG-NH2 3.29Å; N301-R320 PolarHBondContact ND2-NH2 3.14Å; N301-R320 VanDerWaalsContact OD1-CZ 3.27Å; N301-R320 PolarHBondContact OD1-NH1 2.9Å; N301-R320 PolarHBondContact OD1-NH2 3.49Å; N301-K341 WeakPolarHBondContact O-CE 3.3Å; N301-K341 PolarHBondContact O-NZ 3.38Å
302	F	93.1	Very high	85.9	Confident	10 Å²	10	55.9 Å²	55.9	4%	0.044	30%	0.304	C	S	.	.			trans	-151.1	176.7	176.2	63.3	-91.5	0	0	0	110.8	D300 K341 F343 W350 P467 F469 L480	D300-F302 HydrophobicContact CB-CD1 4.41Å; F302-K341 HydrophobicContact CB-CB 4.17Å; F302-K341 HydrophobicContact CB-CD 4.03Å; F302-K341 HydrophobicContact CB-CG 3.93Å; F302-F343 HydrophobicContact CD1-CZ 4.48Å; F302-W350 HydrophobicContact CE1-CB 3.74Å; F302-W350 AromaticContact CE1-CD2 3.81Å; F302-W350 HydrophobicContact CE1-CD2 3.81Å; F302-W350 HydrophobicContact CE1-CE3 4.06Å; F302-W350 AromaticContact CE1-CG 3.69Å; F302-W350 HydrophobicContact CE1-CG 3.69Å; F302-W350 HydrophobicContact CZ-CB 4.06Å; F302-W350 AromaticContact CZ-CD1 3.8Å; F302-W350 AromaticContact CZ-CD2 3.83Å; F302-W350 HydrophobicContact CZ-CD2 3.83Å; F302-W350 HydrophobicContact CZ-CE3 4.44Å; F302-W350 AromaticContact CZ-CG 3.62Å; F302-W350 HydrophobicContact CZ-CG 3.62Å; F302-P467 HydrophobicContact CE1-CB 4.43Å; F302-P467 HydrophobicContact CE1-CG 3.89Å; F302-P467 HydrophobicContact CE2-CB 3.72Å; F302-P467 HydrophobicContact CE2-CG 3.82Å; F302-P467 HydrophobicContact CZ-CB 3.54Å; F302-P467 HydrophobicContact CZ-CG 3.47Å; F302-P467 VanDerWaalsContact CZ-CG 3.47Å; F302-F469 AromaticContact CE2-CE2 3.99Å; F302-F469 HydrophobicContact CE2-CE2 3.99Å; F302-F469 AromaticContact CE2-CZ 3.84Å; F302-F469 HydrophobicContact CE2-CZ 3.84Å; F302-F469 AromaticContact CZ-CZ 3.99Å; F302-F469 HydrophobicContact CZ-CZ 3.99Å; F302-L480 HydrophobicContact CD2-CD1 3.95Å; F302-L480 HydrophobicContact CE2-CD1 3.74Å; F302-L480 HydrophobicContact CE2-CD2 3.93Å; F302-L480 HydrophobicContact CZ-CD2 4.05Å
303	T	93.9	Very high	86	Confident	38 Å²	38	56 Å²	56	23%	0.233	30%	0.304	C	S	.	.			trans	-125.2	169	-179.4	52	0	0	0	0	110.2	H319 R320 G339 S340	T303-H319 WeakPolarHBondContact CB-O 3.48Å; T303-H319 HydrophobicContact CG2-CB 4.31Å; T303-R320 HydrophobicContact CG2-CG 4.31Å; T303-G339 CarbonylContact O-C 3.56Å; T303-S340 PolarHBondContact N-OG 3.3Å; T303-S340 VanDerWaalsContact N-OG 3.12Å; T303-S340 WeakPolarHBondContact O-CB 3.3Å; T303-S340 PolarHBondContact O-N 3.07Å; T303-S340 PolarHBondContact O-OG 2.91Å; T303-S340 PolarHBondContact OG1-OG 3.04Å
304	F	92.6	Very high	86.2	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-66.5	140.3	167.1	-63.5	-59.5	0	0	0	110.3	P306 L315 H319 R320 V322 I337 F469 L480	F304-P306 VanDerWaalsContact O-CD 3.27Å; F304-P306 WeakPolarHBondContact O-CD 3.39Å; F304-L315 HydrophobicContact CB-CD1 4.2Å; F304-L315 HydrophobicContact CB-CD2 3.65Å; F304-L315 HydrophobicContact CD2-CD2 3.86Å; F304-L315 HydrophobicContact CG-CD2 4.03Å; F304-H319 WeakPolarHBondContact CD2-O 3.37Å; F304-H319 PolarHBondContact N-O 3.42Å; F304-R320 VanDerWaalsContact CE2-C 3.43Å; F304-R320 WeakPolarHBondContact CE2-O 3.36Å; F304-V322 HydrophobicContact CD2-CB 3.94Å; F304-V322 HydrophobicContact CD2-CG1 4.26Å; F304-V322 HydrophobicContact CE1-CG1 4.06Å; F304-V322 HydrophobicContact CE2-CB 3.76Å; F304-V322 HydrophobicContact CE2-CG1 3.65Å; F304-V322 HydrophobicContact CG-CB 4.45Å; F304-V322 HydrophobicContact CZ-CB 4.16Å; F304-V322 HydrophobicContact CZ-CG1 3.55Å; F304-I337 HydrophobicContact CB-CD1 3.86Å; F304-I337 HydrophobicContact CB-CG1 4.41Å; F304-I337 HydrophobicContact CD1-CG2 3.98Å; F304-I337 HydrophobicContact CE1-CG2 4.38Å; F304-I337 HydrophobicContact CG-CD1 4.5Å; F304-F469 AromaticContact CD1-CD2 3.81Å; F304-F469 HydrophobicContact CD1-CD2 3.81Å; F304-F469 HydrophobicContact CD1-CE2 4.13Å; F304-F469 HydrophobicContact CD1-CG 4.33Å; F304-F469 HydrophobicContact CE1-CB 4.03Å; F304-F469 HydrophobicContact CE1-CD1 4.04Å; F304-F469 AromaticContact CE1-CD2 3.42Å; F304-F469 HydrophobicContact CE1-CD2 3.42Å; F304-F469 VanDerWaalsContact CE1-CD2 3.42Å; F304-F469 HydrophobicContact CE1-CE1 4.38Å; F304-F469 AromaticContact CE1-CE2 3.79Å; F304-F469 HydrophobicContact CE1-CE2 3.79Å; F304-F469 AromaticContact CE1-CG 3.55Å; F304-F469 HydrophobicContact CE1-CG 3.55Å; F304-F469 HydrophobicContact CE1-CZ 4.26Å; F304-F469 HydrophobicContact CZ-CG 4.47Å; F304-L480 HydrophobicContact CD1-CD1 4.11Å; F304-L480 HydrophobicContact CD2-CD1 4.34Å; F304-L480 HydrophobicContact CE1-CD1 3.9Å; F304-L480 HydrophobicContact CE1-CG 4.03Å; F304-L480 HydrophobicContact CE2-CD1 4.18Å; F304-L480 HydrophobicContact CE2-CG 4.17Å; F304-L480 HydrophobicContact CG-CD1 4.31Å; F304-L480 HydrophobicContact CZ-CD1 3.96Å; F304-L480 HydrophobicContact CZ-CG 3.74Å
305	N	89.9	Confident	86.4	Confident	24 Å²	24	55.6 Å²	55.6	13%	0.128	29%	0.29	C	S	.	.			trans	-81.8	112.3	-179.6	-172.1	-14.5	0	0	0	110.8	E307 N308 L338	N305-E307 VanDerWaalsContact C-N 3.25Å; N305-E307 PolarHBondContact O-N 2.86Å; N305-E307 WeakPolarHBondContact OD1-CB 3.32Å; N305-E307 PolarHBondContact OD1-N 2.83Å; N305-N308 PolarHBondContact ND2-ND2 3.41Å; N305-N308 PolarHBondContact O-N 2.83Å; N305-L338 WeakPolarHBondContact CB-O 3.38Å; N305-L338 PolarHBondContact N-O 3.32Å
306	P	86.1	Confident	86.6	Confident	63 Å²	63	56 Å²	56	41%	0.409	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-67	-23.6	-179.5	28.8	-35.6	0	0	0	113.1	F304 N308 L309 L315	F304-P306 VanDerWaalsContact O-CD 3.27Å; F304-P306 WeakPolarHBondContact O-CD 3.39Å; P306-N308 PolarHBondContact O-N 3.43Å; P306-L309 WeakPolarHBondContact O-CB 3.19Å; P306-L309 PolarHBondContact O-N 3.15Å; P306-L315 HydrophobicContact CB-CD1 4.24Å
307	E	83.6	Confident	86.8	Confident	172 Å²	172	61.9 Å²	61.9	80%	0.804	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-67	-23.8	178.6	-61	-176.1	162	0	0	112.7	N305	N305-E307 VanDerWaalsContact C-N 3.25Å; N305-E307 PolarHBondContact O-N 2.86Å; N305-E307 WeakPolarHBondContact OD1-CB 3.32Å; N305-E307 PolarHBondContact OD1-N 2.83Å
308	N	73.6	Confident	86.9	Confident	43 Å²	43	62.3 Å²	62.3	23%	0.23	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-99.5	14.2	179	-65	-60.6	0	0	0	112.5	N305 P306 N310	N305-N308 PolarHBondContact ND2-ND2 3.41Å; N305-N308 PolarHBondContact O-N 2.83Å; P306-N308 PolarHBondContact O-N 3.43Å; N308-N310 PolarHBondContact O-N 3.34Å
309	L	76	Confident	86.9	Confident	72 Å²	72	60.7 Å²	60.7	38%	0.377	31%	0.312	S	S	.	.			trans	-69	130.7	-175.9	-166.7	67.2	0	0	0	111.2	P306 L313 L315 I337	P306-L309 WeakPolarHBondContact O-CB 3.19Å; P306-L309 PolarHBondContact O-N 3.15Å; L309-L313 HydrophobicContact CD1-CB 3.57Å; L309-L313 HydrophobicContact CD1-CD1 4.45Å; L309-L313 HydrophobicContact CG-CB 4.37Å; L309-L315 HydrophobicContact CD1-CD1 4.06Å; L309-L315 HydrophobicContact CD1-CD2 4.27Å; L309-L315 HydrophobicContact CD1-CG 3.77Å; L309-I337 HydrophobicContact CD1-CD1 3.78Å
310	N	72.3	Confident	86.9	Confident	16 Å²	16	60.9 Å²	60.9	9%	0.086	31%	0.313	C	S	.	.			trans	-87.8	150.8	172.4	-165.9	-37	0	0	0	109.7	N308 N312 L313 C332 N334	N308-N310 PolarHBondContact O-N 3.34Å; N310-N312 PolarHBondContact O-N 2.91Å; N310-L313 HydrophobicContact CB-CD1 4.26Å; N310-L313 HydrophobicContact CB-CG 4.33Å; N310-L313 PolarHBondContact O-N 3.32Å; N310-C332 PolarHBondContact ND2-SG 3.13Å; N310-C332 VanDerWaalsContact ND2-SG 3.44Å; N310-N334 PolarHBondContact ND2-O 3.11Å
311	L	72.9	Confident	86.9	Confident	150 Å²	150	63.3 Å²	63.3	79%	0.785	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-26.2	176.6	-68.4	168.8	0	0	0	113.8	I327	L311-I327 WeakPolarHBondContact O-CD1 3.3Å
312	N	80	Confident	87	Confident	12 Å²	12	59.3 Å²	59.3	6%	0.064	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	10.9	-179.7	-69.5	-10.9	0	0	0	114.2	N310 S324 V325 F330 C332	N310-N312 PolarHBondContact O-N 2.91Å; N312-S324 WeakPolarHBondContact O-CA 3.49Å; N312-V325 WeakPolarHBondContact CA-O 3.3Å; N312-V325 WeakPolarHBondContact CB-O 3.4Å; N312-V325 PolarHBondContact O-N 3Å; N312-F330 PolarHBondContact ND2-O 3.12Å; N312-C332 WeakPolarHBondContact ND2-CB 3.38Å
313	L	85.8	Confident	86.9	Confident	6 Å²	6	60.7 Å²	60.7	3%	0.031	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.5	-179.2	-64.6	-179.8	0	0	0	110.8	L309 N310 V322 T323 N335 I337 P471	L309-L313 HydrophobicContact CD1-CB 3.57Å; L309-L313 HydrophobicContact CD1-CD1 4.45Å; L309-L313 HydrophobicContact CG-CB 4.37Å; N310-L313 HydrophobicContact CB-CD1 4.26Å; N310-L313 HydrophobicContact CB-CG 4.33Å; N310-L313 PolarHBondContact O-N 3.32Å; L313-V322 HydrophobicContact CB-CG2 4.21Å; L313-V322 HydrophobicContact CD1-CG2 4.18Å; L313-V322 HydrophobicContact CD2-CG2 3.95Å; L313-V322 HydrophobicContact CG-CG2 4.35Å; L313-T323 WeakPolarHBondContact CA-O 3.44Å; L313-N335 HydrophobicContact CD2-CB 3.98Å; L313-N335 HydrophobicContact CG-CB 4.46Å; L313-I337 HydrophobicContact CD1-CB 4.01Å; L313-I337 HydrophobicContact CD1-CG2 4.41Å; L313-P471 HydrophobicContact CD2-CG 3.52Å
314	I	88.6	Confident	86.5	Confident	96 Å²	96	59.2 Å²	59.2	49%	0.492	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	136.5	170.7	-59.5	-173.7	0	0	0	108.4	V322 T323 V325	I314-V322 WeakPolarHBondContact O-CA 3.46Å; I314-T323 PolarHBondContact N-O 3.41Å; I314-T323 PolarHBondContact O-N 3.1Å; I314-V325 HydrophobicContact CB-CG2 4.45Å; I314-V325 HydrophobicContact CD1-CB 4.26Å; I314-V325 HydrophobicContact CD1-CG2 3.47Å; I314-V325 VanDerWaalsContact CD1-CG2 3.47Å; I314-V325 HydrophobicContact CG1-CB 4.41Å; I314-V325 HydrophobicContact CG1-CG2 3.74Å
315	L	91.5	Very high	86	Confident	27 Å²	27	61.8 Å²	61.8	14%	0.141	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	146.5	172	-63.3	179.3	0	0	0	110.5	F304 P306 L309 Q321 V322 I337	F304-L315 HydrophobicContact CB-CD1 4.2Å; F304-L315 HydrophobicContact CB-CD2 3.65Å; F304-L315 HydrophobicContact CD2-CD2 3.86Å; F304-L315 HydrophobicContact CG-CD2 4.03Å; P306-L315 HydrophobicContact CB-CD1 4.24Å; L309-L315 HydrophobicContact CD1-CD1 4.06Å; L309-L315 HydrophobicContact CD1-CD2 4.27Å; L309-L315 HydrophobicContact CD1-CG 3.77Å; L315-Q321 WeakPolarHBondContact CA-O 3.3Å; L315-V322 HydrophobicContact CD2-CB 3.84Å; L315-V322 HydrophobicContact CD2-CG2 3.96Å; L315-I337 HydrophobicContact CD1-CD1 4.3Å; L315-I337 HydrophobicContact CD2-CD1 3.94Å
316	S	93.1	Very high	85	Confident	31 Å²	31	65.3 Å²	65.3	22%	0.217	34%	0.344	C	S	.	.			trans	-65	163.6	164.6	52.6	0	0	0	0	111.4	D318 H319 R320 Q321	S316-D318 WeakPolarHBondContact CB-OD1 3.43Å; S316-D318 PolarHBondContact O-N 3.33Å; S316-D318 PolarHBondContact OG-OD1 3.49Å; S316-H319 WeakPolarHBondContact O-CA 3.49Å; S316-H319 PolarHBondContact O-CD2 3.44Å; S316-H319 VanDerWaalsContact O-CD2 3.24Å; S316-H319 PolarHBondContact O-N 2.85Å; S316-R320 PolarHBondContact OG-N 2.81Å; S316-Q321 PolarHBondContact N-O 3Å; S316-Q321 VanDerWaalsContact N-O 3.09Å; S316-Q321 WeakPolarHBondContact OG-CB 3.45Å; S316-Q321 PolarHBondContact OG-N 3.45Å
317	E	91.5	Very high	83.8	Confident	198 Å²	198	66.8 Å²	66.8	93%	0.925	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-35.6	178.9	-173.4	177.6	-174.9	0	0	113.3	H319	E317-H319 PolarHBondContact O-N 2.92Å
318	D	91.4	Very high	82.3	Confident	90 Å²	90	69.8 Å²	69.8	48%	0.481	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	1	176.8	72.5	-12.8	0	0	0	113.9	S316 R320	S316-D318 WeakPolarHBondContact CB-OD1 3.43Å; S316-D318 PolarHBondContact O-N 3.33Å; S316-D318 PolarHBondContact OG-OD1 3.49Å; D318-R320 PolarHBondContact O-N 3.14Å; D318-R320 VanDerWaalsContact O-N 3.15Å; D318-R320 PolarHBondContact OD1-N 2.95Å; D318-R320 WeakPolarHBondContact OD2-CB 3.39Å
319	H	92.5	Very high	81.2	Confident	73 Å²	73	72.2 Å²	72.2	34%	0.338	37%	0.37	S	S	.	.	S	Bend	trans	53	26.9	-174.9	-56.7	160.2	0	0	0	114.3	T303 F304 S316 E317	T303-H319 WeakPolarHBondContact CB-O 3.48Å; T303-H319 HydrophobicContact CG2-CB 4.31Å; F304-H319 WeakPolarHBondContact CD2-O 3.37Å; F304-H319 PolarHBondContact N-O 3.42Å; S316-H319 WeakPolarHBondContact O-CA 3.49Å; S316-H319 PolarHBondContact O-CD2 3.44Å; S316-H319 VanDerWaalsContact O-CD2 3.24Å; S316-H319 PolarHBondContact O-N 2.85Å; E317-H319 PolarHBondContact O-N 2.92Å
320	R	93.2	Very high	80	Confident	43 Å²	43	75.4 Å²	75.4	16%	0.162	38%	0.381	C	S	.	.			trans	-103	-11.2	176.9	-68.3	-171.2	175.2	-94.5	-15.4	114.7	N301 T303 F304 S316 D318 T479 L480	N301-R320 VanDerWaalsContact CG-NH2 3.29Å; N301-R320 PolarHBondContact ND2-NH2 3.14Å; N301-R320 VanDerWaalsContact OD1-CZ 3.27Å; N301-R320 PolarHBondContact OD1-NH1 2.9Å; N301-R320 PolarHBondContact OD1-NH2 3.49Å; T303-R320 HydrophobicContact CG2-CG 4.31Å; F304-R320 VanDerWaalsContact CE2-C 3.43Å; F304-R320 WeakPolarHBondContact CE2-O 3.36Å; S316-R320 PolarHBondContact OG-N 2.81Å; D318-R320 PolarHBondContact O-N 3.14Å; D318-R320 VanDerWaalsContact O-N 3.15Å; D318-R320 PolarHBondContact OD1-N 2.95Å; D318-R320 WeakPolarHBondContact OD2-CB 3.39Å; R320-T479 CarbonylContact O-C 3.45Å; R320-T479 WeakPolarHBondContact O-CA 3.49Å; R320-L480 HydrophobicContact CB-CB 4.44Å; R320-L480 PolarHBondContact O-N 3.41Å
321	Q	93.1	Very high	79	Confident	81 Å²	81	84 Å²	84	38%	0.379	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137.9	175.4	-53.1	-171	-33.3	0	0	109.7	L315 S316 M478 T479	L315-Q321 WeakPolarHBondContact CA-O 3.3Å; S316-Q321 PolarHBondContact N-O 3Å; S316-Q321 VanDerWaalsContact N-O 3.09Å; S316-Q321 WeakPolarHBondContact OG-CB 3.45Å; S316-Q321 PolarHBondContact OG-N 3.45Å; Q321-M478 WeakPolarHBondContact CA-O 3.26Å; Q321-T479 HydrophobicContact CG-CG2 3.8Å; Q321-T479 WeakPolarHBondContact CG-OG1 3.43Å; Q321-T479 PolarHBondContact NE2-OG1 3.18Å
322	V	91.9	Very high	78	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.2	172.8	64.2	0	0	0	0	110	F304 L313 I314 L315 I337 P471 M478	F304-V322 HydrophobicContact CD2-CB 3.94Å; F304-V322 HydrophobicContact CD2-CG1 4.26Å; F304-V322 HydrophobicContact CE1-CG1 4.06Å; F304-V322 HydrophobicContact CE2-CB 3.76Å; F304-V322 HydrophobicContact CE2-CG1 3.65Å; F304-V322 HydrophobicContact CG-CB 4.45Å; F304-V322 HydrophobicContact CZ-CB 4.16Å; F304-V322 HydrophobicContact CZ-CG1 3.55Å; L313-V322 HydrophobicContact CB-CG2 4.21Å; L313-V322 HydrophobicContact CD1-CG2 4.18Å; L313-V322 HydrophobicContact CD2-CG2 3.95Å; L313-V322 HydrophobicContact CG-CG2 4.35Å; I314-V322 WeakPolarHBondContact O-CA 3.46Å; L315-V322 HydrophobicContact CD2-CB 3.84Å; L315-V322 HydrophobicContact CD2-CG2 3.96Å; V322-I337 HydrophobicContact CG1-CG2 4.48Å; V322-I337 HydrophobicContact CG2-CG2 4.31Å; V322-P471 HydrophobicContact CG2-CG 4.4Å; V322-M478 HydrophobicContact CG1-CB 3.85Å; V322-M478 PolarHBondContact N-O 2.88Å; V322-M478 PolarHBondContact O-N 3.47Å
