A0AA82N1R2_SCHMA Loading...

NADPH:quinone reductase AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N1R2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 424 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	95.9	Very high	92.8	Very high	25 Å²	25	22.5 Å²	22.5	12%	0.123	10%	0.103	C	C	.	.				0	152	0	64.7	179.2	-66.3	0	0	110.6	L3 G36 I37 S39 V54 V56 R66 L67 L69	M1-L3 HydrophobicContact CE-CD2 3.91Å; M1-L3 HydrophobicContact SD-CD2 4.38Å; M1-G36 VanDerWaalsContact CE-CA 3.48Å; M1-I37 WeakPolarHBondContact CA-O 3.44Å; M1-I37 WeakPolarHBondContact CB-O 3.36Å; M1-S39 WeakPolarHBondContact CA-OG 3.33Å; M1-V54 HydrophobicContact CE-CG2 3.43Å; M1-V54 VanDerWaalsContact CE-CG2 3.43Å; M1-V54 HydrophobicContact SD-CG2 4.07Å; M1-V56 HydrophobicContact CE-CG2 4.15Å; M1-V56 HydrophobicContact SD-CG2 3.75Å; M1-R66 WeakPolarHBondContact O-CA 3.36Å; M1-L67 HydrophobicContact CG-CB 3.95Å; M1-L67 WeakPolarHBondContact CG-O 3.35Å; M1-L67 PolarHBondContact N-O 3.16Å; M1-L67 PolarHBondContact O-N 3.49Å; M1-L67 VanDerWaalsContact O-N 3.1Å; M1-L67 HydrophobicContact SD-CB 4.44Å; M1-L67 HydrophobicContact SD-CD2 4.27Å; M1-L69 HydrophobicContact SD-CD1 4.3Å
2	K	97.6	Very high	92.4	Very high	124 Å²	124	20.7 Å²	20.7	54%	0.539	10%	0.095	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.8	172.3	-175.1	176.5	-178.2	177	0	109.4	G36 I37	K2-G36 CarbonylContact O-C 3.52Å; K2-G36 VanDerWaalsContact O-CA 3.23Å; K2-G36 WeakPolarHBondContact O-CA 3.32Å; K2-I37 PolarHBondContact N-O 2.63Å; K2-I37 PolarHBondContact O-N 3.16Å
3	L	97.7	Very high	91.9	Very high	8 Å²	8	19.1 Å²	19.1	4%	0.042	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	136.8	-178.7	-65.6	172.8	0	0	0	109.9	M1 C34 A62 S64 E65 L67 P395	M1-L3 HydrophobicContact CE-CD2 3.91Å; M1-L3 HydrophobicContact SD-CD2 4.38Å; L3-C34 HydrophobicContact CD2-CB 3.8Å; L3-C34 WeakPolarHBondContact CD2-SG 3.27Å; L3-A62 VanDerWaalsContact CD1-O 3.25Å; L3-A62 WeakPolarHBondContact CD1-O 3.22Å; L3-S64 WeakPolarHBondContact CD1-O 3.47Å; L3-S64 WeakPolarHBondContact CD1-OG 3.26Å; L3-E65 PolarHBondContact N-O 3.12Å; L3-L67 HydrophobicContact CD1-CB 4.04Å; L3-L67 HydrophobicContact CD2-CB 4.23Å; L3-L67 HydrophobicContact CD2-CD2 4.41Å; L3-L67 HydrophobicContact CG-CB 4.22Å; L3-P395 HydrophobicContact CB-CB 4.24Å; L3-P395 HydrophobicContact CB-CG 4.03Å; L3-P395 WeakPolarHBondContact O-CG 3.14Å
4	Q	97.7	Very high	91.1	Very high	71 Å²	71	17.9 Å²	17.9	33%	0.332	8%	0.082	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-49	174.2	-70.6	-173.4	-76.2	0	0	110.5	T35 I37 V113 P395	Q4-T35 PolarHBondContact N-O 2.95Å; Q4-I37 HydrophobicContact CG-CG1 4.32Å; Q4-V113 HydrophobicContact CB-CG1 3.69Å; Q4-V113 HydrophobicContact CG-CG1 4.47Å; Q4-P395 WeakPolarHBondContact O-CD 3.49Å
5	L	98	Very high	90.6	Very high	12 Å²	12	17.1 Å²	17.1	6%	0.063	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	154.3	-179.3	-71.1	178.5	0	0	0	110.1	T35 V113 N114 A117 V392 L393 I394	L5-T35 HydrophobicContact CB-CG2 4.18Å; L5-T35 PolarHBondContact N-O 2.99Å; L5-T35 PolarHBondContact O-N 2.99Å; L5-V113 HydrophobicContact CB-CG1 4.45Å; L5-V113 HydrophobicContact CD1-CB 4.32Å; L5-V113 HydrophobicContact CD1-CG1 3.86Å; L5-V113 HydrophobicContact CG-CG1 4.11Å; L5-N114 HydrophobicContact CD1-CB 4.14Å; L5-N114 WeakPolarHBondContact CD1-OD1 3.45Å; L5-A117 HydrophobicContact CB-CB 3.59Å; L5-V392 HydrophobicContact CB-CG1 3.72Å; L5-V392 HydrophobicContact CD1-CG1 4.05Å; L5-V392 HydrophobicContact CD2-CG1 3.83Å; L5-V392 HydrophobicContact CG-CG1 4.06Å; L5-L393 WeakPolarHBondContact CA-O 3.27Å; L5-I394 HydrophobicContact CD2-CB 4.38Å; L5-I394 HydrophobicContact CD2-CG1 3.81Å
6	I	97.4	Very high	90.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	131.9	-174.9	-60.3	151.2	0	0	0	109.3	E33 C34 A62 W63 V392 L393 P395	I6-E33 WeakPolarHBondContact CG2-O 3.4Å; I6-C34 HydrophobicContact CB-CB 4.41Å; I6-C34 HydrophobicContact CG1-CB 4.06Å; I6-A62 WeakPolarHBondContact CD1-O 3.49Å; I6-A62 VanDerWaalsContact CG1-O 3.25Å; I6-A62 WeakPolarHBondContact CG1-O 3.41Å; I6-A62 HydrophobicContact CG2-CB 4.19Å; I6-W63 VanDerWaalsContact CG2-CD1 3.46Å; I6-V392 CarbonylContact O-C 3.58Å; I6-V392 VanDerWaalsContact O-CA 3.3Å; I6-V392 WeakPolarHBondContact O-CA 3.16Å; I6-V392 WeakPolarHBondContact O-CG1 2.93Å; I6-L393 HydrophobicContact CB-CB 4.16Å; I6-L393 HydrophobicContact CD1-CB 4.42Å; I6-L393 PolarHBondContact N-O 3.37Å; I6-L393 PolarHBondContact O-N 3.32Å; I6-P395 HydrophobicContact CD1-CB 3.77Å
7	G	94.8	Very high	89.9	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	133.5	174.4	0	0	0	0	0	111.5	E33 A117	G7-E33 PolarHBondContact N-O 2.97Å; G7-E33 VanDerWaalsContact N-O 3.11Å; G7-A117 VanDerWaalsContact CA-O 3.27Å; G7-A117 WeakPolarHBondContact CA-O 3.21Å; G7-A117 PolarHBondContact N-O 3.46Å
8	I	92.2	Very high	89.3	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	126	171.3	-54.5	-177.3	0	0	0	109.6	W63 A378 L382 V391 L393	I8-W63 HydrophobicContact CD1-CZ2 4.42Å; I8-W63 HydrophobicContact CG1-CZ2 4.08Å; I8-W63 HydrophobicContact CG2-CZ2 4.13Å; I8-A378 HydrophobicContact CD1-CB 3.4Å; I8-L382 HydrophobicContact CB-CD1 4.35Å; I8-L382 HydrophobicContact CG2-CD1 3.9Å; I8-L382 HydrophobicContact CG2-CD2 4Å; I8-V391 HydrophobicContact CB-CB 4.38Å; I8-V391 HydrophobicContact CD1-CB 4.27Å; I8-V391 HydrophobicContact CD1-CG1 3.78Å; I8-V391 HydrophobicContact CG1-CG1 4.49Å; I8-V391 PolarHBondContact N-O 2.95Å; I8-L393 HydrophobicContact CD1-CD1 3.96Å; I8-L393 HydrophobicContact CD1-CD2 3.59Å; I8-L393 HydrophobicContact CD1-CG 3.51Å; I8-L393 HydrophobicContact CG1-CD1 3.9Å; I8-L393 HydrophobicContact CG1-CD2 4.28Å; I8-L393 HydrophobicContact CG1-CG 3.63Å
9	N	86.8	Confident	88.5	Confident	3 Å²	3	22.5 Å²	22.5	2%	0.016	11%	0.111	C	C	.	.			trans	-111	152.4	176.9	-69.8	-78.3	0	0	0	111.5	L11 D12 E33 F121 K390	N9-L11 HydrophobicContact CB-CB 4.01Å; N9-L11 PolarHBondContact O-N 3.12Å; N9-D12 WeakPolarHBondContact CA-OD2 3.4Å; N9-D12 WeakPolarHBondContact CB-OD2 3.05Å; N9-D12 PolarHBondContact N-OD2 3.27Å; N9-D12 WeakPolarHBondContact O-CB 3.46Å; N9-D12 PolarHBondContact O-N 2.66Å; N9-E33 WeakPolarHBondContact ND2-CG 3.15Å; N9-E33 PolarHBondContact ND2-OE1 2.79Å; N9-E33 PolarHBondContact OD1-OE1 3.13Å; N9-F121 WeakPolarHBondContact OD1-CB 3.12Å; N9-K390 PolarHBondContact OD1-NZ 3.25Å
10	F	80	Confident	87.6	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.4	-28.8	168.5	-155	-113.3	0	0	0	112	D12 I13 M14 V152 V291	F10-D12 VanDerWaalsContact C-N 3.25Å; F10-D12 PolarHBondContact O-N 2.77Å; F10-I13 HydrophobicContact CD2-CD1 4Å; F10-I13 HydrophobicContact CE2-CD1 4.29Å; F10-I13 WeakPolarHBondContact O-CB 3.43Å; F10-I13 PolarHBondContact O-N 3.39Å; F10-I13 VanDerWaalsContact O-N 3.14Å; F10-M14 HydrophobicContact CB-CE 4.35Å; F10-M14 HydrophobicContact CD1-CE 3.59Å; F10-M14 HydrophobicContact CD1-CG 4.05Å; F10-M14 HydrophobicContact CD1-SD 3.85Å; F10-M14 HydrophobicContact CE1-CE 4.41Å; F10-M14 HydrophobicContact CE1-CG 4.12Å; F10-M14 HydrophobicContact CE1-SD 4.09Å; F10-M14 HydrophobicContact CG-CE 4.36Å; F10-M14 WeakPolarHBondContact O-CE 3.41Å; F10-M14 PolarHBondContact O-N 3.16Å; F10-V152 HydrophobicContact CB-CG1 4.3Å; F10-V152 HydrophobicContact CB-CG2 3.8Å; F10-V152 HydrophobicContact CD1-CG1 3.95Å; F10-V152 HydrophobicContact CD1-CG2 4.08Å; F10-V152 HydrophobicContact CG-CG2 4.11Å; F10-V291 HydrophobicContact CD1-CG2 4.44Å; F10-V291 HydrophobicContact CE1-CB 3.75Å; F10-V291 HydrophobicContact CE1-CG1 4.38Å; F10-V291 HydrophobicContact CE1-CG2 3.42Å; F10-V291 VanDerWaalsContact CE1-CG2 3.42Å; F10-V291 HydrophobicContact CE2-CB 4.38Å; F10-V291 HydrophobicContact CE2-CG1 4.15Å; F10-V291 HydrophobicContact CZ-CB 3.36Å; F10-V291 HydrophobicContact CZ-CG1 3.57Å; F10-V291 HydrophobicContact CZ-CG2 3.49Å; F10-V291 VanDerWaalsContact CZ-CG2 3.49Å
11	L	83.2	Confident	86.7	Confident	3 Å²	3	28 Å²	28	2%	0.016	14%	0.141	C	C	.	.	H	α-helix	trans	-53.3	-40.8	169.9	174.6	58.1	0	0	0	112.4	N9 I13 M14 T15 I20 S32 F121 K329	N9-L11 HydrophobicContact CB-CB 4.01Å; N9-L11 PolarHBondContact O-N 3.12Å; L11-I13 VanDerWaalsContact C-N 3.32Å; L11-I13 PolarHBondContact O-N 3.35Å; L11-M14 PolarHBondContact O-N 3.27Å; L11-T15 VanDerWaalsContact O-CB 3.24Å; L11-T15 WeakPolarHBondContact O-CB 3.35Å; L11-T15 PolarHBondContact O-N 2.91Å; L11-T15 PolarHBondContact O-OG1 2.86Å; L11-I20 HydrophobicContact CD1-CD1 3.32Å; L11-I20 HydrophobicContact CD1-CG2 4.44Å; L11-S32 WeakPolarHBondContact CD2-OG 3.3Å; L11-F121 HydrophobicContact CD2-CE1 3.75Å; L11-F121 HydrophobicContact CD2-CZ 4.33Å; L11-K329 HydrophobicContact CD1-CD 3.88Å; L11-K329 HydrophobicContact CD1-CG 4.46Å; L11-K329 HydrophobicContact CD2-CB 4.29Å; L11-K329 HydrophobicContact CD2-CD 4.4Å; L11-K329 HydrophobicContact CD2-CG 4.12Å
12	D	87.7	Confident	85.5	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-66.9	-37.5	179.3	-54.7	-50.3	0	0	0	110.7	N9 F10 T15 R16 G31 S32 W63	N9-D12 WeakPolarHBondContact CA-OD2 3.4Å; N9-D12 WeakPolarHBondContact CB-OD2 3.05Å; N9-D12 PolarHBondContact N-OD2 3.27Å; N9-D12 WeakPolarHBondContact O-CB 3.46Å; N9-D12 PolarHBondContact O-N 2.66Å; F10-D12 VanDerWaalsContact C-N 3.25Å; F10-D12 PolarHBondContact O-N 2.77Å; D12-T15 PolarHBondContact O-N 3.49Å; D12-R16 WeakPolarHBondContact O-CB 3.16Å; D12-R16 PolarHBondContact O-N 2.71Å; D12-G31 VanDerWaalsContact OD1-CA 3.28Å; D12-G31 WeakPolarHBondContact OD1-CA 3.06Å; D12-G31 PolarHBondContact OD1-N 3.19Å; D12-S32 PolarHBondContact OD1-N 3.03Å; D12-S32 VanDerWaalsContact OD1-N 3.15Å; D12-S32 PolarHBondContact OD1-OG 2.85Å; D12-W63 HydrophobicContact CB-CZ2 4.21Å
13	I	85.6	Confident	84.2	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.1	-47.1	176.8	-56	178.8	0	0	0	110.6	F10 L11 T15 R16 Q17 V291 M379 L382 Q383	F10-I13 HydrophobicContact CD2-CD1 4Å; F10-I13 HydrophobicContact CE2-CD1 4.29Å; F10-I13 WeakPolarHBondContact O-CB 3.43Å; F10-I13 PolarHBondContact O-N 3.39Å; F10-I13 VanDerWaalsContact O-N 3.14Å; L11-I13 VanDerWaalsContact C-N 3.32Å; L11-I13 PolarHBondContact O-N 3.35Å; I13-T15 VanDerWaalsContact C-N 3.27Å; I13-T15 PolarHBondContact O-N 3.08Å; I13-R16 PolarHBondContact O-N 3.37Å; I13-Q17 WeakPolarHBondContact O-CB 3.15Å; I13-Q17 WeakPolarHBondContact O-CG 3.19Å; I13-Q17 PolarHBondContact O-N 3.03Å; I13-V291 HydrophobicContact CG2-CG1 4.39Å; I13-M379 HydrophobicContact CD1-CB 4.39Å; I13-M379 HydrophobicContact CG1-CB 4.48Å; I13-M379 HydrophobicContact CG1-CG 4.15Å; I13-M379 HydrophobicContact CG1-SD 4.19Å; I13-L382 HydrophobicContact CD1-CB 3.75Å; I13-L382 HydrophobicContact CD1-CD2 4.17Å; I13-Q383 HydrophobicContact CD1-CG 3.92Å; I13-Q383 HydrophobicContact CG2-CG 4.07Å
14	M	80.4	Confident	83.2	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-63.3	-35.7	176.6	-73	-178.3	-69	0	0	111.9	F10 L11 Q17 G18 L19 I20 V152 S154 V291	F10-M14 HydrophobicContact CB-CE 4.35Å; F10-M14 HydrophobicContact CD1-CE 3.59Å; F10-M14 HydrophobicContact CD1-CG 4.05Å; F10-M14 HydrophobicContact CD1-SD 3.85Å; F10-M14 HydrophobicContact CE1-CE 4.41Å; F10-M14 HydrophobicContact CE1-CG 4.12Å; F10-M14 HydrophobicContact CE1-SD 4.09Å; F10-M14 HydrophobicContact CG-CE 4.36Å; F10-M14 WeakPolarHBondContact O-CE 3.41Å; F10-M14 PolarHBondContact O-N 3.16Å; L11-M14 PolarHBondContact O-N 3.27Å; M14-Q17 CarbonylContact O-C 3.6Å; M14-Q17 PolarHBondContact O-N 2.78Å; M14-G18 PolarHBondContact O-N 2.89Å; M14-G18 VanDerWaalsContact O-N 3.07Å; M14-L19 HydrophobicContact CB-CB 4.35Å; M14-L19 HydrophobicContact CG-CD1 4.46Å; M14-L19 PolarHBondContact O-N 2.79Å; M14-I20 HydrophobicContact CB-CD1 3.35Å; M14-I20 HydrophobicContact CB-CG1 3.87Å; M14-I20 HydrophobicContact CE-CD1 3.82Å; M14-I20 HydrophobicContact CG-CD1 4.26Å; M14-I20 HydrophobicContact SD-CD1 4.02Å; M14-V152 HydrophobicContact CE-CG1 3.77Å; M14-S154 WeakPolarHBondContact CE-OG 3.41Å; M14-S154 PolarHBondContact SD-OG 2.81Å; M14-S154 VanDerWaalsContact SD-OG 3.34Å; M14-V291 HydrophobicContact CG-CG2 3.47Å; M14-V291 VanDerWaalsContact CG-CG2 3.47Å; M14-V291 HydrophobicContact SD-CG2 4.36Å
15	T	84.5	Confident	82.4	Confident	7 Å²	7	35 Å²	35	4%	0.043	19%	0.188	C	C	.	.	H	α-helix	trans	-66.5	-48.5	173.9	-64.7	0	0	0	0	111.3	L11 D12 I13 Q17 G18 Q22 F28 L30	L11-T15 VanDerWaalsContact O-CB 3.24Å; L11-T15 WeakPolarHBondContact O-CB 3.35Å; L11-T15 PolarHBondContact O-N 2.91Å; L11-T15 PolarHBondContact O-OG1 2.86Å; D12-T15 PolarHBondContact O-N 3.49Å; I13-T15 VanDerWaalsContact C-N 3.27Å; I13-T15 PolarHBondContact O-N 3.08Å; T15-Q17 PolarHBondContact O-N 2.91Å; T15-G18 PolarHBondContact O-N 2.94Å; T15-Q22 HydrophobicContact CG2-CG 3.84Å; T15-Q22 PolarHBondContact OG1-NE2 2.77Å; T15-F28 HydrophobicContact CG2-CE2 3.74Å; T15-F28 HydrophobicContact CG2-CZ 3.78Å; T15-L30 HydrophobicContact CG2-CD2 3.78Å
16	R	87	Confident	81.8	Confident	104 Å²	104	39.5 Å²	39.5	39%	0.392	22%	0.218	S	C	.	.	H	α-helix	trans	-55.8	-42.4	173.3	-178.1	-173.3	63.8	79.5	-9.1	111.6	D12 I13 G18 L30 M379	D12-R16 WeakPolarHBondContact O-CB 3.16Å; D12-R16 PolarHBondContact O-N 2.71Å; I13-R16 PolarHBondContact O-N 3.37Å; R16-G18 PolarHBondContact O-N 2.89Å; R16-L30 HydrophobicContact CB-CD1 4Å; R16-L30 HydrophobicContact CG-CD1 4.39Å; R16-M379 HydrophobicContact CB-CE 4.33Å; R16-M379 VanDerWaalsContact CD-SD 3.57Å; R16-M379 PolarHBondContact NE-SD 2.71Å
17	Q	82.1	Confident	81.5	Confident	12 Å²	12	45.7 Å²	45.7	6%	0.056	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-2.4	177.5	-70.6	-174.8	-7.5	0	0	112.9	I13 M14 T15 L19 G293 D294 K296	I13-Q17 WeakPolarHBondContact O-CB 3.15Å; I13-Q17 WeakPolarHBondContact O-CG 3.19Å; I13-Q17 PolarHBondContact O-N 3.03Å; M14-Q17 CarbonylContact O-C 3.6Å; M14-Q17 PolarHBondContact O-N 2.78Å; T15-Q17 PolarHBondContact O-N 2.91Å; Q17-L19 HydrophobicContact CB-CD1 4.17Å; Q17-L19 HydrophobicContact CB-CG 4.04Å; Q17-L19 PolarHBondContact O-N 3.28Å; Q17-G293 PolarHBondContact NE2-O 3.33Å; Q17-D294 PolarHBondContact NE2-O 2.77Å; Q17-K296 WeakPolarHBondContact O-CE 3.44Å; Q17-K296 VanDerWaalsContact O-CG 3.27Å; Q17-K296 WeakPolarHBondContact O-CG 3.43Å
18	G	79.3	Confident	81.2	Confident	38 Å²	38	48.1 Å²	48.1	39%	0.392	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	31.8	-179.5	0	0	0	0	0	113.9	M14 T15 R16 K296	M14-G18 PolarHBondContact O-N 2.89Å; M14-G18 VanDerWaalsContact O-N 3.07Å; T15-G18 PolarHBondContact O-N 2.94Å; R16-G18 PolarHBondContact O-N 2.89Å; G18-K296 VanDerWaalsContact O-CE 3.29Å; G18-K296 WeakPolarHBondContact O-CE 3.04Å; G18-K296 PolarHBondContact O-NZ 2.89Å
19	L	73.7	Confident	81.2	Confident	16 Å²	16	51.4 Å²	51.4	8%	0.084	29%	0.289	C	S	.	.			trans	-88.7	-12	173.8	-65.3	176.2	0	0	0	111.9	M14 Q17 L290 V291 K296	M14-L19 HydrophobicContact CB-CB 4.35Å; M14-L19 HydrophobicContact CG-CD1 4.46Å; M14-L19 PolarHBondContact O-N 2.79Å; Q17-L19 HydrophobicContact CB-CD1 4.17Å; Q17-L19 HydrophobicContact CB-CG 4.04Å; Q17-L19 PolarHBondContact O-N 3.28Å; L19-L290 HydrophobicContact CD1-CB 4.37Å; L19-V291 HydrophobicContact CD1-CG2 3.76Å; L19-K296 HydrophobicContact CD2-CG 4.34Å
20	I	71	Confident	81.5	Confident	21 Å²	21	52.5 Å²	52.5	11%	0.108	30%	0.295	C	S	.	.	S	Bend	trans	-118	135.1	-179.5	-71.2	172.8	0	0	0	108.3	L11 M14 Q22 S154 K329	L11-I20 HydrophobicContact CD1-CD1 3.32Å; L11-I20 HydrophobicContact CD1-CG2 4.44Å; M14-I20 HydrophobicContact CB-CD1 3.35Å; M14-I20 HydrophobicContact CB-CG1 3.87Å; M14-I20 HydrophobicContact CE-CD1 3.82Å; M14-I20 HydrophobicContact CG-CD1 4.26Å; M14-I20 HydrophobicContact SD-CD1 4.02Å; I20-Q22 PolarHBondContact O-N 2.71Å; I20-S154 VanDerWaalsContact CD1-CB 3.49Å; I20-K329 HydrophobicContact CG2-CD 4.16Å
21	D	69.2	Low	82.1	Confident	139 Å²	139	52.5 Å²	52.5	74%	0.743	30%	0.295	S	S	*	.			trans	-65.5	133.5	173.7	-167.5	22.3	0	0	0	110.1	K329	D21-K329 PolarHBondContact O-NZ 3.2Å
22	Q	70.5	Confident	82.5	Confident	24 Å²	24	52.4 Å²	52.4	11%	0.112	30%	0.295	C	S	.	.			trans	-130.9	128.1	-174.7	-72.7	-67.1	-12.7	0	0	108.3	T15 I20 M24 F28 N59 N60	T15-Q22 HydrophobicContact CG2-CG 3.84Å; T15-Q22 PolarHBondContact OG1-NE2 2.77Å; I20-Q22 PolarHBondContact O-N 2.71Å; Q22-M24 PolarHBondContact O-N 2.83Å; Q22-F28 HydrophobicContact CG-CZ 4.46Å; Q22-N59 PolarHBondContact OE1-ND2 3.47Å; Q22-N60 PolarHBondContact NE2-OD1 3.4Å; Q22-N60 PolarHBondContact OE1-ND2 2.77Å; Q22-N60 VanDerWaalsContact OE1-ND2 3.11Å; Q22-N60 PolarHBondContact OE1-OD1 3.22Å
23	A	69.2	Low	82.8	Confident	84 Å²	84	52.3 Å²	52.3	69%	0.694	29%	0.294	S	S	*	.	S	Bend	trans	-61.8	-33	177	0	0	0	0	0	111.7
24	M	76.1	Confident	83.4	Confident	88 Å²	88	52.3 Å²	52.3	43%	0.433	29%	0.294	S	S	.	.	S	Bend	trans	-93.4	126.5	178	-167.8	174.5	-69.1	0	0	110.3	Q22 F28	Q22-M24 PolarHBondContact O-N 2.83Å; M24-F28 HydrophobicContact CB-CD1 4.46Å; M24-F28 HydrophobicContact CG-CB 3.92Å; M24-F28 HydrophobicContact CG-CD1 4.25Å; M24-F28 HydrophobicContact CG-CG 4.33Å; M24-F28 WeakPolarHBondContact O-CE1 3.4Å; M24-F28 HydrophobicContact SD-CB 3.37Å; M24-F28 WeakPolarHBondContact SD-CB 3.44Å; M24-F28 HydrophobicContact SD-CG 4.23Å
25	K	81.5	Confident	84.2	Confident	179 Å²	179	52.2 Å²	52.2	78%	0.778	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-83.2	150.2	172.2	-67	-177.1	179.4	177.9	0	110.1
26	P	85.9	Confident	84.8	Confident	107 Å²	107	51.9 Å²	51.9	70%	0.695	29%	0.292	S	S	*	.	S	Bend	trans	-55.7	148	173.5	-24.7	34.3	0	0	0	112.4	F28	P26-F28 HydrophobicContact CB-CD1 4.43Å; P26-F28 HydrophobicContact CB-CE1 4.45Å; P26-F28 HydrophobicContact CG-CD1 4.24Å; P26-F28 HydrophobicContact CG-CE1 3.81Å
27	P	90.5	Very high	85.4	Confident	131 Å²	131	49.3 Å²	49.3	85%	0.851	29%	0.285	S	S	*	.	S	Bend	cis	-78.7	141.5	1.3	32.6	-34.6	0	0	0	113
28	F	89.8	Confident	86.1	Confident	50 Å²	50	49.5 Å²	49.5	22%	0.219	29%	0.286	C	S	.	.			trans	-153.7	158.1	169.6	62.2	-97.6	0	0	0	110.7	T15 Q22 M24 P26 L30 N60	T15-F28 HydrophobicContact CG2-CE2 3.74Å; T15-F28 HydrophobicContact CG2-CZ 3.78Å; Q22-F28 HydrophobicContact CG-CZ 4.46Å; M24-F28 HydrophobicContact CB-CD1 4.46Å; M24-F28 HydrophobicContact CG-CB 3.92Å; M24-F28 HydrophobicContact CG-CD1 4.25Å; M24-F28 HydrophobicContact CG-CG 4.33Å; M24-F28 WeakPolarHBondContact O-CE1 3.4Å; M24-F28 HydrophobicContact SD-CB 3.37Å; M24-F28 WeakPolarHBondContact SD-CB 3.44Å; M24-F28 HydrophobicContact SD-CG 4.23Å; P26-F28 HydrophobicContact CB-CD1 4.43Å; P26-F28 HydrophobicContact CB-CE1 4.45Å; P26-F28 HydrophobicContact CG-CD1 4.24Å; P26-F28 HydrophobicContact CG-CE1 3.81Å; F28-L30 HydrophobicContact CE2-CD2 3.9Å; F28-N60 HydrophobicContact CD2-CB 4.27Å; F28-N60 WeakPolarHBondContact CE2-ND2 3.37Å
29	T	92.2	Very high	87	Confident	70 Å²	70	50 Å²	50	43%	0.429	28%	0.284	S	S	.	.			trans	-83.2	134.8	177.6	-55.8	0	0	0	0	110.8	N60 G61 W63	T29-N60 WeakPolarHBondContact O-CB 3.43Å; T29-G61 WeakPolarHBondContact O-CA 3.45Å; T29-G61 PolarHBondContact O-N 2.89Å; T29-G61 VanDerWaalsContact O-N 3.08Å; T29-W63 HydrophobicContact CG2-CB 3.94Å; T29-W63 WeakPolarHBondContact CG2-O 2.95Å
30	L	92.5	Very high	88.1	Confident	27 Å²	27	56 Å²	56	14%	0.141	31%	0.312	C	S	.	.			trans	-73.8	177.8	176.8	-67.4	175.5	0	0	0	112.4	T15 R16 F28 G61 A62 W63 M379	T15-L30 HydrophobicContact CG2-CD2 3.78Å; R16-L30 HydrophobicContact CB-CD1 4Å; R16-L30 HydrophobicContact CG-CD1 4.39Å; F28-L30 HydrophobicContact CE2-CD2 3.9Å; L30-G61 CarbonylContact O-C 3.33Å; L30-G61 PolarHBondContact O-N 3.36Å; L30-A62 PolarHBondContact O-N 2.7Å; L30-A62 VanDerWaalsContact O-N 3.1Å; L30-W63 HydrophobicContact CB-CD2 3.81Å; L30-W63 HydrophobicContact CB-CE3 3.94Å; L30-W63 HydrophobicContact CB-CG 4.08Å; L30-W63 HydrophobicContact CD1-CE3 4.23Å; L30-W63 HydrophobicContact CD1-CZ3 4.13Å; L30-W63 WeakPolarHBondContact O-CB 3.38Å; L30-W63 PolarHBondContact O-N 3.16Å; L30-M379 HydrophobicContact CD1-CE 3.66Å
31	G	91.7	Very high	89.3	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.325	C	S	.	.			trans	107.7	122.4	170.6	0	0	0	0	0	113.7	D12 N60 G61 A62	D12-G31 VanDerWaalsContact OD1-CA 3.28Å; D12-G31 WeakPolarHBondContact OD1-CA 3.06Å; D12-G31 PolarHBondContact OD1-N 3.19Å; G31-N60 CarbonylContact O-C 3.27Å; G31-N60 VanDerWaalsContact O-C 3.27Å; G31-N60 VanDerWaalsContact O-CA 3.24Å; G31-N60 WeakPolarHBondContact O-CA 2.98Å; G31-G61 PolarHBondContact O-N 3.35Å; G31-G61 VanDerWaalsContact O-N 3.09Å; G31-A62 PolarHBondContact O-N 3.38Å
32	S	91.5	Very high	90.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.311	C	S	.	.	S	Bend	trans	-108.8	-14.5	-174.2	-47	0	0	0	0	114	L11 D12 L58 F121	L11-S32 WeakPolarHBondContact CD2-OG 3.3Å; D12-S32 PolarHBondContact OD1-N 3.03Å; D12-S32 VanDerWaalsContact OD1-N 3.15Å; D12-S32 PolarHBondContact OD1-OG 2.85Å; S32-L58 CarbonylContact C-O 3.6Å; S32-L58 VanDerWaalsContact CA-O 3.31Å; S32-L58 WeakPolarHBondContact CA-O 3.49Å; S32-L58 WeakPolarHBondContact O-CD2 3.15Å; S32-L58 PolarHBondContact O-N 2.87Å; S32-L58 VanDerWaalsContact O-O 3.07Å; S32-F121 WeakPolarHBondContact O-CE2 3.35Å
33	E	94.8	Very high	91.5	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	148	177	76.1	-176.3	145.1	0	0	112.8	I6 G7 N9 V56 A117 S120 F121 K390	I6-E33 WeakPolarHBondContact CG2-O 3.4Å; G7-E33 PolarHBondContact N-O 2.97Å; G7-E33 VanDerWaalsContact N-O 3.11Å; N9-E33 WeakPolarHBondContact ND2-CG 3.15Å; N9-E33 PolarHBondContact ND2-OE1 2.79Å; N9-E33 PolarHBondContact OD1-OE1 3.13Å; E33-V56 VanDerWaalsContact CA-O 3.3Å; E33-V56 WeakPolarHBondContact CA-O 3.26Å; E33-A117 WeakPolarHBondContact CG-O 3.02Å; E33-S120 PolarHBondContact OE2-OG 2.98Å; E33-F121 HydrophobicContact CB-CD2 3.64Å; E33-F121 HydrophobicContact CB-CE2 4.07Å; E33-F121 HydrophobicContact CB-CG 4.47Å; E33-F121 HydrophobicContact CG-CD2 4.33Å; E33-F121 VanDerWaalsContact OE2-CB 3.3Å; E33-F121 WeakPolarHBondContact OE2-CB 3.42Å; E33-F121 PolarHBondContact OE2-N 2.86Å; E33-K390 IonicContact OE1-NZ 3.83Å; E33-K390 PolarHBondContact OE1-NZ 3.45Å
34	C	97.3	Very high	92.5	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	169.8	175.5	59	0	0	0	0	112.9	L3 I6 I55 V56 A62	L3-C34 HydrophobicContact CD2-CB 3.8Å; L3-C34 WeakPolarHBondContact CD2-SG 3.27Å; I6-C34 HydrophobicContact CB-CB 4.41Å; I6-C34 HydrophobicContact CG1-CB 4.06Å; C34-I55 CarbonylContact O-C 3.51Å; C34-I55 WeakPolarHBondContact O-CA 3.31Å; C34-V56 PolarHBondContact N-O 3.09Å; C34-V56 PolarHBondContact O-N 2.79Å; C34-A62 HydrophobicContact CB-CB 3.88Å
35	T	98.2	Very high	93.2	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	147.9	166.8	-174.7	0	0	0	0	110.5	Q4 L5 V54 R107 V113 A116 A117	Q4-T35 PolarHBondContact N-O 2.95Å; L5-T35 HydrophobicContact CB-CG2 4.18Å; L5-T35 PolarHBondContact N-O 2.99Å; L5-T35 PolarHBondContact O-N 2.99Å; T35-V54 VanDerWaalsContact CA-O 3.26Å; T35-V54 WeakPolarHBondContact CA-O 3.29Å; T35-V54 WeakPolarHBondContact CB-O 3.34Å; T35-V54 PolarHBondContact OG1-O 2.95Å; T35-R107 PolarHBondContact OG1-NH1 3.39Å; T35-V113 HydrophobicContact CG2-CG1 3.83Å; T35-A116 HydrophobicContact CG2-CB 4.08Å; T35-A117 HydrophobicContact CG2-CB 3.9Å
36	G	97.9	Very high	93.6	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	-173.1	177	0	0	0	0	0	113.4	M1 K2 V54	M1-G36 VanDerWaalsContact CE-CA 3.48Å; K2-G36 CarbonylContact O-C 3.52Å; K2-G36 VanDerWaalsContact O-CA 3.23Å; K2-G36 WeakPolarHBondContact O-CA 3.32Å; G36-V54 PolarHBondContact N-O 3.45Å; G36-V54 PolarHBondContact O-N 3.48Å
37	I	98	Very high	93.7	Very high	49 Å²	49	59.2 Å²	59.2	25%	0.251	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	133.8	177.9	-53.2	-58.3	0	0	0	108.9	M1 K2 Q4 S39 D52 P53	M1-I37 WeakPolarHBondContact CA-O 3.44Å; M1-I37 WeakPolarHBondContact CB-O 3.36Å; K2-I37 PolarHBondContact N-O 2.63Å; K2-I37 PolarHBondContact O-N 3.16Å; Q4-I37 HydrophobicContact CG-CG1 4.32Å; I37-S39 PolarHBondContact O-N 3.26Å; I37-D52 WeakPolarHBondContact CA-O 3.36Å; I37-P53 HydrophobicContact CD1-CB 3.68Å
38	I	97.8	Very high	93.8	Very high	16 Å²	16	54.8 Å²	54.8	8%	0.082	29%	0.294	C	S	.	.			trans	-64.3	120.8	173.4	-61	-173.2	0	0	0	108.8	V41 Y48 K49 V50 G51 D52 V54	I38-V41 HydrophobicContact CG2-CG1 3.54Å; I38-Y48 HydrophobicContact CD1-CD1 3.76Å; I38-Y48 HydrophobicContact CD1-CG 3.9Å; I38-K49 WeakPolarHBondContact CB-O 3.39Å; I38-V50 WeakPolarHBondContact O-CA 3.27Å; I38-G51 PolarHBondContact O-N 3.14Å; I38-D52 HydrophobicContact CD1-CB 4.04Å; I38-D52 HydrophobicContact CG1-CB 4.31Å; I38-D52 PolarHBondContact N-O 3.49Å; I38-V54 HydrophobicContact CD1-CG1 3.99Å; I38-V54 HydrophobicContact CG1-CG1 4.17Å; I38-V54 HydrophobicContact CG1-CG2 4.26Å
39	S	97.6	Very high	94	Very high	48 Å²	48	59 Å²	59	34%	0.336	31%	0.312	S	S	.	.			trans	-101.4	-30	-176.7	56.5	0	0	0	0	112.5	M1 I37	M1-S39 WeakPolarHBondContact CA-OG 3.33Å; I37-S39 PolarHBondContact O-N 3.26Å
40	E	97.3	Very high	94.3	Very high	144 Å²	144	59.9 Å²	59.9	67%	0.673	32%	0.317	S	S	*	.			trans	-151.2	149.6	-176.8	-69.8	172.4	-145.1	0	0	107.7
41	V	95.5	Very high	94.5	Very high	62 Å²	62	60.7 Å²	60.7	38%	0.376	33%	0.332	S	S	.	.			trans	-131.5	146.6	174.8	-64.2	0	0	0	0	108.9	I38 V45 V50	I38-V41 HydrophobicContact CG2-CG1 3.54Å; V41-V45 HydrophobicContact CB-CB 4.31Å; V41-V45 HydrophobicContact CB-CG1 4.41Å; V41-V50 HydrophobicContact CG2-CG2 4.49Å
42	G	93.4	Very high	94.8	Very high	44 Å²	44	62.6 Å²	62.6	45%	0.454	34%	0.342	S	S	.	.			trans	-70.6	154.6	175.6	0	0	0	0	0	111.3	K44 V45	G42-K44 PolarHBondContact O-N 3.06Å; G42-V45 WeakPolarHBondContact O-CB 3.38Å; G42-V45 PolarHBondContact O-N 3.06Å
43	E	92.3	Very high	95.1	Very high	208 Å²	208	64.6 Å²	64.6	97%	0.972	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-27.7	-175	-64.2	-179.9	169.8	0	0	114.4
44	K	90.5	Very high	95.2	Very high	186 Å²	186	64.8 Å²	64.8	81%	0.809	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-6.1	-179.2	-62.5	-175.8	-179.8	-179	0	114.1	G42	G42-K44 PolarHBondContact O-N 3.06Å
45	V	90.4	Very high	95.2	Very high	30 Å²	30	64.8 Å²	64.8	18%	0.182	36%	0.356	C	S	.	.			trans	-81.8	119.8	-177.8	177.9	0	0	0	0	108.8	V41 G42 Y48 I71 E73	V41-V45 HydrophobicContact CB-CB 4.31Å; V41-V45 HydrophobicContact CB-CG1 4.41Å; G42-V45 WeakPolarHBondContact O-CB 3.38Å; G42-V45 PolarHBondContact O-N 3.06Å; V45-Y48 HydrophobicContact CG1-CD2 3.97Å; V45-I71 HydrophobicContact CG1-CG1 4.47Å; V45-I71 HydrophobicContact CG1-CG2 4.36Å; V45-I71 HydrophobicContact CG2-CB 3.93Å; V45-I71 HydrophobicContact CG2-CG1 4.14Å; V45-I71 HydrophobicContact CG2-CG2 4.3Å; V45-E73 WeakPolarHBondContact CA-OE1 3.28Å
46	T	90.7	Very high	95.1	Very high	121 Å²	121	64.8 Å²	64.8	74%	0.742	36%	0.356	S	S	*	.			trans	-113.7	-22	180	72	0	0	0	0	112.7	Y48 E73	T46-Y48 VanDerWaalsContact C-N 3.34Å; T46-Y48 PolarHBondContact O-N 3.3Å; T46-E73 VanDerWaalsContact N-CD 3.26Å; T46-E73 PolarHBondContact N-OE1 2.91Å; T46-E73 PolarHBondContact N-OE2 3.49Å; T46-E73 PolarHBondContact OG1-OE2 2.91Å
47	T	88.4	Confident	94.9	Very high	58 Å²	58	64.8 Å²	64.8	36%	0.356	36%	0.356	S	S	.	.	S	Bend	trans	-73.6	-21	-177.7	50.1	0	0	0	0	114.2	E73	T47-E73 WeakPolarHBondContact CB-OE1 3.5Å; T47-E73 WeakPolarHBondContact CG2-OE1 3.16Å; T47-E73 PolarHBondContact N-OE1 2.95Å; T47-E73 PolarHBondContact OG1-OE1 2.89Å
48	Y	92.3	Very high	94.5	Very high	37 Å²	37	62.4 Å²	62.4	15%	0.145	34%	0.344	C	S	.	.			trans	-129.9	149.4	-175.7	-60.1	-76.8	0	0	0	111.9	I38 V45 T46 I71 I104	I38-Y48 HydrophobicContact CD1-CD1 3.76Å; I38-Y48 HydrophobicContact CD1-CG 3.9Å; V45-Y48 HydrophobicContact CG1-CD2 3.97Å; T46-Y48 VanDerWaalsContact C-N 3.34Å; T46-Y48 PolarHBondContact O-N 3.3Å; Y48-I71 HydrophobicContact CD2-CD1 4.15Å; Y48-I71 HydrophobicContact CD2-CG1 4.42Å; Y48-I71 HydrophobicContact CD2-CG2 4.44Å; Y48-I71 HydrophobicContact CE2-CD1 3.83Å; Y48-I71 HydrophobicContact CE2-CG1 4.48Å; Y48-I71 HydrophobicContact CE2-CG2 4.22Å; Y48-I104 HydrophobicContact CE1-CB 4.38Å; Y48-I104 HydrophobicContact CE1-CG2 3.78Å
49	K	95	Very high	93.9	Very high	140 Å²	140	63 Å²	63	61%	0.609	35%	0.348	S	S	*	.			trans	-126.5	156.1	173.7	58.7	-179.6	175.1	-149.7	0	112.4	I38 G51 D52	I38-K49 WeakPolarHBondContact CB-O 3.39Å; K49-G51 PolarHBondContact O-N 2.79Å; K49-D52 WeakPolarHBondContact CE-OD1 3.34Å; K49-D52 VanDerWaalsContact CG-CG 3.4Å; K49-D52 VanDerWaalsContact CG-OD1 3.27Å; K49-D52 WeakPolarHBondContact CG-OD1 3.46Å; K49-D52 WeakPolarHBondContact CG-OD2 3.22Å; K49-D52 PolarHBondContact N-OD2 3.45Å; K49-D52 WeakPolarHBondContact O-CB 3.4Å; K49-D52 PolarHBondContact O-N 3.28Å
50	V	97.5	Very high	93.5	Very high	88 Å²	88	61.3 Å²	61.3	53%	0.533	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	132.7	170.6	177.9	0	0	0	0	109.5	I38 V41	I38-V50 WeakPolarHBondContact O-CA 3.27Å; V41-V50 HydrophobicContact CG2-CG2 4.49Å
51	G	97.2	Very high	93.2	Very high	44 Å²	44	55 Å²	55	45%	0.454	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.1	-12.7	-177.1	0	0	0	0	0	114.8	I38 K49	I38-G51 PolarHBondContact O-N 3.14Å; K49-G51 PolarHBondContact O-N 2.79Å
52	D	96.9	Very high	93.2	Very high	40 Å²	40	52.1 Å²	52.1	21%	0.214	29%	0.291	C	S	.	.			trans	-67	130.5	179	-73.6	-19	0	0	0	111.7	I37 I38 K49	I37-D52 WeakPolarHBondContact CA-O 3.36Å; I38-D52 HydrophobicContact CD1-CB 4.04Å; I38-D52 HydrophobicContact CG1-CB 4.31Å; I38-D52 PolarHBondContact N-O 3.49Å; K49-D52 WeakPolarHBondContact CE-OD1 3.34Å; K49-D52 VanDerWaalsContact CG-CG 3.4Å; K49-D52 VanDerWaalsContact CG-OD1 3.27Å; K49-D52 WeakPolarHBondContact CG-OD1 3.46Å; K49-D52 WeakPolarHBondContact CG-OD2 3.22Å; K49-D52 PolarHBondContact N-OD2 3.45Å; K49-D52 WeakPolarHBondContact O-CB 3.4Å; K49-D52 PolarHBondContact O-N 3.28Å
53	P	97.5	Very high	93.3	Very high	41 Å²	41	51.4 Å²	51.4	27%	0.266	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	127.1	171.8	33.7	-33	0	0	0	110.8	I37 R107	I37-P53 HydrophobicContact CD1-CB 3.68Å; P53-R107 HydrophobicContact CB-CB 4.05Å; P53-R107 HydrophobicContact CG-CB 4.44Å; P53-R107 WeakPolarHBondContact O-CB 3.47Å; P53-R107 PolarHBondContact O-N 3.5Å
54	V	97.5	Very high	93.4	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.024	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	156.3	-176	-61.4	0	0	0	0	112.4	M1 T35 G36 I38 V56 I104 L105	M1-V54 HydrophobicContact CE-CG2 3.43Å; M1-V54 VanDerWaalsContact CE-CG2 3.43Å; M1-V54 HydrophobicContact SD-CG2 4.07Å; T35-V54 VanDerWaalsContact CA-O 3.26Å; T35-V54 WeakPolarHBondContact CA-O 3.29Å; T35-V54 WeakPolarHBondContact CB-O 3.34Å; T35-V54 PolarHBondContact OG1-O 2.95Å; G36-V54 PolarHBondContact N-O 3.45Å; G36-V54 PolarHBondContact O-N 3.48Å; I38-V54 HydrophobicContact CD1-CG1 3.99Å; I38-V54 HydrophobicContact CG1-CG1 4.17Å; I38-V54 HydrophobicContact CG1-CG2 4.26Å; V54-V56 HydrophobicContact CG2-CG2 4.16Å; V54-I104 HydrophobicContact CB-CG2 3.83Å; V54-I104 HydrophobicContact CG1-CG2 3.83Å; V54-I104 HydrophobicContact CG2-CG2 4.28Å; V54-L105 CarbonylContact C-O 3.32Å; V54-L105 WeakPolarHBondContact CA-O 3.18Å
