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Gasdermin-C

This form constitutes the precursor of the pore-forming protein: upon cleavage, the released N-terminal moiety (Gasdermin-C, N-terminal) binds to membranes and forms pores, triggering pyroptosis. Pore-forming protein that causes membrane permeabilization and pyroptosis. Produced by the cleavage of gasdermin-C by caspase CASP8 in response to death signals. After cleavage, moves to the plasma membrane where it strongly binds to membrane inner leaflet lipids. Homooligomerizes within the membrane and forms pores of 10-15 nanometers (nm) of inner diameter, triggering pyroptosis.

AlphaFold DB , UniProt , Accession Q99NB5, Species MOUSE (Mus musculus, Mouse), Gene Gsdmc, Length 468 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.3	Very low	78.3	Confident	129 Å²	129	36.1 Å²	36.1	64%	0.635	18%	0.179	S	C	*	.				0	96.7	0	-74.6	-160.8	-153.6	0	0	114	K106 E430	M1-K106 WeakPolarHBondContact O-CE 3Å; M1-K106 PolarHBondContact O-NZ 3.49Å; M1-E430 PolarHBondContact N-OE1 2.67Å; M1-E430 PolarHBondContact N-OE2 3.47Å
2	S	52.6	Low	79.5	Confident	33 Å²	33	33.1 Å²	33.1	23%	0.231	16%	0.164	C	C	.	.			trans	-66.4	143.2	160.7	38.5	0	0	0	0	110.6	T4 D368	S2-T4 PolarHBondContact O-N 2.89Å; S2-D368 WeakPolarHBondContact CB-OD2 3.39Å; S2-D368 PolarHBondContact OG-OD2 3.37Å
3	Y	67.2	Low	80.6	Confident	18 Å²	18	32.4 Å²	32.4	7%	0.071	16%	0.163	C	C	.	.			trans	-89.6	87.2	179.3	-60	-66.2	0	0	0	109.8	W7 K106 C108	Y3-W7 HydrophobicContact CD1-CD2 4.15Å; Y3-W7 HydrophobicContact CD1-CE3 4.19Å; Y3-W7 HydrophobicContact CD1-CH2 4.46Å; Y3-W7 HydrophobicContact CD1-CZ2 4.41Å; Y3-W7 HydrophobicContact CD1-CZ3 4.34Å; Y3-W7 HydrophobicContact CE1-CZ2 4.49Å; Y3-K106 HydrophobicContact CE2-CD 3.77Å; Y3-K106 HydrophobicContact CE2-CG 3.6Å; Y3-K106 VanDerWaalsContact CZ-CE 3.42Å; Y3-K106 WeakPolarHBondContact OH-CD 3.45Å; Y3-K106 WeakPolarHBondContact OH-CE 3.38Å; Y3-K106 VanDerWaalsContact OH-CG 3.27Å; Y3-K106 WeakPolarHBondContact OH-CG 3.28Å; Y3-C108 HydrophobicContact CD1-CB 3.47Å; Y3-C108 VanDerWaalsContact CD1-CB 3.47Å; Y3-C108 WeakPolarHBondContact CD1-SG 3.48Å; Y3-C108 HydrophobicContact CD2-CB 3.56Å; Y3-C108 HydrophobicContact CE1-CB 3.41Å; Y3-C108 VanDerWaalsContact CE1-CB 3.41Å; Y3-C108 WeakPolarHBondContact CE1-SG 3.49Å; Y3-C108 HydrophobicContact CE2-CB 3.46Å; Y3-C108 VanDerWaalsContact CE2-CB 3.46Å; Y3-C108 HydrophobicContact CG-CB 3.53Å
4	T	78.5	Confident	81.4	Confident	33 Å²	33	41.2 Å²	41.2	20%	0.202	20%	0.2	C	C	.	.			trans	-103.7	169.4	-176.9	60.1	0	0	0	0	111.8	S2 D6 W7 L8 D368	S2-T4 PolarHBondContact O-N 2.89Å; T4-D6 PolarHBondContact O-N 3.22Å; T4-W7 WeakPolarHBondContact O-CB 3.44Å; T4-W7 PolarHBondContact O-N 2.94Å; T4-W7 PolarHBondContact OG1-N 3.17Å; T4-L8 PolarHBondContact O-N 3.03Å; T4-L8 VanDerWaalsContact O-N 3.07Å; T4-D368 WeakPolarHBondContact CG2-OD2 2.86Å
5	F	86.3	Confident	82.1	Confident	10 Å²	10	43.9 Å²	43.9	4%	0.044	21%	0.21	C	C	.	.	H	α-helix	trans	-55.9	-39.3	169.2	-179.6	-96.4	0	0	0	112.4	W7 L8 S9 V24 L27 A30 I201 L207	F5-W7 PolarHBondContact O-N 3.37Å; F5-L8 WeakPolarHBondContact O-CB 3.25Å; F5-L8 PolarHBondContact O-N 2.79Å; F5-S9 PolarHBondContact O-N 3.36Å; F5-S9 PolarHBondContact O-OG 2.69Å; F5-V24 HydrophobicContact CE1-CB 4.01Å; F5-V24 HydrophobicContact CE1-CG1 3.86Å; F5-V24 WeakPolarHBondContact CE1-O 3.05Å; F5-V24 HydrophobicContact CZ-CB 4.49Å; F5-V24 HydrophobicContact CZ-CG1 4.48Å; F5-L27 HydrophobicContact CB-CB 4.12Å; F5-L27 HydrophobicContact CD1-CB 4.01Å; F5-L27 HydrophobicContact CD2-CB 3.92Å; F5-L27 HydrophobicContact CD2-CD1 3.61Å; F5-L27 HydrophobicContact CD2-CG 4.23Å; F5-L27 HydrophobicContact CE1-CB 4.41Å; F5-L27 HydrophobicContact CE2-CB 4.32Å; F5-L27 HydrophobicContact CE2-CD1 3.45Å; F5-L27 VanDerWaalsContact CE2-CD1 3.45Å; F5-L27 HydrophobicContact CE2-CG 4.45Å; F5-L27 HydrophobicContact CG-CB 3.74Å; F5-L27 HydrophobicContact CG-CD1 4.33Å; F5-L27 HydrophobicContact CZ-CD1 4.07Å; F5-A30 HydrophobicContact CE1-CB 4.39Å; F5-A30 HydrophobicContact CZ-CB 3.82Å; F5-I201 HydrophobicContact CD2-CD1 4.14Å; F5-I201 HydrophobicContact CD2-CG1 4.41Å; F5-I201 HydrophobicContact CE2-CD1 4.43Å; F5-L207 HydrophobicContact CD2-CD2 4.28Å; F5-L207 HydrophobicContact CE2-CD2 3.32Å; F5-L207 HydrophobicContact CZ-CD2 3.58Å
6	D	85.3	Confident	82.7	Confident	27 Å²	27	43.4 Å²	43.4	14%	0.144	21%	0.208	C	C	.	.	H	α-helix	trans	-61.1	-42.7	175.4	175.9	56.7	0	0	0	112.2	T4 S9 K10	T4-D6 PolarHBondContact O-N 3.22Å; D6-S9 PolarHBondContact O-N 3.4Å; D6-K10 WeakPolarHBondContact O-CB 3.45Å; D6-K10 VanDerWaalsContact O-CG 3.32Å; D6-K10 WeakPolarHBondContact O-CG 3.43Å; D6-K10 PolarHBondContact O-N 3.34Å; D6-K10 VanDerWaalsContact OD1-CE 3.25Å; D6-K10 WeakPolarHBondContact OD1-CE 3.29Å; D6-K10 IonicContact OD1-NZ 2.7Å; D6-K10 WeakPolarHBondContact OD2-CE 3.49Å; D6-K10 IonicContact OD2-NZ 3.73Å; D6-K10 PolarHBondContact OD2-NZ 2.68Å
7	W	84.7	Confident	83	Confident	32 Å²	32	51.1 Å²	51.1	12%	0.121	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-47.1	174.8	171.4	86.3	0	0	0	111.5	Y3 T4 F5 S9 K10 D11 I84 Y110 L165	Y3-W7 HydrophobicContact CD1-CD2 4.15Å; Y3-W7 HydrophobicContact CD1-CE3 4.19Å; Y3-W7 HydrophobicContact CD1-CH2 4.46Å; Y3-W7 HydrophobicContact CD1-CZ2 4.41Å; Y3-W7 HydrophobicContact CD1-CZ3 4.34Å; Y3-W7 HydrophobicContact CE1-CZ2 4.49Å; T4-W7 WeakPolarHBondContact O-CB 3.44Å; T4-W7 PolarHBondContact O-N 2.94Å; T4-W7 PolarHBondContact OG1-N 3.17Å; F5-W7 PolarHBondContact O-N 3.37Å; W7-S9 PolarHBondContact O-N 3.5Å; W7-K10 PolarHBondContact O-N 3.14Å; W7-D11 PolarHBondContact O-N 2.98Å; W7-I84 HydrophobicContact CZ2-CD1 4.23Å; W7-Y110 HydrophobicContact CH2-CD1 4.02Å; W7-Y110 HydrophobicContact CH2-CE1 4.04Å; W7-Y110 AromaticContact CZ3-CD1 3.82Å; W7-Y110 HydrophobicContact CZ3-CD1 3.82Å; W7-Y110 HydrophobicContact CZ3-CE1 4.09Å; W7-L165 HydrophobicContact CZ3-CD1 4.23Å
8	L	90.1	Very high	82.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-56.2	-51.9	176.9	170.6	66.2	0	0	0	110.8	T4 F5 K10 D11 V12 Y110 I112 L165 I201 L207	T4-L8 PolarHBondContact O-N 3.03Å; T4-L8 VanDerWaalsContact O-N 3.07Å; F5-L8 WeakPolarHBondContact O-CB 3.25Å; F5-L8 PolarHBondContact O-N 2.79Å; L8-K10 VanDerWaalsContact C-N 3.33Å; L8-K10 PolarHBondContact O-N 2.89Å; L8-D11 PolarHBondContact O-N 2.9Å; L8-V12 HydrophobicContact CD1-CG2 4.09Å; L8-V12 HydrophobicContact CG-CG2 4.48Å; L8-V12 WeakPolarHBondContact O-CB 3.35Å; L8-V12 WeakPolarHBondContact O-CG2 3.43Å; L8-V12 PolarHBondContact O-N 2.68Å; L8-Y110 HydrophobicContact CD1-CD1 3.22Å; L8-Y110 HydrophobicContact CD1-CD2 3.74Å; L8-Y110 HydrophobicContact CD1-CE1 3.41Å; L8-Y110 VanDerWaalsContact CD1-CE1 3.41Å; L8-Y110 HydrophobicContact CD1-CE2 3.92Å; L8-Y110 HydrophobicContact CD1-CG 3.36Å; L8-I112 HydrophobicContact CD1-CD1 4.05Å; L8-L165 HydrophobicContact CB-CD2 4.2Å; L8-L165 HydrophobicContact CD2-CD2 4.48Å; L8-I201 HydrophobicContact CD2-CD1 3.17Å; L8-L207 HydrophobicContact CD2-CD1 4.46Å; L8-L207 HydrophobicContact CD2-CD2 4.22Å
9	S	92.8	Very high	82.8	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.1	-42.7	179.5	-67.7	0	0	0	0	112.1	F5 D6 W7 V12 V13 V24 L207	F5-S9 PolarHBondContact O-N 3.36Å; F5-S9 PolarHBondContact O-OG 2.69Å; D6-S9 PolarHBondContact O-N 3.4Å; W7-S9 PolarHBondContact O-N 3.5Å; S9-V12 PolarHBondContact O-N 3.17Å; S9-V13 WeakPolarHBondContact O-CG2 3.46Å; S9-V13 PolarHBondContact O-N 2.89Å; S9-V24 WeakPolarHBondContact CB-O 3.48Å; S9-V24 PolarHBondContact OG-O 3.26Å; S9-L207 VanDerWaalsContact CB-O 3.3Å; S9-L207 WeakPolarHBondContact CB-O 3.32Å; S9-L207 PolarHBondContact OG-O 3.48Å
10	K	90.7	Very high	82.9	Confident	92 Å²	92	61.8 Å²	61.8	40%	0.4	30%	0.295	S	S	.	.	H	α-helix	trans	-62.6	-43.1	175.7	-77.1	168.6	175.6	168.7	0	112.3	D6 W7 L8 V13 K14 P23	D6-K10 WeakPolarHBondContact O-CB 3.45Å; D6-K10 VanDerWaalsContact O-CG 3.32Å; D6-K10 WeakPolarHBondContact O-CG 3.43Å; D6-K10 PolarHBondContact O-N 3.34Å; D6-K10 VanDerWaalsContact OD1-CE 3.25Å; D6-K10 WeakPolarHBondContact OD1-CE 3.29Å; D6-K10 IonicContact OD1-NZ 2.7Å; D6-K10 WeakPolarHBondContact OD2-CE 3.49Å; D6-K10 IonicContact OD2-NZ 3.73Å; D6-K10 PolarHBondContact OD2-NZ 2.68Å; W7-K10 PolarHBondContact O-N 3.14Å; L8-K10 VanDerWaalsContact C-N 3.33Å; L8-K10 PolarHBondContact O-N 2.89Å; K10-V13 PolarHBondContact O-N 3.32Å; K10-K14 WeakPolarHBondContact O-CG 3.38Å; K10-K14 PolarHBondContact O-N 2.91Å; K10-K14 VanDerWaalsContact O-N 3.14Å; K10-P23 HydrophobicContact CG-CB 4Å; K10-P23 HydrophobicContact CG-CG 3.82Å
11	D	89.4	Confident	83.3	Confident	23 Å²	23	59.7 Å²	59.7	12%	0.123	29%	0.286	C	S	.	.	H	α-helix	trans	-67.7	-40.4	178.3	-171.8	70	0	0	0	111.8	W7 L8 V13 K14 K15 H82 Y110	W7-D11 PolarHBondContact O-N 2.98Å; L8-D11 PolarHBondContact O-N 2.9Å; D11-V13 PolarHBondContact O-N 2.93Å; D11-K14 WeakPolarHBondContact O-CB 3.39Å; D11-K14 PolarHBondContact O-N 3.15Å; D11-K15 WeakPolarHBondContact O-CG 3.41Å; D11-K15 PolarHBondContact O-N 2.92Å; D11-K15 WeakPolarHBondContact OD2-CE 3.34Å; D11-H82 VanDerWaalsContact CG-ND1 3.29Å; D11-H82 IonicContact OD1-CE1 2.77Å; D11-H82 PolarHBondContact OD1-CE1 3.4Å; D11-H82 IonicContact OD1-ND1 2.62Å; D11-H82 PolarHBondContact OD1-ND1 3.3Å; D11-H82 IonicContact OD2-CE1 3.16Å; D11-H82 IonicContact OD2-CG 3.64Å; D11-H82 IonicContact OD2-ND1 2.67Å; D11-H82 PolarHBondContact OD2-ND1 3.3Å; D11-Y110 HydrophobicContact CB-CE1 4.41Å; D11-Y110 VanDerWaalsContact OD2-CE1 3.31Å; D11-Y110 WeakPolarHBondContact OD2-CE1 3.43Å; D11-Y110 PolarHBondContact OD2-OH 2.81Å
12	V	92.7	Very high	85.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-46.7	174	166.4	0	0	0	0	111	L8 S9 K14 K15 L16 L80 Y110 I112 L207	L8-V12 HydrophobicContact CD1-CG2 4.09Å; L8-V12 HydrophobicContact CG-CG2 4.48Å; L8-V12 WeakPolarHBondContact O-CB 3.35Å; L8-V12 WeakPolarHBondContact O-CG2 3.43Å; L8-V12 PolarHBondContact O-N 2.68Å; S9-V12 PolarHBondContact O-N 3.17Å; V12-K14 VanDerWaalsContact C-N 3.31Å; V12-K14 PolarHBondContact O-N 3.49Å; V12-K15 PolarHBondContact O-N 3.47Å; V12-L16 HydrophobicContact CG1-CD1 3.7Å; V12-L16 HydrophobicContact CG1-CG 4.21Å; V12-L16 WeakPolarHBondContact O-CB 3.46Å; V12-L16 VanDerWaalsContact O-CG 3.28Å; V12-L16 WeakPolarHBondContact O-CG 3.22Å; V12-L16 PolarHBondContact O-N 2.78Å; V12-L80 HydrophobicContact CB-CD1 4.38Å; V12-L80 HydrophobicContact CG1-CD1 3.82Å; V12-L80 HydrophobicContact CG2-CD1 4.05Å; V12-Y110 HydrophobicContact CG2-CE2 4.31Å; V12-I112 HydrophobicContact CG2-CD1 3.63Å; V12-L207 HydrophobicContact CG1-CB 4.26Å; V12-L207 HydrophobicContact CG1-CD1 4.49Å; V12-L207 HydrophobicContact CG2-CD1 4.02Å
13	V	93.3	Very high	87.6	Confident	24 Å²	24	57.4 Å²	57.4	15%	0.145	27%	0.269	C	S	.	.	H	α-helix	trans	-57.7	-43.8	175.6	169	0	0	0	0	111.5	S9 K10 D11 L16 Q17 L21 P23 A208	S9-V13 WeakPolarHBondContact O-CG2 3.46Å; S9-V13 PolarHBondContact O-N 2.89Å; K10-V13 PolarHBondContact O-N 3.32Å; D11-V13 PolarHBondContact O-N 2.93Å; V13-L16 PolarHBondContact O-N 3.44Å; V13-Q17 PolarHBondContact O-N 3.44Å; V13-L21 HydrophobicContact CG1-CB 3.96Å; V13-L21 HydrophobicContact CG2-CB 4.45Å; V13-P23 HydrophobicContact CG2-CB 3.95Å; V13-A208 HydrophobicContact CG2-CB 3.57Å
14	K	91.6	Very high	88.9	Confident	156 Å²	156	56.5 Å²	56.5	68%	0.678	27%	0.266	S	S	*	.	H	α-helix	trans	-61.9	-43	176.8	-71.7	175.2	-178.6	-177.2	0	111.9	K10 D11 V12 Q17	K10-K14 WeakPolarHBondContact O-CG 3.38Å; K10-K14 PolarHBondContact O-N 2.91Å; K10-K14 VanDerWaalsContact O-N 3.14Å; D11-K14 WeakPolarHBondContact O-CB 3.39Å; D11-K14 PolarHBondContact O-N 3.15Å; V12-K14 VanDerWaalsContact C-N 3.31Å; V12-K14 PolarHBondContact O-N 3.49Å; K14-Q17 VanDerWaalsContact O-CG 3.29Å; K14-Q17 WeakPolarHBondContact O-CG 3.12Å; K14-Q17 PolarHBondContact O-N 3.41Å
15	K	91.8	Very high	89.3	Confident	82 Å²	82	57.9 Å²	57.9	36%	0.357	27%	0.269	S	S	.	.	H	α-helix	trans	-68.5	-36	178.7	-73.9	-179.2	-172.3	-94.8	0	113	D11 V12 Q17 L80 K81 H82 Y110	D11-K15 WeakPolarHBondContact O-CG 3.41Å; D11-K15 PolarHBondContact O-N 2.92Å; D11-K15 WeakPolarHBondContact OD2-CE 3.34Å; V12-K15 PolarHBondContact O-N 3.47Å; K15-Q17 VanDerWaalsContact C-N 3.27Å; K15-Q17 PolarHBondContact O-N 2.89Å; K15-L80 HydrophobicContact CB-CD2 4.27Å; K15-L80 HydrophobicContact CD-CD2 4.44Å; K15-K81 PolarHBondContact NZ-O 3.49Å; K15-H82 WeakPolarHBondContact CE-ND1 3.4Å; K15-Y110 VanDerWaalsContact CD-OH 3.29Å; K15-Y110 WeakPolarHBondContact CD-OH 3.42Å; K15-Y110 WeakPolarHBondContact CE-OH 3.14Å
16	L	92.4	Very high	89.3	Confident	35 Å²	35	57.9 Å²	57.9	18%	0.183	27%	0.27	C	S	.	.	H	α-helix	trans	-70.2	-23.2	178.5	-70.7	172.2	0	0	0	112.8	V12 V13 G18 L21 I78 L80 V114 Y157 A208	V12-L16 HydrophobicContact CG1-CD1 3.7Å; V12-L16 HydrophobicContact CG1-CG 4.21Å; V12-L16 WeakPolarHBondContact O-CB 3.46Å; V12-L16 VanDerWaalsContact O-CG 3.28Å; V12-L16 WeakPolarHBondContact O-CG 3.22Å; V12-L16 PolarHBondContact O-N 2.78Å; V13-L16 PolarHBondContact O-N 3.44Å; L16-G18 PolarHBondContact O-N 3.19Å; L16-L21 HydrophobicContact CB-CD1 3.96Å; L16-L21 HydrophobicContact CD1-CD1 4.27Å; L16-I78 HydrophobicContact CD2-CD1 4.25Å; L16-L80 HydrophobicContact CD2-CD1 4.39Å; L16-V114 HydrophobicContact CD2-CG2 4.47Å; L16-Y157 HydrophobicContact CD1-CD1 3.5Å; L16-Y157 VanDerWaalsContact CD1-CD1 3.5Å; L16-Y157 HydrophobicContact CD1-CD2 4.3Å; L16-Y157 HydrophobicContact CD1-CE1 3.72Å; L16-Y157 HydrophobicContact CD1-CG 3.82Å; L16-Y157 HydrophobicContact CD2-CD1 4.07Å; L16-Y157 HydrophobicContact CD2-CE1 3.83Å; L16-Y157 HydrophobicContact CG-CD1 4.44Å; L16-Y157 HydrophobicContact CG-CE1 4.37Å; L16-A208 HydrophobicContact CD1-CB 4.28Å
17	Q	87.4	Confident	89.5	Confident	174 Å²	174	59.1 Å²	59.1	81%	0.813	28%	0.276	S	S	*	.			trans	51.6	21.9	178.8	-60	-175.3	-3.1	0	0	114.6	V13 K14 K15	V13-Q17 PolarHBondContact O-N 3.44Å; K14-Q17 VanDerWaalsContact O-CG 3.29Å; K14-Q17 WeakPolarHBondContact O-CG 3.12Å; K14-Q17 PolarHBondContact O-N 3.41Å; K15-Q17 VanDerWaalsContact C-N 3.27Å; K15-Q17 PolarHBondContact O-N 2.89Å
18	G	79.5	Confident	89.8	Confident	28 Å²	28	61.1 Å²	61.1	29%	0.289	30%	0.295	S	S	.	.			trans	-78.7	137.4	-179.4	0	0	0	0	0	111.6	L16	L16-G18 PolarHBondContact O-N 3.19Å
19	R	82.8	Confident	89.9	Confident	220 Å²	220	61.1 Å²	61.1	83%	0.83	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	139	174.1	-67.4	-171.9	-177.3	-166.8	0.4	110.9	L21 K210	R19-L21 PolarHBondContact O-N 2.88Å; R19-L21 VanDerWaalsContact O-N 3.09Å; R19-K210 WeakPolarHBondContact O-CE 3.5Å
20	D	85.1	Confident	89.9	Confident	120 Å²	120	61.1 Å²	61.1	64%	0.642	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	18.1	176.7	-54.4	-37	0	0	0	115.7
21	L	91.2	Very high	90.1	Very high	17 Å²	17	60.6 Å²	60.6	9%	0.089	30%	0.3	C	S	.	.			trans	-71.8	138.3	172	-79.8	172.1	0	0	0	111.1	V13 L16 R19 Y157 A208 K210	V13-L21 HydrophobicContact CG1-CB 3.96Å; V13-L21 HydrophobicContact CG2-CB 4.45Å; L16-L21 HydrophobicContact CB-CD1 3.96Å; L16-L21 HydrophobicContact CD1-CD1 4.27Å; R19-L21 PolarHBondContact O-N 2.88Å; R19-L21 VanDerWaalsContact O-N 3.09Å; L21-Y157 HydrophobicContact CD1-CE2 4.26Å; L21-Y157 HydrophobicContact CD2-CD2 3.93Å; L21-Y157 HydrophobicContact CD2-CE2 3.6Å; L21-A208 HydrophobicContact CD2-CB 4.32Å; L21-K210 HydrophobicContact CD2-CD 4.42Å; L21-K210 HydrophobicContact CD2-CG 3.64Å; L21-K210 HydrophobicContact CG-CG 4.22Å
22	R	93.1	Very high	90.3	Very high	79 Å²	79	63.2 Å²	63.2	30%	0.298	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	140.5	176.6	-66.9	-173.3	176	-104.9	3.7	110.9	A208 Y209	R22-A208 CarbonylContact O-C 3.56Å; R22-A208 VanDerWaalsContact O-CA 3.25Å; R22-A208 WeakPolarHBondContact O-CA 3.24Å; R22-Y209 HydrophobicContact CB-CD1 4.3Å; R22-Y209 HydrophobicContact CB-CE1 3.77Å; R22-Y209 HydrophobicContact CB-CE2 4.23Å; R22-Y209 PolarHBondContact N-O 3.24Å; R22-Y209 VanDerWaalsContact O-CD1 3.28Å; R22-Y209 WeakPolarHBondContact O-CD1 3.45Å; R22-Y209 PolarHBondContact O-N 2.96Å
23	P	93.9	Very high	90.5	Very high	35 Å²	35	63.4 Å²	63.4	23%	0.227	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	147.4	177	32.1	-34.3	0	0	0	110.7	K10 V13 L207	K10-P23 HydrophobicContact CG-CB 4Å; K10-P23 HydrophobicContact CG-CG 3.82Å; V13-P23 HydrophobicContact CG2-CB 3.95Å; P23-L207 WeakPolarHBondContact CA-O 3.39Å