323	T	90.4	Very high	76.8	Confident	40 Å²	40	81.1 Å²	81.1	25%	0.245	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.1	-179	-62.3	0	0	0	0	110	L313 I314 P475	L313-T323 WeakPolarHBondContact CA-O 3.44Å; I314-T323 PolarHBondContact N-O 3.41Å; I314-T323 PolarHBondContact O-N 3.1Å; T323-P475 WeakPolarHBondContact CG2-O 3.49Å
324	S	86.8	Confident	75.7	Confident	7 Å²	7	81.5 Å²	81.5	5%	0.049	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	130.7	173	179.3	0	0	0	0	110.4	N312 N335 W472	N312-S324 WeakPolarHBondContact O-CA 3.49Å; S324-N335 PolarHBondContact OG-ND2 3.15Å; S324-W472 WeakPolarHBondContact CB-O 3.45Å; S324-W472 PolarHBondContact OG-O 3Å
325	V	81.6	Confident	75.1	Confident	53 Å²	53	77.5 Å²	77.5	32%	0.321	39%	0.391	S	S	.	.			trans	-123.2	131.1	173	-178.1	0	0	0	0	109.7	N312 I314 I327	N312-V325 WeakPolarHBondContact CA-O 3.3Å; N312-V325 WeakPolarHBondContact CB-O 3.4Å; N312-V325 PolarHBondContact O-N 3Å; I314-V325 HydrophobicContact CB-CG2 4.45Å; I314-V325 HydrophobicContact CD1-CB 4.26Å; I314-V325 HydrophobicContact CD1-CG2 3.47Å; I314-V325 VanDerWaalsContact CD1-CG2 3.47Å; I314-V325 HydrophobicContact CG1-CB 4.41Å; I314-V325 HydrophobicContact CG1-CG2 3.74Å; V325-I327 HydrophobicContact CG1-CG1 4.44Å; V325-I327 PolarHBondContact O-N 2.82Å
326	S	68.6	Low	74.8	Confident	98 Å²	98	76.6 Å²	76.6	69%	0.685	39%	0.388	S	S	*	.			trans	-85.1	93.5	179.7	-62.5	0	0	0	0	110.1	W328	S326-W328 PolarHBondContact O-N 3.14Å
327	I	61.8	Low	74.6	Confident	94 Å²	94	75.1 Å²	75.1	48%	0.482	38%	0.378	S	S	.	.			trans	-84	109	171.8	-53.4	-175	0	0	0	109	L311 V325 F330	L311-I327 WeakPolarHBondContact O-CD1 3.3Å; V325-I327 HydrophobicContact CG1-CG1 4.44Å; V325-I327 PolarHBondContact O-N 2.82Å; I327-F330 PolarHBondContact O-N 3.09Å
328	W	50.8	Low	74.7	Confident	236 Å²	236	66.3 Å²	66.3	89%	0.894	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	140.2	173.8	-123.3	76.8	0	0	0	110.4	S326	S326-W328 PolarHBondContact O-N 3.14Å
329	P	50.6	Low	74.7	Confident	93 Å²	93	62 Å²	62	60%	0.604	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	cis	-102.7	11.3	6.6	38.8	-33.2	0	0	0	114.7	K331	P329-K331 PolarHBondContact O-N 3.15Å
330	F	51.3	Low	74.7	Confident	140 Å²	140	61.2 Å²	61.2	61%	0.614	32%	0.317	S	S	*	.			trans	-93.3	97.4	-173.6	-68.7	-81.4	0	0	0	111.8	N312 I327 C332 V375	N312-F330 PolarHBondContact ND2-O 3.12Å; I327-F330 PolarHBondContact O-N 3.09Å; F330-C332 PolarHBondContact O-N 3.27Å; F330-V375 HydrophobicContact CD1-CG1 4.45Å
331	K	52.1	Low	74.7	Confident	197 Å²	197	63.2 Å²	63.2	86%	0.857	33%	0.327	S	S	*	.			trans	-68.8	78.1	162.7	-80.8	-175	176.6	-178.9	0	109.7	P329 C333	P329-K331 PolarHBondContact O-N 3.15Å; K331-C333 PolarHBondContact O-N 3.32Å; K331-C333 PolarHBondContact O-SG 3.09Å
332	C	51.4	Low	74.7	Confident	29 Å²	29	62.1 Å²	62.1	20%	0.196	33%	0.327	C	S	.	.			trans	-65.1	119.3	171.4	-152.4	0	0	0	0	108	N310 N312 F330 N334 N335	N310-C332 PolarHBondContact ND2-SG 3.13Å; N310-C332 VanDerWaalsContact ND2-SG 3.44Å; N312-C332 WeakPolarHBondContact ND2-CB 3.38Å; F330-C332 PolarHBondContact O-N 3.27Å; C332-N334 PolarHBondContact O-N 3.24Å; C332-N335 PolarHBondContact O-OD1 3.04Å
333	C	54.4	Low	74.8	Confident	72 Å²	72	62.8 Å²	62.8	49%	0.486	33%	0.33	S	S	.	.	S	Bend	trans	-83.4	7.4	-172.5	-62.4	0	0	0	0	113.1	K331	K331-C333 PolarHBondContact O-N 3.32Å; K331-C333 PolarHBondContact O-SG 3.09Å
334	N	64.1	Low	74.8	Confident	13 Å²	13	65.6 Å²	65.6	7%	0.07	35%	0.351	C	S	.	.			trans	-138.7	77	-171.9	-175.6	26.8	0	0	0	112.5	N310 C332 G336 R387	N310-N334 PolarHBondContact ND2-O 3.11Å; C332-N334 PolarHBondContact O-N 3.24Å; N334-G336 PolarHBondContact O-N 3.38Å; N334-R387 PolarHBondContact ND2-NH1 2.93Å; N334-R387 PolarHBondContact OD1-NH1 2.98Å
335	N	75	Confident	75.1	Confident	12 Å²	12	69.1 Å²	69.1	6%	0.064	38%	0.376	C	S	.	.			trans	-81.4	34	176.7	-64.9	-6.1	0	0	0	112.5	L313 S324 C332 N470 P471 W472	L313-N335 HydrophobicContact CD2-CB 3.98Å; L313-N335 HydrophobicContact CG-CB 4.46Å; S324-N335 PolarHBondContact OG-ND2 3.15Å; C332-N335 PolarHBondContact O-OD1 3.04Å; N335-N470 PolarHBondContact O-OD1 2.98Å; N335-P471 VanDerWaalsContact O-CD 3.28Å; N335-P471 WeakPolarHBondContact O-CD 3.3Å; N335-W472 PolarHBondContact ND2-O 3.11Å
336	G	85.4	Confident	75.6	Confident	8 Å²	8	67.5 Å²	67.5	8%	0.082	37%	0.37	C	S	.	.			trans	-81.9	137.8	-179.5	0	0	0	0	0	112.9	N334 Y468 F469	N334-G336 PolarHBondContact O-N 3.38Å; G336-Y468 WeakPolarHBondContact CA-OH 3.38Å; G336-F469 CarbonylContact C-O 3.59Å; G336-F469 WeakPolarHBondContact CA-O 3.39Å
337	I	89.7	Confident	76.9	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	151.2	173.2	-169.5	161.7	0	0	0	110.5	F304 L309 L313 L315 V322 F469	F304-I337 HydrophobicContact CB-CD1 3.86Å; F304-I337 HydrophobicContact CB-CG1 4.41Å; F304-I337 HydrophobicContact CD1-CG2 3.98Å; F304-I337 HydrophobicContact CE1-CG2 4.38Å; F304-I337 HydrophobicContact CG-CD1 4.5Å; L309-I337 HydrophobicContact CD1-CD1 3.78Å; L313-I337 HydrophobicContact CD1-CB 4.01Å; L313-I337 HydrophobicContact CD1-CG2 4.41Å; L315-I337 HydrophobicContact CD1-CD1 4.3Å; L315-I337 HydrophobicContact CD2-CD1 3.94Å; V322-I337 HydrophobicContact CG1-CG2 4.48Å; V322-I337 HydrophobicContact CG2-CG2 4.31Å; I337-F469 HydrophobicContact CG2-CB 3.94Å; I337-F469 PolarHBondContact N-O 3.48Å; I337-F469 PolarHBondContact O-N 2.79Å
338	L	92.6	Very high	78.5	Confident	13 Å²	13	62.5 Å²	62.5	7%	0.068	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	155.5	178	-60.7	178.6	0	0	0	111.3	N305 Y365 Y466 P467 Y468	N305-L338 WeakPolarHBondContact CB-O 3.38Å; N305-L338 PolarHBondContact N-O 3.32Å; L338-Y365 HydrophobicContact CD1-CD1 4.48Å; L338-Y365 HydrophobicContact CD2-CD1 3.94Å; L338-Y466 HydrophobicContact CD1-CD1 4.19Å; L338-Y466 HydrophobicContact CD1-CG 4.19Å; L338-P467 CarbonylContact C-O 3.5Å; L338-P467 VanDerWaalsContact CA-O 3.32Å; L338-P467 WeakPolarHBondContact CA-O 3.24Å; L338-Y468 HydrophobicContact CD2-CD2 3.74Å
339	G	92.3	Very high	80.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-64	155.5	165	0	0	0	0	0	112.1	T303 K341 P467	T303-G339 CarbonylContact O-C 3.56Å; G339-K341 PolarHBondContact O-N 3.18Å; G339-P467 PolarHBondContact N-O 3.48Å
340	S	92.3	Very high	82.8	Confident	56 Å²	56	47 Å²	47	39%	0.392	26%	0.262	S	S	.	.	S	Bend	trans	-71.4	-18.3	176.1	54.4	0	0	0	0	113.5	T303	T303-S340 PolarHBondContact N-OG 3.3Å; T303-S340 VanDerWaalsContact N-OG 3.12Å; T303-S340 WeakPolarHBondContact O-CB 3.3Å; T303-S340 PolarHBondContact O-N 3.07Å; T303-S340 PolarHBondContact O-OG 2.91Å; T303-S340 PolarHBondContact OG1-OG 3.04Å
341	K	93.2	Very high	85	Confident	85 Å²	85	40.5 Å²	40.5	37%	0.37	23%	0.234	S	C	.	.			trans	-102	156.4	173	-72.5	-172.4	176.8	167.6	0	112.2	D300 N301 F302 G339 F343 P467	D300-K341 IonicContact OD1-NZ 3.73Å; D300-K341 PolarHBondContact OD1-NZ 3.47Å; N301-K341 WeakPolarHBondContact O-CE 3.3Å; N301-K341 PolarHBondContact O-NZ 3.38Å; F302-K341 HydrophobicContact CB-CB 4.17Å; F302-K341 HydrophobicContact CB-CD 4.03Å; F302-K341 HydrophobicContact CB-CG 3.93Å; G339-K341 PolarHBondContact O-N 3.18Å; K341-F343 HydrophobicContact CB-CE1 4.28Å; K341-F343 HydrophobicContact CB-CZ 4.1Å; K341-F343 HydrophobicContact CD-CE1 4.36Å; K341-P467 WeakPolarHBondContact O-CD 3.37Å
342	C	92.3	Very high	87	Confident	58 Å²	58	31.1 Å²	31.1	39%	0.392	19%	0.193	S	C	.	.			trans	-131	156.6	166.7	69.3	0	0	0	0	110	P464 A465 Y466	C342-P464 HydrophobicContact CB-CB 3.96Å; C342-A465 CarbonylContact C-O 3.58Å; C342-A465 VanDerWaalsContact CA-O 3.3Å; C342-A465 WeakPolarHBondContact CA-O 3.3Å; C342-Y466 HydrophobicContact CB-CD1 3.66Å; C342-Y466 HydrophobicContact CB-CD2 4.18Å; C342-Y466 HydrophobicContact CB-CE1 3.38Å; C342-Y466 HydrophobicContact CB-CE2 3.91Å; C342-Y466 HydrophobicContact CB-CG 4.05Å; C342-Y466 VanDerWaalsContact CB-CZ 3.5Å
343	F	93.6	Very high	89.1	Confident	13 Å²	13	31.8 Å²	31.8	6%	0.057	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-128.2	123.2	-171.4	-53.7	-66.3	0	0	0	109.6	D300 F302 K341 H348 W350 L434 P464 A465 P467	D300-F343 HydrophobicContact CB-CE1 4.38Å; D300-F343 HydrophobicContact CB-CZ 4.08Å; D300-F343 WeakPolarHBondContact OD2-CE1 3.35Å; F302-F343 HydrophobicContact CD1-CZ 4.48Å; K341-F343 HydrophobicContact CB-CE1 4.28Å; K341-F343 HydrophobicContact CB-CZ 4.1Å; K341-F343 HydrophobicContact CD-CE1 4.36Å; F343-H348 HydrophobicContact CD1-CB 4.37Å; F343-H348 AromaticContact CD1-CD2 3.62Å; F343-H348 AromaticContact CD1-CE1 3.33Å; F343-H348 WeakPolarHBondContact CD1-CE1 3.42Å; F343-H348 AromaticContact CD1-CG 3.51Å; F343-H348 AromaticContact CD1-ND1 3.33Å; F343-H348 VanDerWaalsContact CD1-ND1 3.33Å; F343-H348 WeakPolarHBondContact CD1-ND1 3.23Å; F343-H348 AromaticContact CD1-NE2 3.5Å; F343-H348 HydrophobicContact CD2-CB 4.42Å; F343-H348 HydrophobicContact CE1-CB 4.29Å; F343-H348 AromaticContact CE1-CE1 3.84Å; F343-H348 AromaticContact CE1-CG 3.75Å; F343-H348 AromaticContact CE1-ND1 3.42Å; F343-H348 WeakPolarHBondContact CE1-ND1 3.48Å; F343-H348 HydrophobicContact CE2-CB 4.33Å; F343-H348 HydrophobicContact CG-CB 4.42Å; F343-H348 AromaticContact CG-CD2 3.58Å; F343-H348 AromaticContact CG-CG 3.75Å; F343-H348 AromaticContact CG-NE2 3.79Å; F343-H348 HydrophobicContact CZ-CB 4.26Å; F343-W350 HydrophobicContact CE2-CZ3 4.07Å; F343-L434 HydrophobicContact CB-CD2 3.96Å; F343-L434 HydrophobicContact CD2-CD2 3.92Å; F343-L434 HydrophobicContact CG-CD2 4.29Å; F343-P464 WeakPolarHBondContact O-CA 3.5Å; F343-A465 PolarHBondContact N-O 3.31Å; F343-A465 PolarHBondContact O-N 3.04Å; F343-P467 HydrophobicContact CD2-CG 4.41Å; F343-P467 HydrophobicContact CE2-CG 3.66Å
344	S	91.5	Very high	91	Very high	99 Å²	99	28.4 Å²	28.4	69%	0.692	17%	0.172	S	C	*	.	S	Bend	trans	-108.8	-14.8	176.8	47	0	0	0	0	113
345	S	92.6	Very high	92.1	Very high	81 Å²	81	30.2 Å²	30.2	57%	0.566	19%	0.185	S	C	*	.	S	Bend	trans	-161.9	155.9	-175.1	59.6	0	0	0	0	110.8	H348	S345-H348 PolarHBondContact O-NE2 3.1Å
346	G	93.1	Very high	92.7	Very high	19 Å²	19	36.3 Å²	36.3	20%	0.196	21%	0.214	C	C	.	.	S	Bend	trans	90	-168.7	175.9	0	0	0	0	0	113.6	C436	G346-C436 VanDerWaalsContact O-CB 3.28Å; G346-C436 WeakPolarHBondContact O-CB 3.42Å; G346-C436 PolarHBondContact O-N 2.91Å; G346-C436 PolarHBondContact O-SG 3.41Å; G346-C436 VanDerWaalsContact O-SG 3.39Å
347	K	95.1	Very high	92.8	Very high	65 Å²	65	36.4 Å²	36.4	28%	0.283	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	134.4	-175.5	-57.6	-177.3	-168.1	-131.8	0	109.3	Y298 F433 L434 D435	Y298-K347 HydrophobicContact CD1-CB 3.64Å; Y298-K347 HydrophobicContact CD2-CB 4.35Å; Y298-K347 HydrophobicContact CE1-CB 4Å; Y298-K347 HydrophobicContact CE1-CD 4.04Å; Y298-K347 HydrophobicContact CE2-CD 4.34Å; Y298-K347 HydrophobicContact CG-CB 3.82Å; K347-F433 HydrophobicContact CB-CE2 4.01Å; K347-F433 HydrophobicContact CB-CZ 4.14Å; K347-F433 HydrophobicContact CD-CZ 4.16Å; K347-F433 HydrophobicContact CG-CZ 4.42Å; K347-L434 CarbonylContact C-O 3.57Å; K347-L434 WeakPolarHBondContact CA-O 3.49Å; K347-D435 VanDerWaalsContact CE-OD2 3.25Å; K347-D435 WeakPolarHBondContact CE-OD2 3.3Å; K347-D435 HydrophobicContact CG-CB 4.49Å; K347-D435 IonicContact NZ-OD1 3.66Å; K347-D435 IonicContact NZ-OD2 3.65Å; K347-D435 PolarHBondContact NZ-OD2 3.37Å
348	H	95.7	Very high	92.7	Very high	23 Å²	23	43.5 Å²	43.5	11%	0.106	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	138.6	-170.7	-53.2	-74.7	0	0	0	110.8	Y298 D300 F343 S345 W350 F433 L434	Y298-H348 CarbonylContact O-C 3.46Å; D300-H348 IonicContact OD2-CE1 3.83Å; D300-H348 IonicContact OD2-CG 2.74Å; D300-H348 IonicContact OD2-ND1 3.54Å; D300-H348 PolarHBondContact OD2-ND1 3.42Å; F343-H348 HydrophobicContact CD1-CB 4.37Å; F343-H348 AromaticContact CD1-CD2 3.62Å; F343-H348 AromaticContact CD1-CE1 3.33Å; F343-H348 WeakPolarHBondContact CD1-CE1 3.42Å; F343-H348 AromaticContact CD1-CG 3.51Å; F343-H348 AromaticContact CD1-ND1 3.33Å; F343-H348 VanDerWaalsContact CD1-ND1 3.33Å; F343-H348 WeakPolarHBondContact CD1-ND1 3.23Å; F343-H348 AromaticContact CD1-NE2 3.5Å; F343-H348 HydrophobicContact CD2-CB 4.42Å; F343-H348 HydrophobicContact CE1-CB 4.29Å; F343-H348 AromaticContact CE1-CE1 3.84Å; F343-H348 AromaticContact CE1-CG 3.75Å; F343-H348 AromaticContact CE1-ND1 3.42Å; F343-H348 WeakPolarHBondContact CE1-ND1 3.48Å; F343-H348 HydrophobicContact CE2-CB 4.33Å; F343-H348 HydrophobicContact CG-CB 4.42Å; F343-H348 AromaticContact CG-CD2 3.58Å; F343-H348 AromaticContact CG-CG 3.75Å; F343-H348 AromaticContact CG-NE2 3.79Å; F343-H348 HydrophobicContact CZ-CB 4.26Å; S345-H348 PolarHBondContact O-NE2 3.1Å; H348-W350 HydrophobicContact CB-CZ3 4.24Å; H348-F433 WeakPolarHBondContact O-CA 3.47Å; H348-F433 WeakPolarHBondContact O-CD2 3.28Å; H348-L434 HydrophobicContact CB-CB 4.41Å; H348-L434 PolarHBondContact N-O 3.29Å; H348-L434 PolarHBondContact O-N 3.27Å
349	Y	96.2	Very high	92.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	138.4	-179.5	-178.5	-106.5	0	0	0	112.1	L292 V295 R296 Y298 W299 D300 E351 G431 V432 F433 L444	L292-Y349 WeakPolarHBondContact CD1-OH 3.39Å; V295-Y349 HydrophobicContact CG1-CD1 4.35Å; V295-Y349 HydrophobicContact CG1-CD2 3.2Å; V295-Y349 HydrophobicContact CG1-CE2 3.63Å; V295-Y349 HydrophobicContact CG1-CG 3.59Å; R296-Y349 HydrophobicContact CG-CD1 4Å; R296-Y349 HydrophobicContact CG-CE1 3.52Å; Y298-Y349 PolarHBondContact O-N 3.21Å; W299-Y349 WeakPolarHBondContact CA-O 3.27Å; W299-Y349 HydrophobicContact CD2-CD1 4.43Å; W299-Y349 AromaticContact CE3-CD1 3.58Å; W299-Y349 HydrophobicContact CE3-CD1 3.58Å; W299-Y349 AromaticContact CE3-CE1 3.73Å; W299-Y349 HydrophobicContact CE3-CE1 3.73Å; W299-Y349 AromaticContact CZ3-CD1 3.97Å; W299-Y349 HydrophobicContact CZ3-CD1 3.97Å; W299-Y349 AromaticContact CZ3-CE1 3.64Å; W299-Y349 HydrophobicContact CZ3-CE1 3.64Å; D300-Y349 PolarHBondContact N-O 2.73Å; Y349-E351 HydrophobicContact CE1-CG 3.58Å; Y349-E351 WeakPolarHBondContact CE1-OE1 3.4Å; Y349-E351 VanDerWaalsContact OH-CD 3.29Å; Y349-E351 WeakPolarHBondContact OH-CG 3.45Å; Y349-E351 PolarHBondContact OH-OE1 2.85Å; Y349-G431 WeakPolarHBondContact OH-CA 3.41Å; Y349-V432 WeakPolarHBondContact CA-O 3.39Å; Y349-V432 WeakPolarHBondContact CD2-O 3.43Å; Y349-F433 HydrophobicContact CD2-CB 4Å; Y349-F433 HydrophobicContact CD2-CD2 4.44Å; Y349-L444 HydrophobicContact CE2-CD1 4.06Å
