A0A087XYL3_POEFO Loading...

U1 small nuclear ribonucleoprotein A

AlphaFold DB , UniProt , Accession A0A087XYL3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 273 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	34.1	Very low	72.1	Confident	240 Å²	240	108 Å²	108	100%	1.182	58%	0.579	S	S	*	*				0	111.3	0	-74.9	175.4	175.2	0	0	107.6	T3	M1-T3 PolarHBondContact O-N 3.15Å; M1-T3 VanDerWaalsContact O-N 3.14Å
2	T	39.4	Very low	74.3	Confident	148 Å²	148	99 Å²	99	91%	0.908	53%	0.531	S	S	*	.			trans	-71.9	100.1	179	41.1	0	0	0	0	109.5	A4	T2-A4 PolarHBondContact O-N 3.27Å; T2-A4 VanDerWaalsContact O-N 3.08Å
3	T	52.3	Low	76.1	Confident	131 Å²	131	94.8 Å²	94.8	80%	0.804	50%	0.503	S	S	*	.			trans	-65.2	106.6	165.3	48	0	0	0	0	106.9	M1 E5	M1-T3 PolarHBondContact O-N 3.15Å; M1-T3 VanDerWaalsContact O-N 3.14Å; T3-E5 PolarHBondContact O-N 3.27Å
4	A	54.3	Low	77.7	Confident	87 Å²	87	88 Å²	88	72%	0.719	47%	0.468	S	S	*	.			trans	-52.3	118.6	170.4	0	0	0	0	0	107.7	T2 V6	T2-A4 PolarHBondContact O-N 3.27Å; T2-A4 VanDerWaalsContact O-N 3.08Å; A4-V6 WeakPolarHBondContact O-CG2 3.33Å; A4-V6 PolarHBondContact O-N 3.47Å
5	E	58	Low	79	Confident	192 Å²	192	84.8 Å²	84.8	90%	0.897	45%	0.451	S	S	*	.			trans	-65	100.6	-174.8	-147.1	172	-166.6	0	0	108	T3 R7	T3-E5 PolarHBondContact O-N 3.27Å; E5-R7 PolarHBondContact O-N 2.78Å
6	V	77.9	Confident	80.1	Confident	59 Å²	59	82.9 Å²	82.9	36%	0.358	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-72.9	121.2	-176.1	-174.4	0	0	0	0	107.4	A4 Y86	A4-V6 WeakPolarHBondContact O-CG2 3.33Å; A4-V6 PolarHBondContact O-N 3.47Å; V6-Y86 WeakPolarHBondContact O-CD2 3.34Å
7	R	89.4	Confident	81	Confident	216 Å²	216	78.1 Å²	78.1	82%	0.815	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-54.4	142	178.5	-73.7	-175.6	-81.8	-171.7	-5.7	111	E5 N9	E5-R7 PolarHBondContact O-N 2.78Å; R7-N9 PolarHBondContact O-N 3.45Å
8	P	95.4	Very high	81.7	Confident	80 Å²	80	75.2 Å²	75.2	52%	0.519	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-51.1	135.4	174.7	-28	35.4	0	0	0	112	I62 Y86	P8-I62 HydrophobicContact CB-CG2 3.71Å; P8-Y86 HydrophobicContact CB-CE1 4.39Å; P8-Y86 HydrophobicContact CB-CE2 4.4Å; P8-Y86 HydrophobicContact CG-CE2 4.46Å
9	N	96.9	Very high	82.4	Confident	12 Å²	12	75.4 Å²	75.4	6%	0.064	40%	0.398	C	S	.	.			trans	-133.6	149.1	-178.1	-159.4	-66.6	0	0	0	109.9	R7 T11 A65 Y86 D90	R7-N9 PolarHBondContact O-N 3.45Å; N9-T11 PolarHBondContact O-N 3.02Å; N9-T11 PolarHBondContact OD1-N 3.14Å; N9-A65 WeakPolarHBondContact O-CB 3.29Å; N9-Y86 HydrophobicContact CB-CD1 4.23Å; N9-Y86 VanDerWaalsContact N-CD1 3.3Å; N9-D90 PolarHBondContact ND2-OD1 3.45Å
10	H	97.7	Very high	82.9	Confident	23 Å²	23	80.7 Å²	80.7	11%	0.106	42%	0.418	C	S	.	.	S	Bend	trans	-59.7	-26	170.4	-69.4	82.5	0	0	0	112.3	F59 K60 I62 I94	H10-F59 PolarHBondContact O-N 3.5Å; H10-K60 PolarHBondContact CD2-O 2.97Å; H10-K60 PolarHBondContact NE2-O 3.35Å; H10-I62 VanDerWaalsContact CE1-CD1 3.43Å; H10-I62 WeakPolarHBondContact CE1-CD1 3.39Å; H10-I62 WeakPolarHBondContact CE1-CG1 3.4Å; H10-I62 VanDerWaalsContact ND1-CG1 3.33Å; H10-I62 WeakPolarHBondContact ND1-CG1 3.32Å; H10-I62 WeakPolarHBondContact NE2-CG1 3.31Å; H10-I94 HydrophobicContact CB-CD1 3.68Å; H10-I94 HydrophobicContact CB-CG1 3.83Å; H10-I94 HydrophobicContact CB-CG2 4.36Å
11	T	98.2	Very high	83.3	Confident	0 Å²	0	78 Å²	78	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.5	-178.9	-50.6	0	0	0	0	110.3	N9 F56 V57 I58 A87 S91	N9-T11 PolarHBondContact O-N 3.02Å; N9-T11 PolarHBondContact OD1-N 3.14Å; T11-F56 HydrophobicContact CG2-CB 3.87Å; T11-F56 HydrophobicContact CG2-CD1 3.86Å; T11-F56 HydrophobicContact CG2-CG 4.37Å; T11-V57 WeakPolarHBondContact CA-O 3.49Å; T11-I58 HydrophobicContact CG2-CG1 3.79Å; T11-A87 HydrophobicContact CG2-CB 3.78Å; T11-A87 WeakPolarHBondContact O-CB 3.3Å; T11-A87 PolarHBondContact O-N 3.21Å; T11-S91 WeakPolarHBondContact CB-OG 3.19Å; T11-S91 WeakPolarHBondContact CG2-OG 3.49Å; T11-S91 WeakPolarHBondContact OG1-CB 3.46Å; T11-S91 PolarHBondContact OG1-OG 3.48Å
12	I	98.2	Very high	86.2	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	137.4	165.2	62.2	172.8	0	0	0	109.9	I14 F34 F56 V57 F59 A65 A68 L69 I84 Q85	I12-I14 HydrophobicContact CD1-CD1 4.05Å; I12-I14 HydrophobicContact CD1-CG1 4.25Å; I12-I14 HydrophobicContact CG1-CD1 4.45Å; I12-I14 HydrophobicContact CG1-CG1 4.34Å; I12-F34 HydrophobicContact CD1-CD1 3.85Å; I12-F34 HydrophobicContact CD1-CE1 3.54Å; I12-F34 HydrophobicContact CD1-CZ 4Å; I12-F56 WeakPolarHBondContact O-CA 3.15Å; I12-V57 HydrophobicContact CD1-CB 4.15Å; I12-V57 HydrophobicContact CG1-CB 3.75Å; I12-V57 HydrophobicContact CG1-CG2 4.49Å; I12-V57 PolarHBondContact N-O 2.88Å; I12-V57 PolarHBondContact O-N 2.81Å; I12-F59 HydrophobicContact CD1-CE2 3.89Å; I12-F59 HydrophobicContact CG1-CE2 4.09Å; I12-A65 HydrophobicContact CG2-CB 3.86Å; I12-A68 HydrophobicContact CD1-CB 4.21Å; I12-L69 HydrophobicContact CG2-CB 4.5Å; I12-I84 HydrophobicContact CB-CG2 3.86Å; I12-I84 HydrophobicContact CD1-CG2 4Å; I12-I84 HydrophobicContact CG1-CG2 4.41Å; I12-I84 HydrophobicContact CG2-CG2 4.27Å; I12-Q85 CarbonylContact C-O 3.53Å; I12-Q85 WeakPolarHBondContact CA-O 3.47Å
13	Y	98	Very high	88.9	Confident	44 Å²	44	71 Å²	71	17%	0.173	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	128.1	169.7	166.8	-109.8	0	0	0	108.8	N15 Q54 F56 I84 Q85	Y13-N15 HydrophobicContact CE1-CB 3.83Å; Y13-N15 HydrophobicContact CE2-CB 4.44Å; Y13-N15 WeakPolarHBondContact OH-CB 3Å; Y13-Q54 HydrophobicContact CE2-CB 3.94Å; Y13-Q54 HydrophobicContact CE2-CG 3.97Å; Y13-Q54 WeakPolarHBondContact OH-CG 3.34Å; Y13-Q54 PolarHBondContact OH-OE1 3.13Å; Y13-F56 HydrophobicContact CD2-CD1 4.24Å; Y13-F56 AromaticContact CD2-CE1 3.64Å; Y13-F56 HydrophobicContact CD2-CE1 3.64Å; Y13-F56 AromaticContact CD2-CE2 3.9Å; Y13-F56 HydrophobicContact CD2-CE2 3.9Å; Y13-F56 AromaticContact CD2-CZ 3.45Å; Y13-F56 HydrophobicContact CD2-CZ 3.45Å; Y13-F56 VanDerWaalsContact CD2-CZ 3.45Å; Y13-F56 HydrophobicContact CE2-CE2 4.29Å; Y13-F56 HydrophobicContact CE2-CZ 4Å; Y13-F56 HydrophobicContact CG-CE1 4.17Å; Y13-F56 HydrophobicContact CG-CZ 4.36Å; Y13-I84 WeakPolarHBondContact O-CA 3.49Å; Y13-Q85 HydrophobicContact CD1-CB 4.41Å; Y13-Q85 PolarHBondContact N-O 3.34Å; Y13-Q85 PolarHBondContact O-N 2.68Å
14	I	97.9	Very high	90.8	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.9	-179.8	-48.8	175.3	0	0	0	108.3	I12 L17 L30 F34 Q54 A55 V57 M82 R83 I84	I12-I14 HydrophobicContact CD1-CD1 4.05Å; I12-I14 HydrophobicContact CD1-CG1 4.25Å; I12-I14 HydrophobicContact CG1-CD1 4.45Å; I12-I14 HydrophobicContact CG1-CG1 4.34Å; I14-L17 HydrophobicContact CB-CD1 4.48Å; I14-L17 HydrophobicContact CG2-CD1 4.23Å; I14-L17 HydrophobicContact CG2-CD2 3.76Å; I14-L17 HydrophobicContact CG2-CG 4.06Å; I14-L30 HydrophobicContact CD1-CD2 4.05Å; I14-F34 HydrophobicContact CD1-CD2 4.22Å; I14-F34 HydrophobicContact CD1-CE2 3.4Å; I14-F34 HydrophobicContact CD1-CZ 3.58Å; I14-Q54 CarbonylContact O-C 3.55Å; I14-Q54 VanDerWaalsContact O-CA 3.25Å; I14-Q54 WeakPolarHBondContact O-CA 3.3Å; I14-A55 PolarHBondContact N-O 3.41Å; I14-A55 PolarHBondContact O-N 2.86Å; I14-V57 HydrophobicContact CD1-CG2 3.78Å; I14-M82 HydrophobicContact CG2-CB 3.89Å; I14-M82 HydrophobicContact CG2-CG 4.48Å; I14-M82 HydrophobicContact CG2-SD 4.13Å; I14-R83 CarbonylContact C-O 3.54Å; I14-R83 VanDerWaalsContact CA-O 3.31Å; I14-R83 WeakPolarHBondContact CA-O 3.28Å; I14-I84 HydrophobicContact CG1-CG1 4.33Å; I14-I84 HydrophobicContact CG1-CG2 4.41Å; I14-I84 HydrophobicContact CG2-CG1 4.36Å
15	N	96.9	Very high	92.7	Very high	40 Å²	40	69.9 Å²	69.9	21%	0.214	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	179.2	171.8	72.2	-34.9	0	0	0	112.2	Y13 L17 G53 Q54 R83	Y13-N15 HydrophobicContact CE1-CB 3.83Å; Y13-N15 HydrophobicContact CE2-CB 4.44Å; Y13-N15 WeakPolarHBondContact OH-CB 3Å; N15-L17 VanDerWaalsContact C-N 3.25Å; N15-L17 PolarHBondContact O-N 3.11Å; N15-G53 WeakPolarHBondContact CA-O 3.43Å; N15-Q54 HydrophobicContact CB-CG 4.1Å; N15-R83 PolarHBondContact N-O 3.43Å; N15-R83 PolarHBondContact O-N 3.02Å; N15-R83 WeakPolarHBondContact OD1-CB 3.5Å; N15-R83 PolarHBondContact OD1-O 3Å; N15-R83 VanDerWaalsContact OD1-O 3.1Å
16	N	96.7	Very high	94.4	Very high	55 Å²	55	61.1 Å²	61.1	29%	0.294	29%	0.288	S	S	.	.	S	Bend	trans	65.6	23.2	-171.6	-162.2	40.3	0	0	0	114.3	G53 K80 P81 R83	N16-G53 PolarHBondContact N-O 2.88Å; N16-K80 WeakPolarHBondContact O-CB 3.48Å; N16-K80 WeakPolarHBondContact O-CE 3.46Å; N16-K80 PolarHBondContact O-NZ 2.8Å; N16-K80 WeakPolarHBondContact OD1-CE 3.39Å; N16-K80 PolarHBondContact OD1-NZ 3.04Å; N16-P81 PolarHBondContact ND2-O 3.28Å; N16-R83 HydrophobicContact CB-CG 4.39Å
17	L	96.3	Very high	95.3	Very high	1 Å²	1	61 Å²	61	1%	0.005	28%	0.282	C	S	.	.			trans	-70.4	160.6	174.9	-59	171.5	0	0	0	111.2	I14 N15 E19 L26 L30 G53 A55 F77 K80 M82	I14-L17 HydrophobicContact CB-CD1 4.48Å; I14-L17 HydrophobicContact CG2-CD1 4.23Å; I14-L17 HydrophobicContact CG2-CD2 3.76Å; I14-L17 HydrophobicContact CG2-CG 4.06Å; N15-L17 VanDerWaalsContact C-N 3.25Å; N15-L17 PolarHBondContact O-N 3.11Å; L17-E19 PolarHBondContact O-N 2.97Å; L17-L26 HydrophobicContact CD1-CD1 4.45Å; L17-L26 HydrophobicContact CD1-CD2 4.41Å; L17-L30 HydrophobicContact CD1-CD1 4.4Å; L17-G53 WeakPolarHBondContact CB-O 3.45Å; L17-G53 PolarHBondContact N-O 3.41Å; L17-G53 VanDerWaalsContact N-O 3.07Å; L17-A55 HydrophobicContact CD1-CB 3.66Å; L17-F77 HydrophobicContact CD2-CD1 3.58Å; L17-F77 HydrophobicContact CD2-CE1 3.89Å; L17-K80 PolarHBondContact O-NZ 3.48Å; L17-M82 HydrophobicContact CD2-CB 4.1Å; L17-M82 HydrophobicContact CD2-CE 4.11Å
18	N	92.9	Very high	95.5	Very high	25 Å²	25	58.3 Å²	58.3	13%	0.134	28%	0.276	C	S	.	.			trans	-72.9	117.9	175.5	-170.6	-23.2	0	0	0	110.5	K20 I21 Y78 K80	N18-K20 VanDerWaalsContact C-N 3.26Å; N18-K20 PolarHBondContact O-N 3.04Å; N18-K20 WeakPolarHBondContact OD1-CB 3.32Å; N18-K20 PolarHBondContact OD1-N 3.34Å; N18-I21 HydrophobicContact CB-CG1 4.01Å; N18-Y78 WeakPolarHBondContact CB-O 3.32Å; N18-Y78 PolarHBondContact ND2-O 3.19Å; N18-K80 HydrophobicContact CB-CD 4.15Å
19	E	94.4	Very high	95.4	Very high	80 Å²	80	55.2 Å²	55.2	37%	0.374	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-16.4	-175.4	-62.6	-176.7	-177.3	0	0	113.5	L17 I21 R47 K52	L17-E19 PolarHBondContact O-N 2.97Å; E19-I21 VanDerWaalsContact C-N 3.34Å; E19-R47 PolarHBondContact O-NH2 3.05Å; E19-K52 HydrophobicContact CG-CB 4.35Å; E19-K52 HydrophobicContact CG-CG 4.37Å; E19-K52 WeakPolarHBondContact OE1-CE 3.19Å; E19-K52 IonicContact OE1-NZ 3.63Å; E19-K52 WeakPolarHBondContact OE2-CD 3.15Å; E19-K52 WeakPolarHBondContact OE2-CE 3.5Å; E19-K52 IonicContact OE2-NZ 2.71Å; E19-K52 PolarHBondContact OE2-NZ 3.48Å
20	K	93.1	Very high	95.4	Very high	181 Å²	181	54.7 Å²	54.7	79%	0.787	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-27.9	-177.2	-63.7	-179.2	180	177.1	0	112.1	N18 R47	N18-K20 VanDerWaalsContact C-N 3.26Å; N18-K20 PolarHBondContact O-N 3.04Å; N18-K20 WeakPolarHBondContact OD1-CB 3.32Å; N18-K20 PolarHBondContact OD1-N 3.34Å; K20-R47 PolarHBondContact O-NH2 3.04Å
21	I	92.4	Very high	95.3	Very high	25 Å²	25	59.4 Å²	59.4	13%	0.128	27%	0.272	C	S	.	.	S	Bend	trans	-65.3	139.5	-176.1	-49.5	-56	0	0	0	111.2	N18 E19 E25 L26 R47 Y78	N18-I21 HydrophobicContact CB-CG1 4.01Å; E19-I21 VanDerWaalsContact C-N 3.34Å; I21-E25 HydrophobicContact CG2-CB 4.11Å; I21-E25 HydrophobicContact CG2-CG 4.14Å; I21-L26 HydrophobicContact CB-CB 4.49Å; I21-L26 HydrophobicContact CG2-CB 3.96Å; I21-R47 PolarHBondContact O-NE 2.79Å; I21-R47 PolarHBondContact O-NH2 3.36Å; I21-Y78 HydrophobicContact CD1-CD1 3.54Å; I21-Y78 HydrophobicContact CD1-CD2 4.42Å; I21-Y78 HydrophobicContact CD1-CE1 3.82Å; I21-Y78 HydrophobicContact CD1-CG 3.85Å; I21-Y78 HydrophobicContact CG1-CD1 3.96Å; I21-Y78 HydrophobicContact CG1-CD2 3.92Å; I21-Y78 HydrophobicContact CG1-CE1 4.26Å; I21-Y78 HydrophobicContact CG1-CE2 4.22Å; I21-Y78 HydrophobicContact CG1-CG 3.76Å; I21-Y78 HydrophobicContact CG2-CE2 4.16Å
22	K	94.4	Very high	94.9	Very high	147 Å²	147	60.7 Å²	60.7	64%	0.639	28%	0.282	S	S	*	.			trans	-67.9	149.9	178.2	-68.7	179.2	-178.1	173.4	0	110.2	D24 E25 L26	K22-D24 VanDerWaalsContact C-N 3.34Å; K22-D24 PolarHBondContact O-N 3.41Å; K22-E25 HydrophobicContact CB-CB 4.37Å; K22-E25 PolarHBondContact O-N 3.1Å; K22-L26 VanDerWaalsContact O-CB 3.29Å; K22-L26 WeakPolarHBondContact O-CB 3.4Å; K22-L26 PolarHBondContact O-N 2.93Å
23	K	94.8	Very high	94.5	Very high	93 Å²	93	60.9 Å²	60.9	40%	0.404	28%	0.283	S	S	.	.	H	α-helix	trans	-56.6	-45.7	-174.5	177.1	-177.3	165.9	-173.1	0	112.4	K27 V45 R47	K23-K27 WeakPolarHBondContact O-CG 3.08Å; K23-K27 PolarHBondContact O-N 3.25Å; K23-V45 WeakPolarHBondContact CE-O 3.42Å; K23-V45 HydrophobicContact CG-CB 4.28Å; K23-V45 HydrophobicContact CG-CG1 4.14Å; K23-R47 HydrophobicContact CB-CG 4.41Å
24	D	93.8	Very high	94.4	Very high	108 Å²	108	58.8 Å²	58.8	58%	0.578	28%	0.275	S	S	*	.	H	α-helix	trans	-74	-38.6	-174.5	-55.5	-45.7	0	0	0	111.9	K22 K27 K28	K22-D24 VanDerWaalsContact C-N 3.34Å; K22-D24 PolarHBondContact O-N 3.41Å; D24-K27 PolarHBondContact O-N 3.08Å; D24-K28 WeakPolarHBondContact O-CG 3.25Å; D24-K28 PolarHBondContact O-N 2.95Å
25	E	92.9	Very high	94.3	Very high	87 Å²	87	61.1 Å²	61.1	41%	0.407	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-47.3	172.9	-170.3	-172.3	158.8	0	0	111.1	I21 K22 K27 K28 S29 Y78	I21-E25 HydrophobicContact CG2-CB 4.11Å; I21-E25 HydrophobicContact CG2-CG 4.14Å; K22-E25 HydrophobicContact CB-CB 4.37Å; K22-E25 PolarHBondContact O-N 3.1Å; E25-K27 VanDerWaalsContact C-N 3.29Å; E25-K27 PolarHBondContact O-N 3.3Å; E25-K28 PolarHBondContact O-N 3.45Å; E25-K28 VanDerWaalsContact O-N 3.14Å; E25-S29 PolarHBondContact O-N 3.31Å; E25-S29 PolarHBondContact O-OG 3.21Å; E25-S29 VanDerWaalsContact O-OG 3.14Å; E25-Y78 PolarHBondContact OE1-OH 3.28Å
26	L	94.7	Very high	94	Very high	8 Å²	8	65.1 Å²	65.1	4%	0.042	31%	0.309	C	S	.	.	H	α-helix	trans	-58.1	-42	176.5	-177.9	57.1	0	0	0	111.7	L17 I21 K22 L30 V45 F77 Y78	L17-L26 HydrophobicContact CD1-CD1 4.45Å; L17-L26 HydrophobicContact CD1-CD2 4.41Å; I21-L26 HydrophobicContact CB-CB 4.49Å; I21-L26 HydrophobicContact CG2-CB 3.96Å; K22-L26 VanDerWaalsContact O-CB 3.29Å; K22-L26 WeakPolarHBondContact O-CB 3.4Å; K22-L26 PolarHBondContact O-N 2.93Å; L26-L30 HydrophobicContact CD1-CD1 4.15Å; L26-L30 HydrophobicContact CD1-CG 4.25Å; L26-L30 HydrophobicContact CG-CD1 4.08Å; L26-L30 WeakPolarHBondContact O-CB 3.39Å; L26-L30 WeakPolarHBondContact O-CG 3.37Å; L26-L30 PolarHBondContact O-N 2.87Å; L26-V45 HydrophobicContact CD2-CG1 3.78Å; L26-V45 HydrophobicContact CG-CG1 4.41Å; L26-F77 HydrophobicContact CD1-CE1 3.48Å; L26-F77 VanDerWaalsContact CD1-CE1 3.48Å; L26-F77 HydrophobicContact CD1-CZ 3.98Å; L26-Y78 HydrophobicContact CD1-CE2 4.48Å
27	K	96.3	Very high	93.9	Very high	56 Å²	56	64 Å²	64	24%	0.243	30%	0.302	C	S	.	.	H	α-helix	trans	-63.2	-46.4	174.7	-79.9	-173.1	174.3	-143.3	0	112.4	K23 D24 E25 L30 Y31 I43 V45	K23-K27 WeakPolarHBondContact O-CG 3.08Å; K23-K27 PolarHBondContact O-N 3.25Å; D24-K27 PolarHBondContact O-N 3.08Å; E25-K27 VanDerWaalsContact C-N 3.29Å; E25-K27 PolarHBondContact O-N 3.3Å; K27-L30 PolarHBondContact O-N 3.43Å; K27-Y31 WeakPolarHBondContact O-CB 3.39Å; K27-Y31 PolarHBondContact O-N 3.39Å; K27-I43 WeakPolarHBondContact CE-O 3.36Å; K27-I43 HydrophobicContact CG-CG2 4.29Å; K27-I43 PolarHBondContact NZ-O 3.11Å; K27-V45 HydrophobicContact CG-CB 4.03Å; K27-V45 HydrophobicContact CG-CG2 3.63Å
28	K	93.2	Very high	93.8	Very high	159 Å²	159	65 Å²	65	69%	0.691	31%	0.312	S	S	*	.	H	α-helix	trans	-60	-46.6	178.7	-74.9	179.9	178.9	-169.5	0	111.3	D24 E25 Y31 A32	D24-K28 WeakPolarHBondContact O-CG 3.25Å; D24-K28 PolarHBondContact O-N 2.95Å; E25-K28 PolarHBondContact O-N 3.45Å; E25-K28 VanDerWaalsContact O-N 3.14Å; K28-Y31 WeakPolarHBondContact O-CB 3.37Å; K28-Y31 PolarHBondContact O-N 3.34Å; K28-A32 WeakPolarHBondContact O-CB 3.16Å; K28-A32 PolarHBondContact O-N 2.94Å
29	S	93.2	Very high	94	Very high	16 Å²	16	69.5 Å²	69.5	11%	0.112	33%	0.332	C	S	.	.	H	α-helix	trans	-68.1	-39.6	-179.5	-56.5	0	0	0	0	112.4	E25 Y31 A32 I33 Y78	E25-S29 PolarHBondContact O-N 3.31Å; E25-S29 PolarHBondContact O-OG 3.21Å; E25-S29 VanDerWaalsContact O-OG 3.14Å; S29-Y31 VanDerWaalsContact C-N 3.34Å; S29-A32 PolarHBondContact O-N 2.9Å; S29-I33 WeakPolarHBondContact O-CG1 3.34Å; S29-I33 PolarHBondContact O-N 2.89Å; S29-I33 VanDerWaalsContact O-N 3.12Å; S29-Y78 WeakPolarHBondContact CB-OH 3.49Å; S29-Y78 PolarHBondContact OG-OH 2.83Å
