A0A087XFE3_POEFO Loading...

Glutamate--cysteine ligase regulatory subunit

AlphaFold DB , UniProt , Accession A0A087XFE3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 280 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	42.2	Very low	53.4	Low	220 Å²	220	109.4 Å²	109.4	100%	1.084	57%	0.573	S	S	*	*				0	25.2	0	-100.1	169.4	-169.8	0	0	110.3
2	D	46.6	Very low	54.6	Low	126 Å²	126	100.3 Å²	100.3	67%	0.674	53%	0.525	S	S	*	.			trans	-112.3	-9.9	-155.8	-55.3	-77.8	0	0	0	114.4	T6	D2-T6 PolarHBondContact O-OG1 3.29Å
3	L	40	Very low	56.1	Low	153 Å²	153	96.8 Å²	96.8	80%	0.801	50%	0.503	S	S	*	.	H	α-helix	trans	-77.7	-28	-179.3	-74.5	161.4	0	0	0	113.3	T6	L3-T6 PolarHBondContact O-OG1 2.72Å; L3-T6 VanDerWaalsContact O-OG1 3.13Å
4	Q	44.5	Very low	57.4	Low	169 Å²	169	96 Å²	96	79%	0.79	50%	0.496	S	S	*	.	H	α-helix	trans	-74.9	-40.2	177.8	-111.8	166.2	-11	0	0	111.1	T6 N7 T8	Q4-T6 PolarHBondContact O-N 2.84Å; Q4-N7 PolarHBondContact O-N 3.06Å; Q4-T8 PolarHBondContact O-N 3.15Å; Q4-T8 PolarHBondContact O-OG1 2.91Å
5	N	49.1	Very low	58.6	Low	98 Å²	98	92.3 Å²	92.3	52%	0.524	48%	0.477	S	S	.	.	H	α-helix	trans	-72.5	-29	-176	-151.5	29	0	0	0	113.1
6	T	54.5	Low	59.7	Low	85 Å²	85	86.5 Å²	86.5	52%	0.521	45%	0.447	S	S	.	.	H	α-helix	trans	-72.9	-35.3	174.4	47.6	0	0	0	0	112.3	D2 L3 Q4 V10	D2-T6 PolarHBondContact O-OG1 3.29Å; L3-T6 PolarHBondContact O-OG1 2.72Å; L3-T6 VanDerWaalsContact O-OG1 3.13Å; Q4-T6 PolarHBondContact O-N 2.84Å; T6-V10 WeakPolarHBondContact O-CG2 3.4Å; T6-V10 PolarHBondContact O-N 3.28Å
7	N	54.7	Low	60.8	Low	100 Å²	100	85.5 Å²	85.5	54%	0.535	44%	0.442	S	S	.	.	H	α-helix	trans	-72.1	-42.4	-178.6	-131.4	19.4	0	0	0	112.3	Q4 N9 V10 E11	Q4-N7 PolarHBondContact O-N 3.06Å; N7-N9 PolarHBondContact O-N 2.75Å; N7-V10 PolarHBondContact O-N 2.69Å; N7-V10 VanDerWaalsContact O-N 3.14Å; N7-E11 PolarHBondContact O-N 3.44Å
8	T	56.7	Low	61.7	Low	28 Å²	28	85.2 Å²	85.2	17%	0.172	44%	0.438	C	S	.	.	H	α-helix	trans	-57.9	-38.3	176.5	-31.4	0	0	0	0	112.3	Q4 G12 A62	Q4-T8 PolarHBondContact O-N 3.15Å; Q4-T8 PolarHBondContact O-OG1 2.91Å; T8-G12 PolarHBondContact O-N 2.64Å; T8-G12 VanDerWaalsContact O-N 3.1Å; T8-A62 WeakPolarHBondContact CG2-O 3.36Å
9	N	63.9	Low	62.5	Low	58 Å²	58	80.7 Å²	80.7	31%	0.31	42%	0.415	S	S	.	.	H	α-helix	trans	-74.9	-25.5	-178.4	-156	-19.4	0	0	0	112.4	N7 K13	N7-N9 PolarHBondContact O-N 2.75Å; N9-K13 WeakPolarHBondContact O-CD 3.39Å; N9-K13 WeakPolarHBondContact O-CE 3.45Å; N9-K13 WeakPolarHBondContact O-CG 3.46Å; N9-K13 WeakPolarHBondContact OD1-CE 3.33Å
10	V	66.6	Low	63.6	Low	84 Å²	84	81.7 Å²	81.7	51%	0.509	42%	0.417	S	S	.	.	H	α-helix	trans	-74.6	-43	174	173.4	0	0	0	0	110.5	T6 N7 K13 E14	T6-V10 WeakPolarHBondContact O-CG2 3.4Å; T6-V10 PolarHBondContact O-N 3.28Å; N7-V10 PolarHBondContact O-N 2.69Å; N7-V10 VanDerWaalsContact O-N 3.14Å; V10-K13 WeakPolarHBondContact O-CB 3.33Å; V10-K13 PolarHBondContact O-N 3.39Å; V10-E14 PolarHBondContact O-N 3.42Å; V10-E14 VanDerWaalsContact O-N 3.07Å
11	E	68.6	Low	64.6	Low	82 Å²	82	79 Å²	79	38%	0.383	40%	0.404	S	S	.	.	H	α-helix	trans	-69.4	-40.2	-179.1	-67.8	178	178.7	0	0	112.8	N7 K13 E14 L15	N7-E11 PolarHBondContact O-N 3.44Å; E11-K13 PolarHBondContact O-N 3.47Å; E11-E14 WeakPolarHBondContact O-CB 3.47Å; E11-E14 PolarHBondContact O-N 2.95Å; E11-L15 PolarHBondContact O-N 3.43Å
12	G	68.4	Low	66.8	Low	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-60.6	-31.8	173.3	0	0	0	0	0	113.2	T8 L16 L59	T8-G12 PolarHBondContact O-N 2.64Å; T8-G12 VanDerWaalsContact O-N 3.1Å; G12-L16 WeakPolarHBondContact O-CG 3.26Å; G12-L16 PolarHBondContact O-N 3.25Å; G12-L59 VanDerWaalsContact C-CD2 3.5Å
13	K	73.6	Confident	68.7	Low	55 Å²	55	65 Å²	65	24%	0.239	33%	0.33	C	S	.	.	H	α-helix	trans	-73.8	-39.5	174.1	-70	173.2	-162.5	-173.8	0	112.4	N9 V10 E11 L15 L16 N17 L59 A241	N9-K13 WeakPolarHBondContact O-CD 3.39Å; N9-K13 WeakPolarHBondContact O-CE 3.45Å; N9-K13 WeakPolarHBondContact O-CG 3.46Å; N9-K13 WeakPolarHBondContact OD1-CE 3.33Å; V10-K13 WeakPolarHBondContact O-CB 3.33Å; V10-K13 PolarHBondContact O-N 3.39Å; E11-K13 PolarHBondContact O-N 3.47Å; K13-L15 VanDerWaalsContact C-N 3.28Å; K13-L15 PolarHBondContact O-N 3.26Å; K13-L16 PolarHBondContact O-N 2.9Å; K13-N17 WeakPolarHBondContact O-CB 3.5Å; K13-N17 VanDerWaalsContact O-CG 3.31Å; K13-N17 PolarHBondContact O-N 3.37Å; K13-N17 PolarHBondContact O-ND2 2.97Å; K13-L59 HydrophobicContact CG-CD2 4.39Å; K13-A241 WeakPolarHBondContact CE-O 3.31Å; K13-A241 PolarHBondContact NZ-O 2.98Å
14	E	73.7	Confident	71	Confident	86 Å²	86	58 Å²	58	40%	0.402	29%	0.293	S	S	.	.	H	α-helix	trans	-58.9	-41.5	172.8	-77.8	-71	130	0	0	111.3	V10 E11 N17 H18 F72	V10-E14 PolarHBondContact O-N 3.42Å; V10-E14 VanDerWaalsContact O-N 3.07Å; E11-E14 WeakPolarHBondContact O-CB 3.47Å; E11-E14 PolarHBondContact O-N 2.95Å; E14-N17 PolarHBondContact O-N 3.38Å; E14-H18 PolarHBondContact O-N 2.84Å; E14-H18 PolarHBondContact O-ND1 3.07Å; E14-H18 IonicContact OE2-CE1 2.95Å; E14-F72 HydrophobicContact CB-CE1 4.36Å
15	L	76.1	Confident	73	Confident	40 Å²	40	50.6 Å²	50.6	21%	0.209	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-51.6	173.3	-75.2	167.2	0	0	0	111.4	E11 K13 N17 H18 G19 W58 F72 P73 L76	E11-L15 PolarHBondContact O-N 3.43Å; K13-L15 VanDerWaalsContact C-N 3.28Å; K13-L15 PolarHBondContact O-N 3.26Å; L15-N17 VanDerWaalsContact C-N 3.28Å; L15-N17 PolarHBondContact O-N 3.41Å; L15-H18 PolarHBondContact O-N 3.42Å; L15-H18 VanDerWaalsContact O-N 3.08Å; L15-G19 PolarHBondContact O-N 3.22Å; L15-W58 HydrophobicContact CB-CH2 4.21Å; L15-W58 HydrophobicContact CD1-CH2 4.12Å; L15-W58 HydrophobicContact CD1-CZ2 4.37Å; L15-F72 HydrophobicContact CD2-CD1 4.06Å; L15-P73 HydrophobicContact CD2-CG 4.13Å; L15-L76 HydrophobicContact CB-CD2 3.94Å; L15-L76 HydrophobicContact CD2-CD2 4.25Å; L15-L76 WeakPolarHBondContact O-CD1 3.45Å
16	L	76.3	Confident	74.6	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-33.4	178.1	-69.2	165.8	0	0	0	113.2	G12 K13 H18 L22 W58 L59 L76 A240 L243	G12-L16 WeakPolarHBondContact O-CG 3.26Å; G12-L16 PolarHBondContact O-N 3.25Å; K13-L16 PolarHBondContact O-N 2.9Å; L16-H18 VanDerWaalsContact C-N 3.26Å; L16-H18 PolarHBondContact O-N 2.92Å; L16-L22 HydrophobicContact CD2-CD1 3.9Å; L16-W58 HydrophobicContact CD1-CZ3 4.1Å; L16-W58 HydrophobicContact CD2-CZ3 4.45Å; L16-W58 HydrophobicContact CG-CZ3 4.04Å; L16-L59 HydrophobicContact CD1-CD2 4.12Å; L16-L76 HydrophobicContact CB-CD1 4.43Å; L16-L76 HydrophobicContact CD2-CD1 3.79Å; L16-L76 HydrophobicContact CG-CD1 4.27Å; L16-A240 HydrophobicContact CD1-CB 4.15Å; L16-L243 HydrophobicContact CB-CD1 3.38Å; L16-L243 HydrophobicContact CD1-CD1 4.17Å; L16-L243 HydrophobicContact CG-CD1 4.37Å
17	N	77.4	Confident	75.6	Confident	69 Å²	69	42 Å²	42	37%	0.369	21%	0.209	S	C	.	.	H	α-helix	trans	-70.8	-18.5	176.2	-76.4	-20.2	0	0	0	113.4	K13 E14 L15 R277	K13-N17 WeakPolarHBondContact O-CB 3.5Å; K13-N17 VanDerWaalsContact O-CG 3.31Å; K13-N17 PolarHBondContact O-N 3.37Å; K13-N17 PolarHBondContact O-ND2 2.97Å; E14-N17 PolarHBondContact O-N 3.38Å; L15-N17 VanDerWaalsContact C-N 3.28Å; L15-N17 PolarHBondContact O-N 3.41Å; N17-R277 PolarHBondContact O-NH1 2.98Å
18	H	77.3	Confident	76.8	Confident	80 Å²	80	38.6 Å²	38.6	37%	0.37	19%	0.191	S	C	.	.	H	α-helix	trans	-105.3	-28	177.7	-68.2	87.1	0	0	0	113.2	E14 L15 L16 F72	E14-H18 PolarHBondContact O-N 2.84Å; E14-H18 PolarHBondContact O-ND1 3.07Å; E14-H18 IonicContact OE2-CE1 2.95Å; L15-H18 PolarHBondContact O-N 3.42Å; L15-H18 VanDerWaalsContact O-N 3.08Å; L16-H18 VanDerWaalsContact C-N 3.26Å; L16-H18 PolarHBondContact O-N 2.92Å; H18-F72 HydrophobicContact CB-CB 3.57Å; H18-F72 HydrophobicContact CB-CD1 4.21Å; H18-F72 HydrophobicContact CB-CD2 3.97Å; H18-F72 HydrophobicContact CB-CG 3.67Å; H18-F72 AromaticContact CD2-CD2 3.55Å; H18-F72 AromaticContact CD2-CE2 3.82Å; H18-F72 AromaticContact CE1-CE2 3.57Å; H18-F72 AromaticContact CE1-CZ 3.78Å; H18-F72 AromaticContact CG-CD2 3.51Å; H18-F72 AromaticContact CG-CE2 3.87Å; H18-F72 AromaticContact CG-CG 3.68Å; H18-F72 AromaticContact ND1-CD2 3.82Å; H18-F72 AromaticContact ND1-CE1 4Å; H18-F72 AromaticContact ND1-CE2 3.72Å; H18-F72 AromaticContact ND1-CZ 3.81Å; H18-F72 AromaticContact NE2-CD2 3.89Å; H18-F72 AromaticContact NE2-CE2 3.64Å
19	G	77.3	Confident	77.7	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.			trans	-61.1	139.5	179.7	0	0	0	0	0	113.5	L15 W248 R277	L15-G19 PolarHBondContact O-N 3.22Å; G19-W248 WeakPolarHBondContact O-CH2 3.36Å; G19-R277 VanDerWaalsContact O-CZ 3.23Å; G19-R277 PolarHBondContact O-NH1 2.92Å
20	K	83.9	Confident	78.1	Confident	101 Å²	101	38.5 Å²	38.5	44%	0.439	19%	0.192	S	C	.	.	S	Bend	trans	-95.8	-30.8	175	-62.6	176.5	-172.3	148	0	111.8	D74 R276 R277	K20-D74 WeakPolarHBondContact CA-O 3.37Å; K20-D74 HydrophobicContact CD-CB 4.38Å; K20-D74 WeakPolarHBondContact CD-OD1 3.4Å; K20-D74 WeakPolarHBondContact CE-OD1 3.35Å; K20-D74 PolarHBondContact N-O 3.37Å; K20-D74 IonicContact NZ-OD1 3.98Å; K20-D74 PolarHBondContact NZ-OD1 3.33Å; K20-D74 IonicContact NZ-OD2 2.74Å; K20-D74 PolarHBondContact NZ-OD2 3.02Å; K20-R276 CarbonylContact O-C 3.54Å; K20-R276 WeakPolarHBondContact O-CA 3.37Å; K20-R277 PolarHBondContact O-N 3.09Å
21	T	85.9	Confident	78	Confident	24 Å²	24	39.9 Å²	39.9	15%	0.147	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136.1	-179.9	-56	0	0	0	0	109.3	D74 T75 L76 A275	T21-D74 PolarHBondContact N-O 2.88Å; T21-T75 HydrophobicContact CG2-CG2 4.13Å; T21-T75 CarbonylContact O-C 3.51Å; T21-T75 WeakPolarHBondContact O-CA 3.38Å; T21-L76 PolarHBondContact O-N 3.08Å; T21-A275 CarbonylContact C-O 3.47Å; T21-A275 WeakPolarHBondContact CA-O 3.31Å
22	L	87	Confident	77.5	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.1	176.7	175.2	67.1	0	0	0	108.3	L16 L24 L55 L76 C78 M236 W248 S274 A275	L16-L22 HydrophobicContact CD2-CD1 3.9Å; L22-L24 HydrophobicContact CD1-CD2 4.44Å; L22-L24 HydrophobicContact CD1-CG 4.48Å; L22-L24 HydrophobicContact CD2-CD1 4.13Å; L22-L24 HydrophobicContact CD2-CG 4.33Å; L22-L24 HydrophobicContact CG-CD1 4.45Å; L22-L24 HydrophobicContact CG-CG 4.16Å; L22-L55 HydrophobicContact CD2-CD2 4.46Å; L22-L76 HydrophobicContact CD1-CB 4.19Å; L22-C78 HydrophobicContact CD1-CB 4.19Å; L22-C78 WeakPolarHBondContact CD1-SG 3.29Å; L22-M236 HydrophobicContact CD2-CE 3.34Å; L22-M236 HydrophobicContact CD2-SD 3.57Å; L22-M236 VanDerWaalsContact CD2-SD 3.57Å; L22-W248 HydrophobicContact CB-CE3 3.95Å; L22-W248 HydrophobicContact CB-CH2 3.7Å; L22-W248 HydrophobicContact CB-CZ3 3.34Å; L22-S274 CarbonylContact O-C 3.55Å; L22-S274 WeakPolarHBondContact O-CA 3.33Å; L22-A275 HydrophobicContact CB-CB 4.39Å; L22-A275 PolarHBondContact N-O 3.31Å; L22-A275 PolarHBondContact O-N 3.19Å
23	R	88.4	Confident	77	Confident	53 Å²	53	49.7 Å²	49.7	20%	0.2	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124.5	173.8	-71.4	177.6	173	-177.1	-1.9	108.8	T75 L76 D77 C78 D114 V273	R23-T75 HydrophobicContact CG-CG2 4.41Å; R23-L76 PolarHBondContact N-O 3.43Å; R23-D77 WeakPolarHBondContact CB-OD1 3.4Å; R23-D77 WeakPolarHBondContact CD-OD1 3.37Å; R23-C78 WeakPolarHBondContact O-CA 3.22Å; R23-C78 WeakPolarHBondContact O-CB 3.34Å; R23-C78 PolarHBondContact O-N 2.86Å; R23-D114 IonicContact CZ-OD1 2.67Å; R23-D114 IonicContact CZ-OD2 2.89Å; R23-D114 IonicContact NE-OD2 3.24Å; R23-D114 IonicContact NH2-OD1 2.85Å; R23-D114 PolarHBondContact NH2-OD1 3.2Å; R23-D114 IonicContact NH2-OD2 2.84Å; R23-D114 PolarHBondContact NH2-OD2 3.26Å; R23-V273 CarbonylContact C-O 3.6Å; R23-V273 VanDerWaalsContact CA-O 3.32Å; R23-V273 WeakPolarHBondContact CA-O 3.43Å
24	L	87.4	Confident	76.2	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.026	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.6	177.6	-62.3	156.7	0	0	0	109.6	L22 I51 T54 L55 C78 L272 V273	L22-L24 HydrophobicContact CD1-CD2 4.44Å; L22-L24 HydrophobicContact CD1-CG 4.48Å; L22-L24 HydrophobicContact CD2-CD1 4.13Å; L22-L24 HydrophobicContact CD2-CG 4.33Å; L22-L24 HydrophobicContact CG-CD1 4.45Å; L22-L24 HydrophobicContact CG-CG 4.16Å; L24-I51 HydrophobicContact CD1-CG1 4.21Å; L24-I51 HydrophobicContact CD1-CG2 3.93Å; L24-T54 HydrophobicContact CD2-CG2 4.09Å; L24-L55 HydrophobicContact CD2-CD2 3.6Å; L24-L55 HydrophobicContact CD2-CG 3.83Å; L24-C78 WeakPolarHBondContact CA-O 3.24Å; L24-C78 HydrophobicContact CD2-CB 3.38Å; L24-C78 HydrophobicContact CG-CB 4.36Å; L24-L272 WeakPolarHBondContact O-CA 3.09Å; L24-V273 HydrophobicContact CB-CB 4.13Å; L24-V273 PolarHBondContact N-O 3.37Å; L24-V273 PolarHBondContact O-N 3.29Å
25	H	87.4	Confident	75.5	Confident	15 Å²	15	49 Å²	49	7%	0.069	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	113	166.9	175.3	-151.3	0	0	0	108.9	G27 T54 C78 A83 D85 T122 Y256 L272	H25-G27 PolarHBondContact CD2-N 2.9Å; H25-G27 PolarHBondContact O-N 2.98Å; H25-T54 WeakPolarHBondContact O-CG2 3.34Å; H25-C78 PolarHBondContact N-O 2.98Å; H25-C78 VanDerWaalsContact N-O 3.11Å; H25-A83 PolarHBondContact CE1-O 2.92Å; H25-D85 IonicContact NE2-OD2 2.87Å; H25-T122 WeakPolarHBondContact CE1-CG2 3.37Å; H25-Y256 AromaticContact NE2-CZ 3.87Å; H25-Y256 PolarHBondContact NE2-OH 3.45Å; H25-L272 HydrophobicContact CB-CD2 3.89Å; H25-L272 VanDerWaalsContact CD2-CD2 3.42Å; H25-L272 WeakPolarHBondContact CD2-CD2 3.41Å
26	T	80.8	Confident	74.5	Confident	2 Å²	2	57 Å²	57	1%	0.012	27%	0.271	C	S	.	.			trans	-72.5	-10.2	-173.6	64.8	0	0	0	0	114	R34 C50 T54 Y271	T26-R34 PolarHBondContact O-NH1 3.45Å; T26-C50 HydrophobicContact CG2-CB 3.54Å; T26-T54 WeakPolarHBondContact CA-OG1 3.5Å; T26-Y271 HydrophobicContact CG2-CD2 4.5Å; T26-Y271 PolarHBondContact N-O 3.06Å; T26-Y271 VanDerWaalsContact N-O 3.08Å; T26-Y271 PolarHBondContact OG1-N 3Å; T26-Y271 PolarHBondContact OG1-O 2.82Å
27	G	77.3	Confident	73.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.295	C	S	.	.			trans	70	-171.6	-170.4	0	0	0	0	0	113.5	H25 L29	H25-G27 PolarHBondContact CD2-N 2.9Å; H25-G27 PolarHBondContact O-N 2.98Å; G27-L29 PolarHBondContact O-N 3.17Å
28	N	78.2	Confident	72.6	Confident	29 Å²	29	68.8 Å²	68.8	16%	0.155	32%	0.319	C	S	.	.			trans	-78.5	107.4	-175.7	-170.2	-10.1	0	0	0	112.8	V30 N31 D85 K267 S268 K269	N28-V30 PolarHBondContact O-N 2.83Å; N28-V30 WeakPolarHBondContact OD1-CB 3.33Å; N28-V30 WeakPolarHBondContact OD1-CG2 3.47Å; N28-V30 PolarHBondContact OD1-N 3.08Å; N28-N31 PolarHBondContact O-N 3.33Å; N28-N31 VanDerWaalsContact O-N 3.1Å; N28-D85 WeakPolarHBondContact CB-OD1 3.34Å; N28-K267 PolarHBondContact ND2-O 3.06Å; N28-K267 VanDerWaalsContact ND2-O 3.16Å; N28-S268 VanDerWaalsContact CG-OG 3.23Å; N28-S268 WeakPolarHBondContact ND2-CB 3.47Å; N28-S268 PolarHBondContact ND2-OG 3.24Å; N28-S268 WeakPolarHBondContact OD1-CA 3.45Å; N28-S268 PolarHBondContact OD1-OG 2.93Å; N28-K269 CarbonylContact C-O 3.59Å; N28-K269 PolarHBondContact OD1-N 3.47Å
29	L	76.6	Confident	71.7	Confident	14 Å²	14	69.5 Å²	69.5	7%	0.073	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-10.7	178.2	-56.1	178.5	0	0	0	114.3	G27 N31 R32 L35 E46 C50 K269 Y271	G27-L29 PolarHBondContact O-N 3.17Å; L29-N31 VanDerWaalsContact C-N 3.32Å; L29-R32 WeakPolarHBondContact O-CG 3.2Å; L29-L35 HydrophobicContact CD2-CD1 4.43Å; L29-E46 HydrophobicContact CD1-CG 4.28Å; L29-C50 WeakPolarHBondContact CD2-SG 3.42Å; L29-K269 VanDerWaalsContact CB-O 3.32Å; L29-K269 WeakPolarHBondContact CB-O 3.19Å; L29-K269 HydrophobicContact CD1-CG 4.4Å; L29-K269 VanDerWaalsContact CG-O 3.31Å; L29-K269 WeakPolarHBondContact CG-O 3.48Å; L29-K269 PolarHBondContact N-O 2.92Å; L29-Y271 HydrophobicContact CD1-CD2 3.68Å; L29-Y271 HydrophobicContact CD1-CE2 3.43Å; L29-Y271 VanDerWaalsContact CD1-CE2 3.43Å
30	V	71.7	Confident	71.1	Confident	69 Å²	69	71.4 Å²	71.4	42%	0.418	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-35.3	169.9	-176.8	0	0	0	0	109.7	N28 R32 I266 K269	N28-V30 PolarHBondContact O-N 2.83Å; N28-V30 WeakPolarHBondContact OD1-CB 3.33Å; N28-V30 WeakPolarHBondContact OD1-CG2 3.47Å; N28-V30 PolarHBondContact OD1-N 3.08Å; V30-R32 VanDerWaalsContact C-N 3.31Å; V30-R32 PolarHBondContact O-N 2.94Å; V30-I266 HydrophobicContact CG2-CG2 3.98Å; V30-K269 HydrophobicContact CG2-CB 4.38Å
31	N	66.1	Low	70.3	Confident	114 Å²	114	70 Å²	70	61%	0.61	36%	0.358	S	S	*	.	S	Bend	trans	-86.7	68.8	176.5	-71.4	-25.3	0	0	0	110.7	N28 L29 N33	N28-N31 PolarHBondContact O-N 3.33Å; N28-N31 VanDerWaalsContact O-N 3.1Å; L29-N31 VanDerWaalsContact C-N 3.32Å; N31-N33 PolarHBondContact O-N 3.42Å
32	R	56.3	Low	70.1	Confident	125 Å²	125	70.9 Å²	70.9	47%	0.472	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-66.2	3.7	-171	-70.1	-171.7	173.1	-172.4	-4.4	117.2	L29 V30 R34 L35 C39	L29-R32 WeakPolarHBondContact O-CG 3.2Å; V30-R32 VanDerWaalsContact C-N 3.31Å; V30-R32 PolarHBondContact O-N 2.94Å; R32-R34 PolarHBondContact O-N 2.97Å; R32-L35 PolarHBondContact O-N 2.82Å; R32-L35 VanDerWaalsContact O-N 3.09Å; R32-C39 PolarHBondContact NH1-SG 3.09Å; R32-C39 VanDerWaalsContact NH1-SG 3.41Å
33	N	57.7	Low	70	Confident	163 Å²	163	72 Å²	72	87%	0.872	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-58.8	-17.2	-176.4	-68.1	-15	0	0	0	113.5	N31	N31-N33 PolarHBondContact O-N 3.42Å
34	R	57.4	Low	69.8	Low	79 Å²	79	70.6 Å²	70.6	30%	0.298	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-87.4	-28.1	179.5	-67.9	-178.9	53.9	-120.1	-17.4	114.7	T26 R32 K36 D57	T26-R34 PolarHBondContact O-NH1 3.45Å; R32-R34 PolarHBondContact O-N 2.97Å; R34-K36 PolarHBondContact O-N 2.96Å; R34-K36 VanDerWaalsContact O-N 3.15Å; R34-D57 IonicContact CZ-OD2 3.18Å; R34-D57 IonicContact NE-OD2 2.9Å; R34-D57 PolarHBondContact NE-OD2 3.3Å; R34-D57 IonicContact NH2-OD2 2.67Å; R34-D57 PolarHBondContact NH2-OD2 2.92Å
35	L	60.3	Low	69.7	Low	46 Å²	46	74 Å²	74	24%	0.241	39%	0.387	C	S	.	.			trans	-86	91.8	-178.4	-63.8	174.3	0	0	0	108.9	L29 R32 K37 D49 A53	L29-L35 HydrophobicContact CD2-CD1 4.43Å; R32-L35 PolarHBondContact O-N 2.82Å; R32-L35 VanDerWaalsContact O-N 3.09Å; L35-K37 PolarHBondContact O-N 3.47Å; L35-D49 HydrophobicContact CD2-CB 4.49Å; L35-A53 HydrophobicContact CD2-CB 4.34Å
36	K	53.3	Low	69.7	Low	210 Å²	210	74 Å²	74	91%	0.913	39%	0.387	S	S	*	.			trans	-66.6	0.7	-178.7	-62.7	-179	-177.7	173.7	0	114.6	R34	R34-K36 PolarHBondContact O-N 2.96Å; R34-K36 VanDerWaalsContact O-N 3.15Å
37	K	57.3	Low	70.1	Confident	119 Å²	119	74 Å²	74	52%	0.517	39%	0.386	S	S	.	.	S	Bend	trans	-103.9	162.3	-175.3	-83.7	179.3	179.2	167.3	0	112.5	L35 D49	L35-K37 PolarHBondContact O-N 3.47Å; K37-D49 IonicContact NZ-OD1 3.9Å
38	K	56.4	Low	70.6	Confident	197 Å²	197	77.1 Å²	77.1	86%	0.857	40%	0.398	S	S	*	.	S	Bend	trans	-49.9	151.7	172	-136	174.3	-176.6	-179.7	0	110.3
39	C	59.3	Low	71	Confident	95 Å²	95	76.6 Å²	76.6	64%	0.642	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-47.1	127	173.9	-73.8	0	0	0	0	110.3	R32	R32-C39 PolarHBondContact NH1-SG 3.09Å; R32-C39 VanDerWaalsContact NH1-SG 3.41Å
40	P	63.8	Low	71.5	Confident	39 Å²	39	76 Å²	76	25%	0.253	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-61.1	140.3	-177.9	22	-30.4	0	0	0	110.3	S42 E45 E46	P40-S42 VanDerWaalsContact C-N 3.34Å; P40-E45 HydrophobicContact CB-CB 4.11Å; P40-E46 HydrophobicContact CB-CB 3.89Å; P40-E46 HydrophobicContact CG-CB 3.66Å; P40-E46 HydrophobicContact CG-CG 3.92Å
41	G	68.5	Low	72.2	Confident	71 Å²	71	72.8 Å²	72.8	73%	0.732	37%	0.373	S	S	*	.	S	Bend	trans	-79.6	-15.7	-179.3	0	0	0	0	0	113.5	E45	G41-E45 VanDerWaalsContact CA-OE2 3.29Å; G41-E45 WeakPolarHBondContact CA-OE2 3.44Å; G41-E45 PolarHBondContact N-OE2 3.3Å
42	S	81.9	Confident	73.3	Confident	43 Å²	43	69.4 Å²	69.4	30%	0.301	35%	0.353	S	S	.	.	S	Bend	trans	-151.4	162.5	177.4	69.3	0	0	0	0	112.8	P40 S44 E45 E46	P40-S42 VanDerWaalsContact C-N 3.34Å; S42-S44 PolarHBondContact O-N 2.99Å; S42-E45 PolarHBondContact O-N 3.19Å; S42-E45 WeakPolarHBondContact OG-CG 3.12Å; S42-E45 PolarHBondContact OG-N 2.76Å; S42-E46 PolarHBondContact O-N 3.49Å
43	P	83.6	Confident	74.6	Confident	23 Å²	23	64.4 Å²	64.4	15%	0.149	34%	0.338	C	S	.	.	H	α-helix	trans	-57	-33	171.5	-26.9	36.4	0	0	0	114.1	E46 L47 L226	P43-E46 PolarHBondContact O-N 3.48Å; P43-L47 WeakPolarHBondContact O-CB 3.38Å; P43-L47 PolarHBondContact O-N 3.25Å; P43-L226 HydrophobicContact CB-CD1 4.01Å
44	S	85.6	Confident	75.9	Confident	24 Å²	24	56.7 Å²	56.7	17%	0.168	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-43.3	176.6	-57.8	0	0	0	0	112.5	S42 L47 R48 P223 L226	S42-S44 PolarHBondContact O-N 2.99Å; S44-L47 PolarHBondContact O-N 2.89Å; S44-R48 WeakPolarHBondContact O-CB 3.26Å; S44-R48 PolarHBondContact O-N 2.91Å; S44-P223 WeakPolarHBondContact OG-CG 3.09Å; S44-L226 WeakPolarHBondContact CA-O 3.44Å; S44-L226 WeakPolarHBondContact CB-O 3.39Å; S44-L226 PolarHBondContact OG-O 3.02Å