350	W	96.2	Very high	92.5	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.015	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	158.6	170.8	62	94.8	0	0	0	111.4	F302 F343 H348 V364 G431 V432 L434 P467 F469	F302-W350 HydrophobicContact CE1-CB 3.74Å; F302-W350 AromaticContact CE1-CD2 3.81Å; F302-W350 HydrophobicContact CE1-CD2 3.81Å; F302-W350 HydrophobicContact CE1-CE3 4.06Å; F302-W350 AromaticContact CE1-CG 3.69Å; F302-W350 HydrophobicContact CE1-CG 3.69Å; F302-W350 HydrophobicContact CZ-CB 4.06Å; F302-W350 AromaticContact CZ-CD1 3.8Å; F302-W350 AromaticContact CZ-CD2 3.83Å; F302-W350 HydrophobicContact CZ-CD2 3.83Å; F302-W350 HydrophobicContact CZ-CE3 4.44Å; F302-W350 AromaticContact CZ-CG 3.62Å; F302-W350 HydrophobicContact CZ-CG 3.62Å; F343-W350 HydrophobicContact CE2-CZ3 4.07Å; H348-W350 HydrophobicContact CB-CZ3 4.24Å; W350-V364 HydrophobicContact CH2-CG2 3.82Å; W350-V364 HydrophobicContact CZ2-CG2 4.12Å; W350-G431 WeakPolarHBondContact O-CA 3.33Å; W350-V432 HydrophobicContact CD2-CB 4.13Å; W350-V432 HydrophobicContact CH2-CB 4.33Å; W350-V432 HydrophobicContact CH2-CG1 3.81Å; W350-V432 HydrophobicContact CZ2-CB 3.72Å; W350-V432 HydrophobicContact CZ2-CG1 3.42Å; W350-V432 VanDerWaalsContact CZ2-CG1 3.42Å; W350-V432 HydrophobicContact CZ2-CG2 4.38Å; W350-V432 PolarHBondContact N-O 3.41Å; W350-V432 VanDerWaalsContact N-O 3.15Å; W350-V432 PolarHBondContact O-N 2.87Å; W350-L434 HydrophobicContact CH2-CB 4.27Å; W350-L434 HydrophobicContact CZ3-CB 4.17Å; W350-P467 HydrophobicContact CH2-CB 4.32Å; W350-P467 HydrophobicContact CH2-CG 4.03Å; W350-P467 HydrophobicContact CZ2-CB 3.76Å; W350-P467 HydrophobicContact CZ2-CG 3.97Å; W350-P467 HydrophobicContact CZ3-CG 4.36Å; W350-F469 AromaticContact NE1-CE1 3.87Å; W350-F469 AromaticContact NE1-CZ 3.78Å
351	E	95.9	Very high	92.5	Very high	2 Å²	2	41 Å²	41	1%	0.009	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	143	178.3	-65	-177.7	-175.5	0	0	111.3	R296 W299 Y349 R429 V430 V446 C481	R296-E351 IonicContact CZ-OE1 2.69Å; R296-E351 VanDerWaalsContact CZ-OE1 3.24Å; R296-E351 IonicContact NE-OE1 3.68Å; R296-E351 PolarHBondContact NE-OE1 3.34Å; R296-E351 IonicContact NH2-OE1 3.79Å; R296-E351 PolarHBondContact NH2-OE1 3.36Å; R296-E351 IonicContact NH2-OE2 3.06Å; R296-E351 PolarHBondContact NH2-OE2 3.13Å; W299-E351 HydrophobicContact CH2-CB 3.82Å; W299-E351 HydrophobicContact CH2-CG 3.78Å; W299-E351 HydrophobicContact CZ3-CB 4.29Å; W299-E351 HydrophobicContact CZ3-CG 3.71Å; Y349-E351 HydrophobicContact CE1-CG 3.58Å; Y349-E351 WeakPolarHBondContact CE1-OE1 3.4Å; Y349-E351 VanDerWaalsContact OH-CD 3.29Å; Y349-E351 WeakPolarHBondContact OH-CG 3.45Å; Y349-E351 PolarHBondContact OH-OE1 2.85Å; E351-R429 HydrophobicContact CB-CG 4.23Å; E351-R429 WeakPolarHBondContact OE2-CD 3.43Å; E351-R429 IonicContact OE2-NH1 3.52Å; E351-V430 WeakPolarHBondContact CA-O 3.29Å; E351-V446 HydrophobicContact CG-CG2 4.01Å; E351-C481 HydrophobicContact CB-CB 3.91Å; E351-C481 PolarHBondContact O-N 2.98Å
352	V	95.3	Very high	92.6	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125.5	-179.4	-167.5	0	0	0	0	109.2	V354 L362 R429 V430 F469 M478 T479 L480	V352-V354 HydrophobicContact CG1-CG1 4.03Å; V352-L362 HydrophobicContact CB-CD2 4.04Å; V352-L362 HydrophobicContact CG1-CD2 4.16Å; V352-L362 HydrophobicContact CG2-CD2 4.24Å; V352-R429 WeakPolarHBondContact O-CA 3.36Å; V352-V430 PolarHBondContact N-O 3.43Å; V352-V430 PolarHBondContact O-N 2.95Å; V352-F469 HydrophobicContact CG2-CD1 4.27Å; V352-F469 HydrophobicContact CG2-CE1 3.65Å; V352-M478 HydrophobicContact CG1-CG 3.32Å; V352-M478 HydrophobicContact CG1-SD 3.78Å; V352-T479 CarbonylContact C-O 3.57Å; V352-T479 WeakPolarHBondContact CA-O 3.46Å; V352-L480 HydrophobicContact CG2-CD2 4.28Å
353	D	95.1	Very high	92.7	Very high	43 Å²	43	34.2 Å²	34.2	23%	0.23	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	125	168.7	-162.1	-36.5	0	0	0	109.8	S355 T479	D353-S355 WeakPolarHBondContact OD1-CB 3.38Å; D353-S355 PolarHBondContact OD1-N 2.91Å; D353-S355 PolarHBondContact OD1-OG 3.22Å; D353-T479 PolarHBondContact N-O 3.28Å; D353-T479 PolarHBondContact O-N 2.76Å; D353-T479 VanDerWaalsContact O-N 3.12Å
354	V	93.3	Very high	92.7	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.006	19%	0.188	C	C	.	.			trans	-131.1	16.1	179.5	-64.4	0	0	0	0	111.6	V352 E356 K357 W360 L362 L427 H428 V430 M478	V352-V354 HydrophobicContact CG1-CG1 4.03Å; V354-E356 VanDerWaalsContact C-N 3.33Å; V354-E356 PolarHBondContact O-N 3.34Å; V354-K357 WeakPolarHBondContact O-CB 3.33Å; V354-K357 PolarHBondContact O-N 3.47Å; V354-W360 HydrophobicContact CB-CD2 4.37Å; V354-W360 HydrophobicContact CB-CG 4.37Å; V354-W360 HydrophobicContact CB-CZ2 4.49Å; V354-W360 HydrophobicContact CG1-CD2 4.11Å; V354-W360 HydrophobicContact CG1-CG 4.19Å; V354-W360 HydrophobicContact CG2-CZ2 3.84Å; V354-L362 HydrophobicContact CG1-CD2 4.05Å; V354-L427 WeakPolarHBondContact CG2-O 3.16Å; V354-H428 PolarHBondContact N-O 2.95Å; V354-V430 HydrophobicContact CG2-CG2 4.05Å; V354-M478 HydrophobicContact CG1-CE 4.07Å; V354-M478 HydrophobicContact CG1-CG 4.24Å
355	S	89.1	Confident	92.7	Very high	51 Å²	51	29.2 Å²	29.2	36%	0.357	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-39.6	-169.5	53.5	0	0	0	0	115	D353 H428	D353-S355 WeakPolarHBondContact OD1-CB 3.38Å; D353-S355 PolarHBondContact OD1-N 2.91Å; D353-S355 PolarHBondContact OD1-OG 3.22Å; S355-H428 WeakPolarHBondContact CA-ND1 3.45Å; S355-H428 PolarHBondContact N-O 3.32Å
356	E	85.9	Confident	92.5	Very high	141 Å²	141	25.3 Å²	25.3	66%	0.659	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	0.6	-178.4	-61.9	-173.9	169.6	0	0	113.3	V354 A476	V354-E356 VanDerWaalsContact C-N 3.33Å; V354-E356 PolarHBondContact O-N 3.34Å; E356-A476 HydrophobicContact CB-CB 3.77Å; E356-A476 WeakPolarHBondContact O-CB 3.39Å
357	K	88.3	Confident	91.7	Very high	10 Å²	10	30.6 Å²	30.6	4%	0.043	14%	0.143	C	C	.	.			trans	-94	136	-173.3	-61.2	-166.8	68.8	60.8	0	112.7	V354 A359 W360 P471 C474 A476 P477 M478	V354-K357 WeakPolarHBondContact O-CB 3.33Å; V354-K357 PolarHBondContact O-N 3.47Å; K357-A359 WeakPolarHBondContact CE-O 3.44Å; K357-W360 HydrophobicContact CD-CB 4.39Å; K357-P471 VanDerWaalsContact NZ-CB 3.34Å; K357-P471 PolarHBondContact NZ-O 2.89Å; K357-C474 PolarHBondContact NZ-O 3.22Å; K357-A476 HydrophobicContact CG-CB 3.99Å; K357-A476 PolarHBondContact NZ-O 2.84Å; K357-P477 WeakPolarHBondContact CD-O 3.31Å; K357-P477 WeakPolarHBondContact CG-O 3.37Å; K357-M478 HydrophobicContact CD-CB 3.79Å; K357-M478 HydrophobicContact CD-CE 4.2Å
358	K	87.3	Confident	90.4	Very high	150 Å²	150	31.6 Å²	31.6	65%	0.652	15%	0.148	S	C	*	.	S	Bend	trans	-98.8	-15.2	174.7	-61.1	-177.8	-178	179	0	113.8	H401 G402 C474	K358-H401 PolarHBondContact O-N 3.45Å; K358-G402 WeakPolarHBondContact O-CA 3.39Å; K358-G402 PolarHBondContact O-N 3.16Å; K358-C474 PolarHBondContact N-SG 3.47Å; K358-C474 VanDerWaalsContact N-SG 3.4Å
359	A	88.6	Confident	88.4	Confident	14 Å²	14	40.2 Å²	40.2	12%	0.116	18%	0.179	C	C	.	.	S	Bend	trans	-145.8	134.1	174.6	0	0	0	0	0	110.1	K357 L399 W472 C474	K357-A359 WeakPolarHBondContact CE-O 3.44Å; A359-L399 VanDerWaalsContact CA-O 3.24Å; A359-L399 WeakPolarHBondContact CA-O 3.37Å; A359-W472 HydrophobicContact CB-CB 4Å; A359-W472 HydrophobicContact CB-CG 4.44Å; A359-C474 HydrophobicContact CB-CB 4.36Å
360	W	91.7	Very high	85.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166	161	177.6	49.7	-96	0	0	0	111.8	V354 K357 L362 I397 G398 L399 Y405 L427 V430 N470 M478	V354-W360 HydrophobicContact CB-CD2 4.37Å; V354-W360 HydrophobicContact CB-CG 4.37Å; V354-W360 HydrophobicContact CB-CZ2 4.49Å; V354-W360 HydrophobicContact CG1-CD2 4.11Å; V354-W360 HydrophobicContact CG1-CG 4.19Å; V354-W360 HydrophobicContact CG2-CZ2 3.84Å; K357-W360 HydrophobicContact CD-CB 4.39Å; W360-L362 HydrophobicContact CE3-CD2 3.77Å; W360-L362 HydrophobicContact CE3-CG 3.82Å; W360-L362 HydrophobicContact CH2-CD2 4.49Å; W360-L362 HydrophobicContact CZ3-CD1 4.42Å; W360-L362 HydrophobicContact CZ3-CD2 3.74Å; W360-L362 HydrophobicContact CZ3-CG 3.67Å; W360-I397 HydrophobicContact CH2-CD1 4.42Å; W360-I397 HydrophobicContact CZ3-CD1 4.44Å; W360-I397 HydrophobicContact CZ3-CG1 4.16Å; W360-G398 CarbonylContact O-C 3.58Å; W360-G398 WeakPolarHBondContact O-CA 3.32Å; W360-L399 HydrophobicContact CD2-CB 3.94Å; W360-L399 VanDerWaalsContact CE2-CB 3.46Å; W360-L399 HydrophobicContact CG-CB 4.16Å; W360-L399 HydrophobicContact CZ2-CB 3.86Å; W360-L399 PolarHBondContact N-O 3.35Å; W360-L399 VanDerWaalsContact N-O 3.07Å; W360-L399 PolarHBondContact O-N 3.11Å; W360-Y405 HydrophobicContact CZ2-CE1 4.25Å; W360-L427 HydrophobicContact CH2-CD1 4.01Å; W360-L427 HydrophobicContact CZ2-CB 4.28Å; W360-L427 HydrophobicContact CZ2-CD1 4.17Å; W360-V430 HydrophobicContact CH2-CG2 3.92Å; W360-V430 HydrophobicContact CZ2-CG2 4.28Å; W360-N470 CarbonylContact C-O 3.56Å; W360-N470 WeakPolarHBondContact CA-O 3.42Å; W360-M478 HydrophobicContact CB-CE 3.44Å; W360-M478 VanDerWaalsContact CB-CE 3.44Å; W360-M478 HydrophobicContact CG-CE 4.23Å
361	T	92.3	Very high	83.7	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	134.1	167.6	-59	0	0	0	0	108.9	Y388 V396 I397 F408 Y468 F469 N470 W472	T361-Y388 HydrophobicContact CG2-CD1 4.2Å; T361-Y388 HydrophobicContact CG2-CE1 4.12Å; T361-Y388 HydrophobicContact CG2-CG 4.45Å; T361-V396 HydrophobicContact CG2-CB 3.74Å; T361-V396 HydrophobicContact CG2-CG1 4.4Å; T361-V396 HydrophobicContact CG2-CG2 3.61Å; T361-I397 CarbonylContact C-O 3.55Å; T361-I397 VanDerWaalsContact CA-O 3.3Å; T361-I397 WeakPolarHBondContact CA-O 3.38Å; T361-F408 HydrophobicContact CG2-CE2 4.38Å; T361-Y468 HydrophobicContact CG2-CE1 4.45Å; T361-F469 CarbonylContact O-C 3.57Å; T361-N470 PolarHBondContact N-O 3.33Å; T361-N470 PolarHBondContact O-N 3.33Å; T361-W472 PolarHBondContact OG1-NE1 3.22Å
362	L	94.9	Very high	81.2	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	159.5	-179.5	63.2	78.9	0	0	0	111.7	V352 V354 W360 V396 I397 V430 V432 F443 Y468 F469	V352-L362 HydrophobicContact CB-CD2 4.04Å; V352-L362 HydrophobicContact CG1-CD2 4.16Å; V352-L362 HydrophobicContact CG2-CD2 4.24Å; V354-L362 HydrophobicContact CG1-CD2 4.05Å; W360-L362 HydrophobicContact CE3-CD2 3.77Å; W360-L362 HydrophobicContact CE3-CG 3.82Å; W360-L362 HydrophobicContact CH2-CD2 4.49Å; W360-L362 HydrophobicContact CZ3-CD1 4.42Å; W360-L362 HydrophobicContact CZ3-CD2 3.74Å; W360-L362 HydrophobicContact CZ3-CG 3.67Å; L362-V396 CarbonylContact O-C 3.55Å; L362-V396 VanDerWaalsContact O-CA 3.23Å; L362-V396 WeakPolarHBondContact O-CA 3.13Å; L362-V396 VanDerWaalsContact O-CB 3.28Å; L362-V396 WeakPolarHBondContact O-CB 3.43Å; L362-I397 HydrophobicContact CD1-CG1 4.19Å; L362-I397 PolarHBondContact N-O 3.32Å; L362-I397 PolarHBondContact O-N 3.3Å; L362-V430 HydrophobicContact CD1-CG1 3.96Å; L362-V430 HydrophobicContact CD2-CB 4.26Å; L362-V432 HydrophobicContact CD1-CG2 3.71Å; L362-F443 HydrophobicContact CD1-CD1 4.03Å; L362-F443 HydrophobicContact CD1-CE1 3.81Å; L362-Y468 CarbonylContact C-O 3.55Å; L362-Y468 VanDerWaalsContact CA-O 3.26Å; L362-Y468 WeakPolarHBondContact CA-O 3.25Å; L362-F469 HydrophobicContact CB-CD1 4.22Å
363	G	94.9	Very high	78.8	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.2	-132.5	176.1	0	0	0	0	0	111.8	W395 Y468	G363-W395 WeakPolarHBondContact CA-O 3.44Å; G363-Y468 PolarHBondContact N-O 3.36Å; G363-Y468 PolarHBondContact O-N 3.06Å
364	V	94.4	Very high	76.2	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.5	-174.7	-177.9	0	0	0	0	110.5	W350 W395 V432 L434 V441 F461 A465 Y466	W350-V364 HydrophobicContact CH2-CG2 3.82Å; W350-V364 HydrophobicContact CZ2-CG2 4.12Å; V364-W395 PolarHBondContact N-O 3.11Å; V364-W395 PolarHBondContact O-N 3.23Å; V364-V432 HydrophobicContact CG2-CG1 4.21Å; V364-L434 HydrophobicContact CG1-CD1 4.49Å; V364-V441 HydrophobicContact CB-CG1 4.47Å; V364-V441 HydrophobicContact CB-CG2 4.26Å; V364-V441 HydrophobicContact CG2-CG1 3.81Å; V364-V441 HydrophobicContact CG2-CG2 4.11Å; V364-F461 HydrophobicContact CG1-CE1 4.48Å; V364-A465 HydrophobicContact CG1-CB 3.65Å; V364-Y466 WeakPolarHBondContact CA-O 3.37Å
365	Y	91.6	Very high	73.6	Confident	7 Å²	7	68.9 Å²	68.9	3%	0.027	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.4	175.2	173.8	-112.3	0	0	0	111.5	L338 R367 R369 L371 G393 Y394 Y466	L338-Y365 HydrophobicContact CD1-CD1 4.48Å; L338-Y365 HydrophobicContact CD2-CD1 3.94Å; Y365-R367 HydrophobicContact CE1-CB 4.34Å; Y365-R369 PolarHBondContact OH-O 3.2Å; Y365-L371 HydrophobicContact CE1-CD1 4.09Å; Y365-G393 CarbonylContact C-O 3.53Å; Y365-G393 VanDerWaalsContact CA-O 3.24Å; Y365-G393 WeakPolarHBondContact CA-O 3.43Å; Y365-G393 WeakPolarHBondContact CD2-O 3.38Å; Y365-Y394 AromaticContact CD2-CD1 3.58Å; Y365-Y394 HydrophobicContact CD2-CD1 3.58Å; Y365-Y394 AromaticContact CD2-CD2 3.94Å; Y365-Y394 HydrophobicContact CD2-CD2 3.94Å; Y365-Y394 AromaticContact CD2-CE1 3.31Å; Y365-Y394 HydrophobicContact CD2-CE1 3.31Å; Y365-Y394 AromaticContact CD2-CE2 3.72Å; Y365-Y394 HydrophobicContact CD2-CE2 3.72Å; Y365-Y394 AromaticContact CD2-CG 3.88Å; Y365-Y394 HydrophobicContact CD2-CG 3.88Å; Y365-Y394 AromaticContact CD2-CZ 3.38Å; Y365-Y394 HydrophobicContact CE2-CD1 4.38Å; Y365-Y394 HydrophobicContact CE2-CD2 4.06Å; Y365-Y394 AromaticContact CE2-CE1 3.85Å; Y365-Y394 HydrophobicContact CE2-CE1 3.85Å; Y365-Y394 AromaticContact CE2-CE2 3.51Å; Y365-Y394 HydrophobicContact CE2-CE2 3.51Å; Y365-Y394 HydrophobicContact CE2-CG 4.47Å; Y365-Y394 AromaticContact CE2-CZ 3.37Å; Y365-Y394 HydrophobicContact CG-CD1 4.25Å; Y365-Y394 AromaticContact CG-CE1 3.9Å; Y365-Y394 HydrophobicContact CG-CE1 3.9Å; Y365-Y466 PolarHBondContact N-O 2.9Å; Y365-Y466 PolarHBondContact O-N 3.3Å
366	T	88.5	Confident	71.1	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.9	165.5	57.4	0	0	0	0	110.7	K368 G393 W395 F461 Q463 A465	T366-K368 PolarHBondContact O-N 3.49Å; T366-G393 PolarHBondContact N-O 2.91Å; T366-W395 HydrophobicContact CG2-CH2 4.15Å; T366-W395 HydrophobicContact CG2-CZ3 3.68Å; T366-W395 VanDerWaalsContact OG1-CH2 3.32Å; T366-W395 WeakPolarHBondContact OG1-CH2 3.16Å; T366-W395 WeakPolarHBondContact OG1-CZ3 3.45Å; T366-F461 HydrophobicContact CG2-CB 4.36Å; T366-F461 HydrophobicContact CG2-CD1 3.73Å; T366-F461 HydrophobicContact CG2-CG 4.49Å; T366-Q463 WeakPolarHBondContact CG2-O 3.5Å; T366-A465 HydrophobicContact CG2-CB 4.04Å
367	R	75.9	Confident	69	Low	130 Å²	130	76.8 Å²	76.8	49%	0.491	34%	0.341	S	S	.	.			trans	-75.6	94.4	-175	-164.3	173.9	-175.6	145.2	-1.8	110.8	Y365	Y365-R367 HydrophobicContact CE1-CB 4.34Å
368	K	67	Low	66.6	Low	86 Å²	86	85.3 Å²	85.3	37%	0.374	37%	0.373	S	S	.	.	S	Bend	trans	-96.2	-20.8	171.9	-72.2	-174.2	178.6	173.1	0	114	T366 P390 Q391	T366-K368 PolarHBondContact O-N 3.49Å; K368-P390 PolarHBondContact NZ-O 3.02Å; K368-Q391 VanDerWaalsContact CD-O 3.29Å; K368-Q391 WeakPolarHBondContact CD-O 3.47Å