30	L	96.6	Very high	94.2	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63	-41.3	171.8	-72.3	171	0	0	0	111.3	I14 L17 L26 K27 I33 F34 I43 V45 A55 F77 M82	I14-L30 HydrophobicContact CD1-CD2 4.05Å; L17-L30 HydrophobicContact CD1-CD1 4.4Å; L26-L30 HydrophobicContact CD1-CD1 4.15Å; L26-L30 HydrophobicContact CD1-CG 4.25Å; L26-L30 HydrophobicContact CG-CD1 4.08Å; L26-L30 WeakPolarHBondContact O-CB 3.39Å; L26-L30 WeakPolarHBondContact O-CG 3.37Å; L26-L30 PolarHBondContact O-N 2.87Å; K27-L30 PolarHBondContact O-N 3.43Å; L30-I33 PolarHBondContact O-N 3.19Å; L30-F34 HydrophobicContact CD2-CD2 4.17Å; L30-F34 HydrophobicContact CD2-CE2 3.85Å; L30-F34 WeakPolarHBondContact O-CB 3.08Å; L30-F34 VanDerWaalsContact O-CD2 3.3Å; L30-F34 WeakPolarHBondContact O-CD2 3.36Å; L30-F34 PolarHBondContact O-N 2.9Å; L30-I43 HydrophobicContact CB-CD1 4.12Å; L30-I43 HydrophobicContact CB-CG2 4.47Å; L30-I43 HydrophobicContact CD1-CG2 4.22Å; L30-V45 HydrophobicContact CD1-CG2 4.25Å; L30-A55 HydrophobicContact CD1-CB 3.57Å; L30-F77 HydrophobicContact CD2-CE1 3.88Å; L30-F77 HydrophobicContact CD2-CZ 3.97Å; L30-F77 HydrophobicContact CG-CE1 4.23Å; L30-F77 HydrophobicContact CG-CZ 4.1Å; L30-M82 HydrophobicContact CD2-CE 4.18Å
31	Y	96.8	Very high	94.4	Very high	122 Å²	122	60.5 Å²	60.5	48%	0.478	30%	0.295	S	S	.	.	H	α-helix	trans	-61.2	-48.4	175.6	-175.6	-91.5	0	0	0	111.5	K27 K28 S29 I33 F34 S35 I40 I43	K27-Y31 WeakPolarHBondContact O-CB 3.39Å; K27-Y31 PolarHBondContact O-N 3.39Å; K28-Y31 WeakPolarHBondContact O-CB 3.37Å; K28-Y31 PolarHBondContact O-N 3.34Å; S29-Y31 VanDerWaalsContact C-N 3.34Å; Y31-I33 VanDerWaalsContact C-N 3.3Å; Y31-I33 PolarHBondContact O-N 3.28Å; Y31-F34 PolarHBondContact O-N 2.8Å; Y31-S35 WeakPolarHBondContact O-CB 3.46Å; Y31-S35 PolarHBondContact O-N 2.92Å; Y31-S35 PolarHBondContact O-OG 2.85Å; Y31-I40 HydrophobicContact CD2-CB 4.27Å; Y31-I40 HydrophobicContact CD2-CD1 3.95Å; Y31-I40 HydrophobicContact CD2-CG2 4.36Å; Y31-I40 HydrophobicContact CE2-CB 4.13Å; Y31-I40 HydrophobicContact CE2-CD1 4.38Å; Y31-I43 HydrophobicContact CD2-CD1 4.18Å; Y31-I43 HydrophobicContact CG-CD1 4.44Å
32	A	88.8	Confident	94.6	Very high	27 Å²	27	62.4 Å²	62.4	22%	0.223	31%	0.305	C	S	.	.	H	α-helix	trans	-57.7	-41.9	-179.2	0	0	0	0	0	112.4	K28 S29 S35	K28-A32 WeakPolarHBondContact O-CB 3.16Å; K28-A32 PolarHBondContact O-N 2.94Å; S29-A32 PolarHBondContact O-N 2.9Å; A32-S35 PolarHBondContact O-OG 2.91Å
33	I	90.3	Very high	94.8	Very high	4 Å²	4	55.9 Å²	55.9	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-75.8	-45.9	-179.8	-64.4	167	0	0	0	111.2	S29 L30 Y31 Q36 M72 F77 L213	S29-I33 WeakPolarHBondContact O-CG1 3.34Å; S29-I33 PolarHBondContact O-N 2.89Å; S29-I33 VanDerWaalsContact O-N 3.12Å; L30-I33 PolarHBondContact O-N 3.19Å; Y31-I33 VanDerWaalsContact C-N 3.3Å; Y31-I33 PolarHBondContact O-N 3.28Å; I33-Q36 VanDerWaalsContact O-CG 3.28Å; I33-Q36 WeakPolarHBondContact O-CG 3.38Å; I33-Q36 PolarHBondContact O-NE2 3.01Å; I33-M72 HydrophobicContact CG2-CE 3.31Å; I33-M72 HydrophobicContact CG2-SD 4.06Å; I33-F77 HydrophobicContact CD1-CD2 3.41Å; I33-F77 VanDerWaalsContact CD1-CD2 3.41Å; I33-F77 HydrophobicContact CD1-CE2 3.27Å; I33-F77 HydrophobicContact CD1-CZ 4.33Å; I33-L213 HydrophobicContact CD1-CD2 3.26Å; I33-L213 HydrophobicContact CG1-CD2 3.8Å
34	F	96.5	Very high	94.9	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-84.7	-17.8	-169.6	-78.1	-73.9	0	0	0	114	I12 I14 L30 Y31 Q36 F37 I40 V57 F59 A68 M72 M82 I84	I12-F34 HydrophobicContact CD1-CD1 3.85Å; I12-F34 HydrophobicContact CD1-CE1 3.54Å; I12-F34 HydrophobicContact CD1-CZ 4Å; I14-F34 HydrophobicContact CD1-CD2 4.22Å; I14-F34 HydrophobicContact CD1-CE2 3.4Å; I14-F34 HydrophobicContact CD1-CZ 3.58Å; L30-F34 HydrophobicContact CD2-CD2 4.17Å; L30-F34 HydrophobicContact CD2-CE2 3.85Å; L30-F34 WeakPolarHBondContact O-CB 3.08Å; L30-F34 VanDerWaalsContact O-CD2 3.3Å; L30-F34 WeakPolarHBondContact O-CD2 3.36Å; L30-F34 PolarHBondContact O-N 2.9Å; Y31-F34 PolarHBondContact O-N 2.8Å; F34-Q36 PolarHBondContact O-N 3.39Å; F34-F37 AromaticContact CD1-CD2 3.86Å; F34-F37 HydrophobicContact CD1-CD2 3.86Å; F34-F37 AromaticContact CD1-CE2 4Å; F34-F37 HydrophobicContact CD1-CE2 4Å; F34-F37 HydrophobicContact CE1-CE2 4.42Å; F34-F37 WeakPolarHBondContact O-CD2 3.17Å; F34-F37 PolarHBondContact O-N 2.79Å; F34-F37 VanDerWaalsContact O-N 3.11Å; F34-I40 HydrophobicContact CB-CD1 3.78Å; F34-V57 HydrophobicContact CB-CG1 4.15Å; F34-V57 HydrophobicContact CD2-CG2 4.23Å; F34-V57 HydrophobicContact CG-CG1 4.46Å; F34-F59 HydrophobicContact CB-CZ 3.9Å; F34-F59 HydrophobicContact CD1-CZ 4.06Å; F34-F59 HydrophobicContact CG-CZ 4.37Å; F34-F59 WeakPolarHBondContact O-CE1 3.25Å; F34-A68 HydrophobicContact CD1-CB 3.73Å; F34-A68 HydrophobicContact CE1-CB 3.89Å; F34-M72 HydrophobicContact CD1-CG 4.46Å; F34-M72 HydrophobicContact CE1-CB 3.89Å; F34-M72 HydrophobicContact CE1-CG 3.75Å; F34-M72 HydrophobicContact CZ-CB 4.01Å; F34-M72 HydrophobicContact CZ-CG 4.16Å; F34-M82 HydrophobicContact CE2-CE 4.23Å; F34-M82 HydrophobicContact CE2-SD 4.05Å; F34-M82 HydrophobicContact CZ-SD 3.74Å; F34-I84 HydrophobicContact CE1-CD1 4.09Å; F34-I84 HydrophobicContact CZ-CD1 3.81Å
35	S	94.4	Very high	95	Very high	49 Å²	49	50.6 Å²	50.6	34%	0.343	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-60.2	-26.8	179	62	0	0	0	0	112.7	Y31 A32 F37 G38	Y31-S35 WeakPolarHBondContact O-CB 3.46Å; Y31-S35 PolarHBondContact O-N 2.92Å; Y31-S35 PolarHBondContact O-OG 2.85Å; A32-S35 PolarHBondContact O-OG 2.91Å; S35-F37 PolarHBondContact O-N 3.33Å; S35-G38 PolarHBondContact O-N 3.24Å
36	Q	92.4	Very high	94.9	Very high	124 Å²	124	48 Å²	48	58%	0.579	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-63.1	-24.9	177.3	78.1	-173.3	-79.8	0	0	113.5	I33 F34	I33-Q36 VanDerWaalsContact O-CG 3.28Å; I33-Q36 WeakPolarHBondContact O-CG 3.38Å; I33-Q36 PolarHBondContact O-NE2 3.01Å; F34-Q36 PolarHBondContact O-N 3.39Å
37	F	93.8	Very high	94.6	Very high	33 Å²	33	53.5 Å²	53.5	15%	0.145	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-86.4	-16.6	-179.7	-56.9	-73.1	0	0	0	112.8	F34 S35 F59 S64 N67 A68 M72	F34-F37 AromaticContact CD1-CD2 3.86Å; F34-F37 HydrophobicContact CD1-CD2 3.86Å; F34-F37 AromaticContact CD1-CE2 4Å; F34-F37 HydrophobicContact CD1-CE2 4Å; F34-F37 HydrophobicContact CE1-CE2 4.42Å; F34-F37 WeakPolarHBondContact O-CD2 3.17Å; F34-F37 PolarHBondContact O-N 2.79Å; F34-F37 VanDerWaalsContact O-N 3.11Å; S35-F37 PolarHBondContact O-N 3.33Å; F37-F59 HydrophobicContact CB-CE1 4.17Å; F37-F59 HydrophobicContact CB-CZ 4.34Å; F37-S64 WeakPolarHBondContact O-CA 3.4Å; F37-S64 WeakPolarHBondContact O-CB 3.25Å; F37-S64 PolarHBondContact O-OG 2.81Å; F37-N67 HydrophobicContact CD1-CB 4.25Å; F37-A68 HydrophobicContact CB-CB 3.98Å; F37-A68 HydrophobicContact CD1-CB 4.34Å; F37-A68 HydrophobicContact CD2-CB 3.62Å; F37-A68 HydrophobicContact CE2-CB 4.22Å; F37-A68 HydrophobicContact CG-CB 3.7Å; F37-M72 HydrophobicContact CE2-CG 3.47Å; F37-M72 VanDerWaalsContact CE2-CG 3.47Å; F37-M72 HydrophobicContact CE2-SD 3.97Å; F37-M72 HydrophobicContact CZ-CG 3.49Å; F37-M72 VanDerWaalsContact CZ-CG 3.49Å; F37-M72 HydrophobicContact CZ-SD 3.75Å
38	G	94.3	Very high	94.4	Very high	21 Å²	21	55.2 Å²	55.2	22%	0.216	28%	0.279	C	S	.	.	S	Bend	trans	152.3	178.7	177	0	0	0	0	0	113.5	S35 I40	S35-G38 PolarHBondContact O-N 3.24Å; G38-I40 PolarHBondContact O-N 3.35Å
39	Q	97.2	Very high	94.1	Very high	120 Å²	120	54.8 Å²	54.8	56%	0.561	28%	0.283	S	S	*	.			trans	-63	120.7	-177.2	-173.4	173.6	25	0	0	111.5	F59 K60	Q39-F59 WeakPolarHBondContact O-CA 3.21Å; Q39-K60 HydrophobicContact CB-CB 4.18Å; Q39-K60 PolarHBondContact O-N 2.9Å
40	I	98.2	Very high	94	Very high	18 Å²	18	61.1 Å²	61.1	9%	0.092	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	128.9	173.5	-62.1	172.9	0	0	0	108.7	Y31 F34 G38 I43 V57 I58 F59	Y31-I40 HydrophobicContact CD2-CB 4.27Å; Y31-I40 HydrophobicContact CD2-CD1 3.95Å; Y31-I40 HydrophobicContact CD2-CG2 4.36Å; Y31-I40 HydrophobicContact CE2-CB 4.13Å; Y31-I40 HydrophobicContact CE2-CD1 4.38Å; F34-I40 HydrophobicContact CB-CD1 3.78Å; G38-I40 PolarHBondContact O-N 3.35Å; I40-I43 HydrophobicContact CD1-CD1 4.32Å; I40-I43 HydrophobicContact CG2-CD1 4.26Å; I40-I43 HydrophobicContact CG2-CG1 3.73Å; I40-V57 HydrophobicContact CD1-CG1 3.99Å; I40-V57 HydrophobicContact CG1-CG1 4.13Å; I40-V57 HydrophobicContact CG2-CG1 4.21Å; I40-I58 CarbonylContact C-O 3.58Å; I40-I58 WeakPolarHBondContact CA-O 3.37Å; I40-F59 HydrophobicContact CD1-CE1 4.49Å; I40-F59 HydrophobicContact CG1-CD1 4.06Å; I40-F59 HydrophobicContact CG1-CE1 3.82Å; I40-F59 HydrophobicContact CG1-CZ 4.47Å
41	L	97	Very high	93.8	Very high	54 Å²	54	63.4 Å²	63.4	28%	0.283	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-43.9	175.2	-61.6	-178.9	0	0	0	111.9	I58 K60 I93 I94	L41-I58 HydrophobicContact CB-CG2 4.36Å; L41-I58 HydrophobicContact CD1-CG2 4.44Å; L41-I58 PolarHBondContact N-O 2.8Å; L41-K60 HydrophobicContact CD2-CB 4.01Å; L41-K60 HydrophobicContact CD2-CG 4.36Å; L41-K60 HydrophobicContact CG-CB 4.14Å; L41-I93 HydrophobicContact CB-CD1 3.96Å; L41-I93 HydrophobicContact CD1-CD1 4.44Å; L41-I93 HydrophobicContact CD1-CG1 4.45Å; L41-I94 HydrophobicContact CD1-CD1 3.73Å
42	D	97.6	Very high	93.6	Very high	65 Å²	65	61.2 Å²	61.2	35%	0.348	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	157.5	177.7	-170.7	15.5	0	0	0	111	L44 I58	D42-L44 VanDerWaalsContact OD2-CD2 3.29Å; D42-L44 WeakPolarHBondContact OD2-CD2 3.36Å; D42-I58 HydrophobicContact CB-CD1 4.21Å; D42-I58 WeakPolarHBondContact O-CB 3.4Å; D42-I58 PolarHBondContact O-N 2.75Å
43	I	97.9	Very high	93.9	Very high	10 Å²	10	60.5 Å²	60.5	5%	0.051	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	116.1	172.8	-54.6	-177.2	0	0	0	109.1	K27 L30 Y31 I40 V45 F56 V57	K27-I43 WeakPolarHBondContact CE-O 3.36Å; K27-I43 HydrophobicContact CG-CG2 4.29Å; K27-I43 PolarHBondContact NZ-O 3.11Å; L30-I43 HydrophobicContact CB-CD1 4.12Å; L30-I43 HydrophobicContact CB-CG2 4.47Å; L30-I43 HydrophobicContact CD1-CG2 4.22Å; Y31-I43 HydrophobicContact CD2-CD1 4.18Å; Y31-I43 HydrophobicContact CG-CD1 4.44Å; I40-I43 HydrophobicContact CD1-CD1 4.32Å; I40-I43 HydrophobicContact CG2-CD1 4.26Å; I40-I43 HydrophobicContact CG2-CG1 3.73Å; I43-V45 HydrophobicContact CG2-CG2 4.02Å; I43-F56 CarbonylContact C-O 3.59Å; I43-F56 WeakPolarHBondContact CA-O 3.42Å; I43-V57 HydrophobicContact CG1-CG1 4.36Å; I43-V57 HydrophobicContact CG1-CG2 4.42Å; I43-V57 HydrophobicContact CG2-CG2 4.21Å
44	L	96.7	Very high	94.2	Very high	79 Å²	79	62.4 Å²	62.4	41%	0.414	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	118.2	178.7	-57.3	175.8	0	0	0	110.4	D42 A55 F56 I58	D42-L44 VanDerWaalsContact OD2-CD2 3.29Å; D42-L44 WeakPolarHBondContact OD2-CD2 3.36Å; L44-A55 WeakPolarHBondContact O-CA 3.3Å; L44-F56 HydrophobicContact CB-CB 4.21Å; L44-F56 PolarHBondContact N-O 2.91Å; L44-F56 PolarHBondContact O-N 3.4Å; L44-I58 HydrophobicContact CD1-CD1 4.11Å; L44-I58 HydrophobicContact CG-CD1 4.26Å
45	V	95.6	Very high	94.3	Very high	11 Å²	11	62.4 Å²	62.4	7%	0.067	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	132.7	176.5	179.9	0	0	0	0	108.7	K23 L26 K27 L30 I43 A55	K23-V45 WeakPolarHBondContact CE-O 3.42Å; K23-V45 HydrophobicContact CG-CB 4.28Å; K23-V45 HydrophobicContact CG-CG1 4.14Å; L26-V45 HydrophobicContact CD2-CG1 3.78Å; L26-V45 HydrophobicContact CG-CG1 4.41Å; K27-V45 HydrophobicContact CG-CB 4.03Å; K27-V45 HydrophobicContact CG-CG2 3.63Å; L30-V45 HydrophobicContact CD1-CG2 4.25Å; I43-V45 HydrophobicContact CG2-CG2 4.02Å; V45-A55 HydrophobicContact CG2-CB 3.92Å
46	A	90.9	Very high	94.5	Very high	33 Å²	33	62.4 Å²	62.4	27%	0.273	31%	0.311	S	S	.	.			trans	-134.1	144.9	173.7	0	0	0	0	0	110.1	M51	A46-M51 HydrophobicContact CB-CB 3.74Å; A46-M51 HydrophobicContact CB-CG 4.19Å; A46-M51 CarbonylContact O-C 3.51Å; A46-M51 VanDerWaalsContact O-C 3.28Å; A46-M51 VanDerWaalsContact O-O 3.04Å
47	R	89.5	Confident	94.8	Very high	122 Å²	122	56.5 Å²	56.5	46%	0.46	28%	0.283	S	S	.	.			trans	-108.7	15.9	-178.3	-63.5	-170.7	75.3	-171.3	11.3	113.7	E19 K20 I21 K23	E19-R47 PolarHBondContact O-NH2 3.05Å; K20-R47 PolarHBondContact O-NH2 3.04Å; I21-R47 PolarHBondContact O-NE 2.79Å; I21-R47 PolarHBondContact O-NH2 3.36Å; K23-R47 HydrophobicContact CB-CG 4.41Å
48	N	91.9	Very high	95	Very high	92 Å²	92	55 Å²	55	49%	0.492	28%	0.277	S	S	.	.	S	Bend	trans	-69.1	162.5	172.4	66.2	24.7	0	0	0	110.1	K50 M51 K52	N48-K50 PolarHBondContact O-N 2.71Å; N48-K50 PolarHBondContact OD1-N 3.42Å; N48-M51 PolarHBondContact O-N 2.92Å; N48-M51 WeakPolarHBondContact OD1-CB 3.11Å; N48-M51 WeakPolarHBondContact OD1-CG 3.33Å; N48-M51 PolarHBondContact OD1-N 3.24Å; N48-K52 WeakPolarHBondContact O-CB 3.41Å; N48-K52 PolarHBondContact O-N 3.22Å
49	L	87.4	Confident	95.2	Very high	150 Å²	150	54 Å²	54	79%	0.785	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-31.8	-174.1	-171.7	64.9	0	0	0	113.6	K52	L49-K52 HydrophobicContact CD1-CD 4.38Å
50	K	90.5	Very high	95.2	Very high	150 Å²	150	52.2 Å²	52.2	65%	0.652	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-30.2	-179.7	-173.8	177.7	176.2	-178.3	0	113.5	N48 Q54 E109	N48-K50 PolarHBondContact O-N 2.71Å; N48-K50 PolarHBondContact OD1-N 3.42Å; K50-Q54 PolarHBondContact O-NE2 3Å; K50-E109 IonicContact NZ-OE1 2.73Å
51	M	92.6	Very high	95.2	Very high	48 Å²	48	56.2 Å²	56.2	24%	0.236	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-6.5	-170.1	-57.6	-68.8	-65.8	0	0	113.7	A46 N48 G53 Q54 F56	A46-M51 HydrophobicContact CB-CB 3.74Å; A46-M51 HydrophobicContact CB-CG 4.19Å; A46-M51 CarbonylContact O-C 3.51Å; A46-M51 VanDerWaalsContact O-C 3.28Å; A46-M51 VanDerWaalsContact O-O 3.04Å; N48-M51 PolarHBondContact O-N 2.92Å; N48-M51 WeakPolarHBondContact OD1-CB 3.11Å; N48-M51 WeakPolarHBondContact OD1-CG 3.33Å; N48-M51 PolarHBondContact OD1-N 3.24Å; M51-G53 PolarHBondContact O-N 2.96Å; M51-Q54 WeakPolarHBondContact O-CB 3.32Å; M51-Q54 PolarHBondContact O-N 2.76Å; M51-Q54 VanDerWaalsContact O-N 3.09Å; M51-F56 HydrophobicContact CE-CD2 4.38Å; M51-F56 HydrophobicContact CE-CE2 3.67Å
52	K	92.8	Very high	95.2	Very high	75 Å²	75	56.3 Å²	56.3	33%	0.326	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	140.9	175.4	66	178.3	-164.1	151.5	0	110	E19 N48 L49 Q54	E19-K52 HydrophobicContact CG-CB 4.35Å; E19-K52 HydrophobicContact CG-CG 4.37Å; E19-K52 WeakPolarHBondContact OE1-CE 3.19Å; E19-K52 IonicContact OE1-NZ 3.63Å; E19-K52 WeakPolarHBondContact OE2-CD 3.15Å; E19-K52 WeakPolarHBondContact OE2-CE 3.5Å; E19-K52 IonicContact OE2-NZ 2.71Å; E19-K52 PolarHBondContact OE2-NZ 3.48Å; N48-K52 WeakPolarHBondContact O-CB 3.41Å; N48-K52 PolarHBondContact O-N 3.22Å; L49-K52 HydrophobicContact CD1-CD 4.38Å; K52-Q54 PolarHBondContact O-N 3.36Å
53	G	94.6	Very high	95.1	Very high	12 Å²	12	58.7 Å²	58.7	12%	0.124	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	12.4	-176.3	0	0	0	0	0	114.6	N15 N16 L17 M51	N15-G53 WeakPolarHBondContact CA-O 3.43Å; N16-G53 PolarHBondContact N-O 2.88Å; L17-G53 WeakPolarHBondContact CB-O 3.45Å; L17-G53 PolarHBondContact N-O 3.41Å; L17-G53 VanDerWaalsContact N-O 3.07Å; M51-G53 PolarHBondContact O-N 2.96Å
54	Q	97.6	Very high	95.1	Very high	44 Å²	44	59 Å²	59	21%	0.206	29%	0.291	C	S	.	.			trans	-127.4	148.7	179.4	-59.5	163.4	50.2	0	0	111.6	Y13 I14 N15 K50 M51 K52	Y13-Q54 HydrophobicContact CE2-CB 3.94Å; Y13-Q54 HydrophobicContact CE2-CG 3.97Å; Y13-Q54 WeakPolarHBondContact OH-CG 3.34Å; Y13-Q54 PolarHBondContact OH-OE1 3.13Å; I14-Q54 CarbonylContact O-C 3.55Å; I14-Q54 VanDerWaalsContact O-CA 3.25Å; I14-Q54 WeakPolarHBondContact O-CA 3.3Å; N15-Q54 HydrophobicContact CB-CG 4.1Å; K50-Q54 PolarHBondContact O-NE2 3Å; M51-Q54 WeakPolarHBondContact O-CB 3.32Å; M51-Q54 PolarHBondContact O-N 2.76Å; M51-Q54 VanDerWaalsContact O-N 3.09Å; K52-Q54 PolarHBondContact O-N 3.36Å
55	A	97.9	Very high	95.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	156.9	175.5	0	0	0	0	0	111.1	I14 L17 L30 L44 V45	I14-A55 PolarHBondContact N-O 3.41Å; I14-A55 PolarHBondContact O-N 2.86Å; L17-A55 HydrophobicContact CD1-CB 3.66Å; L30-A55 HydrophobicContact CD1-CB 3.57Å; L44-A55 WeakPolarHBondContact O-CA 3.3Å; V45-A55 HydrophobicContact CG2-CB 3.92Å