55	I	97.6	Very high	93.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.7	166.5	-67.1	166.7	0	0	0	106.8	C34 L105 R107 L111 A116 I119 W350	C34-I55 CarbonylContact O-C 3.51Å; C34-I55 WeakPolarHBondContact O-CA 3.31Å; I55-L105 HydrophobicContact CB-CB 4.36Å; I55-L105 PolarHBondContact N-O 2.96Å; I55-L105 PolarHBondContact O-N 2.83Å; I55-R107 HydrophobicContact CD1-CB 4.32Å; I55-R107 HydrophobicContact CD1-CG 4.1Å; I55-R107 HydrophobicContact CG1-CB 4.2Å; I55-R107 HydrophobicContact CG1-CG 4.28Å; I55-L111 HydrophobicContact CD1-CD2 4.1Å; I55-A116 HydrophobicContact CD1-CB 3.84Å; I55-A116 HydrophobicContact CG1-CB 4.04Å; I55-I119 HydrophobicContact CD1-CG2 3.85Å; I55-W350 HydrophobicContact CD1-CH2 3.44Å; I55-W350 VanDerWaalsContact CD1-CH2 3.44Å; I55-W350 HydrophobicContact CD1-CZ2 3.55Å
56	V	96	Very high	93.9	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	126.2	-175.9	-178.1	0	0	0	0	109.8	M1 E33 C34 V54 L58 L67 L69 I103 I104	M1-V56 HydrophobicContact CE-CG2 4.15Å; M1-V56 HydrophobicContact SD-CG2 3.75Å; E33-V56 VanDerWaalsContact CA-O 3.3Å; E33-V56 WeakPolarHBondContact CA-O 3.26Å; C34-V56 PolarHBondContact N-O 3.09Å; C34-V56 PolarHBondContact O-N 2.79Å; V54-V56 HydrophobicContact CG2-CG2 4.16Å; V56-L58 HydrophobicContact CG1-CB 4.36Å; V56-L58 HydrophobicContact CG1-CD2 4.11Å; V56-L67 HydrophobicContact CG1-CD2 4.33Å; V56-L69 HydrophobicContact CB-CD1 4.44Å; V56-L69 HydrophobicContact CG1-CD1 3.62Å; V56-L69 HydrophobicContact CG2-CD1 3.94Å; V56-I103 WeakPolarHBondContact CA-O 3.31Å; V56-I104 HydrophobicContact CG2-CG1 4.35Å; V56-I104 HydrophobicContact CG2-CG2 4.48Å
57	L	92.8	Very high	94.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	134.7	162.5	-61.4	91.4	0	0	0	108.6	S102 I103 L105 F121 I124 L328 L332	L57-S102 CarbonylContact O-C 3.59Å; L57-S102 WeakPolarHBondContact O-CA 3.47Å; L57-S102 WeakPolarHBondContact O-CB 3.46Å; L57-I103 HydrophobicContact CB-CB 4.4Å; L57-I103 HydrophobicContact CD1-CB 4.46Å; L57-I103 PolarHBondContact N-O 2.97Å; L57-I103 PolarHBondContact O-N 3.16Å; L57-L105 HydrophobicContact CD1-CD1 3.37Å; L57-L105 HydrophobicContact CD1-CG 4.11Å; L57-F121 HydrophobicContact CB-CE2 4.01Å; L57-F121 HydrophobicContact CD2-CD2 3.78Å; L57-F121 HydrophobicContact CD2-CE2 3.68Å; L57-F121 HydrophobicContact CG-CD2 4.15Å; L57-F121 HydrophobicContact CG-CE2 3.96Å; L57-I124 HydrophobicContact CD1-CD1 4.13Å; L57-I124 HydrophobicContact CD2-CD1 4.02Å; L57-L328 HydrophobicContact CD2-CD2 4.33Å; L57-L332 HydrophobicContact CB-CD1 4.12Å; L57-L332 HydrophobicContact CD2-CD1 3.46Å; L57-L332 VanDerWaalsContact CD2-CD1 3.46Å; L57-L332 HydrophobicContact CG-CD1 4.44Å
58	L	91.2	Very high	94.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	161.5	-177.6	68.2	168	0	0	0	110	S32 V56 N60 A62 L67 I100 K101 F333	S32-L58 CarbonylContact C-O 3.6Å; S32-L58 VanDerWaalsContact CA-O 3.31Å; S32-L58 WeakPolarHBondContact CA-O 3.49Å; S32-L58 WeakPolarHBondContact O-CD2 3.15Å; S32-L58 PolarHBondContact O-N 2.87Å; S32-L58 VanDerWaalsContact O-O 3.07Å; V56-L58 HydrophobicContact CG1-CB 4.36Å; V56-L58 HydrophobicContact CG1-CD2 4.11Å; L58-N60 VanDerWaalsContact CD1-O 3.27Å; L58-N60 WeakPolarHBondContact CD1-O 3.4Å; L58-A62 HydrophobicContact CD1-CB 4.33Å; L58-A62 HydrophobicContact CD2-CB 3.77Å; L58-L67 HydrophobicContact CD1-CD1 4.03Å; L58-L67 HydrophobicContact CD1-CD2 3.96Å; L58-I100 HydrophobicContact CB-CG2 4.27Å; L58-I100 HydrophobicContact CD1-CG2 4.38Å; L58-K101 WeakPolarHBondContact CA-O 3.34Å; L58-F333 WeakPolarHBondContact O-CZ 3.41Å
59	N	85.2	Confident	94.4	Very high	29 Å²	29	43.4 Å²	43.4	16%	0.155	23%	0.231	C	C	.	.	S	Bend	trans	-66.5	-55.9	178.9	-174.9	52.9	0	0	0	110.7	Q22 K101 K329 F333	Q22-N59 PolarHBondContact OE1-ND2 3.47Å; N59-K101 PolarHBondContact N-O 3.32Å; N59-K329 WeakPolarHBondContact OD1-CE 3.42Å; N59-F333 HydrophobicContact CB-CD1 4.49Å; N59-F333 HydrophobicContact CB-CD2 4.08Å; N59-F333 HydrophobicContact CB-CE2 4.25Å; N59-F333 HydrophobicContact CB-CG 4.22Å
60	N	87.9	Confident	94	Very high	12 Å²	12	37.9 Å²	37.9	6%	0.064	21%	0.21	C	C	.	.	S	Bend	trans	-148.1	158.4	178.3	-54.1	-22.6	0	0	0	109.1	Q22 F28 T29 G31 L58	Q22-N60 PolarHBondContact NE2-OD1 3.4Å; Q22-N60 PolarHBondContact OE1-ND2 2.77Å; Q22-N60 VanDerWaalsContact OE1-ND2 3.11Å; Q22-N60 PolarHBondContact OE1-OD1 3.22Å; F28-N60 HydrophobicContact CD2-CB 4.27Å; F28-N60 WeakPolarHBondContact CE2-ND2 3.37Å; T29-N60 WeakPolarHBondContact O-CB 3.43Å; G31-N60 CarbonylContact O-C 3.27Å; G31-N60 VanDerWaalsContact O-C 3.27Å; G31-N60 VanDerWaalsContact O-CA 3.24Å; G31-N60 WeakPolarHBondContact O-CA 2.98Å; L58-N60 VanDerWaalsContact CD1-O 3.27Å; L58-N60 WeakPolarHBondContact CD1-O 3.4Å
61	G	91.7	Very high	93.4	Very high	12 Å²	12	36 Å²	36	12%	0.124	20%	0.197	C	C	.	.			trans	127.3	-12.5	166.4	0	0	0	0	0	115.8	T29 L30 G31 W63 S64	T29-G61 WeakPolarHBondContact O-CA 3.45Å; T29-G61 PolarHBondContact O-N 2.89Å; T29-G61 VanDerWaalsContact O-N 3.08Å; L30-G61 CarbonylContact O-C 3.33Å; L30-G61 PolarHBondContact O-N 3.36Å; G31-G61 PolarHBondContact O-N 3.35Å; G31-G61 VanDerWaalsContact O-N 3.09Å; G61-W63 VanDerWaalsContact C-N 3.28Å; G61-W63 PolarHBondContact O-N 3.27Å; G61-S64 PolarHBondContact O-OG 3.45Å; G61-S64 VanDerWaalsContact O-OG 3.08Å
62	A	94.8	Very high	92.2	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.			trans	-70.5	-16.3	-173.2	0	0	0	0	0	114.9	L3 I6 L30 G31 C34 L58 S64	L3-A62 VanDerWaalsContact CD1-O 3.25Å; L3-A62 WeakPolarHBondContact CD1-O 3.22Å; I6-A62 WeakPolarHBondContact CD1-O 3.49Å; I6-A62 VanDerWaalsContact CG1-O 3.25Å; I6-A62 WeakPolarHBondContact CG1-O 3.41Å; I6-A62 HydrophobicContact CG2-CB 4.19Å; L30-A62 PolarHBondContact O-N 2.7Å; L30-A62 VanDerWaalsContact O-N 3.1Å; G31-A62 PolarHBondContact O-N 3.38Å; C34-A62 HydrophobicContact CB-CB 3.88Å; L58-A62 HydrophobicContact CD1-CB 4.33Å; L58-A62 HydrophobicContact CD2-CB 3.77Å; A62-S64 PolarHBondContact O-N 3.18Å
63	W	95.1	Very high	90.7	Very high	29 Å²	29	37.1 Å²	37.1	11%	0.11	19%	0.19	C	C	.	.	S	Bend	trans	-76.9	61	179.7	-70.7	21.9	0	0	0	111.9	I6 I8 D12 T29 L30 G61 L372 T375 M379 L393	I6-W63 VanDerWaalsContact CG2-CD1 3.46Å; I8-W63 HydrophobicContact CD1-CZ2 4.42Å; I8-W63 HydrophobicContact CG1-CZ2 4.08Å; I8-W63 HydrophobicContact CG2-CZ2 4.13Å; D12-W63 HydrophobicContact CB-CZ2 4.21Å; T29-W63 HydrophobicContact CG2-CB 3.94Å; T29-W63 WeakPolarHBondContact CG2-O 2.95Å; L30-W63 HydrophobicContact CB-CD2 3.81Å; L30-W63 HydrophobicContact CB-CE3 3.94Å; L30-W63 HydrophobicContact CB-CG 4.08Å; L30-W63 HydrophobicContact CD1-CE3 4.23Å; L30-W63 HydrophobicContact CD1-CZ3 4.13Å; L30-W63 WeakPolarHBondContact O-CB 3.38Å; L30-W63 PolarHBondContact O-N 3.16Å; G61-W63 VanDerWaalsContact C-N 3.28Å; G61-W63 PolarHBondContact O-N 3.27Å; W63-L372 HydrophobicContact CB-CD1 4.43Å; W63-T375 HydrophobicContact CE3-CG2 3.82Å; W63-T375 HydrophobicContact CH2-CG2 4.17Å; W63-T375 HydrophobicContact CZ3-CG2 3.52Å; W63-M379 HydrophobicContact CH2-CE 3.09Å; W63-M379 HydrophobicContact CH2-CG 3.96Å; W63-M379 HydrophobicContact CH2-SD 4.26Å; W63-M379 HydrophobicContact CZ2-CE 3.96Å; W63-M379 HydrophobicContact CZ3-CE 3.51Å; W63-L393 HydrophobicContact CD2-CD1 3.68Å; W63-L393 VanDerWaalsContact CE2-CD1 3.47Å; W63-L393 HydrophobicContact CE3-CD1 4.09Å; W63-L393 HydrophobicContact CG-CD1 4.13Å; W63-L393 HydrophobicContact CH2-CD1 3.99Å; W63-L393 HydrophobicContact CZ2-CD1 3.67Å; W63-L393 HydrophobicContact CZ3-CD1 4.23Å
64	S	94.7	Very high	88.9	Confident	26 Å²	26	41.8 Å²	41.8	18%	0.182	21%	0.206	C	C	.	.	S	Bend	trans	-148.1	167.7	-173.9	55.8	0	0	0	0	110.7	L3 G61 A62 R66 P395	L3-S64 WeakPolarHBondContact CD1-O 3.47Å; L3-S64 WeakPolarHBondContact CD1-OG 3.26Å; G61-S64 PolarHBondContact O-OG 3.45Å; G61-S64 VanDerWaalsContact O-OG 3.08Å; A62-S64 PolarHBondContact O-N 3.18Å; S64-R66 PolarHBondContact OG-O 3Å; S64-R66 VanDerWaalsContact OG-O 3.1Å; S64-P395 WeakPolarHBondContact O-CB 3.37Å
65	E	95.9	Very high	86.6	Confident	110 Å²	110	48.4 Å²	48.4	51%	0.514	24%	0.24	S	C	.	.	S	Bend	trans	-81.3	-28.9	172.9	-53.4	-164.6	152.2	0	0	112.7	L3 P395	L3-E65 PolarHBondContact N-O 3.12Å; E65-P395 WeakPolarHBondContact CG-O 3.38Å
66	R	96.1	Very high	84.2	Confident	174 Å²	174	55.4 Å²	55.4	66%	0.657	28%	0.277	S	S	*	.	B	Isolated β-bridge	trans	-136.1	137.9	-177.7	-63.8	-175	-176.6	-167.9	0.5	109.4	M1 S64	M1-R66 WeakPolarHBondContact O-CA 3.36Å; S64-R66 PolarHBondContact OG-O 3Å; S64-R66 VanDerWaalsContact OG-O 3.1Å
67	L	94.9	Very high	81.2	Confident	8 Å²	8	60.6 Å²	60.6	4%	0.042	31%	0.309	C	S	.	.			trans	-122.2	133.1	177.7	-175.1	64.8	0	0	0	109.1	M1 L3 V56 L58 L69	M1-L67 HydrophobicContact CG-CB 3.95Å; M1-L67 WeakPolarHBondContact CG-O 3.35Å; M1-L67 PolarHBondContact N-O 3.16Å; M1-L67 PolarHBondContact O-N 3.49Å; M1-L67 VanDerWaalsContact O-N 3.1Å; M1-L67 HydrophobicContact SD-CB 4.44Å; M1-L67 HydrophobicContact SD-CD2 4.27Å; L3-L67 HydrophobicContact CD1-CB 4.04Å; L3-L67 HydrophobicContact CD2-CB 4.23Å; L3-L67 HydrophobicContact CD2-CD2 4.41Å; L3-L67 HydrophobicContact CG-CB 4.22Å; V56-L67 HydrophobicContact CG1-CD2 4.33Å; L58-L67 HydrophobicContact CD1-CD1 4.03Å; L58-L67 HydrophobicContact CD1-CD2 3.96Å; L67-L69 HydrophobicContact CD1-CD2 4.2Å; L67-L69 HydrophobicContact CD2-CD1 4.12Å; L67-L69 HydrophobicContact CD2-CD2 3.86Å; L67-L69 HydrophobicContact CD2-CG 4.08Å; L67-L69 HydrophobicContact CG-CD2 3.83Å; L67-L69 HydrophobicContact CG-CG 3.99Å
68	V	94.3	Very high	78.6	Confident	126 Å²	126	67.4 Å²	67.4	76%	0.764	35%	0.346	S	S	*	.			trans	-110.7	123.9	172.6	-178.6	0	0	0	0	107
69	L	91.5	Very high	75.9	Confident	28 Å²	28	77 Å²	77	15%	0.147	39%	0.39	C	S	.	.			trans	-119.7	134.7	-179.2	-61.4	173.5	0	0	0	108.6	M1 V56 L67 I100 I104	M1-L69 HydrophobicContact SD-CD1 4.3Å; V56-L69 HydrophobicContact CB-CD1 4.44Å; V56-L69 HydrophobicContact CG1-CD1 3.62Å; V56-L69 HydrophobicContact CG2-CD1 3.94Å; L67-L69 HydrophobicContact CD1-CD2 4.2Å; L67-L69 HydrophobicContact CD2-CD1 4.12Å; L67-L69 HydrophobicContact CD2-CD2 3.86Å; L67-L69 HydrophobicContact CD2-CG 4.08Å; L67-L69 HydrophobicContact CG-CD2 3.83Å; L67-L69 HydrophobicContact CG-CG 3.99Å; L69-I100 HydrophobicContact CD2-CG2 4.43Å; L69-I104 HydrophobicContact CB-CD1 4.4Å; L69-I104 HydrophobicContact CD1-CD1 3.72Å; L69-I104 HydrophobicContact CD1-CG1 3.87Å
70	P	86.9	Confident	73.5	Confident	24 Å²	24	81 Å²	81	16%	0.156	42%	0.416	C	S	.	.			trans	-64.6	144.9	166.2	29.1	-33.8	0	0	0	110.2	T92 M99	P70-T92 HydrophobicContact CB-CG2 4.33Å; P70-T92 HydrophobicContact CG-CG2 4.25Å; P70-T92 WeakPolarHBondContact O-CG2 3.43Å; P70-M99 HydrophobicContact CB-CE 3.4Å; P70-M99 HydrophobicContact CB-SD 3.44Å; P70-M99 WeakPolarHBondContact CB-SD 3.47Å; P70-M99 HydrophobicContact CG-CB 4.33Å; P70-M99 HydrophobicContact CG-CE 3.52Å; P70-M99 HydrophobicContact CG-SD 3.75Å
71	I	85	Confident	70.8	Confident	50 Å²	50	87.8 Å²	87.8	26%	0.256	45%	0.452	S	S	.	.			trans	-122.4	131.2	168.1	-52.7	-62.7	0	0	0	106.5	V45 Y48 E73 I104	V45-I71 HydrophobicContact CG1-CG1 4.47Å; V45-I71 HydrophobicContact CG1-CG2 4.36Å; V45-I71 HydrophobicContact CG2-CB 3.93Å; V45-I71 HydrophobicContact CG2-CG1 4.14Å; V45-I71 HydrophobicContact CG2-CG2 4.3Å; Y48-I71 HydrophobicContact CD2-CD1 4.15Å; Y48-I71 HydrophobicContact CD2-CG1 4.42Å; Y48-I71 HydrophobicContact CD2-CG2 4.44Å; Y48-I71 HydrophobicContact CE2-CD1 3.83Å; Y48-I71 HydrophobicContact CE2-CG1 4.48Å; Y48-I71 HydrophobicContact CE2-CG2 4.22Å; I71-E73 HydrophobicContact CG2-CG 4.19Å; I71-I104 HydrophobicContact CD1-CD1 3.4Å; I71-I104 VanDerWaalsContact CD1-CD1 3.4Å
72	I	71.7	Confident	68	Low	65 Å²	65	92.3 Å²	92.3	33%	0.333	48%	0.482	S	S	.	.			trans	-105.2	120.2	168.5	-61.9	-177.9	0	0	0	104.7	E90 T92 E93	I72-E90 VanDerWaalsContact O-CG 3.25Å; I72-E90 WeakPolarHBondContact O-CG 3.49Å; I72-E90 VanDerWaalsContact O-OE2 3.04Å; I72-T92 HydrophobicContact CB-CG2 4.37Å; I72-T92 HydrophobicContact CD1-CG2 4.43Å; I72-T92 HydrophobicContact CG1-CG2 3.94Å; I72-E93 WeakPolarHBondContact CD1-O 3.48Å
73	E	67	Low	64.8	Low	42 Å²	42	98.4 Å²	98.4	20%	0.196	52%	0.519	C	S	.	.			trans	-96.6	124.3	175.3	-67.7	-96.6	163.4	0	0	108	V45 T46 T47 I71 I75 E90	V45-E73 WeakPolarHBondContact CA-OE1 3.28Å; T46-E73 VanDerWaalsContact N-CD 3.26Å; T46-E73 PolarHBondContact N-OE1 2.91Å; T46-E73 PolarHBondContact N-OE2 3.49Å; T46-E73 PolarHBondContact OG1-OE2 2.91Å; T47-E73 WeakPolarHBondContact CB-OE1 3.5Å; T47-E73 WeakPolarHBondContact CG2-OE1 3.16Å; T47-E73 PolarHBondContact N-OE1 2.95Å; T47-E73 PolarHBondContact OG1-OE1 2.89Å; I71-E73 HydrophobicContact CG2-CG 4.19Å; E73-I75 PolarHBondContact O-N 3.08Å; E73-I75 VanDerWaalsContact O-N 3.13Å; E73-E90 VanDerWaalsContact CA-OE2 3.27Å; E73-E90 WeakPolarHBondContact CA-OE2 3.09Å
74	K	59.1	Low	61.8	Low	138 Å²	138	103.5 Å²	103.5	60%	0.6	55%	0.554	S	S	*	*			trans	-68.3	110.8	169.6	-98.1	162.9	-168.8	-176.9	0	107.5	N76 E90	K74-N76 PolarHBondContact O-N 3.2Å; K74-E90 WeakPolarHBondContact CA-OE1 3.38Å; K74-E90 WeakPolarHBondContact CB-OE1 3.48Å; K74-E90 VanDerWaalsContact CD-OE1 3.3Å; K74-E90 WeakPolarHBondContact CD-OE1 3.49Å; K74-E90 WeakPolarHBondContact CG-OE1 3.35Å; K74-E90 PolarHBondContact N-OE1 3.17Å; K74-E90 PolarHBondContact N-OE2 3.15Å
75	I	48.4	Very low	58.7	Low	143 Å²	143	112.1 Å²	112.1	73%	0.733	59%	0.591	S	S	*	*			trans	-67.9	106.9	166.4	-54	175	0	0	0	105.6	E73 T77	E73-I75 PolarHBondContact O-N 3.08Å; E73-I75 VanDerWaalsContact O-N 3.13Å; I75-T77 HydrophobicContact CG2-CG2 3.85Å; I75-T77 PolarHBondContact O-N 3.3Å
76	N	47.2	Very low	55.9	Low	147 Å²	147	110.8 Å²	110.8	79%	0.786	59%	0.594	S	S	*	*			trans	-64.6	78.5	168.3	-81.5	-19.9	0	0	0	108.9	K74 D78	K74-N76 PolarHBondContact O-N 3.2Å; N76-D78 PolarHBondContact O-N 3.12Å; N76-D78 VanDerWaalsContact O-N 3.1Å
77	T	34.8	Very low	53.2	Low	110 Å²	110	111.9 Å²	111.9	68%	0.675	61%	0.607	S	S	*	*			trans	-79.2	76.4	163.4	48.2	0	0	0	0	107.4	I75	I75-T77 HydrophobicContact CG2-CG2 3.85Å; I75-T77 PolarHBondContact O-N 3.3Å
78	D	37.5	Very low	50.4	Low	143 Å²	143	117.3 Å²	117.3	77%	0.765	64%	0.636	S	S	*	*			trans	-169.8	92	153.1	-87.4	-26.9	0	0	0	110	N76 T80	N76-D78 PolarHBondContact O-N 3.12Å; N76-D78 VanDerWaalsContact O-N 3.1Å; D78-T80 VanDerWaalsContact C-N 3.25Å; D78-T80 PolarHBondContact O-N 2.98Å; D78-T80 VanDerWaalsContact O-N 3.09Å
79	Q	33.8	Very low	48.1	Very low	201 Å²	201	113.6 Å²	113.6	94%	0.939	61%	0.613	S	S	*	*			trans	-74.8	80.6	158.7	-72.5	-174.2	-5.9	0	0	108.8
80	T	36	Very low	46	Very low	112 Å²	112	114 Å²	114	69%	0.687	62%	0.615	S	S	*	*			trans	-149.1	103.7	156	41.7	0	0	0	0	111.5	D78	D78-T80 VanDerWaalsContact C-N 3.25Å; D78-T80 PolarHBondContact O-N 2.98Å; D78-T80 VanDerWaalsContact O-N 3.09Å
81	N	31.2	Very low	43.9	Very low	155 Å²	155	113.8 Å²	113.8	83%	0.829	61%	0.613	S	S	*	*			trans	44.1	120.2	150.5	-62.5	-19.2	0	0	0	121.3
82	S	32	Very low	41.9	Very low	108 Å²	108	112.1 Å²	112.1	76%	0.755	61%	0.605	S	S	*	*			trans	101.7	109.4	137.7	80.2	0	0	0	0	119.3
83	T	28.5	Very low	40.4	Very low	127 Å²	127	113.8 Å²	113.8	78%	0.779	61%	0.612	S	S	*	*			trans	54.5	97.3	140.2	6.2	0	0	0	0	119.4
84	T	32.4	Very low	39.2	Very low	136 Å²	136	116 Å²	116	83%	0.834	63%	0.632	S	S	*	*				166.8	136.5	104.6	29.9	0	0	0	0	109.8	S86	T84-S86 PolarHBondContact O-N 2.79Å
85	Q	29.1	Very low	37.9	Very low	207 Å²	207	114.6 Å²	114.6	97%	0.967	63%	0.631	S	S	*	*			trans	-78.8	113.8	-177.9	-71.3	171	-20.5	0	0	110.2
86	S	36.3	Very low	37.4	Very low	82 Å²	82	117.3 Å²	117.3	57%	0.573	64%	0.641	S	S	*	*			trans	-117.9	128.4	153.8	53.8	0	0	0	0	107.7	T84 D88	T84-S86 PolarHBondContact O-N 2.79Å; S86-D88 PolarHBondContact O-N 3.01Å; S86-D88 PolarHBondContact OG-OD1 2.87Å
87	E	39	Very low	36.9	Very low	197 Å²	197	119.8 Å²	119.8	92%	0.921	65%	0.645	S	S	*	*			trans	-68.1	99.6	176.6	-67.4	177.7	163.8	0	0	108.8	V89	E87-V89 PolarHBondContact O-N 3.12Å
88	D	37.3	Very low	37.4	Very low	123 Å²	123	117.9 Å²	117.9	66%	0.658	65%	0.647	S	S	*	*			trans	-79.2	114.6	-176.8	-65.7	-34.9	0	0	0	110.5	S86	S86-D88 PolarHBondContact O-N 3.01Å; S86-D88 PolarHBondContact OG-OD1 2.87Å
89	V	45.2	Very low	38.2	Very low	48 Å²	48	114.8 Å²	114.8	29%	0.291	63%	0.629	S	S	.	*			trans	-94.2	124	170.3	176.2	0	0	0	0	108.9	E87 I104 V347	E87-V89 PolarHBondContact O-N 3.12Å; V89-I104 WeakPolarHBondContact CG1-O 3.35Å; V89-V347 HydrophobicContact CB-CG1 3.99Å; V89-V347 HydrophobicContact CB-CG2 3.84Å; V89-V347 HydrophobicContact CG1-CG2 3.83Å; V89-V347 HydrophobicContact CG2-CG1 4.1Å
90	E	48	Very low	39.6	Very low	37 Å²	37	107.8 Å²	107.8	17%	0.173	60%	0.597	C	S	.	*			trans	-101.6	145.8	-168.5	-164.2	158.6	-158.5	0	0	113.1	I72 E73 K74	I72-E90 VanDerWaalsContact O-CG 3.25Å; I72-E90 WeakPolarHBondContact O-CG 3.49Å; I72-E90 VanDerWaalsContact O-OE2 3.04Å; E73-E90 VanDerWaalsContact CA-OE2 3.27Å; E73-E90 WeakPolarHBondContact CA-OE2 3.09Å; K74-E90 WeakPolarHBondContact CA-OE1 3.38Å; K74-E90 WeakPolarHBondContact CB-OE1 3.48Å; K74-E90 VanDerWaalsContact CD-OE1 3.3Å; K74-E90 WeakPolarHBondContact CD-OE1 3.49Å; K74-E90 WeakPolarHBondContact CG-OE1 3.35Å; K74-E90 PolarHBondContact N-OE1 3.17Å; K74-E90 PolarHBondContact N-OE2 3.15Å
91	C	43.2	Very low	41.5	Very low	18 Å²	18	104.4 Å²	104.4	12%	0.122	57%	0.573	C	S	.	*			trans	-125.4	145.2	179.9	-74.7	0	0	0	0	111.5	N343	C91-N343 HydrophobicContact CB-CB 3.65Å; C91-N343 VanDerWaalsContact CB-CG 3.45Å; C91-N343 WeakPolarHBondContact CB-ND2 3.48Å; C91-N343 WeakPolarHBondContact SG-CB 3.04Å; C91-N343 VanDerWaalsContact SG-CG 3.6Å
92	T	41.6	Very low	44.3	Very low	16 Å²	16	97.4 Å²	97.4	10%	0.098	54%	0.536	C	S	.	.	P	Polyproline II helix	trans	-83.8	125.3	-173.2	57.4	0	0	0	0	113.5	P70 I72	P70-T92 HydrophobicContact CB-CG2 4.33Å; P70-T92 HydrophobicContact CG-CG2 4.25Å; P70-T92 WeakPolarHBondContact O-CG2 3.43Å; I72-T92 HydrophobicContact CB-CG2 4.37Å; I72-T92 HydrophobicContact CD1-CG2 4.43Å; I72-T92 HydrophobicContact CG1-CG2 3.94Å
93	E	42.1	Very low	47.1	Very low	100 Å²	100	92.3 Å²	92.3	47%	0.467	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-87.8	160.1	163.8	-70.6	-173	175.9	0	0	112.8	I72 T340	I72-E93 WeakPolarHBondContact CD1-O 3.48Å; E93-T340 PolarHBondContact OE1-OG1 3.38Å
94	S	40.5	Very low	50.2	Low	88 Å²	88	86.9 Å²	86.9	62%	0.615	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-89	128.2	-170.2	51.7	0	0	0	0	113.9
95	N	32.5	Very low	53.2	Low	109 Å²	109	80.4 Å²	80.4	58%	0.583	43%	0.427	S	S	*	.			trans	-113	165.7	158	31	16.5	0	0	0	110.3	F97	N95-F97 PolarHBondContact O-N 2.97Å
96	E	37.3	Very low	56.4	Low	200 Å²	200	73.9 Å²	73.9	94%	0.935	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-4.8	-159	-67.3	179.6	148.2	0	0	118.1
97	F	37.2	Very low	59.3	Low	198 Å²	198	71.8 Å²	71.8	87%	0.868	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	59.2	172.9	-85.7	-92.1	0	0	0	112.5	N95 M99	N95-F97 PolarHBondContact O-N 2.97Å; F97-M99 VanDerWaalsContact C-N 3.29Å; F97-M99 PolarHBondContact O-N 2.97Å
98	G	45.7	Very low	61.9	Low	70 Å²	70	63 Å²	63	72%	0.722	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	36	46.2	158.2	0	0	0	0	0	118
99	M	53.7	Low	64.5	Low	79 Å²	79	67.3 Å²	67.3	39%	0.389	35%	0.354	S	S	.	.			trans	-65.3	142.8	-171.3	-66	-121.3	75.3	0	0	112.5	P70 F97 K101	P70-M99 HydrophobicContact CB-CE 3.4Å; P70-M99 HydrophobicContact CB-SD 3.44Å; P70-M99 WeakPolarHBondContact CB-SD 3.47Å; P70-M99 HydrophobicContact CG-CB 4.33Å; P70-M99 HydrophobicContact CG-CE 3.52Å; P70-M99 HydrophobicContact CG-SD 3.75Å; F97-M99 VanDerWaalsContact C-N 3.29Å; F97-M99 PolarHBondContact O-N 2.97Å; M99-K101 PolarHBondContact O-N 2.9Å; M99-K101 VanDerWaalsContact O-N 3.13Å
100	I	62.3	Low	66.7	Low	54 Å²	54	69.3 Å²	69.3	28%	0.277	37%	0.367	S	S	.	.			trans	-64.1	110.2	171.2	-60.5	172.8	0	0	0	107.9	L58 L69 S102	L58-I100 HydrophobicContact CB-CG2 4.27Å; L58-I100 HydrophobicContact CD1-CG2 4.38Å; L69-I100 HydrophobicContact CD2-CG2 4.43Å; I100-S102 PolarHBondContact O-N 3.29Å
101	K	77.7	Confident	69	Low	40 Å²	40	68.1 Å²	68.1	17%	0.174	36%	0.362	C	S	.	.			trans	-68.5	126.9	169.7	-66.9	-165.5	176	-156.8	0	109.1	L58 N59 M99 F333 S334	L58-K101 WeakPolarHBondContact CA-O 3.34Å; N59-K101 PolarHBondContact N-O 3.32Å; M99-K101 PolarHBondContact O-N 2.9Å; M99-K101 VanDerWaalsContact O-N 3.13Å; K101-F333 HydrophobicContact CB-CD1 3.64Å; K101-F333 HydrophobicContact CB-CE1 4.21Å; K101-F333 WeakPolarHBondContact O-CE1 3.31Å; K101-S334 PolarHBondContact NZ-O 3.47Å
102	S	88.1	Confident	71.4	Confident	8 Å²	8	70.8 Å²	70.8	6%	0.056	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	154.7	177.7	67.5	0	0	0	0	111.7	L57 I100	L57-S102 CarbonylContact O-C 3.59Å; L57-S102 WeakPolarHBondContact O-CA 3.47Å; L57-S102 WeakPolarHBondContact O-CB 3.46Å; I100-S102 PolarHBondContact O-N 3.29Å
103	I	91	Very high	74	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.01	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.2	168.1	-57.7	-174.9	0	0	0	106.5	V56 L57 L105 L332 I346	V56-I103 WeakPolarHBondContact CA-O 3.31Å; L57-I103 HydrophobicContact CB-CB 4.4Å; L57-I103 HydrophobicContact CD1-CB 4.46Å; L57-I103 PolarHBondContact N-O 2.97Å; L57-I103 PolarHBondContact O-N 3.16Å; I103-L105 HydrophobicContact CG2-CD2 3.75Å; I103-L105 HydrophobicContact CG2-CG 4.05Å; I103-L332 HydrophobicContact CD1-CD2 3.65Å; I103-I346 HydrophobicContact CD1-CB 4.14Å; I103-I346 HydrophobicContact CD1-CG1 4.32Å; I103-I346 HydrophobicContact CD1-CG2 3.84Å; I103-I346 HydrophobicContact CG2-CG2 4.39Å
104	I	93.7	Very high	76.5	Confident	13 Å²	13	68.4 Å²	68.4	7%	0.067	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.9	179.2	-55.1	174.6	0	0	0	107.2	Y48 V54 V56 L69 I71 V89	Y48-I104 HydrophobicContact CE1-CB 4.38Å; Y48-I104 HydrophobicContact CE1-CG2 3.78Å; V54-I104 HydrophobicContact CB-CG2 3.83Å; V54-I104 HydrophobicContact CG1-CG2 3.83Å; V54-I104 HydrophobicContact CG2-CG2 4.28Å; V56-I104 HydrophobicContact CG2-CG1 4.35Å; V56-I104 HydrophobicContact CG2-CG2 4.48Å; L69-I104 HydrophobicContact CB-CD1 4.4Å; L69-I104 HydrophobicContact CD1-CD1 3.72Å; L69-I104 HydrophobicContact CD1-CG1 3.87Å; I71-I104 HydrophobicContact CD1-CD1 3.4Å; I71-I104 VanDerWaalsContact CD1-CD1 3.4Å; V89-I104 WeakPolarHBondContact CG1-O 3.35Å
105	L	95.5	Very high	79.1	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	136.7	-176.3	-60.1	174.5	0	0	0	109.1	V54 I55 L57 I103 R107 I124 V347 W350	V54-L105 CarbonylContact C-O 3.32Å; V54-L105 WeakPolarHBondContact CA-O 3.18Å; I55-L105 HydrophobicContact CB-CB 4.36Å; I55-L105 PolarHBondContact N-O 2.96Å; I55-L105 PolarHBondContact O-N 2.83Å; L57-L105 HydrophobicContact CD1-CD1 3.37Å; L57-L105 HydrophobicContact CD1-CG 4.11Å; I103-L105 HydrophobicContact CG2-CD2 3.75Å; I103-L105 HydrophobicContact CG2-CG 4.05Å; L105-R107 PolarHBondContact O-N 3.13Å; L105-I124 HydrophobicContact CD1-CD1 3.96Å; L105-V347 HydrophobicContact CD2-CG2 4.27Å; L105-W350 HydrophobicContact CB-CD2 4.17Å; L105-W350 HydrophobicContact CB-CG 4.17Å; L105-W350 HydrophobicContact CB-CZ2 4.45Å; L105-W350 HydrophobicContact CD1-CB 4.17Å; L105-W350 HydrophobicContact CD1-CD2 3.61Å; L105-W350 HydrophobicContact CD1-CE3 3.81Å; L105-W350 HydrophobicContact CD1-CG 3.75Å; L105-W350 HydrophobicContact CD1-CZ3 4.47Å; L105-W350 HydrophobicContact CD2-CB 3.98Å; L105-W350 HydrophobicContact CD2-CG 3.84Å; L105-W350 HydrophobicContact CG-CD2 4.31Å; L105-W350 HydrophobicContact CG-CG 4.13Å
106	P	96	Very high	82.2	Confident	69 Å²	69	62.1 Å²	62.1	45%	0.448	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	133.7	174.4	27.6	-33.4	0	0	0	109.4	P108 W350	P106-P108 WeakPolarHBondContact O-CD 3.45Å; P106-W350 PolarHBondContact O-NE1 2.85Å; P106-W350 VanDerWaalsContact O-NE1 3.12Å
107	R	97.3	Very high	85	Confident	39 Å²	39	52.6 Å²	52.6	15%	0.147	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-79.9	123.7	175	-174.3	177.2	72.7	-161.3	4.1	109.8	T35 P53 I55 L105 K109 A116	T35-R107 PolarHBondContact OG1-NH1 3.39Å; P53-R107 HydrophobicContact CB-CB 4.05Å; P53-R107 HydrophobicContact CG-CB 4.44Å; P53-R107 WeakPolarHBondContact O-CB 3.47Å; P53-R107 PolarHBondContact O-N 3.5Å; I55-R107 HydrophobicContact CD1-CB 4.32Å; I55-R107 HydrophobicContact CD1-CG 4.1Å; I55-R107 HydrophobicContact CG1-CB 4.2Å; I55-R107 HydrophobicContact CG1-CG 4.28Å; L105-R107 PolarHBondContact O-N 3.13Å; R107-K109 PolarHBondContact O-N 3.15Å; R107-A116 HydrophobicContact CG-CB 3.92Å
108	P	94.9	Very high	87.6	Confident	11 Å²	11	43.2 Å²	43.2	7%	0.071	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-57.1	136.9	172.4	-23.3	32.9	0	0	0	110.8	P106 T110 L111 W350 T354 I357	P106-P108 WeakPolarHBondContact O-CD 3.45Å; P108-T110 PolarHBondContact O-N 3.15Å; P108-L111 HydrophobicContact CB-CB 4.12Å; P108-L111 HydrophobicContact CG-CB 4.47Å; P108-L111 WeakPolarHBondContact O-CB 3.36Å; P108-L111 PolarHBondContact O-N 3.36Å; P108-L111 VanDerWaalsContact O-N 3.09Å; P108-W350 HydrophobicContact CG-CZ2 4.33Å; P108-T354 HydrophobicContact CB-CG2 4.16Å; P108-T354 HydrophobicContact CG-CG2 3.71Å; P108-I357 HydrophobicContact CG-CD1 4.35Å
109	K	91.3	Very high	89.9	Confident	214 Å²	214	39.9 Å²	39.9	93%	0.93	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-27.5	-177.9	-67.5	-179.1	-179.2	175.1	0	112.8	R107 L111	R107-K109 PolarHBondContact O-N 3.15Å; K109-L111 VanDerWaalsContact C-N 3.3Å
110	T	92.2	Very high	91.7	Very high	91 Å²	91	36.1 Å²	36.1	56%	0.558	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-17.1	178.4	57.4	0	0	0	0	112.8	P108 D358	P108-T110 PolarHBondContact O-N 3.15Å; T110-D358 WeakPolarHBondContact CB-OD1 3.37Å; T110-D358 WeakPolarHBondContact CG2-OD1 3.27Å; T110-D358 PolarHBondContact OG1-OD1 3.27Å
111	L	94.8	Very high	93.1	Very high	11 Å²	11	33.7 Å²	33.7	6%	0.058	17%	0.171	C	C	.	.	S	Bend	trans	-89.3	116.5	-172.9	-171.5	65.3	0	0	0	111.3	I55 P108 K109 K115 A116 I119 I357	I55-L111 HydrophobicContact CD1-CD2 4.1Å; P108-L111 HydrophobicContact CB-CB 4.12Å; P108-L111 HydrophobicContact CG-CB 4.47Å; P108-L111 WeakPolarHBondContact O-CB 3.36Å; P108-L111 PolarHBondContact O-N 3.36Å; P108-L111 VanDerWaalsContact O-N 3.09Å; K109-L111 VanDerWaalsContact C-N 3.3Å; L111-K115 HydrophobicContact CD1-CB 3.62Å; L111-K115 HydrophobicContact CD1-CD 4.45Å; L111-K115 HydrophobicContact CG-CB 4.25Å; L111-A116 HydrophobicContact CD2-CB 3.8Å; L111-A116 HydrophobicContact CG-CB 4.11Å; L111-I119 HydrophobicContact CD1-CD1 4.41Å; L111-I119 HydrophobicContact CD2-CD1 4.08Å; L111-I119 HydrophobicContact CD2-CG2 4.06Å; L111-I357 HydrophobicContact CB-CG2 4.12Å; L111-I357 HydrophobicContact CD1-CG2 3.86Å; L111-I357 HydrophobicContact CD2-CD1 4.3Å; L111-I357 HydrophobicContact CG-CG2 4.46Å
112	D	94.8	Very high	93.7	Very high	74 Å²	74	31.9 Å²	31.9	40%	0.396	16%	0.164	S	C	.	.			trans	-55.6	146.5	172.8	174.8	60.6	0	0	0	112	N114 K115 A116	D112-N114 VanDerWaalsContact C-N 3.28Å; D112-N114 PolarHBondContact O-N 2.98Å; D112-N114 WeakPolarHBondContact OD2-CB 3.46Å; D112-N114 PolarHBondContact OD2-N 2.87Å; D112-N114 PolarHBondContact OD2-ND2 3.28Å; D112-K115 HydrophobicContact CB-CG 4.49Å; D112-K115 PolarHBondContact O-N 2.66Å; D112-K115 VanDerWaalsContact O-N 3.12Å; D112-A116 WeakPolarHBondContact O-CB 3.46Å; D112-A116 PolarHBondContact O-N 3.45Å
113	V	96.4	Very high	93.9	Very high	32 Å²	32	31.6 Å²	31.6	19%	0.194	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-37.5	-175.3	-171.8	0	0	0	0	111.7	Q4 L5 T35 K115 A116 A117	Q4-V113 HydrophobicContact CB-CG1 3.69Å; Q4-V113 HydrophobicContact CG-CG1 4.47Å; L5-V113 HydrophobicContact CB-CG1 4.45Å; L5-V113 HydrophobicContact CD1-CB 4.32Å; L5-V113 HydrophobicContact CD1-CG1 3.86Å; L5-V113 HydrophobicContact CG-CG1 4.11Å; T35-V113 HydrophobicContact CG2-CG1 3.83Å; V113-K115 VanDerWaalsContact C-N 3.34Å; V113-K115 PolarHBondContact O-N 2.9Å; V113-A116 PolarHBondContact O-N 3.29Å; V113-A117 PolarHBondContact O-N 2.93Å; V113-A117 VanDerWaalsContact O-N 3.11Å
114	N	94.6	Very high	94.1	Very high	35 Å²	35	31.5 Å²	31.5	19%	0.187	16%	0.161	C	C	.	.	H	α-helix	trans	-65.6	-40.4	179.7	-58.7	-79.6	0	0	0	111.5	L5 D112 A117 V366 Q369	L5-N114 HydrophobicContact CD1-CB 4.14Å; L5-N114 WeakPolarHBondContact CD1-OD1 3.45Å; D112-N114 VanDerWaalsContact C-N 3.28Å; D112-N114 PolarHBondContact O-N 2.98Å; D112-N114 WeakPolarHBondContact OD2-CB 3.46Å; D112-N114 PolarHBondContact OD2-N 2.87Å; D112-N114 PolarHBondContact OD2-ND2 3.28Å; N114-A117 PolarHBondContact O-N 3.48Å; N114-V366 HydrophobicContact CB-CG2 3.91Å; N114-V366 WeakPolarHBondContact O-CG2 3.48Å; N114-Q369 PolarHBondContact OD1-NE2 3.09Å; N114-Q369 PolarHBondContact OD1-OE1 2.67Å
115	K	94.9	Very high	94	Very high	64 Å²	64	30.9 Å²	30.9	28%	0.278	16%	0.158	S	C	.	.	H	α-helix	trans	-71.7	-40	177.9	-62.4	-178.1	-176.8	174.3	0	110.9	L111 D112 V113 A117 I118 I119 D363 P364 V366	L111-K115 HydrophobicContact CD1-CB 3.62Å; L111-K115 HydrophobicContact CD1-CD 4.45Å; L111-K115 HydrophobicContact CG-CB 4.25Å; D112-K115 HydrophobicContact CB-CG 4.49Å; D112-K115 PolarHBondContact O-N 2.66Å; D112-K115 VanDerWaalsContact O-N 3.12Å; V113-K115 VanDerWaalsContact C-N 3.34Å; V113-K115 PolarHBondContact O-N 2.9Å; K115-A117 PolarHBondContact O-N 3.13Å; K115-I118 WeakPolarHBondContact O-CG1 3.41Å; K115-I118 PolarHBondContact O-N 3.24Å; K115-I119 VanDerWaalsContact O-CB 3.32Å; K115-I119 WeakPolarHBondContact O-CB 3.42Å; K115-I119 PolarHBondContact O-N 3.4Å; K115-I119 VanDerWaalsContact O-N 3.14Å; K115-D363 WeakPolarHBondContact CE-OD1 3.28Å; K115-D363 IonicContact NZ-OD1 3.47Å; K115-D363 PolarHBondContact NZ-OD1 2.84Å; K115-D363 IonicContact NZ-OD2 3.32Å; K115-P364 HydrophobicContact CB-CB 4.02Å; K115-P364 HydrophobicContact CB-CG 4.21Å; K115-P364 HydrophobicContact CG-CB 4.26Å; K115-V366 HydrophobicContact CG-CG2 4.36Å
116	A	96.9	Very high	93.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59	-32.6	175.3	0	0	0	0	0	113.4	T35 I55 R107 L111 D112 V113 I118	T35-A116 HydrophobicContact CG2-CB 4.08Å; I55-A116 HydrophobicContact CD1-CB 3.84Å; I55-A116 HydrophobicContact CG1-CB 4.04Å; R107-A116 HydrophobicContact CG-CB 3.92Å; L111-A116 HydrophobicContact CD2-CB 3.8Å; L111-A116 HydrophobicContact CG-CB 4.11Å; D112-A116 WeakPolarHBondContact O-CB 3.46Å; D112-A116 PolarHBondContact O-N 3.45Å; V113-A116 PolarHBondContact O-N 3.29Å; A116-I118 VanDerWaalsContact C-N 3.25Å; A116-I118 PolarHBondContact O-N 3.06Å
117	A	95.4	Very high	93.9	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.2	179.4	0	0	0	0	0	114.4	L5 G7 E33 T35 V113 N114 K115 V392	L5-A117 HydrophobicContact CB-CB 3.59Å; G7-A117 VanDerWaalsContact CA-O 3.27Å; G7-A117 WeakPolarHBondContact CA-O 3.21Å; G7-A117 PolarHBondContact N-O 3.46Å; E33-A117 WeakPolarHBondContact CG-O 3.02Å; T35-A117 HydrophobicContact CG2-CB 3.9Å; V113-A117 PolarHBondContact O-N 2.93Å; V113-A117 VanDerWaalsContact O-N 3.11Å; N114-A117 PolarHBondContact O-N 3.48Å; K115-A117 PolarHBondContact O-N 3.13Å; A117-V392 HydrophobicContact CB-CG1 4.17Å; A117-V392 HydrophobicContact CB-CG2 4.45Å