369	R	54	Low	64.1	Low	204 Å²	204	88.3 Å²	88.3	77%	0.77	39%	0.386	S	S	*	.	S	Bend	trans	-141.1	153.5	171.1	-75.7	-176.7	169.7	166.5	-2.6	109.9	Y365 L371	Y365-R369 PolarHBondContact OH-O 3.2Å; R369-L371 PolarHBondContact O-N 3.45Å
370	T	44.6	Very low	61.9	Low	102 Å²	102	91.5 Å²	91.5	63%	0.626	42%	0.42	S	S	*	.			trans	-59.3	122.6	168.1	-2.9	0	0	0	0	108.2	R372	T370-R372 PolarHBondContact O-N 3.07Å
371	L	50	Low	59.6	Low	41 Å²	41	98.3 Å²	98.3	22%	0.215	45%	0.452	C	S	.	.			trans	-58.4	85	166.6	-83.3	155.3	0	0	0	108.1	Y365 R369 F373	Y365-L371 HydrophobicContact CE1-CD1 4.09Å; R369-L371 PolarHBondContact O-N 3.45Å; L371-F373 HydrophobicContact CB-CE2 4.27Å; L371-F373 HydrophobicContact CB-CZ 4.44Å; L371-F373 WeakPolarHBondContact O-CD2 3.48Å; L371-F373 PolarHBondContact O-N 2.93Å; L371-F373 VanDerWaalsContact O-N 3.15Å
372	R	41.8	Very low	57.3	Low	223 Å²	223	102.4 Å²	102.4	84%	0.842	48%	0.479	S	S	*	.			trans	-72.3	103.6	159	-75.5	-169.8	-178.9	-170.7	1.1	104.9	T370 D374	T370-R372 PolarHBondContact O-N 3.07Å; R372-D374 PolarHBondContact O-N 3.26Å
373	F	46.1	Very low	55.4	Low	89 Å²	89	107.9 Å²	107.9	39%	0.39	51%	0.508	S	S	.	.			trans	-61.2	89.5	168.5	-63.1	-89.9	0	0	0	106.9	L371 V375	L371-F373 HydrophobicContact CB-CE2 4.27Å; L371-F373 HydrophobicContact CB-CZ 4.44Å; L371-F373 WeakPolarHBondContact O-CD2 3.48Å; L371-F373 PolarHBondContact O-N 2.93Å; L371-F373 VanDerWaalsContact O-N 3.15Å; F373-V375 PolarHBondContact O-N 3.45Å
374	D	39.3	Very low	53.7	Low	101 Å²	101	110 Å²	110	54%	0.54	53%	0.53	S	S	.	.			trans	-73.6	102.4	-177.4	-140.6	-20.8	0	0	0	107.8	R372 R376	R372-D374 PolarHBondContact O-N 3.26Å; D374-R376 PolarHBondContact O-N 2.9Å
375	V	38.6	Very low	52.2	Low	95 Å²	95	112.2 Å²	112.2	58%	0.576	54%	0.538	S	S	*	.			trans	-73.6	-9.8	-178.4	179.3	0	0	0	0	111.1	F330 F373	F330-V375 HydrophobicContact CD1-CG1 4.45Å; F373-V375 PolarHBondContact O-N 3.45Å
376	R	37.2	Very low	51	Low	206 Å²	206	114.6 Å²	114.6	78%	0.777	55%	0.55	S	S	*	.	S	Bend	trans	-120.1	120.9	-177.8	-63.7	-174	-175.3	-147.6	0.9	110.9	D374 R378	D374-R376 PolarHBondContact O-N 2.9Å; R376-R378 PolarHBondContact O-N 3.28Å
377	Q	41.9	Very low	50.3	Low	152 Å²	152	117.9 Å²	117.9	71%	0.71	56%	0.562	S	S	*	*			trans	-56.4	111.8	158.4	-77	-172.7	4.9	0	0	107.8	K379	Q377-K379 PolarHBondContact O-N 3.09Å
378	R	38.8	Very low	50.6	Low	190 Å²	190	111.8 Å²	111.8	72%	0.717	54%	0.539	S	S	*	.			trans	-65	117.9	156.5	-78.5	-173.6	-177.9	-165	-0.6	106	R376 G380 Q381	R376-R378 PolarHBondContact O-N 3.28Å; R378-G380 PolarHBondContact O-N 3.39Å; R378-Q381 PolarHBondContact O-N 3.2Å
379	K	34.1	Very low	51.4	Low	213 Å²	213	108.5 Å²	108.5	93%	0.926	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	117.4	170.9	-81	-176.3	173.5	-178.3	0	108.2	Q377	Q377-K379 PolarHBondContact O-N 3.09Å
380	G	42.2	Very low	52.9	Low	81 Å²	81	99.4 Å²	99.4	84%	0.835	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	108	1.5	177.2	0	0	0	0	0	117.3	R378	R378-G380 PolarHBondContact O-N 3.39Å
381	Q	43.2	Very low	54.7	Low	142 Å²	142	99.6 Å²	99.6	66%	0.664	49%	0.486	S	S	*	.			trans	-77.6	125.8	169.3	-93.5	-173.3	-29.5	0	0	111.4	R378	R378-Q381 PolarHBondContact O-N 3.2Å
382	P	44.8	Very low	56.3	Low	89 Å²	89	100.5 Å²	100.5	58%	0.578	49%	0.491	S	S	*	.			trans	-70.6	146.2	174.4	30.2	-31.2	0	0	0	109.5	H386	P382-H386 WeakPolarHBondContact CB-NE2 3.44Å; P382-H386 WeakPolarHBondContact CG-NE2 3.49Å; P382-H386 PolarHBondContact O-CD2 2.7Å
383	N	55.5	Low	58.4	Low	114 Å²	114	89.9 Å²	89.9	61%	0.61	45%	0.451	S	S	*	.			trans	16.3	122.9	167	-106.4	-12.3	0	0	0	118	Y385 H386	N383-Y385 HydrophobicContact CB-CD2 3.89Å; N383-Y385 PolarHBondContact O-N 2.78Å; N383-H386 PolarHBondContact O-CD2 3.34Å; N383-H386 PolarHBondContact O-N 3.16Å; N383-H386 VanDerWaalsContact O-N 3.11Å
384	G	58.8	Low	60.5	Low	44 Å²	44	86 Å²	86	45%	0.454	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-54.4	-7.2	178.4	0	0	0	0	0	116.4	R387	G384-R387 WeakPolarHBondContact O-CG 3.32Å
385	Y	62.9	Low	63	Low	47 Å²	47	81.6 Å²	81.6	18%	0.184	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-74.4	-22.8	176	-57.5	-76	0	0	0	115.3	N383 R387 Y388 Q400 F408 W472	N383-Y385 HydrophobicContact CB-CD2 3.89Å; N383-Y385 PolarHBondContact O-N 2.78Å; Y385-R387 PolarHBondContact O-N 3.42Å; Y385-Y388 HydrophobicContact CD1-CD2 4.45Å; Y385-Y388 PolarHBondContact O-N 2.97Å; Y385-Y388 VanDerWaalsContact O-N 3.08Å; Y385-Q400 HydrophobicContact CE1-CG 4.33Å; Y385-F408 AromaticContact CD1-CE1 3.95Å; Y385-F408 HydrophobicContact CD1-CE1 3.95Å; Y385-F408 AromaticContact CD1-CZ 3.99Å; Y385-F408 HydrophobicContact CD1-CZ 3.99Å; Y385-F408 HydrophobicContact CG-CE1 4.45Å; Y385-W472 AromaticContact CD1-CH2 3.63Å; Y385-W472 HydrophobicContact CD1-CH2 3.63Å; Y385-W472 AromaticContact CD1-CZ2 3.53Å; Y385-W472 HydrophobicContact CD1-CZ2 3.53Å; Y385-W472 HydrophobicContact CD2-CH2 4.41Å; Y385-W472 AromaticContact CE1-CE2 3.91Å; Y385-W472 AromaticContact CE1-CH2 3.17Å; Y385-W472 HydrophobicContact CE1-CH2 3.17Å; Y385-W472 AromaticContact CE1-CZ2 3.06Å; Y385-W472 HydrophobicContact CE1-CZ2 3.06Å; Y385-W472 HydrophobicContact CE1-CZ3 4.08Å; Y385-W472 HydrophobicContact CE2-CH2 4.03Å; Y385-W472 HydrophobicContact CG-CH2 4.24Å; Y385-W472 AromaticContact CZ-CH2 3.4Å; Y385-W472 AromaticContact CZ-CZ2 3.76Å; Y385-W472 AromaticContact CZ-CZ3 3.9Å
386	H	66.6	Low	65.6	Low	58 Å²	58	77 Å²	77	27%	0.269	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-61	-17.4	-179.1	-73.8	-83.7	0	0	0	113.7	P382 N383 D415 P416	P382-H386 WeakPolarHBondContact CB-NE2 3.44Å; P382-H386 WeakPolarHBondContact CG-NE2 3.49Å; P382-H386 PolarHBondContact O-CD2 2.7Å; N383-H386 PolarHBondContact O-CD2 3.34Å; N383-H386 PolarHBondContact O-N 3.16Å; N383-H386 VanDerWaalsContact O-N 3.11Å; H386-D415 IonicContact CE1-OD1 2.78Å; H386-P416 WeakPolarHBondContact ND1-CD 3.27Å
387	R	74.1	Confident	68.2	Low	69 Å²	69	67.5 Å²	67.5	26%	0.26	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-72.5	-33.1	177.1	78.9	-179.1	-64.8	153.2	1.3	113.2	N334 G384 Y385 K389 N392 Y394	N334-R387 PolarHBondContact ND2-NH1 2.93Å; N334-R387 PolarHBondContact OD1-NH1 2.98Å; G384-R387 WeakPolarHBondContact O-CG 3.32Å; Y385-R387 PolarHBondContact O-N 3.42Å; R387-K389 PolarHBondContact O-N 3.12Å; R387-N392 WeakPolarHBondContact O-CB 3.49Å; R387-N392 PolarHBondContact O-ND2 3.32Å; R387-N392 VanDerWaalsContact O-ND2 3.09Å; R387-Y394 PolarHBondContact NH2-OH 3.38Å; R387-Y394 WeakPolarHBondContact O-CD2 3.49Å
388	Y	82.3	Confident	70.5	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.008	31%	0.314	C	S	.	.			trans	-79	89.9	-174.2	-59.2	-60.8	0	0	0	107.9	T361 Y385 Y394 V396 F408 Y468 N470 W472	T361-Y388 HydrophobicContact CG2-CD1 4.2Å; T361-Y388 HydrophobicContact CG2-CE1 4.12Å; T361-Y388 HydrophobicContact CG2-CG 4.45Å; Y385-Y388 HydrophobicContact CD1-CD2 4.45Å; Y385-Y388 PolarHBondContact O-N 2.97Å; Y385-Y388 VanDerWaalsContact O-N 3.08Å; Y388-Y394 AromaticContact CD1-CD1 3.91Å; Y388-Y394 HydrophobicContact CD1-CD1 3.91Å; Y388-Y394 HydrophobicContact CD1-CE1 4.32Å; Y388-Y394 HydrophobicContact CD1-CG 4.16Å; Y388-Y394 HydrophobicContact CE1-CD1 4.36Å; Y388-Y394 HydrophobicContact CE1-CE1 4.38Å; Y388-V396 HydrophobicContact CD1-CG2 3.83Å; Y388-V396 HydrophobicContact CG-CG2 4Å; Y388-F408 HydrophobicContact CD2-CE1 4.37Å; Y388-F408 HydrophobicContact CD2-CZ 4.38Å; Y388-F408 WeakPolarHBondContact O-CB 3.4Å; Y388-Y468 HydrophobicContact CD1-CE1 4.38Å; Y388-Y468 AromaticContact CE1-CE1 3.62Å; Y388-Y468 HydrophobicContact CE1-CE1 3.62Å; Y388-Y468 AromaticContact CE1-CZ 3.82Å; Y388-Y468 WeakPolarHBondContact CE1-OH 3.27Å; Y388-Y468 PolarHBondContact OH-OH 3.08Å; Y388-N470 PolarHBondContact OH-ND2 3.38Å; Y388-W472 HydrophobicContact CE2-CH2 4.31Å; Y388-W472 AromaticContact CE2-CZ2 3.67Å; Y388-W472 HydrophobicContact CE2-CZ2 3.67Å
389	K	82.1	Confident	72.9	Confident	16 Å²	16	51.6 Å²	51.6	7%	0.07	28%	0.281	C	S	.	.	S	Bend	trans	-147.6	144.3	176.9	-63.6	-171.2	-177.4	-171.2	0	110.1	R387 Q391 N392 G393 Y394 C414	R387-K389 PolarHBondContact O-N 3.12Å; K389-Q391 HydrophobicContact CB-CB 4.48Å; K389-Q391 PolarHBondContact O-N 3.1Å; K389-N392 HydrophobicContact CB-CB 4.47Å; K389-N392 CarbonylContact O-C 3.53Å; K389-N392 WeakPolarHBondContact O-CA 3.37Å; K389-N392 WeakPolarHBondContact O-CB 3.35Å; K389-N392 PolarHBondContact O-N 2.88Å; K389-G393 PolarHBondContact O-N 2.73Å; K389-Y394 CarbonylContact C-O 3.52Å; K389-Y394 PolarHBondContact O-N 3.01Å; K389-C414 PolarHBondContact NZ-O 3.25Å
390	P	86.4	Confident	75.2	Confident	14 Å²	14	42.5 Å²	42.5	9%	0.091	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-56.7	-34.5	172.5	-27.6	34.5	0	0	0	113.5	K368 N392 G393 Y394 F408 D410 F456	K368-P390 PolarHBondContact NZ-O 3.02Å; P390-N392 PolarHBondContact O-N 3.2Å; P390-G393 WeakPolarHBondContact O-CA 3.49Å; P390-G393 PolarHBondContact O-N 3.22Å; P390-Y394 VanDerWaalsContact CA-O 3.31Å; P390-Y394 WeakPolarHBondContact CA-O 3.45Å; P390-Y394 WeakPolarHBondContact CD-O 3.43Å; P390-F408 WeakPolarHBondContact CD-O 3.45Å; P390-D410 WeakPolarHBondContact CB-OD2 3.43Å; P390-D410 WeakPolarHBondContact CD-OD1 3.48Å; P390-F456 HydrophobicContact CG-CD1 4.39Å; P390-F456 HydrophobicContact CG-CE1 4.18Å
391	Q	82.8	Confident	77	Confident	106 Å²	106	46.4 Å²	46.4	50%	0.495	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-53.3	-40.5	169.3	-85.2	161.1	32.2	0	0	113.1	K368 K389 G393 D410	K368-Q391 VanDerWaalsContact CD-O 3.29Å; K368-Q391 WeakPolarHBondContact CD-O 3.47Å; K389-Q391 HydrophobicContact CB-CB 4.48Å; K389-Q391 PolarHBondContact O-N 3.1Å; Q391-G393 VanDerWaalsContact C-N 3.27Å; Q391-G393 PolarHBondContact O-N 3.15Å; Q391-D410 WeakPolarHBondContact CB-OD1 3.48Å; Q391-D410 WeakPolarHBondContact CG-OD1 3.41Å; Q391-D410 WeakPolarHBondContact CG-OD2 3.2Å; Q391-D410 PolarHBondContact N-OD1 3.44Å; Q391-D410 PolarHBondContact N-OD2 3.45Å
392	N	82.3	Confident	78.7	Confident	60 Å²	60	41.3 Å²	41.3	32%	0.321	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-85.7	2.6	177.6	-67.5	-28.5	0	0	0	113.2	R387 K389 P390 Y394	R387-N392 WeakPolarHBondContact O-CB 3.49Å; R387-N392 PolarHBondContact O-ND2 3.32Å; R387-N392 VanDerWaalsContact O-ND2 3.09Å; K389-N392 HydrophobicContact CB-CB 4.47Å; K389-N392 CarbonylContact O-C 3.53Å; K389-N392 WeakPolarHBondContact O-CA 3.37Å; K389-N392 WeakPolarHBondContact O-CB 3.35Å; K389-N392 PolarHBondContact O-N 2.88Å; P390-N392 PolarHBondContact O-N 3.2Å; N392-Y394 HydrophobicContact CB-CD2 3.93Å; N392-Y394 HydrophobicContact CB-CE2 4.32Å
393	G	87.7	Confident	80.3	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	14.8	-179.8	0	0	0	0	0	114.3	Y365 T366 K389 P390 Q391 W395	Y365-G393 CarbonylContact C-O 3.53Å; Y365-G393 VanDerWaalsContact CA-O 3.24Å; Y365-G393 WeakPolarHBondContact CA-O 3.43Å; Y365-G393 WeakPolarHBondContact CD2-O 3.38Å; T366-G393 PolarHBondContact N-O 2.91Å; K389-G393 PolarHBondContact O-N 2.73Å; P390-G393 WeakPolarHBondContact O-CA 3.49Å; P390-G393 PolarHBondContact O-N 3.22Å; Q391-G393 VanDerWaalsContact C-N 3.27Å; Q391-G393 PolarHBondContact O-N 3.15Å; G393-W395 VanDerWaalsContact O-CZ3 3.25Å; G393-W395 WeakPolarHBondContact O-CZ3 3.31Å
394	Y	88.8	Confident	81.6	Confident	6 Å²	6	40.4 Å²	40.4	2%	0.024	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	122.4	178.1	-66.7	-88.2	0	0	0	111.6	Y365 R387 Y388 K389 P390 N392 V396 Y468	Y365-Y394 AromaticContact CD2-CD1 3.58Å; Y365-Y394 HydrophobicContact CD2-CD1 3.58Å; Y365-Y394 AromaticContact CD2-CD2 3.94Å; Y365-Y394 HydrophobicContact CD2-CD2 3.94Å; Y365-Y394 AromaticContact CD2-CE1 3.31Å; Y365-Y394 HydrophobicContact CD2-CE1 3.31Å; Y365-Y394 AromaticContact CD2-CE2 3.72Å; Y365-Y394 HydrophobicContact CD2-CE2 3.72Å; Y365-Y394 AromaticContact CD2-CG 3.88Å; Y365-Y394 HydrophobicContact CD2-CG 3.88Å; Y365-Y394 AromaticContact CD2-CZ 3.38Å; Y365-Y394 HydrophobicContact CE2-CD1 4.38Å; Y365-Y394 HydrophobicContact CE2-CD2 4.06Å; Y365-Y394 AromaticContact CE2-CE1 3.85Å; Y365-Y394 HydrophobicContact CE2-CE1 3.85Å; Y365-Y394 AromaticContact CE2-CE2 3.51Å; Y365-Y394 HydrophobicContact CE2-CE2 3.51Å; Y365-Y394 HydrophobicContact CE2-CG 4.47Å; Y365-Y394 AromaticContact CE2-CZ 3.37Å; Y365-Y394 HydrophobicContact CG-CD1 4.25Å; Y365-Y394 AromaticContact CG-CE1 3.9Å; Y365-Y394 HydrophobicContact CG-CE1 3.9Å; R387-Y394 PolarHBondContact NH2-OH 3.38Å; R387-Y394 WeakPolarHBondContact O-CD2 3.49Å; Y388-Y394 AromaticContact CD1-CD1 3.91Å; Y388-Y394 HydrophobicContact CD1-CD1 3.91Å; Y388-Y394 HydrophobicContact CD1-CE1 4.32Å; Y388-Y394 HydrophobicContact CD1-CG 4.16Å; Y388-Y394 HydrophobicContact CE1-CD1 4.36Å; Y388-Y394 HydrophobicContact CE1-CE1 4.38Å; K389-Y394 CarbonylContact C-O 3.52Å; K389-Y394 PolarHBondContact O-N 3.01Å; P390-Y394 VanDerWaalsContact CA-O 3.31Å; P390-Y394 WeakPolarHBondContact CA-O 3.45Å; P390-Y394 WeakPolarHBondContact CD-O 3.43Å; N392-Y394 HydrophobicContact CB-CD2 3.93Å; N392-Y394 HydrophobicContact CB-CE2 4.32Å; Y394-V396 HydrophobicContact CD1-CG1 4.37Å; Y394-Y468 HydrophobicContact CD1-CD1 4.41Å; Y394-Y468 HydrophobicContact CD1-CE1 4.46Å; Y394-Y468 HydrophobicContact CD1-CG 4.44Å; Y394-Y468 HydrophobicContact CE1-CD1 4.46Å; Y394-Y468 AromaticContact CE1-CD2 3.95Å; Y394-Y468 HydrophobicContact CE1-CD2 3.95Å; Y394-Y468 HydrophobicContact CE1-CE1 4.29Å; Y394-Y468 AromaticContact CE1-CE2 3.79Å; Y394-Y468 HydrophobicContact CE1-CE2 3.79Å; Y394-Y468 HydrophobicContact CE1-CG 4.3Å; Y394-Y468 AromaticContact CE1-CZ 3.97Å
395	W	92.7	Very high	82.9	Confident	9 Å²	9	39.5 Å²	39.5	3%	0.034	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	91.5	166.9	-61.2	-92.9	0	0	0	107.4	G363 V364 T366 G393 V441 F456 C459 F461	G363-W395 WeakPolarHBondContact CA-O 3.44Å; V364-W395 PolarHBondContact N-O 3.11Å; V364-W395 PolarHBondContact O-N 3.23Å; T366-W395 HydrophobicContact CG2-CH2 4.15Å; T366-W395 HydrophobicContact CG2-CZ3 3.68Å; T366-W395 VanDerWaalsContact OG1-CH2 3.32Å; T366-W395 WeakPolarHBondContact OG1-CH2 3.16Å; T366-W395 WeakPolarHBondContact OG1-CZ3 3.45Å; G393-W395 VanDerWaalsContact O-CZ3 3.25Å; G393-W395 WeakPolarHBondContact O-CZ3 3.31Å; W395-V441 HydrophobicContact CB-CB 4.33Å; W395-V441 HydrophobicContact CB-CG2 4.07Å; W395-V441 HydrophobicContact CG-CG2 4.36Å; W395-F456 HydrophobicContact CB-CD2 3.97Å; W395-F456 HydrophobicContact CB-CE2 4.23Å; W395-F456 HydrophobicContact CB-CG 4.21Å; W395-F456 AromaticContact CD1-CD1 3.76Å; W395-F456 AromaticContact CD1-CG 3.69Å; W395-F456 HydrophobicContact CG-CG 4.35Å; W395-C459 HydrophobicContact CZ2-CB 4.01Å; W395-C459 PolarHBondContact NE1-SG 3.09Å; W395-F461 HydrophobicContact CD2-CE1 4.21Å; W395-F461 HydrophobicContact CE3-CD1 4.41Å; W395-F461 AromaticContact CE3-CE1 3.9Å; W395-F461 HydrophobicContact CE3-CE1 3.9Å; W395-F461 AromaticContact CH2-CD1 3.74Å; W395-F461 HydrophobicContact CH2-CD1 3.74Å; W395-F461 AromaticContact CH2-CE1 3.93Å; W395-F461 HydrophobicContact CH2-CE1 3.93Å; W395-F461 HydrophobicContact CZ2-CD1 4.33Å; W395-F461 HydrophobicContact CZ2-CE1 4.25Å; W395-F461 AromaticContact CZ3-CD1 3.78Å; W395-F461 HydrophobicContact CZ3-CD1 3.78Å; W395-F461 AromaticContact CZ3-CE1 3.75Å; W395-F461 HydrophobicContact CZ3-CE1 3.75Å