45	E	85.3	Confident	77.3	Confident	78 Å²	78	52.9 Å²	52.9	36%	0.364	28%	0.283	S	S	.	.	H	α-helix	trans	-66.1	-41.3	175	-72.5	-179.3	167.5	0	0	111.4	P40 G41 S42 L47 R48 D49	P40-E45 HydrophobicContact CB-CB 4.11Å; G41-E45 VanDerWaalsContact CA-OE2 3.29Å; G41-E45 WeakPolarHBondContact CA-OE2 3.44Å; G41-E45 PolarHBondContact N-OE2 3.3Å; S42-E45 PolarHBondContact O-N 3.19Å; S42-E45 WeakPolarHBondContact OG-CG 3.12Å; S42-E45 PolarHBondContact OG-N 2.76Å; E45-L47 VanDerWaalsContact C-N 3.34Å; E45-L47 PolarHBondContact O-N 3.28Å; E45-R48 PolarHBondContact O-N 3.42Å; E45-D49 WeakPolarHBondContact O-CB 3.35Å; E45-D49 PolarHBondContact O-N 3.29Å
46	E	86.9	Confident	78.4	Confident	15 Å²	15	53.7 Å²	53.7	7%	0.07	29%	0.292	C	S	.	.	H	α-helix	trans	-56.9	-49.3	174.2	-171.5	-179.3	74	0	0	110.2	L29 P40 S42 P43 D49 C50 K269 Y271	L29-E46 HydrophobicContact CD1-CG 4.28Å; P40-E46 HydrophobicContact CB-CB 3.89Å; P40-E46 HydrophobicContact CG-CB 3.66Å; P40-E46 HydrophobicContact CG-CG 3.92Å; S42-E46 PolarHBondContact O-N 3.49Å; P43-E46 PolarHBondContact O-N 3.48Å; E46-D49 PolarHBondContact O-N 3.48Å; E46-C50 WeakPolarHBondContact O-CB 3.33Å; E46-C50 PolarHBondContact O-N 3.25Å; E46-C50 PolarHBondContact O-SG 3.5Å; E46-K269 VanDerWaalsContact CD-NZ 3.34Å; E46-K269 IonicContact OE1-NZ 3Å; E46-K269 PolarHBondContact OE1-NZ 2.99Å; E46-K269 IonicContact OE2-NZ 2.68Å; E46-K269 PolarHBondContact OE2-NZ 3.23Å; E46-K269 VanDerWaalsContact OE2-NZ 3.11Å; E46-Y271 HydrophobicContact CG-CE2 4.1Å; E46-Y271 VanDerWaalsContact OE1-CE2 3.3Å; E46-Y271 WeakPolarHBondContact OE1-CE2 3.4Å; E46-Y271 PolarHBondContact OE1-OH 3.41Å
47	L	87.9	Confident	79.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-46.5	178.8	179.3	61.8	0	0	0	112.2	P43 S44 E45 C50 I51 L226 M227 V253 Y271 V273	P43-L47 WeakPolarHBondContact O-CB 3.38Å; P43-L47 PolarHBondContact O-N 3.25Å; S44-L47 PolarHBondContact O-N 2.89Å; E45-L47 VanDerWaalsContact C-N 3.34Å; E45-L47 PolarHBondContact O-N 3.28Å; L47-C50 PolarHBondContact O-N 3.37Å; L47-I51 HydrophobicContact CD1-CD1 3.98Å; L47-I51 HydrophobicContact CD1-CG1 4.21Å; L47-I51 HydrophobicContact CG-CD1 3.93Å; L47-I51 WeakPolarHBondContact O-CG1 3.25Å; L47-I51 PolarHBondContact O-N 2.96Å; L47-L226 HydrophobicContact CD2-CD2 3.78Å; L47-L226 HydrophobicContact CD2-CG 3.93Å; L47-M227 HydrophobicContact CB-CE 3.95Å; L47-M227 HydrophobicContact CD2-CB 4.12Å; L47-M227 HydrophobicContact CD2-CE 3.68Å; L47-M227 HydrophobicContact CD2-SD 4.04Å; L47-M227 HydrophobicContact CG-CE 3.54Å; L47-M227 HydrophobicContact CG-SD 4.33Å; L47-V253 HydrophobicContact CD1-CG1 4.15Å; L47-V253 HydrophobicContact CD2-CG1 4Å; L47-V253 HydrophobicContact CD2-CG2 4.05Å; L47-Y271 HydrophobicContact CD1-CD1 3.84Å; L47-Y271 HydrophobicContact CD1-CD2 4.08Å; L47-Y271 HydrophobicContact CD1-CE1 4.43Å; L47-Y271 HydrophobicContact CD1-CG 3.66Å; L47-V273 HydrophobicContact CD1-CG2 3.87Å
48	R	88.4	Confident	81	Confident	66 Å²	66	41.9 Å²	41.9	25%	0.249	24%	0.243	C	C	.	.	H	α-helix	trans	-57.9	-51.5	178.8	-176.1	-165.4	62.2	-158.1	-9.6	111.4	S44 E45 C50 I51 Q52 M227 A235	S44-R48 WeakPolarHBondContact O-CB 3.26Å; S44-R48 PolarHBondContact O-N 2.91Å; E45-R48 PolarHBondContact O-N 3.42Å; R48-C50 PolarHBondContact O-N 3.33Å; R48-I51 PolarHBondContact O-N 2.92Å; R48-Q52 WeakPolarHBondContact O-CB 3.23Å; R48-Q52 PolarHBondContact O-N 3.17Å; R48-M227 HydrophobicContact CB-CE 3.88Å; R48-A235 HydrophobicContact CG-CB 3.74Å
49	D	86.3	Confident	82.2	Confident	18 Å²	18	32.7 Å²	32.7	10%	0.096	20%	0.203	C	C	.	.	H	α-helix	trans	-64	-33.7	-178.2	-71.8	5.6	0	0	0	110.9	L35 K37 E45 E46 A53	L35-D49 HydrophobicContact CD2-CB 4.49Å; K37-D49 IonicContact NZ-OD1 3.9Å; E45-D49 WeakPolarHBondContact O-CB 3.35Å; E45-D49 PolarHBondContact O-N 3.29Å; E46-D49 PolarHBondContact O-N 3.48Å; D49-A53 VanDerWaalsContact O-CB 3.3Å; D49-A53 WeakPolarHBondContact O-CB 3.47Å; D49-A53 PolarHBondContact O-N 2.9Å
50	C	86.6	Confident	83.1	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.02	19%	0.19	C	C	.	.	H	α-helix	trans	-70.1	-42	175.5	-68.3	0	0	0	0	113.3	T26 L29 E46 L47 R48 T54	T26-C50 HydrophobicContact CG2-CB 3.54Å; L29-C50 WeakPolarHBondContact CD2-SG 3.42Å; E46-C50 WeakPolarHBondContact O-CB 3.33Å; E46-C50 PolarHBondContact O-N 3.25Å; E46-C50 PolarHBondContact O-SG 3.5Å; L47-C50 PolarHBondContact O-N 3.37Å; R48-C50 PolarHBondContact O-N 3.33Å; C50-T54 VanDerWaalsContact O-CB 3.26Å; C50-T54 WeakPolarHBondContact O-CB 3.45Å; C50-T54 PolarHBondContact O-N 3.11Å; C50-T54 PolarHBondContact O-OG1 2.84Å
51	I	87.9	Confident	83.5	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60.7	-49.9	175.1	-71.7	169.6	0	0	0	109.6	L24 L47 R48 A53 T54 L55 M227 F232 A235 M236 V273	L24-I51 HydrophobicContact CD1-CG1 4.21Å; L24-I51 HydrophobicContact CD1-CG2 3.93Å; L47-I51 HydrophobicContact CD1-CD1 3.98Å; L47-I51 HydrophobicContact CD1-CG1 4.21Å; L47-I51 HydrophobicContact CG-CD1 3.93Å; L47-I51 WeakPolarHBondContact O-CG1 3.25Å; L47-I51 PolarHBondContact O-N 2.96Å; R48-I51 PolarHBondContact O-N 2.92Å; I51-A53 PolarHBondContact O-N 3.16Å; I51-T54 PolarHBondContact O-N 3.26Å; I51-L55 HydrophobicContact CG2-CD1 3.72Å; I51-L55 WeakPolarHBondContact O-CG 3.39Å; I51-L55 PolarHBondContact O-N 3.1Å; I51-M227 HydrophobicContact CD1-CE 3.99Å; I51-M227 HydrophobicContact CD1-SD 3.81Å; I51-F232 HydrophobicContact CD1-CD2 3.98Å; I51-F232 HydrophobicContact CD1-CE2 4.11Å; I51-A235 HydrophobicContact CB-CB 4.33Å; I51-A235 HydrophobicContact CG2-CB 3.95Å; I51-M236 HydrophobicContact CG2-SD 4.46Å; I51-V273 HydrophobicContact CD1-CG2 4.42Å; I51-V273 HydrophobicContact CG1-CG2 4.46Å
52	Q	87.6	Confident	83.4	Confident	44 Å²	44	29.3 Å²	29.3	21%	0.206	17%	0.168	C	C	.	.	H	α-helix	trans	-56.3	-50.8	178.5	179.6	-178.7	25.8	0	0	111.7	R48 T54 S56 E238	R48-Q52 WeakPolarHBondContact O-CB 3.23Å; R48-Q52 PolarHBondContact O-N 3.17Å; Q52-T54 VanDerWaalsContact C-N 3.34Å; Q52-T54 PolarHBondContact O-N 3.17Å; Q52-S56 WeakPolarHBondContact O-CB 3.42Å; Q52-S56 PolarHBondContact O-N 2.78Å; Q52-E238 HydrophobicContact CG-CB 4.25Å; Q52-E238 PolarHBondContact NE2-OE2 3.22Å
53	A	84.3	Confident	82.1	Confident	19 Å²	19	35.6 Å²	35.6	16%	0.157	19%	0.19	C	C	.	.	H	α-helix	trans	-63.9	-39.6	-179.9	0	0	0	0	0	112	L35 D49 I51 D57	L35-A53 HydrophobicContact CD2-CB 4.34Å; D49-A53 VanDerWaalsContact O-CB 3.3Å; D49-A53 WeakPolarHBondContact O-CB 3.47Å; D49-A53 PolarHBondContact O-N 2.9Å; I51-A53 PolarHBondContact O-N 3.16Å; A53-D57 VanDerWaalsContact O-CB 3.31Å; A53-D57 WeakPolarHBondContact O-CB 3.49Å; A53-D57 PolarHBondContact O-N 3.26Å
54	T	86.3	Confident	80.4	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-67.7	-43.9	-178.6	-56.2	0	0	0	0	111.9	L24 H25 T26 C50 I51 Q52 W58 I80	L24-T54 HydrophobicContact CD2-CG2 4.09Å; H25-T54 WeakPolarHBondContact O-CG2 3.34Å; T26-T54 WeakPolarHBondContact CA-OG1 3.5Å; C50-T54 VanDerWaalsContact O-CB 3.26Å; C50-T54 WeakPolarHBondContact O-CB 3.45Å; C50-T54 PolarHBondContact O-N 3.11Å; C50-T54 PolarHBondContact O-OG1 2.84Å; I51-T54 PolarHBondContact O-N 3.26Å; Q52-T54 VanDerWaalsContact C-N 3.34Å; Q52-T54 PolarHBondContact O-N 3.17Å; T54-W58 WeakPolarHBondContact O-CB 3.49Å; T54-W58 PolarHBondContact O-N 2.97Å; T54-I80 HydrophobicContact CG2-CD1 4.13Å; T54-I80 HydrophobicContact CG2-CG1 4.3Å
55	L	85.3	Confident	78.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-45	176.7	-73.2	165.3	0	0	0	112	L22 L24 I51 W58 L59 M236	L22-L55 HydrophobicContact CD2-CD2 4.46Å; L24-L55 HydrophobicContact CD2-CD2 3.6Å; L24-L55 HydrophobicContact CD2-CG 3.83Å; I51-L55 HydrophobicContact CG2-CD1 3.72Å; I51-L55 WeakPolarHBondContact O-CG 3.39Å; I51-L55 PolarHBondContact O-N 3.1Å; L55-W58 PolarHBondContact O-N 3.44Å; L55-L59 WeakPolarHBondContact O-CB 3.13Å; L55-L59 VanDerWaalsContact O-CG 3.31Å; L55-L59 WeakPolarHBondContact O-CG 3.5Å; L55-L59 PolarHBondContact O-N 2.86Å; L55-M236 HydrophobicContact CD1-CE 4.16Å; L55-M236 HydrophobicContact CD1-CG 4.48Å; L55-M236 HydrophobicContact CD1-SD 3.39Å; L55-M236 WeakPolarHBondContact CD1-SD 3.26Å; L55-M236 HydrophobicContact CD2-CE 4.45Å; L55-M236 HydrophobicContact CD2-SD 4.4Å; L55-M236 HydrophobicContact CG-SD 4.48Å
56	S	83.9	Confident	76.3	Confident	62 Å²	62	44.4 Å²	44.4	43%	0.434	25%	0.253	S	S	.	.	H	α-helix	trans	-61.6	-46.6	179	-175.3	0	0	0	0	111.5	Q52 L59 S60 G239	Q52-S56 WeakPolarHBondContact O-CB 3.42Å; Q52-S56 PolarHBondContact O-N 2.78Å; S56-L59 PolarHBondContact O-N 3.37Å; S56-S60 PolarHBondContact O-N 3.01Å; S56-S60 VanDerWaalsContact O-N 3.08Å; S56-G239 PolarHBondContact N-O 2.74Å
57	D	82.7	Confident	74.1	Confident	53 Å²	53	50.2 Å²	50.2	28%	0.283	29%	0.29	S	S	.	.	H	α-helix	trans	-65.2	-43.3	177.7	-71.7	-6.2	0	0	0	111	R34 A53 S60 T61 I80	R34-D57 IonicContact CZ-OD2 3.18Å; R34-D57 IonicContact NE-OD2 2.9Å; R34-D57 PolarHBondContact NE-OD2 3.3Å; R34-D57 IonicContact NH2-OD2 2.67Å; R34-D57 PolarHBondContact NH2-OD2 2.92Å; A53-D57 VanDerWaalsContact O-CB 3.31Å; A53-D57 WeakPolarHBondContact O-CB 3.49Å; A53-D57 PolarHBondContact O-N 3.26Å; D57-S60 PolarHBondContact O-N 3.32Å; D57-S60 PolarHBondContact O-OG 3.11Å; D57-T61 WeakPolarHBondContact O-CB 3.23Å; D57-T61 WeakPolarHBondContact O-CG2 3.42Å; D57-T61 PolarHBondContact O-N 2.89Å; D57-T61 PolarHBondContact O-OG1 2.97Å; D57-I80 HydrophobicContact CB-CD1 4.12Å
58	W	83.1	Confident	71.9	Confident	28 Å²	28	56 Å²	56	11%	0.106	33%	0.325	C	S	.	.	H	α-helix	trans	-61.1	-47	176.7	-179.2	83.1	0	0	0	111.6	L15 L16 T54 L55 S60 T61 A62 C78	L15-W58 HydrophobicContact CB-CH2 4.21Å; L15-W58 HydrophobicContact CD1-CH2 4.12Å; L15-W58 HydrophobicContact CD1-CZ2 4.37Å; L16-W58 HydrophobicContact CD1-CZ3 4.1Å; L16-W58 HydrophobicContact CD2-CZ3 4.45Å; L16-W58 HydrophobicContact CG-CZ3 4.04Å; T54-W58 WeakPolarHBondContact O-CB 3.49Å; T54-W58 PolarHBondContact O-N 2.97Å; L55-W58 PolarHBondContact O-N 3.44Å; W58-S60 VanDerWaalsContact C-N 3.25Å; W58-S60 PolarHBondContact O-N 3.36Å; W58-T61 WeakPolarHBondContact CA-OG1 3.38Å; W58-T61 CarbonylContact O-C 3.49Å; W58-T61 PolarHBondContact O-N 3.32Å; W58-T61 PolarHBondContact O-OG1 3.4Å; W58-A62 HydrophobicContact CD2-CB 4.47Å; W58-A62 WeakPolarHBondContact O-CA 3.26Å; W58-A62 VanDerWaalsContact O-CB 3.22Å; W58-A62 WeakPolarHBondContact O-CB 3.06Å; W58-A62 PolarHBondContact O-N 3.46Å; W58-C78 HydrophobicContact CB-CB 4.45Å; W58-C78 HydrophobicContact CD2-CB 4.19Å; W58-C78 VanDerWaalsContact CE2-SG 3.55Å; W58-C78 HydrophobicContact CG-CB 4Å
59	L	80.7	Confident	69.8	Low	4 Å²	4	59.2 Å²	59.2	2%	0.021	36%	0.358	C	S	.	.	H	α-helix	trans	-61.1	-33.5	176.7	-75.2	173.8	0	0	0	113.1	G12 K13 L16 L55 S56 T61 A240	G12-L59 VanDerWaalsContact C-CD2 3.5Å; K13-L59 HydrophobicContact CG-CD2 4.39Å; L16-L59 HydrophobicContact CD1-CD2 4.12Å; L55-L59 WeakPolarHBondContact O-CB 3.13Å; L55-L59 VanDerWaalsContact O-CG 3.31Å; L55-L59 WeakPolarHBondContact O-CG 3.5Å; L55-L59 PolarHBondContact O-N 2.86Å; S56-L59 PolarHBondContact O-N 3.37Å; L59-T61 VanDerWaalsContact C-N 3.32Å; L59-A240 HydrophobicContact CD1-CB 3.63Å
60	S	77.8	Confident	67.8	Low	54 Å²	54	61.7 Å²	61.7	38%	0.378	39%	0.387	S	S	.	.	H	α-helix	trans	-74.5	-24	176.5	77.1	0	0	0	0	113.3	S56 D57 W58	S56-S60 PolarHBondContact O-N 3.01Å; S56-S60 VanDerWaalsContact O-N 3.08Å; D57-S60 PolarHBondContact O-N 3.32Å; D57-S60 PolarHBondContact O-OG 3.11Å; W58-S60 VanDerWaalsContact C-N 3.25Å; W58-S60 PolarHBondContact O-N 3.36Å
61	T	73.4	Confident	66.6	Low	69 Å²	69	65 Å²	65	42%	0.423	42%	0.422	S	S	.	.	H	α-helix	trans	-109.9	-8.4	-174.3	55.5	0	0	0	0	113.9	D57 W58 L59 K63	D57-T61 WeakPolarHBondContact O-CB 3.23Å; D57-T61 WeakPolarHBondContact O-CG2 3.42Å; D57-T61 PolarHBondContact O-N 2.89Å; D57-T61 PolarHBondContact O-OG1 2.97Å; W58-T61 WeakPolarHBondContact CA-OG1 3.38Å; W58-T61 CarbonylContact O-C 3.49Å; W58-T61 PolarHBondContact O-N 3.32Å; W58-T61 PolarHBondContact O-OG1 3.4Å; L59-T61 VanDerWaalsContact C-N 3.32Å; T61-K63 PolarHBondContact O-N 2.95Å
62	A	65.1	Low	65.5	Low	11 Å²	11	69.8 Å²	69.8	9%	0.091	44%	0.443	C	S	.	.			trans	-61.4	80.6	-178.7	0	0	0	0	0	110.5	T8 W58	T8-A62 WeakPolarHBondContact CG2-O 3.36Å; W58-A62 HydrophobicContact CD2-CB 4.47Å; W58-A62 WeakPolarHBondContact O-CA 3.26Å; W58-A62 VanDerWaalsContact O-CB 3.22Å; W58-A62 WeakPolarHBondContact O-CB 3.06Å; W58-A62 PolarHBondContact O-N 3.46Å
63	K	56.3	Low	64.8	Low	176 Å²	176	70.7 Å²	70.7	77%	0.765	45%	0.453	S	S	*	.			trans	-67.5	144.3	173.2	-73.4	176.6	-176	175.6	0	108.2	T61 T65	T61-K63 PolarHBondContact O-N 2.95Å; K63-T65 PolarHBondContact O-N 3.38Å
64	P	47.9	Very low	64.5	Low	89 Å²	89	73.7 Å²	73.7	58%	0.578	47%	0.466	S	S	*	.			trans	-57.1	109.6	173.2	22.9	-31	0	0	0	107.1	S66	P64-S66 PolarHBondContact O-N 3.37Å
65	T	44.2	Very low	64.3	Low	122 Å²	122	76.2 Å²	76.2	75%	0.748	48%	0.482	S	S	*	.			trans	-62.2	107.7	149.9	16.2	0	0	0	0	102.6	K63 T67	K63-T65 PolarHBondContact O-N 3.38Å; T65-T67 PolarHBondContact O-N 2.71Å
66	S	40.3	Very low	64.1	Low	98 Å²	98	76.6 Å²	76.6	69%	0.685	48%	0.484	S	S	*	.			trans	-36	120.7	171.1	-41.4	0	0	0	0	106.3	P64 V68	P64-S66 PolarHBondContact O-N 3.37Å; S66-V68 PolarHBondContact O-N 3.49Å
67	T	40.1	Very low	64	Low	137 Å²	137	78.2 Å²	78.2	84%	0.84	49%	0.487	S	S	*	.			trans	-29.9	91.3	168.2	31.8	0	0	0	0	109.5	T65 S69	T65-T67 PolarHBondContact O-N 2.71Å; T67-S69 PolarHBondContact O-N 2.96Å
68	V	40.8	Very low	64	Low	123 Å²	123	75.7 Å²	75.7	75%	0.745	47%	0.474	S	S	*	.			trans	-63.2	123.5	161.1	-178.8	0	0	0	0	101.4	S66 G70	S66-V68 PolarHBondContact O-N 3.49Å; V68-G70 PolarHBondContact O-N 3.48Å
69	S	44.3	Very low	63.6	Low	133 Å²	133	77.1 Å²	77.1	93%	0.93	49%	0.489	S	S	*	.	S	Bend	trans	-56.8	75.2	-173.2	-62	0	0	0	0	112	T67	T67-S69 PolarHBondContact O-N 2.96Å
70	G	45.9	Very low	62.9	Low	69 Å²	69	77.6 Å²	77.6	71%	0.711	49%	0.491	S	S	*	.	S	Bend	trans	161.7	69.3	-166.1	0	0	0	0	0	114.8	V68	V68-G70 PolarHBondContact O-N 3.48Å
71	G	59.9	Low	61.8	Low	74 Å²	74	79.7 Å²	79.7	76%	0.763	50%	0.503	S	S	*	.			trans	69.1	173.6	156.3	0	0	0	0	0	118.5
72	F	65.1	Low	60.8	Low	100 Å²	100	85 Å²	85	44%	0.439	52%	0.523	S	S	.	.			trans	-78.9	141.3	169	-66.2	-82.5	0	0	0	109.8	E14 L15 H18	E14-F72 HydrophobicContact CB-CE1 4.36Å; L15-F72 HydrophobicContact CD2-CD1 4.06Å; H18-F72 HydrophobicContact CB-CB 3.57Å; H18-F72 HydrophobicContact CB-CD1 4.21Å; H18-F72 HydrophobicContact CB-CD2 3.97Å; H18-F72 HydrophobicContact CB-CG 3.67Å; H18-F72 AromaticContact CD2-CD2 3.55Å; H18-F72 AromaticContact CD2-CE2 3.82Å; H18-F72 AromaticContact CE1-CE2 3.57Å; H18-F72 AromaticContact CE1-CZ 3.78Å; H18-F72 AromaticContact CG-CD2 3.51Å; H18-F72 AromaticContact CG-CE2 3.87Å; H18-F72 AromaticContact CG-CG 3.68Å; H18-F72 AromaticContact ND1-CD2 3.82Å; H18-F72 AromaticContact ND1-CE1 4Å; H18-F72 AromaticContact ND1-CE2 3.72Å; H18-F72 AromaticContact ND1-CZ 3.81Å; H18-F72 AromaticContact NE2-CD2 3.89Å; H18-F72 AromaticContact NE2-CE2 3.64Å
73	P	73.7	Confident	60.3	Low	62 Å²	62	85.1 Å²	85.1	40%	0.403	52%	0.524	S	S	.	.			trans	-69.2	137.9	178.4	29.2	-34.8	0	0	0	111.4	L15 T75 L76	L15-P73 HydrophobicContact CD2-CG 4.13Å; P73-T75 VanDerWaalsContact C-N 3.3Å; P73-T75 PolarHBondContact O-N 3.43Å; P73-L76 HydrophobicContact CG-CD2 3.81Å
74	D	77.6	Confident	60.4	Low	83 Å²	83	82 Å²	82	44%	0.444	52%	0.52	S	S	.	.	S	Bend	trans	-68.2	-30.2	175	-88.7	-14.4	0	0	0	112	K20 T21	K20-D74 WeakPolarHBondContact CA-O 3.37Å; K20-D74 HydrophobicContact CD-CB 4.38Å; K20-D74 WeakPolarHBondContact CD-OD1 3.4Å; K20-D74 WeakPolarHBondContact CE-OD1 3.35Å; K20-D74 PolarHBondContact N-O 3.37Å; K20-D74 IonicContact NZ-OD1 3.98Å; K20-D74 PolarHBondContact NZ-OD1 3.33Å; K20-D74 IonicContact NZ-OD2 2.74Å; K20-D74 PolarHBondContact NZ-OD2 3.02Å; T21-D74 PolarHBondContact N-O 2.88Å
75	T	81.8	Confident	61.5	Low	54 Å²	54	78.8 Å²	78.8	33%	0.331	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.2	177.6	-57.5	0	0	0	0	110.3	T21 R23 P73	T21-T75 HydrophobicContact CG2-CG2 4.13Å; T21-T75 CarbonylContact O-C 3.51Å; T21-T75 WeakPolarHBondContact O-CA 3.38Å; R23-T75 HydrophobicContact CG-CG2 4.41Å; P73-T75 VanDerWaalsContact C-N 3.3Å; P73-T75 PolarHBondContact O-N 3.43Å
76	L	82.3	Confident	63.3	Low	7 Å²	7	75.2 Å²	75.2	4%	0.037	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	117.6	178.5	-61.8	170.3	0	0	0	110	L15 L16 T21 L22 R23 P73	L15-L76 HydrophobicContact CB-CD2 3.94Å; L15-L76 HydrophobicContact CD2-CD2 4.25Å; L15-L76 WeakPolarHBondContact O-CD1 3.45Å; L16-L76 HydrophobicContact CB-CD1 4.43Å; L16-L76 HydrophobicContact CD2-CD1 3.79Å; L16-L76 HydrophobicContact CG-CD1 4.27Å; T21-L76 PolarHBondContact O-N 3.08Å; L22-L76 HydrophobicContact CD1-CB 4.19Å; R23-L76 PolarHBondContact N-O 3.43Å; P73-L76 HydrophobicContact CG-CD2 3.81Å
77	D	81.9	Confident	65.3	Low	96 Å²	96	71 Å²	71	51%	0.513	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	101.8	173.2	-67	-55.2	0	0	0	110	R23 S79	R23-D77 WeakPolarHBondContact CB-OD1 3.4Å; R23-D77 WeakPolarHBondContact CD-OD1 3.37Å; D77-S79 PolarHBondContact O-N 3.16Å
78	C	81.4	Confident	67.4	Low	1 Å²	1	67.4 Å²	67.4	1%	0.007	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	82.9	175.5	-66.2	0	0	0	0	109.3	L22 R23 L24 H25 W58	L22-C78 HydrophobicContact CD1-CB 4.19Å; L22-C78 WeakPolarHBondContact CD1-SG 3.29Å; R23-C78 WeakPolarHBondContact O-CA 3.22Å; R23-C78 WeakPolarHBondContact O-CB 3.34Å; R23-C78 PolarHBondContact O-N 2.86Å; L24-C78 WeakPolarHBondContact CA-O 3.24Å; L24-C78 HydrophobicContact CD2-CB 3.38Å; L24-C78 HydrophobicContact CG-CB 4.36Å; H25-C78 PolarHBondContact N-O 2.98Å; H25-C78 VanDerWaalsContact N-O 3.11Å; W58-C78 HydrophobicContact CB-CB 4.45Å; W58-C78 HydrophobicContact CD2-CB 4.19Å; W58-C78 VanDerWaalsContact CE2-SG 3.55Å; W58-C78 HydrophobicContact CG-CB 4Å
79	S	75.2	Confident	69.4	Low	58 Å²	58	66.4 Å²	66.4	41%	0.406	42%	0.424	S	S	.	.			trans	-115.5	162.4	173.7	65.2	0	0	0	0	110.7	D77	D77-S79 PolarHBondContact O-N 3.16Å
80	I	66.6	Low	71.2	Confident	14 Å²	14	66.4 Å²	66.4	7%	0.072	41%	0.41	C	S	.	.			trans	-107.9	125.3	-179.6	-61.8	170.9	0	0	0	108.1	T54 D57 E82 A83	T54-I80 HydrophobicContact CG2-CD1 4.13Å; T54-I80 HydrophobicContact CG2-CG1 4.3Å; D57-I80 HydrophobicContact CB-CD1 4.12Å; I80-E82 PolarHBondContact O-N 3.04Å; I80-A83 HydrophobicContact CB-CB 4.37Å; I80-A83 PolarHBondContact O-N 2.89Å
81	P	53.8	Low	73	Confident	98 Å²	98	66.2 Å²	66.2	64%	0.636	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-29.7	-171.2	-27	33.3	0	0	0	115	A83	P81-A83 VanDerWaalsContact C-N 3.31Å
82	E	53.2	Low	74.2	Confident	180 Å²	180	64.8 Å²	64.8	84%	0.841	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-1.6	-176.1	-66.6	157.2	-174.8	0	0	113.4	I80	I80-E82 PolarHBondContact O-N 3.04Å
83	A	54.4	Low	75.1	Confident	14 Å²	14	67.6 Å²	67.6	12%	0.116	38%	0.376	C	S	.	.			trans	-111.6	34.3	-173.4	0	0	0	0	0	113.2	H25 I80 P81 D85	H25-A83 PolarHBondContact CE1-O 2.92Å; I80-A83 HydrophobicContact CB-CB 4.37Å; I80-A83 PolarHBondContact O-N 2.89Å; P81-A83 VanDerWaalsContact C-N 3.31Å; A83-D85 PolarHBondContact O-N 3.03Å
84	T	58.7	Low	75.5	Confident	110 Å²	110	70.7 Å²	70.7	68%	0.675	39%	0.386	S	S	*	.			trans	-70.9	97.1	170.2	60.4	0	0	0	0	108.7	A86	T84-A86 PolarHBondContact O-N 2.92Å
85	D	70.4	Confident	75.7	Confident	21 Å²	21	67 Å²	67	11%	0.112	37%	0.366	C	S	.	.			trans	-72.1	30.2	167.1	-74.4	-54.4	0	0	0	111.6	H25 N28 A83 I87 L123 Y256 S268	H25-D85 IonicContact NE2-OD2 2.87Å; N28-D85 WeakPolarHBondContact CB-OD1 3.34Å; A83-D85 PolarHBondContact O-N 3.03Å; D85-I87 PolarHBondContact O-N 3.04Å; D85-L123 HydrophobicContact CB-CD2 3.67Å; D85-Y256 PolarHBondContact OD2-OH 3.04Å; D85-S268 WeakPolarHBondContact OD1-CB 3.1Å; D85-S268 PolarHBondContact OD1-OG 2.86Å; D85-S268 PolarHBondContact OD2-OG 2.92Å; D85-S268 VanDerWaalsContact OD2-OG 3.08Å
86	A	81.8	Confident	75.7	Confident	47 Å²	47	68.3 Å²	68.3	39%	0.388	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-62.6	122.5	-179.9	0	0	0	0	0	109	T84 A124	T84-A86 PolarHBondContact O-N 2.92Å; A86-A124 HydrophobicContact CB-CB 3.8Å