118	I	92.6	Very high	93.8	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.01	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-15	-169.4	61.6	152.7	0	0	0	114.1	K115 A116 A122 P364 L365 V366 K390 V392	K115-I118 WeakPolarHBondContact O-CG1 3.41Å; K115-I118 PolarHBondContact O-N 3.24Å; A116-I118 VanDerWaalsContact C-N 3.25Å; A116-I118 PolarHBondContact O-N 3.06Å; I118-A122 VanDerWaalsContact O-CB 3.28Å; I118-A122 WeakPolarHBondContact O-CB 3.28Å; I118-A122 PolarHBondContact O-N 3.23Å; I118-P364 HydrophobicContact CD1-CB 3.86Å; I118-P364 HydrophobicContact CG1-CB 4.29Å; I118-L365 WeakPolarHBondContact CD1-O 3.38Å; I118-V366 HydrophobicContact CD1-CG2 3.75Å; I118-V366 HydrophobicContact CG1-CG2 4.24Å; I118-K390 HydrophobicContact CB-CB 3.65Å; I118-K390 HydrophobicContact CB-CD 4.29Å; I118-K390 HydrophobicContact CB-CG 3.92Å; I118-K390 HydrophobicContact CD1-CB 3.73Å; I118-K390 HydrophobicContact CD1-CG 4.12Å; I118-K390 HydrophobicContact CG1-CB 4.28Å; I118-K390 HydrophobicContact CG2-CB 3.52Å; I118-K390 HydrophobicContact CG2-CG 4.3Å; I118-V392 HydrophobicContact CG2-CG2 3.38Å
119	I	93	Very high	93.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-72.3	-37.4	-163.6	-170	175.3	0	0	0	111.4	I55 L111 K115 A122 Y123 W350 I357 P364	I55-I119 HydrophobicContact CD1-CG2 3.85Å; L111-I119 HydrophobicContact CD1-CD1 4.41Å; L111-I119 HydrophobicContact CD2-CD1 4.08Å; L111-I119 HydrophobicContact CD2-CG2 4.06Å; K115-I119 VanDerWaalsContact O-CB 3.32Å; K115-I119 WeakPolarHBondContact O-CB 3.42Å; K115-I119 PolarHBondContact O-N 3.4Å; K115-I119 VanDerWaalsContact O-N 3.14Å; I119-A122 PolarHBondContact O-N 3.45Å; I119-A122 VanDerWaalsContact O-N 3.11Å; I119-Y123 HydrophobicContact CB-CD2 4.48Å; I119-Y123 HydrophobicContact CG1-CD2 3.57Å; I119-Y123 HydrophobicContact CG1-CE2 4.31Å; I119-Y123 HydrophobicContact CG1-CG 3.99Å; I119-Y123 WeakPolarHBondContact O-CB 3.36Å; I119-Y123 PolarHBondContact O-N 3.22Å; I119-W350 HydrophobicContact CD1-CH2 4.34Å; I119-W350 HydrophobicContact CD1-CZ3 4.4Å; I119-W350 HydrophobicContact CG1-CZ3 4.41Å; I119-W350 HydrophobicContact CG2-CH2 3.58Å; I119-W350 HydrophobicContact CG2-CZ3 3.86Å; I119-I357 HydrophobicContact CD1-CD1 3.19Å; I119-I357 HydrophobicContact CD1-CG1 3.84Å; I119-P364 HydrophobicContact CB-CG 4.18Å; I119-P364 HydrophobicContact CD1-CG 3.62Å; I119-P364 HydrophobicContact CG1-CG 3.77Å
120	S	92.6	Very high	94	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-57.4	-56.5	-175.5	34.9	0	0	0	0	112.4	E33 A122 I124	E33-S120 PolarHBondContact OE2-OG 2.98Å; S120-A122 VanDerWaalsContact C-N 3.27Å; S120-A122 PolarHBondContact O-N 3.13Å; S120-I124 VanDerWaalsContact O-CB 3.3Å; S120-I124 WeakPolarHBondContact O-CB 3.41Å; S120-I124 WeakPolarHBondContact O-CG1 3.19Å; S120-I124 PolarHBondContact O-N 2.97Å
121	F	90.6	Very high	94.2	Very high	2 Å²	2	15.4 Å²	15.4	1%	0.009	7%	0.074	C	C	.	.	H	α-helix	trans	-76.4	-13.8	177.5	-87.6	-115.7	0	0	0	112.6	N9 L11 S32 E33 L57 P125 I151 L328 L332	N9-F121 WeakPolarHBondContact OD1-CB 3.12Å; L11-F121 HydrophobicContact CD2-CE1 3.75Å; L11-F121 HydrophobicContact CD2-CZ 4.33Å; S32-F121 WeakPolarHBondContact O-CE2 3.35Å; E33-F121 HydrophobicContact CB-CD2 3.64Å; E33-F121 HydrophobicContact CB-CE2 4.07Å; E33-F121 HydrophobicContact CB-CG 4.47Å; E33-F121 HydrophobicContact CG-CD2 4.33Å; E33-F121 VanDerWaalsContact OE2-CB 3.3Å; E33-F121 WeakPolarHBondContact OE2-CB 3.42Å; E33-F121 PolarHBondContact OE2-N 2.86Å; L57-F121 HydrophobicContact CB-CE2 4.01Å; L57-F121 HydrophobicContact CD2-CD2 3.78Å; L57-F121 HydrophobicContact CD2-CE2 3.68Å; L57-F121 HydrophobicContact CG-CD2 4.15Å; L57-F121 HydrophobicContact CG-CE2 3.96Å; F121-P125 WeakPolarHBondContact O-CD 3.41Å; F121-P125 WeakPolarHBondContact O-CG 3.35Å; F121-I151 VanDerWaalsContact O-CB 3.32Å; F121-I151 WeakPolarHBondContact O-CB 3.16Å; F121-L328 HydrophobicContact CD1-CD2 4.05Å; F121-L328 HydrophobicContact CD2-CD2 4.41Å; F121-L328 HydrophobicContact CE1-CD2 4.25Å; F121-L328 HydrophobicContact CG-CD2 4.14Å; F121-L332 HydrophobicContact CZ-CD1 4.48Å
122	A	90.2	Very high	94.2	Very high	3 Å²	3	19.6 Å²	19.6	3%	0.025	9%	0.093	C	C	.	.	H	α-helix	trans	-85.7	-41	175.6	0	0	0	0	0	113.4	I118 I119 S120 A126 I151 A206	I118-A122 VanDerWaalsContact O-CB 3.28Å; I118-A122 WeakPolarHBondContact O-CB 3.28Å; I118-A122 PolarHBondContact O-N 3.23Å; I119-A122 PolarHBondContact O-N 3.45Å; I119-A122 VanDerWaalsContact O-N 3.11Å; S120-A122 VanDerWaalsContact C-N 3.27Å; S120-A122 PolarHBondContact O-N 3.13Å; A122-A126 WeakPolarHBondContact O-CB 3.36Å; A122-I151 WeakPolarHBondContact O-CD1 3.17Å; A122-I151 WeakPolarHBondContact O-CG1 3.34Å; A122-A206 HydrophobicContact CB-CB 4.26Å; A122-A206 WeakPolarHBondContact O-CB 3.47Å
123	Y	93.9	Very high	94.1	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-107.4	-32	-166	-79.1	-96.9	0	0	0	113.6	I119 A126 Y127 A206 Q209 L210 L353 I362 D363 P364	I119-Y123 HydrophobicContact CB-CD2 4.48Å; I119-Y123 HydrophobicContact CG1-CD2 3.57Å; I119-Y123 HydrophobicContact CG1-CE2 4.31Å; I119-Y123 HydrophobicContact CG1-CG 3.99Å; I119-Y123 WeakPolarHBondContact O-CB 3.36Å; I119-Y123 PolarHBondContact O-N 3.22Å; Y123-A126 PolarHBondContact O-N 2.91Å; Y123-Y127 VanDerWaalsContact O-CB 3.26Å; Y123-Y127 WeakPolarHBondContact O-CB 3.26Å; Y123-Y127 PolarHBondContact O-N 2.91Å; Y123-A206 HydrophobicContact CD1-CB 4.07Å; Y123-A206 HydrophobicContact CD2-CB 3.94Å; Y123-A206 HydrophobicContact CE1-CB 3.9Å; Y123-A206 HydrophobicContact CE2-CB 3.79Å; Y123-A206 HydrophobicContact CG-CB 4.09Å; Y123-Q209 VanDerWaalsContact OH-CD 3.29Å; Y123-Q209 PolarHBondContact OH-OE1 3.02Å; Y123-L210 HydrophobicContact CD1-CD1 4.12Å; Y123-L210 HydrophobicContact CD1-CD2 4.46Å; Y123-L210 HydrophobicContact CD1-CG 4.16Å; Y123-L210 HydrophobicContact CE1-CG 4.43Å; Y123-L353 HydrophobicContact CD1-CD2 4.26Å; Y123-I362 HydrophobicContact CD1-CD1 3.65Å; Y123-I362 HydrophobicContact CE1-CB 3.83Å; Y123-I362 HydrophobicContact CE1-CD1 3.81Å; Y123-I362 HydrophobicContact CE1-CG1 4.32Å; Y123-I362 HydrophobicContact CE1-CG2 4.07Å; Y123-I362 HydrophobicContact CG-CD1 4.41Å; Y123-D363 PolarHBondContact OH-O 2.81Å; Y123-P364 HydrophobicContact CD2-CG 4.29Å; Y123-P364 HydrophobicContact CE2-CB 3.76Å; Y123-P364 HydrophobicContact CE2-CG 3.7Å
124	I	94	Very high	94	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-59	-51.1	174	-66.9	168.2	0	0	0	110.8	L57 L105 S120 A126 Y127 I128 L328 I346 V349 W350 L353	L57-I124 HydrophobicContact CD1-CD1 4.13Å; L57-I124 HydrophobicContact CD2-CD1 4.02Å; L105-I124 HydrophobicContact CD1-CD1 3.96Å; S120-I124 VanDerWaalsContact O-CB 3.3Å; S120-I124 WeakPolarHBondContact O-CB 3.41Å; S120-I124 WeakPolarHBondContact O-CG1 3.19Å; S120-I124 PolarHBondContact O-N 2.97Å; I124-A126 VanDerWaalsContact C-N 3.3Å; I124-A126 PolarHBondContact O-N 3.34Å; I124-Y127 PolarHBondContact O-N 2.97Å; I124-I128 HydrophobicContact CG2-CD1 3.83Å; I124-I128 VanDerWaalsContact O-CG1 3.3Å; I124-I128 WeakPolarHBondContact O-CG1 3.46Å; I124-I128 PolarHBondContact O-N 3.04Å; I124-I128 VanDerWaalsContact O-N 3.08Å; I124-L328 HydrophobicContact CG2-CD1 3.94Å; I124-I346 HydrophobicContact CD1-CG2 4.14Å; I124-I346 HydrophobicContact CG2-CD1 3.73Å; I124-I346 HydrophobicContact CG2-CG2 4.46Å; I124-V349 HydrophobicContact CB-CG1 4.43Å; I124-V349 HydrophobicContact CG1-CG1 4.35Å; I124-V349 HydrophobicContact CG2-CG1 4.16Å; I124-W350 HydrophobicContact CD1-CE3 4.26Å; I124-W350 HydrophobicContact CG1-CE3 4.38Å; I124-L353 HydrophobicContact CG1-CD1 3.81Å
125	P	92.5	Very high	94	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-70.1	-28.4	178.3	14.6	-8.1	0	0	0	112.5	F121 L129 I151 F326 L328	F121-P125 WeakPolarHBondContact O-CD 3.41Å; F121-P125 WeakPolarHBondContact O-CG 3.35Å; P125-L129 VanDerWaalsContact O-CB 3.3Å; P125-L129 WeakPolarHBondContact O-CB 3.47Å; P125-L129 WeakPolarHBondContact O-CD1 3.42Å; P125-L129 WeakPolarHBondContact O-CG 3.36Å; P125-L129 PolarHBondContact O-N 2.88Å; P125-I151 HydrophobicContact CB-CD1 3.54Å; P125-I151 HydrophobicContact CB-CG2 3.98Å; P125-I151 HydrophobicContact CG-CB 3.93Å; P125-I151 HydrophobicContact CG-CD1 3.42Å; P125-I151 VanDerWaalsContact CG-CD1 3.42Å; P125-I151 HydrophobicContact CG-CG1 4.13Å; P125-I151 HydrophobicContact CG-CG2 3.81Å; P125-F326 HydrophobicContact CB-CE1 3.48Å; P125-F326 VanDerWaalsContact CB-CE1 3.48Å; P125-F326 HydrophobicContact CB-CZ 4.08Å; P125-L328 HydrophobicContact CB-CB 4.16Å; P125-L328 HydrophobicContact CB-CD2 4.35Å; P125-L328 HydrophobicContact CG-CB 4.23Å; P125-L328 HydrophobicContact CG-CD2 3.63Å; P125-L328 HydrophobicContact CG-CG 4.36Å
126	A	93.5	Very high	94.1	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-66.9	-42.2	176.9	0	0	0	0	0	111	A122 Y123 I124 L129 T130 I151 A206 L207 L210	A122-A126 WeakPolarHBondContact O-CB 3.36Å; Y123-A126 PolarHBondContact O-N 2.91Å; I124-A126 VanDerWaalsContact C-N 3.3Å; I124-A126 PolarHBondContact O-N 3.34Å; A126-L129 PolarHBondContact O-N 3.2Å; A126-T130 VanDerWaalsContact O-CB 3.28Å; A126-T130 WeakPolarHBondContact O-CB 3.39Å; A126-T130 PolarHBondContact O-N 2.86Å; A126-T130 PolarHBondContact O-OG1 2.81Å; A126-I151 HydrophobicContact CB-CD1 3.67Å; A126-A206 HydrophobicContact CB-CB 3.94Å; A126-L207 HydrophobicContact CB-CD2 3.94Å; A126-L207 HydrophobicContact CB-CG 4.1Å; A126-L210 HydrophobicContact CB-CD1 3.58Å
127	Y	95.7	Very high	94	Very high	30 Å²	30	21.3 Å²	21.3	12%	0.118	10%	0.1	C	C	.	.	H	α-helix	trans	-64	-49	177.8	-171.7	-81.5	0	0	0	111	Y123 I124 L129 T130 Y131 H132 V349 E352 L353	Y123-Y127 VanDerWaalsContact O-CB 3.26Å; Y123-Y127 WeakPolarHBondContact O-CB 3.26Å; Y123-Y127 PolarHBondContact O-N 2.91Å; I124-Y127 PolarHBondContact O-N 2.97Å; Y127-L129 VanDerWaalsContact C-N 3.34Å; Y127-L129 PolarHBondContact O-N 2.9Å; Y127-T130 PolarHBondContact O-N 3.36Å; Y127-Y131 AromaticContact CD1-CD2 3.98Å; Y127-Y131 HydrophobicContact CD1-CD2 3.98Å; Y127-Y131 AromaticContact CD2-CD2 3.52Å; Y127-Y131 HydrophobicContact CD2-CD2 3.52Å; Y127-Y131 AromaticContact CD2-CE2 3.6Å; Y127-Y131 HydrophobicContact CD2-CE2 3.6Å; Y127-Y131 AromaticContact CE1-CD2 3.93Å; Y127-Y131 HydrophobicContact CE1-CD2 3.93Å; Y127-Y131 HydrophobicContact CE1-CG 4.41Å; Y127-Y131 AromaticContact CE2-CD2 3.46Å; Y127-Y131 HydrophobicContact CE2-CD2 3.46Å; Y127-Y131 VanDerWaalsContact CE2-CD2 3.46Å; Y127-Y131 AromaticContact CE2-CE2 3.55Å; Y127-Y131 HydrophobicContact CE2-CE2 3.55Å; Y127-Y131 HydrophobicContact CE2-CG 4.4Å; Y127-Y131 AromaticContact CG-CD2 3.77Å; Y127-Y131 HydrophobicContact CG-CD2 3.77Å; Y127-Y131 HydrophobicContact CG-CE2 4.27Å; Y127-Y131 AromaticContact CZ-CD2 3.67Å; Y127-Y131 WeakPolarHBondContact O-CD2 3.49Å; Y127-Y131 PolarHBondContact O-N 2.81Å; Y127-H132 AromaticContact CE1-CD2 3.92Å; Y127-H132 AromaticContact CE1-NE2 3.55Å; Y127-V349 HydrophobicContact CD1-CB 4.26Å; Y127-V349 HydrophobicContact CD1-CG1 3.62Å; Y127-V349 HydrophobicContact CD1-CG2 3.9Å; Y127-V349 HydrophobicContact CE1-CG1 4.38Å; Y127-V349 HydrophobicContact CE1-CG2 4.14Å; Y127-V349 HydrophobicContact CG-CG1 3.87Å; Y127-E352 HydrophobicContact CE2-CB 3.9Å; Y127-L353 HydrophobicContact CD2-CD2 3.94Å; Y127-L353 HydrophobicContact CD2-CG 4.29Å; Y127-L353 HydrophobicContact CG-CD2 4.45Å
128	I	95	Very high	94.1	Very high	5 Å²	5	24.6 Å²	24.6	3%	0.026	12%	0.123	C	C	.	.	I	π-helix	trans	-59.5	-46	177.1	-65.1	166.9	0	0	0	110.6	I124 T130 H132 I133 F326 L331 F345 I346 V349	I124-I128 HydrophobicContact CG2-CD1 3.83Å; I124-I128 VanDerWaalsContact O-CG1 3.3Å; I124-I128 WeakPolarHBondContact O-CG1 3.46Å; I124-I128 PolarHBondContact O-N 3.04Å; I124-I128 VanDerWaalsContact O-N 3.08Å; I128-T130 PolarHBondContact O-N 3.12Å; I128-H132 HydrophobicContact CG2-CB 4.31Å; I128-H132 CarbonylContact O-C 2.97Å; I128-H132 WeakPolarHBondContact O-CA 3.28Å; I128-H132 WeakPolarHBondContact O-CB 3.33Å; I128-H132 PolarHBondContact O-N 3.43Å; I128-I133 HydrophobicContact CG2-CD1 3.83Å; I128-I133 HydrophobicContact CG2-CG1 3.97Å; I128-I133 PolarHBondContact O-N 3.31Å; I128-F326 HydrophobicContact CB-CE2 4.4Å; I128-F326 HydrophobicContact CB-CZ 3.94Å; I128-F326 HydrophobicContact CD1-CE2 4.49Å; I128-F326 HydrophobicContact CD1-CZ 4.01Å; I128-F326 HydrophobicContact CG2-CD2 4.39Å; I128-F326 HydrophobicContact CG2-CE1 4.48Å; I128-F326 HydrophobicContact CG2-CE2 3.65Å; I128-F326 HydrophobicContact CG2-CZ 3.7Å; I128-L331 HydrophobicContact CD1-CD2 3.99Å; I128-F345 HydrophobicContact CD1-CE1 3.8Å; I128-F345 HydrophobicContact CD1-CZ 4.39Å; I128-F345 HydrophobicContact CG1-CE1 3.87Å; I128-F345 HydrophobicContact CG1-CZ 3.94Å; I128-I346 HydrophobicContact CD1-CD1 3.95Å; I128-V349 HydrophobicContact CG1-CG2 4.15Å
129	L	94.1	Very high	94.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.142	C	C	.	.	I	π-helix	trans	-60.9	-43.7	177.1	-75.6	166	0	0	0	112.1	P125 A126 Y127 I133 L134 L207 L261 V283 Y285 F326	P125-L129 VanDerWaalsContact O-CB 3.3Å; P125-L129 WeakPolarHBondContact O-CB 3.47Å; P125-L129 WeakPolarHBondContact O-CD1 3.42Å; P125-L129 WeakPolarHBondContact O-CG 3.36Å; P125-L129 PolarHBondContact O-N 2.88Å; A126-L129 PolarHBondContact O-N 3.2Å; Y127-L129 VanDerWaalsContact C-N 3.34Å; Y127-L129 PolarHBondContact O-N 2.9Å; L129-I133 HydrophobicContact CD2-CD1 4.08Å; L129-L134 WeakPolarHBondContact O-CB 3.49Å; L129-L134 VanDerWaalsContact O-CG 3.31Å; L129-L134 WeakPolarHBondContact O-CG 3.22Å; L129-L134 PolarHBondContact O-N 2.91Å; L129-L207 HydrophobicContact CB-CD2 3.98Å; L129-L207 HydrophobicContact CD1-CD2 4.11Å; L129-L261 HydrophobicContact CB-CD2 4.35Å; L129-L261 HydrophobicContact CD1-CD2 4.22Å; L129-L261 HydrophobicContact CD2-CD2 3.86Å; L129-L261 HydrophobicContact CG-CD2 4.38Å; L129-V283 HydrophobicContact CD2-CG1 3.54Å; L129-Y285 HydrophobicContact CD1-CD1 4.33Å; L129-Y285 HydrophobicContact CD1-CD2 3.73Å; L129-Y285 HydrophobicContact CD1-CE2 4.31Å; L129-Y285 HydrophobicContact CD1-CG 3.72Å; L129-Y285 HydrophobicContact CD2-CG 4.44Å; L129-F326 HydrophobicContact CD1-CD1 3.99Å; L129-F326 HydrophobicContact CD1-CE1 4.32Å; L129-F326 HydrophobicContact CD2-CB 3.92Å; L129-F326 HydrophobicContact CD2-CD1 3.67Å; L129-F326 HydrophobicContact CD2-CE1 4.46Å; L129-F326 HydrophobicContact CD2-CG 4.03Å; L129-F326 HydrophobicContact CG-CD1 3.66Å; L129-F326 HydrophobicContact CG-CE1 3.99Å; L129-F326 HydrophobicContact CG-CG 4.43Å
130	T	95.4	Very high	94.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.149	C	C	.	.	I	π-helix	trans	-70.9	-54.2	-176.1	-57.8	0	0	0	0	112	A126 Y127 I128 N135 I136 M211 I214	A126-T130 VanDerWaalsContact O-CB 3.28Å; A126-T130 WeakPolarHBondContact O-CB 3.39Å; A126-T130 PolarHBondContact O-N 2.86Å; A126-T130 PolarHBondContact O-OG1 2.81Å; Y127-T130 PolarHBondContact O-N 3.36Å; I128-T130 PolarHBondContact O-N 3.12Å; T130-N135 PolarHBondContact O-N 2.71Å; T130-I136 HydrophobicContact CG2-CB 4.43Å; T130-I136 HydrophobicContact CG2-CG1 4.28Å; T130-I136 PolarHBondContact O-N 3.11Å; T130-I136 VanDerWaalsContact O-N 3.09Å; T130-M211 HydrophobicContact CG2-CE 4.35Å; T130-M211 HydrophobicContact CG2-CG 3.69Å; T130-I214 HydrophobicContact CG2-CD1 3.86Å
131	Y	96.4	Very high	94.8	Very high	64 Å²	64	28.5 Å²	28.5	25%	0.251	15%	0.153	S	C	.	.	I	π-helix	trans	-96.3	-29.9	-168.2	-62.8	-72.4	0	0	0	113.7	Y127 L210 I214	Y127-Y131 AromaticContact CD1-CD2 3.98Å; Y127-Y131 HydrophobicContact CD1-CD2 3.98Å; Y127-Y131 AromaticContact CD2-CD2 3.52Å; Y127-Y131 HydrophobicContact CD2-CD2 3.52Å; Y127-Y131 AromaticContact CD2-CE2 3.6Å; Y127-Y131 HydrophobicContact CD2-CE2 3.6Å; Y127-Y131 AromaticContact CE1-CD2 3.93Å; Y127-Y131 HydrophobicContact CE1-CD2 3.93Å; Y127-Y131 HydrophobicContact CE1-CG 4.41Å; Y127-Y131 AromaticContact CE2-CD2 3.46Å; Y127-Y131 HydrophobicContact CE2-CD2 3.46Å; Y127-Y131 VanDerWaalsContact CE2-CD2 3.46Å; Y127-Y131 AromaticContact CE2-CE2 3.55Å; Y127-Y131 HydrophobicContact CE2-CE2 3.55Å; Y127-Y131 HydrophobicContact CE2-CG 4.4Å; Y127-Y131 AromaticContact CG-CD2 3.77Å; Y127-Y131 HydrophobicContact CG-CD2 3.77Å; Y127-Y131 HydrophobicContact CG-CE2 4.27Å; Y127-Y131 AromaticContact CZ-CD2 3.67Å; Y127-Y131 WeakPolarHBondContact O-CD2 3.49Å; Y127-Y131 PolarHBondContact O-N 2.81Å; Y131-L210 PolarHBondContact OH-O 2.87Å; Y131-I214 HydrophobicContact CE1-CD1 3.88Å; Y131-I214 HydrophobicContact CE1-CG1 4.13Å
132	H	95	Very high	95.1	Very high	99 Å²	99	28.4 Å²	28.4	46%	0.458	15%	0.153	S	C	.	.	I	π-helix	trans	-104.2	-40.7	-173.4	-66.2	-85.2	0	0	0	113.6	Y127 I128 F345	Y127-H132 AromaticContact CE1-CD2 3.92Å; Y127-H132 AromaticContact CE1-NE2 3.55Å; I128-H132 HydrophobicContact CG2-CB 4.31Å; I128-H132 CarbonylContact O-C 2.97Å; I128-H132 WeakPolarHBondContact O-CA 3.28Å; I128-H132 WeakPolarHBondContact O-CB 3.33Å; I128-H132 PolarHBondContact O-N 3.43Å; H132-F345 AromaticContact CD2-CZ 3.87Å; H132-F345 AromaticContact CE1-CE2 3.56Å; H132-F345 AromaticContact CG-CZ 3.91Å; H132-F345 AromaticContact ND1-CE2 3.86Å; H132-F345 AromaticContact NE2-CE2 3.71Å; H132-F345 AromaticContact NE2-CZ 3.94Å
133	I	93.7	Very high	95.4	Very high	48 Å²	48	28.3 Å²	28.3	25%	0.246	15%	0.152	C	C	.	.	I	π-helix	trans	-91	-56	-175.6	-59.2	-179.3	0	0	0	111	I128 L129 V283 F326	I128-I133 HydrophobicContact CG2-CD1 3.83Å; I128-I133 HydrophobicContact CG2-CG1 3.97Å; I128-I133 PolarHBondContact O-N 3.31Å; L129-I133 HydrophobicContact CD2-CD1 4.08Å; I133-V283 HydrophobicContact CG2-CG1 4.1Å; I133-V283 HydrophobicContact CG2-CG2 3.69Å; I133-F326 HydrophobicContact CD1-CB 3.67Å; I133-F326 HydrophobicContact CD1-CD1 4.26Å; I133-F326 HydrophobicContact CD1-CD2 3.3Å; I133-F326 HydrophobicContact CD1-CE2 3.96Å; I133-F326 HydrophobicContact CD1-CG 3.48Å; I133-F326 VanDerWaalsContact CD1-CG 3.48Å
134	L	94.7	Very high	95.3	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	15%	0.151	C	C	.	.	S	Bend	trans	-78.3	-29.2	177.9	-66.7	175.7	0	0	0	112.2	L129 I136 M211 A259 L261 K281 V283	L129-L134 WeakPolarHBondContact O-CB 3.49Å; L129-L134 VanDerWaalsContact O-CG 3.31Å; L129-L134 WeakPolarHBondContact O-CG 3.22Å; L129-L134 PolarHBondContact O-N 2.91Å; L134-I136 HydrophobicContact CB-CD1 3.51Å; L134-I136 HydrophobicContact CB-CG1 3.89Å; L134-I136 HydrophobicContact CD1-CD1 3.98Å; L134-I136 HydrophobicContact CD1-CG1 4.43Å; L134-I136 HydrophobicContact CG-CD1 4.36Å; L134-M211 HydrophobicContact CD1-CE 3.89Å; L134-A259 HydrophobicContact CD1-CB 4.32Å; L134-A259 HydrophobicContact CD2-CB 3.82Å; L134-L261 HydrophobicContact CD1-CD1 3.7Å; L134-L261 HydrophobicContact CD1-CD2 3.76Å; L134-L261 HydrophobicContact CD1-CG 3.62Å; L134-L261 HydrophobicContact CG-CD2 4.49Å; L134-K281 HydrophobicContact CD2-CB 3.76Å; L134-K281 HydrophobicContact CD2-CD 4.33Å; L134-K281 WeakPolarHBondContact O-CD 3.4Å; L134-K281 PolarHBondContact O-NZ 3.37Å; L134-V283 HydrophobicContact CD2-CB 4.17Å; L134-V283 HydrophobicContact CD2-CG2 3.41Å; L134-V283 VanDerWaalsContact CD2-CG2 3.41Å; L134-V283 HydrophobicContact CG-CG2 4.19Å
135	N	94.6	Very high	94.9	Very high	78 Å²	78	28.9 Å²	28.9	42%	0.417	15%	0.154	S	C	.	.			trans	48.6	64.6	-174.8	-171.8	33.4	0	0	0	110.4	T130 H137	T130-N135 PolarHBondContact O-N 2.71Å; N135-H137 PolarHBondContact ND2-CE1 3.3Å; N135-H137 VanDerWaalsContact ND2-CE1 3.3Å; N135-H137 PolarHBondContact O-CE1 2.8Å; N135-H137 PolarHBondContact O-ND1 3.39Å
136	I	95.9	Very high	94.3	Very high	13 Å²	13	29.2 Å²	29.2	7%	0.067	16%	0.157	C	C	.	.			trans	-69.8	137.5	-175.3	-60.6	-54.5	0	0	0	111.1	T130 L134 D140 I142 M211 I214 V217	T130-I136 HydrophobicContact CG2-CB 4.43Å; T130-I136 HydrophobicContact CG2-CG1 4.28Å; T130-I136 PolarHBondContact O-N 3.11Å; T130-I136 VanDerWaalsContact O-N 3.09Å; L134-I136 HydrophobicContact CB-CD1 3.51Å; L134-I136 HydrophobicContact CB-CG1 3.89Å; L134-I136 HydrophobicContact CD1-CD1 3.98Å; L134-I136 HydrophobicContact CD1-CG1 4.43Å; L134-I136 HydrophobicContact CG-CD1 4.36Å; I136-D140 WeakPolarHBondContact CA-OD2 3.3Å; I136-D140 HydrophobicContact CG2-CB 4.2Å; I136-I142 HydrophobicContact CD1-CD1 3.4Å; I136-I142 VanDerWaalsContact CD1-CD1 3.4Å; I136-I142 HydrophobicContact CD1-CG1 4.11Å; I136-M211 HydrophobicContact CG1-CE 4.01Å; I136-I214 HydrophobicContact CB-CD1 3.7Å; I136-I214 HydrophobicContact CG2-CD1 3.63Å; I136-V217 HydrophobicContact CG2-CG1 4.39Å; I136-V217 HydrophobicContact CG2-CG2 3.74Å
137	H	95.5	Very high	93.5	Very high	100 Å²	100	29.2 Å²	29.2	46%	0.463	16%	0.157	S	C	.	.			trans	-119.2	167.7	178	-57.6	86.6	0	0	0	112.1	N135 G139 D140 V217	N135-H137 PolarHBondContact ND2-CE1 3.3Å; N135-H137 VanDerWaalsContact ND2-CE1 3.3Å; N135-H137 PolarHBondContact O-CE1 2.8Å; N135-H137 PolarHBondContact O-ND1 3.39Å; H137-G139 PolarHBondContact O-N 3.45Å; H137-D140 PolarHBondContact N-OD2 3.34Å; H137-D140 WeakPolarHBondContact O-CB 3.17Å; H137-D140 VanDerWaalsContact O-CG 3.3Å; H137-D140 PolarHBondContact O-N 3.28Å; H137-V217 WeakPolarHBondContact O-CG2 3.44Å
138	S	97.4	Very high	92.1	Very high	69 Å²	69	28 Å²	28	48%	0.483	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	129.5	175.2	162.9	0	0	0	0	111.4	P215 N216	S138-P215 WeakPolarHBondContact CA-O 3.16Å; S138-P215 WeakPolarHBondContact CB-O 3.4Å; S138-P215 PolarHBondContact OG-O 3.44Å; S138-P215 VanDerWaalsContact OG-O 3.12Å; S138-N216 PolarHBondContact OG-ND2 2.61Å; S138-N216 VanDerWaalsContact OG-ND2 3.16Å
139	G	96.4	Very high	90.5	Very high	39 Å²	39	27.8 Å²	27.8	40%	0.402	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.5	-7.1	-179.5	0	0	0	0	0	114.4	H137 N216	H137-G139 PolarHBondContact O-N 3.45Å; G139-N216 VanDerWaalsContact CA-O 3.22Å; G139-N216 WeakPolarHBondContact CA-O 3.37Å; G139-N216 PolarHBondContact N-O 2.88Å
140	D	98	Very high	88.2	Confident	28 Å²	28	27.8 Å²	27.8	15%	0.15	15%	0.153	C	C	.	.			trans	-65.9	144.5	178.2	-70.3	-7.9	0	0	0	111.6	I136 H137 I142 V217 T218 D258	I136-D140 WeakPolarHBondContact CA-OD2 3.3Å; I136-D140 HydrophobicContact CG2-CB 4.2Å; H137-D140 PolarHBondContact N-OD2 3.34Å; H137-D140 WeakPolarHBondContact O-CB 3.17Å; H137-D140 VanDerWaalsContact O-CG 3.3Å; H137-D140 PolarHBondContact O-N 3.28Å; D140-I142 HydrophobicContact CB-CD1 3.89Å; D140-I142 HydrophobicContact CB-CG1 4.37Å; D140-V217 WeakPolarHBondContact O-CA 3.29Å; D140-T218 PolarHBondContact O-N 2.86Å; D140-D258 HydrophobicContact CB-CB 4.03Å
141	I	98.2	Very high	86.1	Confident	17 Å²	17	28 Å²	28	9%	0.087	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	120.4	174.9	-55.5	155.1	0	0	0	108.3	T218 I220 Y253 I257 D258 A259	I141-T218 WeakPolarHBondContact CA-O 3.22Å; I141-T218 HydrophobicContact CG2-CG2 4.47Å; I141-I220 HydrophobicContact CG2-CD1 3.83Å; I141-I220 HydrophobicContact CG2-CG1 4.31Å; I141-Y253 HydrophobicContact CD1-CD1 3.43Å; I141-Y253 VanDerWaalsContact CD1-CD1 3.43Å; I141-Y253 HydrophobicContact CD1-CE1 3.56Å; I141-Y253 HydrophobicContact CD1-CG 4.12Å; I141-Y253 HydrophobicContact CG1-CD1 4.41Å; I141-Y253 HydrophobicContact CG1-CE1 4.14Å; I141-Y253 HydrophobicContact CG2-CD2 4.12Å; I141-Y253 HydrophobicContact CG2-CE1 4.28Å; I141-Y253 HydrophobicContact CG2-CE2 3.89Å; I141-Y253 HydrophobicContact CG2-CG 4.41Å; I141-I257 HydrophobicContact CB-CB 4.13Å; I141-I257 HydrophobicContact CB-CG2 4.11Å; I141-I257 HydrophobicContact CG2-CB 4.01Å; I141-I257 HydrophobicContact CG2-CG2 3.54Å; I141-D258 PolarHBondContact N-OD2 2.63Å; I141-D258 PolarHBondContact O-N 3.48Å; I141-A259 PolarHBondContact O-N 3.3Å
142	I	97.4	Very high	83.7	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	126	-168.3	-47.7	-62.4	0	0	0	110.8	I136 D140 I144 M211 V217 T218 L219 I220 A259	I136-I142 HydrophobicContact CD1-CD1 3.4Å; I136-I142 VanDerWaalsContact CD1-CD1 3.4Å; I136-I142 HydrophobicContact CD1-CG1 4.11Å; D140-I142 HydrophobicContact CB-CD1 3.89Å; D140-I142 HydrophobicContact CB-CG1 4.37Å; I142-I144 HydrophobicContact CG2-CG1 4.05Å; I142-M211 HydrophobicContact CB-SD 4.44Å; I142-M211 HydrophobicContact CG1-SD 4.47Å; I142-M211 HydrophobicContact CG2-CE 4.27Å; I142-M211 HydrophobicContact CG2-SD 3.98Å; I142-V217 HydrophobicContact CG1-CG1 4.11Å; I142-T218 PolarHBondContact N-O 2.81Å; I142-L219 HydrophobicContact CB-CD2 3.91Å; I142-L219 HydrophobicContact CG1-CD2 4.3Å; I142-I220 PolarHBondContact O-N 2.72Å; I142-A259 WeakPolarHBondContact CA-O 3.36Å; I142-A259 HydrophobicContact CD1-CB 3.6Å
143	L	95.3	Very high	81.1	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	121.3	169.4	176.8	63.8	0	0	0	110.3	F145 I220 I222 I249 I257 A259 I260 L261 I275	L143-F145 HydrophobicContact CD2-CD2 4.45Å; L143-F145 HydrophobicContact CD2-CE2 3.73Å; L143-F145 HydrophobicContact CD2-CZ 3.97Å; L143-F145 HydrophobicContact CG-CD2 4.49Å; L143-F145 HydrophobicContact CG-CE2 4.23Å; L143-I220 CarbonylContact C-O 3.47Å; L143-I220 WeakPolarHBondContact CA-O 3.33Å; L143-I220 HydrophobicContact CD1-CB 4.03Å; L143-I220 HydrophobicContact CD1-CG2 3.78Å; L143-I222 HydrophobicContact CD1-CD1 4.21Å; L143-I222 HydrophobicContact CD1-CG1 3.94Å; L143-I249 HydrophobicContact CD1-CD1 3.86Å; L143-I249 HydrophobicContact CD2-CD1 3.63Å; L143-I249 HydrophobicContact CG-CD1 4.21Å; L143-I257 HydrophobicContact CB-CD1 3.49Å; L143-I257 VanDerWaalsContact CB-CD1 3.49Å; L143-I257 HydrophobicContact CD2-CD1 4.48Å; L143-A259 PolarHBondContact N-O 2.49Å; L143-I260 HydrophobicContact CB-CG1 4.2Å; L143-I260 HydrophobicContact CD2-CG1 4.27Å; L143-I260 HydrophobicContact CD2-CG2 4.24Å; L143-I260 WeakPolarHBondContact O-CA 3.4Å; L143-L261 PolarHBondContact O-N 2.94Å; L143-I275 HydrophobicContact CD2-CD1 4.08Å
144	I	91.8	Very high	78.5	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	110.6	174.6	-52.6	-179.5	0	0	0	108.7	I142 S146 L207 M211 L219 I220 I222 Y235 L261	I142-I144 HydrophobicContact CG2-CG1 4.05Å; I144-S146 PolarHBondContact O-N 3.19Å; I144-L207 HydrophobicContact CD1-CB 3.88Å; I144-L207 HydrophobicContact CG2-CD1 4Å; I144-M211 HydrophobicContact CD1-SD 3.82Å; I144-L219 HydrophobicContact CD1-CD2 4.32Å; I144-I220 PolarHBondContact N-O 3.36Å; I144-I222 PolarHBondContact O-N 3.1Å; I144-Y235 HydrophobicContact CB-CE1 3.99Å; I144-Y235 HydrophobicContact CD1-CE1 3.87Å; I144-Y235 HydrophobicContact CG1-CE1 4.26Å; I144-L261 HydrophobicContact CG1-CB 4.45Å; I144-L261 HydrophobicContact CG1-CD1 4.28Å; I144-L261 HydrophobicContact CG2-CB 4.5Å
145	F	87.5	Confident	75.8	Confident	14 Å²	14	20.7 Å²	20.7	6%	0.061	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	131.5	166	-73.4	-84.5	0	0	0	108.9	L143 I222 I260 L261 D262 C263 I264 L272 Y285	L143-F145 HydrophobicContact CD2-CD2 4.45Å; L143-F145 HydrophobicContact CD2-CE2 3.73Å; L143-F145 HydrophobicContact CD2-CZ 3.97Å; L143-F145 HydrophobicContact CG-CD2 4.49Å; L143-F145 HydrophobicContact CG-CE2 4.23Å; F145-I222 HydrophobicContact CD1-CB 4.34Å; F145-I222 HydrophobicContact CD1-CD1 3.61Å; F145-I222 HydrophobicContact CD1-CG1 4.2Å; F145-I222 HydrophobicContact CE1-CD1 3.42Å; F145-I222 VanDerWaalsContact CE1-CD1 3.42Å; F145-I222 HydrophobicContact CE1-CG1 4.44Å; F145-I222 HydrophobicContact CZ-CD1 4.17Å; F145-I260 HydrophobicContact CD2-CG2 4.09Å; F145-I260 HydrophobicContact CE2-CG2 3.68Å; F145-L261 WeakPolarHBondContact CD2-O 3.5Å; F145-L261 PolarHBondContact N-O 2.99Å; F145-D262 HydrophobicContact CD2-CB 4.07Å; F145-D262 HydrophobicContact CE2-CB 4.43Å; F145-C263 PolarHBondContact O-SG 3.01Å; F145-I264 HydrophobicContact CB-CD1 3.83Å; F145-I264 HydrophobicContact CB-CG1 4.35Å; F145-I264 HydrophobicContact CD1-CD1 3.15Å; F145-I264 HydrophobicContact CD1-CG1 4.42Å; F145-I264 HydrophobicContact CE1-CD1 3.76Å; F145-I264 HydrophobicContact CG-CD1 3.62Å; F145-L272 HydrophobicContact CE2-CD1 3.74Å; F145-L272 HydrophobicContact CE2-CD2 4.36Å; F145-L272 HydrophobicContact CZ-CD1 3.7Å; F145-L272 HydrophobicContact CZ-CD2 3.84Å; F145-L272 HydrophobicContact CZ-CG 4.44Å; F145-Y285 PolarHBondContact O-OH 3.48Å
146	S	79.4	Confident	72.9	Confident	8 Å²	8	18.8 Å²	18.8	6%	0.056	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	52.5	172.9	-30.8	0	0	0	0	114.7	I144 G148 R201 G204 I222 C263	I144-S146 PolarHBondContact O-N 3.19Å; S146-G148 PolarHBondContact O-N 3.29Å; S146-R201 WeakPolarHBondContact OG-CB 2.98Å; S146-R201 WeakPolarHBondContact OG-CD 3.29Å; S146-R201 WeakPolarHBondContact OG-CG 3.4Å; S146-G204 VanDerWaalsContact O-CA 3.28Å; S146-G204 WeakPolarHBondContact O-CA 3.44Å; S146-G204 PolarHBondContact O-N 3.27Å; S146-I222 WeakPolarHBondContact CA-O 3.45Å; S146-I222 PolarHBondContact N-O 3.49Å; S146-C263 PolarHBondContact OG-SG 3.08Å
147	A	76.7	Confident	70.1	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-23.8	-178.2	0	0	0	0	0	114.8	G204 T205 I222 A223 L231 Y235 L238	A147-G204 CarbonylContact O-C 3.25Å; A147-G204 WeakPolarHBondContact O-CA 3.37Å; A147-T205 PolarHBondContact O-N 3.47Å; A147-I222 PolarHBondContact N-O 3.02Å; A147-I222 VanDerWaalsContact N-O 3.08Å; A147-A223 HydrophobicContact CB-CB 4.1Å; A147-L231 HydrophobicContact CB-CD1 4.01Å; A147-Y235 WeakPolarHBondContact CA-OH 3.19Å; A147-Y235 HydrophobicContact CB-CD1 4.27Å; A147-Y235 HydrophobicContact CB-CD2 3.78Å; A147-Y235 HydrophobicContact CB-CE1 3.85Å; A147-Y235 HydrophobicContact CB-CE2 3.3Å; A147-Y235 HydrophobicContact CB-CG 4.24Å; A147-Y235 WeakPolarHBondContact O-CE2 3.43Å; A147-L238 HydrophobicContact CB-CD2 4.21Å
148	G	64.9	Low	67.5	Low	4 Å²	4	23 Å²	23	4%	0.041	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	15.2	-168.1	0	0	0	0	0	121	S146 I388 G389	S146-G148 PolarHBondContact O-N 3.29Å; G148-I388 WeakPolarHBondContact O-CA 3.43Å; G148-G389 PolarHBondContact O-N 3.02Å
149	G	61.7	Low	64.6	Low	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-137.1	-157.1	174.4	0	0	0	0	0	115.7	T202 C203 G204 T205	G149-T202 CarbonylContact C-O 3.53Å; G149-T202 WeakPolarHBondContact CA-O 3.4Å; G149-T202 PolarHBondContact N-O 3.31Å; G149-T202 CarbonylContact O-C 3.47Å; G149-C203 CarbonylContact O-C 3.58Å; G149-G204 PolarHBondContact O-N 2.76Å; G149-T205 PolarHBondContact O-N 3.44Å; G149-T205 PolarHBondContact O-OG1 2.76Å
150	G	47.5	Very low	61.8	Low	1 Å²	1	30.8 Å²	30.8	1%	0.01	15%	0.15	C	C	.	.			trans	-122.7	150.2	175.3	0	0	0	0	0	119	T202 C203	G150-T202 VanDerWaalsContact CA-C 3.45Å; G150-T202 VanDerWaalsContact N-CA 3.29Å; G150-T202 PolarHBondContact N-O 2.58Å; G150-T202 CarbonylContact O-C 3.59Å; G150-T202 WeakPolarHBondContact O-CA 3.47Å; G150-T202 WeakPolarHBondContact O-CB 3.46Å; G150-T202 PolarHBondContact O-OG1 2.87Å; G150-C203 VanDerWaalsContact CA-CA 3.49Å; G150-C203 VanDerWaalsContact N-N 3.15Å; G150-C203 PolarHBondContact O-N 3.09Å
151	I	49.5	Very low	59	Low	3 Å²	3	34.3 Å²	34.3	2%	0.015	17%	0.173	C	C	.	.			trans	-52.3	141	-146.5	-54.4	-173.6	0	0	0	119.9	F121 A122 P125 A126 C203 Y285	F121-I151 VanDerWaalsContact O-CB 3.32Å; F121-I151 WeakPolarHBondContact O-CB 3.16Å; A122-I151 WeakPolarHBondContact O-CD1 3.17Å; A122-I151 WeakPolarHBondContact O-CG1 3.34Å; P125-I151 HydrophobicContact CB-CD1 3.54Å; P125-I151 HydrophobicContact CB-CG2 3.98Å; P125-I151 HydrophobicContact CG-CB 3.93Å; P125-I151 HydrophobicContact CG-CD1 3.42Å; P125-I151 VanDerWaalsContact CG-CD1 3.42Å; P125-I151 HydrophobicContact CG-CG1 4.13Å; P125-I151 HydrophobicContact CG-CG2 3.81Å; A126-I151 HydrophobicContact CB-CD1 3.67Å; I151-C203 VanDerWaalsContact CA-CA 3.43Å; I151-C203 VanDerWaalsContact CA-N 3.29Å; I151-C203 HydrophobicContact CB-CB 4.02Å; I151-C203 HydrophobicContact CG1-CB 3.55Å; I151-C203 HydrophobicContact CG2-CB 4.42Å; I151-C203 VanDerWaalsContact N-CA 3.26Å; I151-C203 VanDerWaalsContact N-N 3.13Å; I151-Y285 HydrophobicContact CG2-CD2 4.27Å; I151-Y285 HydrophobicContact CG2-CE2 4.49Å