396	V	92.5	Very high	84	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	154.8	-168.2	-61.5	0	0	0	0	111.4	T361 L362 Y388 Y394 F408 Y468	T361-V396 HydrophobicContact CG2-CB 3.74Å; T361-V396 HydrophobicContact CG2-CG1 4.4Å; T361-V396 HydrophobicContact CG2-CG2 3.61Å; L362-V396 CarbonylContact O-C 3.55Å; L362-V396 VanDerWaalsContact O-CA 3.23Å; L362-V396 WeakPolarHBondContact O-CA 3.13Å; L362-V396 VanDerWaalsContact O-CB 3.28Å; L362-V396 WeakPolarHBondContact O-CB 3.43Å; Y388-V396 HydrophobicContact CD1-CG2 3.83Å; Y388-V396 HydrophobicContact CG-CG2 4Å; Y394-V396 HydrophobicContact CD1-CG1 4.37Å; V396-F408 HydrophobicContact CG2-CD2 3.89Å; V396-Y468 HydrophobicContact CG1-CD1 3.85Å
397	I	92.1	Very high	85	Confident	5 Å²	5	34.8 Å²	34.8	3%	0.026	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	159.9	167.7	62.3	167.4	0	0	0	109.1	W360 T361 L362 S406 I407 V430 F443 I453	W360-I397 HydrophobicContact CH2-CD1 4.42Å; W360-I397 HydrophobicContact CZ3-CD1 4.44Å; W360-I397 HydrophobicContact CZ3-CG1 4.16Å; T361-I397 CarbonylContact C-O 3.55Å; T361-I397 VanDerWaalsContact CA-O 3.3Å; T361-I397 WeakPolarHBondContact CA-O 3.38Å; L362-I397 HydrophobicContact CD1-CG1 4.19Å; L362-I397 PolarHBondContact N-O 3.32Å; L362-I397 PolarHBondContact O-N 3.3Å; I397-S406 CarbonylContact C-O 3.09Å; I397-S406 WeakPolarHBondContact CA-O 3.46Å; I397-I407 HydrophobicContact CG2-CB 4.45Å; I397-I407 HydrophobicContact CG2-CG1 3.9Å; I397-I407 HydrophobicContact CG2-CG2 4.44Å; I397-V430 HydrophobicContact CD1-CG1 4.17Å; I397-F443 HydrophobicContact CD1-CB 3.74Å; I397-F443 HydrophobicContact CD1-CD1 3.52Å; I397-F443 HydrophobicContact CD1-CD2 4.48Å; I397-F443 HydrophobicContact CD1-CE1 4.25Å; I397-F443 HydrophobicContact CD1-CG 3.65Å; I397-F443 HydrophobicContact CG1-CD1 3.57Å; I397-F443 HydrophobicContact CG1-CE1 3.78Å; I397-F443 HydrophobicContact CG1-CG 3.96Å; I397-F443 HydrophobicContact CG1-CZ 4.34Å; I397-F443 HydrophobicContact CG2-CD1 4.42Å; I397-F443 HydrophobicContact CG2-CD2 3.84Å; I397-F443 HydrophobicContact CG2-CE2 3.98Å; I397-F443 HydrophobicContact CG2-CG 4.08Å; I397-F443 HydrophobicContact CG2-CZ 4.3Å; I397-I453 HydrophobicContact CD1-CD1 4.33Å; I397-I453 HydrophobicContact CD1-CG2 4.27Å
398	G	90.2	Very high	85.5	Confident	2 Å²	2	31.5 Å²	31.5	2%	0.021	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	167.7	178.7	0	0	0	0	0	114.4	W360 Y405 S406	W360-G398 CarbonylContact O-C 3.58Å; W360-G398 WeakPolarHBondContact O-CA 3.32Å; G398-Y405 CarbonylContact O-C 3.58Å; G398-Y405 WeakPolarHBondContact O-CA 3.5Å; G398-S406 PolarHBondContact N-O 3.22Å; G398-S406 PolarHBondContact O-N 2.98Å
399	L	88.9	Confident	85.3	Confident	7 Å²	7	34 Å²	34	4%	0.037	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.7	170.9	178.2	61.6	0	0	0	108.9	A359 W360 K404 Y405	A359-L399 VanDerWaalsContact CA-O 3.24Å; A359-L399 WeakPolarHBondContact CA-O 3.37Å; W360-L399 HydrophobicContact CD2-CB 3.94Å; W360-L399 VanDerWaalsContact CE2-CB 3.46Å; W360-L399 HydrophobicContact CG-CB 4.16Å; W360-L399 HydrophobicContact CZ2-CB 3.86Å; W360-L399 PolarHBondContact N-O 3.35Å; W360-L399 VanDerWaalsContact N-O 3.07Å; W360-L399 PolarHBondContact O-N 3.11Å; L399-K404 CarbonylContact C-O 3.6Å; L399-Y405 HydrophobicContact CB-CD1 4.37Å; L399-Y405 HydrophobicContact CB-CE1 4.33Å; L399-Y405 HydrophobicContact CD1-CD1 3.89Å; L399-Y405 HydrophobicContact CD1-CD2 4.39Å; L399-Y405 HydrophobicContact CD1-CE1 3.67Å; L399-Y405 HydrophobicContact CD1-CE2 4.21Å; L399-Y405 HydrophobicContact CD1-CG 4.24Å; L399-Y405 HydrophobicContact CD2-CE1 4.43Å; L399-Y405 HydrophobicContact CG-CE1 4.36Å
400	Q	82.9	Confident	84.9	Confident	22 Å²	22	36.2 Å²	36.2	10%	0.103	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.1	175.4	-62.2	174.2	6.6	0	0	110	Y385 G402 S403 K404	Y385-Q400 HydrophobicContact CE1-CG 4.33Å; Q400-G402 PolarHBondContact O-N 2.72Å; Q400-S403 PolarHBondContact O-N 3.23Å; Q400-K404 HydrophobicContact CB-CB 4.3Å; Q400-K404 PolarHBondContact N-O 3.46Å; Q400-K404 WeakPolarHBondContact O-CB 3.32Å; Q400-K404 PolarHBondContact O-N 2.84Å
401	H	79.1	Confident	83.7	Confident	163 Å²	163	36.6 Å²	36.6	76%	0.755	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	26.7	175	-53.4	-68	0	0	0	114.6	K358 S403	K358-H401 PolarHBondContact O-N 3.45Å; H401-S403 PolarHBondContact O-N 3.04Å
402	G	78.9	Confident	82.3	Confident	35 Å²	35	37.4 Å²	37.4	36%	0.361	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	-11.4	177.7	0	0	0	0	0	116.5	K358 Q400	K358-G402 WeakPolarHBondContact O-CA 3.39Å; K358-G402 PolarHBondContact O-N 3.16Å; Q400-G402 PolarHBondContact O-N 2.72Å
403	S	78.3	Confident	80.5	Confident	94 Å²	94	40.6 Å²	40.6	66%	0.657	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-140.9	-15.7	-175.5	61.5	0	0	0	0	115.4	Q400 H401 Y405	Q400-S403 PolarHBondContact O-N 3.23Å; H401-S403 PolarHBondContact O-N 3.04Å; S403-Y405 PolarHBondContact O-N 3.01Å
404	K	83.4	Confident	78.4	Confident	89 Å²	89	45.8 Å²	45.8	39%	0.387	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	100.5	-176.6	-173.1	-178.3	-179.9	-174.2	0	110.3	L399 Q400 N420	L399-K404 CarbonylContact C-O 3.6Å; Q400-K404 HydrophobicContact CB-CB 4.3Å; Q400-K404 PolarHBondContact N-O 3.46Å; Q400-K404 WeakPolarHBondContact O-CB 3.32Å; Q400-K404 PolarHBondContact O-N 2.84Å; K404-N420 VanDerWaalsContact CE-OD1 3.27Å; K404-N420 WeakPolarHBondContact CE-OD1 3.29Å
405	Y	86.4	Confident	76.4	Confident	25 Å²	25	50.3 Å²	50.3	10%	0.098	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	141.5	171	-62	-81.1	0	0	0	110.2	W360 G398 L399 S403 N420 V423 P426 L427	W360-Y405 HydrophobicContact CZ2-CE1 4.25Å; G398-Y405 CarbonylContact O-C 3.58Å; G398-Y405 WeakPolarHBondContact O-CA 3.5Å; L399-Y405 HydrophobicContact CB-CD1 4.37Å; L399-Y405 HydrophobicContact CB-CE1 4.33Å; L399-Y405 HydrophobicContact CD1-CD1 3.89Å; L399-Y405 HydrophobicContact CD1-CD2 4.39Å; L399-Y405 HydrophobicContact CD1-CE1 3.67Å; L399-Y405 HydrophobicContact CD1-CE2 4.21Å; L399-Y405 HydrophobicContact CD1-CG 4.24Å; L399-Y405 HydrophobicContact CD2-CE1 4.43Å; L399-Y405 HydrophobicContact CG-CE1 4.36Å; S403-Y405 PolarHBondContact O-N 3.01Å; Y405-N420 WeakPolarHBondContact O-CA 3.48Å; Y405-N420 PolarHBondContact O-OD1 3.01Å; Y405-V423 HydrophobicContact CD1-CG2 4.41Å; Y405-V423 HydrophobicContact CD2-CB 3.82Å; Y405-V423 HydrophobicContact CD2-CG2 3.49Å; Y405-V423 VanDerWaalsContact CD2-CG2 3.49Å; Y405-V423 HydrophobicContact CE2-CB 3.77Å; Y405-V423 HydrophobicContact CE2-CG1 4.34Å; Y405-V423 HydrophobicContact CE2-CG2 3.93Å; Y405-V423 HydrophobicContact CG-CG2 3.76Å; Y405-P426 WeakPolarHBondContact OH-CA 3.36Å; Y405-L427 HydrophobicContact CD1-CD1 3.69Å; Y405-L427 HydrophobicContact CD1-CG 4.25Å; Y405-L427 HydrophobicContact CE1-CB 3.9Å; Y405-L427 HydrophobicContact CE1-CD1 3.41Å; Y405-L427 VanDerWaalsContact CE1-CD1 3.41Å; Y405-L427 HydrophobicContact CE1-CG 3.52Å; Y405-L427 PolarHBondContact OH-N 3.21Å
406	S	86.3	Confident	74.5	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.007	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	126.7	-174.3	-67.6	0	0	0	0	110.2	I397 G398 V418 L419	I397-S406 CarbonylContact C-O 3.09Å; I397-S406 WeakPolarHBondContact CA-O 3.46Å; G398-S406 PolarHBondContact N-O 3.22Å; G398-S406 PolarHBondContact O-N 2.98Å; S406-V418 VanDerWaalsContact CB-CG1 3.48Å; S406-V418 VanDerWaalsContact OG-CG1 3.22Å; S406-V418 WeakPolarHBondContact OG-CG1 3.39Å; S406-L419 WeakPolarHBondContact CA-O 3.23Å
407	I	86.7	Confident	73	Confident	5 Å²	5	54 Å²	54	3%	0.026	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	134.9	169	-58.1	151	0	0	0	107.3	I397 E409 V418 L419 P421 Y454 F456	I397-I407 HydrophobicContact CG2-CB 4.45Å; I397-I407 HydrophobicContact CG2-CG1 3.9Å; I397-I407 HydrophobicContact CG2-CG2 4.44Å; I407-E409 HydrophobicContact CG2-CG 4.41Å; I407-V418 WeakPolarHBondContact O-CA 3.45Å; I407-L419 HydrophobicContact CB-CB 4.19Å; I407-L419 HydrophobicContact CD1-CB 4.09Å; I407-L419 PolarHBondContact N-O 2.92Å; I407-L419 PolarHBondContact O-N 3.47Å; I407-P421 HydrophobicContact CD1-CB 4.18Å; I407-P421 HydrophobicContact CD1-CG 3.91Å; I407-P421 HydrophobicContact CG1-CG 4.37Å; I407-Y454 HydrophobicContact CD1-CD2 3.47Å; I407-Y454 VanDerWaalsContact CD1-CD2 3.47Å; I407-Y454 HydrophobicContact CD1-CE2 4.18Å; I407-Y454 HydrophobicContact CD1-CG 3.67Å; I407-Y454 HydrophobicContact CG1-CD2 4.3Å; I407-Y454 HydrophobicContact CG1-CG 4.07Å; I407-Y454 HydrophobicContact CG2-CD1 3.72Å; I407-Y454 HydrophobicContact CG2-CD2 4.21Å; I407-Y454 HydrophobicContact CG2-CE1 3.72Å; I407-Y454 HydrophobicContact CG2-CE2 4.17Å; I407-Y454 HydrophobicContact CG2-CG 4Å; I407-F456 HydrophobicContact CG2-CE1 4.29Å; I407-F456 HydrophobicContact CG2-CE2 4.38Å; I407-F456 HydrophobicContact CG2-CZ 3.71Å
408	F	83.9	Confident	71.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	96.6	-176.2	-56.1	-92.1	0	0	0	110.7	T361 Y385 Y388 P390 V396 V418	T361-F408 HydrophobicContact CG2-CE2 4.38Å; Y385-F408 AromaticContact CD1-CE1 3.95Å; Y385-F408 HydrophobicContact CD1-CE1 3.95Å; Y385-F408 AromaticContact CD1-CZ 3.99Å; Y385-F408 HydrophobicContact CD1-CZ 3.99Å; Y385-F408 HydrophobicContact CG-CE1 4.45Å; Y388-F408 HydrophobicContact CD2-CE1 4.37Å; Y388-F408 HydrophobicContact CD2-CZ 4.38Å; Y388-F408 WeakPolarHBondContact O-CB 3.4Å; P390-F408 WeakPolarHBondContact CD-O 3.45Å; V396-F408 HydrophobicContact CG2-CD2 3.89Å; F408-V418 HydrophobicContact CD1-CG2 4.42Å; F408-V418 HydrophobicContact CE1-CG2 4.4Å
409	E	79.8	Confident	70.3	Confident	56 Å²	56	59.2 Å²	59.2	26%	0.262	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	160.4	176.8	-83.4	-176.1	-146.7	0	0	112.9	I407 T417 L419 Y454 F456	I407-E409 HydrophobicContact CG2-CG 4.41Å; E409-T417 PolarHBondContact N-O 3.48Å; E409-L419 VanDerWaalsContact OE1-CD1 3.28Å; E409-L419 WeakPolarHBondContact OE1-CD1 3.47Å; E409-Y454 WeakPolarHBondContact OE1-CE2 3.39Å; E409-Y454 PolarHBondContact OE1-OH 3.35Å; E409-F456 HydrophobicContact CG-CE1 3.98Å
410	D	72.4	Confident	69.4	Low	61 Å²	61	63.3 Å²	63.3	33%	0.326	36%	0.364	S	S	.	.			trans	-71.2	129.4	166.2	-71.8	-25.9	0	0	0	109.4	P390 Q391	P390-D410 WeakPolarHBondContact CB-OD2 3.43Å; P390-D410 WeakPolarHBondContact CD-OD1 3.48Å; Q391-D410 WeakPolarHBondContact CB-OD1 3.48Å; Q391-D410 WeakPolarHBondContact CG-OD1 3.41Å; Q391-D410 WeakPolarHBondContact CG-OD2 3.2Å; Q391-D410 PolarHBondContact N-OD1 3.44Å; Q391-D410 PolarHBondContact N-OD2 3.45Å
411	S	62.3	Low	68.8	Low	23 Å²	23	63.9 Å²	63.9	16%	0.161	37%	0.369	C	S	.	.			trans	-108.8	155.6	170.2	90.6	0	0	0	0	110.6	N413 D415 T417	S411-N413 PolarHBondContact O-N 3.29Å; S411-N413 PolarHBondContact OG-N 3.04Å; S411-D415 WeakPolarHBondContact CB-O 3.31Å; S411-D415 PolarHBondContact OG-O 2.75Å; S411-T417 WeakPolarHBondContact CB-OG1 3.44Å
412	S	53.4	Low	68.1	Low	122 Å²	122	65.3 Å²	65.3	85%	0.853	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-18.6	171.5	44.2	0	0	0	0	113.5
413	N	44	Very low	67.7	Low	127 Å²	127	65.2 Å²	65.2	68%	0.679	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	44.2	-173.1	-76.5	-10.7	0	0	0	112.9	S411 D415	S411-N413 PolarHBondContact O-N 3.29Å; S411-N413 PolarHBondContact OG-N 3.04Å; N413-D415 PolarHBondContact O-N 2.92Å
414	C	42.3	Very low	67.1	Low	110 Å²	110	64.6 Å²	64.6	74%	0.743	37%	0.367	S	S	*	.	S	Bend	trans	51.3	-7.1	173.4	-74.5	0	0	0	0	118.7	K389	K389-C414 PolarHBondContact NZ-O 3.25Å
415	D	47.5	Very low	66.6	Low	101 Å²	101	63 Å²	63	54%	0.54	36%	0.364	S	S	.	.	S	Bend	trans	-110.9	136.5	-178.2	-80.2	-31.6	0	0	0	109.7	H386 S411 N413 T417	H386-D415 IonicContact CE1-OD1 2.78Å; S411-D415 WeakPolarHBondContact CB-O 3.31Å; S411-D415 PolarHBondContact OG-O 2.75Å; N413-D415 PolarHBondContact O-N 2.92Å; D415-T417 PolarHBondContact O-N 2.84Å
416	P	53.4	Low	66.3	Low	26 Å²	26	65.5 Å²	65.5	17%	0.169	38%	0.384	C	S	.	.			trans	-61.4	123.7	-179	24.7	-30.5	0	0	0	110.3	H386 V418	H386-P416 WeakPolarHBondContact ND1-CD 3.27Å; P416-V418 PolarHBondContact O-N 3.32Å
417	T	60.6	Low	66.2	Low	61 Å²	61	65.7 Å²	65.7	37%	0.374	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	107.6	166.5	-58	0	0	0	0	107	E409 S411 D415 L419	E409-T417 PolarHBondContact N-O 3.48Å; S411-T417 WeakPolarHBondContact CB-OG1 3.44Å; D415-T417 PolarHBondContact O-N 2.84Å; T417-L419 HydrophobicContact CG2-CD2 3.83Å; T417-L419 HydrophobicContact CG2-CG 4.32Å; T417-L419 PolarHBondContact O-N 3.47Å
418	V	62.8	Low	66.4	Low	48 Å²	48	69.3 Å²	69.3	29%	0.291	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	103.3	171.9	177.5	0	0	0	0	108.2	S406 I407 F408 P416	S406-V418 VanDerWaalsContact CB-CG1 3.48Å; S406-V418 VanDerWaalsContact OG-CG1 3.22Å; S406-V418 WeakPolarHBondContact OG-CG1 3.39Å; I407-V418 WeakPolarHBondContact O-CA 3.45Å; F408-V418 HydrophobicContact CD1-CG2 4.42Å; F408-V418 HydrophobicContact CE1-CG2 4.4Å; P416-V418 PolarHBondContact O-N 3.32Å
419	L	63.3	Low	66.8	Low	68 Å²	68	71.5 Å²	71.5	36%	0.356	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	130.8	169.8	-56.6	175.1	0	0	0	108.5	S406 I407 E409 T417 P421 Y454	S406-L419 WeakPolarHBondContact CA-O 3.23Å; I407-L419 HydrophobicContact CB-CB 4.19Å; I407-L419 HydrophobicContact CD1-CB 4.09Å; I407-L419 PolarHBondContact N-O 2.92Å; I407-L419 PolarHBondContact O-N 3.47Å; E409-L419 VanDerWaalsContact OE1-CD1 3.28Å; E409-L419 WeakPolarHBondContact OE1-CD1 3.47Å; T417-L419 HydrophobicContact CG2-CD2 3.83Å; T417-L419 HydrophobicContact CG2-CG 4.32Å; T417-L419 PolarHBondContact O-N 3.47Å; L419-P421 VanDerWaalsContact O-CD 3.23Å; L419-P421 WeakPolarHBondContact O-CD 3.34Å; L419-Y454 HydrophobicContact CD1-CE2 4.42Å
420	N	70.5	Confident	67.5	Low	93 Å²	93	68.9 Å²	68.9	50%	0.497	40%	0.397	S	S	.	.			trans	-100.3	96.2	171.6	-59.1	-47.4	0	0	0	108.1	K404 Y405	K404-N420 VanDerWaalsContact CE-OD1 3.27Å; K404-N420 WeakPolarHBondContact CE-OD1 3.29Å; Y405-N420 WeakPolarHBondContact O-CA 3.48Å; Y405-N420 PolarHBondContact O-OD1 3.01Å