87	I	82.6	Confident	75.5	Confident	11 Å²	11	68 Å²	68	6%	0.056	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-92.6	123	-179.8	-62.3	165.9	0	0	0	107.1	D85 E91 R92 V95 I97 L123 V125 V258	D85-I87 PolarHBondContact O-N 3.04Å; I87-E91 HydrophobicContact CG2-CB 3.92Å; I87-R92 HydrophobicContact CG2-CB 4.11Å; I87-V95 HydrophobicContact CD1-CG2 4.15Å; I87-V95 HydrophobicContact CG2-CG2 3.85Å; I87-I97 HydrophobicContact CD1-CD1 3.45Å; I87-I97 VanDerWaalsContact CD1-CD1 3.45Å; I87-I97 HydrophobicContact CD1-CG1 3.72Å; I87-L123 HydrophobicContact CD1-CB 4.34Å; I87-L123 PolarHBondContact N-O 3.08Å; I87-V125 HydrophobicContact CB-CG1 4Å; I87-V125 HydrophobicContact CD1-CG1 4.01Å; I87-V258 HydrophobicContact CD1-CG1 4.03Å; I87-V258 HydrophobicContact CD1-CG2 4.11Å
88	T	84.6	Confident	74.7	Confident	60 Å²	60	64.6 Å²	64.6	37%	0.368	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-71.5	157.5	176.5	82.7	0	0	0	0	110.6	E90 E91 R92	T88-E90 VanDerWaalsContact CB-OE2 3.24Å; T88-E90 WeakPolarHBondContact CB-OE2 3.43Å; T88-E90 PolarHBondContact O-N 3.43Å; T88-E90 PolarHBondContact OG1-OE2 3.3Å; T88-E91 PolarHBondContact N-OE2 2.88Å; T88-E91 PolarHBondContact O-N 2.74Å; T88-E91 VanDerWaalsContact O-N 3.08Å; T88-E91 WeakPolarHBondContact OG1-CG 3.25Å; T88-E91 PolarHBondContact OG1-N 3.27Å; T88-R92 PolarHBondContact O-N 3.01Å
89	P	82.8	Confident	73.6	Confident	102 Å²	102	65.6 Å²	65.6	66%	0.662	36%	0.357	S	S	*	.	H	α-helix	trans	-54.8	-37	177.7	-27	36.4	0	0	0	113.5	R92	P89-R92 WeakPolarHBondContact O-CB 3.46Å; P89-R92 PolarHBondContact O-N 2.91Å
90	E	82.3	Confident	73.3	Confident	134 Å²	134	63 Å²	63	63%	0.626	34%	0.339	S	S	*	.	H	α-helix	trans	-67.2	-41	178.1	-54.9	72.4	-153.6	0	0	111.1	T88 R92	T88-E90 VanDerWaalsContact CB-OE2 3.24Å; T88-E90 WeakPolarHBondContact CB-OE2 3.43Å; T88-E90 PolarHBondContact O-N 3.43Å; T88-E90 PolarHBondContact OG1-OE2 3.3Å; E90-R92 VanDerWaalsContact C-N 3.32Å; E90-R92 PolarHBondContact O-N 3.32Å
91	E	82.7	Confident	74	Confident	64 Å²	64	62.4 Å²	62.4	30%	0.299	34%	0.336	S	S	.	.	H	α-helix	trans	-71.6	-27.6	178.1	-66.3	-175.3	135.1	0	0	112.6	I87 T88 E93 E94 V95 K267	I87-E91 HydrophobicContact CG2-CB 3.92Å; T88-E91 PolarHBondContact N-OE2 2.88Å; T88-E91 PolarHBondContact O-N 2.74Å; T88-E91 VanDerWaalsContact O-N 3.08Å; T88-E91 WeakPolarHBondContact OG1-CG 3.25Å; T88-E91 PolarHBondContact OG1-N 3.27Å; E91-E93 PolarHBondContact O-N 3.07Å; E91-E94 PolarHBondContact O-N 2.83Å; E91-V95 WeakPolarHBondContact O-CG2 3.27Å; E91-V95 PolarHBondContact O-N 2.89Å; E91-K267 IonicContact OE1-NZ 2.72Å; E91-K267 PolarHBondContact OE1-NZ 3.46Å; E91-K267 IonicContact OE2-NZ 3.11Å; E91-K267 PolarHBondContact OE2-NZ 2.95Å
92	R	85.4	Confident	75.3	Confident	45 Å²	45	57.8 Å²	57.8	17%	0.17	31%	0.306	C	S	.	.	H	α-helix	trans	-58.6	-34.7	-175	179.4	58.4	-175	101.4	-4.9	112.9	I87 T88 P89 E90 E94 V95 Q127 D129	I87-R92 HydrophobicContact CG2-CB 4.11Å; T88-R92 PolarHBondContact O-N 3.01Å; P89-R92 WeakPolarHBondContact O-CB 3.46Å; P89-R92 PolarHBondContact O-N 2.91Å; E90-R92 VanDerWaalsContact C-N 3.32Å; E90-R92 PolarHBondContact O-N 3.32Å; R92-E94 VanDerWaalsContact C-N 3.35Å; R92-V95 PolarHBondContact NH1-O 2.96Å; R92-Q127 PolarHBondContact NH2-O 2.94Å; R92-Q127 VanDerWaalsContact NH2-O 3.08Å; R92-D129 IonicContact CZ-OD1 3.69Å; R92-D129 IonicContact CZ-OD2 2.62Å; R92-D129 IonicContact NH1-OD1 3.36Å; R92-D129 PolarHBondContact NH1-OD1 2.88Å; R92-D129 IonicContact NH1-OD2 3.46Å; R92-D129 PolarHBondContact NH1-OD2 3.01Å; R92-D129 VanDerWaalsContact NH2-CG 3.28Å; R92-D129 IonicContact NH2-OD1 3.56Å; R92-D129 PolarHBondContact NH2-OD1 2.84Å; R92-D129 IonicContact NH2-OD2 3.69Å; R92-D129 PolarHBondContact NH2-OD2 2.88Å
93	E	83.8	Confident	76.6	Confident	159 Å²	159	50 Å²	50	74%	0.743	27%	0.27	S	S	*	.	H	α-helix	trans	-70.2	-33.8	177.9	-64.7	-167.9	167.1	0	0	111.9	E91 K261	E91-E93 PolarHBondContact O-N 3.07Å; E93-K261 PolarHBondContact O-NZ 3.36Å
94	E	82.3	Confident	77.6	Confident	127 Å²	127	50.4 Å²	50.4	59%	0.593	27%	0.27	S	S	*	.	H	α-helix	trans	-86.1	-17.9	-176.7	-59	-169.7	173.7	0	0	113.7	E91 R92 K261	E91-E94 PolarHBondContact O-N 2.83Å; R92-E94 VanDerWaalsContact C-N 3.35Å; E94-K261 WeakPolarHBondContact O-CB 3.26Å; E94-K261 WeakPolarHBondContact O-CG 3.4Å; E94-K261 PolarHBondContact O-N 2.85Å
95	V	82.1	Confident	78	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.024	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	147	-179.4	-55.2	0	0	0	0	112.8	I87 E91 R92 V258 I259 K261 K267	I87-V95 HydrophobicContact CD1-CG2 4.15Å; I87-V95 HydrophobicContact CG2-CG2 3.85Å; E91-V95 WeakPolarHBondContact O-CG2 3.27Å; E91-V95 PolarHBondContact O-N 2.89Å; R92-V95 PolarHBondContact NH1-O 2.96Å; V95-V258 HydrophobicContact CB-CG1 3.78Å; V95-V258 HydrophobicContact CG1-CG1 4.07Å; V95-V258 HydrophobicContact CG2-CG1 4Å; V95-I259 CarbonylContact C-O 3.58Å; V95-I259 VanDerWaalsContact CA-O 3.31Å; V95-I259 WeakPolarHBondContact CA-O 3.34Å; V95-K261 WeakPolarHBondContact O-CE 3.09Å; V95-K261 PolarHBondContact O-NZ 2.88Å; V95-K267 HydrophobicContact CG1-CD 4.42Å
96	K	81.5	Confident	77.8	Confident	82 Å²	82	50.5 Å²	50.5	36%	0.357	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	118.4	165.7	-173.8	-179.1	-179.4	179.7	0	108	S98 D129 I259 K261	K96-S98 VanDerWaalsContact C-N 3.27Å; K96-S98 PolarHBondContact O-N 2.62Å; K96-D129 WeakPolarHBondContact CA-OD2 3.33Å; K96-D129 HydrophobicContact CG-CB 4.08Å; K96-I259 PolarHBondContact N-O 3.24Å; K96-I259 PolarHBondContact O-N 3.27Å; K96-K261 HydrophobicContact CB-CG 4.04Å
97	I	78.1	Confident	76.6	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	83.6	171	-53.3	172.7	0	0	0	106.3	I87 L123 V125 L128 D129 S130 S257	I87-I97 HydrophobicContact CD1-CD1 3.45Å; I87-I97 VanDerWaalsContact CD1-CD1 3.45Å; I87-I97 HydrophobicContact CD1-CG1 3.72Å; I97-L123 HydrophobicContact CD1-CD1 4.42Å; I97-L123 HydrophobicContact CG2-CD1 3.73Å; I97-V125 HydrophobicContact CD1-CB 4.11Å; I97-V125 HydrophobicContact CD1-CG1 3.62Å; I97-V125 HydrophobicContact CD1-CG2 3.76Å; I97-L128 HydrophobicContact CG2-CD2 3.84Å; I97-D129 PolarHBondContact N-OD2 3.17Å; I97-D129 WeakPolarHBondContact O-CB 3.09Å; I97-D129 PolarHBondContact O-N 2.96Å; I97-S130 PolarHBondContact O-N 3.03Å; I97-S257 CarbonylContact C-O 3.59Å
98	S	64.3	Low	75.7	Confident	25 Å²	25	55.4 Å²	55.4	18%	0.175	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	129.9	-168.8	174.5	0	0	0	0	110.5	K96 S257	K96-S98 VanDerWaalsContact C-N 3.27Å; K96-S98 PolarHBondContact O-N 2.62Å; S98-S257 PolarHBondContact N-O 3.05Å
99	A	59.3	Low	74.9	Confident	22 Å²	22	57 Å²	57	18%	0.182	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	59.3	66.6	166.3	0	0	0	0	0	113.6	K101 S130 I132	A99-K101 PolarHBondContact O-N 3.45Å; A99-S130 PolarHBondContact N-O 3.24Å; A99-I132 HydrophobicContact CB-CD1 4.04Å
100	A	68.3	Low	74.7	Confident	2 Å²	2	55.9 Å²	55.9	2%	0.017	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	89.9	156.3	0	0	0	0	0	107	L102 L128 S130 V131 I132 L254 R255	A100-L102 PolarHBondContact O-N 3.47Å; A100-L128 HydrophobicContact CB-CD1 4.22Å; A100-S130 PolarHBondContact N-O 2.66Å; A100-V131 HydrophobicContact CB-CG2 4.21Å; A100-I132 PolarHBondContact O-N 3.5Å; A100-L254 HydrophobicContact CB-CD1 3.6Å; A100-L254 HydrophobicContact CB-CD2 4.12Å; A100-L254 HydrophobicContact CB-CG 3.99Å; A100-R255 CarbonylContact C-O 3.53Å; A100-R255 WeakPolarHBondContact CA-O 3.35Å
101	K	81.8	Confident	74.8	Confident	3 Å²	3	49.9 Å²	49.9	1%	0.013	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	109.5	178.4	-170.8	167.2	-175.1	165	0	107.6	A99 F103 I132 A134 S171 H220 D222 R255	A99-K101 PolarHBondContact O-N 3.45Å; K101-F103 HydrophobicContact CB-CE2 3.96Å; K101-F103 HydrophobicContact CB-CZ 4.37Å; K101-F103 HydrophobicContact CD-CE1 4.12Å; K101-F103 HydrophobicContact CD-CE2 4.02Å; K101-F103 HydrophobicContact CD-CZ 3.55Å; K101-F103 HydrophobicContact CG-CD2 4.32Å; K101-F103 HydrophobicContact CG-CE1 4.36Å; K101-F103 HydrophobicContact CG-CE2 3.72Å; K101-F103 HydrophobicContact CG-CZ 3.76Å; K101-F103 WeakPolarHBondContact O-CD2 3.42Å; K101-I132 CarbonylContact C-O 3.55Å; K101-I132 VanDerWaalsContact CA-O 3.31Å; K101-I132 WeakPolarHBondContact CA-O 3.47Å; K101-A134 HydrophobicContact CG-CB 4.25Å; K101-S171 WeakPolarHBondContact CE-OG 3.49Å; K101-S171 PolarHBondContact NZ-OG 3.46Å; K101-H220 PolarHBondContact NZ-CE1 3.25Å; K101-H220 VanDerWaalsContact NZ-CE1 3.27Å; K101-H220 PolarHBondContact NZ-ND1 2.96Å; K101-D222 WeakPolarHBondContact CD-OD2 3.03Å; K101-D222 WeakPolarHBondContact CE-OD2 3.32Å; K101-D222 IonicContact NZ-OD2 3.98Å; K101-D222 PolarHBondContact NZ-OD2 3.3Å; K101-R255 PolarHBondContact N-O 2.85Å; K101-R255 PolarHBondContact O-N 3.47Å
102	L	81.1	Confident	75.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	113.2	-179	-179.8	60.7	0	0	0	109	A100 L104 I112 A115 I132 A134 W252 L254	A100-L102 PolarHBondContact O-N 3.47Å; L102-L104 HydrophobicContact CD1-CD2 4.34Å; L102-L104 HydrophobicContact CD2-CD2 3.9Å; L102-L104 HydrophobicContact CG-CD2 3.95Å; L102-L104 HydrophobicContact CG-CG 4.38Å; L102-I112 HydrophobicContact CD2-CB 4.07Å; L102-I112 HydrophobicContact CD2-CG1 3.8Å; L102-I112 HydrophobicContact CD2-CG2 4Å; L102-A115 HydrophobicContact CD1-CB 3.65Å; L102-A115 HydrophobicContact CD2-CB 4.46Å; L102-I132 PolarHBondContact N-O 3.42Å; L102-A134 WeakPolarHBondContact O-CB 3.3Å; L102-A134 PolarHBondContact O-N 3.11Å; L102-W252 HydrophobicContact CD1-CB 3.98Å; L102-W252 HydrophobicContact CD1-CE3 4.43Å; L102-L254 HydrophobicContact CB-CD1 3.74Å; L102-L254 HydrophobicContact CD1-CB 4.4Å; L102-L254 HydrophobicContact CD1-CD1 4.03Å; L102-L254 HydrophobicContact CG-CD1 4.45Å
103	F	79.6	Confident	75.4	Confident	18 Å²	18	48.9 Å²	48.9	8%	0.079	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	113.3	171.8	-58.2	-95.2	0	0	0	107.8	K101 A134 D222 L226 W252 V253 R255	K101-F103 HydrophobicContact CB-CE2 3.96Å; K101-F103 HydrophobicContact CB-CZ 4.37Å; K101-F103 HydrophobicContact CD-CE1 4.12Å; K101-F103 HydrophobicContact CD-CE2 4.02Å; K101-F103 HydrophobicContact CD-CZ 3.55Å; K101-F103 HydrophobicContact CG-CD2 4.32Å; K101-F103 HydrophobicContact CG-CE1 4.36Å; K101-F103 HydrophobicContact CG-CE2 3.72Å; K101-F103 HydrophobicContact CG-CZ 3.76Å; K101-F103 WeakPolarHBondContact O-CD2 3.42Å; F103-A134 HydrophobicContact CD1-CB 3.86Å; F103-A134 HydrophobicContact CE1-CB 4.19Å; F103-A134 HydrophobicContact CG-CB 4.39Å; F103-D222 HydrophobicContact CE1-CB 4.27Å; F103-D222 HydrophobicContact CZ-CB 4.4Å; F103-L226 HydrophobicContact CB-CD2 4.22Å; F103-L226 HydrophobicContact CD1-CB 3.9Å; F103-L226 HydrophobicContact CD1-CD2 3.99Å; F103-L226 HydrophobicContact CD1-CG 4.46Å; F103-L226 HydrophobicContact CD2-CD2 3.5Å; F103-L226 VanDerWaalsContact CD2-CD2 3.5Å; F103-L226 HydrophobicContact CE1-CB 4.19Å; F103-L226 HydrophobicContact CE1-CD1 4.43Å; F103-L226 HydrophobicContact CE1-CD2 4.17Å; F103-L226 HydrophobicContact CE2-CD2 3.7Å; F103-L226 HydrophobicContact CG-CB 4.24Å; F103-L226 HydrophobicContact CG-CD2 3.64Å; F103-L226 HydrophobicContact CZ-CD1 4.34Å; F103-L226 HydrophobicContact CZ-CD2 4.02Å; F103-W252 WeakPolarHBondContact O-CA 3.37Å; F103-V253 HydrophobicContact CB-CB 4.32Å; F103-V253 WeakPolarHBondContact CD2-O 3.49Å; F103-V253 PolarHBondContact N-O 2.74Å; F103-V253 PolarHBondContact O-N 2.69Å; F103-R255 HydrophobicContact CE2-CB 4.27Å
104	L	76.6	Confident	75.7	Confident	22 Å²	22	43.2 Å²	43.2	12%	0.115	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	118.1	176.3	-65.6	-179.9	0	0	0	109.1	L102 A111 I112 I133 A152	L102-L104 HydrophobicContact CD1-CD2 4.34Å; L102-L104 HydrophobicContact CD2-CD2 3.9Å; L102-L104 HydrophobicContact CG-CD2 3.95Å; L102-L104 HydrophobicContact CG-CG 4.38Å; L104-A111 HydrophobicContact CD2-CB 4.31Å; L104-I112 HydrophobicContact CD1-CD1 4.32Å; L104-I112 HydrophobicContact CD1-CG1 4.33Å; L104-I112 HydrophobicContact CD2-CG1 4.02Å; L104-I133 HydrophobicContact CD1-CD1 3.81Å; L104-I133 HydrophobicContact CD1-CG1 4.3Å; L104-A152 HydrophobicContact CD1-CB 4.42Å
105	C	66.9	Low	76.1	Confident	57 Å²	57	37.1 Å²	37.1	39%	0.385	22%	0.215	S	C	.	.	S	Bend	trans	-97.1	-30.6	176.9	-62.8	0	0	0	0	111.2	L250 E251	C105-L250 HydrophobicContact CB-CB 4.23Å; C105-L250 HydrophobicContact CB-CG 4.22Å; C105-L250 WeakPolarHBondContact CB-O 3.08Å; C105-L250 VanDerWaalsContact SG-CD2 3.54Å; C105-E251 WeakPolarHBondContact CB-O 3.4Å; C105-E251 PolarHBondContact N-O 3.02Å
106	E	66.5	Low	76.5	Confident	75 Å²	75	37 Å²	37	35%	0.35	21%	0.214	S	C	.	.	S	Bend	trans	-121.3	146.5	169.3	-65.9	-168.5	164.6	0	0	111.6	G108 E251	E106-G108 PolarHBondContact O-N 3.32Å; E106-E251 PolarHBondContact N-O 2.77Å; E106-E251 VanDerWaalsContact N-O 3.14Å
107	S	56.7	Low	77	Confident	137 Å²	137	36.5 Å²	36.5	96%	0.958	21%	0.213	S	C	*	.			trans	-77.2	81.9	-179.8	11.8	0	0	0	0	110.7
108	G	63.2	Low	77.5	Confident	24 Å²	24	37.1 Å²	37.1	25%	0.247	22%	0.217	C	C	.	.			trans	-135.2	119.5	176.3	0	0	0	0	0	112.6	E106 S110 A111	E106-G108 PolarHBondContact O-N 3.32Å; G108-S110 PolarHBondContact O-N 3.42Å; G108-A111 VanDerWaalsContact O-CB 3.25Å; G108-A111 WeakPolarHBondContact O-CB 3.46Å; G108-A111 PolarHBondContact O-N 2.98Å
109	Q	67.9	Low	78.7	Confident	93 Å²	93	36 Å²	36	44%	0.435	21%	0.209	S	C	.	.	H	α-helix	trans	-55.7	-35.1	171.6	-74.7	178.3	9	0	0	112.2	A111 I112 P151 E155	Q109-A111 VanDerWaalsContact C-N 3.25Å; Q109-A111 PolarHBondContact O-N 2.94Å; Q109-I112 PolarHBondContact O-N 3.3Å; Q109-P151 HydrophobicContact CG-CB 4.17Å; Q109-E155 HydrophobicContact CB-CG 3.76Å; Q109-E155 HydrophobicContact CG-CG 4.03Å
110	S	78.7	Confident	80.2	Confident	80 Å²	80	35.4 Å²	35.4	56%	0.559	20%	0.203	S	C	*	.	H	α-helix	trans	-62.8	-29.7	176.6	55.4	0	0	0	0	113.3	G108 I112 R113 D114	G108-S110 PolarHBondContact O-N 3.42Å; S110-I112 VanDerWaalsContact C-N 3.32Å; S110-I112 PolarHBondContact O-N 3.36Å; S110-R113 PolarHBondContact O-N 3.04Å; S110-D114 VanDerWaalsContact O-CB 3.29Å; S110-D114 WeakPolarHBondContact O-CB 3.21Å; S110-D114 PolarHBondContact O-N 3.49Å
111	A	84.3	Confident	81.2	Confident	8 Å²	8	41.7 Å²	41.7	7%	0.066	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-36.6	-179.1	0	0	0	0	0	112	L104 G108 Q109 D114 A115 W252	L104-A111 HydrophobicContact CD2-CB 4.31Å; G108-A111 VanDerWaalsContact O-CB 3.25Å; G108-A111 WeakPolarHBondContact O-CB 3.46Å; G108-A111 PolarHBondContact O-N 2.98Å; Q109-A111 VanDerWaalsContact C-N 3.25Å; Q109-A111 PolarHBondContact O-N 2.94Å; A111-D114 PolarHBondContact O-N 2.71Å; A111-A115 VanDerWaalsContact O-CB 3.24Å; A111-A115 WeakPolarHBondContact O-CB 3.43Å; A111-A115 PolarHBondContact O-N 3.08Å; A111-W252 HydrophobicContact CB-CB 4.47Å; A111-W252 HydrophobicContact CB-CG 4.32Å
112	I	89.4	Confident	81.4	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-66.5	-48.9	-179.6	-59.6	170.3	0	0	0	110.5	L102 L104 Q109 S110 D114 A115 V116 I133 A152 E155 L156 L159	L102-I112 HydrophobicContact CD2-CB 4.07Å; L102-I112 HydrophobicContact CD2-CG1 3.8Å; L102-I112 HydrophobicContact CD2-CG2 4Å; L104-I112 HydrophobicContact CD1-CD1 4.32Å; L104-I112 HydrophobicContact CD1-CG1 4.33Å; L104-I112 HydrophobicContact CD2-CG1 4.02Å; Q109-I112 PolarHBondContact O-N 3.3Å; S110-I112 VanDerWaalsContact C-N 3.32Å; S110-I112 PolarHBondContact O-N 3.36Å; I112-D114 VanDerWaalsContact C-N 3.34Å; I112-A115 PolarHBondContact O-N 2.77Å; I112-V116 WeakPolarHBondContact O-CG2 3.22Å; I112-V116 PolarHBondContact O-N 3.34Å; I112-V116 VanDerWaalsContact O-N 3.08Å; I112-I133 HydrophobicContact CD1-CD1 4.1Å; I112-A152 VanDerWaalsContact CD1-CA 3.43Å; I112-A152 HydrophobicContact CD1-CB 3.5Å; I112-A152 WeakPolarHBondContact CD1-O 3.4Å; I112-E155 HydrophobicContact CD1-CB 4.31Å; I112-L156 HydrophobicContact CG2-CD2 3.71Å; I112-L156 HydrophobicContact CG2-CG 4.16Å; I112-L159 HydrophobicContact CG2-CD1 4Å
113	R	90.8	Very high	81.6	Confident	87 Å²	87	43.3 Å²	43.3	33%	0.328	24%	0.242	S	C	.	.	H	α-helix	trans	-60.8	-47.3	177.2	-175.5	-179.6	-53.7	168.4	8.1	110.8	S110 A115 V116 E117 E155 L159	S110-R113 PolarHBondContact O-N 3.04Å; R113-A115 PolarHBondContact O-N 3.21Å; R113-V116 PolarHBondContact O-N 2.78Å; R113-E117 HydrophobicContact CG-CG 4.33Å; R113-E117 WeakPolarHBondContact CG-OE1 3.14Å; R113-E117 WeakPolarHBondContact O-CB 3.36Å; R113-E117 WeakPolarHBondContact O-CG 3.45Å; R113-E117 PolarHBondContact O-N 3.42Å; R113-E155 IonicContact CZ-OE2 3.42Å; R113-E155 IonicContact NE-OE2 3.3Å; R113-E155 PolarHBondContact NE-OE2 2.66Å; R113-E155 IonicContact NH2-OE1 2.76Å; R113-E155 PolarHBondContact NH2-OE1 3.46Å; R113-E155 IonicContact NH2-OE2 3.54Å; R113-E155 PolarHBondContact NH2-OE2 3.48Å; R113-L159 HydrophobicContact CG-CD2 4.33Å
114	D	89.8	Confident	82.1	Confident	39 Å²	39	45.3 Å²	45.3	21%	0.209	26%	0.262	C	S	.	.	H	α-helix	trans	-60.7	-44.7	-179.9	-165.8	53.8	0	0	0	111.8	R23 S110 A111 I112 V116 E117 T118	R23-D114 IonicContact CZ-OD1 2.67Å; R23-D114 IonicContact CZ-OD2 2.89Å; R23-D114 IonicContact NE-OD2 3.24Å; R23-D114 IonicContact NH2-OD1 2.85Å; R23-D114 PolarHBondContact NH2-OD1 3.2Å; R23-D114 IonicContact NH2-OD2 2.84Å; R23-D114 PolarHBondContact NH2-OD2 3.26Å; S110-D114 VanDerWaalsContact O-CB 3.29Å; S110-D114 WeakPolarHBondContact O-CB 3.21Å; S110-D114 PolarHBondContact O-N 3.49Å; A111-D114 PolarHBondContact O-N 2.71Å; I112-D114 VanDerWaalsContact C-N 3.34Å; D114-V116 PolarHBondContact O-N 3.05Å; D114-E117 PolarHBondContact O-N 3.14Å; D114-T118 VanDerWaalsContact O-CB 3.22Å; D114-T118 WeakPolarHBondContact O-CB 3.34Å; D114-T118 PolarHBondContact O-N 2.99Å; D114-T118 PolarHBondContact O-OG1 3.31Å
115	A	90.6	Very high	82.7	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.5	-44.2	178.1	0	0	0	0	0	112.4	L102 A111 I112 R113 A119 W252 L254	L102-A115 HydrophobicContact CD1-CB 3.65Å; L102-A115 HydrophobicContact CD2-CB 4.46Å; A111-A115 VanDerWaalsContact O-CB 3.24Å; A111-A115 WeakPolarHBondContact O-CB 3.43Å; A111-A115 PolarHBondContact O-N 3.08Å; I112-A115 PolarHBondContact O-N 2.77Å; R113-A115 PolarHBondContact O-N 3.21Å; A115-A119 WeakPolarHBondContact O-CB 3.44Å; A115-A119 PolarHBondContact O-N 3.01Å; A115-W252 HydrophobicContact CB-CD2 3.66Å; A115-W252 HydrophobicContact CB-CE3 3.64Å; A115-W252 HydrophobicContact CB-CG 4.3Å; A115-W252 HydrophobicContact CB-CH2 4.08Å; A115-W252 HydrophobicContact CB-CZ2 4.06Å; A115-W252 HydrophobicContact CB-CZ3 3.86Å; A115-L254 HydrophobicContact CB-CD2 4.46Å
116	V	91.4	Very high	83.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-70.3	-43.1	-179.3	170.8	0	0	0	0	111.5	I112 R113 D114 A119 C120 L128 V131 L159 K164 I165	I112-V116 WeakPolarHBondContact O-CG2 3.22Å; I112-V116 PolarHBondContact O-N 3.34Å; I112-V116 VanDerWaalsContact O-N 3.08Å; R113-V116 PolarHBondContact O-N 2.78Å; D114-V116 PolarHBondContact O-N 3.05Å; V116-A119 PolarHBondContact O-N 2.89Å; V116-C120 PolarHBondContact O-N 2.86Å; V116-C120 PolarHBondContact O-SG 3.36Å; V116-C120 VanDerWaalsContact O-SG 3.42Å; V116-L128 HydrophobicContact CG1-CD1 4.09Å; V116-L128 HydrophobicContact CG2-CD1 4.47Å; V116-V131 HydrophobicContact CG2-CG2 4.34Å; V116-L159 HydrophobicContact CB-CD1 4.07Å; V116-L159 HydrophobicContact CG1-CD1 4.25Å; V116-L159 HydrophobicContact CG1-CD2 4.49Å; V116-L159 HydrophobicContact CG2-CD1 3.97Å; V116-K164 HydrophobicContact CG1-CB 4.26Å; V116-I165 HydrophobicContact CG1-CD1 4.2Å; V116-I165 HydrophobicContact CG1-CG1 3.9Å; V116-I165 HydrophobicContact CG2-CD1 4.01Å; V116-I165 HydrophobicContact CG2-CG1 4.49Å
117	E	90.9	Very high	85.1	Confident	73 Å²	73	45.8 Å²	45.8	34%	0.341	27%	0.27	S	S	.	.	H	α-helix	trans	-64.3	-43.7	175.9	-72.8	179.1	-176.8	0	0	111.4	R113 D114 A119 C120 Q121	R113-E117 HydrophobicContact CG-CG 4.33Å; R113-E117 WeakPolarHBondContact CG-OE1 3.14Å; R113-E117 WeakPolarHBondContact O-CB 3.36Å; R113-E117 WeakPolarHBondContact O-CG 3.45Å; R113-E117 PolarHBondContact O-N 3.42Å; D114-E117 PolarHBondContact O-N 3.14Å; E117-A119 VanDerWaalsContact C-N 3.31Å; E117-A119 PolarHBondContact O-N 2.92Å; E117-C120 PolarHBondContact O-N 2.89Å; E117-Q121 VanDerWaalsContact O-CG 3.32Å; E117-Q121 WeakPolarHBondContact O-CG 3.41Å; E117-Q121 PolarHBondContact O-N 3.3Å
118	T	89.4	Confident	86.8	Confident	14 Å²	14	39.3 Å²	39.3	9%	0.086	22%	0.224	C	C	.	.	H	α-helix	trans	-58.2	-44.1	173.7	-54.8	0	0	0	0	110.8	D114 Q121 T122 W252 L272	D114-T118 VanDerWaalsContact O-CB 3.22Å; D114-T118 WeakPolarHBondContact O-CB 3.34Å; D114-T118 PolarHBondContact O-N 2.99Å; D114-T118 PolarHBondContact O-OG1 3.31Å; T118-Q121 PolarHBondContact O-N 3.13Å; T118-T122 WeakPolarHBondContact O-CB 3.38Å; T118-T122 PolarHBondContact O-N 3.24Å; T118-T122 PolarHBondContact O-OG1 2.9Å; T118-W252 HydrophobicContact CG2-CH2 4.24Å; T118-L272 HydrophobicContact CG2-CD1 4.32Å