152	V	46.4	Very low	56.1	Low	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.197	C	C	.	.			trans	-95.7	127.6	161.9	-176.1	0	0	0	0	107.3	F10 M14 T202	F10-V152 HydrophobicContact CB-CG1 4.3Å; F10-V152 HydrophobicContact CB-CG2 3.8Å; F10-V152 HydrophobicContact CD1-CG1 3.95Å; F10-V152 HydrophobicContact CD1-CG2 4.08Å; F10-V152 HydrophobicContact CG-CG2 4.11Å; M14-V152 HydrophobicContact CE-CG1 3.77Å; V152-T202 VanDerWaalsContact CG2-OG1 3.23Å; V152-T202 WeakPolarHBondContact CG2-OG1 3.19Å
153	S	41.3	Very low	53.8	Low	2 Å²	2	43.1 Å²	43.1	1%	0.014	21%	0.213	C	C	.	.			trans	-134	90.4	176	-82.8	0	0	0	0	109.4	L328	S153-L328 VanDerWaalsContact OG-CB 3.28Å; S153-L328 WeakPolarHBondContact OG-CB 3.43Å; S153-L328 PolarHBondContact OG-N 3.24Å
154	S	38	Very low	51.3	Low	7 Å²	7	46.5 Å²	46.5	5%	0.049	23%	0.234	C	C	.	.			trans	-163.2	105.1	166	50.5	0	0	0	0	108	M14 I20	M14-S154 WeakPolarHBondContact CE-OG 3.41Å; M14-S154 PolarHBondContact SD-OG 2.81Å; M14-S154 VanDerWaalsContact SD-OG 3.34Å; I20-S154 VanDerWaalsContact CD1-CB 3.49Å
155	I	37.7	Very low	49	Very low	51 Å²	51	51 Å²	51	26%	0.262	26%	0.255	S	S	.	.			trans	-83.6	114.2	160.2	-69.2	173.2	0	0	0	105.8	I157 F326	I155-I157 HydrophobicContact CG2-CG1 4.16Å; I155-I157 PolarHBondContact O-N 2.97Å; I155-I157 VanDerWaalsContact O-N 3.11Å; I155-F326 VanDerWaalsContact CD1-N 3.29Å; I155-F326 WeakPolarHBondContact CD1-O 3.19Å
156	M	34.9	Very low	47.1	Very low	39 Å²	39	54.2 Å²	54.2	19%	0.192	27%	0.272	C	S	.	.			trans	-78.4	92.8	175.2	-164.9	172.5	97.3	0	0	108.2	I158 M287 L290 L301	M156-I158 HydrophobicContact CE-CB 3.85Å; M156-I158 HydrophobicContact CE-CD1 3.81Å; M156-I158 HydrophobicContact CE-CG1 4.18Å; M156-I158 HydrophobicContact CE-CG2 4.29Å; M156-I158 HydrophobicContact CG-CB 3.84Å; M156-I158 HydrophobicContact CG-CD1 3.51Å; M156-I158 HydrophobicContact CG-CG1 3.46Å; M156-I158 VanDerWaalsContact CG-CG1 3.46Å; M156-I158 PolarHBondContact O-N 3.22Å; M156-I158 HydrophobicContact SD-CB 4.46Å; M156-I158 HydrophobicContact SD-CD1 3.61Å; M156-I158 HydrophobicContact SD-CG1 4.18Å; M156-M287 HydrophobicContact CB-SD 3.8Å; M156-M287 PolarHBondContact N-SD 3.22Å; M156-M287 VanDerWaalsContact N-SD 3.36Å; M156-L290 HydrophobicContact CB-CD1 4.09Å; M156-L290 HydrophobicContact CE-CD1 4.17Å; M156-L290 HydrophobicContact SD-CD1 3.77Å; M156-L301 HydrophobicContact CE-CD1 4.47Å; M156-L301 HydrophobicContact CE-CD2 4.46Å
157	I	37.2	Very low	45.3	Very low	124 Å²	124	59.2 Å²	59.2	64%	0.636	30%	0.296	S	S	*	.			trans	-73.2	62.5	162.9	-53.6	174	0	0	0	107.8	I155 L159	I155-I157 HydrophobicContact CG2-CG1 4.16Å; I155-I157 PolarHBondContact O-N 2.97Å; I155-I157 VanDerWaalsContact O-N 3.11Å; I157-L159 VanDerWaalsContact C-N 3.3Å
158	I	39.5	Very low	43.7	Very low	76 Å²	76	62.4 Å²	62.4	39%	0.39	32%	0.318	S	S	.	.			trans	-93	-0.7	164.4	-70.2	-177.1	0	0	0	110.3	M156 F162	M156-I158 HydrophobicContact CE-CB 3.85Å; M156-I158 HydrophobicContact CE-CD1 3.81Å; M156-I158 HydrophobicContact CE-CG1 4.18Å; M156-I158 HydrophobicContact CE-CG2 4.29Å; M156-I158 HydrophobicContact CG-CB 3.84Å; M156-I158 HydrophobicContact CG-CD1 3.51Å; M156-I158 HydrophobicContact CG-CG1 3.46Å; M156-I158 VanDerWaalsContact CG-CG1 3.46Å; M156-I158 PolarHBondContact O-N 3.22Å; M156-I158 HydrophobicContact SD-CB 4.46Å; M156-I158 HydrophobicContact SD-CD1 3.61Å; M156-I158 HydrophobicContact SD-CG1 4.18Å; I158-F162 HydrophobicContact CG2-CB 4.32Å; I158-F162 WeakPolarHBondContact O-CB 3.25Å
159	L	36.9	Very low	42.8	Very low	95 Å²	95	69 Å²	69	50%	0.497	35%	0.348	S	S	.	.	H	α-helix	trans	-76.6	-35.2	-179.8	-160.3	69.1	0	0	0	113.6	I157 I163 W305	I157-L159 VanDerWaalsContact C-N 3.3Å; L159-I163 HydrophobicContact CD1-CD1 3.75Å; L159-I163 HydrophobicContact CG-CD1 3.93Å; L159-I163 VanDerWaalsContact O-CB 3.27Å; L159-I163 WeakPolarHBondContact O-CB 3.47Å; L159-I163 VanDerWaalsContact O-CD1 3.3Å; L159-I163 WeakPolarHBondContact O-CD1 3.01Å; L159-I163 WeakPolarHBondContact O-CG1 3.17Å; L159-W305 HydrophobicContact CD1-CZ2 4.12Å
160	Y	38.7	Very low	42.1	Very low	178 Å²	178	74.1 Å²	74.1	70%	0.698	37%	0.374	S	S	*	.	H	α-helix	trans	-86.7	-42	-175.1	-143.9	-97.3	0	0	0	112.6	V164	Y160-V164 HydrophobicContact CD1-CG2 3.79Å; Y160-V164 HydrophobicContact CE1-CG2 3.78Å; Y160-V164 HydrophobicContact CG-CG2 4.49Å; Y160-V164 WeakPolarHBondContact O-CB 3.38Å; Y160-V164 WeakPolarHBondContact O-CG2 3.2Å; Y160-V164 PolarHBondContact O-N 2.99Å
161	V	38.1	Very low	41.8	Very low	102 Å²	102	82 Å²	82	62%	0.618	41%	0.408	S	S	*	.	H	α-helix	trans	-74	-39.6	-176.7	-178	0	0	0	0	111.9	E165	V161-E165 WeakPolarHBondContact O-CB 3.33Å; V161-E165 PolarHBondContact O-N 3.08Å
162	F	38.4	Very low	41.5	Very low	134 Å²	134	87 Å²	87	59%	0.588	43%	0.434	S	S	*	.	H	α-helix	trans	-77.1	-31.2	-178.9	-142	-101.7	0	0	0	112.6	I158 I166	I158-F162 HydrophobicContact CG2-CB 4.32Å; I158-F162 WeakPolarHBondContact O-CB 3.25Å; F162-I166 HydrophobicContact CD1-CD1 3.46Å; F162-I166 VanDerWaalsContact CD1-CD1 3.46Å; F162-I166 HydrophobicContact CD1-CG1 4.13Å; F162-I166 HydrophobicContact CE1-CD1 3.65Å; F162-I166 HydrophobicContact CE1-CG1 4.29Å; F162-I166 WeakPolarHBondContact O-CB 3.28Å; F162-I166 WeakPolarHBondContact O-CG1 3.38Å; F162-I166 PolarHBondContact O-N 2.89Å
163	I	47.7	Very low	41.4	Very low	67 Å²	67	90.9 Å²	90.9	34%	0.344	46%	0.455	S	S	.	.	H	α-helix	trans	-74	-42.9	171.9	-65.6	177.8	0	0	0	110.4	L159 E165 I166 M167 W305	L159-I163 HydrophobicContact CD1-CD1 3.75Å; L159-I163 HydrophobicContact CG-CD1 3.93Å; L159-I163 VanDerWaalsContact O-CB 3.27Å; L159-I163 WeakPolarHBondContact O-CB 3.47Å; L159-I163 VanDerWaalsContact O-CD1 3.3Å; L159-I163 WeakPolarHBondContact O-CD1 3.01Å; L159-I163 WeakPolarHBondContact O-CG1 3.17Å; I163-E165 VanDerWaalsContact C-N 3.31Å; I163-E165 PolarHBondContact O-N 3.19Å; I163-I166 PolarHBondContact O-N 3.47Å; I163-M167 HydrophobicContact CG2-CG 3.78Å; I163-M167 HydrophobicContact CG2-SD 4.37Å; I163-M167 WeakPolarHBondContact O-CA 3.16Å; I163-M167 WeakPolarHBondContact O-CB 2.86Å; I163-M167 WeakPolarHBondContact O-CG 2.66Å; I163-M167 PolarHBondContact O-N 3.38Å; I163-W305 HydrophobicContact CD1-CZ2 4.18Å
164	V	42.8	Very low	41.8	Very low	72 Å²	72	100.4 Å²	100.4	44%	0.436	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-38.8	175	171.6	0	0	0	0	110.7	Y160 S168	Y160-V164 HydrophobicContact CD1-CG2 3.79Å; Y160-V164 HydrophobicContact CE1-CG2 3.78Å; Y160-V164 HydrophobicContact CG-CG2 4.49Å; Y160-V164 WeakPolarHBondContact O-CB 3.38Å; Y160-V164 WeakPolarHBondContact O-CG2 3.2Å; Y160-V164 PolarHBondContact O-N 2.99Å; V164-S168 WeakPolarHBondContact O-CA 3.19Å; V164-S168 WeakPolarHBondContact O-CB 3.15Å; V164-S168 PolarHBondContact O-N 3.2Å
165	E	43.3	Very low	42.5	Very low	94 Å²	94	107.8 Å²	107.8	44%	0.439	53%	0.532	S	S	.	.	H	α-helix	trans	-67	-48	174.2	-163.6	68.8	-144.8	0	0	110.8	V161 I163 M167 S168 Q169	V161-E165 WeakPolarHBondContact O-CB 3.33Å; V161-E165 PolarHBondContact O-N 3.08Å; I163-E165 VanDerWaalsContact C-N 3.31Å; I163-E165 PolarHBondContact O-N 3.19Å; E165-M167 PolarHBondContact O-N 3.11Å; E165-S168 PolarHBondContact O-N 3.05Å; E165-Q169 HydrophobicContact CG-CG 4.28Å; E165-Q169 WeakPolarHBondContact O-CB 3.36Å; E165-Q169 WeakPolarHBondContact O-CG 3.41Å; E165-Q169 PolarHBondContact O-N 3.31Å; E165-Q169 PolarHBondContact OE1-NE2 2.72Å
166	I	47.7	Very low	42.9	Very low	82 Å²	82	107.9 Å²	107.9	42%	0.421	55%	0.546	S	S	.	.	H	α-helix	trans	-62.3	-41.9	176	-74.1	172.3	0	0	0	111.5	F162 I163 Q169 L170	F162-I166 HydrophobicContact CD1-CD1 3.46Å; F162-I166 VanDerWaalsContact CD1-CD1 3.46Å; F162-I166 HydrophobicContact CD1-CG1 4.13Å; F162-I166 HydrophobicContact CE1-CD1 3.65Å; F162-I166 HydrophobicContact CE1-CG1 4.29Å; F162-I166 WeakPolarHBondContact O-CB 3.28Å; F162-I166 WeakPolarHBondContact O-CG1 3.38Å; F162-I166 PolarHBondContact O-N 2.89Å; I163-I166 PolarHBondContact O-N 3.47Å; I166-Q169 PolarHBondContact O-N 3.45Å; I166-L170 HydrophobicContact CG2-CD1 3.57Å; I166-L170 HydrophobicContact CG2-CG 4.22Å; I166-L170 WeakPolarHBondContact O-CB 3.28Å; I166-L170 WeakPolarHBondContact O-CD1 2.83Å; I166-L170 WeakPolarHBondContact O-CG 3.37Å; I166-L170 PolarHBondContact O-N 3.42Å
167	M	42.4	Very low	43.4	Very low	113 Å²	113	112.9 Å²	112.9	56%	0.557	57%	0.567	S	S	*	*	H	α-helix	trans	-71.8	-34.1	178.3	-64.1	-128.8	84.1	0	0	112	I163 E165 L170 K171	I163-M167 HydrophobicContact CG2-CG 3.78Å; I163-M167 HydrophobicContact CG2-SD 4.37Å; I163-M167 WeakPolarHBondContact O-CA 3.16Å; I163-M167 WeakPolarHBondContact O-CB 2.86Å; I163-M167 WeakPolarHBondContact O-CG 2.66Å; I163-M167 PolarHBondContact O-N 3.38Å; E165-M167 PolarHBondContact O-N 3.11Å; M167-L170 PolarHBondContact O-N 3.22Å; M167-K171 PolarHBondContact O-N 3.34Å
168	S	43	Very low	43.9	Very low	67 Å²	67	112.1 Å²	112.1	47%	0.469	57%	0.57	S	S	.	*	H	α-helix	trans	-68.9	-37.8	172.7	-177.3	0	0	0	0	111.6	V164 E165 L170 K171	V164-S168 WeakPolarHBondContact O-CA 3.19Å; V164-S168 WeakPolarHBondContact O-CB 3.15Å; V164-S168 PolarHBondContact O-N 3.2Å; E165-S168 PolarHBondContact O-N 3.05Å; S168-L170 VanDerWaalsContact C-N 3.35Å; S168-K171 WeakPolarHBondContact O-CG 3.39Å; S168-K171 PolarHBondContact O-N 3.33Å
169	Q	45.5	Very low	44.3	Very low	143 Å²	143	111.3 Å²	111.3	67%	0.668	58%	0.58	S	S	*	*	H	α-helix	trans	-76.4	-23.3	174.7	-63	-80.4	-11.1	0	0	112	E165 I166 K171	E165-Q169 HydrophobicContact CG-CG 4.28Å; E165-Q169 WeakPolarHBondContact O-CB 3.36Å; E165-Q169 WeakPolarHBondContact O-CG 3.41Å; E165-Q169 PolarHBondContact O-N 3.31Å; E165-Q169 PolarHBondContact OE1-NE2 2.72Å; I166-Q169 PolarHBondContact O-N 3.45Å; Q169-K171 VanDerWaalsContact C-N 3.35Å
170	L	46.8	Very low	44.6	Very low	106 Å²	106	112.3 Å²	112.3	56%	0.555	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-0.1	174.8	-77.3	171.3	0	0	0	113.9	I166 M167 S168 L172	I166-L170 HydrophobicContact CG2-CD1 3.57Å; I166-L170 HydrophobicContact CG2-CG 4.22Å; I166-L170 WeakPolarHBondContact O-CB 3.28Å; I166-L170 WeakPolarHBondContact O-CD1 2.83Å; I166-L170 WeakPolarHBondContact O-CG 3.37Å; I166-L170 PolarHBondContact O-N 3.42Å; M167-L170 PolarHBondContact O-N 3.22Å; S168-L170 VanDerWaalsContact C-N 3.35Å; L170-L172 VanDerWaalsContact C-N 3.3Å; L170-L172 PolarHBondContact O-N 2.97Å
171	K	41.6	Very low	44.6	Very low	168 Å²	168	110.7 Å²	110.7	73%	0.73	60%	0.604	S	S	*	*			trans	-2	80	175.2	-108.5	-179.8	-174.9	-179.4	0	112.8	M167 S168 Q169	M167-K171 PolarHBondContact O-N 3.34Å; S168-K171 WeakPolarHBondContact O-CG 3.39Å; S168-K171 PolarHBondContact O-N 3.33Å; Q169-K171 VanDerWaalsContact C-N 3.35Å
172	L	43.3	Very low	44.5	Very low	106 Å²	106	109.3 Å²	109.3	56%	0.555	61%	0.611	S	S	*	*	B	Isolated β-bridge	trans	-73.4	127.1	165.6	-70.2	166.8	0	0	0	105.1	L170	L170-L172 VanDerWaalsContact C-N 3.3Å; L170-L172 PolarHBondContact O-N 2.97Å
173	D	43.8	Very low	44.3	Very low	82 Å²	82	114.6 Å²	114.6	44%	0.439	63%	0.627	S	S	.	*			trans	-62.8	166.5	168.8	53.1	16.2	0	0	0	110.3	H175 G176 K177	D173-H175 PolarHBondContact O-N 3.35Å; D173-G176 PolarHBondContact O-N 3.48Å; D173-G176 PolarHBondContact OD1-N 2.88Å; D173-K177 PolarHBondContact OD1-N 2.81Å
174	H	50.4	Low	43.8	Very low	202 Å²	202	117.1 Å²	117.1	94%	0.935	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-4	179.6	-99.5	-49.4	0	0	0	114.6
175	H	53	Low	43.5	Very low	163 Å²	163	123 Å²	123	76%	0.755	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.7	7.5	-180	-65.5	-59.6	0	0	0	114.3	D173 K177	D173-H175 PolarHBondContact O-N 3.35Å; H175-K177 PolarHBondContact O-N 2.86Å
176	G	46.4	Very low	42.9	Very low	53 Å²	53	129.4 Å²	129.4	55%	0.546	69%	0.688	S	S	.	*			trans	70.3	26.3	173.6	0	0	0	0	0	114.6	D173	D173-G176 PolarHBondContact O-N 3.48Å; D173-G176 PolarHBondContact OD1-N 2.88Å
177	K	44.2	Very low	42.1	Very low	143 Å²	143	130.8 Å²	130.8	62%	0.622	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-101.6	138	176.5	-68.4	-169.1	178.2	-178.4	0	111.4	D173 H175 G179	D173-K177 PolarHBondContact OD1-N 2.81Å; H175-K177 PolarHBondContact O-N 2.86Å; K177-G179 PolarHBondContact O-N 3.43Å
178	P	49.4	Very low	41.6	Very low	109 Å²	109	133.4 Å²	133.4	71%	0.708	72%	0.717	S	S	*	*	B	Isolated β-bridge	trans	-68.3	125.3	174.8	26.8	-31.9	0	0	0	110.1	S180	P178-S180 PolarHBondContact O-N 3.47Å
179	G	46.4	Very low	40.8	Very low	59 Å²	59	137.9 Å²	137.9	61%	0.608	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-57.4	128.2	173.6	0	0	0	0	0	111.4	K177 T181	K177-G179 PolarHBondContact O-N 3.43Å; G179-T181 VanDerWaalsContact C-N 3.33Å; G179-T181 PolarHBondContact O-N 2.96Å
180	S	42.8	Very low	40.1	Very low	115 Å²	115	133.8 Å²	133.8	80%	0.804	73%	0.728	S	S	*	*	S	Bend	trans	-74	80.6	-176.9	62.9	0	0	0	0	110.9	P178	P178-S180 PolarHBondContact O-N 3.47Å
181	T	40.1	Very low	39.1	Very low	144 Å²	144	135.6 Å²	135.6	88%	0.883	74%	0.737	S	S	*	*			trans	178.1	90.9	159.6	29.3	0	0	0	0	109.8	G179	G179-T181 VanDerWaalsContact C-N 3.33Å; G179-T181 PolarHBondContact O-N 2.96Å
182	G	35.8	Very low	38.5	Very low	74 Å²	74	135.8 Å²	135.8	76%	0.763	75%	0.746	S	S	*	*			trans	-169.1	115.2	174.3	0	0	0	0	0	112.7
183	R	34.9	Very low	37.7	Very low	244 Å²	244	138.3 Å²	138.3	92%	0.921	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-58.9	144.4	177.1	-73.5	-177.1	-176.4	-170.2	1.5	110.8	F185	R183-F185 PolarHBondContact O-N 2.91Å
184	P	35.6	Very low	36.8	Very low	121 Å²	121	136.7 Å²	136.7	79%	0.786	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-71.8	129	177	30	-31.9	0	0	0	110.3
185	F	37.6	Very low	35.7	Very low	196 Å²	196	132.5 Å²	132.5	86%	0.86	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-76.2	125.4	172	-148.8	-93.7	0	0	0	109.2	R183	R183-F185 PolarHBondContact O-N 2.91Å
186	R	29.6	Very low	34.4	Very low	227 Å²	227	129.9 Å²	129.9	86%	0.857	76%	0.761	S	S	*	*			trans	-111.3	111.4	174.8	-80.2	-177.1	155.2	-159.7	-4.9	109.4
187	P	32.5	Very low	33.7	Very low	111 Å²	111	132.2 Å²	132.2	72%	0.721	76%	0.757	S	S	*	*			trans	-84.3	124.4	168.2	31	-25.9	0	0	0	109.5	M189	P187-M189 PolarHBondContact O-N 2.89Å
188	I	31	Very low	33	Very low	169 Å²	169	128.4 Å²	128.4	87%	0.867	75%	0.747	S	S	*	*			trans	-70	111.1	171.4	-67.4	169.8	0	0	0	107.6	G190	I188-G190 PolarHBondContact O-N 3.08Å
189	M	26.4	Very low	32.4	Very low	161 Å²	161	128.9 Å²	128.9	79%	0.793	74%	0.735	S	S	*	*			trans	-84.8	99.3	174.2	-120.4	-71.2	-166.8	0	0	108.3	P187 L299	P187-M189 PolarHBondContact O-N 2.89Å; M189-L299 HydrophobicContact CE-CD2 4.16Å
190	G	30.5	Very low	31.6	Very low	56 Å²	56	126.1 Å²	126.1	58%	0.577	71%	0.706	S	S	*	*			trans	-116.9	100.3	175.5	0	0	0	0	0	110.7	I188	I188-G190 PolarHBondContact O-N 3.08Å
191	L	25.9	Very low	31.8	Very low	144 Å²	144	121.9 Å²	121.9	75%	0.754	67%	0.673	S	S	*	*			trans	4.2	124.1	154.3	-162.7	73.1	0	0	0	117.8	I193	L191-I193 HydrophobicContact CD1-CD1 4.42Å
192	L	28.7	Very low	32.5	Very low	173 Å²	173	115.3 Å²	115.3	91%	0.906	63%	0.632	S	S	*	*			trans	-164	111.8	133	-100.7	165.7	0	0	0	110
193	I	26.4	Very low	34	Very low	159 Å²	159	111.8 Å²	111.8	82%	0.815	60%	0.596	S	S	*	*			trans	-89	128.5	171	-58.9	164.3	0	0	0	106	L191	L191-I193 HydrophobicContact CD1-CD1 4.42Å
194	G	25.9	Very low	36.2	Very low	48 Å²	48	100.2 Å²	100.2	50%	0.495	55%	0.552	S	S	.	*			trans	174.8	111	174	0	0	0	0	0	114.7	H197	G194-H197 PolarHBondContact O-CE1 3.45Å
195	S	25.6	Very low	38.8	Very low	113 Å²	113	94.7 Å²	94.7	79%	0.79	52%	0.516	S	S	*	.			trans	71.1	143.1	144.8	-47.1	0	0	0	0	120.2	H197	S195-H197 PolarHBondContact O-CE1 3.38Å; S195-H197 VanDerWaalsContact O-CE1 3.32Å; S195-H197 PolarHBondContact O-N 2.57Å; S195-H197 PolarHBondContact O-ND1 2.87Å
196	A	26.7	Very low	41.4	Very low	109 Å²	109	85.3 Å²	85.3	90%	0.901	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-63.6	117.8	177.6	0	0	0	0	0	111.1
197	H	30.8	Very low	44.5	Very low	102 Å²	102	74.5 Å²	74.5	47%	0.472	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-102.3	138.7	-174.1	-77.8	76.9	0	0	0	112.6	G194 S195 R199 T292	G194-H197 PolarHBondContact O-CE1 3.45Å; S195-H197 PolarHBondContact O-CE1 3.38Å; S195-H197 VanDerWaalsContact O-CE1 3.32Å; S195-H197 PolarHBondContact O-N 2.57Å; S195-H197 PolarHBondContact O-ND1 2.87Å; H197-R199 PolarHBondContact O-N 3.25Å; H197-T292 PolarHBondContact CD2-O 3.22Å
198	P	30.5	Very low	47.3	Very low	63 Å²	63	69.2 Å²	69.2	41%	0.409	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-73.4	126.3	179.4	31.3	-33.8	0	0	0	110.9	R385	P198-R385 VanDerWaalsContact CA-NH2 3.33Å; P198-R385 VanDerWaalsContact CB-CZ 3.48Å; P198-R385 PolarHBondContact O-NH2 3.31Å
199	R	35.6	Very low	50.3	Low	119 Å²	119	62.8 Å²	62.8	45%	0.449	37%	0.366	S	S	.	.			trans	-79.6	97.5	167.8	-55.9	167.8	-176.7	123.6	-1.6	120	H197 R201 N289 R385	H197-R199 PolarHBondContact O-N 3.25Å; R199-R201 WeakPolarHBondContact O-CG 3.19Å; R199-R201 PolarHBondContact O-NE 2.94Å; R199-N289 WeakPolarHBondContact CB-OD1 3.29Å; R199-N289 VanDerWaalsContact CD-OD1 3.23Å; R199-N289 WeakPolarHBondContact CD-OD1 3.49Å; R199-N289 VanDerWaalsContact CG-OD1 3.29Å; R199-N289 WeakPolarHBondContact CG-OD1 3.42Å; R199-R385 VanDerWaalsContact CA-CZ 3.42Å; R199-R385 PolarHBondContact O-NE 2.89Å; R199-R385 PolarHBondContact O-NH2 2.82Å; R199-R385 VanDerWaalsContact O-NH2 3.09Å
200	S	30.3	Very low	53.7	Low	1 Å²	1	55.1 Å²	55.1	1%	0.007	33%	0.329	C	S	.	.			trans	-83.5	124	-159.4	-79	0	0	0	0	118.3	S288 L382 Q383 R385	S200-S288 WeakPolarHBondContact O-CA 3.47Å; S200-S288 WeakPolarHBondContact O-CB 3.3Å; S200-L382 PolarHBondContact OG-O 3.23Å; S200-Q383 PolarHBondContact OG-O 3.38Å; S200-R385 VanDerWaalsContact CA-NH2 3.27Å; S200-R385 WeakPolarHBondContact OG-CG 3.39Å; S200-R385 PolarHBondContact OG-NH2 3.39Å
201	R	48.1	Very low	56.8	Low	26 Å²	26	52.5 Å²	52.5	10%	0.098	30%	0.301	C	S	.	.			trans	-141.3	133.6	-166.4	-56.1	159.5	-149	-173.3	-13.8	109.9	S146 R199 I264 S288	S146-R201 WeakPolarHBondContact OG-CB 2.98Å; S146-R201 WeakPolarHBondContact OG-CD 3.29Å; S146-R201 WeakPolarHBondContact OG-CG 3.4Å; R199-R201 WeakPolarHBondContact O-CG 3.19Å; R199-R201 PolarHBondContact O-NE 2.94Å; R201-I264 HydrophobicContact CG-CG1 4.4Å; R201-I264 VanDerWaalsContact NE-CG1 3.34Å; R201-S288 WeakPolarHBondContact CG-OG 3.31Å
202	T	53.1	Low	60.1	Low	6 Å²	6	49.3 Å²	49.3	4%	0.037	28%	0.281	C	S	.	.			trans	-115.3	-89.5	-167.2	49.6	0	0	0	0	108.6	G149 G150 V152 G204	G149-T202 CarbonylContact C-O 3.53Å; G149-T202 WeakPolarHBondContact CA-O 3.4Å; G149-T202 PolarHBondContact N-O 3.31Å; G149-T202 CarbonylContact O-C 3.47Å; G150-T202 VanDerWaalsContact CA-C 3.45Å; G150-T202 VanDerWaalsContact N-CA 3.29Å; G150-T202 PolarHBondContact N-O 2.58Å; G150-T202 CarbonylContact O-C 3.59Å; G150-T202 WeakPolarHBondContact O-CA 3.47Å; G150-T202 WeakPolarHBondContact O-CB 3.46Å; G150-T202 PolarHBondContact O-OG1 2.87Å; V152-T202 VanDerWaalsContact CG2-OG1 3.23Å; V152-T202 WeakPolarHBondContact CG2-OG1 3.19Å; T202-G204 PolarHBondContact O-N 3.09Å
203	C	68.6	Low	63.3	Low	0 Å²	0	44 Å²	44	0%	0	25%	0.253	C	S	.	.			trans	17.5	-45.2	178.3	41	0	0	0	0	127.8	G149 G150 I151 T205 A206 L207 Y285	G149-C203 CarbonylContact O-C 3.58Å; G150-C203 VanDerWaalsContact CA-CA 3.49Å; G150-C203 VanDerWaalsContact N-N 3.15Å; G150-C203 PolarHBondContact O-N 3.09Å; I151-C203 VanDerWaalsContact CA-CA 3.43Å; I151-C203 VanDerWaalsContact CA-N 3.29Å; I151-C203 HydrophobicContact CB-CB 4.02Å; I151-C203 HydrophobicContact CG1-CB 3.55Å; I151-C203 HydrophobicContact CG2-CB 4.42Å; I151-C203 VanDerWaalsContact N-CA 3.26Å; I151-C203 VanDerWaalsContact N-N 3.13Å; C203-T205 VanDerWaalsContact C-N 3.32Å; C203-T205 PolarHBondContact O-N 3.24Å; C203-T205 VanDerWaalsContact O-N 3.09Å; C203-A206 PolarHBondContact O-N 3.05Å; C203-L207 HydrophobicContact CB-CD1 4Å; C203-Y285 HydrophobicContact CB-CE2 3.48Å; C203-Y285 VanDerWaalsContact CB-CE2 3.48Å; C203-Y285 WeakPolarHBondContact SG-CE2 3.1Å; C203-Y285 VanDerWaalsContact SG-CZ 3.53Å; C203-Y285 PolarHBondContact SG-OH 2.89Å
204	G	81.7	Confident	66.7	Low	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.1	-39.1	-151.6	0	0	0	0	0	115.8	S146 A147 G149 T202 A206 L207 G208 Y235	S146-G204 VanDerWaalsContact O-CA 3.28Å; S146-G204 WeakPolarHBondContact O-CA 3.44Å; S146-G204 PolarHBondContact O-N 3.27Å; A147-G204 CarbonylContact O-C 3.25Å; A147-G204 WeakPolarHBondContact O-CA 3.37Å; G149-G204 PolarHBondContact O-N 2.76Å; T202-G204 PolarHBondContact O-N 3.09Å; G204-A206 PolarHBondContact O-N 2.61Å; G204-L207 PolarHBondContact O-N 3.3Å; G204-G208 PolarHBondContact O-N 3.12Å; G204-Y235 WeakPolarHBondContact CA-OH 3.4Å; G204-Y235 PolarHBondContact O-OH 2.94Å
205	T	88.9	Confident	70	Confident	5 Å²	5	39 Å²	39	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-61	-42.3	-175	53.9	0	0	0	0	113.5	A147 G149 C203 G208 Q209 L231 I234 L365	A147-T205 PolarHBondContact O-N 3.47Å; G149-T205 PolarHBondContact O-N 3.44Å; G149-T205 PolarHBondContact O-OG1 2.76Å; C203-T205 VanDerWaalsContact C-N 3.32Å; C203-T205 PolarHBondContact O-N 3.24Å; C203-T205 VanDerWaalsContact O-N 3.09Å; T205-G208 PolarHBondContact O-N 2.96Å; T205-Q209 WeakPolarHBondContact O-CG 3.38Å; T205-Q209 PolarHBondContact O-N 3.07Å; T205-L231 HydrophobicContact CG2-CD2 4Å; T205-I234 HydrophobicContact CG2-CD1 4.21Å; T205-L365 HydrophobicContact CG2-CD2 4.28Å
206	A	92.6	Very high	73.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-70.1	-40	179.5	0	0	0	0	0	112.3	A122 Y123 A126 C203 G204 L210	A122-A206 HydrophobicContact CB-CB 4.26Å; A122-A206 WeakPolarHBondContact O-CB 3.47Å; Y123-A206 HydrophobicContact CD1-CB 4.07Å; Y123-A206 HydrophobicContact CD2-CB 3.94Å; Y123-A206 HydrophobicContact CE1-CB 3.9Å; Y123-A206 HydrophobicContact CE2-CB 3.79Å; Y123-A206 HydrophobicContact CG-CB 4.09Å; A126-A206 HydrophobicContact CB-CB 3.94Å; C203-A206 PolarHBondContact O-N 3.05Å; G204-A206 PolarHBondContact O-N 2.61Å; A206-L210 WeakPolarHBondContact O-CG 3.41Å; A206-L210 PolarHBondContact O-N 2.76Å; A206-L210 VanDerWaalsContact O-N 3.11Å
207	L	93.7	Very high	76.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-47.5	173.4	-74	162.6	0	0	0	110.7	A126 L129 I144 C203 G204 L210 M211 L261 Y285	A126-L207 HydrophobicContact CB-CD2 3.94Å; A126-L207 HydrophobicContact CB-CG 4.1Å; L129-L207 HydrophobicContact CB-CD2 3.98Å; L129-L207 HydrophobicContact CD1-CD2 4.11Å; I144-L207 HydrophobicContact CD1-CB 3.88Å; I144-L207 HydrophobicContact CG2-CD1 4Å; C203-L207 HydrophobicContact CB-CD1 4Å; G204-L207 PolarHBondContact O-N 3.3Å; L207-L210 PolarHBondContact O-N 3.21Å; L207-M211 HydrophobicContact CD2-CE 4.25Å; L207-M211 WeakPolarHBondContact O-CB 3.5Å; L207-M211 VanDerWaalsContact O-CG 3.26Å; L207-M211 WeakPolarHBondContact O-CG 3.3Å; L207-M211 PolarHBondContact O-N 2.95Å; L207-L261 HydrophobicContact CD1-CD1 3.85Å; L207-L261 HydrophobicContact CD2-CD1 3.71Å; L207-L261 HydrophobicContact CG-CD1 4.3Å; L207-Y285 HydrophobicContact CD1-CE2 4.21Å
208	G	93.3	Very high	80	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64	-43	-178.7	0	0	0	0	0	112.8	G204 T205 M211 K212 I234	G204-G208 PolarHBondContact O-N 3.12Å; T205-G208 PolarHBondContact O-N 2.96Å; G208-M211 PolarHBondContact O-N 2.83Å; G208-K212 WeakPolarHBondContact O-CB 3.24Å; G208-K212 VanDerWaalsContact O-CG 3.3Å; G208-K212 WeakPolarHBondContact O-CG 3.41Å; G208-K212 PolarHBondContact O-N 2.91Å; G208-I234 VanDerWaalsContact CA-CG2 3.44Å
209	Q	93.9	Very high	83.2	Confident	34 Å²	34	28.7 Å²	28.7	16%	0.159	14%	0.144	C	C	.	.	H	α-helix	trans	-61.7	-45.9	175.8	-74	-173.2	21.1	0	0	112.6	Y123 T205 K212 I234 I362 D363	Y123-Q209 VanDerWaalsContact OH-CD 3.29Å; Y123-Q209 PolarHBondContact OH-OE1 3.02Å; T205-Q209 WeakPolarHBondContact O-CG 3.38Å; T205-Q209 PolarHBondContact O-N 3.07Å; Q209-K212 PolarHBondContact O-N 3.46Å; Q209-I234 HydrophobicContact CG-CD1 4.29Å; Q209-I362 HydrophobicContact CB-CG2 4.45Å; Q209-D363 PolarHBondContact NE2-O 2.94Å; Q209-D363 PolarHBondContact OE1-O 2.73Å
210	L	95.9	Very high	86.1	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.6	-43	179.2	-73.1	174	0	0	0	112.3	Y123 A126 Y131 A206 L207 K212 L213 L353 L356 I362	Y123-L210 HydrophobicContact CD1-CD1 4.12Å; Y123-L210 HydrophobicContact CD1-CD2 4.46Å; Y123-L210 HydrophobicContact CD1-CG 4.16Å; Y123-L210 HydrophobicContact CE1-CG 4.43Å; A126-L210 HydrophobicContact CB-CD1 3.58Å; Y131-L210 PolarHBondContact OH-O 2.87Å; A206-L210 WeakPolarHBondContact O-CG 3.41Å; A206-L210 PolarHBondContact O-N 2.76Å; A206-L210 VanDerWaalsContact O-N 3.11Å; L207-L210 PolarHBondContact O-N 3.21Å; L210-K212 VanDerWaalsContact C-N 3.31Å; L210-K212 PolarHBondContact O-N 2.87Å; L210-L213 HydrophobicContact CD2-CD1 4.31Å; L210-L213 VanDerWaalsContact O-CB 3.31Å; L210-L213 WeakPolarHBondContact O-CB 3.3Å; L210-L213 PolarHBondContact O-N 2.81Å; L210-L213 VanDerWaalsContact O-N 3.16Å; L210-L353 HydrophobicContact CD2-CD2 4.23Å; L210-L356 HydrophobicContact CD2-CD1 3.62Å; L210-I362 HydrophobicContact CD2-CG2 3.83Å; L210-I362 HydrophobicContact CG-CG2 4.47Å
211	M	96.3	Very high	89.1	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-68.7	-30.1	-179.6	-70.9	178.3	173.7	0	0	112.5	T130 L134 I136 I142 I144 L207 G208 L213 I214 V217 L219 L261	T130-M211 HydrophobicContact CG2-CE 4.35Å; T130-M211 HydrophobicContact CG2-CG 3.69Å; L134-M211 HydrophobicContact CD1-CE 3.89Å; I136-M211 HydrophobicContact CG1-CE 4.01Å; I142-M211 HydrophobicContact CB-SD 4.44Å; I142-M211 HydrophobicContact CG1-SD 4.47Å; I142-M211 HydrophobicContact CG2-CE 4.27Å; I142-M211 HydrophobicContact CG2-SD 3.98Å; I144-M211 HydrophobicContact CD1-SD 3.82Å; L207-M211 HydrophobicContact CD2-CE 4.25Å; L207-M211 WeakPolarHBondContact O-CB 3.5Å; L207-M211 VanDerWaalsContact O-CG 3.26Å; L207-M211 WeakPolarHBondContact O-CG 3.3Å; L207-M211 PolarHBondContact O-N 2.95Å; G208-M211 PolarHBondContact O-N 2.83Å; M211-L213 PolarHBondContact O-N 2.62Å; M211-I214 WeakPolarHBondContact O-CB 3.48Å; M211-I214 PolarHBondContact O-N 3.21Å; M211-I214 VanDerWaalsContact O-N 3.08Å; M211-V217 HydrophobicContact CB-CG1 4.41Å; M211-L219 HydrophobicContact CB-CD1 4.08Å; M211-L219 HydrophobicContact CB-CD2 3.87Å; M211-L219 HydrophobicContact SD-CD2 3.88Å; M211-L261 HydrophobicContact CE-CD1 3.47Å; M211-L261 VanDerWaalsContact CE-CD1 3.47Å; M211-L261 HydrophobicContact SD-CD1 4.5Å
212	K	94.5	Very high	91.1	Very high	77 Å²	77	22.1 Å²	22.1	34%	0.335	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-15.1	172.7	-79.3	-59.3	-167.3	-176.9	0	114.3	G208 Q209 L210 I214 L219 I234 D236	G208-K212 WeakPolarHBondContact O-CB 3.24Å; G208-K212 VanDerWaalsContact O-CG 3.3Å; G208-K212 WeakPolarHBondContact O-CG 3.41Å; G208-K212 PolarHBondContact O-N 2.91Å; Q209-K212 PolarHBondContact O-N 3.46Å; L210-K212 VanDerWaalsContact C-N 3.31Å; L210-K212 PolarHBondContact O-N 2.87Å; K212-I214 PolarHBondContact O-N 3.25Å; K212-L219 HydrophobicContact CD-CD1 4.15Å; K212-L219 HydrophobicContact CG-CD1 3.86Å; K212-I234 WeakPolarHBondContact CE-O 3.48Å; K212-D236 IonicContact NZ-OD1 2.72Å; K212-D236 PolarHBondContact NZ-OD1 3.01Å; K212-D236 IonicContact NZ-OD2 2.89Å; K212-D236 PolarHBondContact NZ-OD2 2.79Å
213	L	96.5	Very high	92.8	Very high	61 Å²	61	22.2 Å²	22.2	32%	0.319	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-17.4	171.9	-56.6	178.2	0	0	0	112.4	L210 M211 L356 K361 I362	L210-L213 HydrophobicContact CD2-CD1 4.31Å; L210-L213 VanDerWaalsContact O-CB 3.31Å; L210-L213 WeakPolarHBondContact O-CB 3.3Å; L210-L213 PolarHBondContact O-N 2.81Å; L210-L213 VanDerWaalsContact O-N 3.16Å; M211-L213 PolarHBondContact O-N 2.62Å; L213-L356 HydrophobicContact CD1-CD1 4.01Å; L213-L356 HydrophobicContact CD1-CD2 3.88Å; L213-K361 HydrophobicContact CD1-CB 4.26Å; L213-K361 HydrophobicContact CD2-CB 3.93Å; L213-K361 HydrophobicContact CD2-CD 4.48Å; L213-K361 HydrophobicContact CD2-CG 4.45Å; L213-I362 HydrophobicContact CD1-CG2 4.15Å
214	I	97.4	Very high	93.6	Very high	20 Å²	20	24.6 Å²	24.6	10%	0.103	14%	0.137	C	C	.	.	S	Bend	trans	-88.8	125	178.2	-55	171.6	0	0	0	108	T130 Y131 I136 M211 K212 V217	T130-I214 HydrophobicContact CG2-CD1 3.86Å; Y131-I214 HydrophobicContact CE1-CD1 3.88Å; Y131-I214 HydrophobicContact CE1-CG1 4.13Å; I136-I214 HydrophobicContact CB-CD1 3.7Å; I136-I214 HydrophobicContact CG2-CD1 3.63Å; M211-I214 WeakPolarHBondContact O-CB 3.48Å; M211-I214 PolarHBondContact O-N 3.21Å; M211-I214 VanDerWaalsContact O-N 3.08Å; K212-I214 PolarHBondContact O-N 3.25Å; I214-V217 HydrophobicContact CB-CG2 3.69Å; I214-V217 HydrophobicContact CG2-CG2 3.61Å
215	P	96.3	Very high	94.1	Very high	84 Å²	84	31.4 Å²	31.4	55%	0.545	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	142.4	-176	-26.4	34.3	0	0	0	112.9	S138 V217	S138-P215 WeakPolarHBondContact CA-O 3.16Å; S138-P215 WeakPolarHBondContact CB-O 3.4Å; S138-P215 PolarHBondContact OG-O 3.44Å; S138-P215 VanDerWaalsContact OG-O 3.12Å; P215-V217 PolarHBondContact O-N 2.81Å
216	N	96.6	Very high	94.1	Very high	126 Å²	126	35.7 Å²	35.7	67%	0.674	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	17.9	171.9	-47.4	-52.7	0	0	0	116.1	S138 G139	S138-N216 PolarHBondContact OG-ND2 2.61Å; S138-N216 VanDerWaalsContact OG-ND2 3.16Å; G139-N216 VanDerWaalsContact CA-O 3.22Å; G139-N216 WeakPolarHBondContact CA-O 3.37Å; G139-N216 PolarHBondContact N-O 2.88Å
217	V	97.9	Very high	93.9	Very high	7 Å²	7	36.5 Å²	36.5	4%	0.042	21%	0.206	C	C	.	.			trans	-76.6	131	172	173.5	0	0	0	0	110	I136 H137 D140 I142 M211 I214 P215 L219	I136-V217 HydrophobicContact CG2-CG1 4.39Å; I136-V217 HydrophobicContact CG2-CG2 3.74Å; H137-V217 WeakPolarHBondContact O-CG2 3.44Å; D140-V217 WeakPolarHBondContact O-CA 3.29Å; I142-V217 HydrophobicContact CG1-CG1 4.11Å; M211-V217 HydrophobicContact CB-CG1 4.41Å; I214-V217 HydrophobicContact CB-CG2 3.69Å; I214-V217 HydrophobicContact CG2-CG2 3.61Å; P215-V217 PolarHBondContact O-N 2.81Å; V217-L219 HydrophobicContact CG1-CD2 3.66Å; V217-L219 HydrophobicContact CG1-CG 4.23Å
218	T	98.1	Very high	93.8	Very high	37 Å²	37	38.1 Å²	38.1	23%	0.227	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	124.3	175.6	-57.5	0	0	0	0	110.7	D140 I141 I142 D236 Y253	D140-T218 PolarHBondContact O-N 2.86Å; I141-T218 WeakPolarHBondContact CA-O 3.22Å; I141-T218 HydrophobicContact CG2-CG2 4.47Å; I142-T218 PolarHBondContact N-O 2.81Å; T218-D236 WeakPolarHBondContact CA-OD2 3.5Å; T218-D236 HydrophobicContact CG2-CB 4.07Å; T218-Y253 VanDerWaalsContact CG2-OH 3.26Å; T218-Y253 WeakPolarHBondContact CG2-OH 3.28Å
219	L	97.7	Very high	93.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	120.1	-175.9	-62.2	-174	0	0	0	112	I142 I144 M211 K212 V217 Y235 D236 I237	I142-L219 HydrophobicContact CB-CD2 3.91Å; I142-L219 HydrophobicContact CG1-CD2 4.3Å; I144-L219 HydrophobicContact CD1-CD2 4.32Å; M211-L219 HydrophobicContact CB-CD1 4.08Å; M211-L219 HydrophobicContact CB-CD2 3.87Å; M211-L219 HydrophobicContact SD-CD2 3.88Å; K212-L219 HydrophobicContact CD-CD1 4.15Å; K212-L219 HydrophobicContact CG-CD1 3.86Å; V217-L219 HydrophobicContact CG1-CD2 3.66Å; V217-L219 HydrophobicContact CG1-CG 4.23Å; L219-Y235 HydrophobicContact CB-CD1 3.8Å; L219-Y235 HydrophobicContact CB-CE1 4.29Å; L219-D236 PolarHBondContact N-OD2 3.41Å; L219-D236 PolarHBondContact O-N 2.9Å; L219-I237 PolarHBondContact O-N 3.12Å; L219-I237 VanDerWaalsContact O-N 3.13Å