421	P	69.8	Low	68.5	Low	33 Å²	33	66 Å²	66	21%	0.214	38%	0.382	C	S	.	.			trans	-65	141.6	177.4	27.9	-32.9	0	0	0	109.4	I407 L419 V423	I407-P421 HydrophobicContact CD1-CB 4.18Å; I407-P421 HydrophobicContact CD1-CG 3.91Å; I407-P421 HydrophobicContact CG1-CG 4.37Å; L419-P421 VanDerWaalsContact O-CD 3.23Å; L419-P421 WeakPolarHBondContact O-CD 3.34Å; P421-V423 HydrophobicContact CB-CG2 4.3Å; P421-V423 HydrophobicContact CG-CG2 4.07Å; P421-V423 PolarHBondContact O-N 3.01Å; P421-V423 VanDerWaalsContact O-N 3.15Å
422	F	64.6	Low	70.1	Confident	193 Å²	193	64.9 Å²	64.9	85%	0.846	37%	0.374	S	S	*	.			trans	-71.6	108.6	167.8	-177.5	-100	0	0	0	108.4	A424	F422-A424 HydrophobicContact CE1-CB 3.92Å
423	V	69.5	Low	72.2	Confident	33 Å²	33	60.2 Å²	60.2	20%	0.2	34%	0.339	C	S	.	.			trans	-109.9	105.5	175.6	-164.7	0	0	0	0	107.9	Y405 P421 T425 L427	Y405-V423 HydrophobicContact CD1-CG2 4.41Å; Y405-V423 HydrophobicContact CD2-CB 3.82Å; Y405-V423 HydrophobicContact CD2-CG2 3.49Å; Y405-V423 VanDerWaalsContact CD2-CG2 3.49Å; Y405-V423 HydrophobicContact CE2-CB 3.77Å; Y405-V423 HydrophobicContact CE2-CG1 4.34Å; Y405-V423 HydrophobicContact CE2-CG2 3.93Å; Y405-V423 HydrophobicContact CG-CG2 3.76Å; P421-V423 HydrophobicContact CB-CG2 4.3Å; P421-V423 HydrophobicContact CG-CG2 4.07Å; P421-V423 PolarHBondContact O-N 3.01Å; P421-V423 VanDerWaalsContact O-N 3.15Å; V423-T425 WeakPolarHBondContact CG1-O 3.45Å; V423-T425 PolarHBondContact O-N 3.28Å; V423-L427 HydrophobicContact CG1-CD2 3.85Å; V423-L427 HydrophobicContact CG1-CG 4.1Å
424	A	66.3	Low	74.6	Confident	81 Å²	81	54.1 Å²	54.1	67%	0.669	31%	0.306	S	S	*	.	S	Bend	trans	-64.7	-24.7	-176.2	0	0	0	0	0	113.5	F422	F422-A424 HydrophobicContact CE1-CB 3.92Å
425	T	72.5	Confident	77.1	Confident	55 Å²	55	49.3 Å²	49.3	34%	0.337	27%	0.273	S	S	.	.	S	Bend	trans	-128.6	139	-176.9	54.6	0	0	0	0	110.3	V423 L427 N445	V423-T425 WeakPolarHBondContact CG1-O 3.45Å; V423-T425 PolarHBondContact O-N 3.28Å; T425-L427 PolarHBondContact O-N 3.3Å; T425-N445 PolarHBondContact OG1-ND2 3.3Å
426	P	80.1	Confident	79.2	Confident	79 Å²	79	45.6 Å²	45.6	51%	0.513	26%	0.255	S	S	.	.			trans	-51.7	133.7	173.4	-25.9	34.5	0	0	0	112.4	Y405 H428	Y405-P426 WeakPolarHBondContact OH-CA 3.36Å; P426-H428 PolarHBondContact O-N 3.14Å
427	L	85.1	Confident	81	Confident	5 Å²	5	51 Å²	51	3%	0.026	28%	0.278	C	S	.	.			trans	-75.8	107.4	174.8	-63.4	-176.4	0	0	0	108.4	V354 W360 Y405 V423 T425 V430 N445 I453	V354-L427 WeakPolarHBondContact CG2-O 3.16Å; W360-L427 HydrophobicContact CH2-CD1 4.01Å; W360-L427 HydrophobicContact CZ2-CB 4.28Å; W360-L427 HydrophobicContact CZ2-CD1 4.17Å; Y405-L427 HydrophobicContact CD1-CD1 3.69Å; Y405-L427 HydrophobicContact CD1-CG 4.25Å; Y405-L427 HydrophobicContact CE1-CB 3.9Å; Y405-L427 HydrophobicContact CE1-CD1 3.41Å; Y405-L427 VanDerWaalsContact CE1-CD1 3.41Å; Y405-L427 HydrophobicContact CE1-CG 3.52Å; Y405-L427 PolarHBondContact OH-N 3.21Å; V423-L427 HydrophobicContact CG1-CD2 3.85Å; V423-L427 HydrophobicContact CG1-CG 4.1Å; T425-L427 PolarHBondContact O-N 3.3Å; L427-V430 HydrophobicContact CB-CG2 4.07Å; L427-V430 HydrophobicContact CD1-CG2 4.08Å; L427-N445 HydrophobicContact CD2-CB 3.76Å; L427-N445 VanDerWaalsContact CD2-ND2 3.33Å; L427-N445 WeakPolarHBondContact CD2-ND2 3.49Å; L427-I453 HydrophobicContact CD1-CD1 3.76Å; L427-I453 HydrophobicContact CD2-CD1 3.85Å; L427-I453 HydrophobicContact CD2-CG1 4.33Å; L427-I453 HydrophobicContact CG-CD1 4.5Å
428	H	89.8	Confident	82.3	Confident	80 Å²	80	54.7 Å²	54.7	37%	0.37	29%	0.291	S	S	.	.	S	Bend	trans	-94.9	-35.9	172.9	-65.5	-55.9	0	0	0	111.7	V354 S355 P426 T447	V354-H428 PolarHBondContact N-O 2.95Å; S355-H428 WeakPolarHBondContact CA-ND1 3.45Å; S355-H428 PolarHBondContact N-O 3.32Å; P426-H428 PolarHBondContact O-N 3.14Å; H428-T447 HydrophobicContact CB-CG2 4.32Å; H428-T447 PolarHBondContact N-OG1 3.08Å
429	R	92.6	Very high	83.7	Confident	47 Å²	47	52.9 Å²	52.9	18%	0.177	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	126.3	177.3	-167.2	178	-66.4	-178.3	-1.7	110.6	E351 V352 V446 T447 S485	E351-R429 HydrophobicContact CB-CG 4.23Å; E351-R429 WeakPolarHBondContact OE2-CD 3.43Å; E351-R429 IonicContact OE2-NH1 3.52Å; V352-R429 WeakPolarHBondContact O-CA 3.36Å; R429-V446 HydrophobicContact CB-CB 4.06Å; R429-V446 HydrophobicContact CB-CG1 4.46Å; R429-V446 HydrophobicContact CG-CB 4.05Å; R429-V446 HydrophobicContact CG-CG1 4.25Å; R429-V446 HydrophobicContact CG-CG2 4.4Å; R429-V446 WeakPolarHBondContact O-CB 3.4Å; R429-V446 PolarHBondContact O-N 3.43Å; R429-V446 VanDerWaalsContact O-N 3.12Å; R429-T447 PolarHBondContact N-OG1 3.32Å; R429-S485 PolarHBondContact NH1-O 3.49Å; R429-S485 PolarHBondContact NH1-OXT 2.8Å; R429-S485 PolarHBondContact NH2-OXT 2.75Å
430	V	93.8	Very high	85.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.6	-177.3	-176.2	0	0	0	0	109.5	E351 V352 V354 W360 L362 I397 L427 F443 I453	E351-V430 WeakPolarHBondContact CA-O 3.29Å; V352-V430 PolarHBondContact N-O 3.43Å; V352-V430 PolarHBondContact O-N 2.95Å; V354-V430 HydrophobicContact CG2-CG2 4.05Å; W360-V430 HydrophobicContact CH2-CG2 3.92Å; W360-V430 HydrophobicContact CZ2-CG2 4.28Å; L362-V430 HydrophobicContact CD1-CG1 3.96Å; L362-V430 HydrophobicContact CD2-CB 4.26Å; I397-V430 HydrophobicContact CD1-CG1 4.17Å; L427-V430 HydrophobicContact CB-CG2 4.07Å; L427-V430 HydrophobicContact CD1-CG2 4.08Å; V430-F443 HydrophobicContact CG1-CD1 4.38Å; V430-I453 HydrophobicContact CG1-CD1 4.13Å
431	G	94.7	Very high	86.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	136	172.2	0	0	0	0	0	110.4	Y349 W350 F443 L444	Y349-G431 WeakPolarHBondContact OH-CA 3.41Å; W350-G431 WeakPolarHBondContact O-CA 3.33Å; G431-F443 CarbonylContact O-C 3.55Å; G431-F443 WeakPolarHBondContact O-CA 3.38Å; G431-L444 PolarHBondContact N-O 3.49Å; G431-L444 PolarHBondContact O-N 3.41Å
432	V	96.4	Very high	87.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	119.9	174.9	-173.7	0	0	0	0	108.1	Y349 W350 L362 V364 V441 F443	Y349-V432 WeakPolarHBondContact CA-O 3.39Å; Y349-V432 WeakPolarHBondContact CD2-O 3.43Å; W350-V432 HydrophobicContact CD2-CB 4.13Å; W350-V432 HydrophobicContact CH2-CB 4.33Å; W350-V432 HydrophobicContact CH2-CG1 3.81Å; W350-V432 HydrophobicContact CZ2-CB 3.72Å; W350-V432 HydrophobicContact CZ2-CG1 3.42Å; W350-V432 VanDerWaalsContact CZ2-CG1 3.42Å; W350-V432 HydrophobicContact CZ2-CG2 4.38Å; W350-V432 PolarHBondContact N-O 3.41Å; W350-V432 VanDerWaalsContact N-O 3.15Å; W350-V432 PolarHBondContact O-N 2.87Å; L362-V432 HydrophobicContact CD1-CG2 3.71Å; V364-V432 HydrophobicContact CG2-CG1 4.21Å; V432-V441 HydrophobicContact CG1-CG1 4.16Å; V432-F443 HydrophobicContact CG1-CE1 4.11Å; V432-F443 HydrophobicContact CG2-CD1 4.02Å; V432-F443 HydrophobicContact CG2-CE1 3.94Å
433	F	96.4	Very high	88.9	Confident	24 Å²	24	35.5 Å²	35.5	11%	0.105	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.1	176.1	-178.3	-122.8	0	0	0	110.1	V295 Y298 K347 H348 Y349 D435 V441 S442	V295-F433 HydrophobicContact CB-CD2 4.46Å; V295-F433 HydrophobicContact CG1-CB 3.82Å; V295-F433 HydrophobicContact CG1-CD1 4.47Å; V295-F433 HydrophobicContact CG1-CD2 3.47Å; V295-F433 VanDerWaalsContact CG1-CD2 3.47Å; V295-F433 HydrophobicContact CG1-CE2 4.09Å; V295-F433 HydrophobicContact CG1-CG 3.67Å; V295-F433 HydrophobicContact CG2-CD1 4.31Å; V295-F433 HydrophobicContact CG2-CD2 4.43Å; V295-F433 HydrophobicContact CG2-CE1 4.44Å; V295-F433 HydrophobicContact CG2-CG 4.29Å; Y298-F433 AromaticContact CD2-CE2 3.79Å; Y298-F433 HydrophobicContact CD2-CE2 3.79Å; Y298-F433 HydrophobicContact CD2-CZ 4.24Å; Y298-F433 HydrophobicContact CE2-CE2 4.49Å; Y298-F433 HydrophobicContact CG-CE2 4.23Å; K347-F433 HydrophobicContact CB-CE2 4.01Å; K347-F433 HydrophobicContact CB-CZ 4.14Å; K347-F433 HydrophobicContact CD-CZ 4.16Å; K347-F433 HydrophobicContact CG-CZ 4.42Å; H348-F433 WeakPolarHBondContact O-CA 3.47Å; H348-F433 WeakPolarHBondContact O-CD2 3.28Å; Y349-F433 HydrophobicContact CD2-CB 4Å; Y349-F433 HydrophobicContact CD2-CD2 4.44Å; F433-D435 HydrophobicContact CE1-CB 4.26Å; F433-V441 CarbonylContact O-C 3.54Å; F433-V441 WeakPolarHBondContact O-CA 3.26Å; F433-S442 PolarHBondContact N-O 2.56Å; F433-S442 PolarHBondContact O-N 2.93Å
434	L	95.4	Very high	89.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	121.2	176.5	170.9	63.8	0	0	0	108.8	F343 K347 H348 W350 V364 V441 F461 A465	F343-L434 HydrophobicContact CB-CD2 3.96Å; F343-L434 HydrophobicContact CD2-CD2 3.92Å; F343-L434 HydrophobicContact CG-CD2 4.29Å; K347-L434 CarbonylContact C-O 3.57Å; K347-L434 WeakPolarHBondContact CA-O 3.49Å; H348-L434 HydrophobicContact CB-CB 4.41Å; H348-L434 PolarHBondContact N-O 3.29Å; H348-L434 PolarHBondContact O-N 3.27Å; W350-L434 HydrophobicContact CH2-CB 4.27Å; W350-L434 HydrophobicContact CZ3-CB 4.17Å; V364-L434 HydrophobicContact CG1-CD1 4.49Å; L434-V441 HydrophobicContact CD1-CG2 3.98Å; L434-F461 HydrophobicContact CD1-CE1 4.15Å; L434-F461 HydrophobicContact CD1-CE2 3.66Å; L434-F461 HydrophobicContact CD1-CZ 3.38Å; L434-A465 HydrophobicContact CD2-CB 3.86Å
435	D	94.6	Very high	91	Very high	8 Å²	8	31 Å²	31	4%	0.043	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	102.1	169.5	-165.6	-35.4	0	0	0	107.9	K347 F433 E437 E438 G439 T440	K347-D435 VanDerWaalsContact CE-OD2 3.25Å; K347-D435 WeakPolarHBondContact CE-OD2 3.3Å; K347-D435 HydrophobicContact CG-CB 4.49Å; K347-D435 IonicContact NZ-OD1 3.66Å; K347-D435 IonicContact NZ-OD2 3.65Å; K347-D435 PolarHBondContact NZ-OD2 3.37Å; F433-D435 HydrophobicContact CE1-CB 4.26Å; D435-E437 VanDerWaalsContact C-N 3.29Å; D435-E437 PolarHBondContact OD1-N 3.38Å; D435-E437 VanDerWaalsContact OD1-N 3.14Å; D435-E438 HydrophobicContact CB-CB 4.25Å; D435-E438 PolarHBondContact OD1-N 2.85Å; D435-G439 WeakPolarHBondContact O-CA 3.28Å; D435-G439 PolarHBondContact O-N 3.25Å; D435-T440 WeakPolarHBondContact CB-OG1 3.38Å; D435-T440 PolarHBondContact N-O 2.91Å; D435-T440 PolarHBondContact O-N 2.76Å
436	C	90.9	Very high	91.8	Very high	23 Å²	23	29.4 Å²	29.4	16%	0.155	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-28.7	-178.4	-58.5	0	0	0	0	111.9	G346	G346-C436 VanDerWaalsContact O-CB 3.28Å; G346-C436 WeakPolarHBondContact O-CB 3.42Å; G346-C436 PolarHBondContact O-N 2.91Å; G346-C436 PolarHBondContact O-SG 3.41Å; G346-C436 VanDerWaalsContact O-SG 3.39Å
437	E	90.2	Very high	91.9	Very high	140 Å²	140	28.5 Å²	28.5	65%	0.654	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-46.1	-176	-63.1	173.7	170.3	0	0	110.7	D435 G439	D435-E437 VanDerWaalsContact C-N 3.29Å; D435-E437 PolarHBondContact OD1-N 3.38Å; D435-E437 VanDerWaalsContact OD1-N 3.14Å; E437-G439 VanDerWaalsContact C-N 3.27Å
438	E	89.8	Confident	91.7	Very high	139 Å²	139	31.1 Å²	31.1	65%	0.65	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-7.5	176	-70.7	-68.2	136.7	0	0	113	D435 T440	D435-E438 HydrophobicContact CB-CB 4.25Å; D435-E438 PolarHBondContact OD1-N 2.85Å; E438-T440 HydrophobicContact CB-CG2 4.04Å; E438-T440 WeakPolarHBondContact O-CG2 3.35Å
439	G	90.7	Very high	91.1	Very high	9 Å²	9	31.5 Å²	31.5	9%	0.093	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	50.9	-176.5	0	0	0	0	0	111.7	D435 E437 Q458 C459	D435-G439 WeakPolarHBondContact O-CA 3.28Å; D435-G439 PolarHBondContact O-N 3.25Å; E437-G439 VanDerWaalsContact C-N 3.27Å; G439-Q458 PolarHBondContact O-N 2.83Å; G439-C459 VanDerWaalsContact O-CB 3.24Å; G439-C459 WeakPolarHBondContact O-CB 3.46Å; G439-C459 PolarHBondContact O-N 3.36Å; G439-C459 PolarHBondContact O-SG 2.89Å
440	T	93.9	Very high	90.6	Very high	10 Å²	10	29.4 Å²	29.4	6%	0.061	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	148.9	-178.8	73.5	0	0	0	0	113.1	D435 E438 F456	D435-T440 WeakPolarHBondContact CB-OG1 3.38Å; D435-T440 PolarHBondContact N-O 2.91Å; D435-T440 PolarHBondContact O-N 2.76Å; E438-T440 HydrophobicContact CB-CG2 4.04Å; E438-T440 WeakPolarHBondContact O-CG2 3.35Å; T440-F456 VanDerWaalsContact CA-O 3.31Å; T440-F456 WeakPolarHBondContact CA-O 3.37Å; T440-F456 WeakPolarHBondContact CB-O 3.39Å
441	V	95.1	Very high	90.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	114.8	170.7	-174.2	0	0	0	0	108.3	V364 W395 V432 F433 L434 F443 K455 F456 F461	V364-V441 HydrophobicContact CB-CG1 4.47Å; V364-V441 HydrophobicContact CB-CG2 4.26Å; V364-V441 HydrophobicContact CG2-CG1 3.81Å; V364-V441 HydrophobicContact CG2-CG2 4.11Å; W395-V441 HydrophobicContact CB-CB 4.33Å; W395-V441 HydrophobicContact CB-CG2 4.07Å; W395-V441 HydrophobicContact CG-CG2 4.36Å; V432-V441 HydrophobicContact CG1-CG1 4.16Å; F433-V441 CarbonylContact O-C 3.54Å; F433-V441 WeakPolarHBondContact O-CA 3.26Å; L434-V441 HydrophobicContact CD1-CG2 3.98Å; V441-F443 HydrophobicContact CG1-CE2 3.74Å; V441-F443 HydrophobicContact CG1-CZ 3.79Å; V441-K455 CarbonylContact O-C 3.59Å; V441-K455 WeakPolarHBondContact O-CA 3.42Å; V441-F456 HydrophobicContact CB-CB 4.36Å; V441-F456 HydrophobicContact CB-CD2 4.43Å; V441-F456 PolarHBondContact N-O 2.92Å; V441-F456 PolarHBondContact O-N 3.44Å; V441-F461 HydrophobicContact CG2-CE1 4.22Å; V441-F461 HydrophobicContact CG2-CZ 3.75Å
442	S	94.6	Very high	89.7	Confident	12 Å²	12	35.1 Å²	35.1	8%	0.084	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	137.5	-179.5	-52.8	0	0	0	0	110.9	F433 K455	F433-S442 PolarHBondContact N-O 2.56Å; F433-S442 PolarHBondContact O-N 2.93Å; S442-K455 WeakPolarHBondContact OG-CG 3.35Å
443	F	94	Very high	89.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.2	177.4	-64.4	-86.1	0	0	0	109.5	L362 I397 V430 G431 V432 V441 I453 Y454 F456	L362-F443 HydrophobicContact CD1-CD1 4.03Å; L362-F443 HydrophobicContact CD1-CE1 3.81Å; I397-F443 HydrophobicContact CD1-CB 3.74Å; I397-F443 HydrophobicContact CD1-CD1 3.52Å; I397-F443 HydrophobicContact CD1-CD2 4.48Å; I397-F443 HydrophobicContact CD1-CE1 4.25Å; I397-F443 HydrophobicContact CD1-CG 3.65Å; I397-F443 HydrophobicContact CG1-CD1 3.57Å; I397-F443 HydrophobicContact CG1-CE1 3.78Å; I397-F443 HydrophobicContact CG1-CG 3.96Å; I397-F443 HydrophobicContact CG1-CZ 4.34Å; I397-F443 HydrophobicContact CG2-CD1 4.42Å; I397-F443 HydrophobicContact CG2-CD2 3.84Å; I397-F443 HydrophobicContact CG2-CE2 3.98Å; I397-F443 HydrophobicContact CG2-CG 4.08Å; I397-F443 HydrophobicContact CG2-CZ 4.3Å; V430-F443 HydrophobicContact CG1-CD1 4.38Å; G431-F443 CarbonylContact O-C 3.55Å; G431-F443 WeakPolarHBondContact O-CA 3.38Å; V432-F443 HydrophobicContact CG1-CE1 4.11Å; V432-F443 HydrophobicContact CG2-CD1 4.02Å; V432-F443 HydrophobicContact CG2-CE1 3.94Å; V441-F443 HydrophobicContact CG1-CE2 3.74Å; V441-F443 HydrophobicContact CG1-CZ 3.79Å; F443-I453 HydrophobicContact CB-CB 4.09Å; F443-I453 HydrophobicContact CB-CD1 4.36Å; F443-I453 WeakPolarHBondContact O-CB 3.5Å; F443-I453 PolarHBondContact O-N 3.35Å; F443-Y454 PolarHBondContact N-O 2.78Å; F443-Y454 PolarHBondContact O-N 3.38Å; F443-F456 HydrophobicContact CD2-CD2 4.38Å; F443-F456 HydrophobicContact CD2-CE2 4.32Å; F443-F456 AromaticContact CE2-CD2 3.68Å; F443-F456 HydrophobicContact CE2-CD2 3.68Å; F443-F456 AromaticContact CE2-CE2 3.57Å; F443-F456 HydrophobicContact CE2-CE2 3.57Å; F443-F456 HydrophobicContact CZ-CE2 4.41Å