24	V	93.5	Very high	90.5	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.313	C	S	.	.			trans	-82.5	129	166.5	-177.5	0	0	0	0	109.3	F5 S9 A30 F33 V206 L207 Y209	F5-V24 HydrophobicContact CE1-CB 4.01Å; F5-V24 HydrophobicContact CE1-CG1 3.86Å; F5-V24 WeakPolarHBondContact CE1-O 3.05Å; F5-V24 HydrophobicContact CZ-CB 4.49Å; F5-V24 HydrophobicContact CZ-CG1 4.48Å; S9-V24 WeakPolarHBondContact CB-O 3.48Å; S9-V24 PolarHBondContact OG-O 3.26Å; V24-A30 HydrophobicContact CG1-CB 4.47Å; V24-F33 HydrophobicContact CG1-CD2 3.73Å; V24-F33 HydrophobicContact CG1-CE2 3.82Å; V24-F33 HydrophobicContact CG1-CG 4.43Å; V24-F33 HydrophobicContact CG2-CB 3.98Å; V24-F33 HydrophobicContact CG2-CD1 4.4Å; V24-F33 HydrophobicContact CG2-CD2 4.02Å; V24-F33 HydrophobicContact CG2-CG 3.89Å; V24-V206 HydrophobicContact CG2-CB 4.26Å; V24-V206 HydrophobicContact CG2-CG1 3.98Å; V24-V206 WeakPolarHBondContact CG2-O 3.35Å; V24-L207 PolarHBondContact N-O 3.4Å; V24-Y209 HydrophobicContact CG2-CD1 3.78Å; V24-Y209 HydrophobicContact CG2-CE1 4.15Å
25	K	87.1	Confident	90.6	Very high	62 Å²	62	57.3 Å²	57.3	27%	0.27	29%	0.287	S	S	.	.			trans	-83.1	-40.3	-176.3	-66.7	-161	168.9	-171.6	0	114.5	E51	K25-E51 VanDerWaalsContact CD-OE2 3.29Å; K25-E51 WeakPolarHBondContact CD-OE2 3.47Å; K25-E51 WeakPolarHBondContact CE-OE1 3.39Å; K25-E51 WeakPolarHBondContact CE-OE2 3.41Å; K25-E51 IonicContact NZ-OE1 2.76Å; K25-E51 PolarHBondContact NZ-OE1 3.38Å; K25-E51 IonicContact NZ-OE2 3.02Å; K25-E51 PolarHBondContact NZ-OE2 2.89Å
26	C	87.8	Confident	90.7	Very high	9 Å²	9	54.3 Å²	54.3	6%	0.061	27%	0.274	C	S	.	.			trans	-115.1	129.8	-171.7	-171.5	0	0	0	0	111	S28 D29 A30 Y316	C26-S28 PolarHBondContact SG-OG 2.97Å; C26-D29 PolarHBondContact O-N 2.89Å; C26-A30 PolarHBondContact O-N 2.87Å; C26-Y316 HydrophobicContact CB-CD1 4.14Å; C26-Y316 HydrophobicContact CB-CE1 3.85Å
27	L	89.5	Confident	90.9	Very high	53 Å²	53	53.6 Å²	53.6	28%	0.277	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-65.9	-38.1	-179.1	176.4	60.9	0	0	0	111.8	F5 D29 A30 I199 I201	F5-L27 HydrophobicContact CB-CB 4.12Å; F5-L27 HydrophobicContact CD1-CB 4.01Å; F5-L27 HydrophobicContact CD2-CB 3.92Å; F5-L27 HydrophobicContact CD2-CD1 3.61Å; F5-L27 HydrophobicContact CD2-CG 4.23Å; F5-L27 HydrophobicContact CE1-CB 4.41Å; F5-L27 HydrophobicContact CE2-CB 4.32Å; F5-L27 HydrophobicContact CE2-CD1 3.45Å; F5-L27 VanDerWaalsContact CE2-CD1 3.45Å; F5-L27 HydrophobicContact CE2-CG 4.45Å; F5-L27 HydrophobicContact CG-CB 3.74Å; F5-L27 HydrophobicContact CG-CD1 4.33Å; F5-L27 HydrophobicContact CZ-CD1 4.07Å; L27-D29 PolarHBondContact O-N 2.99Å; L27-A30 HydrophobicContact CD1-CB 4.45Å; L27-A30 VanDerWaalsContact O-CB 3.22Å; L27-A30 WeakPolarHBondContact O-CB 3.5Å; L27-A30 PolarHBondContact O-N 2.82Å; L27-I199 HydrophobicContact CD2-CG2 3.61Å; L27-I201 HydrophobicContact CD1-CG1 4.47Å; L27-I201 HydrophobicContact CD1-CG2 4.41Å
28	S	89.5	Confident	91.2	Very high	74 Å²	74	45.3 Å²	45.3	52%	0.517	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-64.3	-22.2	-178.4	68.2	0	0	0	0	113.2	C26	C26-S28 PolarHBondContact SG-OG 2.97Å
29	D	92.2	Very high	92	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-101.8	-1.6	176.6	-80.5	-21.3	0	0	0	113.3	C26 L27 T31 K32 F33 P54 K320	C26-D29 PolarHBondContact O-N 2.89Å; L27-D29 PolarHBondContact O-N 2.99Å; D29-T31 VanDerWaalsContact C-N 3.27Å; D29-T31 PolarHBondContact O-N 3.05Å; D29-T31 VanDerWaalsContact O-N 3.15Å; D29-K32 WeakPolarHBondContact O-CA 3.3Å; D29-K32 VanDerWaalsContact O-CB 3.28Å; D29-K32 WeakPolarHBondContact O-CB 3.23Å; D29-K32 PolarHBondContact O-N 2.98Å; D29-K32 WeakPolarHBondContact OD1-CD 3.38Å; D29-K32 WeakPolarHBondContact OD1-CE 3.46Å; D29-K32 IonicContact OD1-NZ 3.01Å; D29-K32 PolarHBondContact OD1-NZ 3.36Å; D29-F33 HydrophobicContact CB-CE2 4.01Å; D29-F33 VanDerWaalsContact O-CD2 3.27Å; D29-F33 WeakPolarHBondContact O-CD2 3.38Å; D29-P54 HydrophobicContact CB-CG 4.13Å; D29-K320 IonicContact OD1-NZ 3.72Å; D29-K320 PolarHBondContact OD1-NZ 2.86Å; D29-K320 IonicContact OD2-NZ 3.69Å; D29-K320 PolarHBondContact OD2-NZ 3.36Å
30	A	93.9	Very high	92.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-54.7	-40.9	-172.3	0	0	0	0	0	113.3	F5 V24 C26 L27 K32 F33 V206	F5-A30 HydrophobicContact CE1-CB 4.39Å; F5-A30 HydrophobicContact CZ-CB 3.82Å; V24-A30 HydrophobicContact CG1-CB 4.47Å; C26-A30 PolarHBondContact O-N 2.87Å; L27-A30 HydrophobicContact CD1-CB 4.45Å; L27-A30 VanDerWaalsContact O-CB 3.22Å; L27-A30 WeakPolarHBondContact O-CB 3.5Å; L27-A30 PolarHBondContact O-N 2.82Å; A30-K32 PolarHBondContact O-N 3.32Å; A30-F33 PolarHBondContact O-N 2.88Å; A30-V206 WeakPolarHBondContact O-CB 3.5Å; A30-V206 VanDerWaalsContact O-CG2 3.26Å; A30-V206 WeakPolarHBondContact O-CG2 3.42Å; A30-V206 PolarHBondContact O-N 3.49Å
31	T	94	Very high	92.6	Very high	81 Å²	81	29.3 Å²	29.3	50%	0.497	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-72.9	-11	177.3	57.1	0	0	0	0	113.6	D29 F33 C34	D29-T31 VanDerWaalsContact C-N 3.27Å; D29-T31 PolarHBondContact O-N 3.05Å; D29-T31 VanDerWaalsContact O-N 3.15Å; T31-F33 VanDerWaalsContact C-N 3.33Å; T31-C34 PolarHBondContact O-SG 3.41Å
32	K	94.7	Very high	92.3	Very high	78 Å²	78	28.9 Å²	28.9	34%	0.339	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-91.5	5	177.1	-51.4	178.8	-165.8	153	0	112.8	D29 A30 N37 P54	D29-K32 WeakPolarHBondContact O-CA 3.3Å; D29-K32 VanDerWaalsContact O-CB 3.28Å; D29-K32 WeakPolarHBondContact O-CB 3.23Å; D29-K32 PolarHBondContact O-N 2.98Å; D29-K32 WeakPolarHBondContact OD1-CD 3.38Å; D29-K32 WeakPolarHBondContact OD1-CE 3.46Å; D29-K32 IonicContact OD1-NZ 3.01Å; D29-K32 PolarHBondContact OD1-NZ 3.36Å; A30-K32 PolarHBondContact O-N 3.32Å; K32-N37 VanDerWaalsContact C-ND2 3.26Å; K32-N37 WeakPolarHBondContact CA-ND2 3.35Å; K32-N37 VanDerWaalsContact O-CB 3.27Å; K32-N37 WeakPolarHBondContact O-CB 3.41Å; K32-N37 PolarHBondContact O-ND2 2.68Å; K32-P54 HydrophobicContact CB-CB 3.63Å; K32-P54 HydrophobicContact CB-CG 3.84Å; K32-P54 HydrophobicContact CD-CG 4.27Å
33	F	96.2	Very high	91.3	Very high	5 Å²	5	27.8 Å²	27.8	2%	0.022	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-106.3	21.5	169.2	-69.2	-94.5	0	0	0	112.2	V24 D29 A30 T31 L39 Y52 P54 V153 V206 Y209	V24-F33 HydrophobicContact CG1-CD2 3.73Å; V24-F33 HydrophobicContact CG1-CE2 3.82Å; V24-F33 HydrophobicContact CG1-CG 4.43Å; V24-F33 HydrophobicContact CG2-CB 3.98Å; V24-F33 HydrophobicContact CG2-CD1 4.4Å; V24-F33 HydrophobicContact CG2-CD2 4.02Å; V24-F33 HydrophobicContact CG2-CG 3.89Å; D29-F33 HydrophobicContact CB-CE2 4.01Å; D29-F33 VanDerWaalsContact O-CD2 3.27Å; D29-F33 WeakPolarHBondContact O-CD2 3.38Å; A30-F33 PolarHBondContact O-N 2.88Å; T31-F33 VanDerWaalsContact C-N 3.33Å; F33-L39 HydrophobicContact CD1-CD1 3.96Å; F33-L39 HydrophobicContact CD1-CD2 3.76Å; F33-L39 HydrophobicContact CE1-CD1 3.95Å; F33-L39 HydrophobicContact CE1-CD2 3.68Å; F33-L39 HydrophobicContact CE1-CG 4.48Å; F33-L39 HydrophobicContact CZ-CD2 4.43Å; F33-Y52 WeakPolarHBondContact CZ-O 3.15Å; F33-P54 HydrophobicContact CE2-CG 3.97Å; F33-P54 HydrophobicContact CZ-CG 4.22Å; F33-V153 WeakPolarHBondContact O-CG1 3.1Å; F33-V206 HydrophobicContact CB-CB 4.16Å; F33-V206 HydrophobicContact CB-CG1 4.09Å; F33-V206 HydrophobicContact CB-CG2 4.46Å; F33-Y209 HydrophobicContact CB-CD1 4.5Å; F33-Y209 AromaticContact CD1-CD1 3.82Å; F33-Y209 HydrophobicContact CD1-CD1 3.82Å; F33-Y209 HydrophobicContact CD1-CD2 4.18Å; F33-Y209 AromaticContact CD1-CE1 3.67Å; F33-Y209 HydrophobicContact CD1-CE1 3.67Å; F33-Y209 HydrophobicContact CD1-CE2 4.02Å; F33-Y209 HydrophobicContact CD1-CG 4.09Å; F33-Y209 AromaticContact CD1-CZ 3.77Å; F33-Y209 HydrophobicContact CE1-CD1 4.46Å; F33-Y209 AromaticContact CE1-CE1 3.84Å; F33-Y209 HydrophobicContact CE1-CE1 3.84Å; F33-Y209 HydrophobicContact CE1-CE2 4.25Å; F33-Y209 AromaticContact CE1-CZ 3.73Å; F33-Y209 HydrophobicContact CG-CD1 4.41Å
34	C	94.2	Very high	90	Very high	28 Å²	28	27.4 Å²	27.4	19%	0.189	16%	0.156	C	C	.	.	S	Bend	trans	-70.6	169.4	172.9	-69	0	0	0	0	112	T31 N37 V153	T31-C34 PolarHBondContact O-SG 3.41Å; C34-N37 VanDerWaalsContact O-CB 3.3Å; C34-N37 WeakPolarHBondContact O-CB 3.45Å; C34-N37 PolarHBondContact O-N 3.04Å; C34-N37 PolarHBondContact O-OD1 3.25Å; C34-V153 WeakPolarHBondContact O-CB 3.31Å
35	L	93.9	Very high	88.6	Confident	23 Å²	23	30.7 Å²	30.7	12%	0.12	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	141	178.6	-74	178.5	0	0	0	112.9	N37 P72 K117 I119 T154	L35-N37 PolarHBondContact O-N 3.35Å; L35-P72 HydrophobicContact CD1-CB 3.63Å; L35-P72 HydrophobicContact CD1-CG 4.47Å; L35-K117 HydrophobicContact CD1-CB 3.71Å; L35-K117 HydrophobicContact CG-CB 4.26Å; L35-I119 HydrophobicContact CD1-CD1 4.34Å; L35-I119 HydrophobicContact CD1-CG1 4.17Å; L35-I119 HydrophobicContact CD2-CG1 4.27Å; L35-T154 VanDerWaalsContact CD2-O 3.24Å; L35-T154 WeakPolarHBondContact CD2-O 3.27Å
36	F	92.7	Very high	87.1	Confident	19 Å²	19	28.3 Å²	28.3	8%	0.083	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	-4.5	-177.9	-51.2	-63.7	0	0	0	116.4	I38 T58 L59 L60 V69 I119 L127 V153	F36-I38 PolarHBondContact O-N 2.81Å; F36-T58 CarbonylContact O-C 3.52Å; F36-T58 VanDerWaalsContact O-CA 3.23Å; F36-T58 WeakPolarHBondContact O-CA 3.35Å; F36-L59 HydrophobicContact CB-CB 4.47Å; F36-L59 PolarHBondContact O-N 3.28Å; F36-L60 HydrophobicContact CD2-CD1 4.31Å; F36-V69 HydrophobicContact CE2-CG1 4.16Å; F36-I119 HydrophobicContact CE1-CD1 4.45Å; F36-I119 HydrophobicContact CE1-CG1 3.98Å; F36-I119 HydrophobicContact CE2-CD1 4.21Å; F36-I119 HydrophobicContact CE2-CG1 4.35Å; F36-I119 HydrophobicContact CZ-CD1 3.64Å; F36-I119 HydrophobicContact CZ-CG1 3.63Å; F36-L127 HydrophobicContact CD1-CD1 4.32Å; F36-L127 HydrophobicContact CE1-CD1 3.7Å; F36-L127 HydrophobicContact CZ-CD1 4.46Å; F36-V153 PolarHBondContact N-O 3.39Å
37	N	95.8	Very high	85.5	Confident	21 Å²	21	30.2 Å²	30.2	11%	0.112	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	139.4	173.9	-77.9	47	0	0	0	110.9	K32 C34 L35 V152 V153	K32-N37 VanDerWaalsContact C-ND2 3.26Å; K32-N37 WeakPolarHBondContact CA-ND2 3.35Å; K32-N37 VanDerWaalsContact O-CB 3.27Å; K32-N37 WeakPolarHBondContact O-CB 3.41Å; K32-N37 PolarHBondContact O-ND2 2.68Å; C34-N37 VanDerWaalsContact O-CB 3.3Å; C34-N37 WeakPolarHBondContact O-CB 3.45Å; C34-N37 PolarHBondContact O-N 3.04Å; C34-N37 PolarHBondContact O-OD1 3.25Å; L35-N37 PolarHBondContact O-N 3.35Å; N37-V152 WeakPolarHBondContact O-CA 3.25Å; N37-V153 HydrophobicContact CB-CG2 4.39Å; N37-V153 PolarHBondContact O-N 3.27Å
38	I	95.3	Very high	84.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	133	177.7	-60	174.3	0	0	0	109	F36 V55 F57 L62 F139 L150 Y151	F36-I38 PolarHBondContact O-N 2.81Å; I38-V55 HydrophobicContact CB-CG2 3.7Å; I38-V55 HydrophobicContact CG2-CG2 3.8Å; I38-V55 WeakPolarHBondContact O-CG2 3.37Å; I38-V55 PolarHBondContact O-N 3.01Å; I38-V55 VanDerWaalsContact O-N 3.11Å; I38-F57 PolarHBondContact N-O 3.06Å; I38-L62 HydrophobicContact CD1-CD1 3.29Å; I38-L62 HydrophobicContact CD1-CG 3.78Å; I38-F139 HydrophobicContact CD1-CZ 4.34Å; I38-L150 HydrophobicContact CG2-CB 4.23Å; I38-L150 HydrophobicContact CG2-CD1 4.49Å; I38-L150 HydrophobicContact CG2-CD2 4.15Å; I38-Y151 CarbonylContact C-O 3.48Å; I38-Y151 VanDerWaalsContact CA-O 3.31Å; I38-Y151 WeakPolarHBondContact CA-O 3.32Å
39	L	94.9	Very high	83.3	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	133.3	177.1	-50	179.4	0	0	0	109.5	F33 I53 P54 L150 Y151 V153 Y209 K211	F33-L39 HydrophobicContact CD1-CD1 3.96Å; F33-L39 HydrophobicContact CD1-CD2 3.76Å; F33-L39 HydrophobicContact CE1-CD1 3.95Å; F33-L39 HydrophobicContact CE1-CD2 3.68Å; F33-L39 HydrophobicContact CE1-CG 4.48Å; F33-L39 HydrophobicContact CZ-CD2 4.43Å; L39-I53 CarbonylContact C-O 3.59Å; L39-I53 WeakPolarHBondContact CA-O 3.44Å; L39-P54 HydrophobicContact CD2-CB 4.02Å; L39-L150 CarbonylContact O-C 3.59Å; L39-L150 WeakPolarHBondContact O-CA 3.34Å; L39-Y151 PolarHBondContact N-O 3.18Å; L39-Y151 PolarHBondContact O-N 2.61Å; L39-V153 HydrophobicContact CD1-CG2 3.78Å; L39-V153 HydrophobicContact CD2-CG2 4.3Å; L39-V153 HydrophobicContact CG-CG2 4.02Å; L39-Y209 HydrophobicContact CD1-CD2 4Å; L39-Y209 HydrophobicContact CD1-CE2 3.41Å; L39-Y209 VanDerWaalsContact CD1-CE2 3.41Å; L39-K211 HydrophobicContact CD1-CB 4.48Å; L39-K211 HydrophobicContact CD1-CD 4.43Å
40	Q	93	Very high	82.6	Confident	4 Å²	4	32.9 Å²	32.9	2%	0.019	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	132.5	169	-174	-175.9	-63.8	0	0	109.2	Y52 I53 V55 C143 K148 L150 E323 L324	Q40-Y52 WeakPolarHBondContact O-CA 3.32Å; Q40-I53 PolarHBondContact N-O 3.15Å; Q40-I53 PolarHBondContact O-N 2.84Å; Q40-V55 HydrophobicContact CB-CG1 3.7Å; Q40-C143 PolarHBondContact OE1-SG 3.3Å; Q40-K148 HydrophobicContact CG-CB 3.97Å; Q40-K148 HydrophobicContact CG-CD 4.43Å; Q40-K148 HydrophobicContact CG-CG 4.27Å; Q40-L150 HydrophobicContact CB-CD2 4.11Å; Q40-L150 HydrophobicContact CG-CD2 4.3Å; Q40-E323 PolarHBondContact NE2-O 3.17Å; Q40-L324 HydrophobicContact CB-CD2 4.45Å
41	E	89.4	Confident	82.1	Confident	28 Å²	28	34.8 Å²	34.8	13%	0.131	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	131.3	170.2	-178.2	158.1	-128.8	0	0	110.6	T50 E51 Y52 N149 Y151	E41-T50 HydrophobicContact CG-CG2 4.16Å; E41-T50 PolarHBondContact OE1-OG1 3.25Å; E41-E51 WeakPolarHBondContact CA-O 3.25Å; E41-Y52 HydrophobicContact CB-CD1 4.13Å; E41-Y52 HydrophobicContact CB-CE1 3.75Å; E41-Y52 HydrophobicContact CG-CE1 3.8Å; E41-Y52 PolarHBondContact OE1-OH 3.3Å; E41-N149 HydrophobicContact CB-CB 4.24Å; E41-N149 PolarHBondContact N-O 2.8Å; E41-N149 PolarHBondContact OE2-ND2 3.35Å; E41-Y151 HydrophobicContact CB-CD2 4.35Å; E41-Y151 HydrophobicContact CB-CE2 3.77Å; E41-Y151 HydrophobicContact CG-CE2 4.42Å; E41-Y151 VanDerWaalsContact OE2-CE2 3.31Å; E41-Y151 WeakPolarHBondContact OE2-CE2 3.26Å; E41-Y151 PolarHBondContact OE2-OH 3.37Å
42	T	82.9	Confident	81.9	Confident	8 Å²	8	31.4 Å²	31.4	5%	0.049	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-71.1	151.7	173.6	61.7	0	0	0	0	110.9	S44 E51 I53 E323	T42-S44 PolarHBondContact O-N 2.84Å; T42-S44 VanDerWaalsContact O-N 3.17Å; T42-E51 HydrophobicContact CG2-CB 3.8Å; T42-E51 PolarHBondContact N-O 3.15Å; T42-E51 PolarHBondContact OG1-N 3.24Å; T42-E51 PolarHBondContact OG1-O 3.27Å; T42-I53 HydrophobicContact CG2-CD1 3.47Å; T42-I53 VanDerWaalsContact CG2-CD1 3.47Å; T42-I53 HydrophobicContact CG2-CG1 3.9Å; T42-E323 WeakPolarHBondContact CB-OE1 3.38Å; T42-E323 HydrophobicContact CG2-CG 3.85Å
43	S	73.6	Confident	81.8	Confident	56 Å²	56	27.7 Å²	27.7	39%	0.392	15%	0.149	S	C	.	.			trans	-79.6	100.8	172.3	-67	0	0	0	0	108	R45 K148 Q361	S43-R45 PolarHBondContact O-N 3.01Å; S43-R45 VanDerWaalsContact O-N 3.16Å; S43-K148 PolarHBondContact OG-NZ 2.89Å; S43-Q361 PolarHBondContact O-NE2 2.96Å; S43-Q361 PolarHBondContact O-OE1 3.46Å
44	S	65.3	Low	81.7	Confident	27 Å²	27	27.6 Å²	27.6	19%	0.189	15%	0.149	C	C	.	.			trans	-62.2	115.9	173.9	176.8	0	0	0	0	110	T42 L46 L48	T42-S44 PolarHBondContact O-N 2.84Å; T42-S44 VanDerWaalsContact O-N 3.17Å; S44-L46 PolarHBondContact OG-O 2.95Å; S44-L46 VanDerWaalsContact OG-O 3.05Å; S44-L48 PolarHBondContact OG-O 3.25Å
45	R	64.5	Low	81.6	Confident	69 Å²	69	26.8 Å²	26.8	26%	0.26	14%	0.143	S	C	.	.			trans	-98.8	151.9	157	-58.6	-167.1	-177.6	-157.9	1.4	107.5	S43 D354 Y358	S43-R45 PolarHBondContact O-N 3.01Å; S43-R45 VanDerWaalsContact O-N 3.16Å; R45-D354 IonicContact CZ-OD2 3.59Å; R45-D354 IonicContact NH1-OD2 2.81Å; R45-D354 IonicContact NH2-OD1 3.75Å; R45-D354 PolarHBondContact NH2-OD1 3.12Å; R45-D354 IonicContact NH2-OD2 3.21Å; R45-D354 PolarHBondContact NH2-OD2 3Å; R45-Y358 HydrophobicContact CB-CD2 3.95Å; R45-Y358 HydrophobicContact CB-CE2 4.45Å
46	L	56.2	Low	81.6	Confident	12 Å²	12	28.3 Å²	28.3	6%	0.063	16%	0.164	C	C	.	.	S	Bend	trans	63.3	164.5	-162	-55.8	160.3	0	0	0	111.2	S44 L48 L279 E282 Y358 A362	S44-L46 PolarHBondContact OG-O 2.95Å; S44-L46 VanDerWaalsContact OG-O 3.05Å; L46-L48 HydrophobicContact CB-CB 4.41Å; L46-L48 HydrophobicContact CB-CD1 3.71Å; L46-L48 HydrophobicContact CB-CG 3.55Å; L46-L48 HydrophobicContact CD1-CD1 3.62Å; L46-L48 HydrophobicContact CD1-CG 4.32Å; L46-L48 HydrophobicContact CG-CD1 4.26Å; L46-L48 PolarHBondContact O-N 3.49Å; L46-L279 HydrophobicContact CD2-CD1 3.31Å; L46-E282 WeakPolarHBondContact CA-OE1 3.45Å; L46-E282 HydrophobicContact CD2-CG 4.28Å; L46-E282 WeakPolarHBondContact CD2-OE1 3.44Å; L46-E282 VanDerWaalsContact CG-OE1 3.25Å; L46-E282 WeakPolarHBondContact CG-OE1 3.47Å; L46-E282 PolarHBondContact N-OE1 3.21Å; L46-Y358 HydrophobicContact CD1-CE2 3.85Å; L46-Y358 HydrophobicContact CD2-CE2 4.16Å; L46-Y358 HydrophobicContact CG-CE2 3.74Å; L46-A362 HydrophobicContact CD1-CB 4.47Å