119	A	89.9	Confident	88.2	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-63.5	-44	177.9	0	0	0	0	0	113.4	A115 V116 E117 Q121 T122 L123 L128 L254 L272	A115-A119 WeakPolarHBondContact O-CB 3.44Å; A115-A119 PolarHBondContact O-N 3.01Å; V116-A119 PolarHBondContact O-N 2.89Å; E117-A119 VanDerWaalsContact C-N 3.31Å; E117-A119 PolarHBondContact O-N 2.92Å; A119-Q121 VanDerWaalsContact C-N 3.31Å; A119-Q121 PolarHBondContact O-N 3.1Å; A119-T122 PolarHBondContact O-N 3.34Å; A119-L123 WeakPolarHBondContact O-CB 3.21Å; A119-L123 WeakPolarHBondContact O-CG 3.47Å; A119-L123 PolarHBondContact O-N 2.76Å; A119-L128 HydrophobicContact CB-CD1 4.07Å; A119-L128 HydrophobicContact CB-CD2 4.26Å; A119-L254 HydrophobicContact CB-CD2 3.54Å; A119-L272 HydrophobicContact CB-CD1 3.85Å
120	C	90.1	Very high	89.4	Confident	9 Å²	9	36 Å²	36	6%	0.061	21%	0.205	C	C	.	.	H	α-helix	trans	-59.7	-43	175.2	-77	0	0	0	0	111.5	V116 E117 A124 V125	V116-C120 PolarHBondContact O-N 2.86Å; V116-C120 PolarHBondContact O-SG 3.36Å; V116-C120 VanDerWaalsContact O-SG 3.42Å; E117-C120 PolarHBondContact O-N 2.89Å; C120-A124 CarbonylContact O-C 3.5Å; C120-A124 WeakPolarHBondContact O-CA 3.4Å; C120-A124 PolarHBondContact O-N 3.18Å; C120-V125 CarbonylContact C-O 3.57Å; C120-V125 WeakPolarHBondContact CA-O 3.39Å; C120-V125 WeakPolarHBondContact CB-O 3.31Å; C120-V125 PolarHBondContact O-N 3.36Å
121	Q	88.9	Confident	90.1	Very high	134 Å²	134	32.2 Å²	32.2	63%	0.626	18%	0.179	S	C	*	.	H	α-helix	trans	-64.8	-50.5	176.7	-71.2	170.1	7.7	0	0	111.7	E117 T118 A119 L123 A124	E117-Q121 VanDerWaalsContact O-CG 3.32Å; E117-Q121 WeakPolarHBondContact O-CG 3.41Å; E117-Q121 PolarHBondContact O-N 3.3Å; T118-Q121 PolarHBondContact O-N 3.13Å; A119-Q121 VanDerWaalsContact C-N 3.31Å; A119-Q121 PolarHBondContact O-N 3.1Å; Q121-L123 VanDerWaalsContact C-N 3.35Å; Q121-L123 PolarHBondContact O-N 3.27Å; Q121-A124 PolarHBondContact O-N 3.27Å; Q121-A124 VanDerWaalsContact O-N 3.11Å
122	T	86.2	Confident	90.5	Very high	36 Å²	36	31.9 Å²	31.9	22%	0.221	18%	0.176	C	C	.	.	H	α-helix	trans	-63.3	-39.1	-177.6	-61.2	0	0	0	0	112.8	H25 T118 A119 A124 L272	H25-T122 WeakPolarHBondContact CE1-CG2 3.37Å; T118-T122 WeakPolarHBondContact O-CB 3.38Å; T118-T122 PolarHBondContact O-N 3.24Å; T118-T122 PolarHBondContact O-OG1 2.9Å; A119-T122 PolarHBondContact O-N 3.34Å; T122-A124 VanDerWaalsContact C-N 3.3Å; T122-L272 HydrophobicContact CG2-CD2 4.04Å
123	L	86.8	Confident	90.6	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-0.4	178.6	-60.5	177.8	0	0	0	112.9	D85 I87 I97 A119 Q121 V125 L128 Y256 V258	D85-L123 HydrophobicContact CB-CD2 3.67Å; I87-L123 HydrophobicContact CD1-CB 4.34Å; I87-L123 PolarHBondContact N-O 3.08Å; I97-L123 HydrophobicContact CD1-CD1 4.42Å; I97-L123 HydrophobicContact CG2-CD1 3.73Å; A119-L123 WeakPolarHBondContact O-CB 3.21Å; A119-L123 WeakPolarHBondContact O-CG 3.47Å; A119-L123 PolarHBondContact O-N 2.76Å; Q121-L123 VanDerWaalsContact C-N 3.35Å; Q121-L123 PolarHBondContact O-N 3.27Å; L123-V125 VanDerWaalsContact C-N 3.28Å; L123-V125 HydrophobicContact CB-CG1 4.38Å; L123-V125 HydrophobicContact CB-CG2 4.06Å; L123-V125 WeakPolarHBondContact O-CG1 3.1Å; L123-V125 PolarHBondContact O-N 2.82Å; L123-L128 HydrophobicContact CD1-CD2 4.36Å; L123-Y256 HydrophobicContact CD1-CD2 4.36Å; L123-Y256 HydrophobicContact CD2-CD2 4.06Å; L123-Y256 HydrophobicContact CD2-CE2 3.85Å; L123-V258 HydrophobicContact CD2-CG2 4.47Å
124	A	88.9	Confident	90.4	Very high	61 Å²	61	28.2 Å²	28.2	50%	0.504	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	41	-175.2	0	0	0	0	0	113.6	A86 C120 Q121 T122	A86-A124 HydrophobicContact CB-CB 3.8Å; C120-A124 CarbonylContact O-C 3.5Å; C120-A124 WeakPolarHBondContact O-CA 3.4Å; C120-A124 PolarHBondContact O-N 3.18Å; Q121-A124 PolarHBondContact O-N 3.27Å; Q121-A124 VanDerWaalsContact O-N 3.11Å; T122-A124 VanDerWaalsContact C-N 3.3Å
125	V	89.4	Confident	89.7	Confident	16 Å²	16	27.6 Å²	27.6	10%	0.097	16%	0.162	C	C	.	.			trans	-120.1	150.2	-179.9	-60.6	0	0	0	0	112.5	I87 I97 C120 L123 L128	I87-V125 HydrophobicContact CB-CG1 4Å; I87-V125 HydrophobicContact CD1-CG1 4.01Å; I97-V125 HydrophobicContact CD1-CB 4.11Å; I97-V125 HydrophobicContact CD1-CG1 3.62Å; I97-V125 HydrophobicContact CD1-CG2 3.76Å; C120-V125 CarbonylContact C-O 3.57Å; C120-V125 WeakPolarHBondContact CA-O 3.39Å; C120-V125 WeakPolarHBondContact CB-O 3.31Å; C120-V125 PolarHBondContact O-N 3.36Å; L123-V125 VanDerWaalsContact C-N 3.28Å; L123-V125 HydrophobicContact CB-CG1 4.38Å; L123-V125 HydrophobicContact CB-CG2 4.06Å; L123-V125 WeakPolarHBondContact O-CG1 3.1Å; L123-V125 PolarHBondContact O-N 2.82Å; V125-L128 HydrophobicContact CG2-CD2 4.2Å
126	S	90.6	Very high	88.6	Confident	93 Å²	93	31.6 Å²	31.6	65%	0.65	19%	0.188	S	C	*	.	S	Bend	trans	-77.4	-28.5	175.9	52	0	0	0	0	113.3
127	Q	92.3	Very high	87.2	Confident	55 Å²	55	33.2 Å²	33.2	26%	0.257	21%	0.205	S	C	.	.			trans	-149.6	136.1	-171.1	-174.5	179.5	44.6	0	0	112.2	R92 Q163 K164 I165 A166	R92-Q127 PolarHBondContact NH2-O 2.94Å; R92-Q127 VanDerWaalsContact NH2-O 3.08Å; Q127-Q163 WeakPolarHBondContact CB-O 3.43Å; Q127-Q163 VanDerWaalsContact CG-O 3.22Å; Q127-Q163 WeakPolarHBondContact CG-O 3.35Å; Q127-Q163 PolarHBondContact NE2-O 2.68Å; Q127-K164 WeakPolarHBondContact CA-O 3.32Å; Q127-I165 PolarHBondContact NE2-O 3.42Å; Q127-A166 HydrophobicContact CG-CB 4.49Å
128	L	92.6	Very high	85.6	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	140.7	169.2	-57.1	179	0	0	0	111.1	I97 A100 V116 A119 L123 V125 V131 K164 I165 A166	I97-L128 HydrophobicContact CG2-CD2 3.84Å; A100-L128 HydrophobicContact CB-CD1 4.22Å; V116-L128 HydrophobicContact CG1-CD1 4.09Å; V116-L128 HydrophobicContact CG2-CD1 4.47Å; A119-L128 HydrophobicContact CB-CD1 4.07Å; A119-L128 HydrophobicContact CB-CD2 4.26Å; L123-L128 HydrophobicContact CD1-CD2 4.36Å; V125-L128 HydrophobicContact CG2-CD2 4.2Å; L128-V131 HydrophobicContact CB-CG2 4.25Å; L128-V131 HydrophobicContact CD1-CG2 3.71Å; L128-K164 PolarHBondContact N-O 3Å; L128-I165 CarbonylContact O-C 3.57Å; L128-I165 WeakPolarHBondContact O-CA 3.43Å; L128-A166 PolarHBondContact O-N 3.3Å
129	D	93.1	Very high	83.8	Confident	32 Å²	32	38.4 Å²	38.4	17%	0.171	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	-37.2	-179.3	-62	-61	0	0	0	112.3	R92 K96 I97 A167	R92-D129 IonicContact CZ-OD1 3.69Å; R92-D129 IonicContact CZ-OD2 2.62Å; R92-D129 IonicContact NH1-OD1 3.36Å; R92-D129 PolarHBondContact NH1-OD1 2.88Å; R92-D129 IonicContact NH1-OD2 3.46Å; R92-D129 PolarHBondContact NH1-OD2 3.01Å; R92-D129 VanDerWaalsContact NH2-CG 3.28Å; R92-D129 IonicContact NH2-OD1 3.56Å; R92-D129 PolarHBondContact NH2-OD1 2.84Å; R92-D129 IonicContact NH2-OD2 3.69Å; R92-D129 PolarHBondContact NH2-OD2 2.88Å; K96-D129 WeakPolarHBondContact CA-OD2 3.33Å; K96-D129 HydrophobicContact CG-CB 4.08Å; I97-D129 PolarHBondContact N-OD2 3.17Å; I97-D129 WeakPolarHBondContact O-CB 3.09Å; I97-D129 PolarHBondContact O-N 2.96Å; D129-A167 PolarHBondContact O-N 3.11Å; D129-A167 VanDerWaalsContact O-N 3.16Å
130	S	92.8	Very high	81.6	Confident	16 Å²	16	47.9 Å²	47.9	11%	0.112	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	132.4	177.7	178.8	0	0	0	0	113.2	I97 A99 A100 A167	I97-S130 PolarHBondContact O-N 3.03Å; A99-S130 PolarHBondContact N-O 3.24Å; A100-S130 PolarHBondContact N-O 2.66Å; S130-A167 VanDerWaalsContact CA-O 3.26Å; S130-A167 WeakPolarHBondContact CA-O 3.42Å
131	V	94.6	Very high	79.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.4	173.5	178.6	0	0	0	0	109.2	A100 V116 L128 L156 I165 A167 I168 G169	A100-V131 HydrophobicContact CB-CG2 4.21Å; V116-V131 HydrophobicContact CG2-CG2 4.34Å; L128-V131 HydrophobicContact CB-CG2 4.25Å; L128-V131 HydrophobicContact CD1-CG2 3.71Å; V131-L156 HydrophobicContact CG1-CD2 4.07Å; V131-I165 HydrophobicContact CB-CD1 4.09Å; V131-I165 HydrophobicContact CB-CG2 4.11Å; V131-I165 HydrophobicContact CG2-CB 4.43Å; V131-I165 HydrophobicContact CG2-CD1 3.72Å; V131-I165 HydrophobicContact CG2-CG1 3.81Å; V131-I165 HydrophobicContact CG2-CG2 3.77Å; V131-A167 PolarHBondContact N-O 2.79Å; V131-I168 CarbonylContact O-C 3.48Å; V131-I168 WeakPolarHBondContact O-CA 3.28Å; V131-G169 PolarHBondContact O-N 3.22Å
132	I	92.9	Very high	77.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.5	177.6	-62.3	174.7	0	0	0	107.9	A99 A100 K101 L102 G169 T170 Q193 L218	A99-I132 HydrophobicContact CB-CD1 4.04Å; A100-I132 PolarHBondContact O-N 3.5Å; K101-I132 CarbonylContact C-O 3.55Å; K101-I132 VanDerWaalsContact CA-O 3.31Å; K101-I132 WeakPolarHBondContact CA-O 3.47Å; L102-I132 PolarHBondContact N-O 3.42Å; I132-G169 WeakPolarHBondContact CA-O 3.25Å; I132-T170 WeakPolarHBondContact CG2-O 3.33Å; I132-Q193 HydrophobicContact CD1-CG 4.08Å; I132-L218 HydrophobicContact CD1-CD1 4.08Å
133	I	90.5	Very high	76.4	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	128.8	175.6	-163.9	165.2	0	0	0	110.9	L104 I112 P135 L149 A152 W153 L156 G169 T170 S171	L104-I133 HydrophobicContact CD1-CD1 3.81Å; L104-I133 HydrophobicContact CD1-CG1 4.3Å; I112-I133 HydrophobicContact CD1-CD1 4.1Å; I133-P135 WeakPolarHBondContact O-CD 3.41Å; I133-L149 HydrophobicContact CG2-CD1 4.15Å; I133-A152 HydrophobicContact CD1-CB 3.48Å; I133-A152 VanDerWaalsContact CD1-CB 3.48Å; I133-W153 HydrophobicContact CG2-CE3 4.47Å; I133-W153 HydrophobicContact CG2-CZ3 4.32Å; I133-L156 HydrophobicContact CB-CD1 4.05Å; I133-L156 HydrophobicContact CD1-CD1 4.15Å; I133-L156 HydrophobicContact CG2-CD1 4.07Å; I133-G169 PolarHBondContact N-O 3.46Å; I133-T170 HydrophobicContact CG2-CG2 4.29Å; I133-T170 CarbonylContact O-C 3.58Å; I133-S171 PolarHBondContact O-N 3.41Å
134	A	87.5	Confident	75.5	Confident	11 Å²	11	54.7 Å²	54.7	9%	0.091	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	96	169.3	0	0	0	0	0	107.9	K101 L102 F103	K101-A134 HydrophobicContact CG-CB 4.25Å; L102-A134 WeakPolarHBondContact O-CB 3.3Å; L102-A134 PolarHBondContact O-N 3.11Å; F103-A134 HydrophobicContact CD1-CB 3.86Å; F103-A134 HydrophobicContact CE1-CB 4.19Å; F103-A134 HydrophobicContact CG-CB 4.39Å
135	P	73.6	Confident	75.1	Confident	26 Å²	26	53.9 Å²	53.9	17%	0.169	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-62.7	147.7	176.3	26.8	-32.6	0	0	0	109.5	I133 R144	I133-P135 WeakPolarHBondContact O-CD 3.41Å; P135-R144 PolarHBondContact O-NH2 3.36Å
136	P	68.3	Low	74.9	Confident	83 Å²	83	54.3 Å²	54.3	54%	0.539	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-53.8	149.8	176.2	21	-30.4	0	0	0	110.6	R144	P136-R144 PolarHBondContact O-NH2 2.92Å
137	G	62.4	Low	74.7	Confident	35 Å²	35	52.7 Å²	52.7	36%	0.361	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-55.4	145.6	172.4	0	0	0	0	0	110.1	V139	G137-V139 PolarHBondContact O-N 3.22Å
138	P	56.4	Low	74.2	Confident	76 Å²	76	56 Å²	56	49%	0.494	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-55.2	133.3	171.5	22	-28.9	0	0	0	109.4	D142 R144	P138-D142 WeakPolarHBondContact CB-O 3.24Å; P138-R144 HydrophobicContact CB-CG 4.29Å; P138-R144 HydrophobicContact CG-CG 4.28Å
139	V	52.2	Low	73.9	Confident	120 Å²	120	56.4 Å²	56.4	73%	0.727	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-63	137.5	166.6	-175.1	0	0	0	0	106.6	G137 G141 D142	G137-V139 PolarHBondContact O-N 3.22Å; V139-G141 PolarHBondContact O-N 3.38Å; V139-D142 PolarHBondContact O-N 2.96Å
140	E	43.7	Very low	73.7	Confident	200 Å²	200	57.5 Å²	57.5	94%	0.935	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.8	116.2	-174.6	-68.4	-167.8	151.8	0	0	111.7
141	G	45.7	Very low	73.6	Confident	90 Å²	90	59.1 Å²	59.1	93%	0.928	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.4	-11.9	177.3	0	0	0	0	0	116.6	V139	V139-G141 PolarHBondContact O-N 3.38Å
142	D	52.9	Low	73.3	Confident	94 Å²	94	59.7 Å²	59.7	50%	0.503	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-103.2	122.9	174.9	-158.1	10.8	0	0	0	110.6	P138 V139 H148	P138-D142 WeakPolarHBondContact CB-O 3.24Å; V139-D142 PolarHBondContact O-N 2.96Å; D142-H148 IonicContact OD2-CE1 2.64Å; D142-H148 PolarHBondContact OD2-CE1 2.88Å
143	G	57.3	Low	73.3	Confident	52 Å²	52	59.7 Å²	59.7	54%	0.536	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-66.2	143.7	176.5	0	0	0	0	0	110.4	S145	G143-S145 PolarHBondContact O-N 3.08Å; G143-S145 VanDerWaalsContact O-N 3.09Å
144	R	68.1	Low	73.5	Confident	86 Å²	86	64.2 Å²	64.2	33%	0.325	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-59.7	119.3	166.9	-78.8	-177.2	170.4	172.6	-2.2	108.1	P135 P136 P138 D172 L177	P135-R144 PolarHBondContact O-NH2 3.36Å; P136-R144 PolarHBondContact O-NH2 2.92Å; P138-R144 HydrophobicContact CB-CG 4.29Å; P138-R144 HydrophobicContact CG-CG 4.28Å; R144-D172 PolarHBondContact NH1-O 3.48Å; R144-L177 HydrophobicContact CB-CD2 3.84Å
145	S	81.1	Confident	73.8	Confident	45 Å²	45	64.9 Å²	64.9	32%	0.315	40%	0.396	S	S	.	.			trans	-115.6	154.1	179.6	77.8	0	0	0	0	110.3	G143 A147 H148	G143-S145 PolarHBondContact O-N 3.08Å; G143-S145 VanDerWaalsContact O-N 3.09Å; S145-A147 PolarHBondContact O-N 2.82Å; S145-H148 PolarHBondContact O-N 2.94Å; S145-H148 PolarHBondContact OG-ND1 3.39Å
146	L	84.8	Confident	74.7	Confident	24 Å²	24	63.7 Å²	63.7	13%	0.126	39%	0.388	C	S	.	.	H	α-helix	trans	-56.8	-37.6	175.8	179.3	63.2	0	0	0	111.1	H148 L149 Q150 L177 Q180 L181 W184	L146-H148 PolarHBondContact O-N 3.04Å; L146-L149 WeakPolarHBondContact O-CA 3.46Å; L146-L149 PolarHBondContact O-N 2.8Å; L146-Q150 HydrophobicContact CD1-CG 4.23Å; L146-Q150 HydrophobicContact CG-CG 3.91Å; L146-Q150 WeakPolarHBondContact O-CG 3.42Å; L146-Q150 PolarHBondContact O-N 3.44Å; L146-L177 HydrophobicContact CB-CD1 3.95Å; L146-Q180 HydrophobicContact CD2-CB 4.2Å; L146-L181 HydrophobicContact CD1-CB 3.94Å; L146-L181 HydrophobicContact CD1-CD1 3.87Å; L146-W184 HydrophobicContact CD1-CE3 4.47Å; L146-W184 HydrophobicContact CD2-CB 4.07Å; L146-W184 HydrophobicContact CD2-CG 4.24Å
147	A	85.4	Confident	76	Confident	59 Å²	59	60.4 Å²	60.4	49%	0.488	37%	0.366	S	S	.	.	H	α-helix	trans	-57.6	-33	-179.2	0	0	0	0	0	113.6	S145 L149 P151	S145-A147 PolarHBondContact O-N 2.82Å; A147-L149 VanDerWaalsContact C-N 3.33Å; A147-P151 WeakPolarHBondContact O-CD 3.46Å
148	H	82.6	Confident	77.6	Confident	125 Å²	125	59.5 Å²	59.5	58%	0.579	35%	0.354	S	S	*	.	H	α-helix	trans	-73.9	-25.4	175.9	-66.9	122.3	0	0	0	113	D142 S145 L146	D142-H148 IonicContact OD2-CE1 2.64Å; D142-H148 PolarHBondContact OD2-CE1 2.88Å; S145-H148 PolarHBondContact O-N 2.94Å; S145-H148 PolarHBondContact OG-ND1 3.39Å; L146-H148 PolarHBondContact O-N 3.04Å
149	L	86.2	Confident	79.5	Confident	9 Å²	9	56 Å²	56	5%	0.047	33%	0.331	C	S	.	.	H	α-helix	trans	-91	-30.3	-179.3	-174.6	59.9	0	0	0	112.8	I133 L146 A147 A152 W153 T170 L173 L181	I133-L149 HydrophobicContact CG2-CD1 4.15Å; L146-L149 WeakPolarHBondContact O-CA 3.46Å; L146-L149 PolarHBondContact O-N 2.8Å; A147-L149 VanDerWaalsContact C-N 3.33Å; L149-A152 PolarHBondContact O-N 3.05Å; L149-A152 VanDerWaalsContact O-N 3.1Å; L149-W153 PolarHBondContact O-N 3.02Å; L149-T170 HydrophobicContact CD2-CG2 4.45Å; L149-L173 HydrophobicContact CD2-CD1 3.88Å; L149-L173 HydrophobicContact CD2-CD2 4.39Å; L149-L181 HydrophobicContact CD2-CD1 4.01Å; L149-L181 HydrophobicContact CD2-CD2 3.74Å; L149-L181 HydrophobicContact CD2-CG 4.35Å; L149-L181 HydrophobicContact CG-CD1 4.44Å
150	Q	89.3	Confident	81.6	Confident	55 Å²	55	51.7 Å²	51.7	26%	0.257	31%	0.305	S	S	.	.	H	α-helix	trans	-50	-50.7	-177.2	-75.8	174	-39.8	0	0	113.5	L146 A152 W153 E154 W184	L146-Q150 HydrophobicContact CD1-CG 4.23Å; L146-Q150 HydrophobicContact CG-CG 3.91Å; L146-Q150 WeakPolarHBondContact O-CG 3.42Å; L146-Q150 PolarHBondContact O-N 3.44Å; Q150-A152 PolarHBondContact O-N 2.97Å; Q150-W153 PolarHBondContact O-N 2.84Å; Q150-W153 VanDerWaalsContact O-N 3.11Å; Q150-E154 WeakPolarHBondContact O-CG 3.44Å; Q150-E154 PolarHBondContact O-N 2.8Å; Q150-W184 HydrophobicContact CB-CH2 3.77Å; Q150-W184 HydrophobicContact CB-CZ2 3.92Å; Q150-W184 HydrophobicContact CB-CZ3 4.37Å; Q150-W184 HydrophobicContact CG-CD2 4.1Å; Q150-W184 HydrophobicContact CG-CE3 4.13Å; Q150-W184 HydrophobicContact CG-CH2 3.6Å; Q150-W184 HydrophobicContact CG-CZ2 3.56Å; Q150-W184 HydrophobicContact CG-CZ3 3.89Å; Q150-W184 VanDerWaalsContact NE2-CE2 3.29Å; Q150-W184 VanDerWaalsContact NE2-NE1 3.18Å
151	P	89.4	Confident	84.1	Confident	50 Å²	50	50.8 Å²	50.8	33%	0.325	29%	0.293	S	S	.	.	H	α-helix	trans	-58.5	-38.5	-179	-26.2	36.4	0	0	0	113	Q109 A147	Q109-P151 HydrophobicContact CG-CB 4.17Å; A147-P151 WeakPolarHBondContact O-CD 3.46Å
152	A	89.3	Confident	86.5	Confident	12 Å²	12	52 Å²	52	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-74.6	-37.8	179.8	0	0	0	0	0	111.7	L104 I112 I133 L149 Q150 L156	L104-A152 HydrophobicContact CD1-CB 4.42Å; I112-A152 VanDerWaalsContact CD1-CA 3.43Å; I112-A152 HydrophobicContact CD1-CB 3.5Å; I112-A152 WeakPolarHBondContact CD1-O 3.4Å; I133-A152 HydrophobicContact CD1-CB 3.48Å; I133-A152 VanDerWaalsContact CD1-CB 3.48Å; L149-A152 PolarHBondContact O-N 3.05Å; L149-A152 VanDerWaalsContact O-N 3.1Å; Q150-A152 PolarHBondContact O-N 2.97Å; A152-L156 WeakPolarHBondContact O-CG 3.36Å; A152-L156 PolarHBondContact O-N 3.07Å; A152-L156 VanDerWaalsContact O-N 3.17Å
153	W	93.3	Very high	88.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.7	-44.5	177.4	-158.6	-98.1	0	0	0	111.8	I133 L149 Q150 E155 L156 E157 I168 T170 L181 W184 V187 P189	I133-W153 HydrophobicContact CG2-CE3 4.47Å; I133-W153 HydrophobicContact CG2-CZ3 4.32Å; L149-W153 PolarHBondContact O-N 3.02Å; Q150-W153 PolarHBondContact O-N 2.84Å; Q150-W153 VanDerWaalsContact O-N 3.11Å; W153-E155 VanDerWaalsContact C-N 3.26Å; W153-E155 PolarHBondContact O-N 2.91Å; W153-L156 HydrophobicContact CE3-CD1 3.91Å; W153-L156 HydrophobicContact CZ3-CD1 4.12Å; W153-L156 CarbonylContact O-C 3.47Å; W153-L156 WeakPolarHBondContact O-CA 3.49Å; W153-L156 WeakPolarHBondContact O-CB 3.17Å; W153-L156 PolarHBondContact O-N 2.96Å; W153-E157 PolarHBondContact NE1-OE1 3.37Å; W153-E157 WeakPolarHBondContact O-CG 3.36Å; W153-E157 PolarHBondContact O-N 2.8Å; W153-I168 HydrophobicContact CD2-CD1 4.32Å; W153-I168 HydrophobicContact CH2-CB 4.22Å; W153-I168 HydrophobicContact CH2-CD1 3.83Å; W153-I168 HydrophobicContact CH2-CG1 3.81Å; W153-I168 HydrophobicContact CZ2-CD1 3.41Å; W153-I168 VanDerWaalsContact CZ2-CD1 3.41Å; W153-I168 HydrophobicContact CZ2-CG1 3.73Å; W153-I168 HydrophobicContact CZ3-CD1 4.44Å; W153-T170 HydrophobicContact CE3-CG2 4.12Å; W153-T170 HydrophobicContact CH2-CG2 3.93Å; W153-T170 HydrophobicContact CZ3-CG2 3.36Å; W153-L181 HydrophobicContact CB-CD1 4.3Å; W153-L181 HydrophobicContact CD2-CD1 3.84Å; W153-L181 HydrophobicContact CD2-CD2 4.18Å; W153-L181 HydrophobicContact CD2-CG 4.44Å; W153-L181 HydrophobicContact CE3-CD1 4.38Å; W153-L181 HydrophobicContact CE3-CD2 4.07Å; W153-L181 HydrophobicContact CG-CD1 3.78Å; W153-L181 HydrophobicContact CH2-CD2 4.23Å; W153-L181 HydrophobicContact CZ2-CD2 4.31Å; W153-L181 HydrophobicContact CZ3-CD2 4.11Å; W153-W184 HydrophobicContact CB-CH2 4.38Å; W153-W184 HydrophobicContact CB-CZ3 3.96Å; W153-W184 AromaticContact CD1-CZ3 3.7Å; W153-W184 HydrophobicContact CG-CZ3 4.07Å; W153-V187 PolarHBondContact NE1-O 3.39Å; W153-P189 HydrophobicContact CH2-CB 3.6Å; W153-P189 HydrophobicContact CZ2-CB 3.83Å; W153-P189 HydrophobicContact CZ2-CG 4.38Å
154	E	93.9	Very high	90.2	Very high	97 Å²	97	55.4 Å²	55.4	45%	0.453	27%	0.271	S	S	.	.	H	α-helix	trans	-55.9	-39.6	177.1	-71	177.2	163.8	0	0	112.6	Q150 E157 S158 W184	Q150-E154 WeakPolarHBondContact O-CG 3.44Å; Q150-E154 PolarHBondContact O-N 2.8Å; E154-E157 PolarHBondContact O-N 2.85Å; E154-S158 WeakPolarHBondContact O-CB 3.39Å; E154-S158 PolarHBondContact O-N 2.83Å; E154-W184 HydrophobicContact CG-CH2 3.83Å; E154-W184 HydrophobicContact CG-CZ2 4.17Å
155	E	93.1	Very high	91.5	Very high	25 Å²	25	51.4 Å²	51.4	12%	0.117	26%	0.255	C	S	.	.	H	α-helix	trans	-67.6	-40.3	174.2	-77.6	-61.8	139.3	0	0	112.2	Q109 I112 R113 W153 E157 S158 L159	Q109-E155 HydrophobicContact CB-CG 3.76Å; Q109-E155 HydrophobicContact CG-CG 4.03Å; I112-E155 HydrophobicContact CD1-CB 4.31Å; R113-E155 IonicContact CZ-OE2 3.42Å; R113-E155 IonicContact NE-OE2 3.3Å; R113-E155 PolarHBondContact NE-OE2 2.66Å; R113-E155 IonicContact NH2-OE1 2.76Å; R113-E155 PolarHBondContact NH2-OE1 3.46Å; R113-E155 IonicContact NH2-OE2 3.54Å; R113-E155 PolarHBondContact NH2-OE2 3.48Å; W153-E155 VanDerWaalsContact C-N 3.26Å; W153-E155 PolarHBondContact O-N 2.91Å; E155-E157 PolarHBondContact O-N 2.84Å; E155-S158 WeakPolarHBondContact O-CB 3.17Å; E155-S158 PolarHBondContact O-N 3.32Å; E155-L159 WeakPolarHBondContact O-CG 3.34Å; E155-L159 PolarHBondContact O-N 2.88Å