444	L	91.1	Very high	89	Confident	17 Å²	17	37.8 Å²	37.8	9%	0.089	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	135.3	-174.9	-57.2	172.5	0	0	0	110	L292 V295 Y349 G431 V446 L452	L292-L444 HydrophobicContact CD1-CB 4.43Å; L292-L444 HydrophobicContact CD1-CD1 3.8Å; V295-L444 HydrophobicContact CB-CD1 4.46Å; V295-L444 HydrophobicContact CG1-CD1 4.11Å; Y349-L444 HydrophobicContact CE2-CD1 4.06Å; G431-L444 PolarHBondContact N-O 3.49Å; G431-L444 PolarHBondContact O-N 3.41Å; L444-V446 PolarHBondContact O-N 3.49Å; L444-L452 HydrophobicContact CD2-CB 4.46Å; L444-L452 HydrophobicContact CD2-CD1 3.91Å
445	N	89.8	Confident	88.8	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	94	171.3	-179.1	-6.2	0	0	0	108.5	T425 L427 T447 N448 G450 S451 I453	T425-N445 PolarHBondContact OG1-ND2 3.3Å; L427-N445 HydrophobicContact CD2-CB 3.76Å; L427-N445 VanDerWaalsContact CD2-ND2 3.33Å; L427-N445 WeakPolarHBondContact CD2-ND2 3.49Å; N445-T447 PolarHBondContact O-N 3.31Å; N445-T447 VanDerWaalsContact OD1-CB 3.28Å; N445-T447 WeakPolarHBondContact OD1-CB 3.41Å; N445-T447 PolarHBondContact OD1-N 3.33Å; N445-T447 VanDerWaalsContact OD1-N 3.14Å; N445-N448 HydrophobicContact CB-CB 4.4Å; N445-N448 VanDerWaalsContact ND2-CB 3.35Å; N445-N448 WeakPolarHBondContact ND2-CB 3.29Å; N445-N448 CarbonylContact O-C 3.59Å; N445-N448 PolarHBondContact O-N 3.07Å; N445-N448 VanDerWaalsContact O-N 3.16Å; N445-N448 PolarHBondContact OD1-N 3.36Å; N445-G450 VanDerWaalsContact O-CA 3.23Å; N445-G450 WeakPolarHBondContact O-CA 3.19Å; N445-G450 PolarHBondContact O-N 3.18Å; N445-S451 PolarHBondContact N-O 3.34Å; N445-S451 PolarHBondContact O-N 3.47Å; N445-I453 HydrophobicContact CB-CD1 3.96Å; N445-I453 HydrophobicContact CB-CG1 3.75Å
446	V	88.1	Confident	88.7	Confident	20 Å²	20	42.1 Å²	42.1	12%	0.121	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-65.4	-33	-178.8	-179.2	0	0	0	0	110.7	L292 E351 R429 L444 N448	L292-V446 HydrophobicContact CD1-CG2 4.44Å; L292-V446 HydrophobicContact CD2-CG1 4.47Å; E351-V446 HydrophobicContact CG-CG2 4.01Å; R429-V446 HydrophobicContact CB-CB 4.06Å; R429-V446 HydrophobicContact CB-CG1 4.46Å; R429-V446 HydrophobicContact CG-CB 4.05Å; R429-V446 HydrophobicContact CG-CG1 4.25Å; R429-V446 HydrophobicContact CG-CG2 4.4Å; R429-V446 WeakPolarHBondContact O-CB 3.4Å; R429-V446 PolarHBondContact O-N 3.43Å; R429-V446 VanDerWaalsContact O-N 3.12Å; L444-V446 PolarHBondContact O-N 3.49Å; V446-N448 VanDerWaalsContact C-N 3.26Å; V446-N448 PolarHBondContact O-N 3.09Å
447	T	83.6	Confident	88.6	Confident	61 Å²	61	44.5 Å²	44.5	37%	0.374	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-61.6	-33.6	175.6	-49	0	0	0	0	112.3	H428 R429 N445	H428-T447 HydrophobicContact CB-CG2 4.32Å; H428-T447 PolarHBondContact N-OG1 3.08Å; R429-T447 PolarHBondContact N-OG1 3.32Å; N445-T447 PolarHBondContact O-N 3.31Å; N445-T447 VanDerWaalsContact OD1-CB 3.28Å; N445-T447 WeakPolarHBondContact OD1-CB 3.41Å; N445-T447 PolarHBondContact OD1-N 3.33Å; N445-T447 VanDerWaalsContact OD1-N 3.14Å
448	N	80.9	Confident	88.4	Confident	60 Å²	60	46.3 Å²	46.3	32%	0.321	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-110.5	64.4	178.2	-172.9	22.3	0	0	0	111.7	N445 V446 G450 S451	N445-N448 HydrophobicContact CB-CB 4.4Å; N445-N448 VanDerWaalsContact ND2-CB 3.35Å; N445-N448 WeakPolarHBondContact ND2-CB 3.29Å; N445-N448 CarbonylContact O-C 3.59Å; N445-N448 PolarHBondContact O-N 3.07Å; N445-N448 VanDerWaalsContact O-N 3.16Å; N445-N448 PolarHBondContact OD1-N 3.36Å; V446-N448 VanDerWaalsContact C-N 3.26Å; V446-N448 PolarHBondContact O-N 3.09Å; N448-G450 PolarHBondContact O-N 3.29Å; N448-S451 PolarHBondContact ND2-OG 3.16Å; N448-S451 WeakPolarHBondContact O-CB 3.17Å; N448-S451 PolarHBondContact O-N 2.88Å; N448-S451 PolarHBondContact O-OG 3.15Å
449	H	76.6	Confident	88.1	Confident	88 Å²	88	40 Å²	40	41%	0.407	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	23.5	171.9	-50.9	-69.6	0	0	0	115.5	K288 F289	K288-H449 CarbonylContact C-O 3.58Å; K288-H449 VanDerWaalsContact C-O 3.29Å; F289-H449 PolarHBondContact N-O 2.99Å
450	G	81.1	Confident	87.6	Confident	3 Å²	3	44 Å²	44	3%	0.031	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	21.9	-178.9	0	0	0	0	0	114.6	N445 N448 L452	N445-G450 VanDerWaalsContact O-CA 3.23Å; N445-G450 WeakPolarHBondContact O-CA 3.19Å; N445-G450 PolarHBondContact O-N 3.18Å; N448-G450 PolarHBondContact O-N 3.29Å; G450-L452 PolarHBondContact O-N 3.02Å
451	S	83.8	Confident	87	Confident	16 Å²	16	45.8 Å²	45.8	11%	0.112	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	135.6	173.8	46.1	0	0	0	0	111.8	N445 N448 I453	N445-S451 PolarHBondContact N-O 3.34Å; N445-S451 PolarHBondContact O-N 3.47Å; N448-S451 PolarHBondContact ND2-OG 3.16Å; N448-S451 WeakPolarHBondContact O-CB 3.17Å; N448-S451 PolarHBondContact O-N 2.88Å; N448-S451 PolarHBondContact O-OG 3.15Å; S451-I453 PolarHBondContact O-N 2.87Å
452	L	87.1	Confident	86	Confident	104 Å²	104	49.6 Å²	49.6	55%	0.545	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	121.7	176.9	-175	70.1	0	0	0	110	L444 G450 K455	L444-L452 HydrophobicContact CD2-CB 4.46Å; L444-L452 HydrophobicContact CD2-CD1 3.91Å; G450-L452 PolarHBondContact O-N 3.02Å; L452-K455 HydrophobicContact CD1-CB 4.31Å; L452-K455 HydrophobicContact CD2-CB 4.25Å
453	I	88.7	Confident	85.5	Confident	30 Å²	30	54.1 Å²	54.1	15%	0.154	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-53.6	170.6	-59.7	164.6	0	0	0	108.3	I397 L427 V430 F443 N445 S451	I397-I453 HydrophobicContact CD1-CD1 4.33Å; I397-I453 HydrophobicContact CD1-CG2 4.27Å; L427-I453 HydrophobicContact CD1-CD1 3.76Å; L427-I453 HydrophobicContact CD2-CD1 3.85Å; L427-I453 HydrophobicContact CD2-CG1 4.33Å; L427-I453 HydrophobicContact CG-CD1 4.5Å; V430-I453 HydrophobicContact CG1-CD1 4.13Å; F443-I453 HydrophobicContact CB-CB 4.09Å; F443-I453 HydrophobicContact CB-CD1 4.36Å; F443-I453 WeakPolarHBondContact O-CB 3.5Å; F443-I453 PolarHBondContact O-N 3.35Å; N445-I453 HydrophobicContact CB-CD1 3.96Å; N445-I453 HydrophobicContact CB-CG1 3.75Å; S451-I453 PolarHBondContact O-N 2.87Å
454	Y	89.6	Confident	85.4	Confident	49 Å²	49	56.1 Å²	56.1	19%	0.192	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165	153	-176.3	-173.6	-98.8	0	0	0	111.3	I407 E409 L419 F443 F456	I407-Y454 HydrophobicContact CD1-CD2 3.47Å; I407-Y454 VanDerWaalsContact CD1-CD2 3.47Å; I407-Y454 HydrophobicContact CD1-CE2 4.18Å; I407-Y454 HydrophobicContact CD1-CG 3.67Å; I407-Y454 HydrophobicContact CG1-CD2 4.3Å; I407-Y454 HydrophobicContact CG1-CG 4.07Å; I407-Y454 HydrophobicContact CG2-CD1 3.72Å; I407-Y454 HydrophobicContact CG2-CD2 4.21Å; I407-Y454 HydrophobicContact CG2-CE1 3.72Å; I407-Y454 HydrophobicContact CG2-CE2 4.17Å; I407-Y454 HydrophobicContact CG2-CG 4Å; E409-Y454 WeakPolarHBondContact OE1-CE2 3.39Å; E409-Y454 PolarHBondContact OE1-OH 3.35Å; L419-Y454 HydrophobicContact CD1-CE2 4.42Å; F443-Y454 PolarHBondContact N-O 2.78Å; F443-Y454 PolarHBondContact O-N 3.38Å; Y454-F456 AromaticContact CD1-CD2 3.81Å; Y454-F456 HydrophobicContact CD1-CD2 3.81Å; Y454-F456 AromaticContact CD1-CE2 3.71Å; Y454-F456 HydrophobicContact CD1-CE2 3.71Å; Y454-F456 HydrophobicContact CD1-CG 4.28Å; Y454-F456 HydrophobicContact CD1-CZ 4.1Å; Y454-F456 HydrophobicContact CE1-CB 4.41Å; Y454-F456 AromaticContact CE1-CD1 3.67Å; Y454-F456 HydrophobicContact CE1-CD1 3.67Å; Y454-F456 AromaticContact CE1-CD2 3.63Å; Y454-F456 HydrophobicContact CE1-CD2 3.63Å; Y454-F456 AromaticContact CE1-CE1 3.71Å; Y454-F456 HydrophobicContact CE1-CE1 3.71Å; Y454-F456 AromaticContact CE1-CE2 3.67Å; Y454-F456 HydrophobicContact CE1-CE2 3.67Å; Y454-F456 AromaticContact CE1-CG 3.64Å; Y454-F456 HydrophobicContact CE1-CG 3.64Å; Y454-F456 AromaticContact CE1-CZ 3.72Å; Y454-F456 HydrophobicContact CE1-CZ 3.72Å
455	K	91.6	Very high	85.5	Confident	92 Å²	92	55.3 Å²	55.3	40%	0.4	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	116.3	175.5	176.3	176.3	177.8	-179.1	0	110.7	V441 S442 L452	V441-K455 CarbonylContact O-C 3.59Å; V441-K455 WeakPolarHBondContact O-CA 3.42Å; S442-K455 WeakPolarHBondContact OG-CG 3.35Å; L452-K455 HydrophobicContact CD1-CB 4.31Å; L452-K455 HydrophobicContact CD2-CB 4.25Å
456	F	90.8	Very high	85.7	Confident	8 Å²	8	57.9 Å²	57.9	4%	0.035	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	130.4	162.7	-65.5	-85.7	0	0	0	109.1	P390 W395 I407 E409 T440 V441 F443 Y454 C459	P390-F456 HydrophobicContact CG-CD1 4.39Å; P390-F456 HydrophobicContact CG-CE1 4.18Å; W395-F456 HydrophobicContact CB-CD2 3.97Å; W395-F456 HydrophobicContact CB-CE2 4.23Å; W395-F456 HydrophobicContact CB-CG 4.21Å; W395-F456 AromaticContact CD1-CD1 3.76Å; W395-F456 AromaticContact CD1-CG 3.69Å; W395-F456 HydrophobicContact CG-CG 4.35Å; I407-F456 HydrophobicContact CG2-CE1 4.29Å; I407-F456 HydrophobicContact CG2-CE2 4.38Å; I407-F456 HydrophobicContact CG2-CZ 3.71Å; E409-F456 HydrophobicContact CG-CE1 3.98Å; T440-F456 VanDerWaalsContact CA-O 3.31Å; T440-F456 WeakPolarHBondContact CA-O 3.37Å; T440-F456 WeakPolarHBondContact CB-O 3.39Å; V441-F456 HydrophobicContact CB-CB 4.36Å; V441-F456 HydrophobicContact CB-CD2 4.43Å; V441-F456 PolarHBondContact N-O 2.92Å; V441-F456 PolarHBondContact O-N 3.44Å; F443-F456 HydrophobicContact CD2-CD2 4.38Å; F443-F456 HydrophobicContact CD2-CE2 4.32Å; F443-F456 AromaticContact CE2-CD2 3.68Å; F443-F456 HydrophobicContact CE2-CD2 3.68Å; F443-F456 AromaticContact CE2-CE2 3.57Å; F443-F456 HydrophobicContact CE2-CE2 3.57Å; F443-F456 HydrophobicContact CZ-CE2 4.41Å; Y454-F456 AromaticContact CD1-CD2 3.81Å; Y454-F456 HydrophobicContact CD1-CD2 3.81Å; Y454-F456 AromaticContact CD1-CE2 3.71Å; Y454-F456 HydrophobicContact CD1-CE2 3.71Å; Y454-F456 HydrophobicContact CD1-CG 4.28Å; Y454-F456 HydrophobicContact CD1-CZ 4.1Å; Y454-F456 HydrophobicContact CE1-CB 4.41Å; Y454-F456 AromaticContact CE1-CD1 3.67Å; Y454-F456 HydrophobicContact CE1-CD1 3.67Å; Y454-F456 AromaticContact CE1-CD2 3.63Å; Y454-F456 HydrophobicContact CE1-CD2 3.63Å; Y454-F456 AromaticContact CE1-CE1 3.71Å; Y454-F456 HydrophobicContact CE1-CE1 3.71Å; Y454-F456 AromaticContact CE1-CE2 3.67Å; Y454-F456 HydrophobicContact CE1-CE2 3.67Å; Y454-F456 AromaticContact CE1-CG 3.64Å; Y454-F456 HydrophobicContact CE1-CG 3.64Å; Y454-F456 AromaticContact CE1-CZ 3.72Å; Y454-F456 HydrophobicContact CE1-CZ 3.72Å; F456-C459 VanDerWaalsContact CB-SG 3.53Å
457	S	90	Very high	86	Confident	73 Å²	73	57 Å²	57	51%	0.51	30%	0.302	S	S	.	.			trans	-117.5	157.5	176.5	-56.2	0	0	0	0	110	C459	S457-C459 VanDerWaalsContact C-N 3.26Å; S457-C459 PolarHBondContact O-N 3.48Å
458	Q	84.7	Confident	86.5	Confident	178 Å²	178	54.3 Å²	54.3	83%	0.832	29%	0.285	S	S	*	.	S	Bend	trans	59.2	36.3	179.6	-53.7	176	-1.4	0	0	113	G439 C460	G439-Q458 PolarHBondContact O-N 2.83Å; Q458-C460 PolarHBondContact O-N 3.16Å
459	C	84.4	Confident	87.1	Confident	7 Å²	7	51.4 Å²	51.4	5%	0.047	27%	0.27	C	S	.	.			trans	-69.8	115.9	176.8	-56.6	0	0	0	0	110.4	W395 G439 F456 S457 F461	W395-C459 HydrophobicContact CZ2-CB 4.01Å; W395-C459 PolarHBondContact NE1-SG 3.09Å; G439-C459 VanDerWaalsContact O-CB 3.24Å; G439-C459 WeakPolarHBondContact O-CB 3.46Å; G439-C459 PolarHBondContact O-N 3.36Å; G439-C459 PolarHBondContact O-SG 2.89Å; F456-C459 VanDerWaalsContact CB-SG 3.53Å; S457-C459 VanDerWaalsContact C-N 3.26Å; S457-C459 PolarHBondContact O-N 3.48Å; C459-F461 HydrophobicContact CB-CD1 4.37Å; C459-F461 HydrophobicContact CB-CE1 3.7Å; C459-F461 HydrophobicContact CB-CE2 3.92Å; C459-F461 HydrophobicContact CB-CZ 3.43Å; C459-F461 VanDerWaalsContact CB-CZ 3.43Å; C459-F461 PolarHBondContact O-N 2.8Å
460	C	79.8	Confident	87.8	Confident	92 Å²	92	47.3 Å²	47.3	62%	0.622	25%	0.251	S	S	*	.			trans	-82.9	96.2	175.3	-60.9	0	0	0	0	111.4	Q458 S462	Q458-C460 PolarHBondContact O-N 3.16Å; C460-S462 PolarHBondContact O-N 3.38Å
461	F	81.4	Confident	88.2	Confident	48 Å²	48	47.2 Å²	47.2	21%	0.211	25%	0.25	C	C	.	.			trans	-86.1	82.6	173.5	-52.3	-55	0	0	0	111	V364 T366 W395 L434 V441 C459 Q463 A465	V364-F461 HydrophobicContact CG1-CE1 4.48Å; T366-F461 HydrophobicContact CG2-CB 4.36Å; T366-F461 HydrophobicContact CG2-CD1 3.73Å; T366-F461 HydrophobicContact CG2-CG 4.49Å; W395-F461 HydrophobicContact CD2-CE1 4.21Å; W395-F461 HydrophobicContact CE3-CD1 4.41Å; W395-F461 AromaticContact CE3-CE1 3.9Å; W395-F461 HydrophobicContact CE3-CE1 3.9Å; W395-F461 AromaticContact CH2-CD1 3.74Å; W395-F461 HydrophobicContact CH2-CD1 3.74Å; W395-F461 AromaticContact CH2-CE1 3.93Å; W395-F461 HydrophobicContact CH2-CE1 3.93Å; W395-F461 HydrophobicContact CZ2-CD1 4.33Å; W395-F461 HydrophobicContact CZ2-CE1 4.25Å; W395-F461 AromaticContact CZ3-CD1 3.78Å; W395-F461 HydrophobicContact CZ3-CD1 3.78Å; W395-F461 AromaticContact CZ3-CE1 3.75Å; W395-F461 HydrophobicContact CZ3-CE1 3.75Å; L434-F461 HydrophobicContact CD1-CE1 4.15Å; L434-F461 HydrophobicContact CD1-CE2 3.66Å; L434-F461 HydrophobicContact CD1-CZ 3.38Å; V441-F461 HydrophobicContact CG2-CE1 4.22Å; V441-F461 HydrophobicContact CG2-CZ 3.75Å; C459-F461 HydrophobicContact CB-CD1 4.37Å; C459-F461 HydrophobicContact CB-CE1 3.7Å; C459-F461 HydrophobicContact CB-CE2 3.92Å; C459-F461 HydrophobicContact CB-CZ 3.43Å; C459-F461 VanDerWaalsContact CB-CZ 3.43Å; C459-F461 PolarHBondContact O-N 2.8Å; F461-Q463 PolarHBondContact O-N 3.13Å; F461-A465 HydrophobicContact CD1-CB 4.48Å
462	S	74.4	Confident	88.3	Confident	80 Å²	80	48.3 Å²	48.3	56%	0.559	25%	0.252	S	S	*	.	S	Bend	trans	-76.4	-7.4	178.2	59.8	0	0	0	0	114.2	C460	C460-S462 PolarHBondContact O-N 3.38Å
463	Q	85.1	Confident	88	Confident	107 Å²	107	48.9 Å²	48.9	50%	0.5	26%	0.255	S	S	.	.	S	Bend	trans	-147.2	162.7	-177.2	-70.7	-64	-60	0	0	108.4	T366 F461 A465	T366-Q463 WeakPolarHBondContact CG2-O 3.5Å; F461-Q463 PolarHBondContact O-N 3.13Å; Q463-A465 PolarHBondContact O-N 2.72Å
464	P	90.8	Very high	87.7	Confident	41 Å²	41	48 Å²	48	27%	0.266	25%	0.252	S	S	.	.			trans	-52.3	133.7	175.4	-26.2	34.5	0	0	0	112.1	C342 F343 Y466	C342-P464 HydrophobicContact CB-CB 3.96Å; F343-P464 WeakPolarHBondContact O-CA 3.5Å; P464-Y466 HydrophobicContact CB-CE2 4.26Å; P464-Y466 VanDerWaalsContact O-CD2 3.3Å; P464-Y466 WeakPolarHBondContact O-CD2 3.48Å; P464-Y466 WeakPolarHBondContact O-CE2 3.41Å