47	A	54.5	Low	81.6	Confident	48 Å²	48	30.6 Å²	30.6	40%	0.397	17%	0.174	S	C	.	.	S	Bend	trans	-69	32.6	173.3	0	0	0	0	0	112.8	W258 L274	A47-W258 HydrophobicContact CB-CZ2 4.18Å; A47-L274 HydrophobicContact CB-CD2 3.74Å
48	L	64.3	Low	81.4	Confident	17 Å²	17	30.9 Å²	30.9	9%	0.089	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-79.9	166.9	-177.4	-64.6	177.6	0	0	0	110.8	S44 L46 V365 M450 A454	S44-L48 PolarHBondContact OG-O 3.25Å; L46-L48 HydrophobicContact CB-CB 4.41Å; L46-L48 HydrophobicContact CB-CD1 3.71Å; L46-L48 HydrophobicContact CB-CG 3.55Å; L46-L48 HydrophobicContact CD1-CD1 3.62Å; L46-L48 HydrophobicContact CD1-CG 4.32Å; L46-L48 HydrophobicContact CG-CD1 4.26Å; L46-L48 PolarHBondContact O-N 3.49Å; L48-V365 HydrophobicContact CD1-CG2 3.95Å; L48-V365 HydrophobicContact CD2-CG1 4.5Å; L48-V365 HydrophobicContact CD2-CG2 3.72Å; L48-V365 HydrophobicContact CG-CG2 4.27Å; L48-M450 HydrophobicContact CD2-CG 3.34Å; L48-M450 HydrophobicContact CD2-SD 4.07Å; L48-A454 HydrophobicContact CD2-CB 4.39Å
49	K	68.4	Low	81.2	Confident	129 Å²	129	30.9 Å²	30.9	56%	0.561	18%	0.177	S	C	*	.	P	Polyproline II helix	trans	-78.8	132.7	-178.2	-145.1	168.9	-173.4	169.9	0	109.3
50	T	76.4	Confident	80.9	Confident	38 Å²	38	33.6 Å²	33.6	23%	0.233	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-66.3	140.4	170.6	50.3	0	0	0	0	111	E41 Y52	E41-T50 HydrophobicContact CG-CG2 4.16Å; E41-T50 PolarHBondContact OE1-OG1 3.25Å; T50-Y52 PolarHBondContact OG1-OH 3.28Å
51	E	83.2	Confident	80.8	Confident	39 Å²	39	38.5 Å²	38.5	18%	0.182	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-103.5	160.6	175.8	-64.5	-57.2	145.4	0	0	110.6	K25 E41 T42	K25-E51 VanDerWaalsContact CD-OE2 3.29Å; K25-E51 WeakPolarHBondContact CD-OE2 3.47Å; K25-E51 WeakPolarHBondContact CE-OE1 3.39Å; K25-E51 WeakPolarHBondContact CE-OE2 3.41Å; K25-E51 IonicContact NZ-OE1 2.76Å; K25-E51 PolarHBondContact NZ-OE1 3.38Å; K25-E51 IonicContact NZ-OE2 3.02Å; K25-E51 PolarHBondContact NZ-OE2 2.89Å; E41-E51 WeakPolarHBondContact CA-O 3.25Å; T42-E51 HydrophobicContact CG2-CB 3.8Å; T42-E51 PolarHBondContact N-O 3.15Å; T42-E51 PolarHBondContact OG1-N 3.24Å; T42-E51 PolarHBondContact OG1-O 3.27Å
52	Y	90.8	Very high	80.8	Confident	11 Å²	11	37.1 Å²	37.1	4%	0.043	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	118.4	179.3	-61.6	-76.6	0	0	0	109.7	F33 Q40 E41 T50 Y151 K211	F33-Y52 WeakPolarHBondContact CZ-O 3.15Å; Q40-Y52 WeakPolarHBondContact O-CA 3.32Å; E41-Y52 HydrophobicContact CB-CD1 4.13Å; E41-Y52 HydrophobicContact CB-CE1 3.75Å; E41-Y52 HydrophobicContact CG-CE1 3.8Å; E41-Y52 PolarHBondContact OE1-OH 3.3Å; T50-Y52 PolarHBondContact OG1-OH 3.28Å; Y52-Y151 HydrophobicContact CD1-CD2 4.05Å; Y52-Y151 HydrophobicContact CD1-CE2 4.36Å; Y52-Y151 AromaticContact CE1-CD2 3.82Å; Y52-Y151 HydrophobicContact CE1-CD2 3.82Å; Y52-Y151 AromaticContact CE1-CE2 3.71Å; Y52-Y151 HydrophobicContact CE1-CE2 3.71Å; Y52-Y151 HydrophobicContact CE1-CG 4.48Å; Y52-K211 HydrophobicContact CD1-CD 3.86Å; Y52-K211 HydrophobicContact CD2-CD 4.27Å; Y52-K211 HydrophobicContact CE1-CD 3.95Å; Y52-K211 HydrophobicContact CE2-CD 4.34Å; Y52-K211 HydrophobicContact CG-CD 4.04Å; Y52-K211 WeakPolarHBondContact OH-CE 3.27Å; Y52-K211 PolarHBondContact OH-NZ 3.1Å
53	I	92.1	Very high	81.1	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	127.8	-173.3	-63.2	176.1	0	0	0	108.8	L39 Q40 T42 V55 K320 E323 L324	L39-I53 CarbonylContact C-O 3.59Å; L39-I53 WeakPolarHBondContact CA-O 3.44Å; Q40-I53 PolarHBondContact N-O 3.15Å; Q40-I53 PolarHBondContact O-N 2.84Å; T42-I53 HydrophobicContact CG2-CD1 3.47Å; T42-I53 VanDerWaalsContact CG2-CD1 3.47Å; T42-I53 HydrophobicContact CG2-CG1 3.9Å; I53-V55 PolarHBondContact O-N 3.39Å; I53-K320 HydrophobicContact CG2-CB 4.45Å; I53-K320 HydrophobicContact CG2-CD 4.05Å; I53-K320 HydrophobicContact CG2-CG 3.68Å; I53-E323 HydrophobicContact CD1-CB 3.57Å; I53-E323 HydrophobicContact CD1-CG 3.82Å; I53-L324 HydrophobicContact CG2-CD1 3.89Å; I53-L324 HydrophobicContact CG2-CD2 4.06Å; I53-L324 HydrophobicContact CG2-CG 4.02Å
54	P	94.2	Very high	81.6	Confident	2 Å²	2	38 Å²	38	1%	0.013	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	125.3	175.7	28.4	-32.1	0	0	0	110.2	D29 K32 F33 L39 G56	D29-P54 HydrophobicContact CB-CG 4.13Å; K32-P54 HydrophobicContact CB-CB 3.63Å; K32-P54 HydrophobicContact CB-CG 3.84Å; K32-P54 HydrophobicContact CD-CG 4.27Å; F33-P54 HydrophobicContact CE2-CG 3.97Å; F33-P54 HydrophobicContact CZ-CG 4.22Å; L39-P54 HydrophobicContact CD2-CB 4.02Å; P54-G56 VanDerWaalsContact C-N 3.28Å; P54-G56 PolarHBondContact O-N 3.34Å
55	V	93.3	Very high	82.1	Confident	12 Å²	12	41.3 Å²	41.3	7%	0.073	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-7.2	-177.6	-53.8	0	0	0	0	113.3	I38 Q40 I53 F57 F139 L324	I38-V55 HydrophobicContact CB-CG2 3.7Å; I38-V55 HydrophobicContact CG2-CG2 3.8Å; I38-V55 WeakPolarHBondContact O-CG2 3.37Å; I38-V55 PolarHBondContact O-N 3.01Å; I38-V55 VanDerWaalsContact O-N 3.11Å; Q40-V55 HydrophobicContact CB-CG1 3.7Å; I53-V55 PolarHBondContact O-N 3.39Å; V55-F57 HydrophobicContact CG2-CB 4.09Å; V55-F57 HydrophobicContact CG2-CD2 4.25Å; V55-F57 WeakPolarHBondContact O-CD2 3.47Å; V55-F139 HydrophobicContact CB-CD2 4.2Å; V55-F139 HydrophobicContact CB-CE2 4.3Å; V55-F139 HydrophobicContact CG1-CD2 4.36Å; V55-F139 HydrophobicContact CG1-CE2 4.47Å; V55-F139 HydrophobicContact CG2-CD2 4.2Å; V55-F139 HydrophobicContact CG2-CE1 4.43Å; V55-F139 HydrophobicContact CG2-CE2 3.82Å; V55-F139 HydrophobicContact CG2-CZ 3.95Å; V55-L324 HydrophobicContact CG1-CD2 4.05Å
56	G	92	Very high	82.6	Confident	54 Å²	54	45.7 Å²	45.7	56%	0.557	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	84.1	8.3	-177.3	0	0	0	0	0	114.8	P54	P54-G56 VanDerWaalsContact C-N 3.28Å; P54-G56 PolarHBondContact O-N 3.34Å
57	F	92.6	Very high	83.4	Confident	68 Å²	68	46.6 Å²	46.6	30%	0.298	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	152.8	175.2	-66.4	-94.1	0	0	0	110.9	I38 V55 H61 P137 F139	I38-F57 PolarHBondContact N-O 3.06Å; V55-F57 HydrophobicContact CG2-CB 4.09Å; V55-F57 HydrophobicContact CG2-CD2 4.25Å; V55-F57 WeakPolarHBondContact O-CD2 3.47Å; F57-H61 HydrophobicContact CD1-CB 4.22Å; F57-P137 HydrophobicContact CD1-CB 4.28Å; F57-P137 HydrophobicContact CD1-CG 3.93Å; F57-P137 HydrophobicContact CE1-CB 3.82Å; F57-P137 HydrophobicContact CE1-CG 3.75Å; F57-P137 HydrophobicContact CE2-CB 4.34Å; F57-P137 HydrophobicContact CZ-CB 3.85Å; F57-P137 HydrophobicContact CZ-CG 4.32Å; F57-F139 HydrophobicContact CB-CE1 3.8Å; F57-F139 HydrophobicContact CB-CZ 4.11Å; F57-F139 HydrophobicContact CD1-CE1 4.12Å; F57-F139 AromaticContact CD2-CD1 3.34Å; F57-F139 HydrophobicContact CD2-CD1 3.34Å; F57-F139 AromaticContact CD2-CE1 3.24Å; F57-F139 HydrophobicContact CD2-CE1 3.24Å; F57-F139 HydrophobicContact CD2-CG 4.33Å; F57-F139 HydrophobicContact CD2-CZ 4.17Å; F57-F139 AromaticContact CE2-CD1 3.46Å; F57-F139 HydrophobicContact CE2-CD1 3.46Å; F57-F139 VanDerWaalsContact CE2-CD1 3.46Å; F57-F139 AromaticContact CE2-CE1 3.8Å; F57-F139 HydrophobicContact CE2-CE1 3.8Å; F57-F139 HydrophobicContact CE2-CG 4.46Å; F57-F139 HydrophobicContact CG-CD1 4.02Å; F57-F139 AromaticContact CG-CE1 3.44Å; F57-F139 HydrophobicContact CG-CE1 3.44Å; F57-F139 VanDerWaalsContact CG-CE1 3.44Å; F57-F139 HydrophobicContact CG-CZ 4.25Å; F57-F139 HydrophobicContact CZ-CD1 4.21Å; F57-F139 HydrophobicContact CZ-CE1 4.43Å
58	T	92.3	Very high	84.3	Confident	27 Å²	27	48.9 Å²	48.9	17%	0.166	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	159.9	170.2	68.1	0	0	0	0	109.3	F36 L60 H61	F36-T58 CarbonylContact O-C 3.52Å; F36-T58 VanDerWaalsContact O-CA 3.23Å; F36-T58 WeakPolarHBondContact O-CA 3.35Å; T58-L60 PolarHBondContact O-N 2.95Å; T58-L60 PolarHBondContact OG1-N 2.8Å; T58-H61 PolarHBondContact N-ND1 2.84Å; T58-H61 WeakPolarHBondContact O-CB 3.37Å; T58-H61 PolarHBondContact O-N 2.89Å; T58-H61 VanDerWaalsContact O-N 3.08Å; T58-H61 PolarHBondContact OG1-N 2.9Å; T58-H61 PolarHBondContact OG1-ND1 2.91Å
59	L	90.9	Very high	85.2	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-54	-39.2	172.3	179.2	60.6	0	0	0	111.1	F36 H61 L62 L63 L127 V152 L214 I223	F36-L59 HydrophobicContact CB-CB 4.47Å; F36-L59 PolarHBondContact O-N 3.28Å; L59-H61 PolarHBondContact O-N 3.09Å; L59-L62 WeakPolarHBondContact O-CB 3.49Å; L59-L62 PolarHBondContact O-N 3.23Å; L59-L63 HydrophobicContact CD1-CD2 4.22Å; L59-L63 HydrophobicContact CG-CD1 4.27Å; L59-L63 HydrophobicContact CG-CG 4.47Å; L59-L63 WeakPolarHBondContact O-CG 3.34Å; L59-L127 HydrophobicContact CD2-CD1 4.22Å; L59-V152 HydrophobicContact CB-CG2 4.01Å; L59-V152 HydrophobicContact CD2-CG2 4.26Å; L59-L214 HydrophobicContact CD1-CD1 3.93Å; L59-L214 HydrophobicContact CD1-CD2 4.41Å; L59-I223 HydrophobicContact CD2-CD1 3.7Å; L59-I223 HydrophobicContact CD2-CG1 4.35Å
60	L	89	Confident	85.9	Confident	56 Å²	56	46.4 Å²	46.4	29%	0.293	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-62.3	-28.8	-179.5	-56.6	178.4	0	0	0	112.9	F36 T58 L62 V69	F36-L60 HydrophobicContact CD2-CD1 4.31Å; T58-L60 PolarHBondContact O-N 2.95Å; T58-L60 PolarHBondContact OG1-N 2.8Å; L60-L62 PolarHBondContact O-N 2.64Å; L60-V69 HydrophobicContact CD1-CG1 3.96Å; L60-V69 HydrophobicContact CD1-CG2 3.91Å; L60-V69 HydrophobicContact CD2-CG2 4.31Å
61	H	90.1	Very high	86.4	Confident	107 Å²	107	52 Å²	52	50%	0.495	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-72.6	-10.8	174.2	-61	151.3	0	0	0	113.7	F57 T58 L59 L133	F57-H61 HydrophobicContact CD1-CB 4.22Å; T58-H61 PolarHBondContact N-ND1 2.84Å; T58-H61 WeakPolarHBondContact O-CB 3.37Å; T58-H61 PolarHBondContact O-N 2.89Å; T58-H61 VanDerWaalsContact O-N 3.08Å; T58-H61 PolarHBondContact OG1-N 2.9Å; T58-H61 PolarHBondContact OG1-ND1 2.91Å; L59-H61 PolarHBondContact O-N 3.09Å; H61-L133 WeakPolarHBondContact O-CD1 3.23Å
62	L	89.7	Confident	86.8	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-99.6	-16.8	179	-57	-169.6	0	0	0	113.5	I38 L59 L60 L132 L133 L136 P137 F139 M140	I38-L62 HydrophobicContact CD1-CD1 3.29Å; I38-L62 HydrophobicContact CD1-CG 3.78Å; L59-L62 WeakPolarHBondContact O-CB 3.49Å; L59-L62 PolarHBondContact O-N 3.23Å; L60-L62 PolarHBondContact O-N 2.64Å; L62-L132 HydrophobicContact CB-CD2 4.06Å; L62-L132 CarbonylContact O-C 3.57Å; L62-L132 WeakPolarHBondContact O-CA 3.44Å; L62-L132 WeakPolarHBondContact O-CD2 3.23Å; L62-L133 PolarHBondContact O-N 2.66Å; L62-L136 HydrophobicContact CB-CD2 4.47Å; L62-L136 HydrophobicContact CD2-CD2 4.27Å; L62-P137 HydrophobicContact CD2-CG 3.75Å; L62-F139 HydrophobicContact CD1-CZ 4.45Å; L62-F139 HydrophobicContact CD2-CE1 4.2Å; L62-F139 HydrophobicContact CD2-CZ 4.12Å; L62-M140 HydrophobicContact CD1-CE 4.39Å; L62-M140 HydrophobicContact CD1-SD 4.02Å; L62-M140 HydrophobicContact CD2-CG 4.37Å
63	L	88.7	Confident	86.9	Confident	6 Å²	6	57.1 Å²	57.1	3%	0.031	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-95.3	157.1	-174.3	-50.5	-176.1	0	0	0	111.5	L59 I67 L127 R130 L132 L133 C221	L59-L63 HydrophobicContact CD1-CD2 4.22Å; L59-L63 HydrophobicContact CG-CD1 4.27Å; L59-L63 HydrophobicContact CG-CG 4.47Å; L59-L63 WeakPolarHBondContact O-CG 3.34Å; L63-I67 HydrophobicContact CB-CD1 3.46Å; L63-I67 VanDerWaalsContact CB-CD1 3.46Å; L63-I67 HydrophobicContact CD1-CD1 3.74Å; L63-I67 HydrophobicContact CG-CD1 4.22Å; L63-L127 HydrophobicContact CD1-CD2 4.27Å; L63-R130 HydrophobicContact CD1-CB 4.17Å; L63-R130 HydrophobicContact CD1-CG 4.45Å; L63-R130 HydrophobicContact CD2-CB 4.1Å; L63-L132 HydrophobicContact CD2-CD2 4.03Å; L63-L133 WeakPolarHBondContact O-CD2 3.48Å; L63-L133 WeakPolarHBondContact O-CG 3.44Å; L63-C221 HydrophobicContact CD2-CB 4.35Å; L63-C221 WeakPolarHBondContact CD2-SG 3.5Å
64	E	85.9	Confident	87	Confident	75 Å²	75	60.9 Å²	60.9	35%	0.35	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-56.8	144.9	170.4	-73.3	-179	166.9	0	0	112.1	I67 K131	E64-I67 VanDerWaalsContact O-CD1 3.23Å; E64-I67 WeakPolarHBondContact O-CD1 3.43Å; E64-I67 WeakPolarHBondContact O-CG1 3.27Å; E64-K131 HydrophobicContact CG-CB 4.37Å; E64-K131 HydrophobicContact CG-CG 4.43Å; E64-K131 PolarHBondContact N-O 2.89Å; E64-K131 VanDerWaalsContact OE1-CD 3.24Å; E64-K131 WeakPolarHBondContact OE1-CD 3.39Å; E64-K131 WeakPolarHBondContact OE1-CG 3.49Å; E64-K131 IonicContact OE1-NZ 3.05Å; E64-K131 PolarHBondContact OE1-NZ 3.06Å
65	P	74.7	Confident	87	Confident	98 Å²	98	62.8 Å²	62.8	64%	0.636	36%	0.355	S	S	*	.	S	Bend	trans	-65.6	162.1	179.6	26.7	-33.5	0	0	0	112.3
66	N	75.3	Confident	87	Confident	161 Å²	161	65.9 Å²	65.9	86%	0.861	38%	0.382	S	S	*	.			trans	79	23.2	-179.5	-46.1	-56.4	0	0	0	116.3
67	I	72	Confident	87.1	Confident	31 Å²	31	66.3 Å²	66.3	16%	0.159	38%	0.375	C	S	.	.			trans	-85.3	128.8	171.8	-59.4	170.2	0	0	0	108.8	L63 E64 V69 L127 R130	L63-I67 HydrophobicContact CB-CD1 3.46Å; L63-I67 VanDerWaalsContact CB-CD1 3.46Å; L63-I67 HydrophobicContact CD1-CD1 3.74Å; L63-I67 HydrophobicContact CG-CD1 4.22Å; E64-I67 VanDerWaalsContact O-CD1 3.23Å; E64-I67 WeakPolarHBondContact O-CD1 3.43Å; E64-I67 WeakPolarHBondContact O-CG1 3.27Å; I67-V69 PolarHBondContact O-N 2.9Å; I67-V69 VanDerWaalsContact O-N 3.1Å; I67-L127 HydrophobicContact CG2-CD2 3.84Å; I67-R130 HydrophobicContact CD1-CB 4.34Å; I67-R130 HydrophobicContact CD1-CG 4.22Å
68	P	75.3	Confident	87.2	Confident	95 Å²	95	66 Å²	66	62%	0.617	38%	0.376	S	S	*	.			trans	-62.5	115.5	170.7	23.8	-29.9	0	0	0	108.9	P70	P68-P70 WeakPolarHBondContact O-CD 3.29Å
69	V	81.4	Confident	87.3	Confident	82 Å²	82	69.2 Å²	69.2	50%	0.497	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-69.9	123.8	177.9	-179.1	0	0	0	0	108.1	F36 L60 I67 E71	F36-V69 HydrophobicContact CE2-CG1 4.16Å; L60-V69 HydrophobicContact CD1-CG1 3.96Å; L60-V69 HydrophobicContact CD1-CG2 3.91Å; L60-V69 HydrophobicContact CD2-CG2 4.31Å; I67-V69 PolarHBondContact O-N 2.9Å; I67-V69 VanDerWaalsContact O-N 3.1Å; V69-E71 PolarHBondContact O-N 3.22Å
70	P	84.2	Confident	87.3	Confident	12 Å²	12	70 Å²	70	8%	0.078	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-64.2	131.1	-179.2	-18.2	29.7	0	0	0	111	P68 I119 K123 S126 L127	P68-P70 WeakPolarHBondContact O-CD 3.29Å; P70-I119 HydrophobicContact CB-CD1 4.41Å; P70-I119 HydrophobicContact CB-CG2 4.22Å; P70-K123 HydrophobicContact CB-CB 4.08Å; P70-S126 WeakPolarHBondContact CG-OG 3.43Å; P70-L127 HydrophobicContact CG-CD1 4.07Å; P70-L127 HydrophobicContact CG-CD2 4.3Å; P70-L127 HydrophobicContact CG-CG 4.03Å
71	E	87.2	Confident	87.2	Confident	156 Å²	156	73.4 Å²	73.4	73%	0.729	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-69.1	126.5	177.5	-71.8	-174.5	172.7	0	0	111.1	V69 K123	V69-E71 PolarHBondContact O-N 3.22Å; E71-K123 WeakPolarHBondContact O-CD 3.43Å; E71-K123 PolarHBondContact O-NZ 2.81Å
72	P	91.8	Very high	86.9	Confident	61 Å²	61	70 Å²	70	40%	0.396	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-68.9	143.2	178.6	28	-33.2	0	0	0	112.4	L35 S118 I119	L35-P72 HydrophobicContact CD1-CB 3.63Å; L35-P72 HydrophobicContact CD1-CG 4.47Å; P72-S118 WeakPolarHBondContact CA-O 3.42Å; P72-I119 HydrophobicContact CB-CD1 3.84Å
73	E	92.9	Very high	86.6	Confident	96 Å²	96	75 Å²	75	45%	0.449	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	130.5	166.2	-66.4	-176	-176	0	0	109	K117 S118 P120 K123	E73-K117 WeakPolarHBondContact O-CA 3.26Å; E73-S118 PolarHBondContact N-O 3.49Å; E73-S118 PolarHBondContact O-N 3.34Å; E73-P120 HydrophobicContact CG-CG 3.94Å; E73-P120 WeakPolarHBondContact OE1-CG 3.29Å; E73-P120 WeakPolarHBondContact OE2-CG 3.16Å; E73-K123 IonicContact OE1-NZ 2.71Å
74	V	94.4	Very high	85.7	Confident	80 Å²	80	77.1 Å²	77.1	49%	0.485	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.3	-175.1	-175.3	0	0	0	0	108.4	Q115 S116 K117	V74-Q115 HydrophobicContact CG1-CG 3.62Å; V74-S116 WeakPolarHBondContact CA-O 3.16Å; V74-K117 HydrophobicContact CG2-CG 4.33Å
75	S	93.1	Very high	84.7	Confident	41 Å²	41	78.3 Å²	78.3	29%	0.287	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-75.3	165.2	178.8	77.6	0	0	0	0	112	Q115 S116	S75-Q115 WeakPolarHBondContact O-CG 3.2Å; S75-Q115 PolarHBondContact O-NE2 2.9Å; S75-S116 PolarHBondContact N-O 2.99Å; S75-S116 PolarHBondContact OG-N 3.13Å