156	L	93.6	Very high	92.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-43.1	172.9	-70.9	172.1	0	0	0	111.5	I112 V131 I133 A152 W153 S158 L159 V160 I165 I168	I112-L156 HydrophobicContact CG2-CD2 3.71Å; I112-L156 HydrophobicContact CG2-CG 4.16Å; V131-L156 HydrophobicContact CG1-CD2 4.07Å; I133-L156 HydrophobicContact CB-CD1 4.05Å; I133-L156 HydrophobicContact CD1-CD1 4.15Å; I133-L156 HydrophobicContact CG2-CD1 4.07Å; A152-L156 WeakPolarHBondContact O-CG 3.36Å; A152-L156 PolarHBondContact O-N 3.07Å; A152-L156 VanDerWaalsContact O-N 3.17Å; W153-L156 HydrophobicContact CE3-CD1 3.91Å; W153-L156 HydrophobicContact CZ3-CD1 4.12Å; W153-L156 CarbonylContact O-C 3.47Å; W153-L156 WeakPolarHBondContact O-CA 3.49Å; W153-L156 WeakPolarHBondContact O-CB 3.17Å; W153-L156 PolarHBondContact O-N 2.96Å; L156-S158 VanDerWaalsContact C-N 3.32Å; L156-S158 PolarHBondContact O-N 3.28Å; L156-L159 PolarHBondContact O-N 3.05Å; L156-L159 VanDerWaalsContact O-N 3.16Å; L156-V160 WeakPolarHBondContact O-CG2 3.39Å; L156-V160 PolarHBondContact O-N 2.82Å; L156-I165 HydrophobicContact CD2-CD1 3.93Å; L156-I168 HydrophobicContact CB-CB 4.49Å; L156-I168 HydrophobicContact CB-CD1 3.92Å; L156-I168 HydrophobicContact CB-CG2 4.06Å; L156-I168 HydrophobicContact CD2-CG2 4.27Å
157	E	96.1	Very high	92.6	Very high	14 Å²	14	52 Å²	52	7%	0.065	27%	0.267	C	S	.	.	H	α-helix	trans	-61.5	-40.1	175.2	-62.7	-169.2	152.7	0	0	112	W153 E154 E155 L159 V160 R161 I168 Q186 V187	W153-E157 PolarHBondContact NE1-OE1 3.37Å; W153-E157 WeakPolarHBondContact O-CG 3.36Å; W153-E157 PolarHBondContact O-N 2.8Å; E154-E157 PolarHBondContact O-N 2.85Å; E155-E157 PolarHBondContact O-N 2.84Å; E157-L159 VanDerWaalsContact C-N 3.35Å; E157-V160 PolarHBondContact O-N 2.75Å; E157-R161 WeakPolarHBondContact O-CG 3.48Å; E157-R161 PolarHBondContact O-N 3.01Å; E157-R161 PolarHBondContact O-NE 2.82Å; E157-I168 HydrophobicContact CG-CD1 4.47Å; E157-Q186 WeakPolarHBondContact OE1-CA 3.34Å; E157-Q186 PolarHBondContact OE1-N 3.46Å; E157-V187 HydrophobicContact CB-CB 4.46Å; E157-V187 HydrophobicContact CB-CG2 3.98Å; E157-V187 HydrophobicContact CG-CB 3.92Å; E157-V187 HydrophobicContact CG-CG2 3.96Å; E157-V187 PolarHBondContact OE1-N 2.82Å
158	S	95.9	Very high	93.1	Very high	17 Å²	17	49.2 Å²	49.2	12%	0.119	24%	0.244	C	C	.	.	H	α-helix	trans	-60.4	-43.2	173.3	179.5	0	0	0	0	111.6	E154 E155 L156 R161 K162	E154-S158 WeakPolarHBondContact O-CB 3.39Å; E154-S158 PolarHBondContact O-N 2.83Å; E155-S158 WeakPolarHBondContact O-CB 3.17Å; E155-S158 PolarHBondContact O-N 3.32Å; L156-S158 VanDerWaalsContact C-N 3.32Å; L156-S158 PolarHBondContact O-N 3.28Å; S158-R161 PolarHBondContact O-N 2.79Å; S158-K162 WeakPolarHBondContact O-CB 3.31Å; S158-K162 VanDerWaalsContact O-CG 3.31Å; S158-K162 WeakPolarHBondContact O-CG 3.4Å; S158-K162 PolarHBondContact O-N 2.72Å
159	L	94.9	Very high	93.7	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-68.7	-35.3	178	-70	170.1	0	0	0	112.8	I112 R113 V116 E155 L156 E157 K162 Q163 K164 I165	I112-L159 HydrophobicContact CG2-CD1 4Å; R113-L159 HydrophobicContact CG-CD2 4.33Å; V116-L159 HydrophobicContact CB-CD1 4.07Å; V116-L159 HydrophobicContact CG1-CD1 4.25Å; V116-L159 HydrophobicContact CG1-CD2 4.49Å; V116-L159 HydrophobicContact CG2-CD1 3.97Å; E155-L159 WeakPolarHBondContact O-CG 3.34Å; E155-L159 PolarHBondContact O-N 2.88Å; L156-L159 PolarHBondContact O-N 3.05Å; L156-L159 VanDerWaalsContact O-N 3.16Å; E157-L159 VanDerWaalsContact C-N 3.35Å; L159-K162 PolarHBondContact O-N 2.93Å; L159-Q163 PolarHBondContact O-N 2.95Å; L159-K164 HydrophobicContact CB-CB 4.37Å; L159-K164 HydrophobicContact CD2-CB 4.13Å; L159-K164 HydrophobicContact CD2-CG 4.29Å; L159-K164 PolarHBondContact O-N 3.35Å; L159-I165 HydrophobicContact CB-CD1 3.58Å; L159-I165 HydrophobicContact CB-CG1 4.04Å; L159-I165 HydrophobicContact CD1-CD1 3.86Å; L159-I165 HydrophobicContact CG-CD1 4.37Å; L159-I165 PolarHBondContact O-N 2.82Å
160	V	96.3	Very high	94	Very high	30 Å²	30	42.9 Å²	42.9	18%	0.182	21%	0.214	C	C	.	.	H	α-helix	trans	-65.1	-46.7	172.1	173.4	0	0	0	0	110.7	L156 E157 K162 Q163 I165 I168 V187	L156-V160 WeakPolarHBondContact O-CG2 3.39Å; L156-V160 PolarHBondContact O-N 2.82Å; E157-V160 PolarHBondContact O-N 2.75Å; V160-K162 PolarHBondContact O-N 3Å; V160-Q163 WeakPolarHBondContact O-CA 3.45Å; V160-Q163 PolarHBondContact O-N 2.87Å; V160-I165 WeakPolarHBondContact CA-O 3.49Å; V160-I165 HydrophobicContact CG2-CB 4.07Å; V160-I165 HydrophobicContact CG2-CG2 4.35Å; V160-I168 HydrophobicContact CG2-CD1 4.3Å; V160-I168 HydrophobicContact CG2-CG1 4.31Å; V160-I168 HydrophobicContact CG2-CG2 3.5Å; V160-V187 HydrophobicContact CB-CG1 4.43Å; V160-V187 HydrophobicContact CB-CG2 4.43Å; V160-V187 HydrophobicContact CG1-CG1 4.05Å; V160-V187 HydrophobicContact CG1-CG2 4.3Å; V160-V187 HydrophobicContact CG2-CG1 4.34Å
161	R	96.6	Very high	94	Very high	181 Å²	181	40.3 Å²	40.3	68%	0.683	20%	0.202	S	C	*	.	H	α-helix	trans	-60.4	-34.2	176.3	-75	-178.4	-70.6	144	-8.2	112.9	E157 S158 Q163	E157-R161 WeakPolarHBondContact O-CG 3.48Å; E157-R161 PolarHBondContact O-N 3.01Å; E157-R161 PolarHBondContact O-NE 2.82Å; S158-R161 PolarHBondContact O-N 2.79Å; R161-Q163 PolarHBondContact O-N 3.02Å
162	K	95.7	Very high	94	Very high	115 Å²	115	40.3 Å²	40.3	50%	0.5	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	4.8	174.1	-69.8	174.9	-177.4	178.8	0	113.9	S158 L159 V160 K164	S158-K162 WeakPolarHBondContact O-CB 3.31Å; S158-K162 VanDerWaalsContact O-CG 3.31Å; S158-K162 WeakPolarHBondContact O-CG 3.4Å; S158-K162 PolarHBondContact O-N 2.72Å; L159-K162 PolarHBondContact O-N 2.93Å; V160-K162 PolarHBondContact O-N 3Å; K162-K164 HydrophobicContact CB-CG 4.22Å; K162-K164 PolarHBondContact O-N 3.1Å
163	Q	94.8	Very high	94	Very high	146 Å²	146	40 Å²	40	68%	0.682	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.1	28.3	-178.1	-57.6	-179	-25.6	0	0	113.7	Q127 L159 V160 R161	Q127-Q163 WeakPolarHBondContact CB-O 3.43Å; Q127-Q163 VanDerWaalsContact CG-O 3.22Å; Q127-Q163 WeakPolarHBondContact CG-O 3.35Å; Q127-Q163 PolarHBondContact NE2-O 2.68Å; L159-Q163 PolarHBondContact O-N 2.95Å; V160-Q163 WeakPolarHBondContact O-CA 3.45Å; V160-Q163 PolarHBondContact O-N 2.87Å; R161-Q163 PolarHBondContact O-N 3.02Å
164	K	94.3	Very high	93.8	Very high	73 Å²	73	44.5 Å²	44.5	32%	0.317	22%	0.22	S	C	.	.	S	Bend	trans	-85.4	-24.1	172.8	-65.7	-61.1	-172.5	178.1	0	112.4	V116 Q127 L128 L159 K162	V116-K164 HydrophobicContact CG1-CB 4.26Å; Q127-K164 WeakPolarHBondContact CA-O 3.32Å; L128-K164 PolarHBondContact N-O 3Å; L159-K164 HydrophobicContact CB-CB 4.37Å; L159-K164 HydrophobicContact CD2-CB 4.13Å; L159-K164 HydrophobicContact CD2-CG 4.29Å; L159-K164 PolarHBondContact O-N 3.35Å; K162-K164 HydrophobicContact CB-CG 4.22Å; K162-K164 PolarHBondContact O-N 3.1Å
165	I	95.1	Very high	93.6	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	136.6	176.7	-53.5	169.2	0	0	0	108.1	V116 Q127 L128 V131 L156 L159 V160 A167 I168	V116-I165 HydrophobicContact CG1-CD1 4.2Å; V116-I165 HydrophobicContact CG1-CG1 3.9Å; V116-I165 HydrophobicContact CG2-CD1 4.01Å; V116-I165 HydrophobicContact CG2-CG1 4.49Å; Q127-I165 PolarHBondContact NE2-O 3.42Å; L128-I165 CarbonylContact O-C 3.57Å; L128-I165 WeakPolarHBondContact O-CA 3.43Å; V131-I165 HydrophobicContact CB-CD1 4.09Å; V131-I165 HydrophobicContact CB-CG2 4.11Å; V131-I165 HydrophobicContact CG2-CB 4.43Å; V131-I165 HydrophobicContact CG2-CD1 3.72Å; V131-I165 HydrophobicContact CG2-CG1 3.81Å; V131-I165 HydrophobicContact CG2-CG2 3.77Å; L156-I165 HydrophobicContact CD2-CD1 3.93Å; L159-I165 HydrophobicContact CB-CD1 3.58Å; L159-I165 HydrophobicContact CB-CG1 4.04Å; L159-I165 HydrophobicContact CD1-CD1 3.86Å; L159-I165 HydrophobicContact CG-CD1 4.37Å; L159-I165 PolarHBondContact O-N 2.82Å; V160-I165 WeakPolarHBondContact CA-O 3.49Å; V160-I165 HydrophobicContact CG2-CB 4.07Å; V160-I165 HydrophobicContact CG2-CG2 4.35Å; I165-A167 WeakPolarHBondContact CG2-O 3.42Å; I165-I168 HydrophobicContact CB-CG2 4.38Å; I165-I168 HydrophobicContact CD1-CG2 4.21Å; I165-I168 HydrophobicContact CG2-CG2 3.7Å
166	A	94.5	Very high	93.6	Very high	54 Å²	54	47.9 Å²	47.9	45%	0.446	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-39.9	175.8	0	0	0	0	0	112.2	Q127 L128	Q127-A166 HydrophobicContact CG-CB 4.49Å; L128-A166 PolarHBondContact O-N 3.3Å
167	A	94.7	Very high	93.5	Very high	28 Å²	28	48.4 Å²	48.4	23%	0.231	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	144.7	-179.7	0	0	0	0	0	112.2	D129 S130 V131 I165 S190	D129-A167 PolarHBondContact O-N 3.11Å; D129-A167 VanDerWaalsContact O-N 3.16Å; S130-A167 VanDerWaalsContact CA-O 3.26Å; S130-A167 WeakPolarHBondContact CA-O 3.42Å; V131-A167 PolarHBondContact N-O 2.79Å; I165-A167 WeakPolarHBondContact CG2-O 3.42Å; A167-S190 WeakPolarHBondContact CB-OG 3.42Å
168	I	95.6	Very high	93.4	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	143.9	-178.4	57.4	172.9	0	0	0	110.6	V131 W153 L156 E157 V160 I165 V187 P189 S190	V131-I168 CarbonylContact O-C 3.48Å; V131-I168 WeakPolarHBondContact O-CA 3.28Å; W153-I168 HydrophobicContact CD2-CD1 4.32Å; W153-I168 HydrophobicContact CH2-CB 4.22Å; W153-I168 HydrophobicContact CH2-CD1 3.83Å; W153-I168 HydrophobicContact CH2-CG1 3.81Å; W153-I168 HydrophobicContact CZ2-CD1 3.41Å; W153-I168 VanDerWaalsContact CZ2-CD1 3.41Å; W153-I168 HydrophobicContact CZ2-CG1 3.73Å; W153-I168 HydrophobicContact CZ3-CD1 4.44Å; L156-I168 HydrophobicContact CB-CB 4.49Å; L156-I168 HydrophobicContact CB-CD1 3.92Å; L156-I168 HydrophobicContact CB-CG2 4.06Å; L156-I168 HydrophobicContact CD2-CG2 4.27Å; E157-I168 HydrophobicContact CG-CD1 4.47Å; V160-I168 HydrophobicContact CG2-CD1 4.3Å; V160-I168 HydrophobicContact CG2-CG1 4.31Å; V160-I168 HydrophobicContact CG2-CG2 3.5Å; I165-I168 HydrophobicContact CB-CG2 4.38Å; I165-I168 HydrophobicContact CD1-CG2 4.21Å; I165-I168 HydrophobicContact CG2-CG2 3.7Å; I168-V187 HydrophobicContact CD1-CB 4.02Å; I168-V187 HydrophobicContact CD1-CG1 3.84Å; I168-V187 HydrophobicContact CG1-CG1 4.01Å; I168-P189 CarbonylContact O-C 3.56Å; I168-P189 WeakPolarHBondContact O-CA 3.25Å; I168-S190 PolarHBondContact O-N 2.9Å; I168-S190 PolarHBondContact O-OG 2.92Å
169	G	94.5	Very high	93.3	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	175.1	-178.1	0	0	0	0	0	113.1	V131 I132 I133 S191	V131-G169 PolarHBondContact O-N 3.22Å; I132-G169 WeakPolarHBondContact CA-O 3.25Å; I133-G169 PolarHBondContact N-O 3.46Å; G169-S191 CarbonylContact C-O 3.59Å; G169-S191 WeakPolarHBondContact CA-O 3.48Å
170	T	92.6	Very high	93.3	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	167.9	-175.6	57.3	0	0	0	0	112	I132 I133 L149 W153 L173 L181 S191 N192 Q193	I132-T170 WeakPolarHBondContact CG2-O 3.33Å; I133-T170 HydrophobicContact CG2-CG2 4.29Å; I133-T170 CarbonylContact O-C 3.58Å; L149-T170 HydrophobicContact CD2-CG2 4.45Å; W153-T170 HydrophobicContact CE3-CG2 4.12Å; W153-T170 HydrophobicContact CH2-CG2 3.93Å; W153-T170 HydrophobicContact CZ3-CG2 3.36Å; T170-L173 HydrophobicContact CG2-CD1 3.7Å; T170-L173 HydrophobicContact CG2-CG 4.38Å; T170-L181 HydrophobicContact CG2-CD2 3.58Å; T170-S191 PolarHBondContact N-O 2.61Å; T170-N192 CarbonylContact O-C 3.57Å; T170-N192 WeakPolarHBondContact O-CA 3.09Å; T170-N192 PolarHBondContact O-OD1 3.22Å; T170-N192 PolarHBondContact OG1-OD1 2.73Å; T170-Q193 PolarHBondContact O-N 2.64Å
171	S	90.4	Very high	93.3	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	136.7	172	-165.6	0	0	0	0	109.8	K101 I133 L173 H220	K101-S171 WeakPolarHBondContact CE-OG 3.49Å; K101-S171 PolarHBondContact NZ-OG 3.46Å; I133-S171 PolarHBondContact O-N 3.41Å; S171-L173 VanDerWaalsContact C-N 3.27Å; S171-L173 PolarHBondContact O-N 2.93Å; S171-H220 PolarHBondContact OG-NE2 3.44Å
172	D	88.3	Confident	93.2	Very high	51 Å²	51	46.4 Å²	46.4	27%	0.273	23%	0.231	S	C	.	.	S	Bend	trans	57.3	35.8	170.3	-54.9	-63.6	0	0	0	113.9	R144 Q193 N195 H220	R144-D172 PolarHBondContact NH1-O 3.48Å; D172-Q193 PolarHBondContact N-O 3.26Å; D172-N195 VanDerWaalsContact OD1-CB 3.24Å; D172-N195 WeakPolarHBondContact OD1-CB 3.39Å; D172-N195 PolarHBondContact OD1-N 2.74Å; D172-H220 IonicContact OD1-CE1 3.1Å; D172-H220 IonicContact OD1-NE2 2.92Å; D172-H220 PolarHBondContact OD1-NE2 3Å; D172-H220 VanDerWaalsContact OD1-NE2 3.1Å; D172-H220 IonicContact OD2-CE1 3.13Å; D172-H220 PolarHBondContact OD2-CE1 3.19Å; D172-H220 VanDerWaalsContact OD2-CE1 3.24Å; D172-H220 IonicContact OD2-NE2 3.21Å; D172-H220 PolarHBondContact OD2-NE2 3.3Å; D172-H220 VanDerWaalsContact OD2-NE2 3.13Å
173	L	89.6	Confident	93.2	Very high	6 Å²	6	45.9 Å²	45.9	3%	0.031	23%	0.234	C	C	.	.			trans	-85.4	133.5	164.5	-57.4	-167.8	0	0	0	109.5	L149 T170 S171 L177 L178 L181 N192	L149-L173 HydrophobicContact CD2-CD1 3.88Å; L149-L173 HydrophobicContact CD2-CD2 4.39Å; T170-L173 HydrophobicContact CG2-CD1 3.7Å; T170-L173 HydrophobicContact CG2-CG 4.38Å; S171-L173 VanDerWaalsContact C-N 3.27Å; S171-L173 PolarHBondContact O-N 2.93Å; L173-L177 HydrophobicContact CD1-CG 4.49Å; L173-L177 HydrophobicContact CD2-CD2 3.7Å; L173-L177 HydrophobicContact CD2-CG 4.08Å; L173-L178 HydrophobicContact CB-CB 4.16Å; L173-L178 HydrophobicContact CD1-CD1 4.37Å; L173-L181 HydrophobicContact CD1-CD2 3.89Å; L173-N192 PolarHBondContact O-ND2 2.82Å
174	D	89.7	Confident	93.4	Very high	94 Å²	94	42.8 Å²	42.8	50%	0.503	22%	0.216	S	C	.	.			trans	-73.4	177.4	166.9	61.2	31.1	0	0	0	111.1	E176 L177 L178	D174-E176 PolarHBondContact O-N 2.67Å; D174-E176 PolarHBondContact OD1-N 2.8Å; D174-L177 VanDerWaalsContact OD1-CB 3.25Å; D174-L177 WeakPolarHBondContact OD1-CB 3.39Å; D174-L177 PolarHBondContact OD1-N 3.08Å; D174-L178 WeakPolarHBondContact O-CB 3.48Å; D174-L178 PolarHBondContact O-N 3.24Å
175	K	90.3	Very high	93.5	Very high	62 Å²	62	39.4 Å²	39.4	27%	0.27	20%	0.201	S	C	.	.	H	α-helix	trans	-60.9	-44.5	-178.4	-177.7	-90.5	-176	-173	0	111.8	E179 L206 F209	K175-E179 WeakPolarHBondContact CE-OE2 3.38Å; K175-E179 IonicContact NZ-OE2 3.61Å; K175-E179 PolarHBondContact NZ-OE2 3.38Å; K175-E179 VanDerWaalsContact O-CB 3.23Å; K175-E179 WeakPolarHBondContact O-CB 3.47Å; K175-E179 PolarHBondContact O-N 3.4Å; K175-L206 HydrophobicContact CB-CB 4.28Å; K175-L206 HydrophobicContact CB-CD1 4.31Å; K175-F209 HydrophobicContact CG-CB 4.4Å
176	E	91.9	Very high	93.5	Very high	131 Å²	131	47 Å²	47	61%	0.612	24%	0.237	S	C	*	.	H	α-helix	trans	-65.1	-47.3	-175.3	-65.2	-177.6	-176.2	0	0	111.5	D174 E179 Q180	D174-E176 PolarHBondContact O-N 2.67Å; D174-E176 PolarHBondContact OD1-N 2.8Å; E176-E179 PolarHBondContact O-N 2.9Å; E176-Q180 WeakPolarHBondContact O-CB 3.49Å; E176-Q180 VanDerWaalsContact O-CG 3.26Å; E176-Q180 WeakPolarHBondContact O-CG 3.38Å; E176-Q180 PolarHBondContact O-N 2.81Å
177	L	91.6	Very high	93.6	Very high	11 Å²	11	46.2 Å²	46.2	6%	0.058	23%	0.226	C	C	.	.	H	α-helix	trans	-73.6	-36.3	-178.8	-173.2	54.5	0	0	0	112	R144 L146 L173 D174 E179 Q180 L181	R144-L177 HydrophobicContact CB-CD2 3.84Å; L146-L177 HydrophobicContact CB-CD1 3.95Å; L173-L177 HydrophobicContact CD1-CG 4.49Å; L173-L177 HydrophobicContact CD2-CD2 3.7Å; L173-L177 HydrophobicContact CD2-CG 4.08Å; D174-L177 VanDerWaalsContact OD1-CB 3.25Å; D174-L177 WeakPolarHBondContact OD1-CB 3.39Å; D174-L177 PolarHBondContact OD1-N 3.08Å; L177-E179 VanDerWaalsContact C-N 3.35Å; L177-Q180 PolarHBondContact O-N 3.11Å; L177-L181 WeakPolarHBondContact O-CB 3.28Å; L177-L181 PolarHBondContact O-N 2.95Å
178	L	93.6	Very high	93.7	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.1	-42.2	173.4	-178.8	62.8	0	0	0	111.3	L173 D174 L181 Y182 P189 N192 L206 F209 I215	L173-L178 HydrophobicContact CB-CB 4.16Å; L173-L178 HydrophobicContact CD1-CD1 4.37Å; D174-L178 WeakPolarHBondContact O-CB 3.48Å; D174-L178 PolarHBondContact O-N 3.24Å; L178-L181 PolarHBondContact O-N 2.68Å; L178-Y182 VanDerWaalsContact O-CB 3.26Å; L178-Y182 WeakPolarHBondContact O-CB 3.24Å; L178-Y182 PolarHBondContact O-N 3.3Å; L178-P189 HydrophobicContact CD1-CB 4.44Å; L178-P189 HydrophobicContact CD1-CG 3.97Å; L178-N192 HydrophobicContact CD1-CB 4.33Å; L178-N192 HydrophobicContact CD2-CB 4.16Å; L178-L206 HydrophobicContact CD2-CD1 3.67Å; L178-F209 HydrophobicContact CD2-CD1 4.14Å; L178-F209 HydrophobicContact CD2-CE1 4.3Å; L178-F209 HydrophobicContact CG-CD1 4.4Å; L178-F209 HydrophobicContact CG-CE1 4.11Å; L178-I215 HydrophobicContact CD1-CD1 4.32Å; L178-I215 HydrophobicContact CD2-CD1 4.06Å; L178-I215 HydrophobicContact CG-CD1 4.23Å
179	E	95.3	Very high	93.7	Very high	64 Å²	64	48.9 Å²	48.9	30%	0.299	23%	0.233	S	C	.	.	H	α-helix	trans	-65.5	-44.5	176.5	178.2	173.2	-160	0	0	111.9	K175 E176 L177 L181 Y182 N183 F209	K175-E179 WeakPolarHBondContact CE-OE2 3.38Å; K175-E179 IonicContact NZ-OE2 3.61Å; K175-E179 PolarHBondContact NZ-OE2 3.38Å; K175-E179 VanDerWaalsContact O-CB 3.23Å; K175-E179 WeakPolarHBondContact O-CB 3.47Å; K175-E179 PolarHBondContact O-N 3.4Å; E176-E179 PolarHBondContact O-N 2.9Å; L177-E179 VanDerWaalsContact C-N 3.35Å; E179-L181 PolarHBondContact O-N 3.33Å; E179-Y182 PolarHBondContact O-N 2.77Å; E179-N183 WeakPolarHBondContact O-CB 3.47Å; E179-N183 VanDerWaalsContact O-CG 3.31Å; E179-N183 PolarHBondContact O-N 2.88Å; E179-N183 PolarHBondContact O-ND2 3.39Å; E179-N183 VanDerWaalsContact O-ND2 3.15Å; E179-F209 HydrophobicContact CB-CD2 4.45Å; E179-F209 HydrophobicContact CB-CE1 4.28Å; E179-F209 HydrophobicContact CB-CE2 3.79Å; E179-F209 HydrophobicContact CB-CZ 3.71Å; E179-F209 HydrophobicContact CG-CD2 4.49Å; E179-F209 HydrophobicContact CG-CE2 3.64Å; E179-F209 HydrophobicContact CG-CZ 3.9Å
180	Q	94.9	Very high	93.8	Very high	95 Å²	95	50.9 Å²	50.9	44%	0.444	25%	0.247	S	C	.	.	H	α-helix	trans	-58.3	-47.2	174.4	-75.4	175.8	39	0	0	111.7	L146 E176 L177 N183 W184	L146-Q180 HydrophobicContact CD2-CB 4.2Å; E176-Q180 WeakPolarHBondContact O-CB 3.49Å; E176-Q180 VanDerWaalsContact O-CG 3.26Å; E176-Q180 WeakPolarHBondContact O-CG 3.38Å; E176-Q180 PolarHBondContact O-N 2.81Å; L177-Q180 PolarHBondContact O-N 3.11Å; Q180-N183 PolarHBondContact O-N 3.15Å; Q180-W184 WeakPolarHBondContact O-CB 3.45Å; Q180-W184 PolarHBondContact O-N 2.57Å
181	L	94.8	Very high	93.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.3	-47.7	175.9	177.3	69.4	0	0	0	111	L146 L149 W153 T170 L173 L177 L178 E179 N183 W184 A185 P189	L146-L181 HydrophobicContact CD1-CB 3.94Å; L146-L181 HydrophobicContact CD1-CD1 3.87Å; L149-L181 HydrophobicContact CD2-CD1 4.01Å; L149-L181 HydrophobicContact CD2-CD2 3.74Å; L149-L181 HydrophobicContact CD2-CG 4.35Å; L149-L181 HydrophobicContact CG-CD1 4.44Å; W153-L181 HydrophobicContact CB-CD1 4.3Å; W153-L181 HydrophobicContact CD2-CD1 3.84Å; W153-L181 HydrophobicContact CD2-CD2 4.18Å; W153-L181 HydrophobicContact CD2-CG 4.44Å; W153-L181 HydrophobicContact CE3-CD1 4.38Å; W153-L181 HydrophobicContact CE3-CD2 4.07Å; W153-L181 HydrophobicContact CG-CD1 3.78Å; W153-L181 HydrophobicContact CH2-CD2 4.23Å; W153-L181 HydrophobicContact CZ2-CD2 4.31Å; W153-L181 HydrophobicContact CZ3-CD2 4.11Å; T170-L181 HydrophobicContact CG2-CD2 3.58Å; L173-L181 HydrophobicContact CD1-CD2 3.89Å; L177-L181 WeakPolarHBondContact O-CB 3.28Å; L177-L181 PolarHBondContact O-N 2.95Å; L178-L181 PolarHBondContact O-N 2.68Å; E179-L181 PolarHBondContact O-N 3.33Å; L181-N183 VanDerWaalsContact C-N 3.3Å; L181-N183 PolarHBondContact O-N 3.08Å; L181-W184 HydrophobicContact CD1-CE3 4.01Å; L181-W184 HydrophobicContact CD1-CZ3 4.08Å; L181-W184 PolarHBondContact O-N 3.08Å; L181-A185 HydrophobicContact CD1-CB 4.48Å; L181-A185 WeakPolarHBondContact O-CB 3.36Å; L181-A185 PolarHBondContact O-N 3.34Å; L181-P189 HydrophobicContact CD2-CG 4.35Å