465	A	92.9	Very high	87.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	130.9	177.7	0	0	0	0	0	110.2	C342 F343 V364 T366 L434 F461 Q463	C342-A465 CarbonylContact C-O 3.58Å; C342-A465 VanDerWaalsContact CA-O 3.3Å; C342-A465 WeakPolarHBondContact CA-O 3.3Å; F343-A465 PolarHBondContact N-O 3.31Å; F343-A465 PolarHBondContact O-N 3.04Å; V364-A465 HydrophobicContact CG1-CB 3.65Å; T366-A465 HydrophobicContact CG2-CB 4.04Å; L434-A465 HydrophobicContact CD2-CB 3.86Å; F461-A465 HydrophobicContact CD1-CB 4.48Å; Q463-A465 PolarHBondContact O-N 2.72Å
466	Y	93.9	Very high	87.4	Confident	59 Å²	59	46.8 Å²	46.8	23%	0.231	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	135.8	177.5	-67.4	-98.8	0	0	0	109.5	L338 C342 V364 Y365 P464 Y468	L338-Y466 HydrophobicContact CD1-CD1 4.19Å; L338-Y466 HydrophobicContact CD1-CG 4.19Å; C342-Y466 HydrophobicContact CB-CD1 3.66Å; C342-Y466 HydrophobicContact CB-CD2 4.18Å; C342-Y466 HydrophobicContact CB-CE1 3.38Å; C342-Y466 HydrophobicContact CB-CE2 3.91Å; C342-Y466 HydrophobicContact CB-CG 4.05Å; C342-Y466 VanDerWaalsContact CB-CZ 3.5Å; V364-Y466 WeakPolarHBondContact CA-O 3.37Å; Y365-Y466 PolarHBondContact N-O 2.9Å; Y365-Y466 PolarHBondContact O-N 3.3Å; P464-Y466 HydrophobicContact CB-CE2 4.26Å; P464-Y466 VanDerWaalsContact O-CD2 3.3Å; P464-Y466 WeakPolarHBondContact O-CD2 3.48Å; P464-Y466 WeakPolarHBondContact O-CE2 3.41Å; Y466-Y468 PolarHBondContact O-N 3.42Å
467	P	95.5	Very high	87.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	130.2	162.3	-25.6	36.8	0	0	0	109.9	F302 L338 G339 K341 F343 W350 F469	F302-P467 HydrophobicContact CE1-CB 4.43Å; F302-P467 HydrophobicContact CE1-CG 3.89Å; F302-P467 HydrophobicContact CE2-CB 3.72Å; F302-P467 HydrophobicContact CE2-CG 3.82Å; F302-P467 HydrophobicContact CZ-CB 3.54Å; F302-P467 HydrophobicContact CZ-CG 3.47Å; F302-P467 VanDerWaalsContact CZ-CG 3.47Å; L338-P467 CarbonylContact C-O 3.5Å; L338-P467 VanDerWaalsContact CA-O 3.32Å; L338-P467 WeakPolarHBondContact CA-O 3.24Å; G339-P467 PolarHBondContact N-O 3.48Å; K341-P467 WeakPolarHBondContact O-CD 3.37Å; F343-P467 HydrophobicContact CD2-CG 4.41Å; F343-P467 HydrophobicContact CE2-CG 3.66Å; W350-P467 HydrophobicContact CH2-CB 4.32Å; W350-P467 HydrophobicContact CH2-CG 4.03Å; W350-P467 HydrophobicContact CZ2-CB 3.76Å; W350-P467 HydrophobicContact CZ2-CG 3.97Å; W350-P467 HydrophobicContact CZ3-CG 4.36Å; P467-F469 HydrophobicContact CB-CE2 3.52Å; P467-F469 HydrophobicContact CB-CZ 3.59Å
468	Y	94.4	Very high	87.6	Confident	5 Å²	5	44.8 Å²	44.8	2%	0.02	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	137.6	-176.8	179.2	-93.3	0	0	0	111	G336 L338 T361 L362 G363 Y388 Y394 V396 Y466 N470	G336-Y468 WeakPolarHBondContact CA-OH 3.38Å; L338-Y468 HydrophobicContact CD2-CD2 3.74Å; T361-Y468 HydrophobicContact CG2-CE1 4.45Å; L362-Y468 CarbonylContact C-O 3.55Å; L362-Y468 VanDerWaalsContact CA-O 3.26Å; L362-Y468 WeakPolarHBondContact CA-O 3.25Å; G363-Y468 PolarHBondContact N-O 3.36Å; G363-Y468 PolarHBondContact O-N 3.06Å; Y388-Y468 HydrophobicContact CD1-CE1 4.38Å; Y388-Y468 AromaticContact CE1-CE1 3.62Å; Y388-Y468 HydrophobicContact CE1-CE1 3.62Å; Y388-Y468 AromaticContact CE1-CZ 3.82Å; Y388-Y468 WeakPolarHBondContact CE1-OH 3.27Å; Y388-Y468 PolarHBondContact OH-OH 3.08Å; Y394-Y468 HydrophobicContact CD1-CD1 4.41Å; Y394-Y468 HydrophobicContact CD1-CE1 4.46Å; Y394-Y468 HydrophobicContact CD1-CG 4.44Å; Y394-Y468 HydrophobicContact CE1-CD1 4.46Å; Y394-Y468 AromaticContact CE1-CD2 3.95Å; Y394-Y468 HydrophobicContact CE1-CD2 3.95Å; Y394-Y468 HydrophobicContact CE1-CE1 4.29Å; Y394-Y468 AromaticContact CE1-CE2 3.79Å; Y394-Y468 HydrophobicContact CE1-CE2 3.79Å; Y394-Y468 HydrophobicContact CE1-CG 4.3Å; Y394-Y468 AromaticContact CE1-CZ 3.97Å; V396-Y468 HydrophobicContact CG1-CD1 3.85Å; Y466-Y468 PolarHBondContact O-N 3.42Å; Y468-N470 HydrophobicContact CE1-CB 3.98Å; Y468-N470 PolarHBondContact OH-ND2 3.17Å
469	F	93.4	Very high	88.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	140.8	-177.7	-47.4	-87.1	0	0	0	110.5	F302 F304 G336 I337 W350 V352 T361 L362 P467 M478 L480	F302-F469 AromaticContact CE2-CE2 3.99Å; F302-F469 HydrophobicContact CE2-CE2 3.99Å; F302-F469 AromaticContact CE2-CZ 3.84Å; F302-F469 HydrophobicContact CE2-CZ 3.84Å; F302-F469 AromaticContact CZ-CZ 3.99Å; F302-F469 HydrophobicContact CZ-CZ 3.99Å; F304-F469 AromaticContact CD1-CD2 3.81Å; F304-F469 HydrophobicContact CD1-CD2 3.81Å; F304-F469 HydrophobicContact CD1-CE2 4.13Å; F304-F469 HydrophobicContact CD1-CG 4.33Å; F304-F469 HydrophobicContact CE1-CB 4.03Å; F304-F469 HydrophobicContact CE1-CD1 4.04Å; F304-F469 AromaticContact CE1-CD2 3.42Å; F304-F469 HydrophobicContact CE1-CD2 3.42Å; F304-F469 VanDerWaalsContact CE1-CD2 3.42Å; F304-F469 HydrophobicContact CE1-CE1 4.38Å; F304-F469 AromaticContact CE1-CE2 3.79Å; F304-F469 HydrophobicContact CE1-CE2 3.79Å; F304-F469 AromaticContact CE1-CG 3.55Å; F304-F469 HydrophobicContact CE1-CG 3.55Å; F304-F469 HydrophobicContact CE1-CZ 4.26Å; F304-F469 HydrophobicContact CZ-CG 4.47Å; G336-F469 CarbonylContact C-O 3.59Å; G336-F469 WeakPolarHBondContact CA-O 3.39Å; I337-F469 HydrophobicContact CG2-CB 3.94Å; I337-F469 PolarHBondContact N-O 3.48Å; I337-F469 PolarHBondContact O-N 2.79Å; W350-F469 AromaticContact NE1-CE1 3.87Å; W350-F469 AromaticContact NE1-CZ 3.78Å; V352-F469 HydrophobicContact CG2-CD1 4.27Å; V352-F469 HydrophobicContact CG2-CE1 3.65Å; T361-F469 CarbonylContact O-C 3.57Å; L362-F469 HydrophobicContact CB-CD1 4.22Å; P467-F469 HydrophobicContact CB-CE2 3.52Å; P467-F469 HydrophobicContact CB-CZ 3.59Å; F469-M478 HydrophobicContact CB-SD 3.84Å; F469-M478 HydrophobicContact CD1-SD 3.85Å; F469-M478 HydrophobicContact CG-SD 4.29Å; F469-L480 HydrophobicContact CE1-CD2 3.9Å; F469-L480 HydrophobicContact CZ-CD2 3.72Å
470	N	90.9	Very high	88.6	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.011	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	109.7	173.3	-170.9	-28.5	0	0	0	109.1	N335 W360 T361 Y388 Y468 W472	N335-N470 PolarHBondContact O-OD1 2.98Å; W360-N470 CarbonylContact C-O 3.56Å; W360-N470 WeakPolarHBondContact CA-O 3.42Å; T361-N470 PolarHBondContact N-O 3.33Å; T361-N470 PolarHBondContact O-N 3.33Å; Y388-N470 PolarHBondContact OH-ND2 3.38Å; Y468-N470 HydrophobicContact CE1-CB 3.98Å; Y468-N470 PolarHBondContact OH-ND2 3.17Å; N470-W472 PolarHBondContact O-N 2.81Å; N470-W472 WeakPolarHBondContact OD1-CA 3.41Å; N470-W472 PolarHBondContact OD1-N 3.36Å
471	P	88.7	Confident	89.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.187	C	C	.	.			trans	-76.7	0.9	178.4	32	-34.2	0	0	0	113.8	L313 V322 N335 K357 C474	L313-P471 HydrophobicContact CD2-CG 3.52Å; V322-P471 HydrophobicContact CG2-CG 4.4Å; N335-P471 VanDerWaalsContact O-CD 3.28Å; N335-P471 WeakPolarHBondContact O-CD 3.3Å; K357-P471 VanDerWaalsContact NZ-CB 3.34Å; K357-P471 PolarHBondContact NZ-O 2.89Å; P471-C474 PolarHBondContact O-N 2.9Å
472	W	85.6	Confident	89.4	Confident	39 Å²	39	34.3 Å²	34.3	15%	0.148	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	-141.8	-172	-75.4	84.9	0	0	0	111.5	S324 N335 A359 T361 Y385 Y388 N470 C474	S324-W472 WeakPolarHBondContact CB-O 3.45Å; S324-W472 PolarHBondContact OG-O 3Å; N335-W472 PolarHBondContact ND2-O 3.11Å; A359-W472 HydrophobicContact CB-CB 4Å; A359-W472 HydrophobicContact CB-CG 4.44Å; T361-W472 PolarHBondContact OG1-NE1 3.22Å; Y385-W472 AromaticContact CD1-CH2 3.63Å; Y385-W472 HydrophobicContact CD1-CH2 3.63Å; Y385-W472 AromaticContact CD1-CZ2 3.53Å; Y385-W472 HydrophobicContact CD1-CZ2 3.53Å; Y385-W472 HydrophobicContact CD2-CH2 4.41Å; Y385-W472 AromaticContact CE1-CE2 3.91Å; Y385-W472 AromaticContact CE1-CH2 3.17Å; Y385-W472 HydrophobicContact CE1-CH2 3.17Å; Y385-W472 AromaticContact CE1-CZ2 3.06Å; Y385-W472 HydrophobicContact CE1-CZ2 3.06Å; Y385-W472 HydrophobicContact CE1-CZ3 4.08Å; Y385-W472 HydrophobicContact CE2-CH2 4.03Å; Y385-W472 HydrophobicContact CG-CH2 4.24Å; Y385-W472 AromaticContact CZ-CH2 3.4Å; Y385-W472 AromaticContact CZ-CZ2 3.76Å; Y385-W472 AromaticContact CZ-CZ3 3.9Å; Y388-W472 HydrophobicContact CE2-CH2 4.31Å; Y388-W472 AromaticContact CE2-CZ2 3.67Å; Y388-W472 HydrophobicContact CE2-CZ2 3.67Å; N470-W472 PolarHBondContact O-N 2.81Å; N470-W472 WeakPolarHBondContact OD1-CA 3.41Å; N470-W472 PolarHBondContact OD1-N 3.36Å; W472-C474 VanDerWaalsContact C-N 3.31Å
473	D	80.5	Confident	89.3	Confident	116 Å²	116	35.3 Å²	35.3	62%	0.62	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	8.2	176.1	60.9	-18.4	0	0	0	112.6	P475	D473-P475 WeakPolarHBondContact O-CD 3.28Å
474	C	83.6	Confident	88	Confident	13 Å²	13	37.8 Å²	37.8	9%	0.088	21%	0.212	C	C	.	.			trans	-82	118.8	-177.5	-176.7	0	0	0	0	110.6	K357 K358 A359 P471 W472 A476	K357-C474 PolarHBondContact NZ-O 3.22Å; K358-C474 PolarHBondContact N-SG 3.47Å; K358-C474 VanDerWaalsContact N-SG 3.4Å; A359-C474 HydrophobicContact CB-CB 4.36Å; P471-C474 PolarHBondContact O-N 2.9Å; W472-C474 VanDerWaalsContact C-N 3.31Å; C474-A476 VanDerWaalsContact C-N 3.28Å; C474-A476 PolarHBondContact O-N 3.09Å
475	P	84.6	Confident	86	Confident	97 Å²	97	39.9 Å²	39.9	63%	0.63	23%	0.228	S	C	*	.			trans	-75.6	-12.3	-174.2	31.1	-36.4	0	0	0	113.8	T323 D473	T323-P475 WeakPolarHBondContact CG2-O 3.49Å; D473-P475 WeakPolarHBondContact O-CD 3.28Å
476	A	89.6	Confident	85.6	Confident	18 Å²	18	41.9 Å²	41.9	15%	0.149	24%	0.24	C	C	.	.	S	Bend	trans	-65.2	142.5	172.1	0	0	0	0	0	110.5	E356 K357 C474	E356-A476 HydrophobicContact CB-CB 3.77Å; E356-A476 WeakPolarHBondContact O-CB 3.39Å; K357-A476 HydrophobicContact CG-CB 3.99Å; K357-A476 PolarHBondContact NZ-O 2.84Å; C474-A476 VanDerWaalsContact C-N 3.28Å; C474-A476 PolarHBondContact O-N 3.09Å
477	P	91.3	Very high	85.2	Confident	38 Å²	38	41 Å²	41	25%	0.247	24%	0.24	C	C	.	.			trans	-69.4	150.7	-176.3	28.9	-34.6	0	0	0	111.7	K357	K357-P477 WeakPolarHBondContact CD-O 3.31Å; K357-P477 WeakPolarHBondContact CG-O 3.37Å
478	M	93.6	Very high	84.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	126.7	161.4	-179.5	-179.9	-67.8	0	0	107.9	Q321 V322 V352 V354 K357 W360 F469	Q321-M478 WeakPolarHBondContact CA-O 3.26Å; V322-M478 HydrophobicContact CG1-CB 3.85Å; V322-M478 PolarHBondContact N-O 2.88Å; V322-M478 PolarHBondContact O-N 3.47Å; V352-M478 HydrophobicContact CG1-CG 3.32Å; V352-M478 HydrophobicContact CG1-SD 3.78Å; V354-M478 HydrophobicContact CG1-CE 4.07Å; V354-M478 HydrophobicContact CG1-CG 4.24Å; K357-M478 HydrophobicContact CD-CB 3.79Å; K357-M478 HydrophobicContact CD-CE 4.2Å; W360-M478 HydrophobicContact CB-CE 3.44Å; W360-M478 VanDerWaalsContact CB-CE 3.44Å; W360-M478 HydrophobicContact CG-CE 4.23Å; F469-M478 HydrophobicContact CB-SD 3.84Å; F469-M478 HydrophobicContact CD1-SD 3.85Å; F469-M478 HydrophobicContact CG-SD 4.29Å
479	T	95.1	Very high	84	Confident	29 Å²	29	45.5 Å²	45.5	18%	0.178	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.7	-170.3	-56.3	0	0	0	0	111.9	R320 Q321 V352 D353 C481	R320-T479 CarbonylContact O-C 3.45Å; R320-T479 WeakPolarHBondContact O-CA 3.49Å; Q321-T479 HydrophobicContact CG-CG2 3.8Å; Q321-T479 WeakPolarHBondContact CG-OG1 3.43Å; Q321-T479 PolarHBondContact NE2-OG1 3.18Å; V352-T479 CarbonylContact C-O 3.57Å; V352-T479 WeakPolarHBondContact CA-O 3.46Å; D353-T479 PolarHBondContact N-O 3.28Å; D353-T479 PolarHBondContact O-N 2.76Å; D353-T479 VanDerWaalsContact O-N 3.12Å; T479-C481 PolarHBondContact O-N 3.41Å
480	L	94.7	Very high	83.5	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.026	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	113.3	167.9	-72.7	169.9	0	0	0	110	F302 F304 R320 V352 F469	F302-L480 HydrophobicContact CD2-CD1 3.95Å; F302-L480 HydrophobicContact CE2-CD1 3.74Å; F302-L480 HydrophobicContact CE2-CD2 3.93Å; F302-L480 HydrophobicContact CZ-CD2 4.05Å; F304-L480 HydrophobicContact CD1-CD1 4.11Å; F304-L480 HydrophobicContact CD2-CD1 4.34Å; F304-L480 HydrophobicContact CE1-CD1 3.9Å; F304-L480 HydrophobicContact CE1-CG 4.03Å; F304-L480 HydrophobicContact CE2-CD1 4.18Å; F304-L480 HydrophobicContact CE2-CG 4.17Å; F304-L480 HydrophobicContact CG-CD1 4.31Å; F304-L480 HydrophobicContact CZ-CD1 3.96Å; F304-L480 HydrophobicContact CZ-CG 3.74Å; R320-L480 HydrophobicContact CB-CB 4.44Å; R320-L480 PolarHBondContact O-N 3.41Å; V352-L480 HydrophobicContact CG2-CD2 4.28Å; F469-L480 HydrophobicContact CE1-CD2 3.9Å; F469-L480 HydrophobicContact CZ-CD2 3.72Å
481	C	92.6	Very high	83	Confident	8 Å²	8	51.5 Å²	51.5	5%	0.054	30%	0.302	C	S	.	.			trans	-67.3	144.3	179.7	-63.9	0	0	0	0	110.8	W299 E351 T479 S485	W299-C481 HydrophobicContact CH2-CB 4.45Å; W299-C481 VanDerWaalsContact CZ2-O 3.32Å; W299-C481 WeakPolarHBondContact CZ2-O 3.04Å; E351-C481 HydrophobicContact CB-CB 3.91Å; E351-C481 PolarHBondContact O-N 2.98Å; T479-C481 PolarHBondContact O-N 3.41Å; C481-S485 WeakPolarHBondContact CB-OG 3.43Å
482	P	86.6	Confident	82.6	Confident	64 Å²	64	55.1 Å²	55.1	42%	0.416	32%	0.323	S	S	.	.			trans	-82	161.8	163.1	31.6	-35.5	0	0	0	111.8	W299 N484 S485	W299-P482 VanDerWaalsContact CZ2-C 3.42Å; P482-N484 PolarHBondContact O-N 3.07Å; P482-S485 WeakPolarHBondContact CD-OG 3.23Å; P482-S485 PolarHBondContact O-N 2.86Å; P482-S485 PolarHBondContact O-OG 2.95Å
483	L	72.3	Confident	82.3	Confident	101 Å²	101	56.4 Å²	56.4	53%	0.529	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-22.1	-177.1	-180	63.4	0	0	0	114.4	W299	W299-L483 HydrophobicContact CB-CD1 3.73Å; W299-L483 HydrophobicContact CD2-CB 4.08Å; W299-L483 HydrophobicContact CD2-CD1 3.48Å; W299-L483 VanDerWaalsContact CD2-CD1 3.48Å; W299-L483 HydrophobicContact CD2-CG 4.36Å; W299-L483 HydrophobicContact CE3-CD1 3.61Å; W299-L483 HydrophobicContact CG-CB 4.19Å; W299-L483 HydrophobicContact CG-CD1 3.52Å; W299-L483 HydrophobicContact CG-CG 4.31Å; W299-L483 HydrophobicContact CZ2-CB 4.41Å; W299-L483 HydrophobicContact CZ3-CD1 4.39Å
484	N	57.6	Low	82.5	Confident	159 Å²	159	51.4 Å²	51.4	85%	0.85	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	29.4	-175	-63.6	-21.2	0	0	0	113.9	P482	P482-N484 PolarHBondContact O-N 3.07Å
485	S	48.1	Very low	82.4	Confident	85 Å²	85	54.9 Å²	54.9	59%	0.594	33%	0.334	S	S	*	.			trans	-108.2	0	-177	53.4	0	0	0	0	116	R429 C481 P482	R429-S485 PolarHBondContact NH1-O 3.49Å; R429-S485 PolarHBondContact NH1-OXT 2.8Å; R429-S485 PolarHBondContact NH2-OXT 2.75Å; C481-S485 WeakPolarHBondContact CB-OG 3.43Å; P482-S485 WeakPolarHBondContact CD-OG 3.23Å; P482-S485 PolarHBondContact O-N 2.86Å; P482-S485 PolarHBondContact O-OG 2.95Å

Retrieved 485 of 485 residues in 997.8 ms (Link to these results)

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