56	F	98.3	Very high	95.2	Very high	50 Å²	50	55.2 Å²	55.2	22%	0.219	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.4	167.4	-63.1	-99.8	0	0	0	108.6	T11 I12 Y13 I43 L44 M51 A87	T11-F56 HydrophobicContact CG2-CB 3.87Å; T11-F56 HydrophobicContact CG2-CD1 3.86Å; T11-F56 HydrophobicContact CG2-CG 4.37Å; I12-F56 WeakPolarHBondContact O-CA 3.15Å; Y13-F56 HydrophobicContact CD2-CD1 4.24Å; Y13-F56 AromaticContact CD2-CE1 3.64Å; Y13-F56 HydrophobicContact CD2-CE1 3.64Å; Y13-F56 AromaticContact CD2-CE2 3.9Å; Y13-F56 HydrophobicContact CD2-CE2 3.9Å; Y13-F56 AromaticContact CD2-CZ 3.45Å; Y13-F56 HydrophobicContact CD2-CZ 3.45Å; Y13-F56 VanDerWaalsContact CD2-CZ 3.45Å; Y13-F56 HydrophobicContact CE2-CE2 4.29Å; Y13-F56 HydrophobicContact CE2-CZ 4Å; Y13-F56 HydrophobicContact CG-CE1 4.17Å; Y13-F56 HydrophobicContact CG-CZ 4.36Å; I43-F56 CarbonylContact C-O 3.59Å; I43-F56 WeakPolarHBondContact CA-O 3.42Å; L44-F56 HydrophobicContact CB-CB 4.21Å; L44-F56 PolarHBondContact N-O 2.91Å; L44-F56 PolarHBondContact O-N 3.4Å; M51-F56 HydrophobicContact CE-CD2 4.38Å; M51-F56 HydrophobicContact CE-CE2 3.67Å; F56-A87 HydrophobicContact CD1-CB 4.31Å; F56-A87 HydrophobicContact CE1-CB 4.36Å
57	V	98.3	Very high	95.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	122.2	173.9	-179.7	0	0	0	0	107.4	T11 I12 I14 F34 I40 I43 F59	T11-V57 WeakPolarHBondContact CA-O 3.49Å; I12-V57 HydrophobicContact CD1-CB 4.15Å; I12-V57 HydrophobicContact CG1-CB 3.75Å; I12-V57 HydrophobicContact CG1-CG2 4.49Å; I12-V57 PolarHBondContact N-O 2.88Å; I12-V57 PolarHBondContact O-N 2.81Å; I14-V57 HydrophobicContact CD1-CG2 3.78Å; F34-V57 HydrophobicContact CB-CG1 4.15Å; F34-V57 HydrophobicContact CD2-CG2 4.23Å; F34-V57 HydrophobicContact CG-CG1 4.46Å; I40-V57 HydrophobicContact CD1-CG1 3.99Å; I40-V57 HydrophobicContact CG1-CG1 4.13Å; I40-V57 HydrophobicContact CG2-CG1 4.21Å; I43-V57 HydrophobicContact CG1-CG1 4.36Å; I43-V57 HydrophobicContact CG1-CG2 4.42Å; I43-V57 HydrophobicContact CG2-CG2 4.21Å; V57-F59 HydrophobicContact CB-CE2 4.47Å; V57-F59 HydrophobicContact CG1-CD2 4.32Å; V57-F59 HydrophobicContact CG1-CE2 3.8Å; V57-F59 HydrophobicContact CG1-CZ 4.02Å
58	I	98.4	Very high	95.6	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	111.6	-173.3	-54.3	163.9	0	0	0	108.4	T11 I40 L41 D42 L44 S91 I93 I94	T11-I58 HydrophobicContact CG2-CG1 3.79Å; I40-I58 CarbonylContact C-O 3.58Å; I40-I58 WeakPolarHBondContact CA-O 3.37Å; L41-I58 HydrophobicContact CB-CG2 4.36Å; L41-I58 HydrophobicContact CD1-CG2 4.44Å; L41-I58 PolarHBondContact N-O 2.8Å; D42-I58 HydrophobicContact CB-CD1 4.21Å; D42-I58 WeakPolarHBondContact O-CB 3.4Å; D42-I58 PolarHBondContact O-N 2.75Å; L44-I58 HydrophobicContact CD1-CD1 4.11Å; L44-I58 HydrophobicContact CG-CD1 4.26Å; I58-S91 WeakPolarHBondContact CD1-OG 3.43Å; I58-S91 WeakPolarHBondContact CG1-OG 3.39Å; I58-I93 HydrophobicContact CD1-CG2 3.92Å; I58-I93 HydrophobicContact CG2-CG2 3.71Å; I58-I94 HydrophobicContact CG2-CD1 3.77Å; I58-I94 HydrophobicContact CG2-CG1 3.64Å
59	F	98.6	Very high	95.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	154.9	175.4	-69.2	-85.2	0	0	0	111.6	H10 I12 F34 F37 Q39 I40 V57 E61 A65 A68	H10-F59 PolarHBondContact O-N 3.5Å; I12-F59 HydrophobicContact CD1-CE2 3.89Å; I12-F59 HydrophobicContact CG1-CE2 4.09Å; F34-F59 HydrophobicContact CB-CZ 3.9Å; F34-F59 HydrophobicContact CD1-CZ 4.06Å; F34-F59 HydrophobicContact CG-CZ 4.37Å; F34-F59 WeakPolarHBondContact O-CE1 3.25Å; F37-F59 HydrophobicContact CB-CE1 4.17Å; F37-F59 HydrophobicContact CB-CZ 4.34Å; Q39-F59 WeakPolarHBondContact O-CA 3.21Å; I40-F59 HydrophobicContact CD1-CE1 4.49Å; I40-F59 HydrophobicContact CG1-CD1 4.06Å; I40-F59 HydrophobicContact CG1-CE1 3.82Å; I40-F59 HydrophobicContact CG1-CZ 4.47Å; V57-F59 HydrophobicContact CB-CE2 4.47Å; V57-F59 HydrophobicContact CG1-CD2 4.32Å; V57-F59 HydrophobicContact CG1-CE2 3.8Å; V57-F59 HydrophobicContact CG1-CZ 4.02Å; F59-E61 WeakPolarHBondContact CB-O 3.35Å; F59-A65 HydrophobicContact CB-CB 4.45Å; F59-A65 HydrophobicContact CD2-CB 3.76Å; F59-A65 HydrophobicContact CE2-CB 4.43Å; F59-A65 HydrophobicContact CG-CB 4.4Å; F59-A68 HydrophobicContact CE2-CB 3.97Å; F59-A68 HydrophobicContact CZ-CB 3.84Å
60	K	97	Very high	96	Very high	81 Å²	81	48.7 Å²	48.7	35%	0.352	23%	0.23	S	C	.	.	S	Bend	trans	-68.4	-35.7	168.9	-173.8	176.1	174.5	-174.4	0	112.3	H10 Q39 L41	H10-K60 PolarHBondContact CD2-O 2.97Å; H10-K60 PolarHBondContact NE2-O 3.35Å; Q39-K60 HydrophobicContact CB-CB 4.18Å; Q39-K60 PolarHBondContact O-N 2.9Å; L41-K60 HydrophobicContact CD2-CB 4.01Å; L41-K60 HydrophobicContact CD2-CG 4.36Å; L41-K60 HydrophobicContact CG-CB 4.14Å
61	E	97.6	Very high	96	Very high	102 Å²	102	45.3 Å²	45.3	48%	0.477	23%	0.225	S	C	.	.	S	Bend	trans	-115.1	139.7	-177.5	-59.8	-58.1	146.6	0	0	111.8	F59 N63 S64 A65	F59-E61 WeakPolarHBondContact CB-O 3.35Å; E61-N63 VanDerWaalsContact C-N 3.28Å; E61-N63 PolarHBondContact O-N 3.17Å; E61-S64 WeakPolarHBondContact O-CB 3.44Å; E61-S64 PolarHBondContact O-N 2.97Å; E61-A65 PolarHBondContact O-N 3.17Å
62	I	97.2	Very high	96	Very high	56 Å²	56	43.5 Å²	43.5	29%	0.287	22%	0.216	S	C	.	.	H	α-helix	trans	-64.7	-34.6	176.6	-58.4	179.8	0	0	0	111.5	P8 H10 S64 A65 S66	P8-I62 HydrophobicContact CB-CG2 3.71Å; H10-I62 VanDerWaalsContact CE1-CD1 3.43Å; H10-I62 WeakPolarHBondContact CE1-CD1 3.39Å; H10-I62 WeakPolarHBondContact CE1-CG1 3.4Å; H10-I62 VanDerWaalsContact ND1-CG1 3.33Å; H10-I62 WeakPolarHBondContact ND1-CG1 3.32Å; H10-I62 WeakPolarHBondContact NE2-CG1 3.31Å; I62-S64 VanDerWaalsContact C-N 3.32Å; I62-S64 PolarHBondContact O-N 2.91Å; I62-A65 WeakPolarHBondContact O-CB 3.48Å; I62-A65 PolarHBondContact O-N 3.34Å; I62-S66 PolarHBondContact O-N 3.08Å; I62-S66 PolarHBondContact O-OG 2.79Å
63	N	96.6	Very high	96	Very high	116 Å²	116	44.6 Å²	44.6	62%	0.62	22%	0.222	S	C	*	.	H	α-helix	trans	-64.2	-39.2	-179.3	-67.5	-17.7	0	0	0	111.3	E61 S66 N67	E61-N63 VanDerWaalsContact C-N 3.28Å; E61-N63 PolarHBondContact O-N 3.17Å; N63-S66 WeakPolarHBondContact O-CB 3.46Å; N63-S66 PolarHBondContact O-N 3.4Å; N63-N67 WeakPolarHBondContact O-CB 3.48Å; N63-N67 PolarHBondContact O-N 2.9Å; N63-N67 PolarHBondContact O-OD1 2.95Å
64	S	97.9	Very high	95.6	Very high	15 Å²	15	45.7 Å²	45.7	11%	0.105	23%	0.234	C	C	.	.	H	α-helix	trans	-60	-45.7	173.6	-63	0	0	0	0	111.9	F37 E61 I62 S66 N67 A68	F37-S64 WeakPolarHBondContact O-CA 3.4Å; F37-S64 WeakPolarHBondContact O-CB 3.25Å; F37-S64 PolarHBondContact O-OG 2.81Å; E61-S64 WeakPolarHBondContact O-CB 3.44Å; E61-S64 PolarHBondContact O-N 2.97Å; I62-S64 VanDerWaalsContact C-N 3.32Å; I62-S64 PolarHBondContact O-N 2.91Å; S64-S66 VanDerWaalsContact C-N 3.31Å; S64-S66 PolarHBondContact O-N 2.99Å; S64-N67 PolarHBondContact O-N 2.85Å; S64-A68 VanDerWaalsContact O-CB 3.24Å; S64-A68 WeakPolarHBondContact O-CB 3.39Å; S64-A68 PolarHBondContact O-N 3.35Å
65	A	97.8	Very high	95.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-40.4	175	0	0	0	0	0	112.3	N9 I12 F59 E61 I62 L69	N9-A65 WeakPolarHBondContact O-CB 3.29Å; I12-A65 HydrophobicContact CG2-CB 3.86Å; F59-A65 HydrophobicContact CB-CB 4.45Å; F59-A65 HydrophobicContact CD2-CB 3.76Å; F59-A65 HydrophobicContact CE2-CB 4.43Å; F59-A65 HydrophobicContact CG-CB 4.4Å; E61-A65 PolarHBondContact O-N 3.17Å; I62-A65 WeakPolarHBondContact O-CB 3.48Å; I62-A65 PolarHBondContact O-N 3.34Å; A65-L69 WeakPolarHBondContact O-CB 3.25Å; A65-L69 PolarHBondContact O-N 3.47Å
66	S	96.1	Very high	94.7	Very high	11 Å²	11	49.4 Å²	49.4	8%	0.077	26%	0.258	C	S	.	.	H	α-helix	trans	-67.4	-41.7	179.5	-53.6	0	0	0	0	112.4	I62 N63 S64 R70 Y86	I62-S66 PolarHBondContact O-N 3.08Å; I62-S66 PolarHBondContact O-OG 2.79Å; N63-S66 WeakPolarHBondContact O-CB 3.46Å; N63-S66 PolarHBondContact O-N 3.4Å; S64-S66 VanDerWaalsContact C-N 3.31Å; S64-S66 PolarHBondContact O-N 2.99Å; S66-R70 WeakPolarHBondContact O-CG 3.46Å; S66-R70 PolarHBondContact O-N 2.79Å; S66-R70 PolarHBondContact O-NH1 3.25Å; S66-Y86 VanDerWaalsContact CA-OH 3.29Å; S66-Y86 WeakPolarHBondContact CA-OH 3.47Å; S66-Y86 VanDerWaalsContact CB-OH 3.26Å; S66-Y86 WeakPolarHBondContact CB-OH 3.34Å; S66-Y86 PolarHBondContact OG-OH 3.19Å
67	N	93.3	Very high	94.4	Very high	69 Å²	69	47.2 Å²	47.2	37%	0.369	25%	0.248	S	C	.	.	H	α-helix	trans	-66.4	-48.4	176.4	-66.8	-7.8	0	0	0	110.6	F37 N63 S64 L69 R70 S71	F37-N67 HydrophobicContact CD1-CB 4.25Å; N63-N67 WeakPolarHBondContact O-CB 3.48Å; N63-N67 PolarHBondContact O-N 2.9Å; N63-N67 PolarHBondContact O-OD1 2.95Å; S64-N67 PolarHBondContact O-N 2.85Å; N67-L69 VanDerWaalsContact C-N 3.31Å; N67-L69 PolarHBondContact O-N 3.1Å; N67-R70 PolarHBondContact O-N 3.43Å; N67-R70 PolarHBondContact OD1-NH2 2.94Å; N67-S71 WeakPolarHBondContact O-CB 3.33Å; N67-S71 PolarHBondContact O-N 2.83Å; N67-S71 PolarHBondContact O-OG 2.76Å
68	A	96	Very high	94	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-54.4	-46.4	175.8	0	0	0	0	0	112.2	I12 F34 F37 F59 S64 R70 M72	I12-A68 HydrophobicContact CD1-CB 4.21Å; F34-A68 HydrophobicContact CD1-CB 3.73Å; F34-A68 HydrophobicContact CE1-CB 3.89Å; F37-A68 HydrophobicContact CB-CB 3.98Å; F37-A68 HydrophobicContact CD1-CB 4.34Å; F37-A68 HydrophobicContact CD2-CB 3.62Å; F37-A68 HydrophobicContact CE2-CB 4.22Å; F37-A68 HydrophobicContact CG-CB 3.7Å; F59-A68 HydrophobicContact CE2-CB 3.97Å; F59-A68 HydrophobicContact CZ-CB 3.84Å; S64-A68 VanDerWaalsContact O-CB 3.24Å; S64-A68 WeakPolarHBondContact O-CB 3.39Å; S64-A68 PolarHBondContact O-N 3.35Å; A68-R70 PolarHBondContact O-N 3.4Å; A68-M72 VanDerWaalsContact O-CB 3.25Å; A68-M72 WeakPolarHBondContact O-CB 3.49Å; A68-M72 WeakPolarHBondContact O-CG 3.26Å; A68-M72 PolarHBondContact O-N 2.97Å
69	L	96.3	Very high	93.3	Very high	30 Å²	30	57.5 Å²	57.5	16%	0.157	30%	0.299	C	S	.	.	H	α-helix	trans	-60	-47.1	179.2	-176.5	156	0	0	0	111.8	I12 A65 N67 Q73 I84 Y86	I12-L69 HydrophobicContact CG2-CB 4.5Å; A65-L69 WeakPolarHBondContact O-CB 3.25Å; A65-L69 PolarHBondContact O-N 3.47Å; N67-L69 VanDerWaalsContact C-N 3.31Å; N67-L69 PolarHBondContact O-N 3.1Å; L69-Q73 WeakPolarHBondContact O-CB 3.29Å; L69-Q73 PolarHBondContact O-N 3.45Å; L69-I84 HydrophobicContact CB-CG2 4.08Å; L69-I84 HydrophobicContact CD1-CG2 4.31Å; L69-I84 HydrophobicContact CG-CB 4.34Å; L69-I84 HydrophobicContact CG-CG2 3.94Å; L69-Y86 HydrophobicContact CD1-CD1 4.17Å; L69-Y86 HydrophobicContact CD1-CD2 4.05Å; L69-Y86 HydrophobicContact CD1-CE1 4.09Å; L69-Y86 HydrophobicContact CD1-CE2 3.97Å; L69-Y86 HydrophobicContact CD1-CG 4.15Å
70	R	91.6	Very high	92.9	Very high	161 Å²	161	60.3 Å²	60.3	61%	0.608	31%	0.311	S	S	*	.	H	α-helix	trans	-68.8	-43.1	-178.4	-68.4	-169.9	-56.7	-91.3	-2.1	112.1	S66 N67 A68	S66-R70 WeakPolarHBondContact O-CG 3.46Å; S66-R70 PolarHBondContact O-N 2.79Å; S66-R70 PolarHBondContact O-NH1 3.25Å; N67-R70 PolarHBondContact O-N 3.43Å; N67-R70 PolarHBondContact OD1-NH2 2.94Å; A68-R70 PolarHBondContact O-N 3.4Å
71	S	88.8	Confident	92.5	Very high	80 Å²	80	59.7 Å²	59.7	56%	0.559	32%	0.315	S	S	*	.	H	α-helix	trans	-77	-30.7	-174.5	-60.9	0	0	0	0	113.7	N67	N67-S71 WeakPolarHBondContact O-CB 3.33Å; N67-S71 PolarHBondContact O-N 2.83Å; N67-S71 PolarHBondContact O-OG 2.76Å
72	M	92.8	Very high	92.4	Very high	9 Å²	9	54.8 Å²	54.8	4%	0.044	29%	0.293	C	S	.	.	S	Bend	trans	-105.4	6.4	-173.7	-58.9	-60.3	-56.4	0	0	113.3	I33 F34 F37 A68 G74 F75 M82 I84 M217	I33-M72 HydrophobicContact CG2-CE 3.31Å; I33-M72 HydrophobicContact CG2-SD 4.06Å; F34-M72 HydrophobicContact CD1-CG 4.46Å; F34-M72 HydrophobicContact CE1-CB 3.89Å; F34-M72 HydrophobicContact CE1-CG 3.75Å; F34-M72 HydrophobicContact CZ-CB 4.01Å; F34-M72 HydrophobicContact CZ-CG 4.16Å; F37-M72 HydrophobicContact CE2-CG 3.47Å; F37-M72 VanDerWaalsContact CE2-CG 3.47Å; F37-M72 HydrophobicContact CE2-SD 3.97Å; F37-M72 HydrophobicContact CZ-CG 3.49Å; F37-M72 VanDerWaalsContact CZ-CG 3.49Å; F37-M72 HydrophobicContact CZ-SD 3.75Å; A68-M72 VanDerWaalsContact O-CB 3.25Å; A68-M72 WeakPolarHBondContact O-CB 3.49Å; A68-M72 WeakPolarHBondContact O-CG 3.26Å; A68-M72 PolarHBondContact O-N 2.97Å; M72-G74 PolarHBondContact O-N 3.44Å; M72-F75 HydrophobicContact CB-CB 4.48Å; M72-F75 HydrophobicContact CE-CB 3.75Å; M72-F75 HydrophobicContact CE-CD1 3.32Å; M72-F75 HydrophobicContact CE-CD2 4.02Å; M72-F75 HydrophobicContact CE-CE1 3.97Å; M72-F75 HydrophobicContact CE-CG 3.37Å; M72-F75 WeakPolarHBondContact O-CB 3.47Å; M72-F75 PolarHBondContact O-N 2.76Å; M72-F75 HydrophobicContact SD-CG 4.49Å; M72-M82 HydrophobicContact CB-SD 4.44Å; M72-I84 HydrophobicContact CB-CD1 3.42Å; M72-I84 VanDerWaalsContact CB-CD1 3.42Å; M72-I84 WeakPolarHBondContact O-CD1 3.49Å; M72-M217 HydrophobicContact CE-CE 4.33Å
73	Q	94.3	Very high	92.4	Very high	98 Å²	98	59.6 Å²	59.6	46%	0.458	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	127.8	179.3	-174.9	66.7	-67.1	0	0	110.9	L69 F75 I84	L69-Q73 WeakPolarHBondContact O-CB 3.29Å; L69-Q73 PolarHBondContact O-N 3.45Å; Q73-F75 PolarHBondContact O-N 2.92Å; Q73-I84 PolarHBondContact NE2-O 3.18Å
74	G	86.3	Confident	92.5	Very high	35 Å²	35	54.1 Å²	54.1	36%	0.361	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	2.6	-179.7	0	0	0	0	0	114	M72 P81 M82	M72-G74 PolarHBondContact O-N 3.44Å; G74-P81 VanDerWaalsContact O-CB 3.25Å; G74-P81 WeakPolarHBondContact O-CB 3.37Å; G74-M82 WeakPolarHBondContact CA-O 3.48Å; G74-M82 PolarHBondContact N-O 3.07Å
75	F	89	Confident	92.5	Very high	41 Å²	41	57.8 Å²	57.8	18%	0.18	29%	0.293	C	S	.	.			trans	-61.1	129.1	-175.7	-178.9	-95.8	0	0	0	111.3	M72 Q73 F77 P81 M82 L213 M217	M72-F75 HydrophobicContact CB-CB 4.48Å; M72-F75 HydrophobicContact CE-CB 3.75Å; M72-F75 HydrophobicContact CE-CD1 3.32Å; M72-F75 HydrophobicContact CE-CD2 4.02Å; M72-F75 HydrophobicContact CE-CE1 3.97Å; M72-F75 HydrophobicContact CE-CG 3.37Å; M72-F75 WeakPolarHBondContact O-CB 3.47Å; M72-F75 PolarHBondContact O-N 2.76Å; M72-F75 HydrophobicContact SD-CG 4.49Å; Q73-F75 PolarHBondContact O-N 2.92Å; F75-F77 HydrophobicContact CD1-CB 4.44Å; F75-F77 PolarHBondContact O-N 2.87Å; F75-P81 WeakPolarHBondContact O-CA 3.15Å; F75-M82 HydrophobicContact CB-CG 4.23Å; F75-M82 WeakPolarHBondContact O-CG 3.49Å; F75-M82 PolarHBondContact O-N 3.37Å; F75-L213 HydrophobicContact CE1-CD1 3.75Å; F75-L213 HydrophobicContact CE1-CD2 3.69Å; F75-L213 HydrophobicContact CE1-CG 4.07Å; F75-L213 HydrophobicContact CZ-CD1 3.6Å; F75-L213 HydrophobicContact CZ-CD2 4.1Å; F75-L213 HydrophobicContact CZ-CG 4Å; F75-M217 HydrophobicContact CD1-CE 4.46Å; F75-M217 HydrophobicContact CD2-CE 4.17Å; F75-M217 HydrophobicContact CE1-CE 3.65Å; F75-M217 HydrophobicContact CE2-CE 3.31Å; F75-M217 HydrophobicContact CE2-CG 4.43Å; F75-M217 HydrophobicContact CZ-CE 3.02Å; F75-M217 HydrophobicContact CZ-CG 4.37Å; F75-M217 HydrophobicContact CZ-SD 4.49Å
76	P	87.1	Confident	92.5	Very high	82 Å²	82	59.6 Å²	59.6	53%	0.532	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	120.1	178	-22.2	33.7	0	0	0	112.1
77	F	91.2	Very high	92.5	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.018	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	112.5	-178.4	-179.6	-109.1	0	0	0	110.6	L17 L26 L30 I33 F75 K80 M82 L213	L17-F77 HydrophobicContact CD2-CD1 3.58Å; L17-F77 HydrophobicContact CD2-CE1 3.89Å; L26-F77 HydrophobicContact CD1-CE1 3.48Å; L26-F77 VanDerWaalsContact CD1-CE1 3.48Å; L26-F77 HydrophobicContact CD1-CZ 3.98Å; L30-F77 HydrophobicContact CD2-CE1 3.88Å; L30-F77 HydrophobicContact CD2-CZ 3.97Å; L30-F77 HydrophobicContact CG-CE1 4.23Å; L30-F77 HydrophobicContact CG-CZ 4.1Å; I33-F77 HydrophobicContact CD1-CD2 3.41Å; I33-F77 VanDerWaalsContact CD1-CD2 3.41Å; I33-F77 HydrophobicContact CD1-CE2 3.27Å; I33-F77 HydrophobicContact CD1-CZ 4.33Å; F75-F77 HydrophobicContact CD1-CB 4.44Å; F75-F77 PolarHBondContact O-N 2.87Å; F77-K80 PolarHBondContact N-O 3.09Å; F77-K80 PolarHBondContact O-N 2.83Å; F77-K80 VanDerWaalsContact O-O 3.14Å; F77-M82 HydrophobicContact CB-CE 3.49Å; F77-M82 VanDerWaalsContact CB-CE 3.49Å; F77-M82 HydrophobicContact CD1-CE 3.6Å; F77-M82 HydrophobicContact CD2-CE 4.09Å; F77-M82 HydrophobicContact CE1-CE 4.25Å; F77-M82 HydrophobicContact CG-CE 3.47Å; F77-M82 VanDerWaalsContact CG-CE 3.47Å; F77-L213 HydrophobicContact CD2-CD2 4.21Å
78	Y	90.3	Very high	92.5	Very high	61 Å²	61	65.2 Å²	65.2	24%	0.239	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	56.5	-168.8	-63.6	-75.3	0	0	0	112.1	N18 I21 E25 L26 S29 K80	N18-Y78 WeakPolarHBondContact CB-O 3.32Å; N18-Y78 PolarHBondContact ND2-O 3.19Å; I21-Y78 HydrophobicContact CD1-CD1 3.54Å; I21-Y78 HydrophobicContact CD1-CD2 4.42Å; I21-Y78 HydrophobicContact CD1-CE1 3.82Å; I21-Y78 HydrophobicContact CD1-CG 3.85Å; I21-Y78 HydrophobicContact CG1-CD1 3.96Å; I21-Y78 HydrophobicContact CG1-CD2 3.92Å; I21-Y78 HydrophobicContact CG1-CE1 4.26Å; I21-Y78 HydrophobicContact CG1-CE2 4.22Å; I21-Y78 HydrophobicContact CG1-CG 3.76Å; I21-Y78 HydrophobicContact CG2-CE2 4.16Å; E25-Y78 PolarHBondContact OE1-OH 3.28Å; L26-Y78 HydrophobicContact CD1-CE2 4.48Å; S29-Y78 WeakPolarHBondContact CB-OH 3.49Å; S29-Y78 PolarHBondContact OG-OH 2.83Å; Y78-K80 PolarHBondContact O-N 3.34Å; Y78-K80 VanDerWaalsContact O-N 3.11Å