76	A	93.6	Very high	83.7	Confident	77 Å²	77	78.9 Å²	78.9	64%	0.636	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-60.4	148.5	160.7	0	0	0	0	0	110
77	P	94.3	Very high	82.5	Confident	64 Å²	64	79.6 Å²	79.6	42%	0.416	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-60.7	138.7	172.8	-21.7	32.9	0	0	0	111.9	E113 T160	P77-E113 VanDerWaalsContact CB-CD 3.47Å; P77-E113 HydrophobicContact CB-CG 3.55Å; P77-T160 HydrophobicContact CB-CG2 4.36Å
78	I	94.2	Very high	81.1	Confident	60 Å²	60	83.3 Å²	83.3	31%	0.308	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	110.8	-178.4	-55.1	172.3	0	0	0	107.9	L16 L80 E113 V114	L16-I78 HydrophobicContact CD2-CD1 4.25Å; I78-L80 HydrophobicContact CG2-CD2 4.07Å; I78-L80 HydrophobicContact CG2-CG 4.33Å; I78-E113 WeakPolarHBondContact O-CA 3.48Å; I78-V114 HydrophobicContact CB-CG2 4.11Å; I78-V114 PolarHBondContact N-O 3.28Å; I78-V114 PolarHBondContact O-N 3.06Å
79	P	93.7	Very high	79.3	Confident	95 Å²	95	85.6 Å²	85.6	62%	0.617	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	130.9	173.7	29.8	-32.6	0	0	0	110
80	L	90.8	Very high	77.2	Confident	18 Å²	18	83.8 Å²	83.8	9%	0.094	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.1	177.6	-63.3	176.8	0	0	0	109.2	V12 K15 L16 I78 Y110 I112 V114	V12-L80 HydrophobicContact CB-CD1 4.38Å; V12-L80 HydrophobicContact CG1-CD1 3.82Å; V12-L80 HydrophobicContact CG2-CD1 4.05Å; K15-L80 HydrophobicContact CB-CD2 4.27Å; K15-L80 HydrophobicContact CD-CD2 4.44Å; L16-L80 HydrophobicContact CD2-CD1 4.39Å; I78-L80 HydrophobicContact CG2-CD2 4.07Å; I78-L80 HydrophobicContact CG2-CG 4.33Å; L80-Y110 HydrophobicContact CB-CE2 4Å; L80-I112 HydrophobicContact CB-CG1 3.98Å; L80-I112 PolarHBondContact N-O 3.12Å; L80-I112 PolarHBondContact O-N 3.24Å; L80-I112 VanDerWaalsContact O-O 3.08Å; L80-V114 HydrophobicContact CD1-CG1 4.38Å; L80-V114 HydrophobicContact CD1-CG2 3.67Å; L80-V114 HydrophobicContact CG-CG2 4.27Å
81	K	88.2	Confident	74.7	Confident	126 Å²	126	90.1 Å²	90.1	55%	0.548	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.3	178	-168.2	172.1	-172.7	137.5	0	111	K15 Y110 D111	K15-K81 PolarHBondContact NZ-O 3.49Å; K81-Y110 WeakPolarHBondContact CA-O 3.28Å; K81-D111 WeakPolarHBondContact CD-OD2 3.34Å; K81-D111 WeakPolarHBondContact CE-OD2 3.47Å; K81-D111 HydrophobicContact CG-CB 4.45Å; K81-D111 IonicContact NZ-OD2 3.32Å; K81-D111 PolarHBondContact NZ-OD2 3.42Å
82	H	84.4	Confident	72.2	Confident	37 Å²	37	88.1 Å²	88.1	17%	0.171	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	135.2	170.6	-157.7	125.6	0	0	0	108.8	D11 K15 I84 G109 Y110	D11-H82 VanDerWaalsContact CG-ND1 3.29Å; D11-H82 IonicContact OD1-CE1 2.77Å; D11-H82 PolarHBondContact OD1-CE1 3.4Å; D11-H82 IonicContact OD1-ND1 2.62Å; D11-H82 PolarHBondContact OD1-ND1 3.3Å; D11-H82 IonicContact OD2-CE1 3.16Å; D11-H82 IonicContact OD2-CG 3.64Å; D11-H82 IonicContact OD2-ND1 2.67Å; D11-H82 PolarHBondContact OD2-ND1 3.3Å; K15-H82 WeakPolarHBondContact CE-ND1 3.4Å; H82-I84 WeakPolarHBondContact CD2-CG1 3.05Å; H82-I84 VanDerWaalsContact NE2-CD1 3.28Å; H82-I84 WeakPolarHBondContact NE2-CD1 3.45Å; H82-I84 WeakPolarHBondContact NE2-CG1 3.09Å; H82-G109 CarbonylContact O-C 3.58Å; H82-G109 WeakPolarHBondContact O-CA 3.5Å; H82-Y110 HydrophobicContact CB-CD1 3.65Å; H82-Y110 HydrophobicContact CB-CE1 3.28Å; H82-Y110 HydrophobicContact CB-CE2 4.3Å; H82-Y110 HydrophobicContact CB-CG 4.33Å; H82-Y110 PolarHBondContact N-O 3.46Å; H82-Y110 PolarHBondContact O-N 2.93Å
83	T	81.5	Confident	69.2	Low	105 Å²	105	93 Å²	93	64%	0.644	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.5	118.5	170	-52.2	0	0	0	0	108.2	C108	T83-C108 CarbonylContact C-O 3.49Å; T83-C108 WeakPolarHBondContact CA-O 3.47Å
84	I	70.3	Confident	66.2	Low	50 Å²	50	93 Å²	93	26%	0.256	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	131.6	171.5	-54.3	-175	0	0	0	107.1	W7 H82 S107 C108	W7-I84 HydrophobicContact CZ2-CD1 4.23Å; H82-I84 WeakPolarHBondContact CD2-CG1 3.05Å; H82-I84 VanDerWaalsContact NE2-CD1 3.28Å; H82-I84 WeakPolarHBondContact NE2-CD1 3.45Å; H82-I84 WeakPolarHBondContact NE2-CG1 3.09Å; I84-S107 CarbonylContact O-C 3.58Å; I84-S107 VanDerWaalsContact O-CA 3.23Å; I84-S107 WeakPolarHBondContact O-CA 3.27Å; I84-C108 PolarHBondContact N-O 2.86Å; I84-C108 PolarHBondContact O-N 3.3Å
85	S	66.4	Low	62.9	Low	100 Å²	100	97.9 Å²	97.9	70%	0.699	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.3	115	163.3	58.4	0	0	0	0	107.8	K106	S85-K106 CarbonylContact C-O 3.12Å; S85-K106 WeakPolarHBondContact CA-O 3.49Å
86	Q	51.8	Low	59.8	Low	110 Å²	110	101.4 Å²	101.4	51%	0.514	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114	124.1	176.9	-115.1	175.9	-8.2	0	0	108.4	V105 K106	Q86-V105 WeakPolarHBondContact O-CA 3.04Å; Q86-K106 PolarHBondContact N-O 3.22Å; Q86-K106 PolarHBondContact O-N 3.49Å
87	K	51.6	Low	56.7	Low	176 Å²	176	105.6 Å²	105.6	77%	0.765	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-122.6	112.4	175.3	-128.7	177.6	-176.2	178.9	0	107.3	F104 V105	K87-F104 WeakPolarHBondContact CA-O 3.36Å; K87-V105 HydrophobicContact CD-CG2 4.28Å; K87-V105 HydrophobicContact CG-CB 4.33Å; K87-V105 HydrophobicContact CG-CG1 4.14Å; K87-V105 HydrophobicContact CG-CG2 3.64Å
88	L	41.9	Very low	53.7	Low	108 Å²	108	107.1 Å²	107.1	57%	0.565	58%	0.581	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.5	111.4	173.8	-111.3	147	0	0	0	107.1	G103 F104	L88-G103 WeakPolarHBondContact O-CA 2.93Å; L88-F104 HydrophobicContact CB-CB 4.2Å; L88-F104 PolarHBondContact N-O 3.32Å; L88-F104 PolarHBondContact O-N 3.39Å
89	K	37.3	Very low	50.5	Low	144 Å²	144	108.8 Å²	108.8	63%	0.626	61%	0.613	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.7	112.9	166.9	-110.3	-170.6	167	-138.3	0	106.4	E101	K89-E101 WeakPolarHBondContact CE-OE1 3.35Å; K89-E101 IonicContact NZ-OE1 2.56Å; K89-E101 PolarHBondContact NZ-OE1 3Å
90	A	37.6	Very low	47.5	Very low	44 Å²	44	106.7 Å²	106.7	36%	0.364	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88	106	165.7	0	0	0	0	0	107.4	L92 A102	A90-L92 HydrophobicContact CB-CD1 4.19Å; A90-L92 HydrophobicContact CB-CG 4.31Å; A90-L92 PolarHBondContact O-N 3.02Å; A90-A102 PolarHBondContact N-O 3.39Å
91	D	31.9	Very low	44.7	Very low	145 Å²	145	112.3 Å²	112.3	78%	0.775	63%	0.634	S	S	*	*			trans	-72	80.9	162.9	-78.9	-22.3	0	0	0	107.1	D93	D91-D93 PolarHBondContact O-N 3.49Å
92	L	34.4	Very low	42.3	Very low	113 Å²	113	108.6 Å²	108.6	59%	0.592	63%	0.627	S	S	*	*			trans	-86.6	94.6	170.2	-85.7	161.7	0	0	0	107.7	A90 V94	A90-L92 HydrophobicContact CB-CD1 4.19Å; A90-L92 HydrophobicContact CB-CG 4.31Å; A90-L92 PolarHBondContact O-N 3.02Å; L92-V94 HydrophobicContact CB-CG2 4.2Å; L92-V94 HydrophobicContact CD2-CG2 4.04Å; L92-V94 PolarHBondContact O-N 3.39Å
93	D	28.1	Very low	40.1	Very low	165 Å²	165	108 Å²	108	88%	0.882	63%	0.631	S	S	*	*			trans	-70.4	76.8	164.8	-148.3	14.4	0	0	0	107.8	D91	D91-D93 PolarHBondContact O-N 3.49Å
94	V	30.4	Very low	38.2	Very low	96 Å²	96	105.7 Å²	105.7	58%	0.582	61%	0.612	S	S	*	*			trans	-116.2	89.7	172.6	-174	0	0	0	0	107.5	L92 T96	L92-V94 HydrophobicContact CB-CG2 4.2Å; L92-V94 HydrophobicContact CD2-CG2 4.04Å; L92-V94 PolarHBondContact O-N 3.39Å; V94-T96 PolarHBondContact O-N 3.13Å
95	E	26.3	Very low	37.1	Very low	181 Å²	181	106.1 Å²	106.1	85%	0.846	62%	0.617	S	S	*	*			trans	-60.2	87.3	155.3	-75.8	-172.4	151.3	0	0	108
96	T	27.1	Very low	36.7	Very low	115 Å²	115	102.6 Å²	102.6	71%	0.706	59%	0.589	S	S	*	*	S	Bend	trans	177.9	116	142.3	26.3	0	0	0	0	111	V94	V94-T96 PolarHBondContact O-N 3.13Å
97	I	27.9	Very low	37.1	Very low	165 Å²	165	99.6 Å²	99.6	85%	0.846	58%	0.58	S	S	*	*	S	Bend	trans	76.4	90.6	164.8	-43.7	173.7	0	0	0	115.5
98	A	31.9	Very low	38	Very low	97 Å²	97	91.6 Å²	91.6	80%	0.802	55%	0.546	S	S	*	.	S	Bend	trans	67.4	91.1	166.8	0	0	0	0	0	115.7	G100	A98-G100 PolarHBondContact O-N 3.38Å
99	G	27.4	Very low	39.6	Very low	94 Å²	94	87.3 Å²	87.3	97%	0.969	53%	0.528	S	S	*	.			trans	-49.3	119.4	176.5	0	0	0	0	0	113.5
100	G	29.5	Very low	42	Very low	52 Å²	52	80.8 Å²	80.8	54%	0.536	50%	0.5	S	S	.	.			trans	-138.6	117	165.5	0	0	0	0	0	108.6	A98 A102	A98-G100 PolarHBondContact O-N 3.38Å; G100-A102 PolarHBondContact O-N 3.1Å; G100-A102 VanDerWaalsContact O-N 3.14Å
101	E	31.9	Very low	44.5	Very low	135 Å²	135	83.2 Å²	83.2	63%	0.631	51%	0.506	S	S	*	.			trans	-59.5	113.6	165.7	-84.6	-176.5	137.1	0	0	108.4	K89 G103	K89-E101 WeakPolarHBondContact CE-OE1 3.35Å; K89-E101 IonicContact NZ-OE1 2.56Å; K89-E101 PolarHBondContact NZ-OE1 3Å; E101-G103 PolarHBondContact O-N 3.19Å
102	A	38.5	Very low	47.4	Very low	48 Å²	48	76.5 Å²	76.5	40%	0.397	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	94.1	166.1	0	0	0	0	0	107.9	A90 G100	A90-A102 PolarHBondContact N-O 3.39Å; G100-A102 PolarHBondContact O-N 3.1Å; G100-A102 VanDerWaalsContact O-N 3.14Å
103	G	37.5	Very low	50.3	Low	24 Å²	24	73.3 Å²	73.3	25%	0.247	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.9	176	0	0	0	0	0	110.6	L88 E101	L88-G103 WeakPolarHBondContact O-CA 2.93Å; E101-G103 PolarHBondContact O-N 3.19Å
104	F	42.8	Very low	53.5	Low	57 Å²	57	65.5 Å²	65.5	25%	0.25	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.9	173.3	-179.3	-106.3	0	0	0	109.4	K87 L88 K106	K87-F104 WeakPolarHBondContact CA-O 3.36Å; L88-F104 HydrophobicContact CB-CB 4.2Å; L88-F104 PolarHBondContact N-O 3.32Å; L88-F104 PolarHBondContact O-N 3.39Å; F104-K106 HydrophobicContact CD1-CB 4.28Å; F104-K106 HydrophobicContact CE1-CB 3.54Å; F104-K106 HydrophobicContact CE1-CD 3.9Å; F104-K106 HydrophobicContact CE1-CG 4.25Å; F104-K106 HydrophobicContact CZ-CB 3.77Å; F104-K106 HydrophobicContact CZ-CD 3.65Å; F104-K106 HydrophobicContact CZ-CG 4.05Å
105	V	46.9	Very low	56.6	Low	60 Å²	60	63.4 Å²	63.4	36%	0.364	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	120.9	173.7	-173.8	0	0	0	0	108.2	Q86 K87 N170	Q86-V105 WeakPolarHBondContact O-CA 3.04Å; K87-V105 HydrophobicContact CD-CG2 4.28Å; K87-V105 HydrophobicContact CG-CB 4.33Å; K87-V105 HydrophobicContact CG-CG1 4.14Å; K87-V105 HydrophobicContact CG-CG2 3.64Å; V105-N170 PolarHBondContact N-O 3.07Å; V105-N170 PolarHBondContact O-N 2.66Å
106	K	57.1	Low	59.9	Low	26 Å²	26	55.2 Å²	55.2	11%	0.113	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.1	179.3	-159.5	-174.9	-162.1	144.8	0	109.4	M1 Y3 S85 Q86 F104	M1-K106 WeakPolarHBondContact O-CE 3Å; M1-K106 PolarHBondContact O-NZ 3.49Å; Y3-K106 HydrophobicContact CE2-CD 3.77Å; Y3-K106 HydrophobicContact CE2-CG 3.6Å; Y3-K106 VanDerWaalsContact CZ-CE 3.42Å; Y3-K106 WeakPolarHBondContact OH-CD 3.45Å; Y3-K106 WeakPolarHBondContact OH-CE 3.38Å; Y3-K106 VanDerWaalsContact OH-CG 3.27Å; Y3-K106 WeakPolarHBondContact OH-CG 3.28Å; S85-K106 CarbonylContact C-O 3.12Å; S85-K106 WeakPolarHBondContact CA-O 3.49Å; Q86-K106 PolarHBondContact N-O 3.22Å; Q86-K106 PolarHBondContact O-N 3.49Å; F104-K106 HydrophobicContact CD1-CB 4.28Å; F104-K106 HydrophobicContact CE1-CB 3.54Å; F104-K106 HydrophobicContact CE1-CD 3.9Å; F104-K106 HydrophobicContact CE1-CG 4.25Å; F104-K106 HydrophobicContact CZ-CB 3.77Å; F104-K106 HydrophobicContact CZ-CD 3.65Å; F104-K106 HydrophobicContact CZ-CG 4.05Å
107	S	61.2	Low	63.1	Low	47 Å²	47	52.5 Å²	52.5	33%	0.329	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	131.7	174.7	54.8	0	0	0	0	110.4	I84 T168	I84-S107 CarbonylContact O-C 3.58Å; I84-S107 VanDerWaalsContact O-CA 3.23Å; I84-S107 WeakPolarHBondContact O-CA 3.27Å; S107-T168 PolarHBondContact N-O 3.31Å; S107-T168 CarbonylContact O-C 3.55Å; S107-T168 PolarHBondContact O-N 3.41Å
108	C	69.4	Low	66.2	Low	8 Å²	8	45.9 Å²	45.9	5%	0.054	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	160.5	167.6	79.3	0	0	0	0	110.5	Y3 T83 I84	Y3-C108 HydrophobicContact CD1-CB 3.47Å; Y3-C108 VanDerWaalsContact CD1-CB 3.47Å; Y3-C108 WeakPolarHBondContact CD1-SG 3.48Å; Y3-C108 HydrophobicContact CD2-CB 3.56Å; Y3-C108 HydrophobicContact CE1-CB 3.41Å; Y3-C108 VanDerWaalsContact CE1-CB 3.41Å; Y3-C108 WeakPolarHBondContact CE1-SG 3.49Å; Y3-C108 HydrophobicContact CE2-CB 3.46Å; Y3-C108 VanDerWaalsContact CE2-CB 3.46Å; Y3-C108 HydrophobicContact CG-CB 3.53Å; T83-C108 CarbonylContact C-O 3.49Å; T83-C108 WeakPolarHBondContact CA-O 3.47Å; I84-C108 PolarHBondContact N-O 2.86Å; I84-C108 PolarHBondContact O-N 3.3Å
109	G	77.2	Confident	69	Low	18 Å²	18	41.6 Å²	41.6	19%	0.186	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	168.8	164.3	0	0	0	0	0	112	H82 E166	H82-G109 CarbonylContact O-C 3.58Å; H82-G109 WeakPolarHBondContact O-CA 3.5Å; G109-E166 PolarHBondContact N-O 3.11Å
110	Y	87.5	Confident	71.7	Confident	7 Å²	7	38.5 Å²	38.5	3%	0.027	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	151	166	66	-99.1	0	0	0	108.4	W7 L8 D11 V12 K15 L80 K81 H82 I112	W7-Y110 HydrophobicContact CH2-CD1 4.02Å; W7-Y110 HydrophobicContact CH2-CE1 4.04Å; W7-Y110 AromaticContact CZ3-CD1 3.82Å; W7-Y110 HydrophobicContact CZ3-CD1 3.82Å; W7-Y110 HydrophobicContact CZ3-CE1 4.09Å; L8-Y110 HydrophobicContact CD1-CD1 3.22Å; L8-Y110 HydrophobicContact CD1-CD2 3.74Å; L8-Y110 HydrophobicContact CD1-CE1 3.41Å; L8-Y110 VanDerWaalsContact CD1-CE1 3.41Å; L8-Y110 HydrophobicContact CD1-CE2 3.92Å; L8-Y110 HydrophobicContact CD1-CG 3.36Å; D11-Y110 HydrophobicContact CB-CE1 4.41Å; D11-Y110 VanDerWaalsContact OD2-CE1 3.31Å; D11-Y110 WeakPolarHBondContact OD2-CE1 3.43Å; D11-Y110 PolarHBondContact OD2-OH 2.81Å; V12-Y110 HydrophobicContact CG2-CE2 4.31Å; K15-Y110 VanDerWaalsContact CD-OH 3.29Å; K15-Y110 WeakPolarHBondContact CD-OH 3.42Å; K15-Y110 WeakPolarHBondContact CE-OH 3.14Å; L80-Y110 HydrophobicContact CB-CE2 4Å; K81-Y110 WeakPolarHBondContact CA-O 3.28Å; H82-Y110 HydrophobicContact CB-CD1 3.65Å; H82-Y110 HydrophobicContact CB-CE1 3.28Å; H82-Y110 HydrophobicContact CB-CE2 4.3Å; H82-Y110 HydrophobicContact CB-CG 4.33Å; H82-Y110 PolarHBondContact N-O 3.46Å; H82-Y110 PolarHBondContact O-N 2.93Å; Y110-I112 HydrophobicContact CD2-CB 4.31Å; Y110-I112 HydrophobicContact CD2-CD1 3.85Å; Y110-I112 HydrophobicContact CD2-CG1 3.69Å; Y110-I112 HydrophobicContact CD2-CG2 3.96Å; Y110-I112 HydrophobicContact CE2-CD1 3.81Å; Y110-I112 HydrophobicContact CE2-CG1 3.84Å; Y110-I112 HydrophobicContact CG-CG2 4.48Å
111	D	89.9	Confident	74.3	Confident	94 Å²	94	39.5 Å²	39.5	50%	0.503	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	99.1	171.4	-158.9	-25.9	0	0	0	105.7	K81	K81-D111 WeakPolarHBondContact CD-OD2 3.34Å; K81-D111 WeakPolarHBondContact CE-OD2 3.47Å; K81-D111 HydrophobicContact CG-CB 4.45Å; K81-D111 IonicContact NZ-OD2 3.32Å; K81-D111 PolarHBondContact NZ-OD2 3.42Å
112	I	93	Very high	76.7	Confident	5 Å²	5	37.5 Å²	37.5	3%	0.026	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	158	-172.4	71.3	-179.4	0	0	0	109.8	L8 V12 L80 Y110 V114 T163 L207	L8-I112 HydrophobicContact CD1-CD1 4.05Å; V12-I112 HydrophobicContact CG2-CD1 3.63Å; L80-I112 HydrophobicContact CB-CG1 3.98Å; L80-I112 PolarHBondContact N-O 3.12Å; L80-I112 PolarHBondContact O-N 3.24Å; L80-I112 VanDerWaalsContact O-O 3.08Å; Y110-I112 HydrophobicContact CD2-CB 4.31Å; Y110-I112 HydrophobicContact CD2-CD1 3.85Å; Y110-I112 HydrophobicContact CD2-CG1 3.69Å; Y110-I112 HydrophobicContact CD2-CG2 3.96Å; Y110-I112 HydrophobicContact CE2-CD1 3.81Å; Y110-I112 HydrophobicContact CE2-CG1 3.84Å; Y110-I112 HydrophobicContact CG-CG2 4.48Å; I112-V114 HydrophobicContact CD1-CG1 4.03Å; I112-V114 HydrophobicContact CG1-CG1 4.33Å; I112-T163 HydrophobicContact CG2-CG2 4.2Å; I112-L207 HydrophobicContact CD1-CD1 3.36Å
113	E	94.2	Very high	78.8	Confident	46 Å²	46	38.5 Å²	38.5	22%	0.215	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.8	172.7	-175.9	-172.9	86.2	0	0	107.9	P77 I78 V159 T160 K161	P77-E113 VanDerWaalsContact CB-CD 3.47Å; P77-E113 HydrophobicContact CB-CG 3.55Å; I78-E113 WeakPolarHBondContact O-CA 3.48Å; E113-V159 WeakPolarHBondContact O-CA 3.41Å; E113-T160 WeakPolarHBondContact CB-OG1 3.3Å; E113-T160 HydrophobicContact CG-CG2 4.27Å; E113-T160 WeakPolarHBondContact CG-OG1 3.3Å; E113-T160 PolarHBondContact O-N 3.28Å; E113-T160 PolarHBondContact O-OG1 3.24Å; E113-T160 WeakPolarHBondContact OE1-CB 3.1Å; E113-T160 PolarHBondContact OE1-OG1 2.91Å; E113-K161 WeakPolarHBondContact OE1-CE 3.47Å; E113-K161 IonicContact OE1-NZ 3.33Å; E113-K161 PolarHBondContact OE1-NZ 2.86Å; E113-K161 IonicContact OE2-NZ 2.77Å; E113-K161 PolarHBondContact OE2-NZ 2.71Å