220	I	96.7	Very high	93.4	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	117.9	173	-48.5	174.2	0	0	0	108	I141 I142 L143 I144 I237 L239 I249 Y253 I257	I141-I220 HydrophobicContact CG2-CD1 3.83Å; I141-I220 HydrophobicContact CG2-CG1 4.31Å; I142-I220 PolarHBondContact O-N 2.72Å; L143-I220 CarbonylContact C-O 3.47Å; L143-I220 WeakPolarHBondContact CA-O 3.33Å; L143-I220 HydrophobicContact CD1-CB 4.03Å; L143-I220 HydrophobicContact CD1-CG2 3.78Å; I144-I220 PolarHBondContact N-O 3.36Å; I220-I237 CarbonylContact C-O 3.53Å; I220-I237 WeakPolarHBondContact CA-O 3.23Å; I220-I237 HydrophobicContact CG1-CB 4.28Å; I220-I237 HydrophobicContact CG1-CD1 4.44Å; I220-I237 HydrophobicContact CG2-CB 4.24Å; I220-I237 HydrophobicContact CG2-CG2 4.21Å; I220-L239 HydrophobicContact CG2-CD1 4.12Å; I220-L239 HydrophobicContact CG2-CG 4.3Å; I220-I249 HydrophobicContact CD1-CG1 4.23Å; I220-Y253 HydrophobicContact CD1-CD2 3.88Å; I220-Y253 HydrophobicContact CD1-CE2 3.58Å; I220-Y253 HydrophobicContact CG1-CE2 4.32Å; I220-I257 HydrophobicContact CD1-CG2 4.3Å
221	G	93.6	Very high	93.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	135.6	-178.3	0	0	0	0	0	112.6	Y235 I237 L238 L239	G221-Y235 VanDerWaalsContact CA-CD1 3.46Å; G221-I237 PolarHBondContact N-O 3.4Å; G221-L238 CarbonylContact O-C 3.58Å; G221-L238 WeakPolarHBondContact O-CA 3.28Å; G221-L239 PolarHBondContact O-N 3.28Å
222	I	90.6	Very high	93	Very high	8 Å²	8	55.7 Å²	55.7	4%	0.041	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	115.1	167.6	-52.6	-161.9	0	0	0	110.1	L143 I144 F145 S146 A147 L239 P241 C245	L143-I222 HydrophobicContact CD1-CD1 4.21Å; L143-I222 HydrophobicContact CD1-CG1 3.94Å; I144-I222 PolarHBondContact O-N 3.1Å; F145-I222 HydrophobicContact CD1-CB 4.34Å; F145-I222 HydrophobicContact CD1-CD1 3.61Å; F145-I222 HydrophobicContact CD1-CG1 4.2Å; F145-I222 HydrophobicContact CE1-CD1 3.42Å; F145-I222 VanDerWaalsContact CE1-CD1 3.42Å; F145-I222 HydrophobicContact CE1-CG1 4.44Å; F145-I222 HydrophobicContact CZ-CD1 4.17Å; S146-I222 WeakPolarHBondContact CA-O 3.45Å; S146-I222 PolarHBondContact N-O 3.49Å; A147-I222 PolarHBondContact N-O 3.02Å; A147-I222 VanDerWaalsContact N-O 3.08Å; I222-L239 WeakPolarHBondContact CA-O 3.47Å; I222-L239 HydrophobicContact CG1-CB 4.4Å; I222-P241 HydrophobicContact CG2-CB 4.28Å; I222-P241 HydrophobicContact CG2-CG 4.17Å; I222-C245 HydrophobicContact CD1-CB 3.78Å
223	A	87.2	Confident	92.8	Very high	8 Å²	8	58 Å²	58	7%	0.066	32%	0.316	C	S	.	.			trans	-152.5	157	177.7	0	0	0	0	0	111.7	A147 H228 L231 L239 E240	A147-A223 HydrophobicContact CB-CB 4.1Å; A223-H228 PolarHBondContact O-CD2 2.76Å; A223-H228 PolarHBondContact O-NE2 2.9Å; A223-L231 HydrophobicContact CB-CD1 3.62Å; A223-L239 PolarHBondContact N-O 3.31Å; A223-E240 WeakPolarHBondContact O-CA 3.29Å
224	S	86.7	Confident	92.6	Very high	49 Å²	49	55.6 Å²	55.6	34%	0.343	30%	0.304	S	S	.	.			trans	-61.7	144.8	174.2	54.5	0	0	0	0	111.8	A226 K227 H228	S224-A226 PolarHBondContact O-N 3.47Å; S224-A226 VanDerWaalsContact O-N 3.09Å; S224-K227 WeakPolarHBondContact O-CB 3.32Å; S224-K227 PolarHBondContact O-N 3.36Å; S224-K227 WeakPolarHBondContact OG-CG 3.3Å; S224-H228 PolarHBondContact O-CD2 2.94Å; S224-H228 VanDerWaalsContact O-CD2 3.28Å
225	K	91.2	Very high	92.5	Very high	143 Å²	143	54.9 Å²	54.9	62%	0.622	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-45.9	-42.7	178.1	-163.4	168.5	-170.3	160.8	0	115.2	K227 H228 E240	K225-K227 PolarHBondContact O-N 3.37Å; K225-H228 WeakPolarHBondContact O-CB 3.32Å; K225-H228 PolarHBondContact O-N 3.48Å; K225-E240 HydrophobicContact CB-CG 4.38Å; K225-E240 WeakPolarHBondContact CB-OE2 3.49Å
226	A	89.4	Confident	92.5	Very high	95 Å²	95	55 Å²	55	79%	0.785	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-58.6	-16.5	179.3	0	0	0	0	0	114.2	S224	S224-A226 PolarHBondContact O-N 3.47Å; S224-A226 VanDerWaalsContact O-N 3.09Å
227	K	87.6	Confident	92.5	Very high	17 Å²	17	50.8 Å²	50.8	7%	0.074	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-101.5	-11.9	177.2	-58	-174.8	-176.7	-166.1	0	113	S224 K225 E229 K230 L231 R385 N387 I388	S224-K227 WeakPolarHBondContact O-CB 3.32Å; S224-K227 PolarHBondContact O-N 3.36Å; S224-K227 WeakPolarHBondContact OG-CG 3.3Å; K225-K227 PolarHBondContact O-N 3.37Å; K227-E229 VanDerWaalsContact C-N 3.34Å; K227-E229 PolarHBondContact O-N 3.3Å; K227-K230 PolarHBondContact O-N 3.1Å; K227-K230 VanDerWaalsContact O-N 3.15Å; K227-L231 HydrophobicContact CB-CD1 3.83Å; K227-L231 HydrophobicContact CB-CG 4.45Å; K227-L231 VanDerWaalsContact O-CG 3.28Å; K227-L231 WeakPolarHBondContact O-CG 3.45Å; K227-L231 PolarHBondContact O-N 3.34Å; K227-R385 WeakPolarHBondContact CE-O 3.38Å; K227-R385 PolarHBondContact NZ-O 2.91Å; K227-N387 PolarHBondContact NZ-O 3.46Å; K227-I388 HydrophobicContact CB-CD1 4.27Å; K227-I388 HydrophobicContact CD-CG1 4.03Å; K227-I388 HydrophobicContact CG-CD1 3.91Å; K227-I388 HydrophobicContact CG-CG1 3.94Å
228	H	92.4	Very high	92.4	Very high	35 Å²	35	51.9 Å²	51.9	16%	0.162	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-59	-46.8	-170.5	-75.5	-166.6	0	0	0	111.6	A223 S224 K225 K230 L231 T232 L238	A223-H228 PolarHBondContact O-CD2 2.76Å; A223-H228 PolarHBondContact O-NE2 2.9Å; S224-H228 PolarHBondContact O-CD2 2.94Å; S224-H228 VanDerWaalsContact O-CD2 3.28Å; K225-H228 WeakPolarHBondContact O-CB 3.32Å; K225-H228 PolarHBondContact O-N 3.48Å; H228-K230 PolarHBondContact O-N 3.48Å; H228-K230 VanDerWaalsContact O-N 3.16Å; H228-L231 PolarHBondContact O-N 3.18Å; H228-T232 WeakPolarHBondContact O-CG2 3.49Å; H228-T232 PolarHBondContact O-N 2.92Å; H228-L238 HydrophobicContact CB-CD1 3.99Å; H228-L238 WeakPolarHBondContact O-CD1 2.63Å
229	E	92.3	Very high	92.2	Very high	172 Å²	172	50.6 Å²	50.6	80%	0.804	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-53.4	-38.1	178.8	-172.8	-175.6	174.4	0	0	113.1	K227 L231 T232	K227-E229 VanDerWaalsContact C-N 3.34Å; K227-E229 PolarHBondContact O-N 3.3Å; E229-L231 VanDerWaalsContact C-N 3.34Å; E229-T232 PolarHBondContact O-OG1 3.49Å; E229-T232 VanDerWaalsContact O-OG1 3.06Å
230	K	87.3	Confident	91.9	Very high	138 Å²	138	53 Å²	53	60%	0.6	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-84.2	-6.5	178.9	-61	-156.2	-167.5	179.9	0	114.4	K227 H228 N233 I388	K227-K230 PolarHBondContact O-N 3.1Å; K227-K230 VanDerWaalsContact O-N 3.15Å; H228-K230 PolarHBondContact O-N 3.48Å; H228-K230 VanDerWaalsContact O-N 3.16Å; K230-N233 PolarHBondContact O-OD1 3.23Å; K230-I388 HydrophobicContact CB-CD1 4.32Å; K230-I388 HydrophobicContact CB-CG2 4.47Å; K230-I388 HydrophobicContact CD-CD1 3.64Å; K230-I388 HydrophobicContact CD-CG2 4.47Å; K230-I388 HydrophobicContact CG-CD1 4.2Å
231	L	90.9	Very high	91.3	Very high	1 Å²	1	56 Å²	56	1%	0.005	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-11	-175.5	-65.6	175.2	0	0	0	112.7	A147 T205 A223 K227 H228 E229 N233 I234 Y235 L238	A147-L231 HydrophobicContact CB-CD1 4.01Å; T205-L231 HydrophobicContact CG2-CD2 4Å; A223-L231 HydrophobicContact CB-CD1 3.62Å; K227-L231 HydrophobicContact CB-CD1 3.83Å; K227-L231 HydrophobicContact CB-CG 4.45Å; K227-L231 VanDerWaalsContact O-CG 3.28Å; K227-L231 WeakPolarHBondContact O-CG 3.45Å; K227-L231 PolarHBondContact O-N 3.34Å; H228-L231 PolarHBondContact O-N 3.18Å; E229-L231 VanDerWaalsContact C-N 3.34Å; L231-N233 PolarHBondContact O-N 3.47Å; L231-I234 PolarHBondContact O-N 2.9Å; L231-Y235 HydrophobicContact CB-CD2 4.16Å; L231-Y235 PolarHBondContact O-N 3.12Å; L231-L238 HydrophobicContact CB-CD1 3.96Å; L231-L238 HydrophobicContact CB-CD2 4.04Å; L231-L238 HydrophobicContact CD1-CD2 4.35Å
232	T	92.5	Very high	90.9	Very high	91 Å²	91	62.4 Å²	62.4	56%	0.558	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.8	177.8	48.6	0	0	0	0	113.5	H228 E229 I234 L238	H228-T232 WeakPolarHBondContact O-CG2 3.49Å; H228-T232 PolarHBondContact O-N 2.92Å; E229-T232 PolarHBondContact O-OG1 3.49Å; E229-T232 VanDerWaalsContact O-OG1 3.06Å; T232-I234 VanDerWaalsContact C-N 3.27Å; T232-L238 HydrophobicContact CG2-CD1 4.1Å
233	N	90.2	Very high	90.8	Very high	125 Å²	125	65.7 Å²	65.7	67%	0.668	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-14.3	173.6	63.6	-35.8	0	0	0	113.4	K230 L231	K230-N233 PolarHBondContact O-OD1 3.23Å; L231-N233 PolarHBondContact O-N 3.47Å
234	I	91.8	Very high	90.9	Very high	12 Å²	12	69.5 Å²	69.5	6%	0.062	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-39	-179.3	-60.9	175.6	0	0	0	110.8	T205 G208 Q209 K212 L231 T232	T205-I234 HydrophobicContact CG2-CD1 4.21Å; G208-I234 VanDerWaalsContact CA-CG2 3.44Å; Q209-I234 HydrophobicContact CG-CD1 4.29Å; K212-I234 WeakPolarHBondContact CE-O 3.48Å; L231-I234 PolarHBondContact O-N 2.9Å; T232-I234 VanDerWaalsContact C-N 3.27Å
235	Y	95.7	Very high	91	Very high	5 Å²	5	68.1 Å²	68.1	2%	0.02	36%	0.36	C	S	.	.			trans	-113.2	136.2	-173	-69.6	-87.4	0	0	0	111.8	I144 A147 G204 L219 G221 L231 L238	I144-Y235 HydrophobicContact CB-CE1 3.99Å; I144-Y235 HydrophobicContact CD1-CE1 3.87Å; I144-Y235 HydrophobicContact CG1-CE1 4.26Å; A147-Y235 WeakPolarHBondContact CA-OH 3.19Å; A147-Y235 HydrophobicContact CB-CD1 4.27Å; A147-Y235 HydrophobicContact CB-CD2 3.78Å; A147-Y235 HydrophobicContact CB-CE1 3.85Å; A147-Y235 HydrophobicContact CB-CE2 3.3Å; A147-Y235 HydrophobicContact CB-CG 4.24Å; A147-Y235 WeakPolarHBondContact O-CE2 3.43Å; G204-Y235 WeakPolarHBondContact CA-OH 3.4Å; G204-Y235 PolarHBondContact O-OH 2.94Å; L219-Y235 HydrophobicContact CB-CD1 3.8Å; L219-Y235 HydrophobicContact CB-CE1 4.29Å; G221-Y235 VanDerWaalsContact CA-CD1 3.46Å; L231-Y235 HydrophobicContact CB-CD2 4.16Å; L231-Y235 PolarHBondContact O-N 3.12Å; Y235-L238 HydrophobicContact CD2-CD2 4.31Å; Y235-L238 HydrophobicContact CG-CD2 4.1Å
236	D	97.1	Very high	91.1	Very high	85 Å²	85	62.3 Å²	62.3	46%	0.455	34%	0.336	S	S	.	.	S	Bend	trans	-76	-34.9	177	-55.1	-65.8	0	0	0	111.6	K212 T218 L219	K212-D236 IonicContact NZ-OD1 2.72Å; K212-D236 PolarHBondContact NZ-OD1 3.01Å; K212-D236 IonicContact NZ-OD2 2.89Å; K212-D236 PolarHBondContact NZ-OD2 2.79Å; T218-D236 WeakPolarHBondContact CA-OD2 3.5Å; T218-D236 HydrophobicContact CG2-CB 4.07Å; L219-D236 PolarHBondContact N-OD2 3.41Å; L219-D236 PolarHBondContact O-N 2.9Å
237	I	96.7	Very high	91.3	Very high	38 Å²	38	60.7 Å²	60.7	20%	0.195	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	131.7	-177.6	-52.9	-176.2	0	0	0	108.5	L219 I220 G221 L239 L252 Y253	L219-I237 PolarHBondContact O-N 3.12Å; L219-I237 VanDerWaalsContact O-N 3.13Å; I220-I237 CarbonylContact C-O 3.53Å; I220-I237 WeakPolarHBondContact CA-O 3.23Å; I220-I237 HydrophobicContact CG1-CB 4.28Å; I220-I237 HydrophobicContact CG1-CD1 4.44Å; I220-I237 HydrophobicContact CG2-CB 4.24Å; I220-I237 HydrophobicContact CG2-CG2 4.21Å; G221-I237 PolarHBondContact N-O 3.4Å; I237-L239 HydrophobicContact CG2-CD2 4.38Å; I237-L252 HydrophobicContact CD1-CD1 3.86Å; I237-L252 HydrophobicContact CG2-CD1 4.1Å; I237-Y253 HydrophobicContact CD1-CE2 3.91Å; I237-Y253 WeakPolarHBondContact CD1-OH 3.31Å
238	L	95.4	Very high	91.7	Very high	31 Å²	31	62.3 Å²	62.3	16%	0.162	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.7	178.5	-74.3	161.2	0	0	0	110.1	A147 G221 H228 L231 T232 Y235	A147-L238 HydrophobicContact CB-CD2 4.21Å; G221-L238 CarbonylContact O-C 3.58Å; G221-L238 WeakPolarHBondContact O-CA 3.28Å; H228-L238 HydrophobicContact CB-CD1 3.99Å; H228-L238 WeakPolarHBondContact O-CD1 2.63Å; L231-L238 HydrophobicContact CB-CD1 3.96Å; L231-L238 HydrophobicContact CB-CD2 4.04Å; L231-L238 HydrophobicContact CD1-CD2 4.35Å; T232-L238 HydrophobicContact CG2-CD1 4.1Å; Y235-L238 HydrophobicContact CD2-CD2 4.31Å; Y235-L238 HydrophobicContact CG-CD2 4.1Å
239	L	93.9	Very high	91.8	Very high	9 Å²	9	60.6 Å²	60.6	5%	0.047	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	143.7	175.3	-56.6	179.1	0	0	0	109.8	I220 G221 I222 A223 I237 C245 E248 I249	I220-L239 HydrophobicContact CG2-CD1 4.12Å; I220-L239 HydrophobicContact CG2-CG 4.3Å; G221-L239 PolarHBondContact O-N 3.28Å; I222-L239 WeakPolarHBondContact CA-O 3.47Å; I222-L239 HydrophobicContact CG1-CB 4.4Å; A223-L239 PolarHBondContact N-O 3.31Å; I237-L239 HydrophobicContact CG2-CD2 4.38Å; L239-C245 HydrophobicContact CD1-CB 4.28Å; L239-E248 HydrophobicContact CD1-CB 4.15Å; L239-E248 HydrophobicContact CD2-CB 4.06Å; L239-E248 HydrophobicContact CD2-CG 4.45Å; L239-I249 HydrophobicContact CD1-CG1 4.19Å
240	E	91.3	Very high	92	Very high	50 Å²	50	57.3 Å²	57.3	23%	0.234	30%	0.3	C	S	.	.			trans	-80.2	148	172.2	-58.5	-168.7	-128.1	0	0	111	A223 K225 D242 Q243	A223-E240 WeakPolarHBondContact O-CA 3.29Å; K225-E240 HydrophobicContact CB-CG 4.38Å; K225-E240 WeakPolarHBondContact CB-OE2 3.49Å; E240-D242 WeakPolarHBondContact CB-OD1 2.77Å; E240-D242 PolarHBondContact O-N 2.84Å; E240-D242 VanDerWaalsContact O-N 3.15Å; E240-Q243 HydrophobicContact CB-CG 4.17Å; E240-Q243 WeakPolarHBondContact O-CB 3.29Å; E240-Q243 PolarHBondContact O-N 2.92Å; E240-Q243 VanDerWaalsContact O-N 3.13Å
241	P	84.4	Confident	92.5	Very high	65 Å²	65	57.4 Å²	57.4	42%	0.422	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-14.4	-174.2	-21.4	34.2	0	0	0	115.8	I222	I222-P241 HydrophobicContact CG2-CB 4.28Å; I222-P241 HydrophobicContact CG2-CG 4.17Å
242	D	85	Confident	92.7	Very high	133 Å²	133	61.5 Å²	61.5	71%	0.711	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-11.9	177.3	61.3	-39.1	0	0	0	113.1	E240	E240-D242 WeakPolarHBondContact CB-OD1 2.77Å; E240-D242 PolarHBondContact O-N 2.84Å; E240-D242 VanDerWaalsContact O-N 3.15Å
243	Q	87.2	Confident	93	Very high	77 Å²	77	59.4 Å²	59.4	36%	0.36	30%	0.304	S	S	.	.	S	Bend	trans	-75.8	148.7	173.6	-62.9	-179.2	-68.8	0	0	111.5	E240 C245	E240-Q243 HydrophobicContact CB-CG 4.17Å; E240-Q243 WeakPolarHBondContact O-CB 3.29Å; E240-Q243 PolarHBondContact O-N 2.92Å; E240-Q243 VanDerWaalsContact O-N 3.13Å; Q243-C245 PolarHBondContact O-N 3.2Å
244	D	89.7	Confident	93.2	Very high	88 Å²	88	58.2 Å²	58.2	47%	0.471	30%	0.303	S	S	.	.			trans	-73.5	91.5	169.4	-179.8	2.4	0	0	0	110.1	V246 T247 E248	D244-V246 PolarHBondContact O-N 3.29Å; D244-V246 VanDerWaalsContact O-N 3.17Å; D244-V246 PolarHBondContact OD1-N 3.14Å; D244-V246 VanDerWaalsContact OD1-N 3.12Å; D244-T247 PolarHBondContact O-N 3.32Å; D244-T247 VanDerWaalsContact O-N 3.16Å; D244-T247 PolarHBondContact OD1-N 3.11Å; D244-T247 WeakPolarHBondContact OD2-CB 3.23Å; D244-T247 PolarHBondContact OD2-OG1 3.33Å; D244-E248 WeakPolarHBondContact O-CG 3.48Å; D244-E248 PolarHBondContact O-N 2.85Å
245	C	89.9	Confident	93.4	Very high	21 Å²	21	64.5 Å²	64.5	14%	0.142	34%	0.336	C	S	.	.	H	α-helix	trans	-55.7	-33.2	-178.2	67	0	0	0	0	113.5	I222 L239 Q243 I249	I222-C245 HydrophobicContact CD1-CB 3.78Å; L239-C245 HydrophobicContact CD1-CB 4.28Å; Q243-C245 PolarHBondContact O-N 3.2Å; C245-I249 VanDerWaalsContact O-CB 3.27Å; C245-I249 WeakPolarHBondContact O-CB 3.49Å; C245-I249 WeakPolarHBondContact O-CD1 3.43Å; C245-I249 WeakPolarHBondContact O-CG1 3.1Å; C245-I249 PolarHBondContact O-N 2.89Å
246	V	92.2	Very high	93.4	Very high	20 Å²	20	64.6 Å²	64.6	12%	0.121	34%	0.339	C	S	.	.	H	α-helix	trans	-68.8	-45.7	-179.1	167	0	0	0	0	109.9	D244 K250 K271 L272 I275	D244-V246 PolarHBondContact O-N 3.29Å; D244-V246 VanDerWaalsContact O-N 3.17Å; D244-V246 PolarHBondContact OD1-N 3.14Å; D244-V246 VanDerWaalsContact OD1-N 3.12Å; V246-K250 HydrophobicContact CG1-CD 4.33Å; V246-K250 WeakPolarHBondContact O-CB 3.46Å; V246-K250 VanDerWaalsContact O-CG 3.32Å; V246-K250 WeakPolarHBondContact O-CG 3.37Å; V246-K250 PolarHBondContact O-N 3.38Å; V246-K271 HydrophobicContact CG2-CB 3.99Å; V246-L272 HydrophobicContact CG2-CD2 4.11Å; V246-I275 HydrophobicContact CB-CG2 4.25Å; V246-I275 HydrophobicContact CG1-CG2 3.8Å; V246-I275 HydrophobicContact CG2-CG2 4.32Å
247	T	94.2	Very high	93.4	Very high	61 Å²	61	60.6 Å²	60.6	37%	0.374	32%	0.318	S	S	.	.	H	α-helix	trans	-65.1	-45.5	177.5	-67.5	0	0	0	0	111.6	D244 K250 K251	D244-T247 PolarHBondContact O-N 3.32Å; D244-T247 VanDerWaalsContact O-N 3.16Å; D244-T247 PolarHBondContact OD1-N 3.11Å; D244-T247 WeakPolarHBondContact OD2-CB 3.23Å; D244-T247 PolarHBondContact OD2-OG1 3.33Å; T247-K250 PolarHBondContact O-N 2.88Å; T247-K251 WeakPolarHBondContact O-CG 3.26Å; T247-K251 PolarHBondContact O-N 3.47Å; T247-K251 VanDerWaalsContact O-N 3.16Å
248	E	95.2	Very high	93.5	Very high	51 Å²	51	60.4 Å²	60.4	24%	0.238	32%	0.317	C	S	.	.	H	α-helix	trans	-64.5	-41.7	179.7	-65.7	-50.9	121.4	0	0	112.2	L239 D244 K251 L252	L239-E248 HydrophobicContact CD1-CB 4.15Å; L239-E248 HydrophobicContact CD2-CB 4.06Å; L239-E248 HydrophobicContact CD2-CG 4.45Å; D244-E248 WeakPolarHBondContact O-CG 3.48Å; D244-E248 PolarHBondContact O-N 2.85Å; E248-K251 PolarHBondContact O-N 3.12Å; E248-K251 IonicContact OE1-NZ 2.66Å; E248-K251 PolarHBondContact OE1-NZ 3.26Å; E248-K251 IonicContact OE2-NZ 2.71Å; E248-L252 PolarHBondContact O-N 2.96Å
249	I	95.9	Very high	93.5	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67.4	-40.1	177.6	-69	168.8	0	0	0	111.1	L143 I220 L239 C245 K251 L252 Y253 I257 I275	L143-I249 HydrophobicContact CD1-CD1 3.86Å; L143-I249 HydrophobicContact CD2-CD1 3.63Å; L143-I249 HydrophobicContact CG-CD1 4.21Å; I220-I249 HydrophobicContact CD1-CG1 4.23Å; L239-I249 HydrophobicContact CD1-CG1 4.19Å; C245-I249 VanDerWaalsContact O-CB 3.27Å; C245-I249 WeakPolarHBondContact O-CB 3.49Å; C245-I249 WeakPolarHBondContact O-CD1 3.43Å; C245-I249 WeakPolarHBondContact O-CG1 3.1Å; C245-I249 PolarHBondContact O-N 2.89Å; I249-K251 VanDerWaalsContact C-N 3.28Å; I249-K251 PolarHBondContact O-N 3.07Å; I249-L252 PolarHBondContact O-N 2.97Å; I249-Y253 HydrophobicContact CG2-CD2 4.45Å; I249-Y253 WeakPolarHBondContact O-CA 3.49Å; I249-Y253 PolarHBondContact O-N 3.11Å; I249-I257 HydrophobicContact CG2-CG2 3.7Å; I249-I275 HydrophobicContact CB-CD1 4.34Å; I249-I275 HydrophobicContact CD1-CD1 3.6Å; I249-I275 HydrophobicContact CG2-CB 4.19Å; I249-I275 HydrophobicContact CG2-CD1 4.1Å; I249-I275 HydrophobicContact CG2-CG2 4.4Å
250	K	96.1	Very high	93.5	Very high	103 Å²	103	58.6 Å²	58.6	45%	0.448	31%	0.308	S	S	.	.	H	α-helix	trans	-64.1	-30.5	177	-77.1	-176.3	176.3	-170.2	0	113.6	V246 T247 P254 G274 I275	V246-K250 HydrophobicContact CG1-CD 4.33Å; V246-K250 WeakPolarHBondContact O-CB 3.46Å; V246-K250 VanDerWaalsContact O-CG 3.32Å; V246-K250 WeakPolarHBondContact O-CG 3.37Å; V246-K250 PolarHBondContact O-N 3.38Å; T247-K250 PolarHBondContact O-N 2.88Å; K250-P254 VanDerWaalsContact O-CA 3.27Å; K250-P254 WeakPolarHBondContact O-CA 3.34Å; K250-G274 WeakPolarHBondContact CE-O 3.27Å; K250-G274 PolarHBondContact NZ-O 3.45Å; K250-I275 HydrophobicContact CD-CG2 4.41Å; K250-I275 HydrophobicContact CG-CG2 3.87Å
251	K	96.7	Very high	93.5	Very high	139 Å²	139	56.2 Å²	56.2	60%	0.604	30%	0.297	S	S	*	.	H	α-helix	trans	-65.5	-40.5	174.3	-71.6	170	-176.1	167.9	0	111.6	T247 E248 I249	T247-K251 WeakPolarHBondContact O-CG 3.26Å; T247-K251 PolarHBondContact O-N 3.47Å; T247-K251 VanDerWaalsContact O-N 3.16Å; E248-K251 PolarHBondContact O-N 3.12Å; E248-K251 IonicContact OE1-NZ 2.66Å; E248-K251 PolarHBondContact OE1-NZ 3.26Å; E248-K251 IonicContact OE2-NZ 2.71Å; I249-K251 VanDerWaalsContact C-N 3.28Å; I249-K251 PolarHBondContact O-N 3.07Å
252	L	96.6	Very high	93.6	Very high	87 Å²	87	53.2 Å²	53.2	46%	0.455	28%	0.277	S	S	.	.	H	α-helix	trans	-83.3	-40.5	-176.4	-64.3	166.3	0	0	0	112.1	I237 E248 I249	I237-L252 HydrophobicContact CD1-CD1 3.86Å; I237-L252 HydrophobicContact CG2-CD1 4.1Å; E248-L252 PolarHBondContact O-N 2.96Å; I249-L252 PolarHBondContact O-N 2.97Å
253	Y	97.1	Very high	93.2	Very high	48 Å²	48	46.9 Å²	46.9	19%	0.188	24%	0.243	C	C	.	.			trans	-130	74.5	-175.2	-56.5	-70.5	0	0	0	109.5	I141 T218 I220 I237 I249 N255 G256 I257	I141-Y253 HydrophobicContact CD1-CD1 3.43Å; I141-Y253 VanDerWaalsContact CD1-CD1 3.43Å; I141-Y253 HydrophobicContact CD1-CE1 3.56Å; I141-Y253 HydrophobicContact CD1-CG 4.12Å; I141-Y253 HydrophobicContact CG1-CD1 4.41Å; I141-Y253 HydrophobicContact CG1-CE1 4.14Å; I141-Y253 HydrophobicContact CG2-CD2 4.12Å; I141-Y253 HydrophobicContact CG2-CE1 4.28Å; I141-Y253 HydrophobicContact CG2-CE2 3.89Å; I141-Y253 HydrophobicContact CG2-CG 4.41Å; T218-Y253 VanDerWaalsContact CG2-OH 3.26Å; T218-Y253 WeakPolarHBondContact CG2-OH 3.28Å; I220-Y253 HydrophobicContact CD1-CD2 3.88Å; I220-Y253 HydrophobicContact CD1-CE2 3.58Å; I220-Y253 HydrophobicContact CG1-CE2 4.32Å; I237-Y253 HydrophobicContact CD1-CE2 3.91Å; I237-Y253 WeakPolarHBondContact CD1-OH 3.31Å; I249-Y253 HydrophobicContact CG2-CD2 4.45Å; I249-Y253 WeakPolarHBondContact O-CA 3.49Å; I249-Y253 PolarHBondContact O-N 3.11Å; Y253-N255 PolarHBondContact O-N 3.18Å; Y253-N255 VanDerWaalsContact O-N 3.12Å; Y253-G256 PolarHBondContact O-N 3.27Å; Y253-I257 HydrophobicContact CD2-CG2 4.05Å; Y253-I257 HydrophobicContact CG-CG2 4.17Å
254	P	95.7	Very high	92.5	Very high	100 Å²	100	44.1 Å²	44.1	65%	0.649	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.5	-178.1	23.1	-34.1	0	0	0	113.4	K250 G256	K250-P254 VanDerWaalsContact O-CA 3.27Å; K250-P254 WeakPolarHBondContact O-CA 3.34Å; P254-G256 VanDerWaalsContact C-N 3.3Å
255	N	94.6	Very high	91.4	Very high	143 Å²	143	41.6 Å²	41.6	77%	0.765	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-0.5	175.3	-63.2	-27.6	0	0	0	113.6	Y253 K277	Y253-N255 PolarHBondContact O-N 3.18Å; Y253-N255 VanDerWaalsContact O-N 3.12Å; N255-K277 WeakPolarHBondContact O-CG 3.41Å
256	G	96	Very high	90.1	Very high	8 Å²	8	41.2 Å²	41.2	8%	0.082	22%	0.22	C	C	.	.			trans	89	-176.6	-176.1	0	0	0	0	0	114.3	Y253 P254 I275 K277	Y253-G256 PolarHBondContact O-N 3.27Å; P254-G256 VanDerWaalsContact C-N 3.3Å; G256-I275 CarbonylContact C-O 3.38Å; G256-I275 WeakPolarHBondContact CA-O 3.45Å; G256-K277 WeakPolarHBondContact O-CE 3.48Å
257	I	97.9	Very high	88.5	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	166.1	-178.3	65.7	171.8	0	0	0	110.7	I141 L143 I220 I249 Y253 I260 I275 L276 K277	I141-I257 HydrophobicContact CB-CB 4.13Å; I141-I257 HydrophobicContact CB-CG2 4.11Å; I141-I257 HydrophobicContact CG2-CB 4.01Å; I141-I257 HydrophobicContact CG2-CG2 3.54Å; L143-I257 HydrophobicContact CB-CD1 3.49Å; L143-I257 VanDerWaalsContact CB-CD1 3.49Å; L143-I257 HydrophobicContact CD2-CD1 4.48Å; I220-I257 HydrophobicContact CD1-CG2 4.3Å; I249-I257 HydrophobicContact CG2-CG2 3.7Å; Y253-I257 HydrophobicContact CD2-CG2 4.05Å; Y253-I257 HydrophobicContact CG-CG2 4.17Å; I257-I260 HydrophobicContact CD1-CD1 4.45Å; I257-I260 HydrophobicContact CD1-CG1 3.87Å; I257-I275 HydrophobicContact CD1-CD1 4Å; I257-I275 WeakPolarHBondContact CG1-O 3.41Å; I257-I275 PolarHBondContact N-O 2.96Å; I257-L276 HydrophobicContact CG1-CD2 4.3Å; I257-L276 WeakPolarHBondContact O-CA 3.1Å; I257-K277 PolarHBondContact O-N 3.33Å
258	D	98	Very high	87.3	Confident	34 Å²	34	43.8 Å²	43.8	18%	0.182	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-34.4	-169.3	-55.3	-78.1	0	0	0	112.3	D140 I141 K277 G280 K281	D140-D258 HydrophobicContact CB-CB 4.03Å; I141-D258 PolarHBondContact N-OD2 2.63Å; I141-D258 PolarHBondContact O-N 3.48Å; D258-K277 WeakPolarHBondContact OD1-CD 3.28Å; D258-K277 IonicContact OD1-NZ 2.78Å; D258-K277 PolarHBondContact OD1-NZ 2.66Å; D258-K277 IonicContact OD2-NZ 3.69Å; D258-K277 PolarHBondContact OD2-NZ 3.32Å; D258-G280 CarbonylContact O-C 3.59Å; D258-G280 VanDerWaalsContact O-CA 3.22Å; D258-G280 WeakPolarHBondContact O-CA 3.43Å; D258-K281 PolarHBondContact O-N 2.75Å
259	A	96.9	Very high	86.2	Confident	2 Å²	2	41.8 Å²	41.8	2%	0.017	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	159.2	174.4	0	0	0	0	0	115.9	L134 I141 I142 L143 K281	L134-A259 HydrophobicContact CD1-CB 4.32Å; L134-A259 HydrophobicContact CD2-CB 3.82Å; I141-A259 PolarHBondContact O-N 3.3Å; I142-A259 WeakPolarHBondContact CA-O 3.36Å; I142-A259 HydrophobicContact CD1-CB 3.6Å; L143-A259 PolarHBondContact N-O 2.49Å; A259-K281 CarbonylContact C-O 3.6Å; A259-K281 WeakPolarHBondContact CA-O 3.36Å; A259-K281 HydrophobicContact CB-CB 4.27Å; A259-K281 WeakPolarHBondContact CB-O 2.92Å
260	I	93.8	Very high	85.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	124.3	176.3	-60.8	174.1	0	0	0	109.2	L143 F145 I257 D262 L272 I275 L276 K281 V283	L143-I260 HydrophobicContact CB-CG1 4.2Å; L143-I260 HydrophobicContact CD2-CG1 4.27Å; L143-I260 HydrophobicContact CD2-CG2 4.24Å; L143-I260 WeakPolarHBondContact O-CA 3.4Å; F145-I260 HydrophobicContact CD2-CG2 4.09Å; F145-I260 HydrophobicContact CE2-CG2 3.68Å; I257-I260 HydrophobicContact CD1-CD1 4.45Å; I257-I260 HydrophobicContact CD1-CG1 3.87Å; I260-D262 HydrophobicContact CG2-CB 4.37Å; I260-L272 HydrophobicContact CD1-CB 3.83Å; I260-I275 HydrophobicContact CD1-CD1 3.98Å; I260-I275 HydrophobicContact CD1-CG1 4Å; I260-L276 HydrophobicContact CD1-CD1 4.3Å; I260-L276 HydrophobicContact CD1-CD2 3.9Å; I260-L276 HydrophobicContact CD1-CG 3.89Å; I260-L276 HydrophobicContact CG1-CD2 3.82Å; I260-L276 HydrophobicContact CG1-CG 4.38Å; I260-K281 PolarHBondContact N-O 3.08Å; I260-V283 PolarHBondContact O-N 2.66Å
261	L	91	Very high	84.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	105.9	169.6	-82.1	172.5	0	0	0	109.8	L129 L134 L143 I144 F145 L207 M211 V283 Y285	L129-L261 HydrophobicContact CB-CD2 4.35Å; L129-L261 HydrophobicContact CD1-CD2 4.22Å; L129-L261 HydrophobicContact CD2-CD2 3.86Å; L129-L261 HydrophobicContact CG-CD2 4.38Å; L134-L261 HydrophobicContact CD1-CD1 3.7Å; L134-L261 HydrophobicContact CD1-CD2 3.76Å; L134-L261 HydrophobicContact CD1-CG 3.62Å; L134-L261 HydrophobicContact CG-CD2 4.49Å; L143-L261 PolarHBondContact O-N 2.94Å; I144-L261 HydrophobicContact CG1-CB 4.45Å; I144-L261 HydrophobicContact CG1-CD1 4.28Å; I144-L261 HydrophobicContact CG2-CB 4.5Å; F145-L261 WeakPolarHBondContact CD2-O 3.5Å; F145-L261 PolarHBondContact N-O 2.99Å; L207-L261 HydrophobicContact CD1-CD1 3.85Å; L207-L261 HydrophobicContact CD2-CD1 3.71Å; L207-L261 HydrophobicContact CG-CD1 4.3Å; M211-L261 HydrophobicContact CE-CD1 3.47Å; M211-L261 VanDerWaalsContact CE-CD1 3.47Å; M211-L261 HydrophobicContact SD-CD1 4.5Å; L261-V283 HydrophobicContact CD2-CB 4.1Å; L261-V283 HydrophobicContact CD2-CG1 4.36Å; L261-Y285 VanDerWaalsContact C-CE1 3.46Å; L261-Y285 HydrophobicContact CB-CD1 4.28Å; L261-Y285 HydrophobicContact CB-CE1 3.62Å; L261-Y285 HydrophobicContact CD2-CD1 3.75Å; L261-Y285 HydrophobicContact CD2-CE1 3.89Å; L261-Y285 HydrophobicContact CG-CE1 4.33Å
262	D	85.9	Confident	84.4	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	118.1	-176.3	-174.4	1.8	0	0	0	112.6	F145 I260 I264 S265 H282 V283 I284 Y285	F145-D262 HydrophobicContact CD2-CB 4.07Å; F145-D262 HydrophobicContact CE2-CB 4.43Å; I260-D262 HydrophobicContact CG2-CB 4.37Å; D262-I264 WeakPolarHBondContact OD1-CA 3.44Å; D262-I264 WeakPolarHBondContact OD1-CB 3.45Å; D262-I264 PolarHBondContact OD1-N 3.24Å; D262-S265 PolarHBondContact OD1-N 3Å; D262-S265 PolarHBondContact OD2-N 3.32Å; D262-H282 WeakPolarHBondContact CB-NE2 3.37Å; D262-H282 IonicContact OD2-CE1 3.4Å; D262-H282 IonicContact OD2-NE2 2.77Å; D262-H282 PolarHBondContact OD2-NE2 3.45Å; D262-V283 PolarHBondContact N-O 3.35Å; D262-I284 HydrophobicContact CB-CG1 4.48Å; D262-I284 CarbonylContact O-C 3.58Å; D262-I284 WeakPolarHBondContact O-CA 3.15Å; D262-Y285 WeakPolarHBondContact O-CD1 3.5Å; D262-Y285 PolarHBondContact O-N 3.06Å
263	C	76.7	Confident	84.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-108.6	8.5	173.4	56.7	0	0	0	0	113.1	F145 S146 Y285 G286 S288	F145-C263 PolarHBondContact O-SG 3.01Å; S146-C263 PolarHBondContact OG-SG 3.08Å; C263-Y285 HydrophobicContact CB-CD2 4.47Å; C263-Y285 HydrophobicContact CB-CE1 4Å; C263-Y285 HydrophobicContact CB-CE2 3.97Å; C263-G286 CarbonylContact C-O 2.67Å; C263-G286 VanDerWaalsContact C-O 3.25Å; C263-G286 CarbonylContact O-C 3.58Å; C263-S288 VanDerWaalsContact O-CB 3.29Å; C263-S288 WeakPolarHBondContact O-CB 3.19Å; C263-S288 PolarHBondContact O-N 2.86Å; C263-S288 PolarHBondContact O-OG 3.03Å
264	I	71.6	Confident	83.7	Confident	19 Å²	19	32.9 Å²	32.9	10%	0.097	19%	0.194	C	C	.	.	S	Bend	trans	-97.9	-61.1	-176.6	-60.3	164.7	0	0	0	107.8	F145 R201 D262 S288 N289	F145-I264 HydrophobicContact CB-CD1 3.83Å; F145-I264 HydrophobicContact CB-CG1 4.35Å; F145-I264 HydrophobicContact CD1-CD1 3.15Å; F145-I264 HydrophobicContact CD1-CG1 4.42Å; F145-I264 HydrophobicContact CE1-CD1 3.76Å; F145-I264 HydrophobicContact CG-CD1 3.62Å; R201-I264 HydrophobicContact CG-CG1 4.4Å; R201-I264 VanDerWaalsContact NE-CG1 3.34Å; D262-I264 WeakPolarHBondContact OD1-CA 3.44Å; D262-I264 WeakPolarHBondContact OD1-CB 3.45Å; D262-I264 PolarHBondContact OD1-N 3.24Å; I264-S288 WeakPolarHBondContact CA-OG 3.38Å; I264-N289 WeakPolarHBondContact CG2-ND2 3.32Å; I264-N289 WeakPolarHBondContact CG2-OD1 3.47Å; I264-N289 PolarHBondContact O-ND2 2.78Å
265	S	67.1	Low	83.6	Confident	34 Å²	34	28.1 Å²	28.1	24%	0.238	16%	0.163	C	C	.	.			trans	47.7	111.3	-162.6	-167.6	0	0	0	0	111.5	D262 N289	D262-S265 PolarHBondContact OD1-N 3Å; D262-S265 PolarHBondContact OD2-N 3.32Å; S265-N289 PolarHBondContact O-ND2 2.9Å
266	G	63.4	Low	83.7	Confident	13 Å²	13	22.2 Å²	22.2	13%	0.134	13%	0.131	C	C	.	.			trans	-147.9	-179.8	-169.8	0	0	0	0	0	114.2	D268 T269	G266-D268 PolarHBondContact O-N 2.8Å; G266-D268 VanDerWaalsContact O-N 3.07Å; G266-T269 PolarHBondContact N-OG1 2.97Å; G266-T269 WeakPolarHBondContact O-CB 3.49Å; G266-T269 PolarHBondContact O-N 2.88Å; G266-T269 VanDerWaalsContact O-N 3.12Å; G266-T269 PolarHBondContact O-OG1 3.44Å
267	P	58.8	Low	83.7	Confident	51 Å²	51	24.3 Å²	24.3	33%	0.331	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-12.2	-179.1	27.3	-36.1	0	0	0	114.2	H307 E309	P267-H307 WeakPolarHBondContact CA-O 3.25Å; P267-H307 HydrophobicContact CB-CB 4.02Å; P267-H307 WeakPolarHBondContact CB-O 2.96Å; P267-E309 VanDerWaalsContact O-CG 3.28Å; P267-E309 WeakPolarHBondContact O-CG 3.21Å; P267-E309 VanDerWaalsContact O-OE2 3.09Å
268	D	67.8	Low	83.5	Confident	85 Å²	85	29 Å²	29	46%	0.455	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	10.3	177.7	-63.4	-61.1	0	0	0	113.4	G266 N270 K271 L272	G266-D268 PolarHBondContact O-N 2.8Å; G266-D268 VanDerWaalsContact O-N 3.07Å; D268-N270 VanDerWaalsContact C-N 3.29Å; D268-N270 PolarHBondContact O-N 2.93Å; D268-K271 HydrophobicContact CB-CD 4.24Å; D268-K271 WeakPolarHBondContact O-CB 3.42Å; D268-K271 PolarHBondContact O-N 2.92Å; D268-K271 WeakPolarHBondContact OD1-CE 3.1Å; D268-K271 IonicContact OD1-NZ 3.53Å; D268-K271 PolarHBondContact OD1-NZ 3.22Å; D268-L272 PolarHBondContact O-N 2.95Å