79	D	84.3	Confident	92.2	Very high	156 Å²	156	71 Å²	71	83%	0.834	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	13	177.7	-46	-53.2	0	0	0	115.3
80	K	90.2	Very high	92	Very high	59 Å²	59	71.8 Å²	71.8	26%	0.257	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.2	177.1	-65.9	-173.5	70.4	-167.1	0	111.5	N16 L17 N18 F77 Y78 M82	N16-K80 WeakPolarHBondContact O-CB 3.48Å; N16-K80 WeakPolarHBondContact O-CE 3.46Å; N16-K80 PolarHBondContact O-NZ 2.8Å; N16-K80 WeakPolarHBondContact OD1-CE 3.39Å; N16-K80 PolarHBondContact OD1-NZ 3.04Å; L17-K80 PolarHBondContact O-NZ 3.48Å; N18-K80 HydrophobicContact CB-CD 4.15Å; F77-K80 PolarHBondContact N-O 3.09Å; F77-K80 PolarHBondContact O-N 2.83Å; F77-K80 VanDerWaalsContact O-O 3.14Å; Y78-K80 PolarHBondContact O-N 3.34Å; Y78-K80 VanDerWaalsContact O-N 3.11Å; K80-M82 PolarHBondContact O-N 2.84Å
81	P	87.8	Confident	92.2	Very high	68 Å²	68	64.8 Å²	64.8	44%	0.442	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	116.5	174.8	27.9	-32.9	0	0	0	109.3	N16 G74 F75	N16-P81 PolarHBondContact ND2-O 3.28Å; G74-P81 VanDerWaalsContact O-CB 3.25Å; G74-P81 WeakPolarHBondContact O-CB 3.37Å; F75-P81 WeakPolarHBondContact O-CA 3.15Å
82	M	96.1	Very high	92.3	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.315	C	S	.	.			trans	-70.8	145.4	179	67.6	167.9	54.3	0	0	111	I14 L17 L30 F34 M72 G74 F75 F77 K80 I84	I14-M82 HydrophobicContact CG2-CB 3.89Å; I14-M82 HydrophobicContact CG2-CG 4.48Å; I14-M82 HydrophobicContact CG2-SD 4.13Å; L17-M82 HydrophobicContact CD2-CB 4.1Å; L17-M82 HydrophobicContact CD2-CE 4.11Å; L30-M82 HydrophobicContact CD2-CE 4.18Å; F34-M82 HydrophobicContact CE2-CE 4.23Å; F34-M82 HydrophobicContact CE2-SD 4.05Å; F34-M82 HydrophobicContact CZ-SD 3.74Å; M72-M82 HydrophobicContact CB-SD 4.44Å; G74-M82 WeakPolarHBondContact CA-O 3.48Å; G74-M82 PolarHBondContact N-O 3.07Å; F75-M82 HydrophobicContact CB-CG 4.23Å; F75-M82 WeakPolarHBondContact O-CG 3.49Å; F75-M82 PolarHBondContact O-N 3.37Å; F77-M82 HydrophobicContact CB-CE 3.49Å; F77-M82 VanDerWaalsContact CB-CE 3.49Å; F77-M82 HydrophobicContact CD1-CE 3.6Å; F77-M82 HydrophobicContact CD2-CE 4.09Å; F77-M82 HydrophobicContact CE1-CE 4.25Å; F77-M82 HydrophobicContact CG-CE 3.47Å; F77-M82 VanDerWaalsContact CG-CE 3.47Å; K80-M82 PolarHBondContact O-N 2.84Å; M82-I84 HydrophobicContact CG-CD1 4.38Å; M82-I84 HydrophobicContact CG-CG1 4.31Å; M82-I84 HydrophobicContact SD-CD1 3.85Å; M82-I84 HydrophobicContact SD-CG1 4.17Å
83	R	97.1	Very high	92.4	Very high	157 Å²	157	66 Å²	66	59%	0.592	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	121.9	177.9	-75.3	-176.2	178.6	-168.4	-0.6	108.9	I14 N15 N16	I14-R83 CarbonylContact C-O 3.54Å; I14-R83 VanDerWaalsContact CA-O 3.31Å; I14-R83 WeakPolarHBondContact CA-O 3.28Å; N15-R83 PolarHBondContact N-O 3.43Å; N15-R83 PolarHBondContact O-N 3.02Å; N15-R83 WeakPolarHBondContact OD1-CB 3.5Å; N15-R83 PolarHBondContact OD1-O 3Å; N15-R83 VanDerWaalsContact OD1-O 3.1Å; N16-R83 HydrophobicContact CB-CG 4.39Å
84	I	97.6	Very high	92.4	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136	-172.6	-47.7	179.2	0	0	0	109.5	I12 Y13 I14 F34 L69 M72 Q73 M82	I12-I84 HydrophobicContact CB-CG2 3.86Å; I12-I84 HydrophobicContact CD1-CG2 4Å; I12-I84 HydrophobicContact CG1-CG2 4.41Å; I12-I84 HydrophobicContact CG2-CG2 4.27Å; Y13-I84 WeakPolarHBondContact O-CA 3.49Å; I14-I84 HydrophobicContact CG1-CG1 4.33Å; I14-I84 HydrophobicContact CG1-CG2 4.41Å; I14-I84 HydrophobicContact CG2-CG1 4.36Å; F34-I84 HydrophobicContact CE1-CD1 4.09Å; F34-I84 HydrophobicContact CZ-CD1 3.81Å; L69-I84 HydrophobicContact CB-CG2 4.08Å; L69-I84 HydrophobicContact CD1-CG2 4.31Å; L69-I84 HydrophobicContact CG-CB 4.34Å; L69-I84 HydrophobicContact CG-CG2 3.94Å; M72-I84 HydrophobicContact CB-CD1 3.42Å; M72-I84 VanDerWaalsContact CB-CD1 3.42Å; M72-I84 WeakPolarHBondContact O-CD1 3.49Å; Q73-I84 PolarHBondContact NE2-O 3.18Å; M82-I84 HydrophobicContact CG-CD1 4.38Å; M82-I84 HydrophobicContact CG-CG1 4.31Å; M82-I84 HydrophobicContact SD-CD1 3.85Å; M82-I84 HydrophobicContact SD-CG1 4.17Å
85	Q	97.8	Very high	92.7	Very high	92 Å²	92	60.2 Å²	60.2	43%	0.43	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	161.9	173.4	-64.5	172.2	51.6	0	0	108.9	I12 Y13	I12-Q85 CarbonylContact C-O 3.53Å; I12-Q85 WeakPolarHBondContact CA-O 3.47Å; Y13-Q85 HydrophobicContact CD1-CB 4.41Å; Y13-Q85 PolarHBondContact N-O 3.34Å; Y13-Q85 PolarHBondContact O-N 2.68Å
86	Y	98.1	Very high	92.9	Very high	37 Å²	37	64.3 Å²	64.3	15%	0.145	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	145.4	165.5	-66.7	-63	0	0	0	110.7	V6 P8 N9 S66 L69	V6-Y86 WeakPolarHBondContact O-CD2 3.34Å; P8-Y86 HydrophobicContact CB-CE1 4.39Å; P8-Y86 HydrophobicContact CB-CE2 4.4Å; P8-Y86 HydrophobicContact CG-CE2 4.46Å; N9-Y86 HydrophobicContact CB-CD1 4.23Å; N9-Y86 VanDerWaalsContact N-CD1 3.3Å; S66-Y86 VanDerWaalsContact CA-OH 3.29Å; S66-Y86 WeakPolarHBondContact CA-OH 3.47Å; S66-Y86 VanDerWaalsContact CB-OH 3.26Å; S66-Y86 WeakPolarHBondContact CB-OH 3.34Å; S66-Y86 PolarHBondContact OG-OH 3.19Å; L69-Y86 HydrophobicContact CD1-CD1 4.17Å; L69-Y86 HydrophobicContact CD1-CD2 4.05Å; L69-Y86 HydrophobicContact CD1-CE1 4.09Å; L69-Y86 HydrophobicContact CD1-CE2 3.97Å; L69-Y86 HydrophobicContact CD1-CG 4.15Å
87	A	96.4	Very high	93	Very high	5 Å²	5	66.2 Å²	66.2	4%	0.041	32%	0.315	C	S	.	.			trans	-63.6	142.3	170	0	0	0	0	0	110.3	T11 F56 M89	T11-A87 HydrophobicContact CG2-CB 3.78Å; T11-A87 WeakPolarHBondContact O-CB 3.3Å; T11-A87 PolarHBondContact O-N 3.21Å; F56-A87 HydrophobicContact CD1-CB 4.31Å; F56-A87 HydrophobicContact CE1-CB 4.36Å; A87-M89 PolarHBondContact O-N 2.72Å
88	K	92.6	Very high	92.9	Very high	194 Å²	194	71.1 Å²	71.1	84%	0.843	34%	0.337	S	S	*	.	S	Bend	trans	-68.9	-24.9	-179.7	-61.4	-176.8	-179.4	-177	0	113.4
89	M	91.3	Very high	92.9	Very high	121 Å²	121	71.6 Å²	71.6	60%	0.596	36%	0.36	S	S	*	.	S	Bend	trans	-137.4	156.4	-176.4	-62	-173.3	-67.8	0	0	109.2	A87 R104	A87-M89 PolarHBondContact O-N 2.72Å; M89-R104 VanDerWaalsContact CE-NH1 3.28Å; M89-R104 PolarHBondContact SD-NH1 3.5Å; M89-R104 VanDerWaalsContact SD-NH1 3.38Å
90	D	92.4	Very high	93	Very high	47 Å²	47	68.3 Å²	68.3	25%	0.251	35%	0.346	S	S	.	.			trans	-64.3	136.7	172	-77	2.6	0	0	0	110.9	N9 I94 K98 R104	N9-D90 PolarHBondContact ND2-OD1 3.45Å; D90-I94 HydrophobicContact CB-CG2 4.42Å; D90-K98 IonicContact OD1-NZ 2.75Å; D90-K98 IonicContact OD2-NZ 3.25Å; D90-K98 PolarHBondContact OD2-NZ 2.96Å; D90-R104 PolarHBondContact O-NH2 3.36Å; D90-R104 VanDerWaalsContact O-NH2 3.14Å
91	S	94.1	Very high	92.8	Very high	13 Å²	13	69 Å²	69	9%	0.091	35%	0.348	C	S	.	.			trans	-67.1	148.3	171.5	-68.8	0	0	0	0	110.5	T11 I58 I93 I94 A95	T11-S91 WeakPolarHBondContact CB-OG 3.19Å; T11-S91 WeakPolarHBondContact CG2-OG 3.49Å; T11-S91 WeakPolarHBondContact OG1-CB 3.46Å; T11-S91 PolarHBondContact OG1-OG 3.48Å; I58-S91 WeakPolarHBondContact CD1-OG 3.43Å; I58-S91 WeakPolarHBondContact CG1-OG 3.39Å; S91-I93 PolarHBondContact O-N 3.29Å; S91-I93 VanDerWaalsContact O-N 3.12Å; S91-I94 WeakPolarHBondContact O-CA 3.33Å; S91-I94 WeakPolarHBondContact O-CB 3.34Å; S91-I94 PolarHBondContact O-N 2.98Å; S91-A95 PolarHBondContact O-N 2.89Å
92	D	92.4	Very high	92.6	Very high	48 Å²	48	71.1 Å²	71.1	26%	0.257	36%	0.359	S	S	.	.	H	α-helix	trans	-54.9	-37.3	-174.4	-66.4	-21.3	0	0	0	112.6	A95 K96 Y101 R104 R106	D92-A95 PolarHBondContact O-N 2.91Å; D92-K96 WeakPolarHBondContact O-CB 3.39Å; D92-K96 VanDerWaalsContact O-CG 3.25Å; D92-K96 WeakPolarHBondContact O-CG 3.38Å; D92-K96 PolarHBondContact O-N 3.22Å; D92-Y101 HydrophobicContact CB-CD2 4.25Å; D92-Y101 HydrophobicContact CB-CE2 3.77Å; D92-R104 IonicContact OD1-CZ 2.8Å; D92-R104 IonicContact OD1-NE 3.94Å; D92-R104 IonicContact OD1-NH2 3.95Å; D92-R104 PolarHBondContact OD1-NH2 3Å; D92-R106 IonicContact OD2-NH2 3.78Å
93	I	93.4	Very high	91.7	Very high	67 Å²	67	78.7 Å²	78.7	34%	0.344	39%	0.394	S	S	.	.	H	α-helix	trans	-64.6	-39.7	176.2	-168.9	162.9	0	0	0	112.8	L41 I58 S91 K96 M97	L41-I93 HydrophobicContact CB-CD1 3.96Å; L41-I93 HydrophobicContact CD1-CD1 4.44Å; L41-I93 HydrophobicContact CD1-CG1 4.45Å; I58-I93 HydrophobicContact CD1-CG2 3.92Å; I58-I93 HydrophobicContact CG2-CG2 3.71Å; S91-I93 PolarHBondContact O-N 3.29Å; S91-I93 VanDerWaalsContact O-N 3.12Å; I93-K96 PolarHBondContact O-N 2.94Å; I93-M97 WeakPolarHBondContact O-CB 3.19Å; I93-M97 PolarHBondContact O-N 3.38Å
94	I	94.4	Very high	90.1	Very high	3 Å²	3	76.6 Å²	76.6	2%	0.015	39%	0.386	C	S	.	.	H	α-helix	trans	-70.4	-43.3	177.5	-60.3	-61.8	0	0	0	110.1	H10 L41 I58 D90 S91 K96 M97 K98	H10-I94 HydrophobicContact CB-CD1 3.68Å; H10-I94 HydrophobicContact CB-CG1 3.83Å; H10-I94 HydrophobicContact CB-CG2 4.36Å; L41-I94 HydrophobicContact CD1-CD1 3.73Å; I58-I94 HydrophobicContact CG2-CD1 3.77Å; I58-I94 HydrophobicContact CG2-CG1 3.64Å; D90-I94 HydrophobicContact CB-CG2 4.42Å; S91-I94 WeakPolarHBondContact O-CA 3.33Å; S91-I94 WeakPolarHBondContact O-CB 3.34Å; S91-I94 PolarHBondContact O-N 2.98Å; I94-K96 VanDerWaalsContact C-N 3.3Å; I94-K96 PolarHBondContact O-N 3.34Å; I94-M97 PolarHBondContact O-N 3.2Å; I94-K98 HydrophobicContact CG2-CD 4.06Å; I94-K98 HydrophobicContact CG2-CG 4.44Å; I94-K98 WeakPolarHBondContact O-CB 3.36Å; I94-K98 WeakPolarHBondContact O-CG 3.49Å; I94-K98 PolarHBondContact O-N 2.98Å
95	A	93.3	Very high	88.3	Confident	9 Å²	9	81 Å²	81	7%	0.074	41%	0.41	C	S	.	.	H	α-helix	trans	-61.4	-39.5	176.4	0	0	0	0	0	111.6	S91 D92 K98 G99 T100 Y101	S91-A95 PolarHBondContact O-N 2.89Å; D92-A95 PolarHBondContact O-N 2.91Å; A95-K98 PolarHBondContact O-N 3.39Å; A95-G99 PolarHBondContact O-N 3.09Å; A95-G99 VanDerWaalsContact O-N 3.14Å; A95-T100 PolarHBondContact O-N 3.35Å; A95-T100 PolarHBondContact O-OG1 3.36Å; A95-Y101 HydrophobicContact CB-CD2 4.2Å; A95-Y101 PolarHBondContact O-N 2.9Å; A95-Y101 VanDerWaalsContact O-N 3.13Å
96	K	92.6	Very high	86.4	Confident	126 Å²	126	86.4 Å²	86.4	55%	0.548	43%	0.426	S	S	.	.	H	α-helix	trans	-64.1	-44.6	174.1	-74.9	174.9	-177	-173.9	0	111.5	D92 I93 I94 K98 G99 Y101	D92-K96 WeakPolarHBondContact O-CB 3.39Å; D92-K96 VanDerWaalsContact O-CG 3.25Å; D92-K96 WeakPolarHBondContact O-CG 3.38Å; D92-K96 PolarHBondContact O-N 3.22Å; I93-K96 PolarHBondContact O-N 2.94Å; I94-K96 VanDerWaalsContact C-N 3.3Å; I94-K96 PolarHBondContact O-N 3.34Å; K96-K98 VanDerWaalsContact C-N 3.3Å; K96-K98 PolarHBondContact O-N 2.97Å; K96-G99 PolarHBondContact O-N 3.44Å; K96-G99 VanDerWaalsContact O-N 3.09Å; K96-Y101 HydrophobicContact CD-CD2 4.5Å; K96-Y101 HydrophobicContact CD-CG 4.46Å; K96-Y101 HydrophobicContact CG-CD1 4.03Å; K96-Y101 HydrophobicContact CG-CD2 3.8Å; K96-Y101 HydrophobicContact CG-CE2 4.48Å; K96-Y101 HydrophobicContact CG-CG 3.54Å
97	M	90.3	Very high	84.1	Confident	122 Å²	122	92.8 Å²	92.8	60%	0.601	46%	0.455	S	S	*	.	H	α-helix	trans	-64.9	-33.3	178.9	-159.8	170	118	0	0	112.6	I93 I94 G99	I93-M97 WeakPolarHBondContact O-CB 3.19Å; I93-M97 PolarHBondContact O-N 3.38Å; I94-M97 PolarHBondContact O-N 3.2Å; M97-G99 VanDerWaalsContact C-N 3.33Å
98	K	89.4	Confident	81.8	Confident	108 Å²	108	99.8 Å²	99.8	47%	0.47	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.8	174.2	-69	178.5	-179.8	178.6	0	114.2	D90 I94 A95 K96 T100	D90-K98 IonicContact OD1-NZ 2.75Å; D90-K98 IonicContact OD2-NZ 3.25Å; D90-K98 PolarHBondContact OD2-NZ 2.96Å; I94-K98 HydrophobicContact CG2-CD 4.06Å; I94-K98 HydrophobicContact CG2-CG 4.44Å; I94-K98 WeakPolarHBondContact O-CB 3.36Å; I94-K98 WeakPolarHBondContact O-CG 3.49Å; I94-K98 PolarHBondContact O-N 2.98Å; A95-K98 PolarHBondContact O-N 3.39Å; K96-K98 VanDerWaalsContact C-N 3.3Å; K96-K98 PolarHBondContact O-N 2.97Å; K98-T100 HydrophobicContact CB-CG2 4.33Å; K98-T100 PolarHBondContact O-N 2.77Å
99	G	89	Confident	79.8	Confident	71 Å²	71	97.6 Å²	97.6	73%	0.732	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	16.4	-173	0	0	0	0	0	114.8	A95 K96 M97	A95-G99 PolarHBondContact O-N 3.09Å; A95-G99 VanDerWaalsContact O-N 3.14Å; K96-G99 PolarHBondContact O-N 3.44Å; K96-G99 VanDerWaalsContact O-N 3.09Å; M97-G99 VanDerWaalsContact C-N 3.33Å
100	T	86.9	Confident	77.8	Confident	86 Å²	86	100.8 Å²	100.8	53%	0.528	49%	0.488	S	S	.	.			trans	-105.6	9.4	-178.4	54.7	0	0	0	0	112.8	A95 K98 V102	A95-T100 PolarHBondContact O-N 3.35Å; A95-T100 PolarHBondContact O-OG1 3.36Å; K98-T100 HydrophobicContact CB-CG2 4.33Å; K98-T100 PolarHBondContact O-N 2.77Å; T100-V102 PolarHBondContact O-N 2.81Å
101	Y	85.9	Confident	75.7	Confident	75 Å²	75	107.3 Å²	107.3	29%	0.294	51%	0.514	S	S	.	.			trans	-66.7	115.9	-178.1	-178.9	-104	0	0	0	111.4	D92 A95 K96 E103	D92-Y101 HydrophobicContact CB-CD2 4.25Å; D92-Y101 HydrophobicContact CB-CE2 3.77Å; A95-Y101 HydrophobicContact CB-CD2 4.2Å; A95-Y101 PolarHBondContact O-N 2.9Å; A95-Y101 VanDerWaalsContact O-N 3.13Å; K96-Y101 HydrophobicContact CD-CD2 4.5Å; K96-Y101 HydrophobicContact CD-CG 4.46Å; K96-Y101 HydrophobicContact CG-CD1 4.03Å; K96-Y101 HydrophobicContact CG-CD2 3.8Å; K96-Y101 HydrophobicContact CG-CE2 4.48Å; K96-Y101 HydrophobicContact CG-CG 3.54Å; Y101-E103 HydrophobicContact CE1-CB 4.25Å; Y101-E103 HydrophobicContact CE1-CG 3.93Å
102	V	83.5	Confident	73.4	Confident	112 Å²	112	115 Å²	115	68%	0.679	55%	0.546	S	S	*	.			trans	-105.6	127.4	166.6	-178	0	0	0	0	107.6	T100 R104	T100-V102 PolarHBondContact O-N 2.81Å; V102-R104 PolarHBondContact O-N 2.77Å
103	E	77.8	Confident	71.2	Confident	159 Å²	159	118.6 Å²	118.6	74%	0.743	57%	0.571	S	S	*	*			trans	-63	105.5	178.5	-134.6	165.4	-146.4	0	0	109.5	Y101 D105	Y101-E103 HydrophobicContact CE1-CB 4.25Å; Y101-E103 HydrophobicContact CE1-CG 3.93Å; E103-D105 PolarHBondContact O-N 2.86Å; E103-D105 VanDerWaalsContact O-N 3.16Å
104	R	63.6	Low	69.2	Low	113 Å²	113	124.5 Å²	124.5	43%	0.426	60%	0.595	S	S	.	*			trans	-75.5	110.4	-178.8	-78.5	-177.6	-85.6	-162.3	-7	108.5	M89 D90 D92 V102 R106	M89-R104 VanDerWaalsContact CE-NH1 3.28Å; M89-R104 PolarHBondContact SD-NH1 3.5Å; M89-R104 VanDerWaalsContact SD-NH1 3.38Å; D90-R104 PolarHBondContact O-NH2 3.36Å; D90-R104 VanDerWaalsContact O-NH2 3.14Å; D92-R104 IonicContact OD1-CZ 2.8Å; D92-R104 IonicContact OD1-NE 3.94Å; D92-R104 IonicContact OD1-NH2 3.95Å; D92-R104 PolarHBondContact OD1-NH2 3Å; V102-R104 PolarHBondContact O-N 2.77Å; R104-R106 PolarHBondContact O-N 2.86Å
105	D	60.2	Low	66.8	Low	94 Å²	94	130.3 Å²	130.3	50%	0.503	63%	0.633	S	S	.	*			trans	-63.1	77.3	176.7	-148	-13.7	0	0	0	110	E103 K107 K108	E103-D105 PolarHBondContact O-N 2.86Å; E103-D105 VanDerWaalsContact O-N 3.16Å; D105-K107 PolarHBondContact O-N 3.48Å; D105-K108 HydrophobicContact CB-CD 4.33Å; D105-K108 PolarHBondContact O-N 2.92Å; D105-K108 VanDerWaalsContact OD2-CE 3.23Å; D105-K108 WeakPolarHBondContact OD2-CE 3.25Å; D105-K108 IonicContact OD2-NZ 2.77Å; D105-K108 PolarHBondContact OD2-NZ 2.99Å
106	R	57.1	Low	64.6	Low	204 Å²	204	138.7 Å²	138.7	77%	0.77	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	-9.3	-177.6	-75.7	-178.5	175.3	174.8	1.7	113.5	D92 R104	D92-R106 IonicContact OD2-NH2 3.78Å; R104-R106 PolarHBondContact O-N 2.86Å
107	K	49.3	Very low	62.1	Low	171 Å²	171	138.9 Å²	138.9	74%	0.743	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-24.3	179.3	-149.9	171.2	-174.8	179.8	0	113.4	D105	D105-K107 PolarHBondContact O-N 3.48Å
108	K	48.2	Very low	59.8	Low	152 Å²	152	136.2 Å²	136.2	66%	0.661	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-30	-177.8	-75.7	178.3	-179.6	160.7	0	113.8	D105 K110 K111	D105-K108 HydrophobicContact CB-CD 4.33Å; D105-K108 PolarHBondContact O-N 2.92Å; D105-K108 VanDerWaalsContact OD2-CE 3.23Å; D105-K108 WeakPolarHBondContact OD2-CE 3.25Å; D105-K108 IonicContact OD2-NZ 2.77Å; D105-K108 PolarHBondContact OD2-NZ 2.99Å; K108-K110 PolarHBondContact O-N 3.42Å; K108-K111 PolarHBondContact O-N 3.45Å; K108-K111 VanDerWaalsContact O-N 3.11Å
109	E	50.2	Low	57.6	Low	149 Å²	149	137.4 Å²	137.4	70%	0.696	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-18.5	177.1	-161.6	174.5	123.6	0	0	113.1	K50 K111	K50-E109 IonicContact NZ-OE1 2.73Å; E109-K111 VanDerWaalsContact C-N 3.32Å
110	K	50.7	Low	55.1	Low	187 Å²	187	139.9 Å²	139.9	81%	0.813	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-9.8	172.4	-70.8	-173.8	176.4	-176.8	0	113.8	K108	K108-K110 PolarHBondContact O-N 3.42Å
111	K	47.2	Very low	53	Low	184 Å²	184	144.9 Å²	144.9	80%	0.8	73%	0.725	S	S	*	*			trans	-104.7	58.1	174.3	-78.4	-172.2	172.7	-174.2	0	110.7	K108 E109	K108-K111 PolarHBondContact O-N 3.45Å; K108-K111 VanDerWaalsContact O-N 3.11Å; E109-K111 VanDerWaalsContact C-N 3.32Å
112	K	45.3	Very low	50.6	Low	176 Å²	176	151.4 Å²	151.4	77%	0.765	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-81	121.5	149.9	-76.5	-170.9	176	-173.9	0	106.6	K114	K112-K114 PolarHBondContact O-N 3.41Å