114	V	95.3	Very high	81	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	147.3	-178.1	-61.5	0	0	0	0	110.8	L16 I78 L80 I112 Y157 E158 L207	L16-V114 HydrophobicContact CD2-CG2 4.47Å; I78-V114 HydrophobicContact CB-CG2 4.11Å; I78-V114 PolarHBondContact N-O 3.28Å; I78-V114 PolarHBondContact O-N 3.06Å; L80-V114 HydrophobicContact CD1-CG1 4.38Å; L80-V114 HydrophobicContact CD1-CG2 3.67Å; L80-V114 HydrophobicContact CG-CG2 4.27Å; I112-V114 HydrophobicContact CD1-CG1 4.03Å; I112-V114 HydrophobicContact CG1-CG1 4.33Å; V114-Y157 HydrophobicContact CG2-CD1 4.3Å; V114-E158 CarbonylContact C-O 3.55Å; V114-E158 VanDerWaalsContact CA-O 3.29Å; V114-E158 WeakPolarHBondContact CA-O 3.48Å; V114-L207 HydrophobicContact CG1-CD1 3.89Å
115	Q	95.7	Very high	82.8	Confident	53 Å²	53	41.2 Å²	41.2	25%	0.248	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	131.5	175.8	177.9	170.6	64.2	0	0	109.3	V74 S75 Y157 E158 T160	V74-Q115 HydrophobicContact CG1-CG 3.62Å; S75-Q115 WeakPolarHBondContact O-CG 3.2Å; S75-Q115 PolarHBondContact O-NE2 2.9Å; Q115-Y157 WeakPolarHBondContact O-CA 3.45Å; Q115-E158 PolarHBondContact N-O 2.75Å; Q115-E158 PolarHBondContact O-N 2.97Å; Q115-T160 HydrophobicContact CB-CG2 3.56Å
116	S	95.4	Very high	84.4	Confident	8 Å²	8	40.4 Å²	40.4	6%	0.056	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	132.6	174	-176.2	0	0	0	0	109.8	V74 S75 E155 A156	V74-S116 WeakPolarHBondContact CA-O 3.16Å; S75-S116 PolarHBondContact N-O 2.99Å; S75-S116 PolarHBondContact OG-N 3.13Å; S116-E155 PolarHBondContact OG-OE1 3.36Å; S116-A156 CarbonylContact C-O 3.49Å; S116-A156 WeakPolarHBondContact CA-O 3.48Å
117	K	94.9	Very high	85.7	Confident	58 Å²	58	39.2 Å²	39.2	25%	0.252	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	125.3	162	-59.6	-173.2	-169.5	153.5	0	108	L35 E73 V74 E155 A156 E158	L35-K117 HydrophobicContact CD1-CB 3.71Å; L35-K117 HydrophobicContact CG-CB 4.26Å; E73-K117 WeakPolarHBondContact O-CA 3.26Å; V74-K117 HydrophobicContact CG2-CG 4.33Å; K117-E155 CarbonylContact O-C 3.47Å; K117-E155 VanDerWaalsContact O-CA 3.3Å; K117-E155 WeakPolarHBondContact O-CA 3.41Å; K117-A156 PolarHBondContact N-O 3.16Å; K117-A156 PolarHBondContact O-N 2.99Å; K117-E158 WeakPolarHBondContact CD-OE1 3.03Å; K117-E158 WeakPolarHBondContact CE-OE1 3.27Å; K117-E158 WeakPolarHBondContact CE-OE2 3.23Å; K117-E158 IonicContact NZ-OE1 3.37Å; K117-E158 PolarHBondContact NZ-OE1 3.16Å; K117-E158 IonicContact NZ-OE2 2.77Å; K117-E158 PolarHBondContact NZ-OE2 3.28Å
118	S	94	Very high	86.8	Confident	27 Å²	27	38.9 Å²	38.9	19%	0.189	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154.3	-177.2	72	0	0	0	0	112.4	P72 E73 T154	P72-S118 WeakPolarHBondContact CA-O 3.42Å; E73-S118 PolarHBondContact N-O 3.49Å; E73-S118 PolarHBondContact O-N 3.34Å; S118-T154 WeakPolarHBondContact CA-O 3.47Å
119	I	89.7	Confident	87.4	Confident	6 Å²	6	43.7 Å²	43.7	3%	0.031	24%	0.235	C	C	.	.			trans	-112.9	108.5	167.8	-52.5	-74.2	0	0	0	107.6	L35 F36 P70 P72 K123 L124 T154	L35-I119 HydrophobicContact CD1-CD1 4.34Å; L35-I119 HydrophobicContact CD1-CG1 4.17Å; L35-I119 HydrophobicContact CD2-CG1 4.27Å; F36-I119 HydrophobicContact CE1-CD1 4.45Å; F36-I119 HydrophobicContact CE1-CG1 3.98Å; F36-I119 HydrophobicContact CE2-CD1 4.21Å; F36-I119 HydrophobicContact CE2-CG1 4.35Å; F36-I119 HydrophobicContact CZ-CD1 3.64Å; F36-I119 HydrophobicContact CZ-CG1 3.63Å; P70-I119 HydrophobicContact CB-CD1 4.41Å; P70-I119 HydrophobicContact CB-CG2 4.22Å; P72-I119 HydrophobicContact CB-CD1 3.84Å; I119-K123 HydrophobicContact CG2-CB 3.77Å; I119-L124 HydrophobicContact CB-CD2 4Å; I119-L124 HydrophobicContact CB-CG 4.22Å; I119-L124 HydrophobicContact CG2-CD2 3.65Å; I119-L124 HydrophobicContact CG2-CG 3.72Å; I119-T154 PolarHBondContact N-O 2.86Å
120	P	84.4	Confident	87.8	Confident	30 Å²	30	47.4 Å²	47.4	20%	0.195	24%	0.244	C	C	.	.			trans	-55.8	148.8	174.5	-22.5	27.2	0	0	0	112.7	E73 P122 K123 L124	E73-P120 HydrophobicContact CG-CG 3.94Å; E73-P120 WeakPolarHBondContact OE1-CG 3.29Å; E73-P120 WeakPolarHBondContact OE2-CG 3.16Å; P120-P122 VanDerWaalsContact C-CD 3.45Å; P120-P122 VanDerWaalsContact C-N 3.34Å; P120-K123 HydrophobicContact CG-CD 4.49Å; P120-K123 WeakPolarHBondContact O-CA 3.41Å; P120-K123 WeakPolarHBondContact O-CB 3.37Å; P120-K123 PolarHBondContact O-N 3.04Å; P120-L124 PolarHBondContact O-N 3.15Å; P120-L124 VanDerWaalsContact O-N 3.07Å
121	N	83.5	Confident	87.7	Confident	72 Å²	72	51.1 Å²	51.1	39%	0.385	26%	0.26	S	S	.	.	H	α-helix	trans	-50.5	-43.5	178.7	-68.8	-18.2	0	0	0	114	K123 L124 E125 Q212 T225	N121-K123 PolarHBondContact O-N 3.11Å; N121-L124 WeakPolarHBondContact O-CA 3.35Å; N121-L124 WeakPolarHBondContact O-CB 3.27Å; N121-L124 PolarHBondContact O-N 3.47Å; N121-E125 PolarHBondContact O-N 3.21Å; N121-E125 VanDerWaalsContact O-N 3.08Å; N121-Q212 PolarHBondContact OD1-NE2 2.87Å; N121-T225 HydrophobicContact CB-CG2 4.36Å
122	P	82.3	Confident	87.6	Confident	93 Å²	93	46.9 Å²	46.9	60%	0.604	24%	0.237	S	C	*	.	H	α-helix	trans	-61.2	-31.6	177.6	-24.3	34.8	0	0	0	113.6	P120 E125	P120-P122 VanDerWaalsContact C-CD 3.45Å; P120-P122 VanDerWaalsContact C-N 3.34Å; P122-E125 WeakPolarHBondContact O-CB 3.43Å
123	K	82.9	Confident	87.3	Confident	70 Å²	70	49.3 Å²	49.3	30%	0.304	25%	0.25	S	C	.	.	H	α-helix	trans	-76.4	-32.5	175.1	-71	-172.4	-176.1	168.3	0	111.6	P70 E71 E73 I119 P120 N121 E125 S126	P70-K123 HydrophobicContact CB-CB 4.08Å; E71-K123 WeakPolarHBondContact O-CD 3.43Å; E71-K123 PolarHBondContact O-NZ 2.81Å; E73-K123 IonicContact OE1-NZ 2.71Å; I119-K123 HydrophobicContact CG2-CB 3.77Å; P120-K123 HydrophobicContact CG-CD 4.49Å; P120-K123 WeakPolarHBondContact O-CA 3.41Å; P120-K123 WeakPolarHBondContact O-CB 3.37Å; P120-K123 PolarHBondContact O-N 3.04Å; N121-K123 PolarHBondContact O-N 3.11Å; K123-E125 VanDerWaalsContact C-N 3.25Å; K123-E125 PolarHBondContact O-N 3.22Å; K123-S126 WeakPolarHBondContact O-CB 3.24Å; K123-S126 PolarHBondContact O-N 3.2Å; K123-S126 PolarHBondContact O-OG 3.48Å
124	L	83	Confident	86.7	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-27.4	172.9	-69.5	171.9	0	0	0	112.5	I119 P120 N121 S126 L127 T154 I223	I119-L124 HydrophobicContact CB-CD2 4Å; I119-L124 HydrophobicContact CB-CG 4.22Å; I119-L124 HydrophobicContact CG2-CD2 3.65Å; I119-L124 HydrophobicContact CG2-CG 3.72Å; P120-L124 PolarHBondContact O-N 3.15Å; P120-L124 VanDerWaalsContact O-N 3.07Å; N121-L124 WeakPolarHBondContact O-CA 3.35Å; N121-L124 WeakPolarHBondContact O-CB 3.27Å; N121-L124 PolarHBondContact O-N 3.47Å; L124-S126 PolarHBondContact O-N 2.92Å; L124-L127 HydrophobicContact CD2-CD1 4.48Å; L124-L127 WeakPolarHBondContact O-CB 3.35Å; L124-L127 PolarHBondContact O-N 3.33Å; L124-T154 HydrophobicContact CD1-CG2 3.8Å; L124-T154 HydrophobicContact CD2-CG2 4.35Å; L124-I223 HydrophobicContact CD2-CD1 4.1Å
125	E	80.5	Confident	86.2	Confident	135 Å²	135	61.9 Å²	61.9	63%	0.631	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-56.3	-32.3	175.7	-70.5	178.7	-171.4	0	0	112.5	N121 P122 K123 L127 Q128	N121-E125 PolarHBondContact O-N 3.21Å; N121-E125 VanDerWaalsContact O-N 3.08Å; P122-E125 WeakPolarHBondContact O-CB 3.43Å; K123-E125 VanDerWaalsContact C-N 3.25Å; K123-E125 PolarHBondContact O-N 3.22Å; E125-L127 PolarHBondContact O-N 2.94Å; E125-Q128 WeakPolarHBondContact O-CB 3.47Å; E125-Q128 WeakPolarHBondContact O-CG 3.27Å; E125-Q128 PolarHBondContact O-N 3.33Å; E125-Q128 VanDerWaalsContact O-N 3.08Å
126	S	82.3	Confident	85.7	Confident	44 Å²	44	61.9 Å²	61.9	31%	0.308	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-63.8	-20	176.1	72.5	0	0	0	0	114	P70 K123 L124 R130	P70-S126 WeakPolarHBondContact CG-OG 3.43Å; K123-S126 WeakPolarHBondContact O-CB 3.24Å; K123-S126 PolarHBondContact O-N 3.2Å; K123-S126 PolarHBondContact O-OG 3.48Å; L124-S126 PolarHBondContact O-N 2.92Å; S126-R130 VanDerWaalsContact O-CZ 3.26Å; S126-R130 PolarHBondContact O-NE 3.25Å; S126-R130 PolarHBondContact O-NH2 3.45Å
127	L	83	Confident	85.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-97.5	-2.6	177.6	-59.4	179.3	0	0	0	112.9	F36 L59 L63 I67 P70 L124 E125 R130 C221 I223	F36-L127 HydrophobicContact CD1-CD1 4.32Å; F36-L127 HydrophobicContact CE1-CD1 3.7Å; F36-L127 HydrophobicContact CZ-CD1 4.46Å; L59-L127 HydrophobicContact CD2-CD1 4.22Å; L63-L127 HydrophobicContact CD1-CD2 4.27Å; I67-L127 HydrophobicContact CG2-CD2 3.84Å; P70-L127 HydrophobicContact CG-CD1 4.07Å; P70-L127 HydrophobicContact CG-CD2 4.3Å; P70-L127 HydrophobicContact CG-CG 4.03Å; L124-L127 HydrophobicContact CD2-CD1 4.48Å; L124-L127 WeakPolarHBondContact O-CB 3.35Å; L124-L127 PolarHBondContact O-N 3.33Å; E125-L127 PolarHBondContact O-N 2.94Å; L127-R130 VanDerWaalsContact O-CG 3.3Å; L127-R130 WeakPolarHBondContact O-CG 3.47Å; L127-C221 PolarHBondContact O-SG 2.7Å; L127-I223 HydrophobicContact CB-CD1 4.29Å
128	Q	84	Confident	84.9	Confident	41 Å²	41	65.3 Å²	65.3	19%	0.192	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	146.8	180	-60.9	-72	-9	0	0	111.7	E125 R130 V222 I223	E125-Q128 WeakPolarHBondContact O-CB 3.47Å; E125-Q128 WeakPolarHBondContact O-CG 3.27Å; E125-Q128 PolarHBondContact O-N 3.33Å; E125-Q128 VanDerWaalsContact O-N 3.08Å; Q128-R130 PolarHBondContact O-N 3.19Å; Q128-V222 VanDerWaalsContact OE1-CA 3.27Å; Q128-I223 PolarHBondContact NE2-O 3.4Å
129	N	83.5	Confident	84.7	Confident	109 Å²	109	65.1 Å²	65.1	58%	0.583	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	24.9	177.9	-53.6	-52.3	0	0	0	113.8	C221 V222	N129-C221 WeakPolarHBondContact CA-O 3.31Å; N129-C221 PolarHBondContact N-O 3.28Å; N129-V222 WeakPolarHBondContact OD1-CG2 3.47Å
130	R	84.1	Confident	84.6	Confident	96 Å²	96	65.1 Å²	65.1	36%	0.362	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	138.7	177.6	-66.7	-64.3	-177.5	177.9	-0.9	109.9	L63 I67 S126 L127 Q128 T220 C221	L63-R130 HydrophobicContact CD1-CB 4.17Å; L63-R130 HydrophobicContact CD1-CG 4.45Å; L63-R130 HydrophobicContact CD2-CB 4.1Å; I67-R130 HydrophobicContact CD1-CB 4.34Å; I67-R130 HydrophobicContact CD1-CG 4.22Å; S126-R130 VanDerWaalsContact O-CZ 3.26Å; S126-R130 PolarHBondContact O-NE 3.25Å; S126-R130 PolarHBondContact O-NH2 3.45Å; L127-R130 VanDerWaalsContact O-CG 3.3Å; L127-R130 WeakPolarHBondContact O-CG 3.47Å; Q128-R130 PolarHBondContact O-N 3.19Å; R130-T220 VanDerWaalsContact O-CA 3.23Å; R130-T220 WeakPolarHBondContact O-CA 3.12Å; R130-C221 PolarHBondContact O-N 3.39Å
131	K	86.6	Confident	84.5	Confident	85 Å²	85	70 Å²	70	37%	0.37	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	132.5	177.9	-174.1	162.4	174.5	-89.4	0	109.8	E64 D134 N219	E64-K131 HydrophobicContact CG-CB 4.37Å; E64-K131 HydrophobicContact CG-CG 4.43Å; E64-K131 PolarHBondContact N-O 2.89Å; E64-K131 VanDerWaalsContact OE1-CD 3.24Å; E64-K131 WeakPolarHBondContact OE1-CD 3.39Å; E64-K131 WeakPolarHBondContact OE1-CG 3.49Å; E64-K131 IonicContact OE1-NZ 3.05Å; E64-K131 PolarHBondContact OE1-NZ 3.06Å; K131-D134 IonicContact NZ-OD1 3.71Å; K131-D134 PolarHBondContact NZ-OD1 3.01Å; K131-N219 WeakPolarHBondContact CA-O 3.48Å
132	L	86.8	Confident	84.5	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.021	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-73.3	154.6	173.2	-67.2	179.1	0	0	0	110.5	L62 L63 L136 I216 N219 C221	L62-L132 HydrophobicContact CB-CD2 4.06Å; L62-L132 CarbonylContact O-C 3.57Å; L62-L132 WeakPolarHBondContact O-CA 3.44Å; L62-L132 WeakPolarHBondContact O-CD2 3.23Å; L63-L132 HydrophobicContact CD2-CD2 4.03Å; L132-L136 HydrophobicContact CB-CD2 4.17Å; L132-L136 HydrophobicContact CD1-CD1 4.18Å; L132-L136 HydrophobicContact CD1-CD2 4.46Å; L132-L136 HydrophobicContact CD2-CD2 4.5Å; L132-I216 HydrophobicContact CD1-CD1 4.17Å; L132-I216 HydrophobicContact CD1-CG1 4.26Å; L132-I216 HydrophobicContact CD1-CG2 3.54Å; L132-N219 WeakPolarHBondContact CB-O 3.39Å; L132-N219 PolarHBondContact N-O 3.38Å; L132-C221 HydrophobicContact CD2-CB 4.22Å
133	L	87.3	Confident	84.7	Confident	56 Å²	56	64.1 Å²	64.1	29%	0.293	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-57.2	140.4	170.9	-68.4	173.3	0	0	0	111	H61 L62 L63 Q135	H61-L133 WeakPolarHBondContact O-CD1 3.23Å; L62-L133 PolarHBondContact O-N 2.66Å; L63-L133 WeakPolarHBondContact O-CD2 3.48Å; L63-L133 WeakPolarHBondContact O-CG 3.44Å; L133-Q135 PolarHBondContact O-N 3.25Å
134	D	81.7	Confident	84.6	Confident	136 Å²	136	68.9 Å²	68.9	73%	0.727	34%	0.336	S	S	*	.	S	Bend	trans	-60.8	-32.7	176.2	-62.2	-25.8	0	0	0	111.4	K131	K131-D134 IonicContact NZ-OD1 3.71Å; K131-D134 PolarHBondContact NZ-OD1 3.01Å
135	Q	84.6	Confident	84.5	Confident	175 Å²	175	76.9 Å²	76.9	82%	0.818	37%	0.37	S	S	*	.	S	Bend	trans	-107.6	93.1	171.9	-66.4	-166.9	2.9	0	0	111	L133	L133-Q135 PolarHBondContact O-N 3.25Å
136	L	85.2	Confident	84.5	Confident	52 Å²	52	73.9 Å²	73.9	27%	0.272	36%	0.359	S	S	.	.			trans	-74.3	147.4	174.6	-73.1	170.6	0	0	0	112.2	L62 L132 M140	L62-L136 HydrophobicContact CB-CD2 4.47Å; L62-L136 HydrophobicContact CD2-CD2 4.27Å; L132-L136 HydrophobicContact CB-CD2 4.17Å; L132-L136 HydrophobicContact CD1-CD1 4.18Å; L132-L136 HydrophobicContact CD1-CD2 4.46Å; L132-L136 HydrophobicContact CD2-CD2 4.5Å; L136-M140 HydrophobicContact CB-CB 4.25Å; L136-M140 HydrophobicContact CB-CG 4.35Å; L136-M140 HydrophobicContact CD1-CE 4.3Å
137	P	87.3	Confident	84.5	Confident	25 Å²	25	73.6 Å²	73.6	16%	0.162	36%	0.363	C	S	.	.			trans	-53.9	150.2	171.2	-27	36.1	0	0	0	112.9	F57 L62 F139 M140	F57-P137 HydrophobicContact CD1-CB 4.28Å; F57-P137 HydrophobicContact CD1-CG 3.93Å; F57-P137 HydrophobicContact CE1-CB 3.82Å; F57-P137 HydrophobicContact CE1-CG 3.75Å; F57-P137 HydrophobicContact CE2-CB 4.34Å; F57-P137 HydrophobicContact CZ-CB 3.85Å; F57-P137 HydrophobicContact CZ-CG 4.32Å; L62-P137 HydrophobicContact CD2-CG 3.75Å; P137-F139 VanDerWaalsContact C-N 3.28Å; P137-F139 HydrophobicContact CB-CD1 3.52Å; P137-F139 HydrophobicContact CB-CE1 3.55Å; P137-F139 HydrophobicContact CG-CD1 4.42Å; P137-F139 HydrophobicContact CG-CE1 3.95Å; P137-F139 PolarHBondContact O-N 2.77Å; P137-M140 WeakPolarHBondContact O-CB 3.5Å; P137-M140 PolarHBondContact O-N 3.36Å; P137-M140 VanDerWaalsContact O-N 3.12Å
138	T	86.9	Confident	84.7	Confident	114 Å²	114	74.4 Å²	74.4	70%	0.699	37%	0.366	S	S	*	.	H	α-helix	trans	-58.8	-35.4	-174.7	47.7	0	0	0	0	113.6	M140 K141 T142	T138-M140 PolarHBondContact O-N 3.44Å; T138-M140 VanDerWaalsContact O-N 3.15Å; T138-K141 WeakPolarHBondContact O-CB 3.23Å; T138-K141 PolarHBondContact O-N 3.16Å; T138-T142 PolarHBondContact O-N 3.21Å
139	F	88.2	Confident	84.9	Confident	22 Å²	22	74.1 Å²	74.1	10%	0.096	37%	0.366	C	S	.	.	H	α-helix	trans	-58	-30.7	179.9	84	-91.2	0	0	0	112.6	I38 V55 F57 L62 P137 K141 T142 C143 L150	I38-F139 HydrophobicContact CD1-CZ 4.34Å; V55-F139 HydrophobicContact CB-CD2 4.2Å; V55-F139 HydrophobicContact CB-CE2 4.3Å; V55-F139 HydrophobicContact CG1-CD2 4.36Å; V55-F139 HydrophobicContact CG1-CE2 4.47Å; V55-F139 HydrophobicContact CG2-CD2 4.2Å; V55-F139 HydrophobicContact CG2-CE1 4.43Å; V55-F139 HydrophobicContact CG2-CE2 3.82Å; V55-F139 HydrophobicContact CG2-CZ 3.95Å; F57-F139 HydrophobicContact CB-CE1 3.8Å; F57-F139 HydrophobicContact CB-CZ 4.11Å; F57-F139 HydrophobicContact CD1-CE1 4.12Å; F57-F139 AromaticContact CD2-CD1 3.34Å; F57-F139 HydrophobicContact CD2-CD1 3.34Å; F57-F139 AromaticContact CD2-CE1 3.24Å; F57-F139 HydrophobicContact CD2-CE1 3.24Å; F57-F139 HydrophobicContact CD2-CG 4.33Å; F57-F139 HydrophobicContact CD2-CZ 4.17Å; F57-F139 AromaticContact CE2-CD1 3.46Å; F57-F139 HydrophobicContact CE2-CD1 3.46Å; F57-F139 VanDerWaalsContact CE2-CD1 3.46Å; F57-F139 AromaticContact CE2-CE1 3.8Å; F57-F139 HydrophobicContact CE2-CE1 3.8Å; F57-F139 HydrophobicContact CE2-CG 4.46Å; F57-F139 HydrophobicContact CG-CD1 4.02Å; F57-F139 AromaticContact CG-CE1 3.44Å; F57-F139 HydrophobicContact CG-CE1 3.44Å; F57-F139 VanDerWaalsContact CG-CE1 3.44Å; F57-F139 HydrophobicContact CG-CZ 4.25Å; F57-F139 HydrophobicContact CZ-CD1 4.21Å; F57-F139 HydrophobicContact CZ-CE1 4.43Å; L62-F139 HydrophobicContact CD1-CZ 4.45Å; L62-F139 HydrophobicContact CD2-CE1 4.2Å; L62-F139 HydrophobicContact CD2-CZ 4.12Å; P137-F139 VanDerWaalsContact C-N 3.28Å; P137-F139 HydrophobicContact CB-CD1 3.52Å; P137-F139 HydrophobicContact CB-CE1 3.55Å; P137-F139 HydrophobicContact CG-CD1 4.42Å; P137-F139 HydrophobicContact CG-CE1 3.95Å; P137-F139 PolarHBondContact O-N 2.77Å; F139-K141 VanDerWaalsContact C-N 3.32Å; F139-K141 PolarHBondContact O-N 2.9Å; F139-T142 WeakPolarHBondContact O-CB 3.18Å; F139-T142 PolarHBondContact O-N 3.02Å; F139-C143 PolarHBondContact O-N 3.31Å; F139-C143 PolarHBondContact O-SG 2.77Å; F139-L150 HydrophobicContact CE2-CD1 4.33Å