269	T	73.6	Confident	83.3	Confident	8 Å²	8	33.8 Å²	33.8	5%	0.049	19%	0.193	C	C	.	.	H	α-helix	trans	-56	-40.7	-177.6	-58.5	0	0	0	0	111.7	G266 K271 L272 Y273	G266-T269 PolarHBondContact N-OG1 2.97Å; G266-T269 WeakPolarHBondContact O-CB 3.49Å; G266-T269 PolarHBondContact O-N 2.88Å; G266-T269 VanDerWaalsContact O-N 3.12Å; G266-T269 PolarHBondContact O-OG1 3.44Å; T269-K271 VanDerWaalsContact C-N 3.26Å; T269-K271 PolarHBondContact O-N 3.03Å; T269-L272 WeakPolarHBondContact O-CB 2.85Å; T269-L272 PolarHBondContact O-N 3.09Å; T269-Y273 HydrophobicContact CG2-CE2 4.48Å
270	N	78.4	Confident	83.3	Confident	30 Å²	30	33.7 Å²	33.7	16%	0.16	19%	0.193	C	C	.	.	H	α-helix	trans	-69.1	-22.7	179.2	-72.3	-43.6	0	0	0	114	D268 L272 Y273 E309 R315	D268-N270 VanDerWaalsContact C-N 3.29Å; D268-N270 PolarHBondContact O-N 2.93Å; N270-L272 VanDerWaalsContact C-N 3.29Å; N270-Y273 HydrophobicContact CB-CD2 4.41Å; N270-Y273 WeakPolarHBondContact OD1-CE2 3.37Å; N270-E309 WeakPolarHBondContact CB-OE2 3.26Å; N270-E309 PolarHBondContact N-OE2 3.09Å; N270-E309 WeakPolarHBondContact ND2-CB 3.3Å; N270-E309 VanDerWaalsContact ND2-CD 3.31Å; N270-E309 PolarHBondContact ND2-OE2 3.45Å; N270-R315 PolarHBondContact O-NH1 3.43Å
271	K	84.6	Confident	83.3	Confident	114 Å²	114	36.1 Å²	36.1	50%	0.496	20%	0.204	S	C	.	.	H	α-helix	trans	-71.5	-31.1	176.8	-60.8	179.7	-178.9	161.6	0	110.9	V246 D268 T269 Y273 G274	V246-K271 HydrophobicContact CG2-CB 3.99Å; D268-K271 HydrophobicContact CB-CD 4.24Å; D268-K271 WeakPolarHBondContact O-CB 3.42Å; D268-K271 PolarHBondContact O-N 2.92Å; D268-K271 WeakPolarHBondContact OD1-CE 3.1Å; D268-K271 IonicContact OD1-NZ 3.53Å; D268-K271 PolarHBondContact OD1-NZ 3.22Å; T269-K271 VanDerWaalsContact C-N 3.26Å; T269-K271 PolarHBondContact O-N 3.03Å; K271-Y273 VanDerWaalsContact C-N 3.3Å; K271-Y273 PolarHBondContact O-N 3.29Å; K271-G274 PolarHBondContact O-N 3.28Å; K271-G274 VanDerWaalsContact O-N 3.12Å
272	L	87.7	Confident	83.3	Confident	9 Å²	9	36.1 Å²	36.1	5%	0.047	20%	0.204	C	C	.	.	H	α-helix	trans	-66.1	-29	177	-61.5	178.8	0	0	0	112.8	F145 V246 I260 D268 T269 N270 G274 I275	F145-L272 HydrophobicContact CE2-CD1 3.74Å; F145-L272 HydrophobicContact CE2-CD2 4.36Å; F145-L272 HydrophobicContact CZ-CD1 3.7Å; F145-L272 HydrophobicContact CZ-CD2 3.84Å; F145-L272 HydrophobicContact CZ-CG 4.44Å; V246-L272 HydrophobicContact CG2-CD2 4.11Å; I260-L272 HydrophobicContact CD1-CB 3.83Å; D268-L272 PolarHBondContact O-N 2.95Å; T269-L272 WeakPolarHBondContact O-CB 2.85Å; T269-L272 PolarHBondContact O-N 3.09Å; N270-L272 VanDerWaalsContact C-N 3.29Å; L272-G274 PolarHBondContact O-N 3.16Å; L272-I275 HydrophobicContact CD2-CD1 4.32Å; L272-I275 WeakPolarHBondContact O-CG1 3.44Å; L272-I275 PolarHBondContact O-N 2.78Å
273	Y	88.5	Confident	83.5	Confident	5 Å²	5	36 Å²	36	2%	0.02	20%	0.203	C	C	.	.	H	α-helix	trans	-63.2	-30.6	172.8	-58.7	-40.2	0	0	0	112.3	T269 N270 K271 I275 L276 H282 I311 L316 L321 L323	T269-Y273 HydrophobicContact CG2-CE2 4.48Å; N270-Y273 HydrophobicContact CB-CD2 4.41Å; N270-Y273 WeakPolarHBondContact OD1-CE2 3.37Å; K271-Y273 VanDerWaalsContact C-N 3.3Å; K271-Y273 PolarHBondContact O-N 3.29Å; Y273-I275 PolarHBondContact O-N 3.09Å; Y273-I275 VanDerWaalsContact O-N 3.08Å; Y273-L276 HydrophobicContact CD1-CD1 4.15Å; Y273-L276 PolarHBondContact O-N 2.86Å; Y273-L276 VanDerWaalsContact O-N 3.15Å; Y273-H282 HydrophobicContact CE1-CB 3.99Å; Y273-H282 AromaticContact CE1-ND1 3.21Å; Y273-H282 WeakPolarHBondContact CE1-ND1 3.24Å; Y273-H282 AromaticContact CZ-ND1 3.86Å; Y273-I311 HydrophobicContact CE2-CG1 4.17Å; Y273-I311 HydrophobicContact CE2-CG2 4.18Å; Y273-I311 WeakPolarHBondContact OH-CG1 3.49Å; Y273-L316 HydrophobicContact CE1-CD2 4.44Å; Y273-L321 HydrophobicContact CD1-CD1 4.22Å; Y273-L321 HydrophobicContact CG-CD1 4.25Å; Y273-L323 HydrophobicContact CE1-CD1 4.41Å; Y273-L323 WeakPolarHBondContact OH-CD1 3.46Å
274	G	89.2	Confident	83.9	Confident	32 Å²	32	37.2 Å²	37.2	33%	0.33	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	0.3	177.9	0	0	0	0	0	115.2	K250 K271 L272	K250-G274 WeakPolarHBondContact CE-O 3.27Å; K250-G274 PolarHBondContact NZ-O 3.45Å; K271-G274 PolarHBondContact O-N 3.28Å; K271-G274 VanDerWaalsContact O-N 3.12Å; L272-G274 PolarHBondContact O-N 3.16Å
275	I	94.2	Very high	84.2	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	0.1	172.8	60.6	165.7	0	0	0	112.9	L143 V246 I249 K250 G256 I257 I260 L272 Y273	L143-I275 HydrophobicContact CD2-CD1 4.08Å; V246-I275 HydrophobicContact CB-CG2 4.25Å; V246-I275 HydrophobicContact CG1-CG2 3.8Å; V246-I275 HydrophobicContact CG2-CG2 4.32Å; I249-I275 HydrophobicContact CB-CD1 4.34Å; I249-I275 HydrophobicContact CD1-CD1 3.6Å; I249-I275 HydrophobicContact CG2-CB 4.19Å; I249-I275 HydrophobicContact CG2-CD1 4.1Å; I249-I275 HydrophobicContact CG2-CG2 4.4Å; K250-I275 HydrophobicContact CD-CG2 4.41Å; K250-I275 HydrophobicContact CG-CG2 3.87Å; G256-I275 CarbonylContact C-O 3.38Å; G256-I275 WeakPolarHBondContact CA-O 3.45Å; I257-I275 HydrophobicContact CD1-CD1 4Å; I257-I275 WeakPolarHBondContact CG1-O 3.41Å; I257-I275 PolarHBondContact N-O 2.96Å; I260-I275 HydrophobicContact CD1-CD1 3.98Å; I260-I275 HydrophobicContact CD1-CG1 4Å; L272-I275 HydrophobicContact CD2-CD1 4.32Å; L272-I275 WeakPolarHBondContact O-CG1 3.44Å; L272-I275 PolarHBondContact O-N 2.78Å; Y273-I275 PolarHBondContact O-N 3.09Å; Y273-I275 VanDerWaalsContact O-N 3.08Å
276	L	96	Very high	84.2	Confident	19 Å²	19	34.7 Å²	34.7	10%	0.099	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	142.3	174.9	-73.2	172.2	0	0	0	110.7	I257 I260 Y273 H282 L321	I257-L276 HydrophobicContact CG1-CD2 4.3Å; I257-L276 WeakPolarHBondContact O-CA 3.1Å; I260-L276 HydrophobicContact CD1-CD1 4.3Å; I260-L276 HydrophobicContact CD1-CD2 3.9Å; I260-L276 HydrophobicContact CD1-CG 3.89Å; I260-L276 HydrophobicContact CG1-CD2 3.82Å; I260-L276 HydrophobicContact CG1-CG 4.38Å; Y273-L276 HydrophobicContact CD1-CD1 4.15Å; Y273-L276 PolarHBondContact O-N 2.86Å; Y273-L276 VanDerWaalsContact O-N 3.15Å; L276-H282 HydrophobicContact CD1-CB 4.17Å; L276-L321 HydrophobicContact CB-CD1 4.45Å; L276-L321 HydrophobicContact CB-CD2 3.61Å; L276-L321 HydrophobicContact CD1-CD1 4.31Å; L276-L321 HydrophobicContact CD1-CD2 4.1Å
277	K	96.1	Very high	84.1	Confident	51 Å²	51	35.8 Å²	35.8	22%	0.222	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	162.1	164.7	-69.5	163.1	-175.8	174.2	0	110.2	N255 G256 I257 D258 L279 G280 L321	N255-K277 WeakPolarHBondContact O-CG 3.41Å; G256-K277 WeakPolarHBondContact O-CE 3.48Å; I257-K277 PolarHBondContact O-N 3.33Å; D258-K277 WeakPolarHBondContact OD1-CD 3.28Å; D258-K277 IonicContact OD1-NZ 2.78Å; D258-K277 PolarHBondContact OD1-NZ 2.66Å; D258-K277 IonicContact OD2-NZ 3.69Å; D258-K277 PolarHBondContact OD2-NZ 3.32Å; K277-L279 PolarHBondContact O-N 3.02Å; K277-G280 WeakPolarHBondContact O-CA 3.46Å; K277-G280 PolarHBondContact O-N 2.94Å; K277-L321 VanDerWaalsContact O-CD2 3.27Å; K277-L321 WeakPolarHBondContact O-CD2 3.38Å
278	P	94	Very high	84	Confident	99 Å²	99	33.4 Å²	33.4	64%	0.643	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-50.6	139.4	161	-24.4	34.5	0	0	0	110.6	G280	P278-G280 PolarHBondContact O-N 2.69Å
279	L	94.4	Very high	83.5	Confident	134 Å²	134	29.9 Å²	29.9	70%	0.702	16%	0.161	S	C	*	.	E	Extended strand (participates in β ladder)	trans	69.4	5.9	-170.6	-47.7	176.8	0	0	0	115.1	K277 N320	K277-L279 PolarHBondContact O-N 3.02Å; L279-N320 WeakPolarHBondContact CA-O 3.44Å; L279-N320 HydrophobicContact CD2-CB 4.39Å; L279-N320 PolarHBondContact N-O 3.5Å
280	G	95.8	Very high	82.6	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	147.8	178	0	0	0	0	0	112.8	D258 K277 P278 L322	D258-G280 CarbonylContact O-C 3.59Å; D258-G280 VanDerWaalsContact O-CA 3.22Å; D258-G280 WeakPolarHBondContact O-CA 3.43Å; K277-G280 WeakPolarHBondContact O-CA 3.46Å; K277-G280 PolarHBondContact O-N 2.94Å; P278-G280 PolarHBondContact O-N 2.69Å; G280-L322 PolarHBondContact O-N 3.31Å
281	K	94.7	Very high	81.4	Confident	51 Å²	51	29.4 Å²	29.4	22%	0.222	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.6	-172.5	-55.3	179.1	-172.8	173.7	0	111.5	L134 D258 A259 I260 L322	L134-K281 HydrophobicContact CD2-CB 3.76Å; L134-K281 HydrophobicContact CD2-CD 4.33Å; L134-K281 WeakPolarHBondContact O-CD 3.4Å; L134-K281 PolarHBondContact O-NZ 3.37Å; D258-K281 PolarHBondContact O-N 2.75Å; A259-K281 CarbonylContact C-O 3.6Å; A259-K281 WeakPolarHBondContact CA-O 3.36Å; A259-K281 HydrophobicContact CB-CB 4.27Å; A259-K281 WeakPolarHBondContact CB-O 2.92Å; I260-K281 PolarHBondContact N-O 3.08Å; K281-L322 CarbonylContact C-O 3.6Å; K281-L322 WeakPolarHBondContact CA-O 3.42Å; K281-L322 HydrophobicContact CB-CB 4.44Å; K281-L322 HydrophobicContact CB-CD2 4.36Å; K281-L322 HydrophobicContact CD-CD2 4.07Å; K281-L322 HydrophobicContact CG-CB 4.06Å; K281-L322 HydrophobicContact CG-CD2 3.96Å
282	H	91.7	Very high	79.8	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	115.8	169.1	-171.5	177.4	0	0	0	109.1	D262 Y273 L276 L322 L323 G324	D262-H282 WeakPolarHBondContact CB-NE2 3.37Å; D262-H282 IonicContact OD2-CE1 3.4Å; D262-H282 IonicContact OD2-NE2 2.77Å; D262-H282 PolarHBondContact OD2-NE2 3.45Å; Y273-H282 HydrophobicContact CE1-CB 3.99Å; Y273-H282 AromaticContact CE1-ND1 3.21Å; Y273-H282 WeakPolarHBondContact CE1-ND1 3.24Å; Y273-H282 AromaticContact CZ-ND1 3.86Å; L276-H282 HydrophobicContact CD1-CB 4.17Å; H282-L322 PolarHBondContact N-O 2.95Å; H282-L323 HydrophobicContact CB-CD1 3.97Å; H282-L323 CarbonylContact O-C 3.17Å; H282-L323 WeakPolarHBondContact O-CA 3.48Å; H282-L323 WeakPolarHBondContact O-CD1 3.46Å; H282-G324 PolarHBondContact O-N 3.33Å
283	V	89.6	Confident	78.3	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	119.6	177.9	177.8	0	0	0	0	109.9	L129 I133 L134 I260 L261 D262 G324 F326	L129-V283 HydrophobicContact CD2-CG1 3.54Å; I133-V283 HydrophobicContact CG2-CG1 4.1Å; I133-V283 HydrophobicContact CG2-CG2 3.69Å; L134-V283 HydrophobicContact CD2-CB 4.17Å; L134-V283 HydrophobicContact CD2-CG2 3.41Å; L134-V283 VanDerWaalsContact CD2-CG2 3.41Å; L134-V283 HydrophobicContact CG-CG2 4.19Å; I260-V283 PolarHBondContact O-N 2.66Å; L261-V283 HydrophobicContact CD2-CB 4.1Å; L261-V283 HydrophobicContact CD2-CG1 4.36Å; D262-V283 PolarHBondContact N-O 3.35Å; V283-G324 WeakPolarHBondContact CA-O 3.27Å; V283-F326 HydrophobicContact CG1-CB 4.33Å
284	I	84.6	Confident	76.6	Confident	26 Å²	26	30.5 Å²	30.5	13%	0.133	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	121.1	171.7	-58.9	169.4	0	0	0	108.1	D262 L323 G324 G325 F326	D262-I284 HydrophobicContact CB-CG1 4.48Å; D262-I284 CarbonylContact O-C 3.58Å; D262-I284 WeakPolarHBondContact O-CA 3.15Å; I284-L323 HydrophobicContact CD1-CD1 4.29Å; I284-G324 PolarHBondContact N-O 2.83Å; I284-G325 CarbonylContact O-C 3.33Å; I284-G325 VanDerWaalsContact O-CA 3.24Å; I284-G325 WeakPolarHBondContact O-CA 3.3Å; I284-F326 PolarHBondContact O-N 3.26Å
285	Y	78.2	Confident	74.9	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.2	C	C	.	.			trans	-127.5	6.5	-176.7	68	-78.6	0	0	0	114.4	L129 F145 I151 C203 L207 L261 D262 C263 F326	L129-Y285 HydrophobicContact CD1-CD1 4.33Å; L129-Y285 HydrophobicContact CD1-CD2 3.73Å; L129-Y285 HydrophobicContact CD1-CE2 4.31Å; L129-Y285 HydrophobicContact CD1-CG 3.72Å; L129-Y285 HydrophobicContact CD2-CG 4.44Å; F145-Y285 PolarHBondContact O-OH 3.48Å; I151-Y285 HydrophobicContact CG2-CD2 4.27Å; I151-Y285 HydrophobicContact CG2-CE2 4.49Å; C203-Y285 HydrophobicContact CB-CE2 3.48Å; C203-Y285 VanDerWaalsContact CB-CE2 3.48Å; C203-Y285 WeakPolarHBondContact SG-CE2 3.1Å; C203-Y285 VanDerWaalsContact SG-CZ 3.53Å; C203-Y285 PolarHBondContact SG-OH 2.89Å; L207-Y285 HydrophobicContact CD1-CE2 4.21Å; L261-Y285 VanDerWaalsContact C-CE1 3.46Å; L261-Y285 HydrophobicContact CB-CD1 4.28Å; L261-Y285 HydrophobicContact CB-CE1 3.62Å; L261-Y285 HydrophobicContact CD2-CD1 3.75Å; L261-Y285 HydrophobicContact CD2-CE1 3.89Å; L261-Y285 HydrophobicContact CG-CE1 4.33Å; D262-Y285 WeakPolarHBondContact O-CD1 3.5Å; D262-Y285 PolarHBondContact O-N 3.06Å; C263-Y285 HydrophobicContact CB-CD2 4.47Å; C263-Y285 HydrophobicContact CB-CE1 4Å; C263-Y285 HydrophobicContact CB-CE2 3.97Å; Y285-F326 CarbonylContact C-O 3.58Å; Y285-F326 VanDerWaalsContact CA-O 3.29Å; Y285-F326 WeakPolarHBondContact CA-O 3.44Å
286	G	67.5	Low	73.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.22	C	C	.	.			trans	-165.8	167.8	173.2	0	0	0	0	0	112	C263	C263-G286 CarbonylContact C-O 2.67Å; C263-G286 VanDerWaalsContact C-O 3.25Å; C263-G286 CarbonylContact O-C 3.58Å
287	M	60.1	Low	71.5	Confident	36 Å²	36	46.2 Å²	46.2	18%	0.177	23%	0.233	C	C	.	.			trans	-129.6	58	177.6	-63.4	-177.3	78.9	0	0	111	M156 N289 L290	M156-M287 HydrophobicContact CB-SD 3.8Å; M156-M287 PolarHBondContact N-SD 3.22Å; M156-M287 VanDerWaalsContact N-SD 3.36Å; M287-N289 PolarHBondContact O-N 2.82Å; M287-N289 VanDerWaalsContact O-N 3.08Å; M287-L290 HydrophobicContact CB-CD1 3.64Å; M287-L290 HydrophobicContact CB-CG 3.93Å; M287-L290 HydrophobicContact CE-CD1 3.87Å; M287-L290 HydrophobicContact CE-CD2 4.09Å; M287-L290 HydrophobicContact CE-CG 4.28Å; M287-L290 HydrophobicContact CG-CD1 4.45Å; M287-L290 WeakPolarHBondContact O-CG 3.27Å; M287-L290 PolarHBondContact O-N 3.35Å; M287-L290 HydrophobicContact SD-CD1 3.98Å
288	S	57.9	Low	69.4	Low	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-53.1	-28.7	179.5	52.5	0	0	0	0	115	S200 R201 C263 I264 L290 V291	S200-S288 WeakPolarHBondContact O-CA 3.47Å; S200-S288 WeakPolarHBondContact O-CB 3.3Å; R201-S288 WeakPolarHBondContact CG-OG 3.31Å; C263-S288 VanDerWaalsContact O-CB 3.29Å; C263-S288 WeakPolarHBondContact O-CB 3.19Å; C263-S288 PolarHBondContact O-N 2.86Å; C263-S288 PolarHBondContact O-OG 3.03Å; I264-S288 WeakPolarHBondContact CA-OG 3.38Å; S288-L290 PolarHBondContact O-N 3.4Å; S288-V291 PolarHBondContact O-N 3.04Å
289	N	57.7	Low	67.6	Low	11 Å²	11	50.8 Å²	50.8	6%	0.059	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-65.1	-18.2	-178.3	-78.5	-13.4	0	0	0	114.5	R199 I264 S265 M287 V291 T292	R199-N289 WeakPolarHBondContact CB-OD1 3.29Å; R199-N289 VanDerWaalsContact CD-OD1 3.23Å; R199-N289 WeakPolarHBondContact CD-OD1 3.49Å; R199-N289 VanDerWaalsContact CG-OD1 3.29Å; R199-N289 WeakPolarHBondContact CG-OD1 3.42Å; I264-N289 WeakPolarHBondContact CG2-ND2 3.32Å; I264-N289 WeakPolarHBondContact CG2-OD1 3.47Å; I264-N289 PolarHBondContact O-ND2 2.78Å; S265-N289 PolarHBondContact O-ND2 2.9Å; M287-N289 PolarHBondContact O-N 2.82Å; M287-N289 VanDerWaalsContact O-N 3.08Å; N289-V291 VanDerWaalsContact C-N 3.28Å; N289-V291 PolarHBondContact O-N 3.24Å; N289-T292 VanDerWaalsContact O-CG2 3.29Å; N289-T292 WeakPolarHBondContact O-CG2 3.44Å
290	L	52.8	Low	65.9	Low	27 Å²	27	46.8 Å²	46.8	14%	0.141	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-74.3	-23	-176.6	-54.4	176.3	0	0	0	112.5	L19 M156 M287 S288 T292 L301	L19-L290 HydrophobicContact CD1-CB 4.37Å; M156-L290 HydrophobicContact CB-CD1 4.09Å; M156-L290 HydrophobicContact CE-CD1 4.17Å; M156-L290 HydrophobicContact SD-CD1 3.77Å; M287-L290 HydrophobicContact CB-CD1 3.64Å; M287-L290 HydrophobicContact CB-CG 3.93Å; M287-L290 HydrophobicContact CE-CD1 3.87Å; M287-L290 HydrophobicContact CE-CD2 4.09Å; M287-L290 HydrophobicContact CE-CG 4.28Å; M287-L290 HydrophobicContact CG-CD1 4.45Å; M287-L290 WeakPolarHBondContact O-CG 3.27Å; M287-L290 PolarHBondContact O-N 3.35Å; M287-L290 HydrophobicContact SD-CD1 3.98Å; S288-L290 PolarHBondContact O-N 3.4Å; L290-T292 PolarHBondContact O-N 3.4Å; L290-L301 HydrophobicContact CD2-CD1 3.19Å; L290-L301 HydrophobicContact CG-CD1 4.33Å
291	V	53.3	Low	64.1	Low	2 Å²	2	48.9 Å²	48.9	1%	0.012	24%	0.237	C	C	.	.			trans	-96.2	97.5	177.6	176.6	0	0	0	0	107.6	F10 I13 M14 L19 S288 N289	F10-V291 HydrophobicContact CD1-CG2 4.44Å; F10-V291 HydrophobicContact CE1-CB 3.75Å; F10-V291 HydrophobicContact CE1-CG1 4.38Å; F10-V291 HydrophobicContact CE1-CG2 3.42Å; F10-V291 VanDerWaalsContact CE1-CG2 3.42Å; F10-V291 HydrophobicContact CE2-CB 4.38Å; F10-V291 HydrophobicContact CE2-CG1 4.15Å; F10-V291 HydrophobicContact CZ-CB 3.36Å; F10-V291 HydrophobicContact CZ-CG1 3.57Å; F10-V291 HydrophobicContact CZ-CG2 3.49Å; F10-V291 VanDerWaalsContact CZ-CG2 3.49Å; I13-V291 HydrophobicContact CG2-CG1 4.39Å; M14-V291 HydrophobicContact CG-CG2 3.47Å; M14-V291 VanDerWaalsContact CG-CG2 3.47Å; M14-V291 HydrophobicContact SD-CG2 4.36Å; L19-V291 HydrophobicContact CD1-CG2 3.76Å; S288-V291 PolarHBondContact O-N 3.04Å; N289-V291 VanDerWaalsContact C-N 3.28Å; N289-V291 PolarHBondContact O-N 3.24Å
292	T	52	Low	62.3	Low	24 Å²	24	48.4 Å²	48.4	15%	0.147	24%	0.243	C	C	.	.			trans	-103.8	12.7	-176	49.9	0	0	0	0	113.4	H197 N289 L290	H197-T292 PolarHBondContact CD2-O 3.22Å; N289-T292 VanDerWaalsContact O-CG2 3.29Å; N289-T292 WeakPolarHBondContact O-CG2 3.44Å; L290-T292 PolarHBondContact O-N 3.4Å
293	G	56.3	Low	60.7	Low	28 Å²	28	54.5 Å²	54.5	29%	0.289	27%	0.269	S	S	.	.	S	Bend	trans	158.9	-159	-179.1	0	0	0	0	0	111.5	Q17 Q383	Q17-G293 PolarHBondContact NE2-O 3.33Å; G293-Q383 PolarHBondContact O-NE2 2.9Å
294	D	52.7	Low	59.2	Low	98 Å²	98	57.3 Å²	57.3	52%	0.524	28%	0.283	S	S	.	.	S	Bend	trans	-77.4	-24.9	-177	-69	-27.1	0	0	0	114.7	Q17 Q383	Q17-D294 PolarHBondContact NE2-O 2.77Å; D294-Q383 PolarHBondContact OD1-NE2 3.1Å
295	R	53.6	Low	57.8	Low	218 Å²	218	61.6 Å²	61.6	82%	0.823	30%	0.297	S	S	*	.	S	Bend	trans	-119.5	154	-176.9	-69.1	-168.4	-87.5	-169.5	-5.4	111.3	N297	R295-N297 PolarHBondContact O-N 3.11Å; R295-N297 VanDerWaalsContact O-N 3.17Å
296	K	58.4	Low	56.6	Low	95 Å²	95	69 Å²	69	41%	0.413	33%	0.329	S	S	.	.			trans	-53.5	120.1	169.7	-69	-171.7	176.8	-170.9	0	109.3	Q17 G18 L19 F298	Q17-K296 WeakPolarHBondContact O-CE 3.44Å; Q17-K296 VanDerWaalsContact O-CG 3.27Å; Q17-K296 WeakPolarHBondContact O-CG 3.43Å; G18-K296 VanDerWaalsContact O-CE 3.29Å; G18-K296 WeakPolarHBondContact O-CE 3.04Å; G18-K296 PolarHBondContact O-NZ 2.89Å; L19-K296 HydrophobicContact CD2-CG 4.34Å; K296-F298 HydrophobicContact CB-CD2 4.1Å; K296-F298 HydrophobicContact CB-CE2 3.83Å; K296-F298 HydrophobicContact CB-CZ 4.48Å; K296-F298 HydrophobicContact CD-CE1 4.49Å; K296-F298 HydrophobicContact CD-CE2 3.64Å; K296-F298 HydrophobicContact CD-CZ 3.57Å; K296-F298 HydrophobicContact CG-CE2 4.4Å
297	N	59.9	Low	56	Low	70 Å²	70	73.9 Å²	73.9	37%	0.374	35%	0.352	S	S	.	.			trans	-109.8	82.7	171	-167	-17.4	0	0	0	109.6	R295 L299 N300 L301	R295-N297 PolarHBondContact O-N 3.11Å; R295-N297 VanDerWaalsContact O-N 3.17Å; N297-L299 PolarHBondContact O-N 2.92Å; N297-N300 HydrophobicContact CB-CB 4.19Å; N297-N300 PolarHBondContact ND2-ND2 2.83Å; N297-N300 VanDerWaalsContact ND2-ND2 3.17Å; N297-N300 PolarHBondContact O-N 3.03Å; N297-N300 PolarHBondContact OD1-N 2.82Å; N297-L301 PolarHBondContact O-N 3.06Å
298	F	51.9	Low	56	Low	141 Å²	141	76.3 Å²	76.3	62%	0.618	37%	0.365	S	S	*	.	H	α-helix	trans	-57.4	-34.7	-176.7	-75.6	-84.1	0	0	0	113.3	K296 L301 A302	K296-F298 HydrophobicContact CB-CD2 4.1Å; K296-F298 HydrophobicContact CB-CE2 3.83Å; K296-F298 HydrophobicContact CB-CZ 4.48Å; K296-F298 HydrophobicContact CD-CE1 4.49Å; K296-F298 HydrophobicContact CD-CE2 3.64Å; K296-F298 HydrophobicContact CD-CZ 3.57Å; K296-F298 HydrophobicContact CG-CE2 4.4Å; F298-L301 WeakPolarHBondContact O-CB 3.4Å; F298-L301 PolarHBondContact O-N 2.83Å; F298-A302 WeakPolarHBondContact O-CB 3.43Å; F298-A302 PolarHBondContact O-N 3.34Å
299	L	55.6	Low	55.9	Low	105 Å²	105	79.7 Å²	79.7	55%	0.55	38%	0.381	S	S	.	.	H	α-helix	trans	-66.2	-44.4	177.8	-87.8	148.9	0	0	0	111.7	M189 N297 L301 A302 K303	M189-L299 HydrophobicContact CE-CD2 4.16Å; N297-L299 PolarHBondContact O-N 2.92Å; L299-L301 VanDerWaalsContact C-N 3.32Å; L299-A302 PolarHBondContact O-N 3.36Å; L299-K303 WeakPolarHBondContact O-CB 3.3Å; L299-K303 PolarHBondContact O-N 3.23Å
300	N	59.3	Low	56.2	Low	50 Å²	50	90.2 Å²	90.2	27%	0.267	42%	0.42	S	S	.	.	H	α-helix	trans	-66.4	-36.6	175.3	-86.6	-5.9	0	0	0	112	N297 K303 H304	N297-N300 HydrophobicContact CB-CB 4.19Å; N297-N300 PolarHBondContact ND2-ND2 2.83Å; N297-N300 VanDerWaalsContact ND2-ND2 3.17Å; N297-N300 PolarHBondContact O-N 3.03Å; N297-N300 PolarHBondContact OD1-N 2.82Å; N300-K303 PolarHBondContact O-N 3.33Å; N300-H304 PolarHBondContact O-N 3.32Å; N300-H304 PolarHBondContact O-ND1 2.92Å
301	L	58.1	Low	57	Low	45 Å²	45	91.6 Å²	91.6	24%	0.236	43%	0.427	C	S	.	.	H	α-helix	trans	-61.1	-48.3	174.1	-178.5	64.4	0	0	0	111	M156 L290 N297 F298 L299 H304 W305	M156-L301 HydrophobicContact CE-CD1 4.47Å; M156-L301 HydrophobicContact CE-CD2 4.46Å; L290-L301 HydrophobicContact CD2-CD1 3.19Å; L290-L301 HydrophobicContact CG-CD1 4.33Å; N297-L301 PolarHBondContact O-N 3.06Å; F298-L301 WeakPolarHBondContact O-CB 3.4Å; F298-L301 PolarHBondContact O-N 2.83Å; L299-L301 VanDerWaalsContact C-N 3.32Å; L301-H304 PolarHBondContact O-N 2.87Å; L301-W305 VanDerWaalsContact O-CB 3.24Å; L301-W305 WeakPolarHBondContact O-CB 3.47Å; L301-W305 PolarHBondContact O-N 3.18Å
302	A	55.9	Low	58	Low	41 Å²	41	95.4 Å²	95.4	34%	0.339	45%	0.447	S	S	.	.	H	α-helix	trans	-62.6	-43.3	176.6	0	0	0	0	0	111.9	F298 L299 W305 F306	F298-A302 WeakPolarHBondContact O-CB 3.43Å; F298-A302 PolarHBondContact O-N 3.34Å; L299-A302 PolarHBondContact O-N 3.36Å; A302-W305 WeakPolarHBondContact O-CB 3.46Å; A302-W305 PolarHBondContact O-N 3.11Å; A302-F306 WeakPolarHBondContact O-CD2 3.35Å; A302-F306 PolarHBondContact O-N 3.3Å
303	K	58.9	Low	59.4	Low	128 Å²	128	99 Å²	99	56%	0.557	47%	0.47	S	S	*	.	H	α-helix	trans	-60.5	-48.1	176.8	-174.7	176.6	179.7	179.3	0	111.7	L299 N300 W305 F306 H307	L299-K303 WeakPolarHBondContact O-CB 3.3Å; L299-K303 PolarHBondContact O-N 3.23Å; N300-K303 PolarHBondContact O-N 3.33Å; K303-W305 VanDerWaalsContact C-N 3.28Å; K303-W305 PolarHBondContact O-N 2.95Å; K303-F306 PolarHBondContact O-N 2.98Å; K303-H307 PolarHBondContact O-CD2 2.92Å; K303-H307 PolarHBondContact O-N 3.22Å
304	H	58.2	Low	60.7	Low	59 Å²	59	103 Å²	103	27%	0.273	49%	0.485	S	S	.	.	H	α-helix	trans	-61.1	-41.6	175.4	-78	80	0	0	0	110.9	N300 L301 H307 I308	N300-H304 PolarHBondContact O-N 3.32Å; N300-H304 PolarHBondContact O-ND1 2.92Å; L301-H304 PolarHBondContact O-N 2.87Å; H304-H307 CarbonylContact O-C 3.49Å; H304-H307 WeakPolarHBondContact O-CA 3.4Å; H304-H307 PolarHBondContact O-N 2.78Å; H304-H307 VanDerWaalsContact O-N 3.08Å; H304-I308 WeakPolarHBondContact O-CG1 3.47Å; H304-I308 PolarHBondContact O-N 3.14Å
305	W	54.5	Low	62.2	Low	115 Å²	115	101.7 Å²	101.7	44%	0.436	47%	0.472	S	S	.	.	H	α-helix	trans	-59.5	-46.1	178.4	-177.3	82.5	0	0	0	113.3	L159 I163 L301 A302 K303 H307 I308	L159-W305 HydrophobicContact CD1-CZ2 4.12Å; I163-W305 HydrophobicContact CD1-CZ2 4.18Å; L301-W305 VanDerWaalsContact O-CB 3.24Å; L301-W305 WeakPolarHBondContact O-CB 3.47Å; L301-W305 PolarHBondContact O-N 3.18Å; A302-W305 WeakPolarHBondContact O-CB 3.46Å; A302-W305 PolarHBondContact O-N 3.11Å; K303-W305 VanDerWaalsContact C-N 3.28Å; K303-W305 PolarHBondContact O-N 2.95Å; W305-H307 PolarHBondContact O-N 2.92Å; W305-I308 HydrophobicContact CG-CD1 4.49Å; W305-I308 WeakPolarHBondContact O-CB 3.35Å; W305-I308 PolarHBondContact O-N 3.37Å; W305-I308 VanDerWaalsContact O-N 3.07Å
306	F	53.1	Low	63.8	Low	155 Å²	155	92.9 Å²	92.9	68%	0.68	44%	0.441	S	S	*	.	H	α-helix	trans	-63.3	-23.8	175.6	-83.1	-70.6	0	0	0	113.2	A302 K303	A302-F306 WeakPolarHBondContact O-CD2 3.35Å; A302-F306 PolarHBondContact O-N 3.3Å; K303-F306 PolarHBondContact O-N 2.98Å
307	H	55.8	Low	65.2	Low	104 Å²	104	94.9 Å²	94.9	48%	0.481	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	6.6	176.1	-62.3	-61.7	0	0	0	113.5	P267 K303 H304 W305 E309	P267-H307 WeakPolarHBondContact CA-O 3.25Å; P267-H307 HydrophobicContact CB-CB 4.02Å; P267-H307 WeakPolarHBondContact CB-O 2.96Å; K303-H307 PolarHBondContact O-CD2 2.92Å; K303-H307 PolarHBondContact O-N 3.22Å; H304-H307 CarbonylContact O-C 3.49Å; H304-H307 WeakPolarHBondContact O-CA 3.4Å; H304-H307 PolarHBondContact O-N 2.78Å; H304-H307 VanDerWaalsContact O-N 3.08Å; W305-H307 PolarHBondContact O-N 2.92Å; H307-E309 VanDerWaalsContact C-N 3.34Å; H307-E309 PolarHBondContact O-N 3.19Å
308	I	60.4	Low	66.6	Low	86 Å²	86	96.9 Å²	96.9	44%	0.441	46%	0.462	S	S	.	.			trans	-64.5	104.9	168.2	-66.7	172.7	0	0	0	105.6	H304 W305 R310	H304-I308 WeakPolarHBondContact O-CG1 3.47Å; H304-I308 PolarHBondContact O-N 3.14Å; W305-I308 HydrophobicContact CG-CD1 4.49Å; W305-I308 WeakPolarHBondContact O-CB 3.35Å; W305-I308 PolarHBondContact O-N 3.37Å; W305-I308 VanDerWaalsContact O-N 3.07Å; I308-R310 PolarHBondContact O-N 3.22Å
309	E	55.7	Low	68.5	Low	72 Å²	72	93.5 Å²	93.5	34%	0.336	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-62	130.8	178.4	-64.7	-172.4	132.4	0	0	108.9	P267 N270 H307 I311	P267-E309 VanDerWaalsContact O-CG 3.28Å; P267-E309 WeakPolarHBondContact O-CG 3.21Å; P267-E309 VanDerWaalsContact O-OE2 3.09Å; N270-E309 WeakPolarHBondContact CB-OE2 3.26Å; N270-E309 PolarHBondContact N-OE2 3.09Å; N270-E309 WeakPolarHBondContact ND2-CB 3.3Å; N270-E309 VanDerWaalsContact ND2-CD 3.31Å; N270-E309 PolarHBondContact ND2-OE2 3.45Å; H307-E309 VanDerWaalsContact C-N 3.34Å; H307-E309 PolarHBondContact O-N 3.19Å; E309-I311 PolarHBondContact O-N 2.89Å
310	R	64	Low	70.3	Confident	232 Å²	232	93.2 Å²	93.2	88%	0.875	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-67.6	118.5	171.9	-71.4	-179.6	167.7	177.2	-4.5	107.8	I308 N312	I308-R310 PolarHBondContact O-N 3.22Å; R310-N312 PolarHBondContact O-N 3.43Å
311	I	70	Confident	71.9	Confident	56 Å²	56	91.8 Å²	91.8	29%	0.287	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-68.3	124.6	170.5	-63.6	144.2	0	0	0	107	Y273 E309 P313 L316 L323	Y273-I311 HydrophobicContact CE2-CG1 4.17Å; Y273-I311 HydrophobicContact CE2-CG2 4.18Å; Y273-I311 WeakPolarHBondContact OH-CG1 3.49Å; E309-I311 PolarHBondContact O-N 2.89Å; I311-P313 VanDerWaalsContact O-CD 3.28Å; I311-P313 WeakPolarHBondContact O-CD 3.12Å; I311-L316 HydrophobicContact CG2-CD1 3.76Å; I311-L316 HydrophobicContact CG2-CD2 4.31Å; I311-L316 HydrophobicContact CG2-CG 4Å; I311-L323 HydrophobicContact CB-CD2 4.37Å; I311-L323 HydrophobicContact CD1-CD2 3.22Å; I311-L323 HydrophobicContact CG1-CD2 4.04Å; I311-L323 HydrophobicContact CG2-CD2 3.95Å
312	N	74	Confident	73.5	Confident	82 Å²	82	93.9 Å²	93.9	44%	0.439	45%	0.451	S	S	.	.			trans	-82.2	113.5	176.7	-176.2	-6.4	0	0	0	109	R310 L314 R315 L316	R310-N312 PolarHBondContact O-N 3.43Å; N312-L314 PolarHBondContact O-N 2.93Å; N312-L314 WeakPolarHBondContact OD1-CB 3.27Å; N312-L314 PolarHBondContact OD1-N 3.08Å; N312-R315 HydrophobicContact CB-CB 4.06Å; N312-R315 WeakPolarHBondContact O-CB 3.37Å; N312-R315 PolarHBondContact O-N 3.29Å; N312-L316 PolarHBondContact O-N 2.89Å
313	P	80.3	Confident	75.1	Confident	98 Å²	98	94.5 Å²	94.5	64%	0.636	45%	0.448	S	S	*	.	H	α-helix	trans	-58.8	-31	179.2	-23.4	35.2	0	0	0	113.1	I311 R315 L316 H317	I311-P313 VanDerWaalsContact O-CD 3.28Å; I311-P313 WeakPolarHBondContact O-CD 3.12Å; P313-R315 VanDerWaalsContact C-N 3.3Å; P313-R315 PolarHBondContact O-N 3.19Å; P313-L316 PolarHBondContact O-N 3.42Å; P313-H317 PolarHBondContact O-N 2.8Å
314	L	84.7	Confident	76.3	Confident	113 Å²	113	89.5 Å²	89.5	59%	0.592	43%	0.433	S	S	*	.	H	α-helix	trans	-63.9	-36.7	175.3	-65.6	174.9	0	0	0	111.7	N312 H317 D318	N312-L314 PolarHBondContact O-N 2.93Å; N312-L314 WeakPolarHBondContact OD1-CB 3.27Å; N312-L314 PolarHBondContact OD1-N 3.08Å; L314-H317 WeakPolarHBondContact O-CB 3.5Å; L314-H317 PolarHBondContact O-N 3.45Å; L314-D318 WeakPolarHBondContact O-CB 3.46Å; L314-D318 PolarHBondContact O-N 2.83Å
315	R	84.4	Confident	77.6	Confident	71 Å²	71	89.2 Å²	89.2	27%	0.268	45%	0.446	S	S	.	.	H	α-helix	trans	-65.9	-41.4	176.9	-172.9	177.4	-179.8	-160.4	-10.8	111.6	N270 N312 P313 H317 D318 E319	N270-R315 PolarHBondContact O-NH1 3.43Å; N312-R315 HydrophobicContact CB-CB 4.06Å; N312-R315 WeakPolarHBondContact O-CB 3.37Å; N312-R315 PolarHBondContact O-N 3.29Å; P313-R315 VanDerWaalsContact C-N 3.3Å; P313-R315 PolarHBondContact O-N 3.19Å; R315-H317 VanDerWaalsContact C-N 3.31Å; R315-H317 PolarHBondContact O-N 3.46Å; R315-D318 PolarHBondContact O-N 3.43Å; R315-E319 HydrophobicContact CG-CG 4.22Å; R315-E319 WeakPolarHBondContact CG-OE1 3.14Å; R315-E319 IonicContact CZ-OE1 2.81Å; R315-E319 IonicContact CZ-OE2 3.31Å; R315-E319 IonicContact NE-OE1 2.61Å; R315-E319 PolarHBondContact NE-OE1 2.9Å; R315-E319 IonicContact NE-OE2 3.8Å; R315-E319 PolarHBondContact NE-OE2 3.5Å; R315-E319 IonicContact NH2-OE1 3.34Å; R315-E319 PolarHBondContact NH2-OE1 3Å; R315-E319 IonicContact NH2-OE2 3.25Å; R315-E319 PolarHBondContact NH2-OE2 3.3Å; R315-E319 VanDerWaalsContact O-CB 3.29Å; R315-E319 WeakPolarHBondContact O-CB 3.4Å; R315-E319 WeakPolarHBondContact O-CG 3.4Å; R315-E319 PolarHBondContact O-N 2.88Å
316	L	86.2	Confident	79.1	Confident	33 Å²	33	84.5 Å²	84.5	17%	0.173	43%	0.429	C	S	.	.	H	α-helix	trans	-61.6	-41.9	175	-63.9	177.9	0	0	0	111.4	Y273 I311 N312 P313 N320 L321 L323	Y273-L316 HydrophobicContact CE1-CD2 4.44Å; I311-L316 HydrophobicContact CG2-CD1 3.76Å; I311-L316 HydrophobicContact CG2-CD2 4.31Å; I311-L316 HydrophobicContact CG2-CG 4Å; N312-L316 PolarHBondContact O-N 2.89Å; P313-L316 PolarHBondContact O-N 3.42Å; L316-N320 PolarHBondContact O-N 3.4Å; L316-N320 VanDerWaalsContact O-N 3.14Å; L316-L321 HydrophobicContact CD2-CB 3.97Å; L316-L321 PolarHBondContact O-N 2.87Å; L316-L323 HydrophobicContact CD1-CB 3.93Å; L316-L323 HydrophobicContact CD1-CD2 4.46Å; L316-L323 HydrophobicContact CD2-CB 4.23Å
317	H	88.2	Confident	80.6	Confident	137 Å²	137	77.7 Å²	77.7	63%	0.634	40%	0.4	S	S	*	.	H	α-helix	trans	-62.9	-51.6	175.6	172.8	-87.2	0	0	0	112	P313 L314 R315 E319 N320	P313-H317 PolarHBondContact O-N 2.8Å; L314-H317 WeakPolarHBondContact O-CB 3.5Å; L314-H317 PolarHBondContact O-N 3.45Å; R315-H317 VanDerWaalsContact C-N 3.31Å; R315-H317 PolarHBondContact O-N 3.46Å; H317-E319 PolarHBondContact O-N 2.76Å; H317-N320 PolarHBondContact O-N 2.95Å
318	D	90.4	Very high	82.1	Confident	111 Å²	111	72.7 Å²	72.7	59%	0.594	38%	0.377	S	S	*	.	H	α-helix	trans	-70.3	-34.1	-173.9	-64.3	-13.7	0	0	0	112.3	L314 R315	L314-D318 WeakPolarHBondContact O-CB 3.46Å; L314-D318 PolarHBondContact O-N 2.83Å; R315-D318 PolarHBondContact O-N 3.43Å
319	E	90	Very high	83.2	Confident	71 Å²	71	69.9 Å²	69.9	33%	0.332	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-0.6	177.9	-63.4	179	-171.5	0	0	113	R315 H317 L321	R315-E319 HydrophobicContact CG-CG 4.22Å; R315-E319 WeakPolarHBondContact CG-OE1 3.14Å; R315-E319 IonicContact CZ-OE1 2.81Å; R315-E319 IonicContact CZ-OE2 3.31Å; R315-E319 IonicContact NE-OE1 2.61Å; R315-E319 PolarHBondContact NE-OE1 2.9Å; R315-E319 IonicContact NE-OE2 3.8Å; R315-E319 PolarHBondContact NE-OE2 3.5Å; R315-E319 IonicContact NH2-OE1 3.34Å; R315-E319 PolarHBondContact NH2-OE1 3Å; R315-E319 IonicContact NH2-OE2 3.25Å; R315-E319 PolarHBondContact NH2-OE2 3.3Å; R315-E319 VanDerWaalsContact O-CB 3.29Å; R315-E319 WeakPolarHBondContact O-CB 3.4Å; R315-E319 WeakPolarHBondContact O-CG 3.4Å; R315-E319 PolarHBondContact O-N 2.88Å; H317-E319 PolarHBondContact O-N 2.76Å; E319-L321 HydrophobicContact CB-CD1 3.85Å; E319-L321 HydrophobicContact CB-CG 3.77Å; E319-L321 PolarHBondContact O-N 3.01Å; E319-L321 WeakPolarHBondContact OE2-CD1 3.44Å