182	Y	96	Very high	94.1	Very high	41 Å²	41	50.9 Å²	50.9	16%	0.161	25%	0.247	C	C	.	.	H	α-helix	trans	-59	-43.2	-179.1	-172.1	-84.2	0	0	0	111.3	L178 E179 K188 P189 F209 F213 I215	L178-Y182 VanDerWaalsContact O-CB 3.26Å; L178-Y182 WeakPolarHBondContact O-CB 3.24Å; L178-Y182 PolarHBondContact O-N 3.3Å; E179-Y182 PolarHBondContact O-N 2.77Å; Y182-K188 HydrophobicContact CD1-CD 4.26Å; Y182-K188 HydrophobicContact CD2-CB 4.1Å; Y182-K188 HydrophobicContact CD2-CD 4.17Å; Y182-K188 HydrophobicContact CD2-CG 4.4Å; Y182-K188 HydrophobicContact CE1-CD 4.08Å; Y182-K188 HydrophobicContact CE1-CG 4.48Å; Y182-K188 HydrophobicContact CE2-CB 3.67Å; Y182-K188 HydrophobicContact CE2-CD 4.03Å; Y182-K188 HydrophobicContact CE2-CG 3.85Å; Y182-K188 HydrophobicContact CG-CD 4.29Å; Y182-K188 WeakPolarHBondContact O-CD 3.44Å; Y182-K188 WeakPolarHBondContact O-CE 3.48Å; Y182-K188 PolarHBondContact O-NZ 3.32Å; Y182-P189 HydrophobicContact CD2-CG 4.05Å; Y182-F209 HydrophobicContact CG-CZ 4.3Å; Y182-F213 HydrophobicContact CD1-CD1 4.24Å; Y182-F213 HydrophobicContact CD2-CB 4.41Å; Y182-F213 HydrophobicContact CE1-CB 4.36Å; Y182-F213 AromaticContact CE1-CD1 3.44Å; Y182-F213 HydrophobicContact CE1-CD1 3.44Å; Y182-F213 VanDerWaalsContact CE1-CD1 3.44Å; Y182-F213 AromaticContact CE1-CE1 3.91Å; Y182-F213 HydrophobicContact CE1-CE1 3.91Å; Y182-F213 AromaticContact CE1-CG 4Å; Y182-F213 HydrophobicContact CE1-CG 4Å; Y182-F213 HydrophobicContact CE2-CB 3.76Å; Y182-F213 HydrophobicContact CE2-CD1 4.35Å; Y182-F213 HydrophobicContact CE2-CG 4.27Å; Y182-F213 AromaticContact CZ-CD1 3.5Å; Y182-F213 VanDerWaalsContact CZ-CD1 3.5Å; Y182-F213 AromaticContact CZ-CG 3.86Å; Y182-F213 WeakPolarHBondContact OH-CD1 3.39Å; Y182-I215 HydrophobicContact CD2-CD1 3.77Å; Y182-I215 HydrophobicContact CD2-CG1 4.43Å; Y182-I215 HydrophobicContact CE2-CD1 4.16Å; Y182-I215 HydrophobicContact CE2-CG1 4.37Å
183	N	95.8	Very high	94.2	Very high	105 Å²	105	49.1 Å²	49.1	56%	0.561	24%	0.237	S	C	*	.	H	α-helix	trans	-69.1	-38.5	-179.8	-73.4	-33.8	0	0	0	112.6	E179 Q180 L181	E179-N183 WeakPolarHBondContact O-CB 3.47Å; E179-N183 VanDerWaalsContact O-CG 3.31Å; E179-N183 PolarHBondContact O-N 2.88Å; E179-N183 PolarHBondContact O-ND2 3.39Å; E179-N183 VanDerWaalsContact O-ND2 3.15Å; Q180-N183 PolarHBondContact O-N 3.15Å; L181-N183 VanDerWaalsContact C-N 3.3Å; L181-N183 PolarHBondContact O-N 3.08Å
184	W	97.1	Very high	94.1	Very high	81 Å²	81	49.6 Å²	49.6	31%	0.307	24%	0.24	S	C	.	.	H	α-helix	trans	-78.7	-39	-178.9	168.7	83.7	0	0	0	113.6	L146 Q150 W153 E154 Q180 L181	L146-W184 HydrophobicContact CD1-CE3 4.47Å; L146-W184 HydrophobicContact CD2-CB 4.07Å; L146-W184 HydrophobicContact CD2-CG 4.24Å; Q150-W184 HydrophobicContact CB-CH2 3.77Å; Q150-W184 HydrophobicContact CB-CZ2 3.92Å; Q150-W184 HydrophobicContact CB-CZ3 4.37Å; Q150-W184 HydrophobicContact CG-CD2 4.1Å; Q150-W184 HydrophobicContact CG-CE3 4.13Å; Q150-W184 HydrophobicContact CG-CH2 3.6Å; Q150-W184 HydrophobicContact CG-CZ2 3.56Å; Q150-W184 HydrophobicContact CG-CZ3 3.89Å; Q150-W184 VanDerWaalsContact NE2-CE2 3.29Å; Q150-W184 VanDerWaalsContact NE2-NE1 3.18Å; W153-W184 HydrophobicContact CB-CH2 4.38Å; W153-W184 HydrophobicContact CB-CZ3 3.96Å; W153-W184 AromaticContact CD1-CZ3 3.7Å; W153-W184 HydrophobicContact CG-CZ3 4.07Å; E154-W184 HydrophobicContact CG-CH2 3.83Å; E154-W184 HydrophobicContact CG-CZ2 4.17Å; Q180-W184 WeakPolarHBondContact O-CB 3.45Å; Q180-W184 PolarHBondContact O-N 2.57Å; L181-W184 HydrophobicContact CD1-CE3 4.01Å; L181-W184 HydrophobicContact CD1-CZ3 4.08Å; L181-W184 PolarHBondContact O-N 3.08Å
185	A	96.3	Very high	93.9	Very high	2 Å²	2	45.6 Å²	45.6	2%	0.017	22%	0.219	C	C	.	.			trans	-66.4	142.5	-171.9	0	0	0	0	0	113.4	L181 V187 K188	L181-A185 HydrophobicContact CD1-CB 4.48Å; L181-A185 WeakPolarHBondContact O-CB 3.36Å; L181-A185 PolarHBondContact O-N 3.34Å; A185-V187 WeakPolarHBondContact CB-O 3.36Å; A185-K188 PolarHBondContact O-NZ 3.26Å
186	Q	96.4	Very high	93.4	Very high	160 Å²	160	47 Å²	47	75%	0.748	23%	0.229	S	C	*	.	S	Bend	trans	-79	-43	171	-59.5	-59.1	-44.2	0	0	111.1	E157	E157-Q186 WeakPolarHBondContact OE1-CA 3.34Å; E157-Q186 PolarHBondContact OE1-N 3.46Å
187	V	96.8	Very high	92.6	Very high	38 Å²	38	45.1 Å²	45.1	23%	0.23	24%	0.236	C	C	.	.	S	Bend	trans	-99	115.6	170.3	-174.8	0	0	0	0	108.1	W153 E157 V160 I168 A185	W153-V187 PolarHBondContact NE1-O 3.39Å; E157-V187 HydrophobicContact CB-CB 4.46Å; E157-V187 HydrophobicContact CB-CG2 3.98Å; E157-V187 HydrophobicContact CG-CB 3.92Å; E157-V187 HydrophobicContact CG-CG2 3.96Å; E157-V187 PolarHBondContact OE1-N 2.82Å; V160-V187 HydrophobicContact CB-CG1 4.43Å; V160-V187 HydrophobicContact CB-CG2 4.43Å; V160-V187 HydrophobicContact CG1-CG1 4.05Å; V160-V187 HydrophobicContact CG1-CG2 4.3Å; V160-V187 HydrophobicContact CG2-CG1 4.34Å; I168-V187 HydrophobicContact CD1-CB 4.02Å; I168-V187 HydrophobicContact CD1-CG1 3.84Å; I168-V187 HydrophobicContact CG1-CG1 4.01Å; A185-V187 WeakPolarHBondContact CB-O 3.36Å
188	K	96.4	Very high	91.5	Very high	82 Å²	82	48.8 Å²	48.8	36%	0.357	26%	0.262	S	S	.	.			trans	-71.6	143.2	-175	-54.9	-53.3	-176.4	-172.1	0	111.5	Y182 A185 S190	Y182-K188 HydrophobicContact CD1-CD 4.26Å; Y182-K188 HydrophobicContact CD2-CB 4.1Å; Y182-K188 HydrophobicContact CD2-CD 4.17Å; Y182-K188 HydrophobicContact CD2-CG 4.4Å; Y182-K188 HydrophobicContact CE1-CD 4.08Å; Y182-K188 HydrophobicContact CE1-CG 4.48Å; Y182-K188 HydrophobicContact CE2-CB 3.67Å; Y182-K188 HydrophobicContact CE2-CD 4.03Å; Y182-K188 HydrophobicContact CE2-CG 3.85Å; Y182-K188 HydrophobicContact CG-CD 4.29Å; Y182-K188 WeakPolarHBondContact O-CD 3.44Å; Y182-K188 WeakPolarHBondContact O-CE 3.48Å; Y182-K188 PolarHBondContact O-NZ 3.32Å; A185-K188 PolarHBondContact O-NZ 3.26Å; K188-S190 PolarHBondContact O-N 2.76Å
189	P	95.8	Very high	90	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.019	28%	0.275	C	S	.	.			trans	-62.2	122.6	172.2	25.5	-33.1	0	0	0	109.7	W153 I168 L178 L181 Y182 S191 I215	W153-P189 HydrophobicContact CH2-CB 3.6Å; W153-P189 HydrophobicContact CZ2-CB 3.83Å; W153-P189 HydrophobicContact CZ2-CG 4.38Å; I168-P189 CarbonylContact O-C 3.56Å; I168-P189 WeakPolarHBondContact O-CA 3.25Å; L178-P189 HydrophobicContact CD1-CB 4.44Å; L178-P189 HydrophobicContact CD1-CG 3.97Å; L181-P189 HydrophobicContact CD2-CG 4.35Å; Y182-P189 HydrophobicContact CD2-CG 4.05Å; P189-S191 VanDerWaalsContact C-N 3.34Å; P189-I215 HydrophobicContact CG-CD1 4.44Å
190	S	96.1	Very high	88.5	Confident	41 Å²	41	53.7 Å²	53.7	29%	0.287	30%	0.302	S	S	.	.	S	Bend	trans	-82.5	-15.7	176.8	65.6	0	0	0	0	112.9	A167 I168 K188 Q216	A167-S190 WeakPolarHBondContact CB-OG 3.42Å; I168-S190 PolarHBondContact O-N 2.9Å; I168-S190 PolarHBondContact O-OG 2.92Å; K188-S190 PolarHBondContact O-N 2.76Å; S190-Q216 PolarHBondContact O-N 2.59Å
191	S	94.8	Very high	87.6	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.014	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	149.7	-177.8	61.9	0	0	0	0	112.2	G169 T170 P189 Q216	G169-S191 CarbonylContact C-O 3.59Å; G169-S191 WeakPolarHBondContact CA-O 3.48Å; T170-S191 PolarHBondContact N-O 2.61Å; P189-S191 VanDerWaalsContact C-N 3.34Å; S191-Q216 CarbonylContact C-O 3.59Å; S191-Q216 WeakPolarHBondContact CA-O 3.37Å; S191-Q216 VanDerWaalsContact CB-O 3.27Å; S191-Q216 WeakPolarHBondContact CB-O 3.48Å
192	N	93.7	Very high	86.8	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128	168.7	-174.9	47.2	0	0	0	109.7	T170 L173 L178 I215 Q216 L217 L218	T170-N192 CarbonylContact O-C 3.57Å; T170-N192 WeakPolarHBondContact O-CA 3.09Å; T170-N192 PolarHBondContact O-OD1 3.22Å; T170-N192 PolarHBondContact OG1-OD1 2.73Å; L173-N192 PolarHBondContact O-ND2 2.82Å; L178-N192 HydrophobicContact CD1-CB 4.33Å; L178-N192 HydrophobicContact CD2-CB 4.16Å; N192-I215 HydrophobicContact CB-CG2 4.32Å; N192-Q216 PolarHBondContact N-O 2.77Å; N192-L217 HydrophobicContact CB-CD2 4.04Å; N192-L217 WeakPolarHBondContact O-CA 3.45Å; N192-L218 PolarHBondContact O-N 2.85Å
193	Q	91.3	Very high	86.2	Confident	14 Å²	14	56.9 Å²	56.9	7%	0.065	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	143.6	175	-89.9	-174	1.3	0	0	111.3	I132 T170 D172 L218	I132-Q193 HydrophobicContact CD1-CG 4.08Å; T170-Q193 PolarHBondContact O-N 2.64Å; D172-Q193 PolarHBondContact N-O 3.26Å; Q193-L218 CarbonylContact C-O 3.56Å; Q193-L218 VanDerWaalsContact CA-O 3.3Å; Q193-L218 WeakPolarHBondContact CA-O 3.5Å; Q193-L218 HydrophobicContact CG-CB 3.63Å; Q193-L218 HydrophobicContact CG-CD1 4.36Å
194	V	88.4	Confident	85.9	Confident	16 Å²	16	57 Å²	57	10%	0.097	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	132	174.8	-179.4	0	0	0	0	111	L196 C199 M202 L206 L218 T219 H220	V194-L196 PolarHBondContact O-N 3.22Å; V194-C199 HydrophobicContact CG1-CB 4.3Å; V194-M202 HydrophobicContact CB-CE 4.13Å; V194-M202 HydrophobicContact CB-SD 3.58Å; V194-M202 VanDerWaalsContact CB-SD 3.58Å; V194-M202 HydrophobicContact CG1-SD 3.66Å; V194-M202 HydrophobicContact CG2-CE 3.55Å; V194-M202 HydrophobicContact CG2-SD 3.69Å; V194-L206 HydrophobicContact CG2-CD2 3.98Å; V194-L218 PolarHBondContact N-O 3.31Å; V194-T219 WeakPolarHBondContact O-CA 3.12Å; V194-H220 PolarHBondContact O-CD2 2.86Å; V194-H220 PolarHBondContact O-N 3.01Å; V194-H220 VanDerWaalsContact O-N 3.11Å
195	N	85.5	Confident	85.7	Confident	10 Å²	10	57.3 Å²	57.3	5%	0.053	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	119.7	179.6	-164.1	-33.4	0	0	0	112.6	D172 A197 S198 C199 H220 D222	D172-N195 VanDerWaalsContact OD1-CB 3.24Å; D172-N195 WeakPolarHBondContact OD1-CB 3.39Å; D172-N195 PolarHBondContact OD1-N 2.74Å; N195-A197 PolarHBondContact O-N 2.78Å; N195-A197 VanDerWaalsContact OD1-CB 3.28Å; N195-A197 WeakPolarHBondContact OD1-CB 3.36Å; N195-A197 PolarHBondContact OD1-N 3.13Å; N195-S198 PolarHBondContact O-N 3.23Å; N195-C199 PolarHBondContact O-N 2.92Å; N195-C199 VanDerWaalsContact O-N 3.17Å; N195-H220 WeakPolarHBondContact CA-O 3.33Å; N195-H220 PolarHBondContact N-NE2 3.18Å; N195-D222 PolarHBondContact ND2-O 2.87Å
196	L	79.9	Confident	85.4	Confident	90 Å²	90	57.4 Å²	57.4	47%	0.471	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.6	177.7	-68.5	173.3	0	0	0	113.4	V194 S198 T219 H220	V194-L196 PolarHBondContact O-N 3.22Å; L196-S198 VanDerWaalsContact C-N 3.26Å; L196-S198 PolarHBondContact O-N 3.34Å; L196-T219 HydrophobicContact CD2-CG2 3.7Å; L196-T219 HydrophobicContact CG-CG2 4.35Å; L196-H220 PolarHBondContact N-O 2.97Å
197	A	75	Confident	85.2	Confident	93 Å²	93	52.5 Å²	52.5	77%	0.769	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-23.4	177.1	0	0	0	0	0	112.6	N195	N195-A197 PolarHBondContact O-N 2.78Å; N195-A197 VanDerWaalsContact OD1-CB 3.28Å; N195-A197 WeakPolarHBondContact OD1-CB 3.36Å; N195-A197 PolarHBondContact OD1-N 3.13Å
198	S	67.5	Low	85.1	Confident	87 Å²	87	53.5 Å²	53.5	61%	0.608	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-20.2	-180	-58.9	0	0	0	0	112.5	N195 L196	N195-S198 PolarHBondContact O-N 3.23Å; L196-S198 VanDerWaalsContact C-N 3.26Å; L196-S198 PolarHBondContact O-N 3.34Å
199	C	62	Low	85.1	Confident	40 Å²	40	50 Å²	50	27%	0.27	32%	0.323	S	S	.	.			trans	-153.1	111.2	-177.8	-139.8	0	0	0	0	111.2	V194 N195 V201	V194-C199 HydrophobicContact CG1-CB 4.3Å; N195-C199 PolarHBondContact O-N 2.92Å; N195-C199 VanDerWaalsContact O-N 3.17Å; C199-V201 VanDerWaalsContact C-N 3.32Å; C199-V201 PolarHBondContact SG-O 3.2Å
200	C	64.8	Low	85	Confident	127 Å²	127	50 Å²	50	86%	0.858	32%	0.322	S	S	*	.	S	Bend	trans	-79.9	-17.1	172.7	57.8	0	0	0	0	112.9
201	V	74.8	Confident	85	Confident	109 Å²	109	56.6 Å²	56.6	66%	0.661	35%	0.346	S	S	*	.	S	Bend	trans	-132.4	118.1	177.6	179.2	0	0	0	0	108	C199	C199-V201 VanDerWaalsContact C-N 3.32Å; C199-V201 PolarHBondContact SG-O 3.2Å
202	M	79.2	Confident	85.1	Confident	50 Å²	50	63.4 Å²	63.4	25%	0.246	38%	0.377	C	S	.	.			trans	-57	134.5	179.4	-76	-68	-69.6	0	0	111.7	V194 L206 L217	V194-M202 HydrophobicContact CB-CE 4.13Å; V194-M202 HydrophobicContact CB-SD 3.58Å; V194-M202 VanDerWaalsContact CB-SD 3.58Å; V194-M202 HydrophobicContact CG1-SD 3.66Å; V194-M202 HydrophobicContact CG2-CE 3.55Å; V194-M202 HydrophobicContact CG2-SD 3.69Å; M202-L206 HydrophobicContact CE-CD2 3.89Å; M202-L217 HydrophobicContact CE-CB 4.04Å; M202-L217 HydrophobicContact CE-CD1 3.62Å; M202-L217 HydrophobicContact CE-CD2 4.03Å; M202-L217 HydrophobicContact CE-CG 4.09Å
203	P	83.8	Confident	85.2	Confident	44 Å²	44	66.5 Å²	66.5	29%	0.286	39%	0.391	S	S	.	.			trans	-56.1	128.3	176.4	-25	34.1	0	0	0	111.2	D205 L206 T207	P203-D205 VanDerWaalsContact C-N 3.29Å; P203-D205 WeakPolarHBondContact CB-OD1 3.39Å; P203-D205 PolarHBondContact O-N 3.27Å; P203-L206 HydrophobicContact CB-CB 4.01Å; P203-L206 PolarHBondContact O-N 2.96Å; P203-T207 PolarHBondContact O-N 3.21Å; P203-T207 PolarHBondContact O-OG1 2.94Å
204	P	89.5	Confident	85.3	Confident	108 Å²	108	72.8 Å²	72.8	70%	0.701	43%	0.425	S	S	*	.	H	α-helix	trans	-61.7	-35.6	-176.1	-26.3	34.8	0	0	0	113.9	T207 A208	P204-T207 PolarHBondContact O-N 3.49Å; P204-A208 WeakPolarHBondContact O-CB 3.33Å; P204-A208 PolarHBondContact O-N 3.19Å
205	D	91.9	Very high	85.7	Confident	87 Å²	87	72.4 Å²	72.4	47%	0.465	42%	0.422	S	S	.	.	H	α-helix	trans	-66	-46.2	175.9	56.5	-24.6	0	0	0	112.3	P203 T207 A208 F209	P203-D205 VanDerWaalsContact C-N 3.29Å; P203-D205 WeakPolarHBondContact CB-OD1 3.39Å; P203-D205 PolarHBondContact O-N 3.27Å; D205-T207 VanDerWaalsContact C-N 3.29Å; D205-T207 PolarHBondContact O-N 3.3Å; D205-A208 PolarHBondContact O-N 3.48Å; D205-F209 WeakPolarHBondContact O-CB 3.23Å; D205-F209 PolarHBondContact O-N 2.94Å
206	L	91	Very high	86.1	Confident	5 Å²	5	77.1 Å²	77.1	3%	0.026	44%	0.444	C	S	.	.	H	α-helix	trans	-61	-41.1	172.4	179.2	63.2	0	0	0	111	K175 L178 V194 M202 P203 A210 L217	K175-L206 HydrophobicContact CB-CB 4.28Å; K175-L206 HydrophobicContact CB-CD1 4.31Å; L178-L206 HydrophobicContact CD2-CD1 3.67Å; V194-L206 HydrophobicContact CG2-CD2 3.98Å; M202-L206 HydrophobicContact CE-CD2 3.89Å; P203-L206 HydrophobicContact CB-CB 4.01Å; P203-L206 PolarHBondContact O-N 2.96Å; L206-A210 VanDerWaalsContact O-CB 3.23Å; L206-A210 WeakPolarHBondContact O-CB 3.39Å; L206-A210 PolarHBondContact O-N 3.46Å; L206-L217 HydrophobicContact CD2-CD2 4.49Å; L206-L217 HydrophobicContact CG-CD2 4.3Å
207	T	92	Very high	86.7	Confident	56 Å²	56	75.2 Å²	75.2	34%	0.344	43%	0.434	S	S	.	.	H	α-helix	trans	-65	-43.4	178.7	-55.2	0	0	0	0	111.9	P203 P204 D205 K211	P203-T207 PolarHBondContact O-N 3.21Å; P203-T207 PolarHBondContact O-OG1 2.94Å; P204-T207 PolarHBondContact O-N 3.49Å; D205-T207 VanDerWaalsContact C-N 3.29Å; D205-T207 PolarHBondContact O-N 3.3Å; T207-K211 VanDerWaalsContact O-CB 3.26Å; T207-K211 WeakPolarHBondContact O-CB 3.49Å; T207-K211 PolarHBondContact O-N 3.11Å
208	A	94.9	Very high	87.4	Confident	59 Å²	59	73.1 Å²	73.1	49%	0.488	41%	0.41	S	S	.	.	H	α-helix	trans	-63.1	-49	177.3	0	0	0	0	0	111.4	P204 D205 K211 E212	P204-A208 WeakPolarHBondContact O-CB 3.33Å; P204-A208 PolarHBondContact O-N 3.19Å; D205-A208 PolarHBondContact O-N 3.48Å; A208-K211 PolarHBondContact O-N 2.72Å; A208-E212 WeakPolarHBondContact O-CB 3.3Å; A208-E212 PolarHBondContact O-N 3.49Å
209	F	95.3	Very high	88.4	Confident	10 Å²	10	73.1 Å²	73.1	4%	0.044	41%	0.406	C	S	.	.	H	α-helix	trans	-59.5	-49.6	177.4	-177.5	-93.7	0	0	0	111.5	K175 L178 E179 Y182 D205 K211 E212 F213 I215	K175-F209 HydrophobicContact CG-CB 4.4Å; L178-F209 HydrophobicContact CD2-CD1 4.14Å; L178-F209 HydrophobicContact CD2-CE1 4.3Å; L178-F209 HydrophobicContact CG-CD1 4.4Å; L178-F209 HydrophobicContact CG-CE1 4.11Å; E179-F209 HydrophobicContact CB-CD2 4.45Å; E179-F209 HydrophobicContact CB-CE1 4.28Å; E179-F209 HydrophobicContact CB-CE2 3.79Å; E179-F209 HydrophobicContact CB-CZ 3.71Å; E179-F209 HydrophobicContact CG-CD2 4.49Å; E179-F209 HydrophobicContact CG-CE2 3.64Å; E179-F209 HydrophobicContact CG-CZ 3.9Å; Y182-F209 HydrophobicContact CG-CZ 4.3Å; D205-F209 WeakPolarHBondContact O-CB 3.23Å; D205-F209 PolarHBondContact O-N 2.94Å; F209-K211 VanDerWaalsContact C-N 3.29Å; F209-K211 PolarHBondContact O-N 3.38Å; F209-E212 PolarHBondContact O-N 2.59Å; F209-E212 VanDerWaalsContact O-N 3.17Å; F209-F213 HydrophobicContact CD1-CD2 4.22Å; F209-F213 AromaticContact CD2-CD2 3.65Å; F209-F213 HydrophobicContact CD2-CD2 3.65Å; F209-F213 AromaticContact CD2-CE2 3.55Å; F209-F213 HydrophobicContact CD2-CE2 3.55Å; F209-F213 AromaticContact CE1-CD2 3.97Å; F209-F213 HydrophobicContact CE1-CD2 3.97Å; F209-F213 AromaticContact CE2-CD2 3.38Å; F209-F213 HydrophobicContact CE2-CD2 3.38Å; F209-F213 AromaticContact CE2-CE2 3.19Å; F209-F213 HydrophobicContact CE2-CE2 3.19Å; F209-F213 HydrophobicContact CE2-CG 4.49Å; F209-F213 HydrophobicContact CE2-CZ 4.18Å; F209-F213 HydrophobicContact CG-CD2 4.06Å; F209-F213 HydrophobicContact CG-CE2 4.39Å; F209-F213 AromaticContact CZ-CD2 3.53Å; F209-F213 HydrophobicContact CZ-CD2 3.53Å; F209-F213 AromaticContact CZ-CE2 3.78Å; F209-F213 HydrophobicContact CZ-CE2 3.78Å; F209-F213 HydrophobicContact CZ-CG 4.3Å; F209-F213 WeakPolarHBondContact O-CD2 3.44Å; F209-F213 PolarHBondContact O-N 2.96Å; F209-F213 VanDerWaalsContact O-N 3.08Å; F209-I215 HydrophobicContact CD1-CD1 4.26Å; F209-I215 HydrophobicContact CE1-CD1 3.84Å
210	A	94.8	Very high	89.7	Confident	1 Å²	1	71.9 Å²	71.9	1%	0.008	40%	0.396	C	S	.	.	H	α-helix	trans	-61.5	-39	180	0	0	0	0	0	112.3	L206 D214 I215 L217	L206-A210 VanDerWaalsContact O-CB 3.23Å; L206-A210 WeakPolarHBondContact O-CB 3.39Å; L206-A210 PolarHBondContact O-N 3.46Å; A210-D214 PolarHBondContact O-N 2.87Å; A210-D214 VanDerWaalsContact O-N 3.11Å; A210-I215 HydrophobicContact CB-CB 4Å; A210-I215 WeakPolarHBondContact CB-O 3.36Å; A210-I215 PolarHBondContact O-N 3.07Å; A210-L217 HydrophobicContact CB-CD1 3.47Å; A210-L217 VanDerWaalsContact CB-CD1 3.47Å; A210-L217 HydrophobicContact CB-CD2 3.8Å; A210-L217 HydrophobicContact CB-CG 3.5Å
211	K	95.1	Very high	90.7	Very high	180 Å²	180	69.9 Å²	69.9	78%	0.783	38%	0.384	S	S	*	.	H	α-helix	trans	-66.7	-40	175.4	-175.9	-179.7	178.8	-176.4	0	112.6	T207 A208 F209 F213	T207-K211 VanDerWaalsContact O-CB 3.26Å; T207-K211 WeakPolarHBondContact O-CB 3.49Å; T207-K211 PolarHBondContact O-N 3.11Å; A208-K211 PolarHBondContact O-N 2.72Å; F209-K211 VanDerWaalsContact C-N 3.29Å; F209-K211 PolarHBondContact O-N 3.38Å; K211-F213 VanDerWaalsContact C-N 3.33Å
212	E	96.4	Very high	91.1	Very high	146 Å²	146	64.9 Å²	64.9	68%	0.682	35%	0.353	S	S	*	.	H	α-helix	trans	-63.2	-40	179.3	-177.3	175.6	172.3	0	0	112	A208 F209	A208-E212 WeakPolarHBondContact O-CB 3.3Å; A208-E212 PolarHBondContact O-N 3.49Å; F209-E212 PolarHBondContact O-N 2.59Å; F209-E212 VanDerWaalsContact O-N 3.17Å
213	F	95.3	Very high	91.2	Very high	64 Å²	64	64.8 Å²	64.8	28%	0.281	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	14.5	-175.8	-66.7	-74.4	0	0	0	114.6	Y182 F209 K211 I215	Y182-F213 HydrophobicContact CD1-CD1 4.24Å; Y182-F213 HydrophobicContact CD2-CB 4.41Å; Y182-F213 HydrophobicContact CE1-CB 4.36Å; Y182-F213 AromaticContact CE1-CD1 3.44Å; Y182-F213 HydrophobicContact CE1-CD1 3.44Å; Y182-F213 VanDerWaalsContact CE1-CD1 3.44Å; Y182-F213 AromaticContact CE1-CE1 3.91Å; Y182-F213 HydrophobicContact CE1-CE1 3.91Å; Y182-F213 AromaticContact CE1-CG 4Å; Y182-F213 HydrophobicContact CE1-CG 4Å; Y182-F213 HydrophobicContact CE2-CB 3.76Å; Y182-F213 HydrophobicContact CE2-CD1 4.35Å; Y182-F213 HydrophobicContact CE2-CG 4.27Å; Y182-F213 AromaticContact CZ-CD1 3.5Å; Y182-F213 VanDerWaalsContact CZ-CD1 3.5Å; Y182-F213 AromaticContact CZ-CG 3.86Å; Y182-F213 WeakPolarHBondContact OH-CD1 3.39Å; F209-F213 HydrophobicContact CD1-CD2 4.22Å; F209-F213 AromaticContact CD2-CD2 3.65Å; F209-F213 HydrophobicContact CD2-CD2 3.65Å; F209-F213 AromaticContact CD2-CE2 3.55Å; F209-F213 HydrophobicContact CD2-CE2 3.55Å; F209-F213 AromaticContact CE1-CD2 3.97Å; F209-F213 HydrophobicContact CE1-CD2 3.97Å; F209-F213 AromaticContact CE2-CD2 3.38Å; F209-F213 HydrophobicContact CE2-CD2 3.38Å; F209-F213 AromaticContact CE2-CE2 3.19Å; F209-F213 HydrophobicContact CE2-CE2 3.19Å; F209-F213 HydrophobicContact CE2-CG 4.49Å; F209-F213 HydrophobicContact CE2-CZ 4.18Å; F209-F213 HydrophobicContact CG-CD2 4.06Å; F209-F213 HydrophobicContact CG-CE2 4.39Å; F209-F213 AromaticContact CZ-CD2 3.53Å; F209-F213 HydrophobicContact CZ-CD2 3.53Å; F209-F213 AromaticContact CZ-CE2 3.78Å; F209-F213 HydrophobicContact CZ-CE2 3.78Å; F209-F213 HydrophobicContact CZ-CG 4.3Å; F209-F213 WeakPolarHBondContact O-CD2 3.44Å; F209-F213 PolarHBondContact O-N 2.96Å; F209-F213 VanDerWaalsContact O-N 3.08Å; K211-F213 VanDerWaalsContact C-N 3.33Å; F213-I215 VanDerWaalsContact C-N 3.29Å; F213-I215 HydrophobicContact CB-CD1 4.17Å; F213-I215 HydrophobicContact CB-CG1 4.1Å; F213-I215 PolarHBondContact O-N 3.34Å
214	D	95.1	Very high	90.8	Very high	147 Å²	147	71.7 Å²	71.7	79%	0.786	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	40.5	-179.7	-161.5	37.9	0	0	0	114.1	A210	A210-D214 PolarHBondContact O-N 2.87Å; A210-D214 VanDerWaalsContact O-N 3.11Å