113	P	46.9	Very low	48.2	Very low	122 Å²	122	150.6 Å²	150.6	79%	0.792	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-61.6	130	175.1	24.8	-29.7	0	0	0	108.2
114	K	50.4	Low	46.2	Very low	192 Å²	192	147.8 Å²	147.8	84%	0.835	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-58.9	138.1	166.8	-72.7	177.8	175.2	179	0	107.3	K112 E116	K112-K114 PolarHBondContact O-N 3.41Å; K114-E116 PolarHBondContact O-N 3.13Å
115	P	44.6	Very low	44.8	Very low	125 Å²	125	146.4 Å²	146.4	81%	0.812	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-62.6	123.6	170.7	26.2	-29.7	0	0	0	107.7
116	E	46.7	Very low	43.6	Very low	185 Å²	185	146.9 Å²	146.9	86%	0.864	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-68.6	132.6	175.3	-62.4	-169.5	123.4	0	0	109.4	K114 G118	K114-E116 PolarHBondContact O-N 3.13Å; E116-G118 PolarHBondContact O-N 2.72Å
117	P	41.3	Very low	42.6	Very low	129 Å²	129	145.1 Å²	145.1	84%	0.838	80%	0.796	S	S	*	*			trans	-80.6	109.8	165.8	29.6	-27.1	0	0	0	109.3
118	G	42.2	Very low	42	Very low	67 Å²	67	143.5 Å²	143.5	69%	0.691	80%	0.8	S	S	*	*			trans	-71	155.4	153.1	0	0	0	0	0	109.3	E116	E116-G118 PolarHBondContact O-N 2.72Å
119	V	43.1	Very low	41.3	Very low	132 Å²	132	141.1 Å²	141.1	80%	0.8	81%	0.809	S	S	*	*			cis	-161.9	145.4	12.9	170.8	0	0	0	0	106.5
120	S	35	Very low	40.4	Very low	124 Å²	124	137.9 Å²	137.9	87%	0.867	82%	0.816	S	S	*	*			trans	-151.2	127	144.6	41.9	0	0	0	0	111.8
121	K	43.6	Very low	39.6	Very low	191 Å²	191	135.8 Å²	135.8	83%	0.83	82%	0.818	S	S	*	*			trans	-80.1	154.9	-178.6	-76.7	177.4	171.9	177.8	0	112.7
122	K	35.6	Very low	39.8	Very low	211 Å²	211	132.6 Å²	132.6	92%	0.917	82%	0.816	S	S	*	*			trans	129.1	133.2	151.1	-76.3	-176.3	175.5	-174.2	0	109.5
123	A	34.1	Very low	39.3	Very low	96 Å²	96	129.1 Å²	129.1	79%	0.793	82%	0.82	S	S	*	*			cis	-157	166.2	6.1	0	0	0	0	0	109.8
124	A	34.4	Very low	38.7	Very low	99 Å²	99	127.1 Å²	127.1	82%	0.818	82%	0.821	S	S	*	*			trans	-39.6	164.1	166.8	0	0	0	0	0	115.4
125	A	33.5	Very low	38.5	Very low	85 Å²	85	126.9 Å²	126.9	70%	0.702	83%	0.826	S	S	*	*			cis	-171.3	147.3	-6.8	0	0	0	0	0	106.2
126	A	35.2	Very low	38.3	Very low	103 Å²	103	127 Å²	127	85%	0.851	83%	0.826	S	S	*	*			trans	-170.3	114.2	148.3	0	0	0	0	0	110.9
127	M	35.9	Very low	37.9	Very low	168 Å²	168	121.8 Å²	121.8	83%	0.828	82%	0.822	S	S	*	*			trans	-78	149.5	164.2	17.6	178.4	161.3	0	0	106.2
128	V	37.1	Very low	38.2	Very low	137 Å²	137	124.5 Å²	124.5	83%	0.83	83%	0.826	S	S	*	*				-174.2	156.9	56.2	-147.6	0	0	0	0	109.6
129	A	34.1	Very low	38.6	Very low	102 Å²	102	126.9 Å²	126.9	84%	0.843	83%	0.83	S	S	*	*			trans	75.9	127.1	140.6	0	0	0	0	0	122.6
130	G	31.7	Very low	39	Very low	81 Å²	81	125.8 Å²	125.8	84%	0.835	83%	0.825	S	S	*	*			trans	144.4	101.5	150	0	0	0	0	0	116.1
131	V	34	Very low	39.9	Very low	143 Å²	143	129.1 Å²	129.1	87%	0.867	83%	0.829	S	S	*	*			trans	-113.3	166.3	156	-131.8	0	0	0	0	106.2
132	P	51.3	Low	40.2	Very low	117 Å²	117	124.3 Å²	124.3	76%	0.76	82%	0.82	S	S	*	*			cis	-138.4	-167.9	-6.9	31.7	-7.6	0	0	0	114.1
133	A	34.3	Very low	40.5	Very low	103 Å²	103	122.6 Å²	122.6	85%	0.851	82%	0.815	S	S	*	*			trans	98.7	131.6	148.2	0	0	0	0	0	119
134	G	34	Very low	41	Very low	79 Å²	79	122.7 Å²	122.7	81%	0.814	82%	0.815	S	S	*	*			trans	144.8	69.8	162.8	0	0	0	0	0	114.8
135	M	47.7	Very low	41.5	Very low	188 Å²	188	122.9 Å²	122.9	93%	0.926	81%	0.809	S	S	*	*			trans	-99	125.6	154.2	-161.4	146.4	155.7	0	0	105.7
136	P	40.2	Very low	42	Very low	127 Å²	127	130 Å²	130	83%	0.825	82%	0.817	S	S	*	*				-153.1	157.7	114.1	34.1	-15.4	0	0	0	114.6
137	G	38.4	Very low	42.5	Very low	76 Å²	76	133.4 Å²	133.4	78%	0.784	82%	0.818	S	S	*	*			trans	128.1	72.7	148.5	0	0	0	0	0	117.9
138	M	47.1	Very low	43.1	Very low	185 Å²	185	134.5 Å²	134.5	91%	0.911	82%	0.823	S	S	*	*				-92.1	152.7	127	-85.9	-175.3	140.7	0	0	106.1
139	P	50.8	Low	43.8	Very low	118 Å²	118	136.1 Å²	136.1	77%	0.766	82%	0.821	S	S	*	*			cis	-151	-148.5	43.1	43.7	-19.9	0	0	0	110.8
140	P	50.8	Low	44.7	Very low	109 Å²	109	139 Å²	139	71%	0.708	82%	0.821	S	S	*	*			cis	-129.8	161.4	-13.9	31.5	-10.5	0	0	0	115.7
141	M	54.9	Low	45.2	Very low	193 Å²	193	140.8 Å²	140.8	95%	0.951	82%	0.817	S	S	*	*			trans	-71.5	125.1	161.5	-179	176.9	-83.4	0	0	109.2
142	S	48.1	Very low	46.3	Very low	90 Å²	90	137.6 Å²	137.6	63%	0.629	81%	0.814	S	S	*	*			trans	-123.6	111.4	175.2	59.3	0	0	0	0	111.5
143	Q	42.6	Very low	46.1	Very low	176 Å²	176	140.4 Å²	140.4	82%	0.822	82%	0.817	S	S	*	*			trans	71.5	108.8	139	-58.5	179.3	50.1	0	0	118.6
144	A	43.9	Very low	47.1	Very low	97 Å²	97	140.5 Å²	140.5	80%	0.802	81%	0.809	S	S	*	*			trans	-73.8	147	138.9	0	0	0	0	0	108.9
145	P	46.8	Very low	48	Very low	104 Å²	104	142.7 Å²	142.7	68%	0.675	81%	0.809	S	S	*	*				-143.6	141.5	119.2	30.4	-12.6	0	0	0	115.5
146	R	42.7	Very low	48.5	Very low	235 Å²	235	144.3 Å²	144.3	89%	0.887	81%	0.806	S	S	*	*			trans	64.8	115.1	134.5	-69.2	-177.5	155.9	154.1	-4.4	120.9
147	M	46	Very low	49.7	Very low	174 Å²	174	146.6 Å²	146.6	86%	0.857	81%	0.808	S	S	*	*				25.3	120.8	124.7	-73.3	-171	166.8	0	0	118.3
148	M	49.6	Very low	50.6	Low	190 Å²	190	148.4 Å²	148.4	94%	0.936	81%	0.806	S	S	*	*			trans	-126.9	120.5	140.4	-83.5	-156.2	-174.7	0	0	110.9
149	H	50	Low	51.4	Low	171 Å²	171	145.4 Å²	145.4	79%	0.792	80%	0.8	S	S	*	*			trans	-61.3	137.2	159.5	-106.1	53.1	0	0	0	109.9
150	I	54	Low	51.5	Low	164 Å²	164	145.7 Å²	145.7	84%	0.841	80%	0.802	S	S	*	*			trans	-104.4	115.6	163.1	-60.7	177.7	0	0	0	107.5
151	P	42.3	Very low	51.5	Low	117 Å²	117	144.1 Å²	144.1	76%	0.76	81%	0.805	S	S	*	*			trans	-88.6	137.4	171.7	32.8	-27.8	0	0	0	110.4
152	G	56.6	Low	51.4	Low	77 Å²	77	143.6 Å²	143.6	79%	0.794	80%	0.803	S	S	*	*			trans	133.8	34.1	164	0	0	0	0	0	118.9
153	Q	47.9	Very low	51.8	Low	175 Å²	175	148.2 Å²	148.2	82%	0.818	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-100.9	128.8	163.5	-72.7	-150.4	3.1	0	0	111.6
154	P	54.2	Low	52.5	Low	106 Å²	106	145.3 Å²	145.3	69%	0.688	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72.7	154.4	177.9	27.8	-31.3	0	0	0	112.2	Y156	P154-Y156 PolarHBondContact O-N 3.32Å
155	P	53.9	Low	53.1	Low	125 Å²	125	146.5 Å²	146.5	81%	0.812	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-69.7	130	-173.5	-13.9	28.5	0	0	0	112.3	M157	P155-M157 PolarHBondContact O-N 3.14Å
156	Y	56.8	Low	53.4	Low	222 Å²	222	147.8 Å²	147.8	87%	0.871	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-66.3	120.7	166.8	-84.5	-94.5	0	0	0	110	P154	P154-Y156 PolarHBondContact O-N 3.32Å
157	M	65.4	Low	53.9	Low	174 Å²	174	140.1 Å²	140.1	86%	0.857	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-85.2	143.5	168.8	-67.9	178.8	92.9	0	0	110.4	P155	P155-M157 PolarHBondContact O-N 3.14Å
158	P	57.4	Low	53.9	Low	114 Å²	114	141 Å²	141	74%	0.74	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-74.7	152.3	175	31.1	-33	0	0	0	111.4
159	P	64.9	Low	53.9	Low	123 Å²	123	136.5 Å²	136.5	80%	0.799	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-67.6	139.9	176.8	-16.5	29.9	0	0	0	112.1	G161	P159-G161 PolarHBondContact O-N 2.89Å
160	P	53.6	Low	53.5	Low	123 Å²	123	134.6 Å²	134.6	80%	0.799	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-68.5	117.6	175.1	-16.2	29.6	0	0	0	111.8	M162	P160-M162 PolarHBondContact O-N 3.14Å
161	G	49.6	Very low	53.7	Low	76 Å²	76	129.9 Å²	129.9	78%	0.784	81%	0.807	S	S	*	*			trans	-68.4	112.1	162.9	0	0	0	0	0	109.5	P159 M163	P159-G161 PolarHBondContact O-N 2.89Å; G161-M163 PolarHBondContact O-N 3.32Å
162	M	52.5	Low	53.6	Low	182 Å²	182	133.7 Å²	133.7	90%	0.897	81%	0.814	S	S	*	*			trans	-60.8	121.7	175.5	-65.9	178.1	172.3	0	0	110.8	P160	P160-M162 PolarHBondContact O-N 3.14Å
163	M	57.2	Low	53.4	Low	188 Å²	188	138.3 Å²	138.3	93%	0.926	82%	0.82	S	S	*	*			trans	-77.1	136.5	155.1	-70.3	175.1	162	0	0	109	G161	G161-M163 PolarHBondContact O-N 3.32Å
164	P	57.2	Low	53.7	Low	115 Å²	115	135.3 Å²	135.3	75%	0.747	82%	0.816	S	S	*	*			trans	-104.5	162.6	148.8	5	15	0	0	0	111.9
165	P	56.3	Low	53.4	Low	121 Å²	121	136.3 Å²	136.3	79%	0.786	82%	0.822	S	S	*	*			trans	-88.4	177.8	-152.5	-5.5	26.4	0	0	0	114.9
166	P	52.9	Low	53.1	Low	132 Å²	132	134.2 Å²	134.2	86%	0.857	82%	0.823	S	S	*	*			trans	-86.7	150.3	-165.6	34.2	-32.4	0	0	0	113.5
167	G	53.9	Low	52.3	Low	73 Å²	73	128.6 Å²	128.6	75%	0.753	82%	0.823	S	S	*	*			trans	131.5	81	156.6	0	0	0	0	0	115.6
168	M	46.6	Very low	51.5	Low	192 Å²	192	129 Å²	129	95%	0.946	83%	0.827	S	S	*	*			trans	-140.5	111.5	149.6	-74.8	-168	177.9	0	0	108.9
169	A	48.8	Very low	51	Low	96 Å²	96	127.9 Å²	127.9	79%	0.793	83%	0.828	S	S	*	*			trans	-74	143.7	171.8	0	0	0	0	0	109.9
170	P	42.4	Very low	50.4	Low	132 Å²	132	128.5 Å²	128.5	86%	0.857	83%	0.832	S	S	*	*	S	Bend	trans	-79.8	127.2	174.3	30.8	-30.3	0	0	0	110
171	G	56.5	Low	50.3	Low	64 Å²	64	126 Å²	126	66%	0.66	83%	0.828	S	S	*	*			trans	116.8	97.4	168.3	0	0	0	0	0	113.3
172	Q	40.4	Very low	50.1	Low	197 Å²	197	131.5 Å²	131.5	92%	0.921	83%	0.834	S	S	*	*			trans	-163.6	97.8	147.1	-106.2	160.3	83	0	0	108.5
173	L	54.1	Low	49.9	Very low	174 Å²	174	131.9 Å²	131.9	91%	0.911	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-75.6	138	152.8	-74.6	160.6	0	0	0	107.3
174	P	53.3	Low	49.5	Very low	113 Å²	113	131.5 Å²	131.5	73%	0.734	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-99.3	156.2	148.9	23	-8.3	0	0	0	111.3
175	P	47	Very low	49.2	Very low	126 Å²	126	132.8 Å²	132.8	82%	0.818	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-98.5	141.2	-153.4	1.9	20.4	0	0	0	112.5
176	G	48	Very low	48.8	Very low	81 Å²	81	129.8 Å²	129.8	84%	0.835	83%	0.833	S	S	*	*			trans	49.6	103.3	141.2	0	0	0	0	0	119.1
177	A	40.3	Very low	48.3	Very low	105 Å²	105	132.6 Å²	132.6	87%	0.868	84%	0.835	S	S	*	*			trans	-149.1	109.3	135.1	0	0	0	0	0	109.2
178	L	49.1	Very low	47.6	Very low	181 Å²	181	137.2 Å²	137.2	95%	0.948	84%	0.839	S	S	*	*			trans	-68.5	130.6	169	-75.1	155.6	0	0	0	109.6
179	A	46.1	Very low	47.6	Very low	91 Å²	91	133.7 Å²	133.7	75%	0.752	83%	0.83	S	S	*	*			trans	-143.8	118.7	151.9	0	0	0	0	0	108.4
180	P	52.1	Low	47.3	Very low	137 Å²	137	136.7 Å²	136.7	89%	0.89	83%	0.828	S	S	*	*			trans	-83.8	114.8	171.6	30.9	-26.6	0	0	0	108.8
181	G	51.9	Low	47.4	Very low	69 Å²	69	139 Å²	139	71%	0.711	83%	0.827	S	S	*	*			trans	114.1	82.3	168.5	0	0	0	0	0	114.2
182	Q	44.5	Very low	47.3	Very low	193 Å²	193	138.1 Å²	138.1	90%	0.902	81%	0.809	S	S	*	*			trans	-156.1	97.2	147	-110.7	166.5	7.4	0	0	107.8	M184	Q182-M184 PolarHBondContact O-N 3.04Å
183	M	48.4	Very low	48	Very low	190 Å²	190	133.2 Å²	133.2	94%	0.936	80%	0.796	S	S	*	*			trans	-62	121.2	167.7	-57.1	174.2	-164.9	0	0	107.1
184	M	50.7	Low	48.5	Very low	179 Å²	179	131.2 Å²	131.2	88%	0.882	78%	0.782	S	S	*	*			trans	-63.9	128.9	168.2	-70.1	-163.1	175.5	0	0	109.1	Q182 G186	Q182-M184 PolarHBondContact O-N 3.04Å; M184-G186 PolarHBondContact O-N 3.34Å
185	P	49.5	Very low	50	Low	143 Å²	143	127.3 Å²	127.3	93%	0.929	76%	0.755	S	S	*	*			trans	-81.1	75.2	164.6	32.6	-28.5	0	0	0	107.6
186	G	48.2	Very low	52	Low	58 Å²	58	125.7 Å²	125.7	60%	0.598	75%	0.745	S	S	*	*			trans	-119.6	108.8	-179.9	0	0	0	0	0	110.4	M184	M184-G186 PolarHBondContact O-N 3.34Å
187	Q	42.2	Very low	54.2	Low	191 Å²	191	125 Å²	125	89%	0.893	73%	0.726	S	S	*	*			trans	83.2	77	173.6	-52.8	-178.9	16	0	0	115
188	M	39.3	Very low	56.8	Low	169 Å²	169	120.6 Å²	120.6	83%	0.833	69%	0.688	S	S	*	*			trans	-49.1	131.1	148.4	-65.3	179.2	-79.3	0	0	108.4	Q190	M188-Q190 PolarHBondContact O-N 3.31Å
189	P	46.5	Very low	59	Low	118 Å²	118	115.3 Å²	115.3	77%	0.766	66%	0.658	S	S	*	*			trans	-56	130.7	166.7	20.7	-25.9	0	0	0	107.2	Q191	P189-Q191 PolarHBondContact O-N 2.88Å
190	Q	42.2	Very low	61.5	Low	160 Å²	160	113.1 Å²	113.1	75%	0.748	63%	0.633	S	S	*	*			trans	-42.5	106.9	177.4	-77.1	179.5	-40.9	0	0	108.9	M188 V192	M188-Q190 PolarHBondContact O-N 3.31Å; Q190-V192 VanDerWaalsContact C-N 3.28Å; Q190-V192 PolarHBondContact O-N 3.38Å
191	Q	45.1	Very low	63.6	Low	180 Å²	180	106.6 Å²	106.6	84%	0.841	59%	0.591	S	S	*	*			trans	-59.7	99.3	172.4	-113	170.1	-2.9	0	0	105.7	P189 S193	P189-Q191 PolarHBondContact O-N 2.88Å; Q191-S193 PolarHBondContact O-N 3.41Å
192	V	53.4	Low	65.8	Low	46 Å²	46	106 Å²	106	28%	0.279	57%	0.569	S	S	.	*			trans	-54	127.9	165	-72.6	0	0	0	0	105.2	Q190 E194	Q190-V192 VanDerWaalsContact C-N 3.28Å; Q190-V192 PolarHBondContact O-N 3.38Å; V192-E194 VanDerWaalsContact C-N 3.34Å; V192-E194 PolarHBondContact O-N 3.32Å
193	S	56.6	Low	68.2	Low	93 Å²	93	96.8 Å²	96.8	65%	0.65	53%	0.526	S	S	*	.			trans	-53.6	102.9	175.5	15.7	0	0	0	0	107.5	Q191 N195	Q191-S193 PolarHBondContact O-N 3.41Å; S193-N195 VanDerWaalsContact C-N 3.27Å; S193-N195 PolarHBondContact O-N 3.21Å
194	E	64.6	Low	70.5	Confident	132 Å²	132	89.6 Å²	89.6	62%	0.617	49%	0.492	S	S	*	.			trans	-74.5	91	177.8	-73.9	-165.1	106.2	0	0	106.8	V192 R252	V192-E194 VanDerWaalsContact C-N 3.34Å; V192-E194 PolarHBondContact O-N 3.32Å; E194-R252 IonicContact OE1-CZ 3.2Å; E194-R252 VanDerWaalsContact OE1-CZ 3.25Å; E194-R252 IonicContact OE1-NH1 3.46Å; E194-R252 PolarHBondContact OE1-NH1 3.33Å; E194-R252 IonicContact OE1-NH2 3.78Å; E194-R252 PolarHBondContact OE1-NH2 2.86Å
195	N	85.1	Confident	72.5	Confident	31 Å²	31	84.5 Å²	84.5	17%	0.166	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-56	149.3	162.7	-63.1	-41	0	0	0	107.9	S193 F270	S193-N195 VanDerWaalsContact C-N 3.27Å; S193-N195 PolarHBondContact O-N 3.21Å; N195-F270 HydrophobicContact CB-CB 4.08Å; N195-F270 WeakPolarHBondContact CB-O 3.48Å; N195-F270 PolarHBondContact ND2-O 3.48Å; N195-F270 WeakPolarHBondContact O-CD2 3.25Å
196	P	88.4	Confident	74.5	Confident	92 Å²	92	78 Å²	78	60%	0.597	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-51.6	152.4	175.6	-23.9	32.2	0	0	0	111.4	N198 F270	P196-N198 PolarHBondContact O-N 2.94Å; P196-F270 WeakPolarHBondContact O-CB 3.38Å
197	P	93.1	Very high	76.5	Confident	67 Å²	67	75.9 Å²	75.9	44%	0.435	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-47.2	136.3	175.8	-29.6	36.4	0	0	0	112.4	E245 F270	P197-E245 HydrophobicContact CB-CB 4.16Å; P197-E245 HydrophobicContact CB-CG 4.38Å; P197-F270 HydrophobicContact CB-CE2 4.43Å; P197-F270 HydrophobicContact CB-CZ 4.35Å; P197-F270 HydrophobicContact CG-CE2 4.48Å
198	N	95.6	Very high	78.4	Confident	13 Å²	13	74.5 Å²	74.5	7%	0.07	40%	0.395	C	S	.	.			trans	-147.7	147.7	-178.1	-162.6	-20.4	0	0	0	108.7	P196 I200 A248 F270 A271	P196-N198 PolarHBondContact O-N 2.94Å; N198-I200 PolarHBondContact O-N 3.42Å; N198-I200 PolarHBondContact OD1-N 3.37Å; N198-A248 VanDerWaalsContact O-CB 3.32Å; N198-A248 WeakPolarHBondContact O-CB 3.35Å; N198-F270 HydrophobicContact CB-CB 4.05Å; N198-F270 HydrophobicContact CB-CD1 4.16Å; N198-F270 HydrophobicContact CB-CG 4.45Å; N198-F270 VanDerWaalsContact N-CD1 3.26Å; N198-F270 WeakPolarHBondContact O-CD1 3.43Å; N198-F270 VanDerWaalsContact O-CE1 3.32Å; N198-F270 WeakPolarHBondContact O-CE1 3.45Å; N198-A271 PolarHBondContact ND2-O 3.44Å
199	H	96.1	Very high	80.4	Confident	70 Å²	70	73.9 Å²	73.9	32%	0.324	39%	0.39	S	S	.	.	S	Bend	trans	-72.7	-10.4	173.8	66.4	-75.5	0	0	0	112.3	F242	H199-F242 WeakPolarHBondContact O-CB 3.21Å; H199-F242 PolarHBondContact O-N 3.23Å
200	I	97.1	Very high	82.3	Confident	45 Å²	45	68.6 Å²	68.6	23%	0.231	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129.7	173.9	-55.5	175.1	0	0	0	109.9	N198 F239 V240 E241 A271	N198-I200 PolarHBondContact O-N 3.42Å; N198-I200 PolarHBondContact OD1-N 3.37Å; I200-F239 HydrophobicContact CG2-CB 4.15Å; I200-F239 HydrophobicContact CG2-CD1 3.97Å; I200-V240 CarbonylContact C-O 3.56Å; I200-V240 WeakPolarHBondContact CA-O 3.48Å; I200-E241 HydrophobicContact CG1-CB 4.43Å; I200-E241 HydrophobicContact CG1-CG 4.08Å; I200-A271 HydrophobicContact CB-CB 3.85Å; I200-A271 HydrophobicContact CG2-CB 3.69Å; I200-A271 WeakPolarHBondContact O-CB 3.12Å; I200-A271 PolarHBondContact O-N 3.39Å
201	L	97.4	Very high	84.4	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	143	171.5	-58.7	178.1	0	0	0	110.6	L203 F219 F239 V240 F242 A248 A251 R252 I268 S269 F270	L201-L203 HydrophobicContact CB-CD1 4.01Å; L201-F219 HydrophobicContact CD1-CD1 4.44Å; L201-F219 HydrophobicContact CD1-CE1 3.84Å; L201-F239 CarbonylContact O-C 3.54Å; L201-F239 VanDerWaalsContact O-CA 3.25Å; L201-F239 WeakPolarHBondContact O-CA 3.29Å; L201-V240 HydrophobicContact CB-CB 4.36Å; L201-V240 PolarHBondContact N-O 3.29Å; L201-V240 PolarHBondContact O-N 3.46Å; L201-F242 HydrophobicContact CD1-CD2 4.27Å; L201-F242 HydrophobicContact CD1-CE2 3.87Å; L201-A248 WeakPolarHBondContact CD1-O 3.43Å; L201-A248 HydrophobicContact CD2-CB 3.97Å; L201-A248 HydrophobicContact CG-CB 4.09Å; L201-A251 HydrophobicContact CD1-CB 4.23Å; L201-R252 HydrophobicContact CD1-CB 4.27Å; L201-R252 HydrophobicContact CD2-CB 3.96Å; L201-I268 HydrophobicContact CB-CG2 3.95Å; L201-I268 HydrophobicContact CD1-CG2 3.97Å; L201-I268 HydrophobicContact CD2-CG2 4.19Å; L201-I268 HydrophobicContact CG-CG2 4.27Å; L201-S269 CarbonylContact C-O 3.45Å; L201-S269 WeakPolarHBondContact CA-O 3.12Å; L201-F270 HydrophobicContact CD2-CD1 3.73Å; L201-F270 HydrophobicContact CD2-CE1 3.9Å