140	M	87.5	Confident	85.4	Confident	7 Å²	7	68.9 Å²	68.9	3%	0.034	34%	0.338	C	S	.	.	H	α-helix	trans	-63	-39.4	178.4	-73.7	-67	-71.2	0	0	112	L62 L136 P137 T138 T142 C143 W144 L150 I216 F235	L62-M140 HydrophobicContact CD1-CE 4.39Å; L62-M140 HydrophobicContact CD1-SD 4.02Å; L62-M140 HydrophobicContact CD2-CG 4.37Å; L136-M140 HydrophobicContact CB-CB 4.25Å; L136-M140 HydrophobicContact CB-CG 4.35Å; L136-M140 HydrophobicContact CD1-CE 4.3Å; P137-M140 WeakPolarHBondContact O-CB 3.5Å; P137-M140 PolarHBondContact O-N 3.36Å; P137-M140 VanDerWaalsContact O-N 3.12Å; T138-M140 PolarHBondContact O-N 3.44Å; T138-M140 VanDerWaalsContact O-N 3.15Å; M140-T142 VanDerWaalsContact C-N 3.31Å; M140-T142 PolarHBondContact O-N 3.35Å; M140-C143 PolarHBondContact O-N 3.48Å; M140-W144 WeakPolarHBondContact O-CB 3.49Å; M140-W144 PolarHBondContact O-N 3.37Å; M140-L150 HydrophobicContact CE-CD1 4.38Å; M140-L150 HydrophobicContact SD-CD1 3.62Å; M140-I216 HydrophobicContact CE-CD1 3.11Å; M140-I216 HydrophobicContact SD-CD1 4.49Å; M140-F235 HydrophobicContact CE-CE1 3.98Å; M140-F235 HydrophobicContact CE-CZ 3.97Å; M140-F235 HydrophobicContact SD-CZ 4.47Å
141	K	84	Confident	85.8	Confident	133 Å²	133	65.6 Å²	65.6	58%	0.578	33%	0.326	S	S	*	.	H	α-helix	trans	-65.8	-39.3	177.8	-64.1	-179.6	-179.5	176.7	0	110.9	T138 F139 K145	T138-K141 WeakPolarHBondContact O-CB 3.23Å; T138-K141 PolarHBondContact O-N 3.16Å; F139-K141 VanDerWaalsContact C-N 3.32Å; F139-K141 PolarHBondContact O-N 2.9Å; K141-K145 WeakPolarHBondContact O-CG 3.22Å; K141-K145 PolarHBondContact O-N 2.98Å
142	T	83.4	Confident	86.1	Confident	39 Å²	39	61.6 Å²	61.6	24%	0.239	31%	0.308	C	S	.	.	H	α-helix	trans	-65	-49.9	175.9	-52.4	0	0	0	0	111	T138 F139 M140 W144 K145 D146 N325	T138-T142 PolarHBondContact O-N 3.21Å; F139-T142 WeakPolarHBondContact O-CB 3.18Å; F139-T142 PolarHBondContact O-N 3.02Å; M140-T142 VanDerWaalsContact C-N 3.31Å; M140-T142 PolarHBondContact O-N 3.35Å; T142-W144 PolarHBondContact O-N 3.06Å; T142-K145 PolarHBondContact O-N 2.85Å; T142-D146 WeakPolarHBondContact O-CB 2.93Å; T142-D146 PolarHBondContact O-N 3.43Å; T142-N325 HydrophobicContact CG2-CB 3.66Å; T142-N325 WeakPolarHBondContact CG2-ND2 3.25Å
143	C	84.9	Confident	86.5	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.007	31%	0.307	C	S	.	.	H	α-helix	trans	-58.7	-39.6	178.1	-65.3	0	0	0	0	111.8	Q40 F139 M140 G147 K148 L150 F235	Q40-C143 PolarHBondContact OE1-SG 3.3Å; F139-C143 PolarHBondContact O-N 3.31Å; F139-C143 PolarHBondContact O-SG 2.77Å; M140-C143 PolarHBondContact O-N 3.48Å; C143-G147 PolarHBondContact O-N 2.67Å; C143-K148 HydrophobicContact CB-CB 4.11Å; C143-K148 PolarHBondContact O-N 3.45Å; C143-L150 HydrophobicContact CB-CD2 4.43Å; C143-F235 HydrophobicContact CB-CE2 3.81Å; C143-F235 HydrophobicContact CB-CZ 4.18Å
144	W	82.7	Confident	86.8	Confident	171 Å²	171	59.2 Å²	59.2	65%	0.648	30%	0.297	S	S	*	.	H	α-helix	trans	-64.6	-46.5	177	-179.9	44.2	0	0	0	112.5	M140 T142 D146 G147 F235	M140-W144 WeakPolarHBondContact O-CB 3.49Å; M140-W144 PolarHBondContact O-N 3.37Å; T142-W144 PolarHBondContact O-N 3.06Å; W144-D146 VanDerWaalsContact C-N 3.32Å; W144-D146 PolarHBondContact O-N 2.61Å; W144-G147 PolarHBondContact O-N 2.96Å; W144-F235 HydrophobicContact CB-CD1 4.24Å; W144-F235 HydrophobicContact CB-CD2 4.42Å; W144-F235 HydrophobicContact CB-CE1 4.22Å; W144-F235 HydrophobicContact CB-CE2 4.43Å; W144-F235 HydrophobicContact CB-CG 4.33Å; W144-F235 HydrophobicContact CB-CZ 4.32Å; W144-F235 AromaticContact CD1-CD1 3.82Å; W144-F235 AromaticContact CD1-CG 3.7Å; W144-F235 HydrophobicContact CG-CD1 4.28Å; W144-F235 HydrophobicContact CG-CG 4.38Å
145	K	80.7	Confident	87.4	Confident	170 Å²	170	54 Å²	54	74%	0.739	27%	0.268	S	S	*	.	H	α-helix	trans	-61	-41	176.9	-76.4	178.3	177.4	-173.3	0	112.4	K141 T142 G147	K141-K145 WeakPolarHBondContact O-CG 3.22Å; K141-K145 PolarHBondContact O-N 2.98Å; T142-K145 PolarHBondContact O-N 2.85Å; K145-G147 VanDerWaalsContact C-N 3.31Å
146	D	79.7	Confident	88	Confident	72 Å²	72	45.7 Å²	45.7	39%	0.385	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	0.7	-174.6	-65.8	-3.8	0	0	0	112.7	T142 W144 K148 N325	T142-D146 WeakPolarHBondContact O-CB 2.93Å; T142-D146 PolarHBondContact O-N 3.43Å; W144-D146 VanDerWaalsContact C-N 3.32Å; W144-D146 PolarHBondContact O-N 2.61Å; D146-K148 HydrophobicContact CB-CG 3.81Å; D146-K148 PolarHBondContact O-N 3.04Å; D146-N325 PolarHBondContact OD2-ND2 3.07Å
147	G	83	Confident	88.6	Confident	38 Å²	38	44.5 Å²	44.5	39%	0.392	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	27.1	-178.3	0	0	0	0	0	114	C143 W144 K145	C143-G147 PolarHBondContact O-N 2.67Å; W144-G147 PolarHBondContact O-N 2.96Å; K145-G147 VanDerWaalsContact C-N 3.31Å
148	K	85.6	Confident	89	Confident	16 Å²	16	44.4 Å²	44.4	7%	0.07	22%	0.218	C	C	.	.			trans	-74.5	136.4	-176	-62.7	-71.5	-174.6	169.3	0	111.2	Q40 S43 C143 D146 E323	Q40-K148 HydrophobicContact CG-CB 3.97Å; Q40-K148 HydrophobicContact CG-CD 4.43Å; Q40-K148 HydrophobicContact CG-CG 4.27Å; S43-K148 PolarHBondContact OG-NZ 2.89Å; C143-K148 HydrophobicContact CB-CB 4.11Å; C143-K148 PolarHBondContact O-N 3.45Å; D146-K148 HydrophobicContact CB-CG 3.81Å; D146-K148 PolarHBondContact O-N 3.04Å; K148-E323 IonicContact NZ-OE2 3.46Å; K148-E323 PolarHBondContact NZ-OE2 2.65Å
149	N	89.7	Confident	89.4	Confident	35 Å²	35	39 Å²	39	19%	0.187	19%	0.186	C	C	.	.			trans	-81.4	138.2	171.4	-69.3	-41.2	0	0	0	110.9	E41 Y151 Q213 M233 T234	E41-N149 HydrophobicContact CB-CB 4.24Å; E41-N149 PolarHBondContact N-O 2.8Å; E41-N149 PolarHBondContact OE2-ND2 3.35Å; N149-Y151 HydrophobicContact CB-CE2 3.75Å; N149-Q213 PolarHBondContact OD1-NE2 3.47Å; N149-M233 WeakPolarHBondContact OD1-CA 3.4Å; N149-T234 WeakPolarHBondContact CA-OG1 3.49Å; N149-T234 PolarHBondContact OD1-N 2.89Å
150	L	92.6	Very high	89.7	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	145.4	175.6	-58.9	177.6	0	0	0	110.1	I38 L39 Q40 F139 M140 C143 L214 T234 F235	I38-L150 HydrophobicContact CG2-CB 4.23Å; I38-L150 HydrophobicContact CG2-CD1 4.49Å; I38-L150 HydrophobicContact CG2-CD2 4.15Å; L39-L150 CarbonylContact O-C 3.59Å; L39-L150 WeakPolarHBondContact O-CA 3.34Å; Q40-L150 HydrophobicContact CB-CD2 4.11Å; Q40-L150 HydrophobicContact CG-CD2 4.3Å; F139-L150 HydrophobicContact CE2-CD1 4.33Å; M140-L150 HydrophobicContact CE-CD1 4.38Å; M140-L150 HydrophobicContact SD-CD1 3.62Å; C143-L150 HydrophobicContact CB-CD2 4.43Å; L150-L214 HydrophobicContact CB-CB 4.24Å; L150-L214 HydrophobicContact CB-CD2 4.38Å; L150-L214 PolarHBondContact O-N 3.46Å; L150-T234 HydrophobicContact CB-CG2 3.88Å; L150-T234 HydrophobicContact CD1-CG2 4.16Å; L150-T234 HydrophobicContact CG-CG2 4.02Å; L150-T234 PolarHBondContact N-OG1 3.12Å; L150-T234 PolarHBondContact O-OG1 3.07Å; L150-F235 HydrophobicContact CD1-CE2 4.29Å; L150-F235 HydrophobicContact CD1-CZ 4.02Å
151	Y	93.3	Very high	90	Very high	26 Å²	26	44.3 Å²	44.3	10%	0.102	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	154.9	177.4	-61.2	-99.4	0	0	0	109.5	I38 L39 E41 Y52 N149 K211 Q212 Q213	I38-Y151 CarbonylContact C-O 3.48Å; I38-Y151 VanDerWaalsContact CA-O 3.31Å; I38-Y151 WeakPolarHBondContact CA-O 3.32Å; L39-Y151 PolarHBondContact N-O 3.18Å; L39-Y151 PolarHBondContact O-N 2.61Å; E41-Y151 HydrophobicContact CB-CD2 4.35Å; E41-Y151 HydrophobicContact CB-CE2 3.77Å; E41-Y151 HydrophobicContact CG-CE2 4.42Å; E41-Y151 VanDerWaalsContact OE2-CE2 3.31Å; E41-Y151 WeakPolarHBondContact OE2-CE2 3.26Å; E41-Y151 PolarHBondContact OE2-OH 3.37Å; Y52-Y151 HydrophobicContact CD1-CD2 4.05Å; Y52-Y151 HydrophobicContact CD1-CE2 4.36Å; Y52-Y151 AromaticContact CE1-CD2 3.82Å; Y52-Y151 HydrophobicContact CE1-CD2 3.82Å; Y52-Y151 AromaticContact CE1-CE2 3.71Å; Y52-Y151 HydrophobicContact CE1-CE2 3.71Å; Y52-Y151 HydrophobicContact CE1-CG 4.48Å; N149-Y151 HydrophobicContact CB-CE2 3.75Å; Y151-K211 HydrophobicContact CD1-CD 3.9Å; Y151-K211 HydrophobicContact CD1-CG 3.95Å; Y151-K211 HydrophobicContact CD2-CD 4.49Å; Y151-K211 HydrophobicContact CG-CD 3.82Å; Y151-K211 HydrophobicContact CG-CG 4.23Å; Y151-K211 VanDerWaalsContact CZ-NZ 3.33Å; Y151-Q212 CarbonylContact C-O 3.52Å; Y151-Q212 WeakPolarHBondContact CA-O 3.33Å; Y151-Q212 WeakPolarHBondContact CB-O 3.45Å; Y151-Q213 VanDerWaalsContact CD1-CA 3.45Å; Y151-Q213 HydrophobicContact CD1-CB 3.76Å; Y151-Q213 HydrophobicContact CD1-CG 4.11Å; Y151-Q213 HydrophobicContact CE1-CB 3.6Å; Y151-Q213 HydrophobicContact CE1-CG 3.76Å
152	V	93.6	Very high	90.4	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	137	174	66.7	0	0	0	0	109.5	N37 L59 T154 K211 Q212 I223	N37-V152 WeakPolarHBondContact O-CA 3.25Å; L59-V152 HydrophobicContact CB-CG2 4.01Å; L59-V152 HydrophobicContact CD2-CG2 4.26Å; V152-T154 HydrophobicContact CG1-CG2 4.02Å; V152-T154 PolarHBondContact O-N 2.67Å; V152-K211 CarbonylContact O-C 3.49Å; V152-K211 WeakPolarHBondContact O-CA 3.45Å; V152-Q212 HydrophobicContact CG1-CB 4.39Å; V152-Q212 PolarHBondContact N-O 3.25Å; V152-Q212 PolarHBondContact O-N 3.4Å; V152-I223 HydrophobicContact CG1-CD1 4.31Å; V152-I223 HydrophobicContact CG1-CG1 4.39Å; V152-I223 HydrophobicContact CG1-CG2 3.79Å
153	V	95	Very high	90.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	123.2	172.6	179.4	0	0	0	0	109.8	F33 C34 F36 N37 L39 E155 A156 Y209 K210	F33-V153 WeakPolarHBondContact O-CG1 3.1Å; C34-V153 WeakPolarHBondContact O-CB 3.31Å; F36-V153 PolarHBondContact N-O 3.39Å; N37-V153 HydrophobicContact CB-CG2 4.39Å; N37-V153 PolarHBondContact O-N 3.27Å; L39-V153 HydrophobicContact CD1-CG2 3.78Å; L39-V153 HydrophobicContact CD2-CG2 4.3Å; L39-V153 HydrophobicContact CG-CG2 4.02Å; V153-E155 WeakPolarHBondContact CG1-O 3.32Å; V153-A156 HydrophobicContact CG1-CB 4.25Å; V153-Y209 HydrophobicContact CG2-CD2 4.25Å; V153-K210 WeakPolarHBondContact CA-O 3.37Å
154	T	93.5	Very high	90.8	Very high	11 Å²	11	46.5 Å²	46.5	7%	0.067	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-14.9	-178.7	58.4	0	0	0	0	113.2	L35 S118 I119 L124 V152 K210 Q212	L35-T154 VanDerWaalsContact CD2-O 3.24Å; L35-T154 WeakPolarHBondContact CD2-O 3.27Å; S118-T154 WeakPolarHBondContact CA-O 3.47Å; I119-T154 PolarHBondContact N-O 2.86Å; L124-T154 HydrophobicContact CD1-CG2 3.8Å; L124-T154 HydrophobicContact CD2-CG2 4.35Å; V152-T154 HydrophobicContact CG1-CG2 4.02Å; V152-T154 PolarHBondContact O-N 2.67Å; T154-K210 PolarHBondContact N-O 2.68Å; T154-Q212 HydrophobicContact CG2-CB 3.9Å; T154-Q212 HydrophobicContact CG2-CG 3.74Å
155	E	95	Very high	90.8	Very high	26 Å²	26	38.5 Å²	38.5	12%	0.121	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	135.6	174.4	-178.4	174.2	174.7	0	0	108.7	S116 K117 V153 Y157 Y209 K210	S116-E155 PolarHBondContact OG-OE1 3.36Å; K117-E155 CarbonylContact O-C 3.47Å; K117-E155 VanDerWaalsContact O-CA 3.3Å; K117-E155 WeakPolarHBondContact O-CA 3.41Å; V153-E155 WeakPolarHBondContact CG1-O 3.32Å; E155-Y157 HydrophobicContact CG-CE2 3.89Å; E155-Y157 WeakPolarHBondContact OE1-CE2 3.39Å; E155-Y157 VanDerWaalsContact OE1-CZ 3.29Å; E155-Y157 PolarHBondContact OE1-OH 3.49Å; E155-Y209 CarbonylContact O-C 3.53Å; E155-Y209 WeakPolarHBondContact O-CA 3.35Å; E155-Y209 WeakPolarHBondContact O-CB 3.27Å; E155-K210 HydrophobicContact CB-CB 4.02Å; E155-K210 HydrophobicContact CB-CD 4.41Å; E155-K210 HydrophobicContact CB-CG 4.18Å; E155-K210 PolarHBondContact O-N 3.28Å; E155-K210 IonicContact OE1-NZ 3.88Å; E155-K210 WeakPolarHBondContact OE2-CD 3.48Å; E155-K210 WeakPolarHBondContact OE2-CE 3.49Å; E155-K210 IonicContact OE2-NZ 2.65Å; E155-K210 PolarHBondContact OE2-NZ 3.39Å
156	A	96.8	Very high	90.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	138.7	178.7	0	0	0	0	0	110.5	S116 K117 V153 V206	S116-A156 CarbonylContact C-O 3.49Å; S116-A156 WeakPolarHBondContact CA-O 3.48Å; K117-A156 PolarHBondContact N-O 3.16Å; K117-A156 PolarHBondContact O-N 2.99Å; V153-A156 HydrophobicContact CG1-CB 4.25Å; A156-V206 HydrophobicContact CB-CG1 3.99Å; A156-V206 HydrophobicContact CB-CG2 4.2Å
157	Y	96.7	Very high	90	Very high	27 Å²	27	33.2 Å²	33.2	11%	0.106	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	104.3	175.8	-72.4	-104.9	0	0	0	108.6	L16 L21 V114 Q115 E155 V206 L207 A208	L16-Y157 HydrophobicContact CD1-CD1 3.5Å; L16-Y157 VanDerWaalsContact CD1-CD1 3.5Å; L16-Y157 HydrophobicContact CD1-CD2 4.3Å; L16-Y157 HydrophobicContact CD1-CE1 3.72Å; L16-Y157 HydrophobicContact CD1-CG 3.82Å; L16-Y157 HydrophobicContact CD2-CD1 4.07Å; L16-Y157 HydrophobicContact CD2-CE1 3.83Å; L16-Y157 HydrophobicContact CG-CD1 4.44Å; L16-Y157 HydrophobicContact CG-CE1 4.37Å; L21-Y157 HydrophobicContact CD1-CE2 4.26Å; L21-Y157 HydrophobicContact CD2-CD2 3.93Å; L21-Y157 HydrophobicContact CD2-CE2 3.6Å; V114-Y157 HydrophobicContact CG2-CD1 4.3Å; Q115-Y157 WeakPolarHBondContact O-CA 3.45Å; E155-Y157 HydrophobicContact CG-CE2 3.89Å; E155-Y157 WeakPolarHBondContact OE1-CE2 3.39Å; E155-Y157 VanDerWaalsContact OE1-CZ 3.29Å; E155-Y157 PolarHBondContact OE1-OH 3.49Å; Y157-V206 WeakPolarHBondContact O-CA 3.46Å; Y157-L207 PolarHBondContact O-N 3.04Å; Y157-A208 HydrophobicContact CD2-CB 4.21Å; Y157-A208 HydrophobicContact CG-CB 4.38Å; Y157-A208 PolarHBondContact N-O 2.95Å
158	E	96.6	Very high	88.8	Confident	23 Å²	23	33.8 Å²	33.8	11%	0.107	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	142.8	-177.1	-69.7	175.7	-146.3	0	0	111.2	V114 Q115 K117 S205 V206	V114-E158 CarbonylContact C-O 3.55Å; V114-E158 VanDerWaalsContact CA-O 3.29Å; V114-E158 WeakPolarHBondContact CA-O 3.48Å; Q115-E158 PolarHBondContact N-O 2.75Å; Q115-E158 PolarHBondContact O-N 2.97Å; K117-E158 WeakPolarHBondContact CD-OE1 3.03Å; K117-E158 WeakPolarHBondContact CE-OE1 3.27Å; K117-E158 WeakPolarHBondContact CE-OE2 3.23Å; K117-E158 IonicContact NZ-OE1 3.37Å; K117-E158 PolarHBondContact NZ-OE1 3.16Å; K117-E158 IonicContact NZ-OE2 2.77Å; K117-E158 PolarHBondContact NZ-OE2 3.28Å; E158-S205 WeakPolarHBondContact CA-O 3.47Å; E158-V206 HydrophobicContact CG-CG2 3.78Å
159	V	95.3	Very high	87.3	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.012	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	131.6	171.2	-178.5	0	0	0	0	109.9	E113 K161 T163 I201 G204 S205 L207	E113-V159 WeakPolarHBondContact O-CA 3.41Å; V159-K161 WeakPolarHBondContact CG1-O 3.42Å; V159-T163 HydrophobicContact CG1-CG2 4.36Å; V159-I201 HydrophobicContact CG2-CG2 3.98Å; V159-G204 PolarHBondContact O-N 2.95Å; V159-S205 WeakPolarHBondContact CG2-O 3.05Å; V159-S205 PolarHBondContact N-O 2.85Å; V159-L207 HydrophobicContact CG2-CD1 3.68Å; V159-L207 HydrophobicContact CG2-CD2 4.21Å; V159-L207 HydrophobicContact CG2-CG 3.8Å
160	T	94.2	Very high	85.2	Confident	22 Å²	22	34.5 Å²	34.5	14%	0.135	18%	0.179	C	C	.	.	S	Bend	trans	-86.4	-21.6	-172.7	61.9	0	0	0	0	114.4	P77 E113 Q115 K203	P77-T160 HydrophobicContact CB-CG2 4.36Å; E113-T160 WeakPolarHBondContact CB-OG1 3.3Å; E113-T160 HydrophobicContact CG-CG2 4.27Å; E113-T160 WeakPolarHBondContact CG-OG1 3.3Å; E113-T160 PolarHBondContact O-N 3.28Å; E113-T160 PolarHBondContact O-OG1 3.24Å; E113-T160 WeakPolarHBondContact OE1-CB 3.1Å; E113-T160 PolarHBondContact OE1-OG1 2.91Å; Q115-T160 HydrophobicContact CB-CG2 3.56Å; T160-K203 VanDerWaalsContact O-CD 3.26Å; T160-K203 WeakPolarHBondContact O-CD 3.44Å; T160-K203 VanDerWaalsContact O-CE 3.32Å; T160-K203 WeakPolarHBondContact O-CE 3.32Å; T160-K203 WeakPolarHBondContact O-CG 3.5Å
161	K	93.4	Very high	82.7	Confident	118 Å²	118	35.2 Å²	35.2	51%	0.513	18%	0.184	S	C	.	.	S	Bend	trans	-141.8	152.6	-174.4	-64	167.4	-172.2	146.2	0	109.6	E113 V159 T163	E113-K161 WeakPolarHBondContact OE1-CE 3.47Å; E113-K161 IonicContact OE1-NZ 3.33Å; E113-K161 PolarHBondContact OE1-NZ 2.86Å; E113-K161 IonicContact OE2-NZ 2.77Å; E113-K161 PolarHBondContact OE2-NZ 2.71Å; V159-K161 WeakPolarHBondContact CG1-O 3.42Å; K161-T163 WeakPolarHBondContact O-CG2 3.22Å; K161-T163 PolarHBondContact O-N 2.67Å
162	D	92.6	Very high	80	Confident	124 Å²	124	38.1 Å²	38.1	66%	0.663	20%	0.197	S	C	*	.			trans	-62	132.3	172.8	-60.2	-24.3	0	0	0	109.4	I201 Q202 K203	D162-I201 WeakPolarHBondContact CA-O 3.49Å; D162-Q202 WeakPolarHBondContact OD1-CA 3.19Å; D162-K203 WeakPolarHBondContact OD1-CB 3.42Å; D162-K203 PolarHBondContact OD1-N 2.77Å
163	T	89.5	Confident	77.3	Confident	25 Å²	25	42.8 Å²	42.8	15%	0.153	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	167.7	-179.8	64	0	0	0	0	110.3	I112 V159 K161 I201	I112-T163 HydrophobicContact CG2-CG2 4.2Å; V159-T163 HydrophobicContact CG1-CG2 4.36Å; K161-T163 WeakPolarHBondContact O-CG2 3.22Å; K161-T163 PolarHBondContact O-N 2.67Å; T163-I201 PolarHBondContact N-O 3.01Å; T163-I201 PolarHBondContact O-N 2.86Å