215	I	96.3	Very high	90.3	Very high	8 Å²	8	72.4 Å²	72.4	4%	0.041	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-91.8	119.9	175.3	-51.7	176.9	0	0	0	108.5	L178 Y182 P189 N192 F209 A210 F213 L217	L178-I215 HydrophobicContact CD1-CD1 4.32Å; L178-I215 HydrophobicContact CD2-CD1 4.06Å; L178-I215 HydrophobicContact CG-CD1 4.23Å; Y182-I215 HydrophobicContact CD2-CD1 3.77Å; Y182-I215 HydrophobicContact CD2-CG1 4.43Å; Y182-I215 HydrophobicContact CE2-CD1 4.16Å; Y182-I215 HydrophobicContact CE2-CG1 4.37Å; P189-I215 HydrophobicContact CG-CD1 4.44Å; N192-I215 HydrophobicContact CB-CG2 4.32Å; F209-I215 HydrophobicContact CD1-CD1 4.26Å; F209-I215 HydrophobicContact CE1-CD1 3.84Å; A210-I215 HydrophobicContact CB-CB 4Å; A210-I215 WeakPolarHBondContact CB-O 3.36Å; A210-I215 PolarHBondContact O-N 3.07Å; F213-I215 VanDerWaalsContact C-N 3.29Å; F213-I215 HydrophobicContact CB-CD1 4.17Å; F213-I215 HydrophobicContact CB-CG1 4.1Å; F213-I215 PolarHBondContact O-N 3.34Å; I215-L217 PolarHBondContact O-N 3.24Å
216	Q	94.5	Very high	89.8	Confident	108 Å²	108	68.8 Å²	68.8	51%	0.505	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	116.8	177.1	-172.8	175.1	43.9	0	0	111.2	S190 S191 N192 L218	S190-Q216 PolarHBondContact O-N 2.59Å; S191-Q216 CarbonylContact C-O 3.59Å; S191-Q216 WeakPolarHBondContact CA-O 3.37Å; S191-Q216 VanDerWaalsContact CB-O 3.27Å; S191-Q216 WeakPolarHBondContact CB-O 3.48Å; N192-Q216 PolarHBondContact N-O 2.77Å; Q216-L218 HydrophobicContact CG-CD2 3.86Å; Q216-L218 HydrophobicContact CG-CG 4.09Å
217	L	92.3	Very high	89.6	Confident	50 Å²	50	69.1 Å²	69.1	26%	0.262	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	124.2	171.4	-65.2	173.2	0	0	0	110.5	N192 M202 L206 A210 I215	N192-L217 HydrophobicContact CB-CD2 4.04Å; N192-L217 WeakPolarHBondContact O-CA 3.45Å; M202-L217 HydrophobicContact CE-CB 4.04Å; M202-L217 HydrophobicContact CE-CD1 3.62Å; M202-L217 HydrophobicContact CE-CD2 4.03Å; M202-L217 HydrophobicContact CE-CG 4.09Å; L206-L217 HydrophobicContact CD2-CD2 4.49Å; L206-L217 HydrophobicContact CG-CD2 4.3Å; A210-L217 HydrophobicContact CB-CD1 3.47Å; A210-L217 VanDerWaalsContact CB-CD1 3.47Å; A210-L217 HydrophobicContact CB-CD2 3.8Å; A210-L217 HydrophobicContact CB-CG 3.5Å; I215-L217 PolarHBondContact O-N 3.24Å
218	L	89.9	Confident	89.2	Confident	50 Å²	50	67.7 Å²	67.7	26%	0.262	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	156.1	-178.9	-64	176.7	0	0	0	109.8	I132 N192 Q193 V194 Q216	I132-L218 HydrophobicContact CD1-CD1 4.08Å; N192-L218 PolarHBondContact O-N 2.85Å; Q193-L218 CarbonylContact C-O 3.56Å; Q193-L218 VanDerWaalsContact CA-O 3.3Å; Q193-L218 WeakPolarHBondContact CA-O 3.5Å; Q193-L218 HydrophobicContact CG-CB 3.63Å; Q193-L218 HydrophobicContact CG-CD1 4.36Å; V194-L218 PolarHBondContact N-O 3.31Å; Q216-L218 HydrophobicContact CG-CD2 3.86Å; Q216-L218 HydrophobicContact CG-CG 4.09Å
219	T	88.3	Confident	88.7	Confident	86 Å²	86	68.3 Å²	68.3	53%	0.528	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	148.8	176.4	55.6	0	0	0	0	111.2	V194 L196	V194-T219 WeakPolarHBondContact O-CA 3.12Å; L196-T219 HydrophobicContact CD2-CG2 3.7Å; L196-T219 HydrophobicContact CG-CG2 4.35Å
220	H	88.1	Confident	88.3	Confident	15 Å²	15	70.4 Å²	70.4	7%	0.069	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	166.6	171.8	71.3	107.5	0	0	0	111.2	K101 S171 D172 V194 N195 L196 D222	K101-H220 PolarHBondContact NZ-CE1 3.25Å; K101-H220 VanDerWaalsContact NZ-CE1 3.27Å; K101-H220 PolarHBondContact NZ-ND1 2.96Å; S171-H220 PolarHBondContact OG-NE2 3.44Å; D172-H220 IonicContact OD1-CE1 3.1Å; D172-H220 IonicContact OD1-NE2 2.92Å; D172-H220 PolarHBondContact OD1-NE2 3Å; D172-H220 VanDerWaalsContact OD1-NE2 3.1Å; D172-H220 IonicContact OD2-CE1 3.13Å; D172-H220 PolarHBondContact OD2-CE1 3.19Å; D172-H220 VanDerWaalsContact OD2-CE1 3.24Å; D172-H220 IonicContact OD2-NE2 3.21Å; D172-H220 PolarHBondContact OD2-NE2 3.3Å; D172-H220 VanDerWaalsContact OD2-NE2 3.13Å; V194-H220 PolarHBondContact O-CD2 2.86Å; V194-H220 PolarHBondContact O-N 3.01Å; V194-H220 VanDerWaalsContact O-N 3.11Å; N195-H220 WeakPolarHBondContact CA-O 3.33Å; N195-H220 PolarHBondContact N-NE2 3.18Å; L196-H220 PolarHBondContact N-O 2.97Å; H220-D222 IonicContact CE1-OD2 2.66Å; H220-D222 IonicContact CG-OD2 3.81Å; H220-D222 WeakPolarHBondContact ND1-CB 3.48Å; H220-D222 PolarHBondContact ND1-N 3.07Å; H220-D222 IonicContact ND1-OD2 3.52Å; H220-D222 PolarHBondContact ND1-OD2 3.48Å
221	S	86	Confident	87.9	Confident	85 Å²	85	72.3 Å²	72.3	59%	0.594	38%	0.379	S	S	*	.			trans	-125	29.4	179.1	54.8	0	0	0	0	111.5
222	D	84.3	Confident	87.6	Confident	4 Å²	4	63.7 Å²	63.7	2%	0.021	34%	0.342	C	S	.	.			trans	-71.1	143.7	178.4	-56.1	-44.9	0	0	0	110.1	K101 F103 N195 H220 R255	K101-D222 WeakPolarHBondContact CD-OD2 3.03Å; K101-D222 WeakPolarHBondContact CE-OD2 3.32Å; K101-D222 IonicContact NZ-OD2 3.98Å; K101-D222 PolarHBondContact NZ-OD2 3.3Å; F103-D222 HydrophobicContact CE1-CB 4.27Å; F103-D222 HydrophobicContact CZ-CB 4.4Å; N195-D222 PolarHBondContact ND2-O 2.87Å; H220-D222 IonicContact CE1-OD2 2.66Å; H220-D222 IonicContact CG-OD2 3.81Å; H220-D222 WeakPolarHBondContact ND1-CB 3.48Å; H220-D222 PolarHBondContact ND1-N 3.07Å; H220-D222 IonicContact ND1-OD2 3.52Å; H220-D222 PolarHBondContact ND1-OD2 3.48Å; D222-R255 VanDerWaalsContact CG-NH2 3.29Å; D222-R255 IonicContact OD1-CZ 2.76Å; D222-R255 IonicContact OD1-NH1 3.21Å; D222-R255 PolarHBondContact OD1-NH1 3.06Å; D222-R255 IonicContact OD1-NH2 3.93Å; D222-R255 PolarHBondContact OD1-NH2 3.27Å; D222-R255 IonicContact OD2-CZ 3.78Å; D222-R255 IonicContact OD2-NH2 3.82Å; D222-R255 PolarHBondContact OD2-NH2 3.38Å
223	P	81.1	Confident	87.2	Confident	47 Å²	47	58.7 Å²	58.7	31%	0.305	32%	0.318	S	S	.	.			trans	-67.8	159.3	170.7	23.8	-23.7	0	0	0	110.7	S44 E225	S44-P223 WeakPolarHBondContact OG-CG 3.09Å; P223-E225 WeakPolarHBondContact CG-O 3.47Å; P223-E225 PolarHBondContact O-N 3.3Å
224	K	75	Confident	86.9	Confident	189 Å²	189	60.5 Å²	60.5	82%	0.822	33%	0.328	S	S	*	.	S	Bend	trans	-58.9	-38.4	178.9	-70.5	-174.8	178.2	-177.9	0	112.2
225	E	78.3	Confident	86.5	Confident	124 Å²	124	53.5 Å²	53.5	58%	0.579	29%	0.29	S	S	*	.	S	Bend	trans	-116	118.3	171.3	-177.1	-179.8	-143.4	0	0	107.3	P223 S228	P223-E225 WeakPolarHBondContact CG-O 3.47Å; P223-E225 PolarHBondContact O-N 3.3Å; E225-S228 WeakPolarHBondContact OE1-CA 3.4Å
226	L	82.6	Confident	86	Confident	10 Å²	10	53.1 Å²	53.1	5%	0.052	29%	0.288	C	S	.	.	S	Bend	trans	-67.5	-40.8	-178.5	-176.6	65.5	0	0	0	111.4	P43 S44 L47 F103 V253	P43-L226 HydrophobicContact CB-CD1 4.01Å; S44-L226 WeakPolarHBondContact CA-O 3.44Å; S44-L226 WeakPolarHBondContact CB-O 3.39Å; S44-L226 PolarHBondContact OG-O 3.02Å; L47-L226 HydrophobicContact CD2-CD2 3.78Å; L47-L226 HydrophobicContact CD2-CG 3.93Å; F103-L226 HydrophobicContact CB-CD2 4.22Å; F103-L226 HydrophobicContact CD1-CB 3.9Å; F103-L226 HydrophobicContact CD1-CD2 3.99Å; F103-L226 HydrophobicContact CD1-CG 4.46Å; F103-L226 HydrophobicContact CD2-CD2 3.5Å; F103-L226 VanDerWaalsContact CD2-CD2 3.5Å; F103-L226 HydrophobicContact CE1-CB 4.19Å; F103-L226 HydrophobicContact CE1-CD1 4.43Å; F103-L226 HydrophobicContact CE1-CD2 4.17Å; F103-L226 HydrophobicContact CE2-CD2 3.7Å; F103-L226 HydrophobicContact CG-CB 4.24Å; F103-L226 HydrophobicContact CG-CD2 3.64Å; F103-L226 HydrophobicContact CZ-CD1 4.34Å; F103-L226 HydrophobicContact CZ-CD2 4.02Å; L226-V253 HydrophobicContact CD2-CB 4.04Å; L226-V253 HydrophobicContact CD2-CG1 3.77Å; L226-V253 HydrophobicContact CD2-CG2 4.49Å
227	M	85.6	Confident	85.6	Confident	12 Å²	12	53.7 Å²	53.7	6%	0.059	29%	0.291	C	S	.	.			trans	-158.6	122.4	179.6	-179	169.7	-78.7	0	0	109	L47 R48 I51 T231 F232 L250	L47-M227 HydrophobicContact CB-CE 3.95Å; L47-M227 HydrophobicContact CD2-CB 4.12Å; L47-M227 HydrophobicContact CD2-CE 3.68Å; L47-M227 HydrophobicContact CD2-SD 4.04Å; L47-M227 HydrophobicContact CG-CE 3.54Å; L47-M227 HydrophobicContact CG-SD 4.33Å; R48-M227 HydrophobicContact CB-CE 3.88Å; I51-M227 HydrophobicContact CD1-CE 3.99Å; I51-M227 HydrophobicContact CD1-SD 3.81Å; M227-T231 HydrophobicContact CE-CG2 4.45Å; M227-T231 HydrophobicContact CG-CG2 4.23Å; M227-F232 HydrophobicContact CG-CB 3.95Å; M227-F232 HydrophobicContact SD-CB 3.72Å; M227-F232 HydrophobicContact SD-CD2 3.87Å; M227-F232 HydrophobicContact SD-CG 4.29Å; M227-L250 HydrophobicContact CB-CD2 4.1Å; M227-L250 HydrophobicContact CG-CD2 4.35Å; M227-L250 HydrophobicContact SD-CD2 4.39Å
228	S	84.6	Confident	85.2	Confident	27 Å²	27	56.5 Å²	56.5	19%	0.189	30%	0.302	C	S	.	.			trans	-71.6	159.9	173.8	78	0	0	0	0	110.9	E225 A230 T231 F232	E225-S228 WeakPolarHBondContact OE1-CA 3.4Å; S228-A230 VanDerWaalsContact C-N 3.26Å; S228-A230 PolarHBondContact O-N 2.66Å; S228-A230 PolarHBondContact OG-N 3.17Å; S228-T231 PolarHBondContact O-N 3.34Å; S228-T231 WeakPolarHBondContact OG-CB 3.19Å; S228-T231 PolarHBondContact OG-N 3.31Å; S228-T231 PolarHBondContact OG-OG1 2.75Å; S228-F232 PolarHBondContact O-N 3.1Å
229	T	84.2	Confident	84.8	Confident	71 Å²	71	54.3 Å²	54.3	44%	0.436	29%	0.292	S	S	.	.	H	α-helix	trans	-55.9	-43.3	173.6	-63.8	0	0	0	0	111	T231 F232 Q233	T229-T231 PolarHBondContact O-N 2.66Å; T229-F232 PolarHBondContact O-N 2.96Å; T229-Q233 HydrophobicContact CG2-CG 4.32Å; T229-Q233 VanDerWaalsContact O-CG 3.23Å; T229-Q233 WeakPolarHBondContact O-CG 3.34Å; T229-Q233 PolarHBondContact O-N 3.21Å
230	A	85.9	Confident	84.4	Confident	55 Å²	55	50.2 Å²	50.2	46%	0.455	27%	0.267	S	S	.	.	H	α-helix	trans	-61.3	-47.4	178.7	0	0	0	0	0	111.8	S228 F232 Q233 E234	S228-A230 VanDerWaalsContact C-N 3.26Å; S228-A230 PolarHBondContact O-N 2.66Å; S228-A230 PolarHBondContact OG-N 3.17Å; A230-F232 VanDerWaalsContact C-N 3.31Å; A230-F232 PolarHBondContact O-N 3.25Å; A230-Q233 PolarHBondContact O-N 2.85Å; A230-E234 WeakPolarHBondContact O-CG 3.47Å; A230-E234 PolarHBondContact O-N 2.97Å
231	T	87.4	Confident	83.6	Confident	40 Å²	40	52.6 Å²	52.6	25%	0.245	29%	0.29	C	S	.	.	H	α-helix	trans	-63.4	-36.9	178.6	-52.4	0	0	0	0	112.2	M227 S228 T229 A235	M227-T231 HydrophobicContact CE-CG2 4.45Å; M227-T231 HydrophobicContact CG-CG2 4.23Å; S228-T231 PolarHBondContact O-N 3.34Å; S228-T231 WeakPolarHBondContact OG-CB 3.19Å; S228-T231 PolarHBondContact OG-N 3.31Å; S228-T231 PolarHBondContact OG-OG1 2.75Å; T229-T231 PolarHBondContact O-N 2.66Å; T231-A235 WeakPolarHBondContact O-CB 3.42Å; T231-A235 PolarHBondContact O-N 3.25Å
232	F	88.7	Confident	82.7	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65	-45.6	174.6	175.9	-112.1	0	0	0	111.6	I51 M227 S228 T229 A230 E234 A235 M236 W248 L250 A275	I51-F232 HydrophobicContact CD1-CD2 3.98Å; I51-F232 HydrophobicContact CD1-CE2 4.11Å; M227-F232 HydrophobicContact CG-CB 3.95Å; M227-F232 HydrophobicContact SD-CB 3.72Å; M227-F232 HydrophobicContact SD-CD2 3.87Å; M227-F232 HydrophobicContact SD-CG 4.29Å; S228-F232 PolarHBondContact O-N 3.1Å; T229-F232 PolarHBondContact O-N 2.96Å; A230-F232 VanDerWaalsContact C-N 3.31Å; A230-F232 PolarHBondContact O-N 3.25Å; F232-E234 PolarHBondContact O-N 3.16Å; F232-A235 WeakPolarHBondContact O-CB 3.42Å; F232-A235 PolarHBondContact O-N 2.92Å; F232-M236 HydrophobicContact CD1-CG 4.35Å; F232-M236 HydrophobicContact CD2-CG 4.37Å; F232-M236 HydrophobicContact CE1-CG 3.9Å; F232-M236 HydrophobicContact CE1-SD 4.49Å; F232-M236 HydrophobicContact CE2-CG 3.9Å; F232-M236 HydrophobicContact CE2-SD 4.05Å; F232-M236 HydrophobicContact CZ-CG 3.64Å; F232-M236 HydrophobicContact CZ-SD 3.75Å; F232-M236 WeakPolarHBondContact O-CG 3.4Å; F232-M236 PolarHBondContact O-N 2.93Å; F232-W248 HydrophobicContact CE1-CB 3.95Å; F232-L250 HydrophobicContact CD1-CB 4.31Å; F232-L250 HydrophobicContact CD2-CD1 3.99Å; F232-L250 HydrophobicContact CE2-CD1 3.98Å; F232-L250 HydrophobicContact CG-CB 4.31Å; F232-L250 HydrophobicContact CG-CD1 4.43Å; F232-L250 HydrophobicContact CZ-CD1 4.41Å; F232-A275 HydrophobicContact CE1-CB 3.72Å; F232-A275 HydrophobicContact CE2-CB 4.41Å; F232-A275 HydrophobicContact CZ-CB 3.4Å
233	Q	88	Confident	82	Confident	40 Å²	40	52.4 Å²	52.4	19%	0.187	30%	0.299	C	S	.	.	H	α-helix	trans	-64.6	-39	179.1	-68.5	179.4	-14.5	0	0	112.2	T229 A230 M236 Q237 A245 T246 W248	T229-Q233 HydrophobicContact CG2-CG 4.32Å; T229-Q233 VanDerWaalsContact O-CG 3.23Å; T229-Q233 WeakPolarHBondContact O-CG 3.34Å; T229-Q233 PolarHBondContact O-N 3.21Å; A230-Q233 PolarHBondContact O-N 2.85Å; Q233-M236 WeakPolarHBondContact O-CB 3.48Å; Q233-M236 PolarHBondContact O-N 3.34Å; Q233-Q237 WeakPolarHBondContact O-CB 3.33Å; Q233-Q237 PolarHBondContact O-N 3.01Å; Q233-A245 HydrophobicContact CB-CB 4.22Å; Q233-A245 WeakPolarHBondContact CG-O 3.23Å; Q233-A245 WeakPolarHBondContact O-CB 3.49Å; Q233-T246 PolarHBondContact NE2-O 3.47Å; Q233-W248 PolarHBondContact NE2-O 3.47Å; Q233-W248 VanDerWaalsContact NE2-O 3.1Å
234	E	88.1	Confident	81.5	Confident	103 Å²	103	52.8 Å²	52.8	48%	0.481	30%	0.303	S	S	.	.	H	α-helix	trans	-59.4	-47.4	170.8	-73.4	171.9	-178.7	0	0	111.3	A230 F232 M236 Q237 E238	A230-E234 WeakPolarHBondContact O-CG 3.47Å; A230-E234 PolarHBondContact O-N 2.97Å; F232-E234 PolarHBondContact O-N 3.16Å; E234-M236 VanDerWaalsContact C-N 3.31Å; E234-M236 PolarHBondContact O-N 3Å; E234-Q237 PolarHBondContact O-N 2.99Å; E234-E238 WeakPolarHBondContact O-CG 3.44Å; E234-E238 PolarHBondContact O-N 3.44Å
235	A	87.4	Confident	81.5	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.2	-42.4	177.8	0	0	0	0	0	112.2	R48 I51 T231 F232 G239	R48-A235 HydrophobicContact CG-CB 3.74Å; I51-A235 HydrophobicContact CB-CB 4.33Å; I51-A235 HydrophobicContact CG2-CB 3.95Å; T231-A235 WeakPolarHBondContact O-CB 3.42Å; T231-A235 PolarHBondContact O-N 3.25Å; F232-A235 WeakPolarHBondContact O-CB 3.42Å; F232-A235 PolarHBondContact O-N 2.92Å; A235-G239 PolarHBondContact O-N 2.92Å
236	M	86.4	Confident	81.3	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63	-46.9	176	-74.3	-68.1	-59.3	0	0	111.4	L22 I51 L55 F232 Q233 E234 G239 A240 L243 A245 W248	L22-M236 HydrophobicContact CD2-CE 3.34Å; L22-M236 HydrophobicContact CD2-SD 3.57Å; L22-M236 VanDerWaalsContact CD2-SD 3.57Å; I51-M236 HydrophobicContact CG2-SD 4.46Å; L55-M236 HydrophobicContact CD1-CE 4.16Å; L55-M236 HydrophobicContact CD1-CG 4.48Å; L55-M236 HydrophobicContact CD1-SD 3.39Å; L55-M236 WeakPolarHBondContact CD1-SD 3.26Å; L55-M236 HydrophobicContact CD2-CE 4.45Å; L55-M236 HydrophobicContact CD2-SD 4.4Å; L55-M236 HydrophobicContact CG-SD 4.48Å; F232-M236 HydrophobicContact CD1-CG 4.35Å; F232-M236 HydrophobicContact CD2-CG 4.37Å; F232-M236 HydrophobicContact CE1-CG 3.9Å; F232-M236 HydrophobicContact CE1-SD 4.49Å; F232-M236 HydrophobicContact CE2-CG 3.9Å; F232-M236 HydrophobicContact CE2-SD 4.05Å; F232-M236 HydrophobicContact CZ-CG 3.64Å; F232-M236 HydrophobicContact CZ-SD 3.75Å; F232-M236 WeakPolarHBondContact O-CG 3.4Å; F232-M236 PolarHBondContact O-N 2.93Å; Q233-M236 WeakPolarHBondContact O-CB 3.48Å; Q233-M236 PolarHBondContact O-N 3.34Å; E234-M236 VanDerWaalsContact C-N 3.31Å; E234-M236 PolarHBondContact O-N 3Å; M236-G239 PolarHBondContact O-N 3.33Å; M236-A240 WeakPolarHBondContact O-CB 3.2Å; M236-A240 PolarHBondContact O-N 3.25Å; M236-L243 HydrophobicContact CE-CD2 3.62Å; M236-A245 HydrophobicContact CB-CB 4.03Å; M236-W248 HydrophobicContact CE-CG 4.5Å
237	Q	85.8	Confident	81.2	Confident	119 Å²	119	45.3 Å²	45.3	56%	0.556	28%	0.28	S	S	*	.	H	α-helix	trans	-66.8	-38.5	-178.4	-171.7	173.4	5.7	0	0	112.2	Q233 E234 A240 A241 A245	Q233-Q237 WeakPolarHBondContact O-CB 3.33Å; Q233-Q237 PolarHBondContact O-N 3.01Å; E234-Q237 PolarHBondContact O-N 2.99Å; Q237-A240 CarbonylContact O-C 3.41Å; Q237-A241 PolarHBondContact O-N 2.89Å; Q237-A245 HydrophobicContact CB-CB 4.16Å
238	E	84.7	Confident	81.2	Confident	109 Å²	109	44.9 Å²	44.9	51%	0.509	28%	0.278	S	S	.	.	H	α-helix	trans	-71.7	-34.8	175.1	-70.9	-170.9	-164.4	0	0	112.9	Q52 E234	Q52-E238 HydrophobicContact CG-CB 4.25Å; Q52-E238 PolarHBondContact NE2-OE2 3.22Å; E234-E238 WeakPolarHBondContact O-CG 3.44Å; E234-E238 PolarHBondContact O-N 3.44Å
239	G	81.1	Confident	81.3	Confident	5 Å²	5	49.6 Å²	49.6	5%	0.052	29%	0.292	C	S	.	.	H	α-helix	trans	-76	-28.9	177.1	0	0	0	0	0	113.5	S56 A235 M236	S56-G239 PolarHBondContact N-O 2.74Å; A235-G239 PolarHBondContact O-N 2.92Å; M236-G239 PolarHBondContact O-N 3.33Å
240	A	79.9	Confident	81.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	-136.5	76.8	-176.1	0	0	0	0	0	111.3	L16 L59 M236 Q237 G242 L243	L16-A240 HydrophobicContact CD1-CB 4.15Å; L59-A240 HydrophobicContact CD1-CB 3.63Å; M236-A240 WeakPolarHBondContact O-CB 3.2Å; M236-A240 PolarHBondContact O-N 3.25Å; Q237-A240 CarbonylContact O-C 3.41Å; A240-G242 PolarHBondContact O-N 2.92Å; A240-L243 HydrophobicContact CB-CB 4.33Å; A240-L243 WeakPolarHBondContact O-CB 3.42Å; A240-L243 PolarHBondContact O-N 3.37Å
241	A	71.9	Confident	81.5	Confident	65 Å²	65	44.8 Å²	44.8	54%	0.537	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	124.6	-178	0	0	0	0	0	112.3	K13 Q237	K13-A241 WeakPolarHBondContact CE-O 3.31Å; K13-A241 PolarHBondContact NZ-O 2.98Å; Q237-A241 PolarHBondContact O-N 2.89Å
242	G	65.9	Low	81.6	Confident	73 Å²	73	42.9 Å²	42.9	75%	0.753	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	96.7	3.7	179.5	0	0	0	0	0	115.3	A240	A240-G242 PolarHBondContact O-N 2.92Å
243	L	70.3	Confident	81.7	Confident	11 Å²	11	43 Å²	43	6%	0.058	24%	0.244	C	C	.	.			trans	-78.6	140.9	169.8	-166.7	80.7	0	0	0	111.2	L16 M236 A240 A245	L16-L243 HydrophobicContact CB-CD1 3.38Å; L16-L243 HydrophobicContact CD1-CD1 4.17Å; L16-L243 HydrophobicContact CG-CD1 4.37Å; M236-L243 HydrophobicContact CE-CD2 3.62Å; A240-L243 HydrophobicContact CB-CB 4.33Å; A240-L243 WeakPolarHBondContact O-CB 3.42Å; A240-L243 PolarHBondContact O-N 3.37Å; L243-A245 PolarHBondContact O-N 3.05Å
244	S	71.1	Confident	81.9	Confident	56 Å²	56	41 Å²	41	39%	0.392	24%	0.235	S	C	.	.			trans	-70.4	82.9	161.1	-174.7	0	0	0	0	109.2	T246 D247	S244-T246 PolarHBondContact O-N 2.91Å; S244-T246 PolarHBondContact OG-OG1 3.37Å; S244-D247 WeakPolarHBondContact CB-OD2 3.36Å; S244-D247 PolarHBondContact OG-OD2 2.97Å
245	A	73.3	Confident	82.1	Confident	6 Å²	6	37.7 Å²	37.7	5%	0.05	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-68.2	-20.6	-179.5	0	0	0	0	0	112.5	Q233 M236 Q237 L243 D247 W248	Q233-A245 HydrophobicContact CB-CB 4.22Å; Q233-A245 WeakPolarHBondContact CG-O 3.23Å; Q233-A245 WeakPolarHBondContact O-CB 3.49Å; M236-A245 HydrophobicContact CB-CB 4.03Å; Q237-A245 HydrophobicContact CB-CB 4.16Å; L243-A245 PolarHBondContact O-N 3.05Å; A245-D247 PolarHBondContact O-N 2.99Å; A245-D247 VanDerWaalsContact O-N 3.13Å; A245-W248 PolarHBondContact O-N 3.35Å
246	T	73.9	Confident	82.2	Confident	94 Å²	94	37.8 Å²	37.8	58%	0.577	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-61.4	-24.1	-176.2	51.4	0	0	0	0	113.8	Q233 S244 W248	Q233-T246 PolarHBondContact NE2-O 3.47Å; S244-T246 PolarHBondContact O-N 2.91Å; S244-T246 PolarHBondContact OG-OG1 3.37Å; T246-W248 VanDerWaalsContact C-N 3.33Å
247	D	82.2	Confident	82.4	Confident	66 Å²	66	38.8 Å²	38.8	35%	0.353	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-84.9	-12.5	-177.7	-52.3	-38.5	0	0	0	111.5	S244 A245 R277 A278	S244-D247 WeakPolarHBondContact CB-OD2 3.36Å; S244-D247 PolarHBondContact OG-OD2 2.97Å; A245-D247 PolarHBondContact O-N 2.99Å; A245-D247 VanDerWaalsContact O-N 3.13Å; D247-R277 HydrophobicContact CB-CG 3.59Å; D247-R277 CarbonylContact O-C 3.43Å; D247-R277 VanDerWaalsContact O-CA 3.25Å; D247-R277 WeakPolarHBondContact O-CA 3.3Å; D247-R277 WeakPolarHBondContact O-CG 3.39Å; D247-A278 PolarHBondContact O-N 3.13Å
248	W	85.1	Confident	82.5	Confident	3 Å²	3	33.2 Å²	33.2	1%	0.011	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	136.9	-177.8	-68.6	91.3	0	0	0	112.2	G19 L22 F232 Q233 M236 A245 T246 A275 R277	G19-W248 WeakPolarHBondContact O-CH2 3.36Å; L22-W248 HydrophobicContact CB-CE3 3.95Å; L22-W248 HydrophobicContact CB-CH2 3.7Å; L22-W248 HydrophobicContact CB-CZ3 3.34Å; F232-W248 HydrophobicContact CE1-CB 3.95Å; Q233-W248 PolarHBondContact NE2-O 3.47Å; Q233-W248 VanDerWaalsContact NE2-O 3.1Å; M236-W248 HydrophobicContact CE-CG 4.5Å; A245-W248 PolarHBondContact O-N 3.35Å; T246-W248 VanDerWaalsContact C-N 3.33Å; W248-A275 HydrophobicContact CE3-CB 4.12Å; W248-R277 HydrophobicContact CD2-CB 4.28Å; W248-R277 HydrophobicContact CD2-CG 4.49Å; W248-R277 HydrophobicContact CE3-CB 4.19Å; W248-R277 HydrophobicContact CH2-CB 4.3Å; W248-R277 HydrophobicContact CZ2-CB 4.38Å; W248-R277 HydrophobicContact CZ3-CB 4.18Å