202	F	97.3	Very high	86.4	Confident	56 Å²	56	58.9 Å²	58.9	25%	0.246	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	121.1	172.5	177.5	-122.5	0	0	0	109.5	T204 I237 F239 I268 S269 A271	F202-T204 HydrophobicContact CD1-CG2 3.88Å; F202-T204 HydrophobicContact CE1-CG2 3.19Å; F202-T204 HydrophobicContact CE2-CG2 4.23Å; F202-T204 HydrophobicContact CZ-CG2 3.4Å; F202-T204 VanDerWaalsContact CZ-CG2 3.4Å; F202-I237 HydrophobicContact CE2-CB 4.01Å; F202-I237 HydrophobicContact CE2-CG2 4.23Å; F202-I237 HydrophobicContact CZ-CB 4.39Å; F202-I237 HydrophobicContact CZ-CG2 4.09Å; F202-F239 HydrophobicContact CB-CD1 4.34Å; F202-F239 HydrophobicContact CB-CE1 4.14Å; F202-F239 HydrophobicContact CD2-CD1 4.02Å; F202-F239 AromaticContact CD2-CE1 3.47Å; F202-F239 HydrophobicContact CD2-CE1 3.47Å; F202-F239 VanDerWaalsContact CD2-CE1 3.47Å; F202-F239 HydrophobicContact CD2-CE2 4.26Å; F202-F239 AromaticContact CD2-CZ 3.61Å; F202-F239 HydrophobicContact CD2-CZ 3.61Å; F202-F239 HydrophobicContact CE2-CE1 4.25Å; F202-F239 HydrophobicContact CE2-CE2 4.41Å; F202-F239 AromaticContact CE2-CZ 3.92Å; F202-F239 HydrophobicContact CE2-CZ 3.92Å; F202-F239 HydrophobicContact CG-CE1 4.14Å; F202-I268 WeakPolarHBondContact O-CA 3.23Å; F202-S269 PolarHBondContact N-O 3.26Å; F202-S269 PolarHBondContact O-N 3.32Å; F202-A271 HydrophobicContact CB-CB 4.46Å
203	L	96.1	Very high	87.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	138.2	-178.9	-74.8	60.3	0	0	0	109.1	L201 L206 L215 F219 I237 A238 V240 M266 K267 I268	L201-L203 HydrophobicContact CB-CD1 4.01Å; L203-L206 HydrophobicContact CB-CD1 4.22Å; L203-L206 HydrophobicContact CB-CD2 4.34Å; L203-L206 HydrophobicContact CB-CG 4.45Å; L203-L206 HydrophobicContact CD2-CD2 4.38Å; L203-L215 HydrophobicContact CD2-CD1 4.21Å; L203-L215 HydrophobicContact CD2-CD2 3.87Å; L203-F219 HydrophobicContact CD1-CZ 4.13Å; L203-F219 HydrophobicContact CD2-CE2 3.61Å; L203-F219 HydrophobicContact CD2-CZ 3.8Å; L203-F219 HydrophobicContact CG-CZ 4.22Å; L203-I237 VanDerWaalsContact O-CA 3.25Å; L203-I237 WeakPolarHBondContact O-CA 3.39Å; L203-A238 HydrophobicContact CB-CB 4.22Å; L203-A238 HydrophobicContact CD2-CB 4.38Å; L203-A238 PolarHBondContact N-O 3.41Å; L203-A238 PolarHBondContact O-N 3.2Å; L203-A238 VanDerWaalsContact O-N 3.13Å; L203-V240 HydrophobicContact CD1-CB 4.28Å; L203-V240 HydrophobicContact CD1-CG2 3.61Å; L203-V240 HydrophobicContact CD2-CG2 3.89Å; L203-V240 HydrophobicContact CG-CG2 4.44Å; L203-M266 HydrophobicContact CD2-SD 3.6Å; L203-M266 HydrophobicContact CG-CG 4.48Å; L203-M266 HydrophobicContact CG-SD 3.91Å; L203-K267 CarbonylContact C-O 3.6Å; L203-K267 WeakPolarHBondContact CA-O 3.29Å; L203-I268 HydrophobicContact CD1-CG2 4.32Å; L203-I268 HydrophobicContact CG-CG1 4.45Å
204	T	95	Very high	88.9	Confident	39 Å²	39	57 Å²	57	24%	0.239	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	168.2	174	59.5	0	0	0	0	110.7	F202 L206 D236 I237 K267	F202-T204 HydrophobicContact CD1-CG2 3.88Å; F202-T204 HydrophobicContact CE1-CG2 3.19Å; F202-T204 HydrophobicContact CE2-CG2 4.23Å; F202-T204 HydrophobicContact CZ-CG2 3.4Å; F202-T204 VanDerWaalsContact CZ-CG2 3.4Å; T204-L206 VanDerWaalsContact C-N 3.28Å; T204-L206 PolarHBondContact O-N 2.75Å; T204-D236 CarbonylContact C-O 3.59Å; T204-D236 WeakPolarHBondContact CA-O 3.45Å; T204-I237 HydrophobicContact CG2-CG2 4.04Å; T204-K267 PolarHBondContact N-O 3.4Å; T204-K267 PolarHBondContact O-N 3.31Å; T204-K267 WeakPolarHBondContact OG1-CB 3.24Å; T204-K267 PolarHBondContact OG1-O 3.43Å
205	N	93.4	Very high	90.3	Very high	71 Å²	71	50.8 Å²	50.8	38%	0.38	26%	0.262	S	S	.	.	S	Bend	trans	63.8	33.4	-178.5	-161.8	40.7	0	0	0	113	D236 A265	N205-D236 PolarHBondContact N-O 3.24Å; N205-D236 VanDerWaalsContact N-O 3.16Å; N205-A265 PolarHBondContact ND2-O 3.14Å
206	L	92.8	Very high	90.5	Very high	7 Å²	7	50.7 Å²	50.7	4%	0.037	26%	0.264	C	S	.	.			trans	-76.6	139.1	172.9	-56.7	177.7	0	0	0	110	L203 T204 T210 L215 D236 A238 I260 M266	L203-L206 HydrophobicContact CB-CD1 4.22Å; L203-L206 HydrophobicContact CB-CD2 4.34Å; L203-L206 HydrophobicContact CB-CG 4.45Å; L203-L206 HydrophobicContact CD2-CD2 4.38Å; T204-L206 VanDerWaalsContact C-N 3.28Å; T204-L206 PolarHBondContact O-N 2.75Å; L206-T210 HydrophobicContact CB-CG2 4.36Å; L206-T210 HydrophobicContact CD1-CG2 4.4Å; L206-L215 HydrophobicContact CD1-CD1 3.89Å; L206-L215 HydrophobicContact CD2-CD2 4.13Å; L206-D236 PolarHBondContact N-O 3.3Å; L206-D236 VanDerWaalsContact N-O 3.11Å; L206-A238 HydrophobicContact CD1-CB 3.64Å; L206-I260 HydrophobicContact CD2-CD1 3.44Å; L206-I260 VanDerWaalsContact CD2-CD1 3.44Å; L206-M266 HydrophobicContact CD2-CB 4.27Å; L206-M266 HydrophobicContact CD2-CG 4.29Å; L206-M266 HydrophobicContact CD2-SD 4.29Å
207	P	88.8	Confident	90.2	Very high	13 Å²	13	49.8 Å²	49.8	8%	0.084	25%	0.253	C	S	.	.			trans	-63.8	151.1	171.5	14.3	-18.9	0	0	0	111.4	E209 T210 I260 T261 N264	P207-E209 PolarHBondContact O-N 2.82Å; P207-E209 VanDerWaalsContact O-N 3.12Å; P207-T210 WeakPolarHBondContact CD-OG1 3.45Å; P207-T210 WeakPolarHBondContact CG-OG1 3.5Å; P207-T210 WeakPolarHBondContact O-CB 3.07Å; P207-T210 PolarHBondContact O-N 2.81Å; P207-T210 PolarHBondContact O-OG1 3.25Å; P207-I260 HydrophobicContact CG-CB 4.23Å; P207-I260 HydrophobicContact CG-CG2 3.96Å; P207-T261 HydrophobicContact CB-CG2 4.14Å; P207-T261 HydrophobicContact CG-CG2 3.73Å; P207-N264 HydrophobicContact CB-CB 4.36Å; P207-N264 HydrophobicContact CG-CB 4.09Å
208	E	82.9	Confident	90.1	Very high	162 Å²	162	47.9 Å²	47.9	76%	0.757	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.7	-176.5	-160.9	178.6	-175.1	0	0	113.2	T210 H235	E208-T210 VanDerWaalsContact C-N 3.27Å; E208-T210 PolarHBondContact O-N 2.88Å; E208-H235 HydrophobicContact CG-CB 4.26Å
209	E	81.9	Confident	90.1	Very high	157 Å²	157	47.3 Å²	47.3	73%	0.734	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-7.3	176.4	-59.5	175.9	-178.8	0	0	113	P207 N211	P207-E209 PolarHBondContact O-N 2.82Å; P207-E209 VanDerWaalsContact O-N 3.12Å; E209-N211 PolarHBondContact O-N 3.43Å
210	T	84.8	Confident	89.9	Confident	6 Å²	6	49.2 Å²	49.2	4%	0.037	25%	0.248	C	C	.	.			trans	-66.1	129.6	179.8	-51.3	0	0	0	0	110	L206 P207 E208 L215	L206-T210 HydrophobicContact CB-CG2 4.36Å; L206-T210 HydrophobicContact CD1-CG2 4.4Å; P207-T210 WeakPolarHBondContact CD-OG1 3.45Å; P207-T210 WeakPolarHBondContact CG-OG1 3.5Å; P207-T210 WeakPolarHBondContact O-CB 3.07Å; P207-T210 PolarHBondContact O-N 2.81Å; P207-T210 PolarHBondContact O-OG1 3.25Å; E208-T210 VanDerWaalsContact C-N 3.27Å; E208-T210 PolarHBondContact O-N 2.88Å; T210-L215 HydrophobicContact CG2-CD1 4.01Å; T210-L215 HydrophobicContact CG2-CD2 3.98Å; T210-L215 HydrophobicContact CG2-CG 3.78Å
211	N	87.8	Confident	89.5	Confident	31 Å²	31	53 Å²	53	17%	0.166	27%	0.265	C	S	.	.			trans	-119.9	167.3	174.2	60.8	41.4	0	0	0	111	E209 L213 M214 L215	E209-N211 PolarHBondContact O-N 3.43Å; N211-L213 PolarHBondContact O-N 2.88Å; N211-L213 WeakPolarHBondContact OD1-CB 3.49Å; N211-L213 PolarHBondContact OD1-N 3.2Å; N211-M214 PolarHBondContact O-N 3.11Å; N211-M214 WeakPolarHBondContact OD1-CG 3.17Å; N211-M214 PolarHBondContact OD1-N 3.3Å; N211-L215 PolarHBondContact O-N 2.87Å
212	E	87.1	Confident	89.5	Confident	105 Å²	105	54.7 Å²	54.7	49%	0.491	27%	0.272	S	S	.	.	H	α-helix	trans	-56.1	-34.4	-179	-168.5	-173.5	139.8	0	0	112	L215 S216 V228 L230	E212-L215 PolarHBondContact O-N 2.77Å; E212-S216 WeakPolarHBondContact O-CB 3.18Å; E212-S216 PolarHBondContact O-N 3.24Å; E212-S216 PolarHBondContact O-OG 2.94Å; E212-V228 VanDerWaalsContact CD-O 3.32Å; E212-V228 HydrophobicContact CG-CB 3.77Å; E212-V228 HydrophobicContact CG-CG1 4.02Å; E212-V228 WeakPolarHBondContact CG-O 3.36Å; E212-L230 HydrophobicContact CB-CD1 4.16Å; E212-L230 HydrophobicContact CB-CG 4.26Å
213	L	77.8	Confident	89.3	Confident	39 Å²	39	56.6 Å²	56.6	20%	0.204	29%	0.29	C	S	.	.	H	α-helix	trans	-69	-42	-178.1	-171.2	75.3	0	0	0	113.2	I33 F75 F77 N211 L215 S216 M217	I33-L213 HydrophobicContact CD1-CD2 3.26Å; I33-L213 HydrophobicContact CG1-CD2 3.8Å; F75-L213 HydrophobicContact CE1-CD1 3.75Å; F75-L213 HydrophobicContact CE1-CD2 3.69Å; F75-L213 HydrophobicContact CE1-CG 4.07Å; F75-L213 HydrophobicContact CZ-CD1 3.6Å; F75-L213 HydrophobicContact CZ-CD2 4.1Å; F75-L213 HydrophobicContact CZ-CG 4Å; F77-L213 HydrophobicContact CD2-CD2 4.21Å; N211-L213 PolarHBondContact O-N 2.88Å; N211-L213 WeakPolarHBondContact OD1-CB 3.49Å; N211-L213 PolarHBondContact OD1-N 3.2Å; L213-L215 VanDerWaalsContact C-N 3.27Å; L213-L215 PolarHBondContact O-N 3.11Å; L213-S216 WeakPolarHBondContact CA-OG 3.48Å; L213-S216 PolarHBondContact O-N 3.24Å; L213-S216 PolarHBondContact O-OG 3.18Å; L213-M217 HydrophobicContact CD2-CE 4.36Å; L213-M217 HydrophobicContact CG-CE 4.31Å; L213-M217 WeakPolarHBondContact O-CG 3.37Å; L213-M217 PolarHBondContact O-N 3.16Å
214	M	84.6	Confident	89.3	Confident	62 Å²	62	57.7 Å²	57.7	31%	0.305	30%	0.301	S	S	.	.	H	α-helix	trans	-62.4	-41.4	176.7	-71.8	172.1	68.3	0	0	110.7	N211 L218 I260	N211-M214 PolarHBondContact O-N 3.11Å; N211-M214 WeakPolarHBondContact OD1-CG 3.17Å; N211-M214 PolarHBondContact OD1-N 3.3Å; M214-L218 WeakPolarHBondContact O-CB 3.38Å; M214-L218 PolarHBondContact O-N 2.94Å; M214-I260 HydrophobicContact CE-CG2 3.82Å
215	L	92.6	Very high	89.4	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-69.7	-41.9	176.7	-64.9	177.2	0	0	0	111.1	L203 L206 T210 N211 E212 L213 M217 L218 F219 V228 L230 A238 I260	L203-L215 HydrophobicContact CD2-CD1 4.21Å; L203-L215 HydrophobicContact CD2-CD2 3.87Å; L206-L215 HydrophobicContact CD1-CD1 3.89Å; L206-L215 HydrophobicContact CD2-CD2 4.13Å; T210-L215 HydrophobicContact CG2-CD1 4.01Å; T210-L215 HydrophobicContact CG2-CD2 3.98Å; T210-L215 HydrophobicContact CG2-CG 3.78Å; N211-L215 PolarHBondContact O-N 2.87Å; E212-L215 PolarHBondContact O-N 2.77Å; L213-L215 VanDerWaalsContact C-N 3.27Å; L213-L215 PolarHBondContact O-N 3.11Å; L215-M217 VanDerWaalsContact C-N 3.32Å; L215-M217 PolarHBondContact O-N 3.27Å; L215-L218 PolarHBondContact O-N 3.37Å; L215-L218 VanDerWaalsContact O-N 3.08Å; L215-F219 HydrophobicContact CD2-CE2 4.47Å; L215-F219 VanDerWaalsContact O-CD2 3.32Å; L215-F219 WeakPolarHBondContact O-CD2 3.34Å; L215-F219 PolarHBondContact O-N 2.95Å; L215-V228 HydrophobicContact CB-CB 4.46Å; L215-V228 HydrophobicContact CB-CG1 3.83Å; L215-V228 HydrophobicContact CB-CG2 3.96Å; L215-V228 HydrophobicContact CD1-CG1 3.77Å; L215-V228 HydrophobicContact CG-CG1 4.48Å; L215-L230 HydrophobicContact CD1-CD2 3.91Å; L215-A238 HydrophobicContact CD1-CB 3.64Å; L215-I260 HydrophobicContact CD2-CD1 4.03Å
216	S	89.1	Confident	89.4	Confident	29 Å²	29	59.4 Å²	59.4	20%	0.203	30%	0.302	C	S	.	.	H	α-helix	trans	-62	-42.2	178.6	71.8	0	0	0	0	111.2	E212 L213 L218 F219 N220	E212-S216 WeakPolarHBondContact O-CB 3.18Å; E212-S216 PolarHBondContact O-N 3.24Å; E212-S216 PolarHBondContact O-OG 2.94Å; L213-S216 WeakPolarHBondContact CA-OG 3.48Å; L213-S216 PolarHBondContact O-N 3.24Å; L213-S216 PolarHBondContact O-OG 3.18Å; S216-L218 VanDerWaalsContact C-N 3.32Å; S216-L218 PolarHBondContact O-N 2.7Å; S216-F219 PolarHBondContact O-N 2.95Å; S216-N220 WeakPolarHBondContact O-CB 3.39Å; S216-N220 PolarHBondContact O-N 3.33Å
217	M	83.9	Confident	89.4	Confident	73 Å²	73	63.8 Å²	63.8	36%	0.36	32%	0.323	S	S	.	.	H	α-helix	trans	-57.6	-44.4	172.1	-71.9	178.7	-179.3	0	0	112.4	M72 F75 L213 L215	M72-M217 HydrophobicContact CE-CE 4.33Å; F75-M217 HydrophobicContact CD1-CE 4.46Å; F75-M217 HydrophobicContact CD2-CE 4.17Å; F75-M217 HydrophobicContact CE1-CE 3.65Å; F75-M217 HydrophobicContact CE2-CE 3.31Å; F75-M217 HydrophobicContact CE2-CG 4.43Å; F75-M217 HydrophobicContact CZ-CE 3.02Å; F75-M217 HydrophobicContact CZ-CG 4.37Å; F75-M217 HydrophobicContact CZ-SD 4.49Å; L213-M217 HydrophobicContact CD2-CE 4.36Å; L213-M217 HydrophobicContact CG-CE 4.31Å; L213-M217 WeakPolarHBondContact O-CG 3.37Å; L213-M217 PolarHBondContact O-N 3.16Å; L215-M217 VanDerWaalsContact C-N 3.32Å; L215-M217 PolarHBondContact O-N 3.27Å
218	L	89.4	Confident	89.8	Confident	27 Å²	27	63.5 Å²	63.5	14%	0.141	32%	0.32	C	S	.	.	H	α-helix	trans	-69.6	-36.6	-176.3	-172.3	65.2	0	0	0	112.5	M214 L215 S216 Q221 L255 F258 M266	M214-L218 WeakPolarHBondContact O-CB 3.38Å; M214-L218 PolarHBondContact O-N 2.94Å; L215-L218 PolarHBondContact O-N 3.37Å; L215-L218 VanDerWaalsContact O-N 3.08Å; S216-L218 VanDerWaalsContact C-N 3.32Å; S216-L218 PolarHBondContact O-N 2.7Å; L218-Q221 WeakPolarHBondContact O-CG 3.33Å; L218-Q221 PolarHBondContact O-NE2 2.69Å; L218-L255 HydrophobicContact CD1-CD2 3.81Å; L218-L255 HydrophobicContact CD2-CD1 4.19Å; L218-L255 HydrophobicContact CD2-CD2 4.3Å; L218-L255 HydrophobicContact CG-CD1 3.83Å; L218-L255 HydrophobicContact CG-CD2 3.95Å; L218-F258 HydrophobicContact CD1-CD1 4.15Å; L218-F258 HydrophobicContact CD1-CE1 3.75Å; L218-F258 HydrophobicContact CD1-CE2 4.47Å; L218-F258 HydrophobicContact CD1-CZ 3.93Å; L218-F258 HydrophobicContact CD2-CD1 3.71Å; L218-F258 HydrophobicContact CD2-CE1 3.9Å; L218-M266 HydrophobicContact CD2-CE 3.49Å; L218-M266 VanDerWaalsContact CD2-CE 3.49Å
219	F	95.6	Very high	90.4	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-91.5	-23.2	-178.1	-76.4	-92.3	0	0	0	113.5	L201 L203 L215 S216 Q221 F222 F225 V240 F242 A251 L255 M266 I268	L201-F219 HydrophobicContact CD1-CD1 4.44Å; L201-F219 HydrophobicContact CD1-CE1 3.84Å; L203-F219 HydrophobicContact CD1-CZ 4.13Å; L203-F219 HydrophobicContact CD2-CE2 3.61Å; L203-F219 HydrophobicContact CD2-CZ 3.8Å; L203-F219 HydrophobicContact CG-CZ 4.22Å; L215-F219 HydrophobicContact CD2-CE2 4.47Å; L215-F219 VanDerWaalsContact O-CD2 3.32Å; L215-F219 WeakPolarHBondContact O-CD2 3.34Å; L215-F219 PolarHBondContact O-N 2.95Å; S216-F219 PolarHBondContact O-N 2.95Å; F219-Q221 PolarHBondContact O-N 3.12Å; F219-Q221 VanDerWaalsContact O-N 3.11Å; F219-F222 PolarHBondContact O-N 3.48Å; F219-F225 HydrophobicContact CB-CD2 3.52Å; F219-F225 HydrophobicContact CB-CE2 3.74Å; F219-F225 HydrophobicContact CB-CG 4.38Å; F219-V240 HydrophobicContact CB-CG1 4.01Å; F219-V240 HydrophobicContact CD1-CB 4.44Å; F219-V240 HydrophobicContact CD1-CG1 3.86Å; F219-V240 HydrophobicContact CD1-CG2 4.42Å; F219-V240 HydrophobicContact CD2-CG1 4.48Å; F219-V240 HydrophobicContact CD2-CG2 4.06Å; F219-V240 HydrophobicContact CE1-CG1 4.47Å; F219-V240 HydrophobicContact CE1-CG2 4.42Å; F219-V240 HydrophobicContact CE2-CG2 4.09Å; F219-V240 HydrophobicContact CG-CG1 3.86Å; F219-V240 HydrophobicContact CG-CG2 4.24Å; F219-V240 HydrophobicContact CZ-CG2 4.26Å; F219-F242 HydrophobicContact CB-CZ 4.3Å; F219-F242 AromaticContact CD1-CE2 3.84Å; F219-F242 HydrophobicContact CD1-CE2 3.84Å; F219-F242 AromaticContact CD1-CZ 3.85Å; F219-F242 HydrophobicContact CD1-CZ 3.85Å; F219-A251 HydrophobicContact CD1-CB 4.14Å; F219-A251 HydrophobicContact CE1-CB 4.33Å; F219-L255 HydrophobicContact CD1-CD1 3.79Å; F219-L255 HydrophobicContact CD2-CD1 4.14Å; F219-L255 HydrophobicContact CE1-CD1 3.57Å; F219-L255 HydrophobicContact CE2-CD1 3.91Å; F219-L255 HydrophobicContact CG-CD1 4.09Å; F219-L255 HydrophobicContact CZ-CD1 3.63Å; F219-M266 HydrophobicContact CE2-CE 4.41Å; F219-M266 HydrophobicContact CE2-SD 4.08Å; F219-M266 HydrophobicContact CZ-CE 4.44Å; F219-M266 HydrophobicContact CZ-SD 4.09Å; F219-I268 HydrophobicContact CE1-CD1 4.28Å; F219-I268 HydrophobicContact CZ-CD1 3.86Å
220	N	93.1	Very high	90.8	Very high	111 Å²	111	58.4 Å²	58.4	59%	0.594	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.9	178	-176.1	79.7	0	0	0	113.9	S216 F222 F225	S216-N220 WeakPolarHBondContact O-CB 3.39Å; S216-N220 PolarHBondContact O-N 3.33Å; N220-F222 PolarHBondContact O-N 3.5Å; N220-F225 HydrophobicContact CB-CD1 3.85Å; N220-F225 HydrophobicContact CB-CE1 4.16Å; N220-F225 HydrophobicContact CB-CG 4.42Å
221	Q	89.1	Confident	91.1	Very high	124 Å²	124	60 Å²	60	58%	0.579	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-16.5	172.2	72.9	-172.5	-44.6	0	0	113.2	L218 F219	L218-Q221 WeakPolarHBondContact O-CG 3.33Å; L218-Q221 PolarHBondContact O-NE2 2.69Å; F219-Q221 PolarHBondContact O-N 3.12Å; F219-Q221 VanDerWaalsContact O-N 3.11Å