320	N	93.4	Very high	84.4	Confident	99 Å²	99	69.4 Å²	69.4	53%	0.529	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	46	-176.5	-62.3	-89.6	0	0	0	113.2	L279 L316 H317	L279-N320 WeakPolarHBondContact CA-O 3.44Å; L279-N320 HydrophobicContact CD2-CB 4.39Å; L279-N320 PolarHBondContact N-O 3.5Å; L316-N320 PolarHBondContact O-N 3.4Å; L316-N320 VanDerWaalsContact O-N 3.14Å; H317-N320 PolarHBondContact O-N 2.95Å
321	L	93.1	Very high	85.4	Confident	19 Å²	19	60.4 Å²	60.4	10%	0.099	34%	0.335	C	S	.	.			trans	-105.7	147.3	-176	-60.8	179.8	0	0	0	112.2	Y273 L276 K277 L316 E319	Y273-L321 HydrophobicContact CD1-CD1 4.22Å; Y273-L321 HydrophobicContact CG-CD1 4.25Å; L276-L321 HydrophobicContact CB-CD1 4.45Å; L276-L321 HydrophobicContact CB-CD2 3.61Å; L276-L321 HydrophobicContact CD1-CD1 4.31Å; L276-L321 HydrophobicContact CD1-CD2 4.1Å; K277-L321 VanDerWaalsContact O-CD2 3.27Å; K277-L321 WeakPolarHBondContact O-CD2 3.38Å; L316-L321 HydrophobicContact CD2-CB 3.97Å; L316-L321 PolarHBondContact O-N 2.87Å; E319-L321 HydrophobicContact CB-CD1 3.85Å; E319-L321 HydrophobicContact CB-CG 3.77Å; E319-L321 PolarHBondContact O-N 3.01Å; E319-L321 WeakPolarHBondContact OE2-CD1 3.44Å
322	L	91.8	Very high	86.1	Confident	90 Å²	90	57.9 Å²	57.9	47%	0.471	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	126.2	171	-170.2	88.6	0	0	0	110.1	G280 K281 H282	G280-L322 PolarHBondContact O-N 3.31Å; K281-L322 CarbonylContact C-O 3.6Å; K281-L322 WeakPolarHBondContact CA-O 3.42Å; K281-L322 HydrophobicContact CB-CB 4.44Å; K281-L322 HydrophobicContact CB-CD2 4.36Å; K281-L322 HydrophobicContact CD-CD2 4.07Å; K281-L322 HydrophobicContact CG-CB 4.06Å; K281-L322 HydrophobicContact CG-CD2 3.96Å; H282-L322 PolarHBondContact N-O 2.95Å
323	L	89.1	Confident	86.3	Confident	53 Å²	53	55.3 Å²	55.3	28%	0.277	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.4	166.8	178	69	0	0	0	109.8	Y273 H282 I284 I311 L316	Y273-L323 HydrophobicContact CE1-CD1 4.41Å; Y273-L323 WeakPolarHBondContact OH-CD1 3.46Å; H282-L323 HydrophobicContact CB-CD1 3.97Å; H282-L323 CarbonylContact O-C 3.17Å; H282-L323 WeakPolarHBondContact O-CA 3.48Å; H282-L323 WeakPolarHBondContact O-CD1 3.46Å; I284-L323 HydrophobicContact CD1-CD1 4.29Å; I311-L323 HydrophobicContact CB-CD2 4.37Å; I311-L323 HydrophobicContact CD1-CD2 3.22Å; I311-L323 HydrophobicContact CG1-CD2 4.04Å; I311-L323 HydrophobicContact CG2-CD2 3.95Å; L316-L323 HydrophobicContact CD1-CB 3.93Å; L316-L323 HydrophobicContact CD1-CD2 4.46Å; L316-L323 HydrophobicContact CD2-CB 4.23Å
324	G	86.1	Confident	86.2	Confident	24 Å²	24	52.9 Å²	52.9	25%	0.247	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	163.3	179.7	0	0	0	0	0	113.6	H282 V283 I284	H282-G324 PolarHBondContact O-N 3.33Å; V283-G324 WeakPolarHBondContact CA-O 3.27Å; I284-G324 PolarHBondContact N-O 2.83Å
325	G	84.1	Confident	85.5	Confident	53 Å²	53	57.7 Å²	57.7	55%	0.546	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.6	173.9	0	0	0	0	0	111.1	I284	I284-G325 CarbonylContact O-C 3.33Å; I284-G325 VanDerWaalsContact O-CA 3.24Å; I284-G325 WeakPolarHBondContact O-CA 3.3Å
326	F	86.7	Confident	84.9	Confident	16 Å²	16	58 Å²	58	7%	0.07	31%	0.31	C	S	.	.			trans	-138.2	138.4	175.3	179.3	-116.7	0	0	0	112.7	P125 I128 L129 I133 I155 V283 I284 Y285 L331	P125-F326 HydrophobicContact CB-CE1 3.48Å; P125-F326 VanDerWaalsContact CB-CE1 3.48Å; P125-F326 HydrophobicContact CB-CZ 4.08Å; I128-F326 HydrophobicContact CB-CE2 4.4Å; I128-F326 HydrophobicContact CB-CZ 3.94Å; I128-F326 HydrophobicContact CD1-CE2 4.49Å; I128-F326 HydrophobicContact CD1-CZ 4.01Å; I128-F326 HydrophobicContact CG2-CD2 4.39Å; I128-F326 HydrophobicContact CG2-CE1 4.48Å; I128-F326 HydrophobicContact CG2-CE2 3.65Å; I128-F326 HydrophobicContact CG2-CZ 3.7Å; L129-F326 HydrophobicContact CD1-CD1 3.99Å; L129-F326 HydrophobicContact CD1-CE1 4.32Å; L129-F326 HydrophobicContact CD2-CB 3.92Å; L129-F326 HydrophobicContact CD2-CD1 3.67Å; L129-F326 HydrophobicContact CD2-CE1 4.46Å; L129-F326 HydrophobicContact CD2-CG 4.03Å; L129-F326 HydrophobicContact CG-CD1 3.66Å; L129-F326 HydrophobicContact CG-CE1 3.99Å; L129-F326 HydrophobicContact CG-CG 4.43Å; I133-F326 HydrophobicContact CD1-CB 3.67Å; I133-F326 HydrophobicContact CD1-CD1 4.26Å; I133-F326 HydrophobicContact CD1-CD2 3.3Å; I133-F326 HydrophobicContact CD1-CE2 3.96Å; I133-F326 HydrophobicContact CD1-CG 3.48Å; I133-F326 VanDerWaalsContact CD1-CG 3.48Å; I155-F326 VanDerWaalsContact CD1-N 3.29Å; I155-F326 WeakPolarHBondContact CD1-O 3.19Å; V283-F326 HydrophobicContact CG1-CB 4.33Å; I284-F326 PolarHBondContact O-N 3.26Å; Y285-F326 CarbonylContact C-O 3.58Å; Y285-F326 VanDerWaalsContact CA-O 3.29Å; Y285-F326 WeakPolarHBondContact CA-O 3.44Å; F326-L331 HydrophobicContact CE2-CD2 4.05Å
327	S	85	Confident	84.2	Confident	11 Å²	11	61.9 Å²	61.9	8%	0.077	34%	0.337	C	S	.	.			trans	-146.1	107.8	178.3	173.4	0	0	0	0	109.4	K329 S330 L331	S327-K329 VanDerWaalsContact C-N 3.32Å; S327-K329 PolarHBondContact O-N 2.82Å; S327-S330 WeakPolarHBondContact CB-OG 3.45Å; S327-S330 PolarHBondContact O-N 3.09Å; S327-S330 PolarHBondContact OG-N 2.89Å; S327-S330 PolarHBondContact OG-OG 3.17Å; S327-L331 PolarHBondContact O-N 3.04Å
328	L	86.3	Confident	83.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-57	-45.4	176.7	-176.5	66	0	0	0	111.4	L57 F121 I124 P125 S153 S330 L331 L332 I346	L57-L328 HydrophobicContact CD2-CD2 4.33Å; F121-L328 HydrophobicContact CD1-CD2 4.05Å; F121-L328 HydrophobicContact CD2-CD2 4.41Å; F121-L328 HydrophobicContact CE1-CD2 4.25Å; F121-L328 HydrophobicContact CG-CD2 4.14Å; I124-L328 HydrophobicContact CG2-CD1 3.94Å; P125-L328 HydrophobicContact CB-CB 4.16Å; P125-L328 HydrophobicContact CB-CD2 4.35Å; P125-L328 HydrophobicContact CG-CB 4.23Å; P125-L328 HydrophobicContact CG-CD2 3.63Å; P125-L328 HydrophobicContact CG-CG 4.36Å; S153-L328 VanDerWaalsContact OG-CB 3.28Å; S153-L328 WeakPolarHBondContact OG-CB 3.43Å; S153-L328 PolarHBondContact OG-N 3.24Å; L328-S330 VanDerWaalsContact C-N 3.26Å; L328-S330 PolarHBondContact O-N 3.17Å; L328-L331 WeakPolarHBondContact O-CA 3.45Å; L328-L331 WeakPolarHBondContact O-CB 3.23Å; L328-L331 PolarHBondContact O-N 3.19Å; L328-L332 HydrophobicContact CD1-CD1 3.94Å; L328-L332 HydrophobicContact CD1-CD2 3.85Å; L328-L332 HydrophobicContact CD1-CG 3.72Å; L328-L332 HydrophobicContact CD2-CD1 3.98Å; L328-L332 HydrophobicContact CG-CD1 3.68Å; L328-L332 HydrophobicContact CG-CD2 4.48Å; L328-L332 HydrophobicContact CG-CG 3.83Å; L328-L332 WeakPolarHBondContact O-CG 3.42Å; L328-L332 PolarHBondContact O-N 3.16Å; L328-I346 HydrophobicContact CD1-CD1 4.27Å
329	K	82.9	Confident	83.1	Confident	27 Å²	27	55 Å²	55	12%	0.117	30%	0.304	C	S	.	.	H	α-helix	trans	-54.3	-45	179.4	-169.3	-154.4	-175.5	-157.8	0	111.7	L11 I20 D21 N59 S327 L331 F333	L11-K329 HydrophobicContact CD1-CD 3.88Å; L11-K329 HydrophobicContact CD1-CG 4.46Å; L11-K329 HydrophobicContact CD2-CB 4.29Å; L11-K329 HydrophobicContact CD2-CD 4.4Å; L11-K329 HydrophobicContact CD2-CG 4.12Å; I20-K329 HydrophobicContact CG2-CD 4.16Å; D21-K329 PolarHBondContact O-NZ 3.2Å; N59-K329 WeakPolarHBondContact OD1-CE 3.42Å; S327-K329 VanDerWaalsContact C-N 3.32Å; S327-K329 PolarHBondContact O-N 2.82Å; K329-L331 VanDerWaalsContact C-N 3.33Å; K329-F333 HydrophobicContact CG-CD2 3.98Å; K329-F333 WeakPolarHBondContact O-CD2 3.37Å; K329-F333 PolarHBondContact O-N 2.88Å; K329-F333 VanDerWaalsContact O-N 3.11Å
330	S	82.1	Confident	82.6	Confident	62 Å²	62	53.9 Å²	53.9	43%	0.434	30%	0.302	S	S	.	.	H	α-helix	trans	-68.3	-34.6	-180	-55.6	0	0	0	0	111.8	S327 L328 S334	S327-S330 WeakPolarHBondContact CB-OG 3.45Å; S327-S330 PolarHBondContact O-N 3.09Å; S327-S330 PolarHBondContact OG-N 2.89Å; S327-S330 PolarHBondContact OG-OG 3.17Å; L328-S330 VanDerWaalsContact C-N 3.26Å; L328-S330 PolarHBondContact O-N 3.17Å; S330-S334 WeakPolarHBondContact O-CB 3.1Å; S330-S334 PolarHBondContact O-N 3.24Å
331	L	84.8	Confident	82.3	Confident	42 Å²	42	54.1 Å²	54.1	22%	0.22	30%	0.303	C	S	.	.	H	α-helix	trans	-69.2	-45.4	176.1	-172.2	67.5	0	0	0	111.9	I128 F326 S327 L328 K329 Q339 I342 I346	I128-L331 HydrophobicContact CD1-CD2 3.99Å; F326-L331 HydrophobicContact CE2-CD2 4.05Å; S327-L331 PolarHBondContact O-N 3.04Å; L328-L331 WeakPolarHBondContact O-CA 3.45Å; L328-L331 WeakPolarHBondContact O-CB 3.23Å; L328-L331 PolarHBondContact O-N 3.19Å; K329-L331 VanDerWaalsContact C-N 3.33Å; L331-Q339 PolarHBondContact O-NE2 3.02Å; L331-Q339 VanDerWaalsContact O-NE2 3.09Å; L331-I342 HydrophobicContact CD1-CD1 3.95Å; L331-I342 HydrophobicContact CD1-CG1 4.35Å; L331-I342 HydrophobicContact CD1-CG2 3.68Å; L331-I342 HydrophobicContact CD2-CG2 4.48Å; L331-I342 HydrophobicContact CG-CG2 3.65Å; L331-I342 WeakPolarHBondContact O-CG2 3.25Å; L331-I346 HydrophobicContact CD2-CD1 4.07Å
332	L	84.2	Confident	82	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-74.6	-32.6	-175.2	-63.1	-173.5	0	0	0	113.7	L57 I103 F121 L328 Q339 I346	L57-L332 HydrophobicContact CB-CD1 4.12Å; L57-L332 HydrophobicContact CD2-CD1 3.46Å; L57-L332 VanDerWaalsContact CD2-CD1 3.46Å; L57-L332 HydrophobicContact CG-CD1 4.44Å; I103-L332 HydrophobicContact CD1-CD2 3.65Å; F121-L332 HydrophobicContact CZ-CD1 4.48Å; L328-L332 HydrophobicContact CD1-CD1 3.94Å; L328-L332 HydrophobicContact CD1-CD2 3.85Å; L328-L332 HydrophobicContact CD1-CG 3.72Å; L328-L332 HydrophobicContact CD2-CD1 3.98Å; L328-L332 HydrophobicContact CG-CD1 3.68Å; L328-L332 HydrophobicContact CG-CD2 4.48Å; L328-L332 HydrophobicContact CG-CG 3.83Å; L328-L332 WeakPolarHBondContact O-CG 3.42Å; L328-L332 PolarHBondContact O-N 3.16Å; L332-Q339 PolarHBondContact O-NE2 3.32Å; L332-I346 HydrophobicContact CD2-CB 4.5Å; L332-I346 HydrophobicContact CD2-CD1 3.6Å; L332-I346 HydrophobicContact CD2-CG1 3.59Å; L332-I346 HydrophobicContact CD2-CG2 4.26Å
333	F	79.2	Confident	81.8	Confident	29 Å²	29	51.5 Å²	51.5	13%	0.127	29%	0.29	C	S	.	.	S	Bend	trans	-124.5	23.9	-167.3	-49.2	-54.3	0	0	0	113	L58 N59 K101 K329	L58-F333 WeakPolarHBondContact O-CZ 3.41Å; N59-F333 HydrophobicContact CB-CD1 4.49Å; N59-F333 HydrophobicContact CB-CD2 4.08Å; N59-F333 HydrophobicContact CB-CE2 4.25Å; N59-F333 HydrophobicContact CB-CG 4.22Å; K101-F333 HydrophobicContact CB-CD1 3.64Å; K101-F333 HydrophobicContact CB-CE1 4.21Å; K101-F333 WeakPolarHBondContact O-CE1 3.31Å; K329-F333 HydrophobicContact CG-CD2 3.98Å; K329-F333 WeakPolarHBondContact O-CD2 3.37Å; K329-F333 PolarHBondContact O-N 2.88Å; K329-F333 VanDerWaalsContact O-N 3.11Å
334	S	77	Confident	81.8	Confident	46 Å²	46	55 Å²	55	32%	0.322	30%	0.303	S	S	.	.			trans	-60.4	158	170.9	-169.3	0	0	0	0	110.6	K101 S330 D336 Q339	K101-S334 PolarHBondContact NZ-O 3.47Å; S330-S334 WeakPolarHBondContact O-CB 3.1Å; S330-S334 PolarHBondContact O-N 3.24Å; S334-D336 VanDerWaalsContact C-N 3.29Å; S334-D336 WeakPolarHBondContact OG-CB 3.02Å; S334-D336 PolarHBondContact OG-N 2.61Å; S334-Q339 VanDerWaalsContact N-OE1 3.17Å; S334-Q339 PolarHBondContact O-OE1 3.33Å; S334-Q339 VanDerWaalsContact O-OE1 3.11Å
335	R	70.4	Confident	82.2	Confident	214 Å²	214	56.5 Å²	56.5	81%	0.808	30%	0.302	S	S	*	.			trans	-95.8	15.1	171.1	-63.9	-175.7	-178.6	177.4	0.1	112.1
336	D	72.9	Confident	82.6	Confident	77 Å²	77	54 Å²	54	41%	0.412	28%	0.276	S	S	.	.			trans	-69.8	137.1	-176.9	-162.2	-50.4	0	0	0	111.4	S334 I338 Q339	S334-D336 VanDerWaalsContact C-N 3.29Å; S334-D336 WeakPolarHBondContact OG-CB 3.02Å; S334-D336 PolarHBondContact OG-N 2.61Å; D336-I338 PolarHBondContact O-N 3.08Å; D336-I338 VanDerWaalsContact O-N 3.16Å; D336-I338 WeakPolarHBondContact OD1-CB 3.49Å; D336-I338 PolarHBondContact OD1-N 3.36Å; D336-Q339 WeakPolarHBondContact O-CB 3.25Å; D336-Q339 PolarHBondContact O-N 3.09Å
337	P	69.6	Low	82.9	Confident	116 Å²	116	53.7 Å²	53.7	75%	0.753	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-27.8	169.8	-28.1	35.5	0	0	0	114.8	Q339	P337-Q339 PolarHBondContact O-N 2.95Å
338	I	76.8	Confident	83.5	Confident	94 Å²	94	56.9 Å²	56.9	48%	0.482	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	1.5	179.3	-58.5	171	0	0	0	111.8	D336 T340 D341 I342	D336-I338 PolarHBondContact O-N 3.08Å; D336-I338 VanDerWaalsContact O-N 3.16Å; D336-I338 WeakPolarHBondContact OD1-CB 3.49Å; D336-I338 PolarHBondContact OD1-N 3.36Å; I338-T340 PolarHBondContact O-N 3.11Å; I338-D341 HydrophobicContact CG2-CB 3.92Å; I338-D341 PolarHBondContact O-N 2.81Å; I338-I342 PolarHBondContact O-N 3.23Å
339	Q	79.7	Confident	84	Confident	8 Å²	8	57 Å²	57	4%	0.037	29%	0.293	C	S	.	.	H	α-helix	trans	-55.1	-31.9	-177.2	-169.3	65	64.2	0	0	113	L331 L332 S334 D336 P337 D341 I342 N343	L331-Q339 PolarHBondContact O-NE2 3.02Å; L331-Q339 VanDerWaalsContact O-NE2 3.09Å; L332-Q339 PolarHBondContact O-NE2 3.32Å; S334-Q339 VanDerWaalsContact N-OE1 3.17Å; S334-Q339 PolarHBondContact O-OE1 3.33Å; S334-Q339 VanDerWaalsContact O-OE1 3.11Å; D336-Q339 WeakPolarHBondContact O-CB 3.25Å; D336-Q339 PolarHBondContact O-N 3.09Å; P337-Q339 PolarHBondContact O-N 2.95Å; Q339-D341 PolarHBondContact O-N 3.44Å; Q339-I342 PolarHBondContact O-N 3.04Å; Q339-N343 PolarHBondContact NE2-OD1 3.01Å; Q339-N343 WeakPolarHBondContact O-CB 3.28Å; Q339-N343 PolarHBondContact O-N 2.87Å; Q339-N343 PolarHBondContact O-ND2 3.23Å; Q339-N343 VanDerWaalsContact O-ND2 3.08Å; Q339-N343 PolarHBondContact O-OD1 3.06Å
340	T	79.3	Confident	84.7	Confident	48 Å²	48	55.8 Å²	55.8	29%	0.294	29%	0.287	S	S	.	.	H	α-helix	trans	-59.3	-43.8	174	-72.2	0	0	0	0	112.6	E93 I338 N343 K344	E93-T340 PolarHBondContact OE1-OG1 3.38Å; I338-T340 PolarHBondContact O-N 3.11Å; T340-N343 PolarHBondContact O-N 3.11Å; T340-K344 PolarHBondContact O-N 3.2Å; T340-K344 VanDerWaalsContact O-N 3.08Å
341	D	86.3	Confident	85.4	Confident	105 Å²	105	56 Å²	56	56%	0.561	28%	0.284	S	S	*	.	H	α-helix	trans	-70.2	-37.5	178.1	-65.6	-27.7	0	0	0	111.8	I338 Q339 N343 K344 F345	I338-D341 HydrophobicContact CG2-CB 3.92Å; I338-D341 PolarHBondContact O-N 2.81Å; Q339-D341 PolarHBondContact O-N 3.44Å; D341-N343 VanDerWaalsContact C-N 3.32Å; D341-N343 PolarHBondContact O-N 2.84Å; D341-K344 PolarHBondContact O-N 2.9Å; D341-F345 WeakPolarHBondContact O-CB 3.24Å; D341-F345 PolarHBondContact O-N 2.93Å
342	I	88.2	Confident	86	Confident	45 Å²	45	57.5 Å²	57.5	23%	0.231	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-42.1	174.5	-63.3	-55.1	0	0	0	110.9	L331 I338 Q339 F345 I346	L331-I342 HydrophobicContact CD1-CD1 3.95Å; L331-I342 HydrophobicContact CD1-CG1 4.35Å; L331-I342 HydrophobicContact CD1-CG2 3.68Å; L331-I342 HydrophobicContact CD2-CG2 4.48Å; L331-I342 HydrophobicContact CG-CG2 3.65Å; L331-I342 WeakPolarHBondContact O-CG2 3.25Å; I338-I342 PolarHBondContact O-N 3.23Å; Q339-I342 PolarHBondContact O-N 3.04Å; I342-F345 WeakPolarHBondContact O-CB 3.47Å; I342-F345 PolarHBondContact O-N 3.01Å; I342-I346 HydrophobicContact CG2-CG1 4.46Å; I342-I346 VanDerWaalsContact O-CG1 3.28Å; I342-I346 WeakPolarHBondContact O-CG1 3.36Å; I342-I346 PolarHBondContact O-N 3.09Å
343	N	86.8	Confident	86.6	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.048	29%	0.289	C	S	.	.	H	α-helix	trans	-62.6	-43.9	177.7	-70.9	-16.7	0	0	0	111.5	C91 Q339 T340 D341 F345 I346 V347	C91-N343 HydrophobicContact CB-CB 3.65Å; C91-N343 VanDerWaalsContact CB-CG 3.45Å; C91-N343 WeakPolarHBondContact CB-ND2 3.48Å; C91-N343 WeakPolarHBondContact SG-CB 3.04Å; C91-N343 VanDerWaalsContact SG-CG 3.6Å; Q339-N343 PolarHBondContact NE2-OD1 3.01Å; Q339-N343 WeakPolarHBondContact O-CB 3.28Å; Q339-N343 PolarHBondContact O-N 2.87Å; Q339-N343 PolarHBondContact O-ND2 3.23Å; Q339-N343 VanDerWaalsContact O-ND2 3.08Å; Q339-N343 PolarHBondContact O-OD1 3.06Å; T340-N343 PolarHBondContact O-N 3.11Å; D341-N343 VanDerWaalsContact C-N 3.32Å; D341-N343 PolarHBondContact O-N 2.84Å; N343-F345 VanDerWaalsContact C-N 3.33Å; N343-F345 PolarHBondContact O-N 2.8Å; N343-I346 PolarHBondContact O-N 3.3Å; N343-V347 WeakPolarHBondContact O-CG2 3.22Å; N343-V347 PolarHBondContact O-N 2.95Å
344	K	89.7	Confident	87.5	Confident	127 Å²	127	57.2 Å²	57.2	55%	0.552	29%	0.29	S	S	*	.	H	α-helix	trans	-58.4	-45.9	172.6	-176.1	175	-180	172.7	0	111.5	T340 D341 I346 V347 D348	T340-K344 PolarHBondContact O-N 3.2Å; T340-K344 VanDerWaalsContact O-N 3.08Å; D341-K344 PolarHBondContact O-N 2.9Å; K344-I346 VanDerWaalsContact C-N 3.3Å; K344-I346 PolarHBondContact O-N 2.95Å; K344-V347 WeakPolarHBondContact O-CB 3.42Å; K344-V347 PolarHBondContact O-N 2.77Å; K344-V347 VanDerWaalsContact O-N 3.1Å; K344-D348 PolarHBondContact O-N 3.34Å
345	F	93.8	Very high	88.4	Confident	54 Å²	54	60.7 Å²	60.7	24%	0.237	30%	0.3	C	S	.	.	H	α-helix	trans	-58.3	-40	175.4	170.8	-112.5	0	0	0	112.9	I128 H132 D341 I342 N343 V347 D348 V349	I128-F345 HydrophobicContact CD1-CE1 3.8Å; I128-F345 HydrophobicContact CD1-CZ 4.39Å; I128-F345 HydrophobicContact CG1-CE1 3.87Å; I128-F345 HydrophobicContact CG1-CZ 3.94Å; H132-F345 AromaticContact CD2-CZ 3.87Å; H132-F345 AromaticContact CE1-CE2 3.56Å; H132-F345 AromaticContact CG-CZ 3.91Å; H132-F345 AromaticContact ND1-CE2 3.86Å; H132-F345 AromaticContact NE2-CE2 3.71Å; H132-F345 AromaticContact NE2-CZ 3.94Å; D341-F345 WeakPolarHBondContact O-CB 3.24Å; D341-F345 PolarHBondContact O-N 2.93Å; I342-F345 WeakPolarHBondContact O-CB 3.47Å; I342-F345 PolarHBondContact O-N 3.01Å; N343-F345 VanDerWaalsContact C-N 3.33Å; N343-F345 PolarHBondContact O-N 2.8Å; F345-V347 VanDerWaalsContact C-N 3.33Å; F345-V347 PolarHBondContact O-N 3.15Å; F345-D348 PolarHBondContact O-N 2.81Å; F345-V349 HydrophobicContact CD2-CG2 4.28Å; F345-V349 HydrophobicContact CE1-CG2 4.21Å; F345-V349 HydrophobicContact CE2-CG2 3.77Å; F345-V349 HydrophobicContact CZ-CG2 3.74Å; F345-V349 WeakPolarHBondContact O-CG2 3.45Å; F345-V349 PolarHBondContact O-N 3.45Å
346	I	93.4	Very high	89.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.2	-38	176.3	-65.5	-68.4	0	0	0	111.6	I103 I124 I128 L328 L331 L332 I342 N343 K344 V349 W350	I103-I346 HydrophobicContact CD1-CB 4.14Å; I103-I346 HydrophobicContact CD1-CG1 4.32Å; I103-I346 HydrophobicContact CD1-CG2 3.84Å; I103-I346 HydrophobicContact CG2-CG2 4.39Å; I124-I346 HydrophobicContact CD1-CG2 4.14Å; I124-I346 HydrophobicContact CG2-CD1 3.73Å; I124-I346 HydrophobicContact CG2-CG2 4.46Å; I128-I346 HydrophobicContact CD1-CD1 3.95Å; L328-I346 HydrophobicContact CD1-CD1 4.27Å; L331-I346 HydrophobicContact CD2-CD1 4.07Å; L332-I346 HydrophobicContact CD2-CB 4.5Å; L332-I346 HydrophobicContact CD2-CD1 3.6Å; L332-I346 HydrophobicContact CD2-CG1 3.59Å; L332-I346 HydrophobicContact CD2-CG2 4.26Å; I342-I346 HydrophobicContact CG2-CG1 4.46Å; I342-I346 VanDerWaalsContact O-CG1 3.28Å; I342-I346 WeakPolarHBondContact O-CG1 3.36Å; I342-I346 PolarHBondContact O-N 3.09Å; N343-I346 PolarHBondContact O-N 3.3Å; K344-I346 VanDerWaalsContact C-N 3.3Å; K344-I346 PolarHBondContact O-N 2.95Å; I346-V349 PolarHBondContact O-N 2.9Å; I346-W350 WeakPolarHBondContact O-CB 3.37Å; I346-W350 PolarHBondContact O-N 3.43Å
347	V	92.9	Very high	90.8	Very high	10 Å²	10	48.6 Å²	48.6	6%	0.061	25%	0.251	C	S	.	.	H	α-helix	trans	-65.7	-42	174.1	173.2	0	0	0	0	110.8	V89 L105 N343 K344 F345 V349 W350 N351	V89-V347 HydrophobicContact CB-CG1 3.99Å; V89-V347 HydrophobicContact CB-CG2 3.84Å; V89-V347 HydrophobicContact CG1-CG2 3.83Å; V89-V347 HydrophobicContact CG2-CG1 4.1Å; L105-V347 HydrophobicContact CD2-CG2 4.27Å; N343-V347 WeakPolarHBondContact O-CG2 3.22Å; N343-V347 PolarHBondContact O-N 2.95Å; K344-V347 WeakPolarHBondContact O-CB 3.42Å; K344-V347 PolarHBondContact O-N 2.77Å; K344-V347 VanDerWaalsContact O-N 3.1Å; F345-V347 VanDerWaalsContact C-N 3.33Å; F345-V347 PolarHBondContact O-N 3.15Å; V347-V349 PolarHBondContact O-N 3.07Å; V347-W350 CarbonylContact O-C 3.34Å; V347-W350 WeakPolarHBondContact O-CA 3.32Å; V347-W350 WeakPolarHBondContact O-CB 3.42Å; V347-W350 PolarHBondContact O-N 3.47Å; V347-W350 VanDerWaalsContact O-N 3.12Å; V347-N351 VanDerWaalsContact O-CG 3.27Å; V347-N351 PolarHBondContact O-N 2.86Å; V347-N351 PolarHBondContact O-ND2 2.8Å
348	D	96.4	Very high	92	Very high	79 Å²	79	46.9 Å²	46.9	42%	0.422	24%	0.235	S	C	.	.	H	α-helix	trans	-61.4	-44.9	175.9	-67.1	-26.4	0	0	0	111.4	K344 F345 W350 N351 E352	K344-D348 PolarHBondContact O-N 3.34Å; F345-D348 PolarHBondContact O-N 2.81Å; D348-W350 VanDerWaalsContact C-N 3.3Å; D348-W350 PolarHBondContact O-N 2.86Å; D348-N351 PolarHBondContact O-N 3.41Å; D348-E352 PolarHBondContact O-N 3.44Å; D348-E352 VanDerWaalsContact O-N 3.11Å
349	V	97.2	Very high	92.9	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.018	23%	0.233	C	C	.	.	H	α-helix	trans	-59.6	-41.8	172.7	168.9	0	0	0	0	111.1	I124 Y127 I128 F345 I346 V347 N351 E352 L353	I124-V349 HydrophobicContact CB-CG1 4.43Å; I124-V349 HydrophobicContact CG1-CG1 4.35Å; I124-V349 HydrophobicContact CG2-CG1 4.16Å; Y127-V349 HydrophobicContact CD1-CB 4.26Å; Y127-V349 HydrophobicContact CD1-CG1 3.62Å; Y127-V349 HydrophobicContact CD1-CG2 3.9Å; Y127-V349 HydrophobicContact CE1-CG1 4.38Å; Y127-V349 HydrophobicContact CE1-CG2 4.14Å; Y127-V349 HydrophobicContact CG-CG1 3.87Å; I128-V349 HydrophobicContact CG1-CG2 4.15Å; F345-V349 HydrophobicContact CD2-CG2 4.28Å; F345-V349 HydrophobicContact CE1-CG2 4.21Å; F345-V349 HydrophobicContact CE2-CG2 3.77Å; F345-V349 HydrophobicContact CZ-CG2 3.74Å; F345-V349 WeakPolarHBondContact O-CG2 3.45Å; F345-V349 PolarHBondContact O-N 3.45Å; I346-V349 PolarHBondContact O-N 2.9Å; V347-V349 PolarHBondContact O-N 3.07Å; V349-N351 VanDerWaalsContact C-N 3.33Å; V349-N351 PolarHBondContact O-N 3.31Å; V349-E352 PolarHBondContact O-N 3.17Å; V349-L353 HydrophobicContact CG1-CD1 4.06Å; V349-L353 HydrophobicContact CG1-CG 4.48Å; V349-L353 WeakPolarHBondContact O-CG 3.38Å; V349-L353 PolarHBondContact O-N 3.19Å
350	W	97.1	Very high	93.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-37.7	177.2	-178.9	-108.6	0	0	0	112.8	I55 L105 P106 P108 I119 I124 I346 V347 D348 L353 T354	I55-W350 HydrophobicContact CD1-CH2 3.44Å; I55-W350 VanDerWaalsContact CD1-CH2 3.44Å; I55-W350 HydrophobicContact CD1-CZ2 3.55Å; L105-W350 HydrophobicContact CB-CD2 4.17Å; L105-W350 HydrophobicContact CB-CG 4.17Å; L105-W350 HydrophobicContact CB-CZ2 4.45Å; L105-W350 HydrophobicContact CD1-CB 4.17Å; L105-W350 HydrophobicContact CD1-CD2 3.61Å; L105-W350 HydrophobicContact CD1-CE3 3.81Å; L105-W350 HydrophobicContact CD1-CG 3.75Å; L105-W350 HydrophobicContact CD1-CZ3 4.47Å; L105-W350 HydrophobicContact CD2-CB 3.98Å; L105-W350 HydrophobicContact CD2-CG 3.84Å; L105-W350 HydrophobicContact CG-CD2 4.31Å; L105-W350 HydrophobicContact CG-CG 4.13Å; P106-W350 PolarHBondContact O-NE1 2.85Å; P106-W350 VanDerWaalsContact O-NE1 3.12Å; P108-W350 HydrophobicContact CG-CZ2 4.33Å; I119-W350 HydrophobicContact CD1-CH2 4.34Å; I119-W350 HydrophobicContact CD1-CZ3 4.4Å; I119-W350 HydrophobicContact CG1-CZ3 4.41Å; I119-W350 HydrophobicContact CG2-CH2 3.58Å; I119-W350 HydrophobicContact CG2-CZ3 3.86Å; I124-W350 HydrophobicContact CD1-CE3 4.26Å; I124-W350 HydrophobicContact CG1-CE3 4.38Å; I346-W350 WeakPolarHBondContact O-CB 3.37Å; I346-W350 PolarHBondContact O-N 3.43Å; V347-W350 CarbonylContact O-C 3.34Å; V347-W350 WeakPolarHBondContact O-CA 3.32Å; V347-W350 WeakPolarHBondContact O-CB 3.42Å; V347-W350 PolarHBondContact O-N 3.47Å; V347-W350 VanDerWaalsContact O-N 3.12Å; D348-W350 VanDerWaalsContact C-N 3.3Å; D348-W350 PolarHBondContact O-N 2.86Å; W350-L353 HydrophobicContact CE3-CB 4.45Å; W350-L353 HydrophobicContact CE3-CD1 4.28Å; W350-L353 PolarHBondContact O-N 3.38Å; W350-T354 WeakPolarHBondContact O-CB 3.36Å; W350-T354 PolarHBondContact O-N 2.91Å; W350-T354 PolarHBondContact O-OG1 3.37Å
351	N	97.2	Very high	94.4	Very high	68 Å²	68	57 Å²	57	36%	0.364	28%	0.282	S	S	.	.	H	α-helix	trans	-64.9	-41.1	176.5	-70.8	-25.1	0	0	0	111.3	V347 D348 V349 T354 K355	V347-N351 VanDerWaalsContact O-CG 3.27Å; V347-N351 PolarHBondContact O-N 2.86Å; V347-N351 PolarHBondContact O-ND2 2.8Å; D348-N351 PolarHBondContact O-N 3.41Å; V349-N351 VanDerWaalsContact C-N 3.33Å; V349-N351 PolarHBondContact O-N 3.31Å; N351-T354 PolarHBondContact O-N 3.3Å; N351-K355 WeakPolarHBondContact O-CG 3.12Å; N351-K355 PolarHBondContact O-N 3.27Å; N351-K355 VanDerWaalsContact O-N 3.13Å
352	E	98	Very high	94.7	Very high	72 Å²	72	52.4 Å²	52.4	34%	0.336	26%	0.258	S	S	.	.	H	α-helix	trans	-64.8	-43	173	-67.1	-53.3	134.1	0	0	112.1	Y127 D348 V349 T354 K355 L356	Y127-E352 HydrophobicContact CE2-CB 3.9Å; D348-E352 PolarHBondContact O-N 3.44Å; D348-E352 VanDerWaalsContact O-N 3.11Å; V349-E352 PolarHBondContact O-N 3.17Å; E352-T354 VanDerWaalsContact C-N 3.3Å; E352-T354 PolarHBondContact O-N 3.38Å; E352-K355 WeakPolarHBondContact O-CB 3.45Å; E352-K355 PolarHBondContact O-N 2.95Å; E352-K355 IonicContact OE1-NZ 3.8Å; E352-K355 PolarHBondContact OE1-NZ 3.17Å; E352-K355 IonicContact OE2-NZ 2.71Å; E352-L356 WeakPolarHBondContact O-CG 3.04Å; E352-L356 PolarHBondContact O-N 3.04Å; E352-L356 VanDerWaalsContact O-N 3.13Å
353	L	97.1	Very high	94.9	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-39.4	174.3	-72.2	172.5	0	0	0	112	Y123 I124 Y127 L210 V349 W350 K355 L356 I357 I362	Y123-L353 HydrophobicContact CD1-CD2 4.26Å; I124-L353 HydrophobicContact CG1-CD1 3.81Å; Y127-L353 HydrophobicContact CD2-CD2 3.94Å; Y127-L353 HydrophobicContact CD2-CG 4.29Å; Y127-L353 HydrophobicContact CG-CD2 4.45Å; L210-L353 HydrophobicContact CD2-CD2 4.23Å; V349-L353 HydrophobicContact CG1-CD1 4.06Å; V349-L353 HydrophobicContact CG1-CG 4.48Å; V349-L353 WeakPolarHBondContact O-CG 3.38Å; V349-L353 PolarHBondContact O-N 3.19Å; W350-L353 HydrophobicContact CE3-CB 4.45Å; W350-L353 HydrophobicContact CE3-CD1 4.28Å; W350-L353 PolarHBondContact O-N 3.38Å; L353-K355 VanDerWaalsContact C-N 3.34Å; L353-K355 PolarHBondContact O-N 2.8Å; L353-L356 HydrophobicContact CD2-CD1 4.47Å; L353-L356 WeakPolarHBondContact O-CB 3.42Å; L353-L356 PolarHBondContact O-N 3.3Å; L353-L356 VanDerWaalsContact O-N 3.12Å; L353-I357 WeakPolarHBondContact O-CD1 3.09Å; L353-I357 VanDerWaalsContact O-CG1 3.22Å; L353-I357 WeakPolarHBondContact O-CG1 2.97Å; L353-I357 PolarHBondContact O-N 3.21Å; L353-I362 HydrophobicContact CD2-CD1 3.98Å
354	T	97	Very high	95.1	Very high	26 Å²	26	54 Å²	54	16%	0.16	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-44.4	176	-63.9	0	0	0	0	111.3	P108 W350 N351 E352 L356 I357 D358	P108-T354 HydrophobicContact CB-CG2 4.16Å; P108-T354 HydrophobicContact CG-CG2 3.71Å; W350-T354 WeakPolarHBondContact O-CB 3.36Å; W350-T354 PolarHBondContact O-N 2.91Å; W350-T354 PolarHBondContact O-OG1 3.37Å; N351-T354 PolarHBondContact O-N 3.3Å; E352-T354 VanDerWaalsContact C-N 3.3Å; E352-T354 PolarHBondContact O-N 3.38Å; T354-L356 VanDerWaalsContact C-N 3.3Å; T354-L356 PolarHBondContact O-N 2.98Å; T354-I357 PolarHBondContact O-N 3.2Å; T354-D358 WeakPolarHBondContact O-CB 3.37Å; T354-D358 PolarHBondContact O-N 3.44Å
355	K	97.2	Very high	95.1	Very high	119 Å²	119	51 Å²	51	52%	0.517	26%	0.256	S	S	.	.	H	α-helix	trans	-59.6	-40.1	173.8	-64.7	168.9	-170.7	171.1	0	112.1	N351 E352 L353 S359	N351-K355 WeakPolarHBondContact O-CG 3.12Å; N351-K355 PolarHBondContact O-N 3.27Å; N351-K355 VanDerWaalsContact O-N 3.13Å; E352-K355 WeakPolarHBondContact O-CB 3.45Å; E352-K355 PolarHBondContact O-N 2.95Å; E352-K355 IonicContact OE1-NZ 3.8Å; E352-K355 PolarHBondContact OE1-NZ 3.17Å; E352-K355 IonicContact OE2-NZ 2.71Å; L353-K355 VanDerWaalsContact C-N 3.34Å; L353-K355 PolarHBondContact O-N 2.8Å; K355-S359 WeakPolarHBondContact O-CB 3.45Å; K355-S359 PolarHBondContact O-N 3.47Å; K355-S359 PolarHBondContact O-OG 3.13Å
356	L	97.1	Very high	95	Very high	26 Å²	26	50.2 Å²	50.2	14%	0.136	26%	0.256	C	S	.	.	H	α-helix	trans	-68.6	-35.8	177.8	-64.9	178.1	0	0	0	112.5	L210 L213 E352 L353 T354 S359 Q360 K361 I362	L210-L356 HydrophobicContact CD2-CD1 3.62Å; L213-L356 HydrophobicContact CD1-CD1 4.01Å; L213-L356 HydrophobicContact CD1-CD2 3.88Å; E352-L356 WeakPolarHBondContact O-CG 3.04Å; E352-L356 PolarHBondContact O-N 3.04Å; E352-L356 VanDerWaalsContact O-N 3.13Å; L353-L356 HydrophobicContact CD2-CD1 4.47Å; L353-L356 WeakPolarHBondContact O-CB 3.42Å; L353-L356 PolarHBondContact O-N 3.3Å; L353-L356 VanDerWaalsContact O-N 3.12Å; T354-L356 VanDerWaalsContact C-N 3.3Å; T354-L356 PolarHBondContact O-N 2.98Å; L356-S359 PolarHBondContact O-OG 3.24Å; L356-Q360 PolarHBondContact O-N 3.05Å; L356-K361 HydrophobicContact CB-CB 4.46Å; L356-K361 HydrophobicContact CD2-CB 4.14Å; L356-K361 HydrophobicContact CD2-CD 3.8Å; L356-K361 PolarHBondContact O-N 3.26Å; L356-I362 HydrophobicContact CB-CD1 3.86Å; L356-I362 HydrophobicContact CB-CG1 3.89Å; L356-I362 HydrophobicContact CB-CG2 4.44Å
357	I	95.2	Very high	94.9	Very high	12 Å²	12	51.9 Å²	51.9	6%	0.062	27%	0.265	C	S	.	.	H	α-helix	trans	-67.9	-50.7	175	-65.9	158.1	0	0	0	110.5	P108 L111 I119 L353 T354 S359 Q360 I362	P108-I357 HydrophobicContact CG-CD1 4.35Å; L111-I357 HydrophobicContact CB-CG2 4.12Å; L111-I357 HydrophobicContact CD1-CG2 3.86Å; L111-I357 HydrophobicContact CD2-CD1 4.3Å; L111-I357 HydrophobicContact CG-CG2 4.46Å; I119-I357 HydrophobicContact CD1-CD1 3.19Å; I119-I357 HydrophobicContact CD1-CG1 3.84Å; L353-I357 WeakPolarHBondContact O-CD1 3.09Å; L353-I357 VanDerWaalsContact O-CG1 3.22Å; L353-I357 WeakPolarHBondContact O-CG1 2.97Å; L353-I357 PolarHBondContact O-N 3.21Å; T354-I357 PolarHBondContact O-N 3.2Å; I357-S359 PolarHBondContact O-N 3.07Å; I357-Q360 WeakPolarHBondContact O-CA 3.11Å; I357-Q360 PolarHBondContact O-N 2.89Å; I357-I362 HydrophobicContact CG1-CD1 3.92Å; I357-I362 HydrophobicContact CG1-CG1 3.99Å
358	D	95.5	Very high	94.9	Very high	79 Å²	79	52.4 Å²	52.4	42%	0.422	27%	0.269	S	S	.	.	H	α-helix	trans	-63.5	-32.7	-178.1	-73.5	-27.4	0	0	0	111.7	T110 T354 Q360	T110-D358 WeakPolarHBondContact CB-OD1 3.37Å; T110-D358 WeakPolarHBondContact CG2-OD1 3.27Å; T110-D358 PolarHBondContact OG1-OD1 3.27Å; T354-D358 WeakPolarHBondContact O-CB 3.37Å; T354-D358 PolarHBondContact O-N 3.44Å; D358-Q360 VanDerWaalsContact C-N 3.29Å
359	S	95.9	Very high	94.9	Very high	61 Å²	61	53.1 Å²	53.1	43%	0.427	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	6	172.3	61.8	0	0	0	0	114.6	K355 L356 I357 K361	K355-S359 WeakPolarHBondContact O-CB 3.45Å; K355-S359 PolarHBondContact O-N 3.47Å; K355-S359 PolarHBondContact O-OG 3.13Å; L356-S359 PolarHBondContact O-OG 3.24Å; I357-S359 PolarHBondContact O-N 3.07Å; S359-K361 PolarHBondContact O-N 3.22Å
360	Q	94.5	Very high	94.9	Very high	176 Å²	176	55.7 Å²	55.7	82%	0.822	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	29.9	178.1	-56.5	-179	-2.5	0	0	114.3	L356 I357 D358	L356-Q360 PolarHBondContact O-N 3.05Å; I357-Q360 WeakPolarHBondContact O-CA 3.11Å; I357-Q360 PolarHBondContact O-N 2.89Å; D358-Q360 VanDerWaalsContact C-N 3.29Å
361	K	95.6	Very high	94.9	Very high	125 Å²	125	59.4 Å²	59.4	54%	0.543	29%	0.294	S	S	.	.			trans	-83	-20.1	178.4	-72.6	-177.1	179.3	-179.7	0	113.3	L213 L356 S359	L213-K361 HydrophobicContact CD1-CB 4.26Å; L213-K361 HydrophobicContact CD2-CB 3.93Å; L213-K361 HydrophobicContact CD2-CD 4.48Å; L213-K361 HydrophobicContact CD2-CG 4.45Å; L356-K361 HydrophobicContact CB-CB 4.46Å; L356-K361 HydrophobicContact CD2-CB 4.14Å; L356-K361 HydrophobicContact CD2-CD 3.8Å; L356-K361 PolarHBondContact O-N 3.26Å; S359-K361 PolarHBondContact O-N 3.22Å