249	R	85.9	Confident	82.6	Confident	126 Å²	126	30 Å²	30	48%	0.475	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.1	176.6	-62.2	-174.8	-176.7	-173.1	1.5	110.3	A275 R276	R249-A275 CarbonylContact O-C 3.59Å; R249-A275 WeakPolarHBondContact O-CA 3.31Å; R249-A275 VanDerWaalsContact O-CB 3.25Å; R249-A275 WeakPolarHBondContact O-CB 3.32Å; R249-R276 PolarHBondContact N-O 2.91Å; R249-R276 PolarHBondContact O-N 3.49Å
250	L	87.3	Confident	82.9	Confident	8 Å²	8	31.2 Å²	31.2	4%	0.042	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	124.2	178	-167.3	63.6	0	0	0	109.1	C105 M227 F232 V253 V273	C105-L250 HydrophobicContact CB-CB 4.23Å; C105-L250 HydrophobicContact CB-CG 4.22Å; C105-L250 WeakPolarHBondContact CB-O 3.08Å; C105-L250 VanDerWaalsContact SG-CD2 3.54Å; M227-L250 HydrophobicContact CB-CD2 4.1Å; M227-L250 HydrophobicContact CG-CD2 4.35Å; M227-L250 HydrophobicContact SD-CD2 4.39Å; F232-L250 HydrophobicContact CD1-CB 4.31Å; F232-L250 HydrophobicContact CD2-CD1 3.99Å; F232-L250 HydrophobicContact CE2-CD1 3.98Å; F232-L250 HydrophobicContact CG-CB 4.31Å; F232-L250 HydrophobicContact CG-CD1 4.43Å; F232-L250 HydrophobicContact CZ-CD1 4.41Å; L250-V253 HydrophobicContact CD1-CG2 3.84Å; L250-V253 HydrophobicContact CD2-CG2 3.71Å; L250-V253 HydrophobicContact CG-CG2 4Å; L250-V273 HydrophobicContact CD1-CG1 3.26Å
251	E	87.5	Confident	83.1	Confident	16 Å²	16	36.6 Å²	36.6	8%	0.075	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-51.4	176.8	-65.8	-166.3	139.4	0	0	110.9	C105 E106 S274 R276	C105-E251 WeakPolarHBondContact CB-O 3.4Å; C105-E251 PolarHBondContact N-O 3.02Å; E106-E251 PolarHBondContact N-O 2.77Å; E106-E251 VanDerWaalsContact N-O 3.14Å; E251-S274 PolarHBondContact N-O 3.41Å; E251-S274 PolarHBondContact OE2-OG 3.23Å; E251-R276 HydrophobicContact CG-CB 3.84Å; E251-R276 WeakPolarHBondContact OE1-CB 3.49Å; E251-R276 IonicContact OE1-CZ 2.77Å; E251-R276 IonicContact OE1-NE 3.04Å; E251-R276 PolarHBondContact OE1-NE 3.15Å; E251-R276 IonicContact OE1-NH1 2.71Å; E251-R276 IonicContact OE1-NH2 3.92Å; E251-R276 PolarHBondContact OE1-NH2 3.03Å; E251-R276 IonicContact OE2-NH2 3.49Å
252	W	89.9	Confident	83.7	Confident	1 Å²	1	38.2 Å²	38.2	0%	0.004	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	151.8	-179.6	56.6	-95.8	0	0	0	111.7	L102 F103 A111 A115 T118 L254 L272 S274	L102-W252 HydrophobicContact CD1-CB 3.98Å; L102-W252 HydrophobicContact CD1-CE3 4.43Å; F103-W252 WeakPolarHBondContact O-CA 3.37Å; A111-W252 HydrophobicContact CB-CB 4.47Å; A111-W252 HydrophobicContact CB-CG 4.32Å; A115-W252 HydrophobicContact CB-CD2 3.66Å; A115-W252 HydrophobicContact CB-CE3 3.64Å; A115-W252 HydrophobicContact CB-CG 4.3Å; A115-W252 HydrophobicContact CB-CH2 4.08Å; A115-W252 HydrophobicContact CB-CZ2 4.06Å; A115-W252 HydrophobicContact CB-CZ3 3.86Å; T118-W252 HydrophobicContact CG2-CH2 4.24Å; W252-L254 HydrophobicContact CE3-CB 4.08Å; W252-L254 HydrophobicContact CZ3-CB 3.91Å; W252-L272 HydrophobicContact CH2-CB 4.16Å; W252-L272 HydrophobicContact CZ3-CB 3.78Å; W252-L272 WeakPolarHBondContact CZ3-O 3.45Å; W252-S274 VanDerWaalsContact CZ2-CB 3.43Å; W252-S274 PolarHBondContact N-O 3.26Å; W252-S274 PolarHBondContact O-N 2.8Å
253	V	91.1	Very high	84.5	Confident	1 Å²	1	44 Å²	44	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.1	169.7	179.6	0	0	0	0	108.3	L47 F103 L226 L250 Y271 L272 V273	L47-V253 HydrophobicContact CD1-CG1 4.15Å; L47-V253 HydrophobicContact CD2-CG1 4Å; L47-V253 HydrophobicContact CD2-CG2 4.05Å; F103-V253 HydrophobicContact CB-CB 4.32Å; F103-V253 WeakPolarHBondContact CD2-O 3.49Å; F103-V253 PolarHBondContact N-O 2.74Å; F103-V253 PolarHBondContact O-N 2.69Å; L226-V253 HydrophobicContact CD2-CB 4.04Å; L226-V253 HydrophobicContact CD2-CG1 3.77Å; L226-V253 HydrophobicContact CD2-CG2 4.49Å; L250-V253 HydrophobicContact CD1-CG2 3.84Å; L250-V253 HydrophobicContact CD2-CG2 3.71Å; L250-V253 HydrophobicContact CG-CG2 4Å; V253-Y271 HydrophobicContact CG1-CD1 3.85Å; V253-L272 WeakPolarHBondContact CA-O 3.31Å; V253-V273 HydrophobicContact CG1-CG2 4.27Å; V253-V273 HydrophobicContact CG2-CG1 4.27Å; V253-V273 HydrophobicContact CG2-CG2 4.28Å
254	L	91.4	Very high	85.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	112.3	174	-171.6	72.2	0	0	0	109.2	A100 L102 A115 A119 W252 Y271 L272	A100-L254 HydrophobicContact CB-CD1 3.6Å; A100-L254 HydrophobicContact CB-CD2 4.12Å; A100-L254 HydrophobicContact CB-CG 3.99Å; L102-L254 HydrophobicContact CB-CD1 3.74Å; L102-L254 HydrophobicContact CD1-CB 4.4Å; L102-L254 HydrophobicContact CD1-CD1 4.03Å; L102-L254 HydrophobicContact CG-CD1 4.45Å; A115-L254 HydrophobicContact CB-CD2 4.46Å; A119-L254 HydrophobicContact CB-CD2 3.54Å; W252-L254 HydrophobicContact CE3-CB 4.08Å; W252-L254 HydrophobicContact CZ3-CB 3.91Å; L254-Y271 CarbonylContact O-C 3.54Å; L254-Y271 WeakPolarHBondContact O-CA 3.49Å; L254-L272 HydrophobicContact CB-CB 4.28Å; L254-L272 HydrophobicContact CD2-CD1 4.3Å; L254-L272 PolarHBondContact N-O 3.14Å; L254-L272 PolarHBondContact O-N 3.22Å
255	R	91.6	Very high	85.7	Confident	33 Å²	33	48.1 Å²	48.1	13%	0.125	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	120.8	171.3	-177.2	174.9	64.2	-161.6	-3.2	109.2	A100 K101 F103 D222 G270 Y271	A100-R255 CarbonylContact C-O 3.53Å; A100-R255 WeakPolarHBondContact CA-O 3.35Å; K101-R255 PolarHBondContact N-O 2.85Å; K101-R255 PolarHBondContact O-N 3.47Å; F103-R255 HydrophobicContact CE2-CB 4.27Å; D222-R255 VanDerWaalsContact CG-NH2 3.29Å; D222-R255 IonicContact OD1-CZ 2.76Å; D222-R255 IonicContact OD1-NH1 3.21Å; D222-R255 PolarHBondContact OD1-NH1 3.06Å; D222-R255 IonicContact OD1-NH2 3.93Å; D222-R255 PolarHBondContact OD1-NH2 3.27Å; D222-R255 IonicContact OD2-CZ 3.78Å; D222-R255 IonicContact OD2-NH2 3.82Å; D222-R255 PolarHBondContact OD2-NH2 3.38Å; R255-G270 WeakPolarHBondContact CA-O 3.44Å; R255-Y271 HydrophobicContact CB-CD1 3.75Å; R255-Y271 HydrophobicContact CB-CE1 3.63Å; R255-Y271 WeakPolarHBondContact CD-OH 3.14Å; R255-Y271 HydrophobicContact CG-CD1 3.99Å; R255-Y271 HydrophobicContact CG-CE1 3.57Å
256	Y	90.5	Very high	86.2	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.008	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	156.2	177.2	68	-89.8	0	0	0	112.3	H25 D85 L123 V258 K269 G270 L272	H25-Y256 AromaticContact NE2-CZ 3.87Å; H25-Y256 PolarHBondContact NE2-OH 3.45Å; D85-Y256 PolarHBondContact OD2-OH 3.04Å; L123-Y256 HydrophobicContact CD1-CD2 4.36Å; L123-Y256 HydrophobicContact CD2-CD2 4.06Å; L123-Y256 HydrophobicContact CD2-CE2 3.85Å; Y256-V258 HydrophobicContact CD2-CG2 4.4Å; Y256-K269 WeakPolarHBondContact O-CA 3.33Å; Y256-G270 VanDerWaalsContact CD1-O 3.28Å; Y256-G270 WeakPolarHBondContact CD1-O 3.29Å; Y256-G270 VanDerWaalsContact CE1-CA 3.48Å; Y256-G270 PolarHBondContact N-O 3.1Å; Y256-G270 PolarHBondContact O-N 3.39Å; Y256-L272 HydrophobicContact CD1-CG 4.17Å; Y256-L272 HydrophobicContact CE1-CD2 4.3Å; Y256-L272 HydrophobicContact CE1-CG 4.15Å
257	S	89.1	Confident	86.7	Confident	21 Å²	21	50.6 Å²	50.6	15%	0.147	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	132.7	170.1	-66.1	0	0	0	0	110.8	I97 S98 S268	I97-S257 CarbonylContact C-O 3.59Å; S98-S257 PolarHBondContact N-O 3.05Å; S257-S268 CarbonylContact C-O 3.44Å; S257-S268 WeakPolarHBondContact CA-O 3.49Å
258	V	88.5	Confident	86.9	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.012	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	118	177.2	-175	0	0	0	0	107.5	I87 V95 L123 Y256 I266 K267 S268	I87-V258 HydrophobicContact CD1-CG1 4.03Å; I87-V258 HydrophobicContact CD1-CG2 4.11Å; V95-V258 HydrophobicContact CB-CG1 3.78Å; V95-V258 HydrophobicContact CG1-CG1 4.07Å; V95-V258 HydrophobicContact CG2-CG1 4Å; L123-V258 HydrophobicContact CD2-CG2 4.47Å; Y256-V258 HydrophobicContact CD2-CG2 4.4Å; V258-I266 CarbonylContact O-C 3.57Å; V258-I266 WeakPolarHBondContact O-CA 3.48Å; V258-K267 HydrophobicContact CG1-CB 4.47Å; V258-K267 PolarHBondContact O-N 2.97Å; V258-S268 PolarHBondContact N-O 2.9Å; V258-S268 PolarHBondContact O-N 2.67Å
259	I	87.9	Confident	87	Confident	41 Å²	41	49.8 Å²	49.8	21%	0.21	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	130.8	-174.8	-57	178.7	0	0	0	109.1	V95 K96 K261 I265 I266	V95-I259 CarbonylContact C-O 3.58Å; V95-I259 VanDerWaalsContact CA-O 3.31Å; V95-I259 WeakPolarHBondContact CA-O 3.34Å; K96-I259 PolarHBondContact N-O 3.24Å; K96-I259 PolarHBondContact O-N 3.27Å; I259-K261 PolarHBondContact O-N 3.08Å; I259-I265 CarbonylContact C-O 3.58Å; I259-I265 WeakPolarHBondContact CA-O 3.22Å; I259-I266 HydrophobicContact CG1-CG1 4.37Å
260	V	86.9	Confident	87.1	Confident	30 Å²	30	43.8 Å²	43.8	18%	0.182	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	115.9	172.2	-177.7	0	0	0	0	109	S262 R263 G264 I265 K267	V260-S262 VanDerWaalsContact C-N 3.35Å; V260-S262 PolarHBondContact O-N 2.73Å; V260-R263 PolarHBondContact O-N 3.44Å; V260-G264 WeakPolarHBondContact O-CA 2.97Å; V260-G264 PolarHBondContact O-N 2.85Å; V260-I265 PolarHBondContact N-O 2.73Å; V260-K267 HydrophobicContact CG2-CB 3.98Å
261	K	84.2	Confident	87.2	Confident	113 Å²	113	43.4 Å²	43.4	49%	0.491	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-43.5	-171.6	-69.8	172.9	-178.2	160.2	0	112.8	E93 E94 V95 K96 I259 R263	E93-K261 PolarHBondContact O-NZ 3.36Å; E94-K261 WeakPolarHBondContact O-CB 3.26Å; E94-K261 WeakPolarHBondContact O-CG 3.4Å; E94-K261 PolarHBondContact O-N 2.85Å; V95-K261 WeakPolarHBondContact O-CE 3.09Å; V95-K261 PolarHBondContact O-NZ 2.88Å; K96-K261 HydrophobicContact CB-CG 4.04Å; I259-K261 PolarHBondContact O-N 3.08Å; K261-R263 PolarHBondContact O-N 3.22Å
262	S	83.6	Confident	87.4	Confident	99 Å²	99	42.8 Å²	42.8	69%	0.692	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-20.7	-175.8	57.9	0	0	0	0	114.2	V260	V260-S262 VanDerWaalsContact C-N 3.35Å; V260-S262 PolarHBondContact O-N 2.73Å
263	R	83.3	Confident	87.4	Confident	194 Å²	194	42.8 Å²	42.8	73%	0.732	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.4	-14.1	-174.2	-59.5	-176.4	-176.7	-179	1.2	113.9	V260 K261 I265	V260-R263 PolarHBondContact O-N 3.44Å; K261-R263 PolarHBondContact O-N 3.22Å; R263-I265 HydrophobicContact CB-CB 4.34Å; R263-I265 HydrophobicContact CB-CD1 3.73Å; R263-I265 HydrophobicContact CB-CG1 3.81Å; R263-I265 PolarHBondContact O-N 2.78Å
264	G	82	Confident	87.4	Confident	56 Å²	56	42.8 Å²	42.8	58%	0.577	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.4	18.9	-172.9	0	0	0	0	0	113.8	V260	V260-G264 WeakPolarHBondContact O-CA 2.97Å; V260-G264 PolarHBondContact O-N 2.85Å
265	I	83.8	Confident	87.3	Confident	98 Å²	98	42.8 Å²	42.8	50%	0.503	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	136.4	-175.8	-62.8	171.8	0	0	0	109.9	I259 V260 R263 K267	I259-I265 CarbonylContact C-O 3.58Å; I259-I265 WeakPolarHBondContact CA-O 3.22Å; V260-I265 PolarHBondContact N-O 2.73Å; R263-I265 HydrophobicContact CB-CB 4.34Å; R263-I265 HydrophobicContact CB-CD1 3.73Å; R263-I265 HydrophobicContact CB-CG1 3.81Å; R263-I265 PolarHBondContact O-N 2.78Å; I265-K267 PolarHBondContact O-N 3.49Å
266	I	85.2	Confident	87.2	Confident	77 Å²	77	46.8 Å²	46.8	40%	0.395	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	111.3	172.3	-58.7	174.5	0	0	0	108.8	V30 V258 I259 S268 K269	V30-I266 HydrophobicContact CG2-CG2 3.98Å; V258-I266 CarbonylContact O-C 3.57Å; V258-I266 WeakPolarHBondContact O-CA 3.48Å; I259-I266 HydrophobicContact CG1-CG1 4.37Å; I266-S268 WeakPolarHBondContact CG2-O 3.33Å; I266-K269 HydrophobicContact CG2-CB 4.06Å
267	K	84.3	Confident	86.9	Confident	76 Å²	76	49.8 Å²	49.8	33%	0.33	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-43	173	175.6	177.7	171.4	-178.1	0	111.2	N28 E91 V95 V258 V260 I265	N28-K267 PolarHBondContact ND2-O 3.06Å; N28-K267 VanDerWaalsContact ND2-O 3.16Å; E91-K267 IonicContact OE1-NZ 2.72Å; E91-K267 PolarHBondContact OE1-NZ 3.46Å; E91-K267 IonicContact OE2-NZ 3.11Å; E91-K267 PolarHBondContact OE2-NZ 2.95Å; V95-K267 HydrophobicContact CG1-CD 4.42Å; V258-K267 HydrophobicContact CG1-CB 4.47Å; V258-K267 PolarHBondContact O-N 2.97Å; V260-K267 HydrophobicContact CG2-CB 3.98Å; I265-K267 PolarHBondContact O-N 3.49Å
268	S	85.4	Confident	86.1	Confident	4 Å²	4	50.5 Å²	50.5	3%	0.028	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	147.3	179.1	-176.4	0	0	0	0	111.5	N28 D85 S257 V258 I266	N28-S268 VanDerWaalsContact CG-OG 3.23Å; N28-S268 WeakPolarHBondContact ND2-CB 3.47Å; N28-S268 PolarHBondContact ND2-OG 3.24Å; N28-S268 WeakPolarHBondContact OD1-CA 3.45Å; N28-S268 PolarHBondContact OD1-OG 2.93Å; D85-S268 WeakPolarHBondContact OD1-CB 3.1Å; D85-S268 PolarHBondContact OD1-OG 2.86Å; D85-S268 PolarHBondContact OD2-OG 2.92Å; D85-S268 VanDerWaalsContact OD2-OG 3.08Å; S257-S268 CarbonylContact C-O 3.44Å; S257-S268 WeakPolarHBondContact CA-O 3.49Å; V258-S268 PolarHBondContact N-O 2.9Å; V258-S268 PolarHBondContact O-N 2.67Å; I266-S268 WeakPolarHBondContact CG2-O 3.33Å
269	K	87.4	Confident	84.7	Confident	47 Å²	47	55.5 Å²	55.5	20%	0.204	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	136.9	173.8	178.9	-170.8	172	-155.9	0	107.7	N28 L29 V30 E46 Y256 I266	N28-K269 CarbonylContact C-O 3.59Å; N28-K269 PolarHBondContact OD1-N 3.47Å; L29-K269 VanDerWaalsContact CB-O 3.32Å; L29-K269 WeakPolarHBondContact CB-O 3.19Å; L29-K269 HydrophobicContact CD1-CG 4.4Å; L29-K269 VanDerWaalsContact CG-O 3.31Å; L29-K269 WeakPolarHBondContact CG-O 3.48Å; L29-K269 PolarHBondContact N-O 2.92Å; V30-K269 HydrophobicContact CG2-CB 4.38Å; E46-K269 VanDerWaalsContact CD-NZ 3.34Å; E46-K269 IonicContact OE1-NZ 3Å; E46-K269 PolarHBondContact OE1-NZ 2.99Å; E46-K269 IonicContact OE2-NZ 2.68Å; E46-K269 PolarHBondContact OE2-NZ 3.23Å; E46-K269 VanDerWaalsContact OE2-NZ 3.11Å; Y256-K269 WeakPolarHBondContact O-CA 3.33Å; I266-K269 HydrophobicContact CG2-CB 4.06Å
270	G	88.2	Confident	82.8	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	179.4	176.7	0	0	0	0	0	112.8	R255 Y256	R255-G270 WeakPolarHBondContact CA-O 3.44Å; Y256-G270 VanDerWaalsContact CD1-O 3.28Å; Y256-G270 WeakPolarHBondContact CD1-O 3.29Å; Y256-G270 VanDerWaalsContact CE1-CA 3.48Å; Y256-G270 PolarHBondContact N-O 3.1Å; Y256-G270 PolarHBondContact O-N 3.39Å
271	Y	89.7	Confident	82.6	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	138.4	172.9	-59.3	-88.8	0	0	0	109.7	T26 L29 E46 L47 V253 L254 R255	T26-Y271 HydrophobicContact CG2-CD2 4.5Å; T26-Y271 PolarHBondContact N-O 3.06Å; T26-Y271 VanDerWaalsContact N-O 3.08Å; T26-Y271 PolarHBondContact OG1-N 3Å; T26-Y271 PolarHBondContact OG1-O 2.82Å; L29-Y271 HydrophobicContact CD1-CD2 3.68Å; L29-Y271 HydrophobicContact CD1-CE2 3.43Å; L29-Y271 VanDerWaalsContact CD1-CE2 3.43Å; E46-Y271 HydrophobicContact CG-CE2 4.1Å; E46-Y271 VanDerWaalsContact OE1-CE2 3.3Å; E46-Y271 WeakPolarHBondContact OE1-CE2 3.4Å; E46-Y271 PolarHBondContact OE1-OH 3.41Å; L47-Y271 HydrophobicContact CD1-CD1 3.84Å; L47-Y271 HydrophobicContact CD1-CD2 4.08Å; L47-Y271 HydrophobicContact CD1-CE1 4.43Å; L47-Y271 HydrophobicContact CD1-CG 3.66Å; V253-Y271 HydrophobicContact CG1-CD1 3.85Å; L254-Y271 CarbonylContact O-C 3.54Å; L254-Y271 WeakPolarHBondContact O-CA 3.49Å; R255-Y271 HydrophobicContact CB-CD1 3.75Å; R255-Y271 HydrophobicContact CB-CE1 3.63Å; R255-Y271 WeakPolarHBondContact CD-OH 3.14Å; R255-Y271 HydrophobicContact CG-CD1 3.99Å; R255-Y271 HydrophobicContact CG-CE1 3.57Å
272	L	90.4	Very high	82.5	Confident	3 Å²	3	62.1 Å²	62.1	2%	0.016	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	130.9	160.7	-56.3	176.5	0	0	0	106.6	L24 H25 T118 A119 T122 W252 V253 L254 Y256	L24-L272 WeakPolarHBondContact O-CA 3.09Å; H25-L272 HydrophobicContact CB-CD2 3.89Å; H25-L272 VanDerWaalsContact CD2-CD2 3.42Å; H25-L272 WeakPolarHBondContact CD2-CD2 3.41Å; T118-L272 HydrophobicContact CG2-CD1 4.32Å; A119-L272 HydrophobicContact CB-CD1 3.85Å; T122-L272 HydrophobicContact CG2-CD2 4.04Å; W252-L272 HydrophobicContact CH2-CB 4.16Å; W252-L272 HydrophobicContact CZ3-CB 3.78Å; W252-L272 WeakPolarHBondContact CZ3-O 3.45Å; V253-L272 WeakPolarHBondContact CA-O 3.31Å; L254-L272 HydrophobicContact CB-CB 4.28Å; L254-L272 HydrophobicContact CD2-CD1 4.3Å; L254-L272 PolarHBondContact N-O 3.14Å; L254-L272 PolarHBondContact O-N 3.22Å; Y256-L272 HydrophobicContact CD1-CG 4.17Å; Y256-L272 HydrophobicContact CE1-CD2 4.3Å; Y256-L272 HydrophobicContact CE1-CG 4.15Å
273	V	91	Very high	82.5	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.012	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	134.6	-176.7	-179.4	0	0	0	0	108.1	R23 L24 L47 I51 L250 V253	R23-V273 CarbonylContact C-O 3.6Å; R23-V273 VanDerWaalsContact CA-O 3.32Å; R23-V273 WeakPolarHBondContact CA-O 3.43Å; L24-V273 HydrophobicContact CB-CB 4.13Å; L24-V273 PolarHBondContact N-O 3.37Å; L24-V273 PolarHBondContact O-N 3.29Å; L47-V273 HydrophobicContact CD1-CG2 3.87Å; I51-V273 HydrophobicContact CD1-CG2 4.42Å; I51-V273 HydrophobicContact CG1-CG2 4.46Å; L250-V273 HydrophobicContact CD1-CG1 3.26Å; V253-V273 HydrophobicContact CG1-CG2 4.27Å; V253-V273 HydrophobicContact CG2-CG1 4.27Å; V253-V273 HydrophobicContact CG2-CG2 4.28Å
274	S	90.8	Very high	82.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.1	165.5	-169.6	0	0	0	0	110.3	L22 E251 W252	L22-S274 CarbonylContact O-C 3.55Å; L22-S274 WeakPolarHBondContact O-CA 3.33Å; E251-S274 PolarHBondContact N-O 3.41Å; E251-S274 PolarHBondContact OE2-OG 3.23Å; W252-S274 VanDerWaalsContact CZ2-CB 3.43Å; W252-S274 PolarHBondContact N-O 3.26Å; W252-S274 PolarHBondContact O-N 2.8Å
275	A	89.6	Confident	82.4	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.008	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	147.1	174	0	0	0	0	0	109.5	T21 L22 F232 W248 R249	T21-A275 CarbonylContact C-O 3.47Å; T21-A275 WeakPolarHBondContact CA-O 3.31Å; L22-A275 HydrophobicContact CB-CB 4.39Å; L22-A275 PolarHBondContact N-O 3.31Å; L22-A275 PolarHBondContact O-N 3.19Å; F232-A275 HydrophobicContact CE1-CB 3.72Å; F232-A275 HydrophobicContact CE2-CB 4.41Å; F232-A275 HydrophobicContact CZ-CB 3.4Å; W248-A275 HydrophobicContact CE3-CB 4.12Å; R249-A275 CarbonylContact O-C 3.59Å; R249-A275 WeakPolarHBondContact O-CA 3.31Å; R249-A275 VanDerWaalsContact O-CB 3.25Å; R249-A275 WeakPolarHBondContact O-CB 3.32Å
276	R	88.4	Confident	82.3	Confident	117 Å²	117	48.9 Å²	48.9	44%	0.442	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	144.4	175.2	-175.9	178.4	-61.5	-176.1	10.2	109.5	K20 R249 E251	K20-R276 CarbonylContact O-C 3.54Å; K20-R276 WeakPolarHBondContact O-CA 3.37Å; R249-R276 PolarHBondContact N-O 2.91Å; R249-R276 PolarHBondContact O-N 3.49Å; E251-R276 HydrophobicContact CG-CB 3.84Å; E251-R276 WeakPolarHBondContact OE1-CB 3.49Å; E251-R276 IonicContact OE1-CZ 2.77Å; E251-R276 IonicContact OE1-NE 3.04Å; E251-R276 PolarHBondContact OE1-NE 3.15Å; E251-R276 IonicContact OE1-NH1 2.71Å; E251-R276 IonicContact OE1-NH2 3.92Å; E251-R276 PolarHBondContact OE1-NH2 3.03Å; E251-R276 IonicContact OE2-NH2 3.49Å
277	R	84.9	Confident	82.1	Confident	64 Å²	64	46.9 Å²	46.9	24%	0.242	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.7	168.7	-158.7	170	68.7	-166	8.4	109.1	N17 G19 K20 D247 W248 S279	N17-R277 PolarHBondContact O-NH1 2.98Å; G19-R277 VanDerWaalsContact O-CZ 3.23Å; G19-R277 PolarHBondContact O-NH1 2.92Å; K20-R277 PolarHBondContact O-N 3.09Å; D247-R277 HydrophobicContact CB-CG 3.59Å; D247-R277 CarbonylContact O-C 3.43Å; D247-R277 VanDerWaalsContact O-CA 3.25Å; D247-R277 WeakPolarHBondContact O-CA 3.3Å; D247-R277 WeakPolarHBondContact O-CG 3.39Å; W248-R277 HydrophobicContact CD2-CB 4.28Å; W248-R277 HydrophobicContact CD2-CG 4.49Å; W248-R277 HydrophobicContact CE3-CB 4.19Å; W248-R277 HydrophobicContact CH2-CB 4.3Å; W248-R277 HydrophobicContact CZ2-CB 4.38Å; W248-R277 HydrophobicContact CZ3-CB 4.18Å; R277-S279 PolarHBondContact O-N 3.21Å
278	A	72.8	Confident	82	Confident	36 Å²	36	44.6 Å²	44.6	30%	0.298	25%	0.253	S	S	.	.			trans	-54.4	114.9	168.5	0	0	0	0	0	107.7	D247	D247-A278 PolarHBondContact O-N 3.13Å
279	S	59.5	Low	81.7	Confident	107 Å²	107	48 Å²	48	75%	0.748	27%	0.272	S	S	*	.			trans	-62.5	136.4	170.4	31.1	0	0	0	0	108.7	R277	R277-S279 PolarHBondContact O-N 3.21Å
280	P	47.6	Very low	81.2	Confident	199 Å²	199	48.1 Å²	48.1	100%	1.292	28%	0.278	S	S	*	.			trans	-61.2	0	171.6	26.1	-32.7	0	0	0	112.2

Retrieved 280 of 280 residues in 374.8 ms (Link to these results)

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