222	F	95.4	Very high	91	Very high	35 Å²	35	64.4 Å²	64.4	15%	0.154	33%	0.331	C	S	.	.	S	Bend	trans	-95.2	133.5	178.5	-63.4	-84.7	0	0	0	110.2	F219 N220 G224 F225 F242 A251 A254 L255	F219-F222 PolarHBondContact O-N 3.48Å; N220-F222 PolarHBondContact O-N 3.5Å; F222-G224 PolarHBondContact O-N 3.11Å; F222-F225 PolarHBondContact O-N 3.16Å; F222-F242 HydrophobicContact CB-CE1 3.74Å; F222-F242 HydrophobicContact CB-CZ 4.05Å; F222-A251 HydrophobicContact CB-CB 3.92Å; F222-A251 HydrophobicContact CD1-CB 3.9Å; F222-A251 HydrophobicContact CD2-CB 3.83Å; F222-A251 HydrophobicContact CE1-CB 4.43Å; F222-A251 HydrophobicContact CE2-CB 4.38Å; F222-A251 HydrophobicContact CG-CB 3.58Å; F222-A254 HydrophobicContact CE1-CB 3.47Å; F222-A254 VanDerWaalsContact CE1-CB 3.47Å; F222-A254 HydrophobicContact CZ-CB 3.47Å; F222-A254 VanDerWaalsContact CZ-CB 3.47Å; F222-L255 HydrophobicContact CD2-CD1 4.18Å; F222-L255 HydrophobicContact CE2-CD1 3.49Å; F222-L255 VanDerWaalsContact CE2-CD1 3.49Å; F222-L255 HydrophobicContact CE2-CD2 4.05Å; F222-L255 HydrophobicContact CE2-CG 3.59Å; F222-L255 HydrophobicContact CZ-CD1 4.25Å; F222-L255 HydrophobicContact CZ-CD2 4.26Å; F222-L255 HydrophobicContact CZ-CG 3.85Å
223	P	94.9	Very high	91	Very high	96 Å²	96	62.8 Å²	62.8	62%	0.623	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	140.1	178.4	-25.9	34.3	0	0	0	112.6	F225 Q247	P223-F225 VanDerWaalsContact C-N 3.33Å; P223-F225 PolarHBondContact O-N 3.38Å; P223-Q247 WeakPolarHBondContact O-CB 3.48Å; P223-Q247 WeakPolarHBondContact O-CG 3.37Å; P223-Q247 PolarHBondContact O-OE1 2.86Å
224	G	95.1	Very high	91.6	Very high	23 Å²	23	67 Å²	67	24%	0.237	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	13.9	175.7	0	0	0	0	0	115.7	F222 K226 F242 E243	F222-G224 PolarHBondContact O-N 3.11Å; G224-K226 PolarHBondContact O-N 2.88Å; G224-F242 CarbonylContact O-C 3.4Å; G224-F242 WeakPolarHBondContact O-CA 3.35Å; G224-E243 PolarHBondContact O-N 3.23Å
225	F	97.3	Very high	91.6	Very high	39 Å²	39	68.4 Å²	68.4	17%	0.171	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	133.5	165.1	168.8	-100.5	0	0	0	111	F219 N220 F222 P223 V228 V240 F242	F219-F225 HydrophobicContact CB-CD2 3.52Å; F219-F225 HydrophobicContact CB-CE2 3.74Å; F219-F225 HydrophobicContact CB-CG 4.38Å; N220-F225 HydrophobicContact CB-CD1 3.85Å; N220-F225 HydrophobicContact CB-CE1 4.16Å; N220-F225 HydrophobicContact CB-CG 4.42Å; F222-F225 PolarHBondContact O-N 3.16Å; P223-F225 VanDerWaalsContact C-N 3.33Å; P223-F225 PolarHBondContact O-N 3.38Å; F225-V228 HydrophobicContact CE2-CG2 3.63Å; F225-V228 HydrophobicContact CZ-CG2 3.8Å; F225-V240 HydrophobicContact CD2-CG1 3.85Å; F225-V240 HydrophobicContact CE2-CG1 3.8Å; F225-F242 HydrophobicContact CB-CD1 4.39Å; F225-F242 HydrophobicContact CB-CE1 3.86Å; F225-F242 HydrophobicContact CB-CZ 4.25Å; F225-F242 HydrophobicContact CD2-CZ 4.4Å
226	K	93.8	Very high	91.5	Very high	108 Å²	108	71.3 Å²	71.3	47%	0.47	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	-66	178.5	-73	174.1	169	168.4	0	112.7	G224 E241	G224-K226 PolarHBondContact O-N 2.88Å; K226-E241 HydrophobicContact CB-CB 4.27Å; K226-E241 HydrophobicContact CB-CG 4.43Å; K226-E241 WeakPolarHBondContact CB-O 3.13Å; K226-E241 HydrophobicContact CD-CG 3.89Å; K226-E241 WeakPolarHBondContact CD-OE1 3.17Å; K226-E241 PolarHBondContact N-O 3.11Å; K226-E241 IonicContact NZ-OE1 2.78Å; K226-E241 PolarHBondContact NZ-OE1 2.88Å
227	E	93.1	Very high	91.8	Very high	99 Å²	99	70.4 Å²	70.4	46%	0.463	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	157.9	-174.5	65.8	167.4	-145.7	0	0	113	V240 E241	E227-V240 WeakPolarHBondContact O-CA 3.03Å; E227-E241 HydrophobicContact CG-CB 3.96Å; E227-E241 PolarHBondContact O-N 2.91Å
228	V	96.6	Very high	92.4	Very high	6 Å²	6	66.9 Å²	66.9	4%	0.036	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	134.3	166.5	-180	0	0	0	0	108.2	E212 L215 F225 A238 F239 V240	E212-V228 VanDerWaalsContact CD-O 3.32Å; E212-V228 HydrophobicContact CG-CB 3.77Å; E212-V228 HydrophobicContact CG-CG1 4.02Å; E212-V228 WeakPolarHBondContact CG-O 3.36Å; L215-V228 HydrophobicContact CB-CB 4.46Å; L215-V228 HydrophobicContact CB-CG1 3.83Å; L215-V228 HydrophobicContact CB-CG2 3.96Å; L215-V228 HydrophobicContact CD1-CG1 3.77Å; L215-V228 HydrophobicContact CG-CG1 4.48Å; F225-V228 HydrophobicContact CE2-CG2 3.63Å; F225-V228 HydrophobicContact CZ-CG2 3.8Å; V228-A238 HydrophobicContact CG1-CB 4.41Å; V228-F239 CarbonylContact C-O 3.28Å; V228-F239 WeakPolarHBondContact CA-O 3.15Å; V228-V240 HydrophobicContact CG1-CG2 4.39Å; V228-V240 HydrophobicContact CG2-CG1 4.43Å; V228-V240 HydrophobicContact CG2-CG2 4.06Å
229	R	94.6	Very high	92.8	Very high	169 Å²	169	69 Å²	69	64%	0.638	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	110.4	174.8	-177	173.7	169.3	-177.7	-3.5	110.6	A238 F239	R229-A238 CarbonylContact O-C 3.58Å; R229-A238 WeakPolarHBondContact O-CA 3.44Å; R229-F239 HydrophobicContact CB-CB 4.46Å; R229-F239 PolarHBondContact N-O 3.49Å; R229-F239 PolarHBondContact O-N 2.87Å
230	L	91.6	Very high	92.9	Very high	43 Å²	43	69 Å²	69	23%	0.225	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	150.6	169.6	-64.2	-179.7	0	0	0	110.9	E212 L215 A238	E212-L230 HydrophobicContact CB-CD1 4.16Å; E212-L230 HydrophobicContact CB-CG 4.26Å; L215-L230 HydrophobicContact CD1-CD2 3.91Å; L230-A238 HydrophobicContact CD2-CB 3.7Å
231	V	90.6	Very high	93.1	Very high	41 Å²	41	66 Å²	66	25%	0.248	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	122	175.2	-178.7	0	0	0	0	110.1	G233 R234 I237 F239	V231-G233 PolarHBondContact O-N 3.12Å; V231-R234 HydrophobicContact CB-CB 4.18Å; V231-R234 HydrophobicContact CG1-CB 4.11Å; V231-R234 CarbonylContact O-C 3.56Å; V231-R234 PolarHBondContact O-N 3.35Å; V231-R234 VanDerWaalsContact O-O 3.11Å; V231-I237 HydrophobicContact CB-CD1 3.76Å; V231-I237 HydrophobicContact CB-CG1 3.74Å; V231-I237 HydrophobicContact CG1-CD1 4.06Å; V231-I237 HydrophobicContact CG2-CD1 3.58Å; V231-I237 HydrophobicContact CG2-CG1 3.67Å; V231-F239 HydrophobicContact CG2-CD2 4.16Å; V231-F239 HydrophobicContact CG2-CE2 3.82Å
232	P	86.1	Confident	93.6	Very high	123 Å²	123	60.1 Å²	60.1	80%	0.799	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	129.8	176.5	-24.7	34.2	0	0	0	111.6	R234	P232-R234 PolarHBondContact O-N 2.77Å
233	G	86	Confident	93.6	Very high	71 Å²	71	64.5 Å²	64.5	73%	0.732	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	0.6	-178.7	0	0	0	0	0	115	V231	V231-G233 PolarHBondContact O-N 3.12Å
234	R	90.6	Very high	93.7	Very high	127 Å²	127	62.6 Å²	62.6	48%	0.479	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	89.8	173.5	-73.4	-159.5	62.4	174.9	-0.8	111.5	V231 P232 D236 I237	V231-R234 HydrophobicContact CB-CB 4.18Å; V231-R234 HydrophobicContact CG1-CB 4.11Å; V231-R234 CarbonylContact O-C 3.56Å; V231-R234 PolarHBondContact O-N 3.35Å; V231-R234 VanDerWaalsContact O-O 3.11Å; P232-R234 PolarHBondContact O-N 2.77Å; R234-D236 IonicContact CZ-OD1 3.93Å; R234-D236 IonicContact CZ-OD2 3.59Å; R234-D236 IonicContact NE-OD1 2.75Å; R234-D236 PolarHBondContact NE-OD1 3.03Å; R234-D236 IonicContact NE-OD2 3.94Å; R234-D236 IonicContact NH2-OD1 3.23Å; R234-D236 PolarHBondContact NH2-OD1 3.36Å; R234-D236 IonicContact NH2-OD2 3.67Å; R234-D236 PolarHBondContact NH2-OD2 2.96Å; R234-D236 PolarHBondContact O-N 2.76Å; R234-I237 HydrophobicContact CB-CD1 3.81Å; R234-I237 HydrophobicContact CB-CG1 3.76Å; R234-I237 HydrophobicContact CG-CD1 4.42Å
235	H	85.7	Confident	93.8	Very high	92 Å²	92	66.2 Å²	66.2	43%	0.426	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	-11.5	-178	-60.5	-70.7	0	0	0	113.9	E208 I237	E208-H235 HydrophobicContact CG-CB 4.26Å; H235-I237 VanDerWaalsContact C-N 3.32Å
236	D	90.9	Very high	93.7	Very high	61 Å²	61	69.7 Å²	69.7	33%	0.326	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-6.2	-178.4	66.6	-48.4	0	0	0	113.9	T204 N205 L206 R234	T204-D236 CarbonylContact C-O 3.59Å; T204-D236 WeakPolarHBondContact CA-O 3.45Å; N205-D236 PolarHBondContact N-O 3.24Å; N205-D236 VanDerWaalsContact N-O 3.16Å; L206-D236 PolarHBondContact N-O 3.3Å; L206-D236 VanDerWaalsContact N-O 3.11Å; R234-D236 IonicContact CZ-OD1 3.93Å; R234-D236 IonicContact CZ-OD2 3.59Å; R234-D236 IonicContact NE-OD1 2.75Å; R234-D236 PolarHBondContact NE-OD1 3.03Å; R234-D236 IonicContact NE-OD2 3.94Å; R234-D236 IonicContact NH2-OD1 3.23Å; R234-D236 PolarHBondContact NH2-OD1 3.36Å; R234-D236 IonicContact NH2-OD2 3.67Å; R234-D236 PolarHBondContact NH2-OD2 2.96Å; R234-D236 PolarHBondContact O-N 2.76Å
237	I	94.8	Very high	93.9	Very high	10 Å²	10	66.5 Å²	66.5	5%	0.051	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	148.8	-173.9	64.5	177	0	0	0	113.1	F202 L203 T204 V231 R234 H235	F202-I237 HydrophobicContact CE2-CB 4.01Å; F202-I237 HydrophobicContact CE2-CG2 4.23Å; F202-I237 HydrophobicContact CZ-CB 4.39Å; F202-I237 HydrophobicContact CZ-CG2 4.09Å; L203-I237 VanDerWaalsContact O-CA 3.25Å; L203-I237 WeakPolarHBondContact O-CA 3.39Å; T204-I237 HydrophobicContact CG2-CG2 4.04Å; V231-I237 HydrophobicContact CB-CD1 3.76Å; V231-I237 HydrophobicContact CB-CG1 3.74Å; V231-I237 HydrophobicContact CG1-CD1 4.06Å; V231-I237 HydrophobicContact CG2-CD1 3.58Å; V231-I237 HydrophobicContact CG2-CG1 3.67Å; R234-I237 HydrophobicContact CB-CD1 3.81Å; R234-I237 HydrophobicContact CB-CG1 3.76Å; R234-I237 HydrophobicContact CG-CD1 4.42Å; H235-I237 VanDerWaalsContact C-N 3.32Å
238	A	96.7	Very high	94.1	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	161.7	175.8	0	0	0	0	0	111.3	L203 L206 L215 V228 R229 L230	L203-A238 HydrophobicContact CB-CB 4.22Å; L203-A238 HydrophobicContact CD2-CB 4.38Å; L203-A238 PolarHBondContact N-O 3.41Å; L203-A238 PolarHBondContact O-N 3.2Å; L203-A238 VanDerWaalsContact O-N 3.13Å; L206-A238 HydrophobicContact CD1-CB 3.64Å; L215-A238 HydrophobicContact CD1-CB 3.64Å; V228-A238 HydrophobicContact CG1-CB 4.41Å; R229-A238 CarbonylContact O-C 3.58Å; R229-A238 WeakPolarHBondContact O-CA 3.44Å; L230-A238 HydrophobicContact CD2-CB 3.7Å
239	F	97.4	Very high	94.1	Very high	71 Å²	71	62 Å²	62	31%	0.311	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	142.6	167.6	-65.2	-86.5	0	0	0	109.8	I200 L201 F202 V228 R229 V231 A271	I200-F239 HydrophobicContact CG2-CB 4.15Å; I200-F239 HydrophobicContact CG2-CD1 3.97Å; L201-F239 CarbonylContact O-C 3.54Å; L201-F239 VanDerWaalsContact O-CA 3.25Å; L201-F239 WeakPolarHBondContact O-CA 3.29Å; F202-F239 HydrophobicContact CB-CD1 4.34Å; F202-F239 HydrophobicContact CB-CE1 4.14Å; F202-F239 HydrophobicContact CD2-CD1 4.02Å; F202-F239 AromaticContact CD2-CE1 3.47Å; F202-F239 HydrophobicContact CD2-CE1 3.47Å; F202-F239 VanDerWaalsContact CD2-CE1 3.47Å; F202-F239 HydrophobicContact CD2-CE2 4.26Å; F202-F239 AromaticContact CD2-CZ 3.61Å; F202-F239 HydrophobicContact CD2-CZ 3.61Å; F202-F239 HydrophobicContact CE2-CE1 4.25Å; F202-F239 HydrophobicContact CE2-CE2 4.41Å; F202-F239 AromaticContact CE2-CZ 3.92Å; F202-F239 HydrophobicContact CE2-CZ 3.92Å; F202-F239 HydrophobicContact CG-CE1 4.14Å; V228-F239 CarbonylContact C-O 3.28Å; V228-F239 WeakPolarHBondContact CA-O 3.15Å; R229-F239 HydrophobicContact CB-CB 4.46Å; R229-F239 PolarHBondContact N-O 3.49Å; R229-F239 PolarHBondContact O-N 2.87Å; V231-F239 HydrophobicContact CG2-CD2 4.16Å; V231-F239 HydrophobicContact CG2-CE2 3.82Å; F239-A271 HydrophobicContact CD1-CB 4.23Å; F239-A271 HydrophobicContact CE1-CB 4.22Å
240	V	97.8	Very high	94.2	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	123.3	174.6	-177.3	0	0	0	0	108.6	I200 L201 L203 F219 F225 E227 V228 F242	I200-V240 CarbonylContact C-O 3.56Å; I200-V240 WeakPolarHBondContact CA-O 3.48Å; L201-V240 HydrophobicContact CB-CB 4.36Å; L201-V240 PolarHBondContact N-O 3.29Å; L201-V240 PolarHBondContact O-N 3.46Å; L203-V240 HydrophobicContact CD1-CB 4.28Å; L203-V240 HydrophobicContact CD1-CG2 3.61Å; L203-V240 HydrophobicContact CD2-CG2 3.89Å; L203-V240 HydrophobicContact CG-CG2 4.44Å; F219-V240 HydrophobicContact CB-CG1 4.01Å; F219-V240 HydrophobicContact CD1-CB 4.44Å; F219-V240 HydrophobicContact CD1-CG1 3.86Å; F219-V240 HydrophobicContact CD1-CG2 4.42Å; F219-V240 HydrophobicContact CD2-CG1 4.48Å; F219-V240 HydrophobicContact CD2-CG2 4.06Å; F219-V240 HydrophobicContact CE1-CG1 4.47Å; F219-V240 HydrophobicContact CE1-CG2 4.42Å; F219-V240 HydrophobicContact CE2-CG2 4.09Å; F219-V240 HydrophobicContact CG-CG1 3.86Å; F219-V240 HydrophobicContact CG-CG2 4.24Å; F219-V240 HydrophobicContact CZ-CG2 4.26Å; F225-V240 HydrophobicContact CD2-CG1 3.85Å; F225-V240 HydrophobicContact CE2-CG1 3.8Å; E227-V240 WeakPolarHBondContact O-CA 3.03Å; V228-V240 HydrophobicContact CG1-CG2 4.39Å; V228-V240 HydrophobicContact CG2-CG1 4.43Å; V228-V240 HydrophobicContact CG2-CG2 4.06Å; V240-F242 HydrophobicContact CG1-CD2 4.15Å; V240-F242 HydrophobicContact CG1-CE2 3.61Å; V240-F242 HydrophobicContact CG1-CZ 4.41Å
241	E	97.6	Very high	94.5	Very high	48 Å²	48	54.4 Å²	54.4	22%	0.224	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	136.6	178.7	-168.3	-174.5	149.6	0	0	111	I200 K226 E227	I200-E241 HydrophobicContact CG1-CB 4.43Å; I200-E241 HydrophobicContact CG1-CG 4.08Å; K226-E241 HydrophobicContact CB-CB 4.27Å; K226-E241 HydrophobicContact CB-CG 4.43Å; K226-E241 WeakPolarHBondContact CB-O 3.13Å; K226-E241 HydrophobicContact CD-CG 3.89Å; K226-E241 WeakPolarHBondContact CD-OE1 3.17Å; K226-E241 PolarHBondContact N-O 3.11Å; K226-E241 IonicContact NZ-OE1 2.78Å; K226-E241 PolarHBondContact NZ-OE1 2.88Å; E227-E241 HydrophobicContact CG-CB 3.96Å; E227-E241 PolarHBondContact O-N 2.91Å
242	F	98.3	Very high	94.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	166.4	169.3	-77.5	-95.4	0	0	0	111.4	H199 L201 F219 F222 G224 F225 V240 N244 Q247 A248 A251	H199-F242 WeakPolarHBondContact O-CB 3.21Å; H199-F242 PolarHBondContact O-N 3.23Å; L201-F242 HydrophobicContact CD1-CD2 4.27Å; L201-F242 HydrophobicContact CD1-CE2 3.87Å; F219-F242 HydrophobicContact CB-CZ 4.3Å; F219-F242 AromaticContact CD1-CE2 3.84Å; F219-F242 HydrophobicContact CD1-CE2 3.84Å; F219-F242 AromaticContact CD1-CZ 3.85Å; F219-F242 HydrophobicContact CD1-CZ 3.85Å; F222-F242 HydrophobicContact CB-CE1 3.74Å; F222-F242 HydrophobicContact CB-CZ 4.05Å; G224-F242 CarbonylContact O-C 3.4Å; G224-F242 WeakPolarHBondContact O-CA 3.35Å; F225-F242 HydrophobicContact CB-CD1 4.39Å; F225-F242 HydrophobicContact CB-CE1 3.86Å; F225-F242 HydrophobicContact CB-CZ 4.25Å; F225-F242 HydrophobicContact CD2-CZ 4.4Å; V240-F242 HydrophobicContact CG1-CD2 4.15Å; V240-F242 HydrophobicContact CG1-CE2 3.61Å; V240-F242 HydrophobicContact CG1-CZ 4.41Å; F242-N244 VanDerWaalsContact C-N 3.34Å; F242-Q247 HydrophobicContact CB-CB 4.48Å; F242-Q247 HydrophobicContact CD1-CB 3.95Å; F242-A248 HydrophobicContact CB-CB 4.01Å; F242-A248 HydrophobicContact CD2-CB 3.99Å; F242-A248 HydrophobicContact CG-CB 4.12Å; F242-A251 HydrophobicContact CE1-CB 4.12Å; F242-A251 HydrophobicContact CE2-CB 3.9Å; F242-A251 HydrophobicContact CZ-CB 3.47Å; F242-A251 VanDerWaalsContact CZ-CB 3.47Å
243	E	97.2	Very high	95.2	Very high	127 Å²	127	53 Å²	53	59%	0.593	29%	0.286	S	S	*	.	S	Bend	trans	-65.4	-37.4	174.9	-175.5	-176.5	-164.8	0	0	112	G224	G224-E243 PolarHBondContact O-N 3.23Å
244	N	96.9	Very high	95.5	Very high	57 Å²	57	52.7 Å²	52.7	31%	0.305	28%	0.277	S	S	.	.	S	Bend	trans	-147.5	166.5	177	59.7	64.3	0	0	0	113.1	F242 V246 Q247 A248	F242-N244 VanDerWaalsContact C-N 3.34Å; N244-V246 VanDerWaalsContact C-N 3.31Å; N244-V246 PolarHBondContact O-N 2.73Å; N244-V246 PolarHBondContact OD1-N 3.16Å; N244-Q247 PolarHBondContact ND2-NE2 2.94Å; N244-Q247 VanDerWaalsContact ND2-NE2 3.15Å; N244-Q247 PolarHBondContact ND2-OE1 3.47Å; N244-Q247 WeakPolarHBondContact OD1-CB 3.07Å; N244-Q247 VanDerWaalsContact OD1-CG 3.29Å; N244-Q247 WeakPolarHBondContact OD1-CG 3.43Å; N244-Q247 PolarHBondContact OD1-N 3.28Å; N244-A248 PolarHBondContact O-N 2.92Å; N244-A248 VanDerWaalsContact O-N 3.13Å
245	E	95.6	Very high	95.8	Very high	98 Å²	98	47 Å²	47	46%	0.458	26%	0.256	S	S	.	.	H	α-helix	trans	-67.9	-26.1	-177.5	63.8	-175.6	-168.3	0	0	114.1	P197 G249	P197-E245 HydrophobicContact CB-CB 4.16Å; P197-E245 HydrophobicContact CB-CG 4.38Å; E245-G249 PolarHBondContact O-N 2.87Å
246	V	96.9	Very high	96.2	Very high	112 Å²	112	46.1 Å²	46.1	68%	0.679	25%	0.252	S	S	*	.	H	α-helix	trans	-69.8	-46	179.3	-179.1	0	0	0	0	110.1	N244 G249 A250	N244-V246 VanDerWaalsContact C-N 3.31Å; N244-V246 PolarHBondContact O-N 2.73Å; N244-V246 PolarHBondContact OD1-N 3.16Å; V246-G249 PolarHBondContact O-N 3.23Å; V246-A250 PolarHBondContact O-N 3.27Å