362	I	93.5	Very high	94.7	Very high	10 Å²	10	58.1 Å²	58.1	5%	0.051	29%	0.287	C	S	.	.			trans	-129.5	146	174.9	59.2	176.4	0	0	0	110.1	Y123 Q209 L210 L213 L353 L356 I357	Y123-I362 HydrophobicContact CD1-CD1 3.65Å; Y123-I362 HydrophobicContact CE1-CB 3.83Å; Y123-I362 HydrophobicContact CE1-CD1 3.81Å; Y123-I362 HydrophobicContact CE1-CG1 4.32Å; Y123-I362 HydrophobicContact CE1-CG2 4.07Å; Y123-I362 HydrophobicContact CG-CD1 4.41Å; Q209-I362 HydrophobicContact CB-CG2 4.45Å; L210-I362 HydrophobicContact CD2-CG2 3.83Å; L210-I362 HydrophobicContact CG-CG2 4.47Å; L213-I362 HydrophobicContact CD1-CG2 4.15Å; L353-I362 HydrophobicContact CD2-CD1 3.98Å; L356-I362 HydrophobicContact CB-CD1 3.86Å; L356-I362 HydrophobicContact CB-CG1 3.89Å; L356-I362 HydrophobicContact CB-CG2 4.44Å; I357-I362 HydrophobicContact CG1-CD1 3.92Å; I357-I362 HydrophobicContact CG1-CG1 3.99Å
363	D	90.9	Very high	94.5	Very high	84 Å²	84	58.7 Å²	58.7	45%	0.449	29%	0.292	S	S	.	.			trans	-134.7	94.3	-178.6	-171.8	21.8	0	0	0	111.2	K115 Y123 Q209 L365	K115-D363 WeakPolarHBondContact CE-OD1 3.28Å; K115-D363 IonicContact NZ-OD1 3.47Å; K115-D363 PolarHBondContact NZ-OD1 2.84Å; K115-D363 IonicContact NZ-OD2 3.32Å; Y123-D363 PolarHBondContact OH-O 2.81Å; Q209-D363 PolarHBondContact NE2-O 2.94Å; Q209-D363 PolarHBondContact OE1-O 2.73Å; D363-L365 PolarHBondContact O-N 2.83Å
364	P	91.4	Very high	94.5	Very high	4 Å²	4	60.4 Å²	60.4	3%	0.026	30%	0.3	C	S	.	.			trans	-55.6	124.1	177.5	-24.4	31.8	0	0	0	112.9	K115 I118 I119 Y123	K115-P364 HydrophobicContact CB-CB 4.02Å; K115-P364 HydrophobicContact CB-CG 4.21Å; K115-P364 HydrophobicContact CG-CB 4.26Å; I118-P364 HydrophobicContact CD1-CB 3.86Å; I118-P364 HydrophobicContact CG1-CB 4.29Å; I119-P364 HydrophobicContact CB-CG 4.18Å; I119-P364 HydrophobicContact CD1-CG 3.62Å; I119-P364 HydrophobicContact CG1-CG 3.77Å; Y123-P364 HydrophobicContact CD2-CG 4.29Å; Y123-P364 HydrophobicContact CE2-CB 3.76Å; Y123-P364 HydrophobicContact CE2-CG 3.7Å
365	L	89.9	Confident	94.3	Very high	63 Å²	63	60.9 Å²	60.9	33%	0.33	30%	0.303	S	S	.	.			trans	-89.1	114.3	-177.1	-171.5	65.3	0	0	0	111.7	I118 T205 D363 I388 G389 K390	I118-L365 WeakPolarHBondContact CD1-O 3.38Å; T205-L365 HydrophobicContact CG2-CD2 4.28Å; D363-L365 PolarHBondContact O-N 2.83Å; L365-I388 HydrophobicContact CD2-CG2 3.75Å; L365-I388 WeakPolarHBondContact CD2-O 3.09Å; L365-G389 CarbonylContact O-C 3.33Å; L365-G389 VanDerWaalsContact O-CA 3.31Å; L365-G389 WeakPolarHBondContact O-CA 3.47Å; L365-K390 PolarHBondContact O-N 2.76Å
366	V	91.1	Very high	94.1	Very high	38 Å²	38	61.7 Å²	61.7	23%	0.23	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	128.2	170.6	-179.5	0	0	0	0	108.6	N114 K115 I118 V392	N114-V366 HydrophobicContact CB-CG2 3.91Å; N114-V366 WeakPolarHBondContact O-CG2 3.48Å; K115-V366 HydrophobicContact CG-CG2 4.36Å; I118-V366 HydrophobicContact CD1-CG2 3.75Å; I118-V366 HydrophobicContact CG1-CG2 4.24Å; V366-V392 HydrophobicContact CG1-CG2 3.91Å
367	D	91.5	Very high	94	Very high	34 Å²	34	64 Å²	64	18%	0.182	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-49.7	-177.8	167.3	76.4	0	0	0	112.5	R381 N387 I388 K390 V391	D367-R381 IonicContact OD1-CZ 2.66Å; D367-R381 IonicContact OD1-NE 2.75Å; D367-R381 IonicContact OD1-NH2 2.67Å; D367-R381 PolarHBondContact OD1-NH2 2.98Å; D367-R381 WeakPolarHBondContact OD2-CD 3.05Å; D367-R381 IonicContact OD2-CZ 3.66Å; D367-R381 IonicContact OD2-NE 3.62Å; D367-R381 PolarHBondContact OD2-NE 3.03Å; D367-R381 IonicContact OD2-NH2 3.64Å; D367-R381 PolarHBondContact OD2-NH2 3.47Å; D367-N387 HydrophobicContact CB-CB 4.14Å; D367-N387 VanDerWaalsContact CG-CA 3.49Å; D367-N387 WeakPolarHBondContact OD1-CA 3.17Å; D367-N387 WeakPolarHBondContact OD2-CB 3.17Å; D367-I388 VanDerWaalsContact CB-O 3.29Å; D367-I388 WeakPolarHBondContact CB-O 3.5Å; D367-I388 PolarHBondContact OD1-N 2.75Å; D367-K390 WeakPolarHBondContact CB-O 3.09Å; D367-K390 PolarHBondContact N-O 3.1Å; D367-V391 HydrophobicContact CB-CG2 4.48Å
368	S	93.8	Very high	93.9	Very high	22 Å²	22	63.4 Å²	63.4	15%	0.154	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	156.7	-176.4	51.2	0	0	0	0	111.5	W370 R381 V392	S368-W370 PolarHBondContact OG-NE1 2.78Å; S368-R381 VanDerWaalsContact OG-CD 3.26Å; S368-R381 WeakPolarHBondContact OG-CD 3.27Å; S368-R381 PolarHBondContact OG-NE 2.96Å; S368-V392 PolarHBondContact O-N 2.81Å
369	Q	95.8	Very high	93.6	Very high	94 Å²	94	60 Å²	60	44%	0.439	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	140.8	175	-66.1	178.8	50.5	0	0	109.5	N114 V392 I394	N114-Q369 PolarHBondContact OD1-NE2 3.09Å; N114-Q369 PolarHBondContact OD1-OE1 2.67Å; Q369-V392 WeakPolarHBondContact CA-O 3.16Å; Q369-V392 HydrophobicContact CG-CB 4.22Å; Q369-I394 HydrophobicContact CB-CD1 4.39Å
370	W	96.8	Very high	93.3	Very high	56 Å²	56	59.7 Å²	59.7	21%	0.212	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	149.5	-177.7	-59	82.1	0	0	0	109.7	S368 E374 E377 A378 V392 L393 I394	S368-W370 PolarHBondContact OG-NE1 2.78Å; W370-E374 HydrophobicContact CB-CB 4.14Å; W370-E374 HydrophobicContact CE3-CB 3.93Å; W370-E377 HydrophobicContact CE3-CB 3.83Å; W370-E377 HydrophobicContact CH2-CB 4.02Å; W370-E377 HydrophobicContact CZ3-CB 3.49Å; W370-E377 VanDerWaalsContact CZ3-CB 3.49Å; W370-E377 HydrophobicContact CZ3-CG 4.25Å; W370-A378 HydrophobicContact CB-CB 3.8Å; W370-A378 HydrophobicContact CD2-CB 4.15Å; W370-A378 HydrophobicContact CG-CB 3.58Å; W370-V392 PolarHBondContact N-O 2.75Å; W370-L393 HydrophobicContact CB-CD2 4.07Å; W370-L393 CarbonylContact O-C 3.46Å; W370-L393 VanDerWaalsContact O-CA 3.27Å; W370-L393 WeakPolarHBondContact O-CA 3.19Å; W370-I394 PolarHBondContact O-N 3.31Å
371	Y	96.9	Very high	93	Very high	79 Å²	79	54.7 Å²	54.7	31%	0.31	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	165.9	173.6	-69.2	-88.7	0	0	0	111.7	D373 E374 I394 K398	Y371-D373 WeakPolarHBondContact CB-OD1 3.14Å; Y371-D373 PolarHBondContact O-N 2.67Å; Y371-E374 WeakPolarHBondContact CD2-OE2 3.2Å; Y371-E374 PolarHBondContact N-OE2 3.13Å; Y371-E374 PolarHBondContact O-N 2.94Å; Y371-I394 HydrophobicContact CD1-CB 4.16Å; Y371-I394 HydrophobicContact CD1-CD1 4.34Å; Y371-I394 HydrophobicContact CD1-CG2 4.14Å; Y371-I394 HydrophobicContact CE1-CB 4.49Å; Y371-I394 HydrophobicContact CE1-CD1 4.07Å; Y371-I394 HydrophobicContact CE1-CG2 4.17Å; Y371-I394 HydrophobicContact CE2-CD1 4.4Å; Y371-K398 HydrophobicContact CD1-CB 4.26Å; Y371-K398 HydrophobicContact CD2-CB 3.77Å; Y371-K398 HydrophobicContact CD2-CD 3.98Å; Y371-K398 HydrophobicContact CD2-CG 3.73Å; Y371-K398 HydrophobicContact CE2-CB 4.27Å; Y371-K398 HydrophobicContact CE2-CD 4.25Å; Y371-K398 HydrophobicContact CE2-CG 3.81Å; Y371-K398 HydrophobicContact CG-CB 3.77Å; Y371-K398 HydrophobicContact CG-CG 4.23Å
372	L	94.1	Very high	92.4	Very high	40 Å²	40	49 Å²	49	21%	0.209	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-65	-28.5	-176.6	-169.1	64	0	0	0	112.5	W63 E374 T375 I394 K396	W63-L372 HydrophobicContact CB-CD1 4.43Å; L372-E374 VanDerWaalsContact C-N 3.33Å; L372-T375 HydrophobicContact CD1-CG2 4.2Å; L372-T375 WeakPolarHBondContact O-CG2 3.4Å; L372-T375 PolarHBondContact O-OG1 2.68Å; L372-I394 PolarHBondContact N-O 3.47Å; L372-I394 VanDerWaalsContact N-O 3.17Å; L372-K396 WeakPolarHBondContact CB-O 3.44Å; L372-K396 PolarHBondContact N-O 2.78Å
373	D	94	Very high	91.8	Very high	84 Å²	84	49.3 Å²	49.3	45%	0.449	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-78.1	-13.3	172.1	51.8	-26.7	0	0	0	114.1	Y371 L397 K398	Y371-D373 WeakPolarHBondContact CB-OD1 3.14Å; Y371-D373 PolarHBondContact O-N 2.67Å; D373-L397 HydrophobicContact CB-CD2 3.82Å; D373-K398 PolarHBondContact OD1-N 2.8Å; D373-K398 VanDerWaalsContact OD1-N 3.07Å; D373-K398 PolarHBondContact OD2-N 3.43Å
374	E	95.9	Very high	91.4	Very high	36 Å²	36	49.2 Å²	49.2	17%	0.168	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-98.3	19.6	175.8	-58.6	175.6	142.9	0	0	112	W370 Y371 L372 K376 E377 A378 K398	W370-E374 HydrophobicContact CB-CB 4.14Å; W370-E374 HydrophobicContact CE3-CB 3.93Å; Y371-E374 WeakPolarHBondContact CD2-OE2 3.2Å; Y371-E374 PolarHBondContact N-OE2 3.13Å; Y371-E374 PolarHBondContact O-N 2.94Å; L372-E374 VanDerWaalsContact C-N 3.33Å; E374-K376 PolarHBondContact O-N 2.91Å; E374-E377 WeakPolarHBondContact CA-OE2 3.27Å; E374-E377 PolarHBondContact O-N 3.35Å; E374-A378 WeakPolarHBondContact O-CB 3.24Å; E374-A378 PolarHBondContact O-N 3.41Å; E374-K398 WeakPolarHBondContact OE1-CD 3.38Å; E374-K398 IonicContact OE1-NZ 2.82Å; E374-K398 PolarHBondContact OE1-NZ 2.81Å
375	T	93.7	Very high	90.6	Very high	37 Å²	37	52.1 Å²	52.1	23%	0.227	25%	0.246	C	C	.	.	H	α-helix	trans	-59.9	-30.2	-177	42.7	0	0	0	0	113.5	W63 L372 M379 L393	W63-T375 HydrophobicContact CE3-CG2 3.82Å; W63-T375 HydrophobicContact CH2-CG2 4.17Å; W63-T375 HydrophobicContact CZ3-CG2 3.52Å; L372-T375 HydrophobicContact CD1-CG2 4.2Å; L372-T375 WeakPolarHBondContact O-CG2 3.4Å; L372-T375 PolarHBondContact O-OG1 2.68Å; T375-M379 WeakPolarHBondContact O-CB 3.43Å; T375-M379 WeakPolarHBondContact O-CG 3.4Å; T375-M379 PolarHBondContact O-N 2.85Å; T375-L393 HydrophobicContact CG2-CD1 3.73Å; T375-L393 HydrophobicContact CG2-CD2 3.88Å; T375-L393 HydrophobicContact CG2-CG 4.47Å
376	K	93.7	Very high	90.3	Very high	136 Å²	136	55.3 Å²	55.3	59%	0.591	26%	0.257	S	S	*	.	H	α-helix	trans	-64.7	-50.5	176.9	178.9	-170.3	172.2	-165.1	0	110.6	E374 A378 M379 M380	E374-K376 PolarHBondContact O-N 2.91Å; K376-A378 VanDerWaalsContact C-N 3.32Å; K376-A378 PolarHBondContact O-N 3.13Å; K376-M379 PolarHBondContact O-N 2.84Å; K376-M380 HydrophobicContact CG-SD 4.08Å; K376-M380 WeakPolarHBondContact O-CB 3.49Å; K376-M380 WeakPolarHBondContact O-CG 3.29Å; K376-M380 PolarHBondContact O-N 3.37Å
377	E	94.3	Very high	90	Very high	73 Å²	73	53.6 Å²	53.6	34%	0.341	25%	0.246	S	C	.	.	H	α-helix	trans	-63.5	-42	179.6	-67.1	65.5	-146.2	0	0	110.2	W370 E374 M380 R381	W370-E377 HydrophobicContact CE3-CB 3.83Å; W370-E377 HydrophobicContact CH2-CB 4.02Å; W370-E377 HydrophobicContact CZ3-CB 3.49Å; W370-E377 VanDerWaalsContact CZ3-CB 3.49Å; W370-E377 HydrophobicContact CZ3-CG 4.25Å; E374-E377 WeakPolarHBondContact CA-OE2 3.27Å; E374-E377 PolarHBondContact O-N 3.35Å; E377-M380 PolarHBondContact O-N 3.47Å; E377-R381 PolarHBondContact O-N 2.83Å
378	A	92.9	Very high	89.7	Confident	0 Å²	0	53 Å²	53	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.9	-46.1	176.1	0	0	0	0	0	112.1	I8 W370 E374 K376 R381 L382 V391 L393	I8-A378 HydrophobicContact CD1-CB 3.4Å; W370-A378 HydrophobicContact CB-CB 3.8Å; W370-A378 HydrophobicContact CD2-CB 4.15Å; W370-A378 HydrophobicContact CG-CB 3.58Å; E374-A378 WeakPolarHBondContact O-CB 3.24Å; E374-A378 PolarHBondContact O-N 3.41Å; K376-A378 VanDerWaalsContact C-N 3.32Å; K376-A378 PolarHBondContact O-N 3.13Å; A378-R381 WeakPolarHBondContact O-CB 2.61Å; A378-R381 PolarHBondContact O-N 3.34Å; A378-L382 WeakPolarHBondContact O-CD1 3.21Å; A378-V391 HydrophobicContact CB-CG1 4.12Å; A378-L393 HydrophobicContact CB-CD2 3.87Å
379	M	89.9	Confident	89.3	Confident	9 Å²	9	52 Å²	52	4%	0.044	24%	0.236	C	C	.	.	H	α-helix	trans	-64.8	-43.9	174.5	-76.4	-164.7	174.4	0	0	112.3	I13 R16 L30 W63 T375 K376 R381 L382 Q383	I13-M379 HydrophobicContact CD1-CB 4.39Å; I13-M379 HydrophobicContact CG1-CB 4.48Å; I13-M379 HydrophobicContact CG1-CG 4.15Å; I13-M379 HydrophobicContact CG1-SD 4.19Å; R16-M379 HydrophobicContact CB-CE 4.33Å; R16-M379 VanDerWaalsContact CD-SD 3.57Å; R16-M379 PolarHBondContact NE-SD 2.71Å; L30-M379 HydrophobicContact CD1-CE 3.66Å; W63-M379 HydrophobicContact CH2-CE 3.09Å; W63-M379 HydrophobicContact CH2-CG 3.96Å; W63-M379 HydrophobicContact CH2-SD 4.26Å; W63-M379 HydrophobicContact CZ2-CE 3.96Å; W63-M379 HydrophobicContact CZ3-CE 3.51Å; T375-M379 WeakPolarHBondContact O-CB 3.43Å; T375-M379 WeakPolarHBondContact O-CG 3.4Å; T375-M379 PolarHBondContact O-N 2.85Å; K376-M379 PolarHBondContact O-N 2.84Å; M379-R381 PolarHBondContact O-N 3.45Å; M379-L382 PolarHBondContact O-N 3.1Å; M379-L382 VanDerWaalsContact O-N 3.09Å; M379-Q383 WeakPolarHBondContact O-CG 3.44Å; M379-Q383 PolarHBondContact O-N 3.08Å
380	M	89.3	Confident	89	Confident	54 Å²	54	47.9 Å²	47.9	27%	0.266	22%	0.216	S	C	.	.	H	α-helix	trans	-56.8	-39.5	177.2	-81.6	172.8	35.8	0	0	111.2	K376 E377 L382 Q383 E384	K376-M380 HydrophobicContact CG-SD 4.08Å; K376-M380 WeakPolarHBondContact O-CB 3.49Å; K376-M380 WeakPolarHBondContact O-CG 3.29Å; K376-M380 PolarHBondContact O-N 3.37Å; E377-M380 PolarHBondContact O-N 3.47Å; M380-L382 VanDerWaalsContact C-N 3.29Å; M380-L382 PolarHBondContact O-N 3.1Å; M380-Q383 PolarHBondContact O-N 3.27Å; M380-Q383 VanDerWaalsContact O-N 3.09Å; M380-E384 VanDerWaalsContact O-CB 3.31Å; M380-E384 WeakPolarHBondContact O-CB 3.35Å; M380-E384 VanDerWaalsContact O-CG 3.28Å; M380-E384 WeakPolarHBondContact O-CG 3.21Å; M380-E384 PolarHBondContact O-N 3.2Å
381	R	88.8	Confident	88.8	Confident	71 Å²	71	45.2 Å²	45.2	27%	0.268	21%	0.207	S	C	.	.	H	α-helix	trans	-58.8	-37.4	177.2	-170.4	168.3	175.3	106	-3.7	113.4	D367 S368 E377 A378 M379 R385 K386 N387	D367-R381 IonicContact OD1-CZ 2.66Å; D367-R381 IonicContact OD1-NE 2.75Å; D367-R381 IonicContact OD1-NH2 2.67Å; D367-R381 PolarHBondContact OD1-NH2 2.98Å; D367-R381 WeakPolarHBondContact OD2-CD 3.05Å; D367-R381 IonicContact OD2-CZ 3.66Å; D367-R381 IonicContact OD2-NE 3.62Å; D367-R381 PolarHBondContact OD2-NE 3.03Å; D367-R381 IonicContact OD2-NH2 3.64Å; D367-R381 PolarHBondContact OD2-NH2 3.47Å; S368-R381 VanDerWaalsContact OG-CD 3.26Å; S368-R381 WeakPolarHBondContact OG-CD 3.27Å; S368-R381 PolarHBondContact OG-NE 2.96Å; E377-R381 PolarHBondContact O-N 2.83Å; A378-R381 WeakPolarHBondContact O-CB 2.61Å; A378-R381 PolarHBondContact O-N 3.34Å; M379-R381 PolarHBondContact O-N 3.45Å; R381-R385 PolarHBondContact O-N 3.11Å; R381-K386 HydrophobicContact CG-CB 4.25Å; R381-K386 PolarHBondContact O-N 3.35Å; R381-K386 VanDerWaalsContact O-N 3.1Å; R381-N387 HydrophobicContact CG-CB 4.31Å
382	L	82.9	Confident	88.7	Confident	5 Å²	5	41.5 Å²	41.5	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-72.4	-43.3	171.5	-78.9	84.7	0	0	0	112.1	I8 I13 S200 A378 M379 M380 E384 R385 V391	I8-L382 HydrophobicContact CB-CD1 4.35Å; I8-L382 HydrophobicContact CG2-CD1 3.9Å; I8-L382 HydrophobicContact CG2-CD2 4Å; I13-L382 HydrophobicContact CD1-CB 3.75Å; I13-L382 HydrophobicContact CD1-CD2 4.17Å; S200-L382 PolarHBondContact OG-O 3.23Å; A378-L382 WeakPolarHBondContact O-CD1 3.21Å; M379-L382 PolarHBondContact O-N 3.1Å; M379-L382 VanDerWaalsContact O-N 3.09Å; M380-L382 VanDerWaalsContact C-N 3.29Å; M380-L382 PolarHBondContact O-N 3.1Å; L382-E384 VanDerWaalsContact C-N 3.31Å; L382-E384 PolarHBondContact O-N 3.08Å; L382-R385 PolarHBondContact O-N 3.32Å; L382-R385 VanDerWaalsContact O-N 3.16Å; L382-V391 HydrophobicContact CD1-CB 3.67Å; L382-V391 HydrophobicContact CD1-CG1 4.36Å; L382-V391 HydrophobicContact CD1-CG2 3.39Å; L382-V391 HydrophobicContact CG-CG2 4.31Å
383	Q	80.2	Confident	88.8	Confident	16 Å²	16	39.6 Å²	39.6	8%	0.075	18%	0.182	C	C	.	.	H	α-helix	trans	-64.1	-37.4	-179.3	-68.1	175.3	-106.8	0	0	111.7	I13 S200 G293 D294 M379 M380 R385	I13-Q383 HydrophobicContact CD1-CG 3.92Å; I13-Q383 HydrophobicContact CG2-CG 4.07Å; S200-Q383 PolarHBondContact OG-O 3.38Å; G293-Q383 PolarHBondContact O-NE2 2.9Å; D294-Q383 PolarHBondContact OD1-NE2 3.1Å; M379-Q383 WeakPolarHBondContact O-CG 3.44Å; M379-Q383 PolarHBondContact O-N 3.08Å; M380-Q383 PolarHBondContact O-N 3.27Å; M380-Q383 VanDerWaalsContact O-N 3.09Å; Q383-R385 VanDerWaalsContact C-N 3.31Å
384	E	82.2	Confident	89	Confident	83 Å²	83	37.1 Å²	37.1	39%	0.388	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-6.9	176.8	-64.5	178.6	165.8	0	0	113.2	M380 L382 K386	M380-E384 VanDerWaalsContact O-CB 3.31Å; M380-E384 WeakPolarHBondContact O-CB 3.35Å; M380-E384 VanDerWaalsContact O-CG 3.28Å; M380-E384 WeakPolarHBondContact O-CG 3.21Å; M380-E384 PolarHBondContact O-N 3.2Å; L382-E384 VanDerWaalsContact C-N 3.31Å; L382-E384 PolarHBondContact O-N 3.08Å; E384-K386 HydrophobicContact CB-CD 4.27Å; E384-K386 HydrophobicContact CB-CG 4.16Å; E384-K386 PolarHBondContact O-N 3.41Å; E384-K386 WeakPolarHBondContact OE2-CD 3.44Å; E384-K386 WeakPolarHBondContact OE2-CE 2.93Å; E384-K386 IonicContact OE2-NZ 2.58Å; E384-K386 PolarHBondContact OE2-NZ 3.25Å
385	R	74.3	Confident	89	Confident	65 Å²	65	35.7 Å²	35.7	25%	0.245	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	29.9	-174.4	-51.6	-171.9	-166.9	63.3	89.3	115.6	P198 R199 S200 K227 R381 L382 Q383 N387	P198-R385 VanDerWaalsContact CA-NH2 3.33Å; P198-R385 VanDerWaalsContact CB-CZ 3.48Å; P198-R385 PolarHBondContact O-NH2 3.31Å; R199-R385 VanDerWaalsContact CA-CZ 3.42Å; R199-R385 PolarHBondContact O-NE 2.89Å; R199-R385 PolarHBondContact O-NH2 2.82Å; R199-R385 VanDerWaalsContact O-NH2 3.09Å; S200-R385 VanDerWaalsContact CA-NH2 3.27Å; S200-R385 WeakPolarHBondContact OG-CG 3.39Å; S200-R385 PolarHBondContact OG-NH2 3.39Å; K227-R385 WeakPolarHBondContact CE-O 3.38Å; K227-R385 PolarHBondContact NZ-O 2.91Å; R381-R385 PolarHBondContact O-N 3.11Å; L382-R385 PolarHBondContact O-N 3.32Å; L382-R385 VanDerWaalsContact O-N 3.16Å; Q383-R385 VanDerWaalsContact C-N 3.31Å; R385-N387 PolarHBondContact O-N 2.88Å
386	K	83.8	Confident	89	Confident	129 Å²	129	39.5 Å²	39.5	56%	0.561	18%	0.176	S	C	*	.			trans	-72.5	-18	174.8	-68.9	175	179.4	163.9	0	111.5	R381 E384	R381-K386 HydrophobicContact CG-CB 4.25Å; R381-K386 PolarHBondContact O-N 3.35Å; R381-K386 VanDerWaalsContact O-N 3.1Å; E384-K386 HydrophobicContact CB-CD 4.27Å; E384-K386 HydrophobicContact CB-CG 4.16Å; E384-K386 PolarHBondContact O-N 3.41Å; E384-K386 WeakPolarHBondContact OE2-CD 3.44Å; E384-K386 WeakPolarHBondContact OE2-CE 2.93Å; E384-K386 IonicContact OE2-NZ 2.58Å; E384-K386 PolarHBondContact OE2-NZ 3.25Å
387	N	85.7	Confident	88.9	Confident	3 Å²	3	38.6 Å²	38.6	2%	0.016	18%	0.177	C	C	.	.			trans	-68.3	141.8	-179.2	68.5	-63.7	0	0	0	113.5	K227 D367 R381 R385 G389 V391	K227-N387 PolarHBondContact NZ-O 3.46Å; D367-N387 HydrophobicContact CB-CB 4.14Å; D367-N387 VanDerWaalsContact CG-CA 3.49Å; D367-N387 WeakPolarHBondContact OD1-CA 3.17Å; D367-N387 WeakPolarHBondContact OD2-CB 3.17Å; R381-N387 HydrophobicContact CG-CB 4.31Å; R385-N387 PolarHBondContact O-N 2.88Å; N387-G389 PolarHBondContact ND2-O 2.95Å; N387-V391 HydrophobicContact CB-CG2 4.1Å
388	I	84.8	Confident	88.7	Confident	20 Å²	20	40 Å²	40	10%	0.103	18%	0.182	C	C	.	.	S	Bend	trans	-120.9	103.5	163.6	-54.9	176.3	0	0	0	107	G148 K227 K230 L365 D367	G148-I388 WeakPolarHBondContact O-CA 3.43Å; K227-I388 HydrophobicContact CB-CD1 4.27Å; K227-I388 HydrophobicContact CD-CG1 4.03Å; K227-I388 HydrophobicContact CG-CD1 3.91Å; K227-I388 HydrophobicContact CG-CG1 3.94Å; K230-I388 HydrophobicContact CB-CD1 4.32Å; K230-I388 HydrophobicContact CB-CG2 4.47Å; K230-I388 HydrophobicContact CD-CD1 3.64Å; K230-I388 HydrophobicContact CD-CG2 4.47Å; K230-I388 HydrophobicContact CG-CD1 4.2Å; L365-I388 HydrophobicContact CD2-CG2 3.75Å; L365-I388 WeakPolarHBondContact CD2-O 3.09Å; D367-I388 VanDerWaalsContact CB-O 3.29Å; D367-I388 WeakPolarHBondContact CB-O 3.5Å; D367-I388 PolarHBondContact OD1-N 2.75Å
389	G	85.9	Confident	88.4	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.01	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	98.5	-157.2	-166.3	0	0	0	0	0	112.8	G148 L365 N387	G148-G389 PolarHBondContact O-N 3.02Å; L365-G389 CarbonylContact O-C 3.33Å; L365-G389 VanDerWaalsContact O-CA 3.31Å; L365-G389 WeakPolarHBondContact O-CA 3.47Å; N387-G389 PolarHBondContact ND2-O 2.95Å
390	K	88.5	Confident	87.8	Confident	8 Å²	8	57.7 Å²	57.7	4%	0.035	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	146.5	-176.3	-75.7	-100.8	-156.4	155.1	0	112.5	N9 E33 I118 L365 D367	N9-K390 PolarHBondContact OD1-NZ 3.25Å; E33-K390 IonicContact OE1-NZ 3.83Å; E33-K390 PolarHBondContact OE1-NZ 3.45Å; I118-K390 HydrophobicContact CB-CB 3.65Å; I118-K390 HydrophobicContact CB-CD 4.29Å; I118-K390 HydrophobicContact CB-CG 3.92Å; I118-K390 HydrophobicContact CD1-CB 3.73Å; I118-K390 HydrophobicContact CD1-CG 4.12Å; I118-K390 HydrophobicContact CG1-CB 4.28Å; I118-K390 HydrophobicContact CG2-CB 3.52Å; I118-K390 HydrophobicContact CG2-CG 4.3Å; L365-K390 PolarHBondContact O-N 2.76Å; D367-K390 WeakPolarHBondContact CB-O 3.09Å; D367-K390 PolarHBondContact N-O 3.1Å
391	V	92.3	Very high	86.7	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.006	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	142	175.6	-176.4	0	0	0	0	109.5	I8 D367 A378 L382 N387	I8-V391 HydrophobicContact CB-CB 4.38Å; I8-V391 HydrophobicContact CD1-CB 4.27Å; I8-V391 HydrophobicContact CD1-CG1 3.78Å; I8-V391 HydrophobicContact CG1-CG1 4.49Å; I8-V391 PolarHBondContact N-O 2.95Å; D367-V391 HydrophobicContact CB-CG2 4.48Å; A378-V391 HydrophobicContact CB-CG1 4.12Å; L382-V391 HydrophobicContact CD1-CB 3.67Å; L382-V391 HydrophobicContact CD1-CG1 4.36Å; L382-V391 HydrophobicContact CD1-CG2 3.39Å; L382-V391 HydrophobicContact CG-CG2 4.31Å; N387-V391 HydrophobicContact CB-CG2 4.1Å
392	V	95.1	Very high	84.8	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	143.5	-176.7	179.5	0	0	0	0	110.1	L5 I6 A117 I118 V366 S368 Q369 W370	L5-V392 HydrophobicContact CB-CG1 3.72Å; L5-V392 HydrophobicContact CD1-CG1 4.05Å; L5-V392 HydrophobicContact CD2-CG1 3.83Å; L5-V392 HydrophobicContact CG-CG1 4.06Å; I6-V392 CarbonylContact O-C 3.58Å; I6-V392 VanDerWaalsContact O-CA 3.3Å; I6-V392 WeakPolarHBondContact O-CA 3.16Å; I6-V392 WeakPolarHBondContact O-CG1 2.93Å; A117-V392 HydrophobicContact CB-CG1 4.17Å; A117-V392 HydrophobicContact CB-CG2 4.45Å; I118-V392 HydrophobicContact CG2-CG2 3.38Å; V366-V392 HydrophobicContact CG1-CG2 3.91Å; S368-V392 PolarHBondContact O-N 2.81Å; Q369-V392 WeakPolarHBondContact CA-O 3.16Å; Q369-V392 HydrophobicContact CG-CB 4.22Å; W370-V392 PolarHBondContact N-O 2.75Å
393	L	97	Very high	83.2	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	138.4	167.5	-60.9	169.6	0	0	0	111.1	L5 I6 I8 W63 W370 T375 A378	L5-L393 WeakPolarHBondContact CA-O 3.27Å; I6-L393 HydrophobicContact CB-CB 4.16Å; I6-L393 HydrophobicContact CD1-CB 4.42Å; I6-L393 PolarHBondContact N-O 3.37Å; I6-L393 PolarHBondContact O-N 3.32Å; I8-L393 HydrophobicContact CD1-CD1 3.96Å; I8-L393 HydrophobicContact CD1-CD2 3.59Å; I8-L393 HydrophobicContact CD1-CG 3.51Å; I8-L393 HydrophobicContact CG1-CD1 3.9Å; I8-L393 HydrophobicContact CG1-CD2 4.28Å; I8-L393 HydrophobicContact CG1-CG 3.63Å; W63-L393 HydrophobicContact CD2-CD1 3.68Å; W63-L393 VanDerWaalsContact CE2-CD1 3.47Å; W63-L393 HydrophobicContact CE3-CD1 4.09Å; W63-L393 HydrophobicContact CG-CD1 4.13Å; W63-L393 HydrophobicContact CH2-CD1 3.99Å; W63-L393 HydrophobicContact CZ2-CD1 3.67Å; W63-L393 HydrophobicContact CZ3-CD1 4.23Å; W370-L393 HydrophobicContact CB-CD2 4.07Å; W370-L393 CarbonylContact O-C 3.46Å; W370-L393 VanDerWaalsContact O-CA 3.27Å; W370-L393 WeakPolarHBondContact O-CA 3.19Å; T375-L393 HydrophobicContact CG2-CD1 3.73Å; T375-L393 HydrophobicContact CG2-CD2 3.88Å; T375-L393 HydrophobicContact CG2-CG 4.47Å; A378-L393 HydrophobicContact CB-CD2 3.87Å
394	I	97.5	Very high	81.4	Confident	32 Å²	32	81.8 Å²	81.8	16%	0.164	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	121.4	166.2	-56.7	171.6	0	0	0	106.7	L5 Q369 W370 Y371 L372 K396	L5-I394 HydrophobicContact CD2-CB 4.38Å; L5-I394 HydrophobicContact CD2-CG1 3.81Å; Q369-I394 HydrophobicContact CB-CD1 4.39Å; W370-I394 PolarHBondContact O-N 3.31Å; Y371-I394 HydrophobicContact CD1-CB 4.16Å; Y371-I394 HydrophobicContact CD1-CD1 4.34Å; Y371-I394 HydrophobicContact CD1-CG2 4.14Å; Y371-I394 HydrophobicContact CE1-CB 4.49Å; Y371-I394 HydrophobicContact CE1-CD1 4.07Å; Y371-I394 HydrophobicContact CE1-CG2 4.17Å; Y371-I394 HydrophobicContact CE2-CD1 4.4Å; L372-I394 PolarHBondContact N-O 3.47Å; L372-I394 VanDerWaalsContact N-O 3.17Å; I394-K396 HydrophobicContact CG2-CB 4.26Å; I394-K396 HydrophobicContact CG2-CG 4.46Å; I394-K396 PolarHBondContact O-N 3.4Å
395	P	95.8	Very high	79.4	Confident	6 Å²	6	81 Å²	81	4%	0.039	41%	0.407	C	S	.	.	S	Bend	trans	-78.6	58.3	-176.9	33.4	-35.9	0	0	0	111.2	L3 Q4 I6 S64 E65	L3-P395 HydrophobicContact CB-CB 4.24Å; L3-P395 HydrophobicContact CB-CG 4.03Å; L3-P395 WeakPolarHBondContact O-CG 3.14Å; Q4-P395 WeakPolarHBondContact O-CD 3.49Å; I6-P395 HydrophobicContact CD1-CB 3.77Å; S64-P395 WeakPolarHBondContact O-CB 3.37Å; E65-P395 WeakPolarHBondContact CG-O 3.38Å
396	K	94.1	Very high	77.7	Confident	118 Å²	118	84.7 Å²	84.7	51%	0.513	44%	0.436	S	S	.	.	S	Bend	trans	-153.4	159.6	176.6	-64.7	-172.9	-178.8	179.5	0	109.1	L372 I394	L372-K396 WeakPolarHBondContact CB-O 3.44Å; L372-K396 PolarHBondContact N-O 2.78Å; I394-K396 HydrophobicContact CG2-CB 4.26Å; I394-K396 HydrophobicContact CG2-CG 4.46Å; I394-K396 PolarHBondContact O-N 3.4Å
397	L	91.6	Very high	75.6	Confident	117 Å²	117	85.5 Å²	85.5	61%	0.613	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-79.1	147.2	167.1	-56	177.7	0	0	0	109.8	D373 E399	D373-L397 HydrophobicContact CB-CD2 3.82Å; L397-E399 PolarHBondContact O-N 3.43Å
398	K	90.5	Very high	73.4	Confident	103 Å²	103	93 Å²	93	45%	0.448	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-64.5	130.9	172.8	-166.1	173.7	-169	169.6	0	109.8	Y371 D373 E374 K400	Y371-K398 HydrophobicContact CD1-CB 4.26Å; Y371-K398 HydrophobicContact CD2-CB 3.77Å; Y371-K398 HydrophobicContact CD2-CD 3.98Å; Y371-K398 HydrophobicContact CD2-CG 3.73Å; Y371-K398 HydrophobicContact CE2-CB 4.27Å; Y371-K398 HydrophobicContact CE2-CD 4.25Å; Y371-K398 HydrophobicContact CE2-CG 3.81Å; Y371-K398 HydrophobicContact CG-CB 3.77Å; Y371-K398 HydrophobicContact CG-CG 4.23Å; D373-K398 PolarHBondContact OD1-N 2.8Å; D373-K398 VanDerWaalsContact OD1-N 3.07Å; D373-K398 PolarHBondContact OD2-N 3.43Å; E374-K398 WeakPolarHBondContact OE1-CD 3.38Å; E374-K398 IonicContact OE1-NZ 2.82Å; E374-K398 PolarHBondContact OE1-NZ 2.81Å; K398-K400 PolarHBondContact O-N 2.78Å
399	E	86.4	Confident	71.3	Confident	178 Å²	178	97 Å²	97	83%	0.832	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-63	125.3	171.7	-68.3	176.9	-171	0	0	108.2	L397 E401	L397-E399 PolarHBondContact O-N 3.43Å; E399-E401 PolarHBondContact O-N 2.81Å
400	K	78.4	Confident	69.1	Low	201 Å²	201	106 Å²	106	87%	0.874	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-68.7	118.1	172.4	-67.6	-175.3	178.9	-176.2	0	106.9	K398 A402	K398-K400 PolarHBondContact O-N 2.78Å; K400-A402 PolarHBondContact O-N 3.3Å; K400-A402 VanDerWaalsContact O-N 3.13Å
401	E	65.8	Low	66.7	Low	184 Å²	184	115.3 Å²	115.3	86%	0.86	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-51.8	122.8	165.2	-69.3	176.5	-178.9	0	0	106.8	E399 E403	E399-E401 PolarHBondContact O-N 2.81Å; E401-E403 PolarHBondContact O-N 2.74Å
402	A	48.6	Very low	64.3	Low	93 Å²	93	121.1 Å²	121.1	77%	0.769	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-58.5	117	173.4	0	0	0	0	0	106.3	K400 E404	K400-A402 PolarHBondContact O-N 3.3Å; K400-A402 VanDerWaalsContact O-N 3.13Å; A402-E404 PolarHBondContact O-N 3.02Å
403	E	49.4	Very low	61.4	Low	189 Å²	189	127.9 Å²	127.9	88%	0.883	68%	0.684	S	S	*	*			trans	-52.7	109.8	168.3	-72.6	176.4	170.4	0	0	106.3	E401 G405	E401-E403 PolarHBondContact O-N 2.74Å; E403-G405 VanDerWaalsContact C-N 3.34Å; E403-G405 PolarHBondContact O-N 3.38Å
404	E	42.1	Very low	59	Low	186 Å²	186	132.1 Å²	132.1	87%	0.869	72%	0.719	S	S	*	*			trans	-56.9	105.8	167.3	-79.1	-176.3	159.6	0	0	106	A402 T406	A402-E404 PolarHBondContact O-N 3.02Å; E404-T406 PolarHBondContact O-N 3.38Å
405	G	40.2	Very low	56.4	Low	68 Å²	68	137.9 Å²	137.9	70%	0.701	75%	0.75	S	S	*	*			trans	-56	108.7	172.8	0	0	0	0	0	108	E403 D407	E403-G405 VanDerWaalsContact C-N 3.34Å; E403-G405 PolarHBondContact O-N 3.38Å; G405-D407 PolarHBondContact O-N 2.89Å
406	T	38.1	Very low	53.7	Low	142 Å²	142	145.8 Å²	145.8	87%	0.871	79%	0.787	S	S	*	*			trans	-69.6	70.4	161.5	49.7	0	0	0	0	108.3	E404	E404-T406 PolarHBondContact O-N 3.38Å
407	D	40.5	Very low	51.2	Low	145 Å²	145	147.3 Å²	147.3	78%	0.775	81%	0.806	S	S	*	*			trans	-82.8	104.4	152.9	-89.5	-23	0	0	0	105.9	G405	G405-D407 PolarHBondContact O-N 2.89Å
408	N	38.7	Very low	48.8	Very low	162 Å²	162	146.5 Å²	146.5	87%	0.866	81%	0.81	S	S	*	*			trans	154.3	86.8	150.4	-76.4	-30.7	0	0	0	110.5
409	A	41.3	Very low	46.4	Very low	102 Å²	102	147.2 Å²	147.2	84%	0.843	82%	0.823	S	S	*	*			trans	-136.9	94.5	151.4	0	0	0	0	0	107.7	K411	A409-K411 PolarHBondContact O-N 3.44Å
410	E	39.1	Very low	44.2	Very low	192 Å²	192	145.8 Å²	145.8	90%	0.897	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-47	130.1	169.5	-72.8	171.3	131.9	0	0	110.9
411	K	37.6	Very low	42.4	Very low	202 Å²	202	141.2 Å²	141.2	88%	0.878	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-92.8	118.4	169.2	-133.2	179.8	-173.6	-179.7	0	107.6	A409	A409-K411 PolarHBondContact O-N 3.44Å
412	P	42	Very low	41.3	Very low	124 Å²	124	138.4 Å²	138.4	81%	0.805	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-77	128.8	170.7	-6.3	23.2	0	0	0	109.8
413	T	35.8	Very low	41.1	Very low	141 Å²	141	140 Å²	140	87%	0.865	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-70	131.4	168.2	42.2	0	0	0	0	111.8
414	A	45.6	Very low	40.8	Very low	90 Å²	90	144.3 Å²	144.3	74%	0.744	83%	0.827	S	S	*	*			trans	-168.6	100.1	150.4	0	0	0	0	0	106.9
415	D	43.2	Very low	40.7	Very low	152 Å²	152	142.2 Å²	142.2	81%	0.813	82%	0.824	S	S	*	*				78.3	111.8	93.8	-89	-8.7	0	0	0	114.1
416	E	39.1	Very low	40.8	Very low	173 Å²	173	146.1 Å²	146.1	81%	0.808	83%	0.831	S	S	*	*			trans	37.6	112.4	143.2	-59	-171.8	160.1	0	0	118.9
417	T	41.3	Very low	40.9	Very low	150 Å²	150	146.3 Å²	146.3	92%	0.92	83%	0.829	S	S	*	*				-166.6	126.5	116.6	13.4	0	0	0	0	111.3
418	S	40.4	Very low	40.9	Very low	99 Å²	99	146.4 Å²	146.4	69%	0.692	83%	0.832	S	S	*	*			trans	-83.4	163.2	178.8	61.1	0	0	0	0	112.7
419	T	40.9	Very low	41.1	Very low	118 Å²	118	145.4 Å²	145.4	72%	0.724	83%	0.83	S	S	*	*			trans	84.3	104.8	150.7	53	0	0	0	0	120.5
420	N	40.4	Very low	41	Very low	149 Å²	149	148.3 Å²	148.3	80%	0.797	83%	0.829	S	S	*	*				47.3	119.1	122.3	-69.1	-9	0	0	0	119.3
421	S	40.9	Very low	41.2	Very low	105 Å²	105	145.2 Å²	145.2	73%	0.734	82%	0.824	S	S	*	*				164.6	129.9	87.6	46.7	0	0	0	0	112.8
422	T	41.3	Very low	41.5	Very low	124 Å²	124	140.8 Å²	140.8	76%	0.761	82%	0.82	S	S	*	*			trans	42	138.9	134.9	-25.9	0	0	0	0	123.1
423	T	45.6	Very low	41.4	Very low	128 Å²	128	142.3 Å²	142.3	79%	0.785	82%	0.821	S	S	*	*			trans	79.5	100.9	152.2	16.8	0	0	0	0	115.9
424	K	42.7	Very low	41.9	Very low	278 Å²	278	142.4 Å²	142.4	100%	1.209	82%	0.817	S	S	*	*				-172.9	0	70.1	-123.6	-176.7	-176.3	178.9	0	109.1

Retrieved 424 of 424 residues in 148.8 ms (Link to these results)

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