164	V	87.2	Confident	74.5	Confident	69 Å²	69	46.8 Å²	46.8	42%	0.418	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.3	173.5	-177.8	0	0	0	0	107.7	E166 I199	V164-E166 HydrophobicContact CG1-CG 3.94Å; V164-I199 WeakPolarHBondContact CA-O 3.38Å
165	L	83.2	Confident	71.7	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	120.1	166.8	174.9	66.3	0	0	0	107.7	W7 L8 S198 I199 I201	W7-L165 HydrophobicContact CZ3-CD1 4.23Å; L8-L165 HydrophobicContact CB-CD2 4.2Å; L8-L165 HydrophobicContact CD2-CD2 4.48Å; L165-S198 CarbonylContact O-C 3.56Å; L165-S198 WeakPolarHBondContact O-CA 3.28Å; L165-I199 HydrophobicContact CB-CB 4.29Å; L165-I199 HydrophobicContact CD2-CD1 4.36Å; L165-I199 PolarHBondContact N-O 3.34Å; L165-I199 PolarHBondContact O-N 3.4Å; L165-I201 HydrophobicContact CB-CD1 4.19Å
166	E	77.1	Confident	68.8	Low	127 Å²	127	55.8 Å²	55.8	59%	0.593	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	123.3	-179.9	-65.8	-177.3	176.6	0	0	110.3	G109 V164	G109-E166 PolarHBondContact N-O 3.11Å; V164-E166 HydrophobicContact CG1-CG 3.94Å
167	G	66	Low	65.9	Low	4 Å²	4	58.1 Å²	58.1	4%	0.041	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.6	173.7	0	0	0	0	0	110.5	T196 D197	G167-T196 WeakPolarHBondContact O-CA 3.48Å; G167-D197 PolarHBondContact N-O 3.18Å; G167-D197 PolarHBondContact O-N 2.84Å
168	T	57.3	Low	63.1	Low	51 Å²	51	59.2 Å²	59.2	31%	0.313	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	117.2	170.6	-31.2	0	0	0	0	108.3	S107 K195	S107-T168 PolarHBondContact N-O 3.31Å; S107-T168 CarbonylContact O-C 3.55Å; S107-T168 PolarHBondContact O-N 3.41Å; T168-K195 WeakPolarHBondContact CA-O 3.39Å
169	S	54.8	Low	60.2	Low	26 Å²	26	60.6 Å²	60.6	18%	0.182	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.8	168.5	61.9	0	0	0	0	108.9	T193 K195	S169-T193 VanDerWaalsContact O-O 3.04Å; S169-K195 PolarHBondContact N-O 3.13Å; S169-K195 PolarHBondContact O-N 3.46Å
170	N	44.7	Very low	57.2	Low	40 Å²	40	64.4 Å²	64.4	21%	0.214	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	101.2	169.3	-153.9	-15.4	0	0	0	107.7	V105 T193 E194	V105-N170 PolarHBondContact N-O 3.07Å; V105-N170 PolarHBondContact O-N 2.66Å; N170-T193 WeakPolarHBondContact CA-O 3.3Å; N170-E194 PolarHBondContact ND2-OE1 3.43Å
171	S	40.7	Very low	54.5	Low	15 Å²	15	71.6 Å²	71.6	11%	0.105	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	125	173.9	51.4	0	0	0	0	109.6	T193	S171-T193 PolarHBondContact N-O 2.7Å; S171-T193 VanDerWaalsContact N-O 3.15Å; S171-T193 PolarHBondContact O-N 2.94Å
172	K	37.6	Very low	51.8	Low	87 Å²	87	70.4 Å²	70.4	38%	0.378	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	103.6	171.1	-62.6	-163.9	178.2	-178	0	108.9	W191 Q192	K172-W191 CarbonylContact C-O 3.34Å; K172-W191 VanDerWaalsContact CA-O 3.29Å; K172-W191 WeakPolarHBondContact CA-O 3.43Å; K172-Q192 HydrophobicContact CD-CG 4.05Å; K172-Q192 HydrophobicContact CG-CB 4.49Å; K172-Q192 HydrophobicContact CG-CG 3.93Å
173	F	35.3	Very low	48.8	Very low	98 Å²	98	68.8 Å²	68.8	43%	0.43	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.6	168.7	-71.6	-82.2	0	0	0	108.7	I175 W191	F173-I175 PolarHBondContact O-N 3Å; F173-W191 HydrophobicContact CB-CB 4.31Å; F173-W191 HydrophobicContact CB-CE3 4.32Å; F173-W191 HydrophobicContact CD2-CE3 4.3Å; F173-W191 PolarHBondContact N-O 3.34Å; F173-W191 CarbonylContact O-C 3.6Å; F173-W191 WeakPolarHBondContact O-CA 3.25Å; F173-W191 WeakPolarHBondContact O-CB 3.2Å; F173-W191 PolarHBondContact O-N 2.85Å
174	A	36.9	Very low	46	Very low	84 Å²	84	77.7 Å²	77.7	69%	0.694	41%	0.411	S	S	*	.			trans	-90.7	97.5	171.9	0	0	0	0	0	108.6	Q190	A174-Q190 HydrophobicContact CB-CG 4.18Å
175	I	34.4	Very low	43.1	Very low	51 Å²	51	79.2 Å²	79.2	26%	0.262	42%	0.42	S	S	.	.			trans	-107.8	115.8	170.2	-57	176.6	0	0	0	107.5	F173 G177 E419	F173-I175 PolarHBondContact O-N 3Å; I175-G177 PolarHBondContact O-N 3.44Å; I175-E419 HydrophobicContact CG2-CG 4.47Å
176	K	35.4	Very low	40.3	Very low	176 Å²	176	82.4 Å²	82.4	77%	0.765	45%	0.454	S	S	*	.			trans	-92.5	90.7	-167.7	-145.7	-179.5	-172.1	-178	0	109.7	E419	K176-E419 PolarHBondContact N-OE1 2.89Å
177	G	34.6	Very low	37.9	Very low	49 Å²	49	78.6 Å²	78.6	51%	0.505	45%	0.449	S	S	.	.	S	Bend	trans	110.1	12.7	150.2	0	0	0	0	0	120.5	I175	I175-G177 PolarHBondContact O-N 3.44Å
178	I	37.9	Very low	36.2	Very low	50 Å²	50	83.7 Å²	83.7	26%	0.256	48%	0.484	S	S	.	.			trans	-107	-15	-174.9	-60.7	175.3	0	0	0	113.9	N180 M380	I178-N180 VanDerWaalsContact C-N 3.32Å; I178-N180 PolarHBondContact O-N 3.34Å; I178-M380 HydrophobicContact CD1-CE 4.12Å; I178-M380 HydrophobicContact CD1-CG 4.41Å; I178-M380 HydrophobicContact CD1-SD 4.05Å
179	I	36.9	Very low	35	Very low	51 Å²	51	83.2 Å²	83.2	26%	0.262	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-6.9	-163.3	-55.6	-178.1	0	0	0	114.6	Q181 V183 W191	I179-Q181 PolarHBondContact O-N 2.92Å; I179-V183 PolarHBondContact O-N 3.5Å; I179-V183 VanDerWaalsContact O-O 3.1Å; I179-W191 HydrophobicContact CD1-CD2 4.43Å; I179-W191 HydrophobicContact CD1-CG 3.95Å
180	N	31.5	Very low	34	Very low	83 Å²	83	87.4 Å²	87.4	44%	0.444	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.6	-177.8	-74.1	7.5	0	0	0	114.1	I178 V185 G186 G187	I178-N180 VanDerWaalsContact C-N 3.32Å; I178-N180 PolarHBondContact O-N 3.34Å; N180-V185 PolarHBondContact OD1-O 2.96Å; N180-G186 WeakPolarHBondContact OD1-CA 3.49Å; N180-G187 PolarHBondContact OD1-N 3.15Å
181	Q	36.7	Very low	33.5	Very low	173 Å²	173	90.4 Å²	90.4	81%	0.808	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-30	-174.4	-62.4	-157.4	16.1	0	0	115.3	I179	I179-Q181 PolarHBondContact O-N 2.92Å
182	L	37.1	Very low	33.3	Very low	93 Å²	93	94.6 Å²	94.6	49%	0.487	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-24.3	-180	-92.1	150.7	0	0	0	113.3	L376	L182-L376 HydrophobicContact CD1-CD2 4.21Å
183	V	30.8	Very low	33.5	Very low	89 Å²	89	92 Å²	92	54%	0.539	52%	0.524	S	S	.	.	S	Bend	trans	-135.7	127.2	171.2	-171.4	0	0	0	0	106.4	I179 V185	I179-V183 PolarHBondContact O-N 3.5Å; I179-V183 VanDerWaalsContact O-O 3.1Å; V183-V185 HydrophobicContact CG1-CG2 4.08Å; V183-V185 PolarHBondContact O-N 3.25Å
184	K	29.2	Very low	34	Very low	213 Å²	213	94.3 Å²	94.3	93%	0.926	54%	0.536	S	S	*	.	S	Bend	trans	-64.6	70	178.3	-78.6	-177.7	174.7	175.7	0	111.9
185	V	26.8	Very low	34.7	Very low	100 Å²	100	95 Å²	95	61%	0.606	52%	0.523	S	S	*	.			trans	-131.5	97.7	170.9	-176.4	0	0	0	0	106.7	N180 V183 G187	N180-V185 PolarHBondContact OD1-O 2.96Å; V183-V185 HydrophobicContact CG1-CG2 4.08Å; V183-V185 PolarHBondContact O-N 3.25Å; V185-G187 PolarHBondContact O-N 3.48Å
186	G	24.8	Very low	35.8	Very low	71 Å²	71	97.4 Å²	97.4	73%	0.732	54%	0.54	S	S	*	.			trans	-72.3	113.3	177.2	0	0	0	0	0	111.5	N180	N180-G186 WeakPolarHBondContact OD1-CA 3.49Å
187	G	27.6	Very low	37.2	Very low	46 Å²	46	91.5 Å²	91.5	47%	0.474	52%	0.517	S	S	.	.	S	Bend	trans	168.8	140.7	165.1	0	0	0	0	0	113.6	N180 V185 G189	N180-G187 PolarHBondContact OD1-N 3.15Å; V185-G187 PolarHBondContact O-N 3.48Å; G187-G189 VanDerWaalsContact C-N 3.34Å; G187-G189 PolarHBondContact O-N 3.39Å
188	S	28.8	Very low	39.2	Very low	111 Å²	111	92.9 Å²	92.9	78%	0.776	52%	0.519	S	S	*	.			trans	-67.5	93.5	165.7	65.2	0	0	0	0	108.4
189	G	32.5	Very low	41.3	Very low	41 Å²	41	92.6 Å²	92.6	42%	0.423	52%	0.517	S	S	.	.			trans	-127.4	137.9	-168.4	0	0	0	0	0	112.6	G187 W191	G187-G189 VanDerWaalsContact C-N 3.34Å; G187-G189 PolarHBondContact O-N 3.39Å; G189-W191 PolarHBondContact O-N 3.29Å
190	Q	33.6	Very low	43.8	Very low	114 Å²	114	94.4 Å²	94.4	53%	0.533	53%	0.533	S	S	.	.			trans	-51.2	125.2	159.1	-153.2	174.1	20.5	0	0	108	A174 Q192	A174-Q190 HydrophobicContact CB-CG 4.18Å; Q190-Q192 VanDerWaalsContact C-N 3.3Å; Q190-Q192 PolarHBondContact O-N 2.81Å
191	W	34.6	Very low	46.7	Very low	104 Å²	104	90.6 Å²	90.6	39%	0.394	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	86.9	176.9	-147	55.2	0	0	0	108.4	K172 F173 I179 G189 T193	K172-W191 CarbonylContact C-O 3.34Å; K172-W191 VanDerWaalsContact CA-O 3.29Å; K172-W191 WeakPolarHBondContact CA-O 3.43Å; F173-W191 HydrophobicContact CB-CB 4.31Å; F173-W191 HydrophobicContact CB-CE3 4.32Å; F173-W191 HydrophobicContact CD2-CE3 4.3Å; F173-W191 PolarHBondContact N-O 3.34Å; F173-W191 CarbonylContact O-C 3.6Å; F173-W191 WeakPolarHBondContact O-CA 3.25Å; F173-W191 WeakPolarHBondContact O-CB 3.2Å; F173-W191 PolarHBondContact O-N 2.85Å; I179-W191 HydrophobicContact CD1-CD2 4.43Å; I179-W191 HydrophobicContact CD1-CG 3.95Å; G189-W191 PolarHBondContact O-N 3.29Å; W191-T193 VanDerWaalsContact CE2-OG1 3.28Å; W191-T193 VanDerWaalsContact CE3-OG1 3.3Å
192	Q	37.4	Very low	49.4	Very low	103 Å²	103	89 Å²	89	48%	0.481	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	101.9	163.7	-60.5	-169	-7.3	0	0	106.4	K172 Q190	K172-Q192 HydrophobicContact CD-CG 4.05Å; K172-Q192 HydrophobicContact CG-CB 4.49Å; K172-Q192 HydrophobicContact CG-CG 3.93Å; Q190-Q192 VanDerWaalsContact C-N 3.3Å; Q190-Q192 PolarHBondContact O-N 2.81Å
193	T	41.3	Very low	52.2	Low	33 Å²	33	91.5 Å²	91.5	20%	0.202	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	95.6	175.9	-52	0	0	0	0	107.2	S169 N170 S171 W191 K195	S169-T193 VanDerWaalsContact O-O 3.04Å; N170-T193 WeakPolarHBondContact CA-O 3.3Å; S171-T193 PolarHBondContact N-O 2.7Å; S171-T193 VanDerWaalsContact N-O 3.15Å; S171-T193 PolarHBondContact O-N 2.94Å; W191-T193 VanDerWaalsContact CE2-OG1 3.28Å; W191-T193 VanDerWaalsContact CE3-OG1 3.3Å; T193-K195 HydrophobicContact CG2-CB 4.26Å; T193-K195 PolarHBondContact O-N 2.97Å
194	E	46.3	Very low	55.2	Low	145 Å²	145	88 Å²	88	68%	0.678	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	92.4	168.9	-156.4	166.4	-127.5	0	0	107	N170	N170-E194 PolarHBondContact ND2-OE1 3.43Å
195	K	49.8	Very low	58.3	Low	100 Å²	100	78.2 Å²	78.2	44%	0.435	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	113.6	-177.6	-143.3	-177.1	174.9	-140.6	0	108.8	T168 S169 T193 D197	T168-K195 WeakPolarHBondContact CA-O 3.39Å; S169-K195 PolarHBondContact N-O 3.13Å; S169-K195 PolarHBondContact O-N 3.46Å; T193-K195 HydrophobicContact CG2-CB 4.26Å; T193-K195 PolarHBondContact O-N 2.97Å; K195-D197 WeakPolarHBondContact CD-OD2 3.31Å; K195-D197 WeakPolarHBondContact CE-OD1 3.09Å; K195-D197 WeakPolarHBondContact CE-OD2 3.26Å; K195-D197 IonicContact NZ-OD1 2.73Å; K195-D197 PolarHBondContact NZ-OD1 3.46Å; K195-D197 IonicContact NZ-OD2 2.69Å; K195-D197 PolarHBondContact NZ-OD2 3.47Å
196	T	57.5	Low	61.7	Low	101 Å²	101	73.5 Å²	73.5	62%	0.62	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	102.7	167.6	-52.6	0	0	0	0	106.8	G167	G167-T196 WeakPolarHBondContact O-CA 3.48Å
197	D	65.6	Low	65.1	Low	52 Å²	52	70.1 Å²	70.1	28%	0.278	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.2	177	-70.9	-30.1	0	0	0	107.4	G167 K195	G167-D197 PolarHBondContact N-O 3.18Å; G167-D197 PolarHBondContact O-N 2.84Å; K195-D197 WeakPolarHBondContact CD-OD2 3.31Å; K195-D197 WeakPolarHBondContact CE-OD1 3.09Å; K195-D197 WeakPolarHBondContact CE-OD2 3.26Å; K195-D197 IonicContact NZ-OD1 2.73Å; K195-D197 PolarHBondContact NZ-OD1 3.46Å; K195-D197 IonicContact NZ-OD2 2.69Å; K195-D197 PolarHBondContact NZ-OD2 3.47Å
198	S	76.6	Confident	68.3	Low	78 Å²	78	67.9 Å²	67.9	55%	0.545	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	115	174.9	60.9	0	0	0	0	109.1	L165	L165-S198 CarbonylContact O-C 3.56Å; L165-S198 WeakPolarHBondContact O-CA 3.28Å
199	I	82.5	Confident	71.5	Confident	43 Å²	43	63 Å²	63	22%	0.221	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	109.5	-177.4	-54.7	177.4	0	0	0	108.4	L27 V164 L165 I201	L27-I199 HydrophobicContact CD2-CG2 3.61Å; V164-I199 WeakPolarHBondContact CA-O 3.38Å; L165-I199 HydrophobicContact CB-CB 4.29Å; L165-I199 HydrophobicContact CD2-CD1 4.36Å; L165-I199 PolarHBondContact N-O 3.34Å; L165-I199 PolarHBondContact O-N 3.4Å; I199-I201 PolarHBondContact O-N 2.85Å
200	P	89.1	Confident	74.5	Confident	90 Å²	90	63.7 Å²	63.7	58%	0.584	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	129.4	175.9	29.2	-32.9	0	0	0	110.1
201	I	92.1	Very high	77.2	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	115.9	176.9	-56.6	174.3	0	0	0	107.5	F5 L8 L27 V159 D162 T163 L165 I199	F5-I201 HydrophobicContact CD2-CD1 4.14Å; F5-I201 HydrophobicContact CD2-CG1 4.41Å; F5-I201 HydrophobicContact CE2-CD1 4.43Å; L8-I201 HydrophobicContact CD2-CD1 3.17Å; L27-I201 HydrophobicContact CD1-CG1 4.47Å; L27-I201 HydrophobicContact CD1-CG2 4.41Å; V159-I201 HydrophobicContact CG2-CG2 3.98Å; D162-I201 WeakPolarHBondContact CA-O 3.49Å; T163-I201 PolarHBondContact N-O 3.01Å; T163-I201 PolarHBondContact O-N 2.86Å; L165-I201 HydrophobicContact CB-CD1 4.19Å; I199-I201 PolarHBondContact O-N 2.85Å
202	Q	93.5	Very high	79.9	Confident	141 Å²	141	56.1 Å²	56.1	66%	0.659	29%	0.29	S	S	*	.			trans	-78.8	151.7	-177.6	-65.2	-178.1	-12.6	0	0	111.1	D162 G204 S205	D162-Q202 WeakPolarHBondContact OD1-CA 3.19Å; Q202-G204 PolarHBondContact O-N 3.16Å; Q202-S205 VanDerWaalsContact O-CB 3.3Å; Q202-S205 WeakPolarHBondContact O-CB 3.49Å; Q202-S205 PolarHBondContact O-N 3.49Å; Q202-S205 VanDerWaalsContact O-N 3.12Å; Q202-S205 PolarHBondContact O-OG 3.32Å; Q202-S205 VanDerWaalsContact O-OG 3.1Å
203	K	94.9	Very high	82.4	Confident	145 Å²	145	52.5 Å²	52.5	63%	0.63	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	134.7	167.8	175.6	178.6	-179.3	-178.1	0	110.3	T160 D162	T160-K203 VanDerWaalsContact O-CD 3.26Å; T160-K203 WeakPolarHBondContact O-CD 3.44Å; T160-K203 VanDerWaalsContact O-CE 3.32Å; T160-K203 WeakPolarHBondContact O-CE 3.32Å; T160-K203 WeakPolarHBondContact O-CG 3.5Å; D162-K203 WeakPolarHBondContact OD1-CB 3.42Å; D162-K203 PolarHBondContact OD1-N 2.77Å
204	G	94	Very high	84.7	Confident	16 Å²	16	50.9 Å²	50.9	17%	0.165	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	-6.2	-178.5	0	0	0	0	0	114.4	V159 Q202 V206	V159-G204 PolarHBondContact O-N 2.95Å; Q202-G204 PolarHBondContact O-N 3.16Å; G204-V206 PolarHBondContact O-N 3.05Å
205	S	96.1	Very high	86.7	Confident	7 Å²	7	44 Å²	44	5%	0.049	23%	0.232	C	C	.	.			trans	-61.5	128.4	168.8	-70.3	0	0	0	0	110.3	E158 V159 Q202	E158-S205 WeakPolarHBondContact CA-O 3.47Å; V159-S205 WeakPolarHBondContact CG2-O 3.05Å; V159-S205 PolarHBondContact N-O 2.85Å; Q202-S205 VanDerWaalsContact O-CB 3.3Å; Q202-S205 WeakPolarHBondContact O-CB 3.49Å; Q202-S205 PolarHBondContact O-N 3.49Å; Q202-S205 VanDerWaalsContact O-N 3.12Å; Q202-S205 PolarHBondContact O-OG 3.32Å; Q202-S205 VanDerWaalsContact O-OG 3.1Å
206	V	96.9	Very high	88.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	131.5	175.7	-177.2	0	0	0	0	109.9	V24 A30 F33 A156 Y157 E158 G204 A208	V24-V206 HydrophobicContact CG2-CB 4.26Å; V24-V206 HydrophobicContact CG2-CG1 3.98Å; V24-V206 WeakPolarHBondContact CG2-O 3.35Å; A30-V206 WeakPolarHBondContact O-CB 3.5Å; A30-V206 VanDerWaalsContact O-CG2 3.26Å; A30-V206 WeakPolarHBondContact O-CG2 3.42Å; A30-V206 PolarHBondContact O-N 3.49Å; F33-V206 HydrophobicContact CB-CB 4.16Å; F33-V206 HydrophobicContact CB-CG1 4.09Å; F33-V206 HydrophobicContact CB-CG2 4.46Å; A156-V206 HydrophobicContact CB-CG1 3.99Å; A156-V206 HydrophobicContact CB-CG2 4.2Å; Y157-V206 WeakPolarHBondContact O-CA 3.46Å; E158-V206 HydrophobicContact CG-CG2 3.78Å; G204-V206 PolarHBondContact O-N 3.05Å; V206-A208 VanDerWaalsContact CG1-O 3.26Å; V206-A208 WeakPolarHBondContact CG1-O 3.34Å
207	L	95.9	Very high	89.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-32.7	176.1	-58.5	-177.6	0	0	0	112.5	F5 L8 S9 V12 P23 V24 I112 V114 Y157 V159	F5-L207 HydrophobicContact CD2-CD2 4.28Å; F5-L207 HydrophobicContact CE2-CD2 3.32Å; F5-L207 HydrophobicContact CZ-CD2 3.58Å; L8-L207 HydrophobicContact CD2-CD1 4.46Å; L8-L207 HydrophobicContact CD2-CD2 4.22Å; S9-L207 VanDerWaalsContact CB-O 3.3Å; S9-L207 WeakPolarHBondContact CB-O 3.32Å; S9-L207 PolarHBondContact OG-O 3.48Å; V12-L207 HydrophobicContact CG1-CB 4.26Å; V12-L207 HydrophobicContact CG1-CD1 4.49Å; V12-L207 HydrophobicContact CG2-CD1 4.02Å; P23-L207 WeakPolarHBondContact CA-O 3.39Å; V24-L207 PolarHBondContact N-O 3.4Å; I112-L207 HydrophobicContact CD1-CD1 3.36Å; V114-L207 HydrophobicContact CG1-CD1 3.89Å; Y157-L207 PolarHBondContact O-N 3.04Å; V159-L207 HydrophobicContact CG2-CD1 3.68Å; V159-L207 HydrophobicContact CG2-CD2 4.21Å; V159-L207 HydrophobicContact CG2-CG 3.8Å