247	Q	97.5	Very high	96.1	Very high	41 Å²	41	45 Å²	45	19%	0.192	26%	0.255	C	S	.	.	H	α-helix	trans	-65.4	-42.1	174.8	-70.4	162.7	-6.8	0	0	112	P223 F242 N244 G249 A250 A251	P223-Q247 WeakPolarHBondContact O-CB 3.48Å; P223-Q247 WeakPolarHBondContact O-CG 3.37Å; P223-Q247 PolarHBondContact O-OE1 2.86Å; F242-Q247 HydrophobicContact CB-CB 4.48Å; F242-Q247 HydrophobicContact CD1-CB 3.95Å; N244-Q247 PolarHBondContact ND2-NE2 2.94Å; N244-Q247 VanDerWaalsContact ND2-NE2 3.15Å; N244-Q247 PolarHBondContact ND2-OE1 3.47Å; N244-Q247 WeakPolarHBondContact OD1-CB 3.07Å; N244-Q247 VanDerWaalsContact OD1-CG 3.29Å; N244-Q247 WeakPolarHBondContact OD1-CG 3.43Å; N244-Q247 PolarHBondContact OD1-N 3.28Å; Q247-G249 VanDerWaalsContact C-N 3.32Å; Q247-G249 PolarHBondContact O-N 2.98Å; Q247-A250 PolarHBondContact O-N 2.78Å; Q247-A251 PolarHBondContact O-N 3.39Å
248	A	97.6	Very high	96	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59	-44	173.7	0	0	0	0	0	111.4	N198 L201 F242 N244 A251 R252 F270	N198-A248 VanDerWaalsContact O-CB 3.32Å; N198-A248 WeakPolarHBondContact O-CB 3.35Å; L201-A248 WeakPolarHBondContact CD1-O 3.43Å; L201-A248 HydrophobicContact CD2-CB 3.97Å; L201-A248 HydrophobicContact CG-CB 4.09Å; F242-A248 HydrophobicContact CB-CB 4.01Å; F242-A248 HydrophobicContact CD2-CB 3.99Å; F242-A248 HydrophobicContact CG-CB 4.12Å; N244-A248 PolarHBondContact O-N 2.92Å; N244-A248 VanDerWaalsContact O-N 3.13Å; A248-A251 PolarHBondContact O-N 2.75Å; A248-R252 WeakPolarHBondContact O-CB 3.45Å; A248-R252 PolarHBondContact O-N 2.75Å; A248-F270 HydrophobicContact CB-CE1 4.25Å
249	G	96.3	Very high	95.5	Very high	10 Å²	10	55.5 Å²	55.5	10%	0.103	30%	0.3	C	S	.	.	H	α-helix	trans	-59.9	-46.2	176.1	0	0	0	0	0	112.5	E245 V246 Q247 A251 R252 D253	E245-G249 PolarHBondContact O-N 2.87Å; V246-G249 PolarHBondContact O-N 3.23Å; Q247-G249 VanDerWaalsContact C-N 3.32Å; Q247-G249 PolarHBondContact O-N 2.98Å; G249-A251 PolarHBondContact O-N 3.16Å; G249-R252 WeakPolarHBondContact O-CB 3.17Å; G249-R252 PolarHBondContact O-N 3.12Å; G249-D253 VanDerWaalsContact O-CG 3.29Å; G249-D253 PolarHBondContact O-N 3.14Å
250	A	96.6	Very high	94.6	Very high	54 Å²	54	53.6 Å²	53.6	45%	0.446	29%	0.293	S	S	.	.	H	α-helix	trans	-60	-43.6	176.7	0	0	0	0	0	112.5	V246 Q247 A254	V246-A250 PolarHBondContact O-N 3.27Å; Q247-A250 PolarHBondContact O-N 2.78Å; A250-A254 VanDerWaalsContact O-CB 3.3Å; A250-A254 WeakPolarHBondContact O-CB 3.33Å; A250-A254 PolarHBondContact O-N 3.14Å; A250-A254 VanDerWaalsContact O-N 3.1Å
251	A	96.8	Very high	93.6	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.8	-41.6	176.8	0	0	0	0	0	112.2	L201 F219 F222 F242 Q247 A248 G249 L255	L201-A251 HydrophobicContact CD1-CB 4.23Å; F219-A251 HydrophobicContact CD1-CB 4.14Å; F219-A251 HydrophobicContact CE1-CB 4.33Å; F222-A251 HydrophobicContact CB-CB 3.92Å; F222-A251 HydrophobicContact CD1-CB 3.9Å; F222-A251 HydrophobicContact CD2-CB 3.83Å; F222-A251 HydrophobicContact CE1-CB 4.43Å; F222-A251 HydrophobicContact CE2-CB 4.38Å; F222-A251 HydrophobicContact CG-CB 3.58Å; F242-A251 HydrophobicContact CE1-CB 4.12Å; F242-A251 HydrophobicContact CE2-CB 3.9Å; F242-A251 HydrophobicContact CZ-CB 3.47Å; F242-A251 VanDerWaalsContact CZ-CB 3.47Å; Q247-A251 PolarHBondContact O-N 3.39Å; A248-A251 PolarHBondContact O-N 2.75Å; G249-A251 PolarHBondContact O-N 3.16Å; A251-L255 WeakPolarHBondContact O-CB 3.47Å; A251-L255 PolarHBondContact O-N 3.33Å
252	R	96.6	Very high	92.3	Very high	22 Å²	22	62.3 Å²	62.3	8%	0.083	34%	0.337	C	S	.	.	H	α-helix	trans	-56.3	-54.7	174.4	174.2	-162.6	170.5	-147.2	-5.1	110.5	E194 L201 A248 G249 A254 L255 Q256 I268	E194-R252 IonicContact OE1-CZ 3.2Å; E194-R252 VanDerWaalsContact OE1-CZ 3.25Å; E194-R252 IonicContact OE1-NH1 3.46Å; E194-R252 PolarHBondContact OE1-NH1 3.33Å; E194-R252 IonicContact OE1-NH2 3.78Å; E194-R252 PolarHBondContact OE1-NH2 2.86Å; L201-R252 HydrophobicContact CD1-CB 4.27Å; L201-R252 HydrophobicContact CD2-CB 3.96Å; A248-R252 WeakPolarHBondContact O-CB 3.45Å; A248-R252 PolarHBondContact O-N 2.75Å; G249-R252 WeakPolarHBondContact O-CB 3.17Å; G249-R252 PolarHBondContact O-N 3.12Å; R252-A254 VanDerWaalsContact C-N 3.31Å; R252-A254 PolarHBondContact O-N 2.82Å; R252-L255 PolarHBondContact O-N 2.99Å; R252-Q256 VanDerWaalsContact O-CB 3.3Å; R252-Q256 WeakPolarHBondContact O-CB 3.45Å; R252-Q256 PolarHBondContact O-N 3.04Å; R252-I268 HydrophobicContact CB-CG2 3.98Å; R252-I268 HydrophobicContact CG-CB 4.07Å; R252-I268 HydrophobicContact CG-CG2 3.83Å
253	D	94.6	Very high	91.4	Very high	112 Å²	112	68.1 Å²	68.1	60%	0.599	37%	0.372	S	S	*	.	H	α-helix	trans	-65.6	-37.4	-173.3	-65.3	-19.6	0	0	0	111.6	G249	G249-D253 VanDerWaalsContact O-CG 3.29Å; G249-D253 PolarHBondContact O-N 3.14Å
254	A	94	Very high	90.8	Very high	65 Å²	65	63.9 Å²	63.9	54%	0.537	35%	0.354	S	S	.	.	H	α-helix	trans	-73	-34.7	179.1	0	0	0	0	0	113.8	F222 A250 R252	F222-A254 HydrophobicContact CE1-CB 3.47Å; F222-A254 VanDerWaalsContact CE1-CB 3.47Å; F222-A254 HydrophobicContact CZ-CB 3.47Å; F222-A254 VanDerWaalsContact CZ-CB 3.47Å; A250-A254 VanDerWaalsContact O-CB 3.3Å; A250-A254 WeakPolarHBondContact O-CB 3.33Å; A250-A254 PolarHBondContact O-N 3.14Å; A250-A254 VanDerWaalsContact O-N 3.1Å; R252-A254 VanDerWaalsContact C-N 3.31Å; R252-A254 PolarHBondContact O-N 2.82Å
255	L	95.4	Very high	90.5	Very high	7 Å²	7	62.6 Å²	62.6	4%	0.037	35%	0.351	C	S	.	.	H	α-helix	trans	-101.9	3.1	-176.4	-64.7	177.6	0	0	0	113.6	L218 F219 F222 A251 R252 G257 F258 M266 I268	L218-L255 HydrophobicContact CD1-CD2 3.81Å; L218-L255 HydrophobicContact CD2-CD1 4.19Å; L218-L255 HydrophobicContact CD2-CD2 4.3Å; L218-L255 HydrophobicContact CG-CD1 3.83Å; L218-L255 HydrophobicContact CG-CD2 3.95Å; F219-L255 HydrophobicContact CD1-CD1 3.79Å; F219-L255 HydrophobicContact CD2-CD1 4.14Å; F219-L255 HydrophobicContact CE1-CD1 3.57Å; F219-L255 HydrophobicContact CE2-CD1 3.91Å; F219-L255 HydrophobicContact CG-CD1 4.09Å; F219-L255 HydrophobicContact CZ-CD1 3.63Å; F222-L255 HydrophobicContact CD2-CD1 4.18Å; F222-L255 HydrophobicContact CE2-CD1 3.49Å; F222-L255 VanDerWaalsContact CE2-CD1 3.49Å; F222-L255 HydrophobicContact CE2-CD2 4.05Å; F222-L255 HydrophobicContact CE2-CG 3.59Å; F222-L255 HydrophobicContact CZ-CD1 4.25Å; F222-L255 HydrophobicContact CZ-CD2 4.26Å; F222-L255 HydrophobicContact CZ-CG 3.85Å; A251-L255 WeakPolarHBondContact O-CB 3.47Å; A251-L255 PolarHBondContact O-N 3.33Å; R252-L255 PolarHBondContact O-N 2.99Å; L255-G257 PolarHBondContact O-N 3.18Å; L255-F258 HydrophobicContact CB-CB 4.44Å; L255-F258 HydrophobicContact CD2-CB 4.42Å; L255-F258 HydrophobicContact CD2-CD2 4.37Å; L255-F258 HydrophobicContact CD2-CG 4.32Å; L255-F258 WeakPolarHBondContact O-CB 3.46Å; L255-F258 PolarHBondContact O-N 3.13Å; L255-M266 HydrophobicContact CB-CE 4.02Å; L255-I268 HydrophobicContact CB-CD1 3.49Å; L255-I268 VanDerWaalsContact CB-CD1 3.49Å
256	Q	94.1	Very high	90.4	Very high	73 Å²	73	58 Å²	58	34%	0.341	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	123.6	179.7	-174.4	66.6	-14.2	0	0	110.8	R252 F258 I268	R252-Q256 VanDerWaalsContact O-CB 3.3Å; R252-Q256 WeakPolarHBondContact O-CB 3.45Å; R252-Q256 PolarHBondContact O-N 3.04Å; Q256-F258 PolarHBondContact O-N 3.42Å; Q256-I268 PolarHBondContact NE2-O 2.9Å; Q256-I268 VanDerWaalsContact OE1-CB 3.29Å; Q256-I268 PolarHBondContact OE1-O 3.37Å; Q256-I268 VanDerWaalsContact OE1-O 3.09Å
257	G	90.3	Very high	90.3	Very high	38 Å²	38	56.7 Å²	56.7	39%	0.392	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	8.5	-177.6	0	0	0	0	0	114	L255 K259 A265 M266	L255-G257 PolarHBondContact O-N 3.18Å; G257-K259 PolarHBondContact O-N 3.46Å; G257-A265 WeakPolarHBondContact O-CB 3.46Å; G257-M266 WeakPolarHBondContact CA-O 3.49Å; G257-M266 PolarHBondContact N-O 3.41Å
258	F	91.4	Very high	90.2	Very high	93 Å²	93	54.8 Å²	54.8	41%	0.408	31%	0.306	S	S	.	.			trans	-58.4	128.7	176.5	-177.9	-94.9	0	0	0	110.4	L218 L255 Q256 I260 M266	L218-F258 HydrophobicContact CD1-CD1 4.15Å; L218-F258 HydrophobicContact CD1-CE1 3.75Å; L218-F258 HydrophobicContact CD1-CE2 4.47Å; L218-F258 HydrophobicContact CD1-CZ 3.93Å; L218-F258 HydrophobicContact CD2-CD1 3.71Å; L218-F258 HydrophobicContact CD2-CE1 3.9Å; L255-F258 HydrophobicContact CB-CB 4.44Å; L255-F258 HydrophobicContact CD2-CB 4.42Å; L255-F258 HydrophobicContact CD2-CD2 4.37Å; L255-F258 HydrophobicContact CD2-CG 4.32Å; L255-F258 WeakPolarHBondContact O-CB 3.46Å; L255-F258 PolarHBondContact O-N 3.13Å; Q256-F258 PolarHBondContact O-N 3.42Å; F258-I260 HydrophobicContact CD1-CG1 4.2Å; F258-I260 PolarHBondContact O-N 2.88Å; F258-M266 HydrophobicContact CB-CE 3.81Å; F258-M266 HydrophobicContact CD1-CE 4.14Å; F258-M266 HydrophobicContact CG-CE 4.39Å; F258-M266 WeakPolarHBondContact O-CB 3.37Å; F258-M266 PolarHBondContact O-N 2.94Å
259	K	86.2	Confident	90.1	Very high	137 Å²	137	55.6 Å²	55.6	60%	0.596	31%	0.312	S	S	*	.	B	Isolated β-bridge	trans	-85.4	99.2	-177.5	-71.1	-172.2	179.9	-171.9	0	110.2	G257 T261 N264 A265	G257-K259 PolarHBondContact O-N 3.46Å; K259-T261 VanDerWaalsContact C-N 3.31Å; K259-T261 WeakPolarHBondContact CB-O 3.47Å; K259-N264 WeakPolarHBondContact CA-O 3.46Å; K259-A265 HydrophobicContact CG-CB 4.11Å
260	I	79.6	Confident	90.2	Very high	32 Å²	32	55.8 Å²	55.8	16%	0.164	31%	0.31	C	S	.	.	S	Bend	trans	-65.9	-40.1	176.4	-61.7	177.6	0	0	0	110	L206 P207 M214 L215 F258 N264 M266	L206-I260 HydrophobicContact CD2-CD1 3.44Å; L206-I260 VanDerWaalsContact CD2-CD1 3.44Å; P207-I260 HydrophobicContact CG-CB 4.23Å; P207-I260 HydrophobicContact CG-CG2 3.96Å; M214-I260 HydrophobicContact CE-CG2 3.82Å; L215-I260 HydrophobicContact CD2-CD1 4.03Å; F258-I260 HydrophobicContact CD1-CG1 4.2Å; F258-I260 PolarHBondContact O-N 2.88Å; I260-N264 PolarHBondContact N-O 3.23Å; I260-N264 VanDerWaalsContact N-O 3.11Å; I260-M266 HydrophobicContact CD1-CB 4.01Å; I260-M266 HydrophobicContact CD1-SD 4.27Å; I260-M266 HydrophobicContact CG1-CB 4.28Å
261	T	76	Confident	90.1	Very high	45 Å²	45	53.6 Å²	53.6	28%	0.276	29%	0.292	S	S	.	.	S	Bend	trans	-123.3	167.3	168.3	61.2	0	0	0	0	109.1	P207 K259 T263 N264	P207-T261 HydrophobicContact CB-CG2 4.14Å; P207-T261 HydrophobicContact CG-CG2 3.73Å; K259-T261 VanDerWaalsContact C-N 3.31Å; K259-T261 WeakPolarHBondContact CB-O 3.47Å; T261-T263 PolarHBondContact O-N 3.45Å; T261-T263 PolarHBondContact OG1-OG1 3.21Å; T261-N264 PolarHBondContact O-N 3Å; T261-N264 WeakPolarHBondContact OG1-CB 3.5Å; T261-N264 PolarHBondContact OG1-N 2.94Å; T261-N264 PolarHBondContact OG1-OD1 3.09Å
262	Q	71.6	Confident	89.8	Confident	186 Å²	186	61.4 Å²	61.4	87%	0.869	33%	0.326	S	S	*	.	S	Bend	trans	-55.2	-24.5	-179.6	-66.9	179.2	-6.4	0	0	113.4
263	T	78.6	Confident	88.7	Confident	121 Å²	121	71.4 Å²	71.4	74%	0.742	37%	0.37	S	S	*	.	S	Bend	trans	-104.5	-24.4	-175.9	50.5	0	0	0	0	114.4	T261	T261-T263 PolarHBondContact O-N 3.45Å; T261-T263 PolarHBondContact OG1-OG1 3.21Å
264	N	84.3	Confident	88.4	Confident	38 Å²	38	69.4 Å²	69.4	20%	0.203	36%	0.359	C	S	.	.			trans	-113.2	105.2	-170.1	-64.1	68.3	0	0	0	111.6	P207 K259 I260 T261	P207-N264 HydrophobicContact CB-CB 4.36Å; P207-N264 HydrophobicContact CG-CB 4.09Å; K259-N264 WeakPolarHBondContact CA-O 3.46Å; I260-N264 PolarHBondContact N-O 3.23Å; I260-N264 VanDerWaalsContact N-O 3.11Å; T261-N264 PolarHBondContact O-N 3Å; T261-N264 WeakPolarHBondContact OG1-CB 3.5Å; T261-N264 PolarHBondContact OG1-N 2.94Å; T261-N264 PolarHBondContact OG1-OD1 3.09Å
265	A	89.9	Confident	88.1	Confident	31 Å²	31	69.6 Å²	69.6	26%	0.256	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-86.2	113.3	169.2	0	0	0	0	0	110	N205 G257 K259	N205-A265 PolarHBondContact ND2-O 3.14Å; G257-A265 WeakPolarHBondContact O-CB 3.46Å; K259-A265 HydrophobicContact CG-CB 4.11Å
266	M	93.8	Very high	87.7	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	37%	0.367	C	S	.	.			trans	-60.5	138.3	176.6	154.8	175.2	59.9	0	0	110.7	L203 L206 L218 F219 L255 G257 F258 I260 I268	L203-M266 HydrophobicContact CD2-SD 3.6Å; L203-M266 HydrophobicContact CG-CG 4.48Å; L203-M266 HydrophobicContact CG-SD 3.91Å; L206-M266 HydrophobicContact CD2-CB 4.27Å; L206-M266 HydrophobicContact CD2-CG 4.29Å; L206-M266 HydrophobicContact CD2-SD 4.29Å; L218-M266 HydrophobicContact CD2-CE 3.49Å; L218-M266 VanDerWaalsContact CD2-CE 3.49Å; F219-M266 HydrophobicContact CE2-CE 4.41Å; F219-M266 HydrophobicContact CE2-SD 4.08Å; F219-M266 HydrophobicContact CZ-CE 4.44Å; F219-M266 HydrophobicContact CZ-SD 4.09Å; L255-M266 HydrophobicContact CB-CE 4.02Å; G257-M266 WeakPolarHBondContact CA-O 3.49Å; G257-M266 PolarHBondContact N-O 3.41Å; F258-M266 HydrophobicContact CB-CE 3.81Å; F258-M266 HydrophobicContact CD1-CE 4.14Å; F258-M266 HydrophobicContact CG-CE 4.39Å; F258-M266 WeakPolarHBondContact O-CB 3.37Å; F258-M266 PolarHBondContact O-N 2.94Å; I260-M266 HydrophobicContact CD1-CB 4.01Å; I260-M266 HydrophobicContact CD1-SD 4.27Å; I260-M266 HydrophobicContact CG1-CB 4.28Å; M266-I268 HydrophobicContact CE-CD1 4.08Å; M266-I268 HydrophobicContact CG-CD1 4.24Å; M266-I268 HydrophobicContact CG-CG1 3.72Å; M266-I268 HydrophobicContact SD-CD1 3.99Å; M266-I268 HydrophobicContact SD-CG1 3.99Å
267	K	95.1	Very high	87.4	Confident	85 Å²	85	73.1 Å²	73.1	37%	0.37	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.6	172.7	-68.1	-177.6	179.5	-173.3	0	109.4	L203 T204	L203-K267 CarbonylContact C-O 3.6Å; L203-K267 WeakPolarHBondContact CA-O 3.29Å; T204-K267 PolarHBondContact N-O 3.4Å; T204-K267 PolarHBondContact O-N 3.31Å; T204-K267 WeakPolarHBondContact OG1-CB 3.24Å; T204-K267 PolarHBondContact OG1-O 3.43Å
268	I	96.1	Very high	87.2	Confident	1 Å²	1	75.3 Å²	75.3	1%	0.005	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.3	-176.9	-46.3	177.2	0	0	0	109.2	L201 F202 L203 F219 R252 L255 Q256 M266	L201-I268 HydrophobicContact CB-CG2 3.95Å; L201-I268 HydrophobicContact CD1-CG2 3.97Å; L201-I268 HydrophobicContact CD2-CG2 4.19Å; L201-I268 HydrophobicContact CG-CG2 4.27Å; F202-I268 WeakPolarHBondContact O-CA 3.23Å; L203-I268 HydrophobicContact CD1-CG2 4.32Å; L203-I268 HydrophobicContact CG-CG1 4.45Å; F219-I268 HydrophobicContact CE1-CD1 4.28Å; F219-I268 HydrophobicContact CZ-CD1 3.86Å; R252-I268 HydrophobicContact CB-CG2 3.98Å; R252-I268 HydrophobicContact CG-CB 4.07Å; R252-I268 HydrophobicContact CG-CG2 3.83Å; L255-I268 HydrophobicContact CB-CD1 3.49Å; L255-I268 VanDerWaalsContact CB-CD1 3.49Å; Q256-I268 PolarHBondContact NE2-O 2.9Å; Q256-I268 VanDerWaalsContact OE1-CB 3.29Å; Q256-I268 PolarHBondContact OE1-O 3.37Å; Q256-I268 VanDerWaalsContact OE1-O 3.09Å; M266-I268 HydrophobicContact CE-CD1 4.08Å; M266-I268 HydrophobicContact CG-CD1 4.24Å; M266-I268 HydrophobicContact CG-CG1 3.72Å; M266-I268 HydrophobicContact SD-CD1 3.99Å; M266-I268 HydrophobicContact SD-CG1 3.99Å
269	S	96	Very high	86.9	Confident	18 Å²	18	74.1 Å²	74.1	13%	0.126	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	165.2	167.9	61.8	0	0	0	0	110.1	L201 F202	L201-S269 CarbonylContact C-O 3.45Å; L201-S269 WeakPolarHBondContact CA-O 3.12Å; F202-S269 PolarHBondContact N-O 3.26Å; F202-S269 PolarHBondContact O-N 3.32Å
270	F	97.1	Very high	86.9	Confident	13 Å²	13	69.6 Å²	69.6	6%	0.057	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	141.4	168.4	-67.9	-66.3	0	0	0	110.1	N195 P196 P197 N198 L201 A248	N195-F270 HydrophobicContact CB-CB 4.08Å; N195-F270 WeakPolarHBondContact CB-O 3.48Å; N195-F270 PolarHBondContact ND2-O 3.48Å; N195-F270 WeakPolarHBondContact O-CD2 3.25Å; P196-F270 WeakPolarHBondContact O-CB 3.38Å; P197-F270 HydrophobicContact CB-CE2 4.43Å; P197-F270 HydrophobicContact CB-CZ 4.35Å; P197-F270 HydrophobicContact CG-CE2 4.48Å; N198-F270 HydrophobicContact CB-CB 4.05Å; N198-F270 HydrophobicContact CB-CD1 4.16Å; N198-F270 HydrophobicContact CB-CG 4.45Å; N198-F270 VanDerWaalsContact N-CD1 3.26Å; N198-F270 WeakPolarHBondContact O-CD1 3.43Å; N198-F270 VanDerWaalsContact O-CE1 3.32Å; N198-F270 WeakPolarHBondContact O-CE1 3.45Å; L201-F270 HydrophobicContact CD2-CD1 3.73Å; L201-F270 HydrophobicContact CD2-CE1 3.9Å; A248-F270 HydrophobicContact CB-CE1 4.25Å
271	A	94.3	Very high	87.5	Confident	8 Å²	8	72.5 Å²	72.5	7%	0.066	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-66.1	145.5	172.8	0	0	0	0	0	110	N198 I200 F202 F239	N198-A271 PolarHBondContact ND2-O 3.44Å; I200-A271 HydrophobicContact CB-CB 3.85Å; I200-A271 HydrophobicContact CG2-CB 3.69Å; I200-A271 WeakPolarHBondContact O-CB 3.12Å; I200-A271 PolarHBondContact O-N 3.39Å; F202-A271 HydrophobicContact CB-CB 4.46Å; F239-A271 HydrophobicContact CD1-CB 4.23Å; F239-A271 HydrophobicContact CE1-CB 4.22Å
272	K	90.8	Very high	88.5	Confident	165 Å²	165	74.8 Å²	74.8	72%	0.717	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-64.4	138.6	172.2	-64.5	-176.9	178.9	-176.9	0	109
273	K	74.1	Confident	90	Very high	232 Å²	232	64.7 Å²	64.7	100%	1.009	32%	0.323	S	S	*	.			trans	-65.7	0	169.5	-74.9	-174.2	178.4	179.7	0	110.6

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