208	A	96.3	Very high	90.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	148.6	-179.3	0	0	0	0	0	111.1	V13 L16 L21 R22 Y157 V206	V13-A208 HydrophobicContact CG2-CB 3.57Å; L16-A208 HydrophobicContact CD1-CB 4.28Å; L21-A208 HydrophobicContact CD2-CB 4.32Å; R22-A208 CarbonylContact O-C 3.56Å; R22-A208 VanDerWaalsContact O-CA 3.25Å; R22-A208 WeakPolarHBondContact O-CA 3.24Å; Y157-A208 HydrophobicContact CD2-CB 4.21Å; Y157-A208 HydrophobicContact CG-CB 4.38Å; Y157-A208 PolarHBondContact N-O 2.95Å; V206-A208 VanDerWaalsContact CG1-O 3.26Å; V206-A208 WeakPolarHBondContact CG1-O 3.34Å
209	Y	95.9	Very high	90.3	Very high	8 Å²	8	42.9 Å²	42.9	3%	0.031	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	158.8	-179.1	68.2	-79	0	0	0	112.3	R22 V24 F33 L39 V153 E155 K211	R22-Y209 HydrophobicContact CB-CD1 4.3Å; R22-Y209 HydrophobicContact CB-CE1 3.77Å; R22-Y209 HydrophobicContact CB-CE2 4.23Å; R22-Y209 PolarHBondContact N-O 3.24Å; R22-Y209 VanDerWaalsContact O-CD1 3.28Å; R22-Y209 WeakPolarHBondContact O-CD1 3.45Å; R22-Y209 PolarHBondContact O-N 2.96Å; V24-Y209 HydrophobicContact CG2-CD1 3.78Å; V24-Y209 HydrophobicContact CG2-CE1 4.15Å; F33-Y209 HydrophobicContact CB-CD1 4.5Å; F33-Y209 AromaticContact CD1-CD1 3.82Å; F33-Y209 HydrophobicContact CD1-CD1 3.82Å; F33-Y209 HydrophobicContact CD1-CD2 4.18Å; F33-Y209 AromaticContact CD1-CE1 3.67Å; F33-Y209 HydrophobicContact CD1-CE1 3.67Å; F33-Y209 HydrophobicContact CD1-CE2 4.02Å; F33-Y209 HydrophobicContact CD1-CG 4.09Å; F33-Y209 AromaticContact CD1-CZ 3.77Å; F33-Y209 HydrophobicContact CE1-CD1 4.46Å; F33-Y209 AromaticContact CE1-CE1 3.84Å; F33-Y209 HydrophobicContact CE1-CE1 3.84Å; F33-Y209 HydrophobicContact CE1-CE2 4.25Å; F33-Y209 AromaticContact CE1-CZ 3.73Å; F33-Y209 HydrophobicContact CG-CD1 4.41Å; L39-Y209 HydrophobicContact CD1-CD2 4Å; L39-Y209 HydrophobicContact CD1-CE2 3.41Å; L39-Y209 VanDerWaalsContact CD1-CE2 3.41Å; V153-Y209 HydrophobicContact CG2-CD2 4.25Å; E155-Y209 CarbonylContact O-C 3.53Å; E155-Y209 WeakPolarHBondContact O-CA 3.35Å; E155-Y209 WeakPolarHBondContact O-CB 3.27Å; Y209-K211 HydrophobicContact CD2-CB 4.49Å; Y209-K211 HydrophobicContact CE2-CB 4.44Å; Y209-K211 HydrophobicContact CE2-CD 4.3Å
210	K	93.9	Very high	90.4	Very high	55 Å²	55	42.6 Å²	42.6	24%	0.239	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	150.4	163	-56.2	-172	-168.6	153.7	0	109.9	R19 L21 V153 T154 E155	R19-K210 WeakPolarHBondContact O-CE 3.5Å; L21-K210 HydrophobicContact CD2-CD 4.42Å; L21-K210 HydrophobicContact CD2-CG 3.64Å; L21-K210 HydrophobicContact CG-CG 4.22Å; V153-K210 WeakPolarHBondContact CA-O 3.37Å; T154-K210 PolarHBondContact N-O 2.68Å; E155-K210 HydrophobicContact CB-CB 4.02Å; E155-K210 HydrophobicContact CB-CD 4.41Å; E155-K210 HydrophobicContact CB-CG 4.18Å; E155-K210 PolarHBondContact O-N 3.28Å; E155-K210 IonicContact OE1-NZ 3.88Å; E155-K210 WeakPolarHBondContact OE2-CD 3.48Å; E155-K210 WeakPolarHBondContact OE2-CE 3.49Å; E155-K210 IonicContact OE2-NZ 2.65Å; E155-K210 PolarHBondContact OE2-NZ 3.39Å
211	K	91.9	Very high	90.2	Very high	39 Å²	39	38.3 Å²	38.3	17%	0.17	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	150	-179.3	72	-173.6	175.4	85	0	111	L39 Y52 Y151 V152 Y209	L39-K211 HydrophobicContact CD1-CB 4.48Å; L39-K211 HydrophobicContact CD1-CD 4.43Å; Y52-K211 HydrophobicContact CD1-CD 3.86Å; Y52-K211 HydrophobicContact CD2-CD 4.27Å; Y52-K211 HydrophobicContact CE1-CD 3.95Å; Y52-K211 HydrophobicContact CE2-CD 4.34Å; Y52-K211 HydrophobicContact CG-CD 4.04Å; Y52-K211 WeakPolarHBondContact OH-CE 3.27Å; Y52-K211 PolarHBondContact OH-NZ 3.1Å; Y151-K211 HydrophobicContact CD1-CD 3.9Å; Y151-K211 HydrophobicContact CD1-CG 3.95Å; Y151-K211 HydrophobicContact CD2-CD 4.49Å; Y151-K211 HydrophobicContact CG-CD 3.82Å; Y151-K211 HydrophobicContact CG-CG 4.23Å; Y151-K211 VanDerWaalsContact CZ-NZ 3.33Å; V152-K211 CarbonylContact O-C 3.49Å; V152-K211 WeakPolarHBondContact O-CA 3.45Å; Y209-K211 HydrophobicContact CD2-CB 4.49Å; Y209-K211 HydrophobicContact CE2-CB 4.44Å; Y209-K211 HydrophobicContact CE2-CD 4.3Å
212	Q	90.4	Very high	89.9	Confident	20 Å²	20	39.7 Å²	39.7	9%	0.093	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147.5	169.6	-69.7	-171.7	1.1	0	0	109.7	N121 Y151 V152 T154 I223	N121-Q212 PolarHBondContact OD1-NE2 2.87Å; Y151-Q212 CarbonylContact C-O 3.52Å; Y151-Q212 WeakPolarHBondContact CA-O 3.33Å; Y151-Q212 WeakPolarHBondContact CB-O 3.45Å; V152-Q212 HydrophobicContact CG1-CB 4.39Å; V152-Q212 PolarHBondContact N-O 3.25Å; V152-Q212 PolarHBondContact O-N 3.4Å; T154-Q212 HydrophobicContact CG2-CB 3.9Å; T154-Q212 HydrophobicContact CG2-CG 3.74Å; Q212-I223 HydrophobicContact CB-CG2 3.48Å; Q212-I223 VanDerWaalsContact CB-CG2 3.48Å; Q212-I223 HydrophobicContact CG-CG2 4.43Å; Q212-I223 VanDerWaalsContact OE1-CG2 3.23Å
213	Q	90.1	Very high	89.5	Confident	27 Å²	27	33.1 Å²	33.1	13%	0.126	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	135.5	-176	-168.3	177	-1.4	0	0	110.3	N149 Y151 I223 L224 K232	N149-Q213 PolarHBondContact OD1-NE2 3.47Å; Y151-Q213 VanDerWaalsContact CD1-CA 3.45Å; Y151-Q213 HydrophobicContact CD1-CB 3.76Å; Y151-Q213 HydrophobicContact CD1-CG 4.11Å; Y151-Q213 HydrophobicContact CE1-CB 3.6Å; Y151-Q213 HydrophobicContact CE1-CG 3.76Å; Q213-I223 WeakPolarHBondContact O-CA 3.36Å; Q213-L224 HydrophobicContact CB-CB 4.31Å; Q213-L224 PolarHBondContact O-N 3.2Å; Q213-K232 PolarHBondContact NE2-O 3.39Å; Q213-K232 PolarHBondContact OE1-O 3.16Å
214	L	89.6	Confident	88.8	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	132.3	171.4	-170.5	66.7	0	0	0	108.8	L59 L150 I216 C221 I223 T234	L59-L214 HydrophobicContact CD1-CD1 3.93Å; L59-L214 HydrophobicContact CD1-CD2 4.41Å; L150-L214 HydrophobicContact CB-CB 4.24Å; L150-L214 HydrophobicContact CB-CD2 4.38Å; L150-L214 PolarHBondContact O-N 3.46Å; L214-I216 HydrophobicContact CD2-CD1 4.22Å; L214-I216 HydrophobicContact CD2-CG1 4.49Å; L214-I216 HydrophobicContact CG-CG1 4.36Å; L214-C221 HydrophobicContact CD1-CB 3.91Å; L214-I223 HydrophobicContact CD1-CG1 4.37Å; L214-T234 VanDerWaalsContact O-CA 3.3Å; L214-T234 WeakPolarHBondContact O-CA 3.31Å; L214-T234 WeakPolarHBondContact O-CB 3.45Å; L214-T234 VanDerWaalsContact O-CG2 3.24Å; L214-T234 WeakPolarHBondContact O-CG2 3.33Å; L214-T234 PolarHBondContact O-OG1 3.33Å
215	V	88.1	Confident	87.6	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.6	171.3	175.5	0	0	0	0	108.4	E217 V222 L224 K232	V215-E217 HydrophobicContact CG1-CG 3.95Å; V215-V222 HydrophobicContact CB-CB 4.4Å; V215-V222 PolarHBondContact N-O 2.92Å; V215-V222 PolarHBondContact O-N 2.81Å; V215-L224 HydrophobicContact CG2-CD1 3.51Å; V215-L224 HydrophobicContact CG2-CD2 4.45Å; V215-L224 HydrophobicContact CG2-CG 3.74Å; V215-K232 HydrophobicContact CG2-CB 4.19Å
216	I	84.5	Confident	86.1	Confident	21 Å²	21	32.2 Å²	32.2	11%	0.108	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	110.8	-178.7	-64.9	171	0	0	0	108.1	L132 M140 L214 T220 T234 F235 P236	L132-I216 HydrophobicContact CD1-CD1 4.17Å; L132-I216 HydrophobicContact CD1-CG1 4.26Å; L132-I216 HydrophobicContact CD1-CG2 3.54Å; M140-I216 HydrophobicContact CE-CD1 3.11Å; M140-I216 HydrophobicContact SD-CD1 4.49Å; L214-I216 HydrophobicContact CD2-CD1 4.22Å; L214-I216 HydrophobicContact CD2-CG1 4.49Å; L214-I216 HydrophobicContact CG-CG1 4.36Å; I216-T220 WeakPolarHBondContact CA-O 3.48Å; I216-T234 PolarHBondContact N-O 3.32Å; I216-F235 HydrophobicContact CB-CD1 4.37Å; I216-F235 HydrophobicContact CB-CE1 4.34Å; I216-F235 HydrophobicContact CD1-CE1 3.83Å; I216-F235 HydrophobicContact CD1-CZ 4.27Å; I216-P236 WeakPolarHBondContact O-CD 3.37Å
217	E	80.6	Confident	83.8	Confident	65 Å²	65	36.2 Å²	36.2	30%	0.304	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	128.9	179.5	-76.3	175.8	-162.4	0	0	107.7	V215 N219 T220 K232 P236	V215-E217 HydrophobicContact CG1-CG 3.95Å; E217-N219 PolarHBondContact O-N 2.62Å; E217-T220 PolarHBondContact N-O 3.44Å; E217-T220 VanDerWaalsContact N-O 3.12Å; E217-T220 PolarHBondContact O-N 2.86Å; E217-T220 PolarHBondContact O-OG1 3.08Å; E217-K232 IonicContact OE1-NZ 3.22Å; E217-K232 PolarHBondContact OE1-NZ 2.67Å; E217-K232 IonicContact OE2-NZ 2.86Å; E217-P236 HydrophobicContact CG-CG 3.59Å
218	D	79	Confident	81.5	Confident	118 Å²	118	41.7 Å²	41.7	63%	0.631	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.3	47.5	174.7	-63.3	-46.9	0	0	0	115.1	T220 R238	D218-T220 PolarHBondContact O-N 3.18Å; D218-R238 IonicContact OD1-CZ 3.7Å; D218-R238 IonicContact OD1-NH2 3.21Å; D218-R238 PolarHBondContact OD1-NH2 2.92Å; D218-R238 IonicContact OD2-NH2 2.65Å
219	N	80.9	Confident	79.1	Confident	103 Å²	103	47.4 Å²	47.4	55%	0.551	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	20.2	-176.1	-69.8	-6.9	0	0	0	114.7	K131 L132 E217	K131-N219 WeakPolarHBondContact CA-O 3.48Å; L132-N219 WeakPolarHBondContact CB-O 3.39Å; L132-N219 PolarHBondContact N-O 3.38Å; E217-N219 PolarHBondContact O-N 2.62Å
220	T	84.1	Confident	77.1	Confident	36 Å²	36	55.5 Å²	55.5	22%	0.221	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	151.9	172.6	67.6	0	0	0	0	111.2	R130 I216 E217 D218	R130-T220 VanDerWaalsContact O-CA 3.23Å; R130-T220 WeakPolarHBondContact O-CA 3.12Å; I216-T220 WeakPolarHBondContact CA-O 3.48Å; E217-T220 PolarHBondContact N-O 3.44Å; E217-T220 VanDerWaalsContact N-O 3.12Å; E217-T220 PolarHBondContact O-N 2.86Å; E217-T220 PolarHBondContact O-OG1 3.08Å; D218-T220 PolarHBondContact O-N 3.18Å
221	C	85	Confident	75.4	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	136.7	173.9	68.9	0	0	0	0	111.9	L63 L127 N129 R130 L132 L214	L63-C221 HydrophobicContact CD2-CB 4.35Å; L63-C221 WeakPolarHBondContact CD2-SG 3.5Å; L127-C221 PolarHBondContact O-SG 2.7Å; N129-C221 WeakPolarHBondContact CA-O 3.31Å; N129-C221 PolarHBondContact N-O 3.28Å; R130-C221 PolarHBondContact O-N 3.39Å; L132-C221 HydrophobicContact CD2-CB 4.22Å; L214-C221 HydrophobicContact CD1-CB 3.91Å
222	V	85.9	Confident	74.2	Confident	31 Å²	31	62 Å²	62	19%	0.188	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130	171.7	179.5	0	0	0	0	108.2	Q128 N129 V215 L224	Q128-V222 VanDerWaalsContact OE1-CA 3.27Å; N129-V222 WeakPolarHBondContact OD1-CG2 3.47Å; V215-V222 HydrophobicContact CB-CB 4.4Å; V215-V222 PolarHBondContact N-O 2.92Å; V215-V222 PolarHBondContact O-N 2.81Å; V222-L224 HydrophobicContact CG1-CD2 4.25Å
223	I	85.4	Confident	73.5	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.021	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	111.9	174.6	-50.9	170.5	0	0	0	107.2	L59 L124 L127 Q128 V152 Q212 Q213 L214 T225	L59-I223 HydrophobicContact CD2-CD1 3.7Å; L59-I223 HydrophobicContact CD2-CG1 4.35Å; L124-I223 HydrophobicContact CD2-CD1 4.1Å; L127-I223 HydrophobicContact CB-CD1 4.29Å; Q128-I223 PolarHBondContact NE2-O 3.4Å; V152-I223 HydrophobicContact CG1-CD1 4.31Å; V152-I223 HydrophobicContact CG1-CG1 4.39Å; V152-I223 HydrophobicContact CG1-CG2 3.79Å; Q212-I223 HydrophobicContact CB-CG2 3.48Å; Q212-I223 VanDerWaalsContact CB-CG2 3.48Å; Q212-I223 HydrophobicContact CG-CG2 4.43Å; Q212-I223 VanDerWaalsContact OE1-CG2 3.23Å; Q213-I223 WeakPolarHBondContact O-CA 3.36Å; L214-I223 HydrophobicContact CD1-CG1 4.37Å; I223-T225 PolarHBondContact O-N 2.99Å
224	L	79.9	Confident	72.9	Confident	28 Å²	28	62.9 Å²	62.9	15%	0.147	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	113.4	178.9	-65.6	-177.9	0	0	0	110.2	Q213 V215 V222 K232	Q213-L224 HydrophobicContact CB-CB 4.31Å; Q213-L224 PolarHBondContact O-N 3.2Å; V215-L224 HydrophobicContact CG2-CD1 3.51Å; V215-L224 HydrophobicContact CG2-CD2 4.45Å; V215-L224 HydrophobicContact CG2-CG 3.74Å; V222-L224 HydrophobicContact CG1-CD2 4.25Å; L224-K232 HydrophobicContact CD1-CB 4.11Å; L224-K232 HydrophobicContact CD1-CD 4.47Å
225	T	69.9	Low	72.3	Confident	33 Å²	33	64.1 Å²	64.1	20%	0.202	35%	0.345	C	S	.	.			trans	-73.4	147.8	166.7	59.2	0	0	0	0	109.3	N121 I223 A227 N228	N121-T225 HydrophobicContact CB-CG2 4.36Å; I223-T225 PolarHBondContact O-N 2.99Å; T225-A227 PolarHBondContact O-N 3.2Å; T225-N228 PolarHBondContact O-N 3.38Å; T225-N228 VanDerWaalsContact O-N 3.11Å
226	S	63.2	Low	71.2	Confident	88 Å²	88	66.8 Å²	66.8	62%	0.615	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-6.2	-175.9	44.5	0	0	0	0	115.3
227	A	49.4	Very low	69.8	Low	84 Å²	84	71.5 Å²	71.5	69%	0.694	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-17.4	175	0	0	0	0	0	114.5	T225	T225-A227 PolarHBondContact O-N 3.2Å
228	N	48.5	Very low	68.2	Low	114 Å²	114	77.4 Å²	77.4	61%	0.61	41%	0.405	S	S	*	.	S	Bend	trans	-108.8	42.8	-171.8	-80.3	-23.1	0	0	0	113.9	T225 K230	T225-N228 PolarHBondContact O-N 3.38Å; T225-N228 VanDerWaalsContact O-N 3.11Å; N228-K230 PolarHBondContact O-N 3.35Å
229	T	46.1	Very low	66.2	Low	120 Å²	120	81.3 Å²	81.3	74%	0.736	42%	0.417	S	S	*	.			trans	-78.6	80.1	-172.3	48.4	0	0	0	0	113.7
230	K	52.6	Low	63.7	Low	179 Å²	179	82.6 Å²	82.6	78%	0.778	43%	0.428	S	S	*	.	S	Bend		-99.2	125.7	129.7	-71	-175.2	179.8	-178.6	0	105.8	N228 K232	N228-K230 PolarHBondContact O-N 3.35Å; K230-K232 PolarHBondContact O-N 2.83Å
231	K	59.5	Low	61	Low	136 Å²	136	84.7 Å²	84.7	59%	0.591	46%	0.456	S	S	*	.			trans	-56.6	100.2	176.4	-75.8	-173.2	179.7	-176.9	0	108.2	I253	K231-I253 HydrophobicContact CB-CG2 4.44Å; K231-I253 HydrophobicContact CD-CG2 3.57Å; K231-I253 PolarHBondContact NZ-O 2.77Å
232	K	66.7	Low	58.2	Low	95 Å²	95	93.4 Å²	93.4	41%	0.413	50%	0.499	S	S	.	.			trans	-87.6	148	169.9	-76.3	-169.9	165.5	-160.3	0	107.7	Q213 V215 E217 L224 K230	Q213-K232 PolarHBondContact NE2-O 3.39Å; Q213-K232 PolarHBondContact OE1-O 3.16Å; V215-K232 HydrophobicContact CG2-CB 4.19Å; E217-K232 IonicContact OE1-NZ 3.22Å; E217-K232 PolarHBondContact OE1-NZ 2.67Å; E217-K232 IonicContact OE2-NZ 2.86Å; L224-K232 HydrophobicContact CD1-CB 4.11Å; L224-K232 HydrophobicContact CD1-CD 4.47Å; K230-K232 PolarHBondContact O-N 2.83Å
233	M	75.1	Confident	55.5	Low	64 Å²	64	96.7 Å²	96.7	32%	0.315	52%	0.524	S	S	.	.			trans	-76	148.9	165	-69.5	178.7	171.7	0	0	108.9	N149 F235 I253	N149-M233 WeakPolarHBondContact OD1-CA 3.4Å; M233-F235 PolarHBondContact O-N 3.43Å; M233-I253 HydrophobicContact CE-CD1 3.9Å
234	T	76.5	Confident	52.8	Low	0 Å²	0	99.9 Å²	99.9	0%	0	56%	0.557	C	S	.	*	S	Bend	trans	-55.9	-37.1	172.5	-70	0	0	0	0	111.6	N149 L150 L214 I216	N149-T234 WeakPolarHBondContact CA-OG1 3.49Å; N149-T234 PolarHBondContact OD1-N 2.89Å; L150-T234 HydrophobicContact CB-CG2 3.88Å; L150-T234 HydrophobicContact CD1-CG2 4.16Å; L150-T234 HydrophobicContact CG-CG2 4.02Å; L150-T234 PolarHBondContact N-OG1 3.12Å; L150-T234 PolarHBondContact O-OG1 3.07Å; L214-T234 VanDerWaalsContact O-CA 3.3Å; L214-T234 WeakPolarHBondContact O-CA 3.31Å; L214-T234 WeakPolarHBondContact O-CB 3.45Å; L214-T234 VanDerWaalsContact O-CG2 3.24Å; L214-T234 WeakPolarHBondContact O-CG2 3.33Å; L214-T234 PolarHBondContact O-OG1 3.33Å; I216-T234 PolarHBondContact N-O 3.32Å
235	F	78.1	Confident	50.6	Low	26 Å²	26	107.1 Å²	107.1	11%	0.114	59%	0.59	C	S	.	*	S	Bend	trans	-115.4	98.7	173.7	-53.2	-80	0	0	0	108.5	M140 C143 W144 L150 I216 M233 M237	M140-F235 HydrophobicContact CE-CE1 3.98Å; M140-F235 HydrophobicContact CE-CZ 3.97Å; M140-F235 HydrophobicContact SD-CZ 4.47Å; C143-F235 HydrophobicContact CB-CE2 3.81Å; C143-F235 HydrophobicContact CB-CZ 4.18Å; W144-F235 HydrophobicContact CB-CD1 4.24Å; W144-F235 HydrophobicContact CB-CD2 4.42Å; W144-F235 HydrophobicContact CB-CE1 4.22Å; W144-F235 HydrophobicContact CB-CE2 4.43Å; W144-F235 HydrophobicContact CB-CG 4.33Å; W144-F235 HydrophobicContact CB-CZ 4.32Å; W144-F235 AromaticContact CD1-CD1 3.82Å; W144-F235 AromaticContact CD1-CG 3.7Å; W144-F235 HydrophobicContact CG-CD1 4.28Å; W144-F235 HydrophobicContact CG-CG 4.38Å; L150-F235 HydrophobicContact CD1-CE2 4.29Å; L150-F235 HydrophobicContact CD1-CZ 4.02Å; I216-F235 HydrophobicContact CB-CD1 4.37Å; I216-F235 HydrophobicContact CB-CE1 4.34Å; I216-F235 HydrophobicContact CD1-CE1 3.83Å; I216-F235 HydrophobicContact CD1-CZ 4.27Å; M233-F235 PolarHBondContact O-N 3.43Å; F235-M237 PolarHBondContact O-N 3.03Å
236	P	65.2	Low	48.7	Very low	58 Å²	58	110.7 Å²	110.7	38%	0.377	61%	0.608	S	S	.	*			trans	-62.8	121.4	177	19.3	-25.4	0	0	0	110	I216 E217 R238	I216-P236 WeakPolarHBondContact O-CD 3.37Å; E217-P236 HydrophobicContact CG-CG 3.59Å; P236-R238 PolarHBondContact O-N 3.01Å; P236-R238 VanDerWaalsContact O-N 3.1Å
237	M	55.3	Low	47.1	Very low	119 Å²	119	116.8 Å²	116.8	59%	0.586	62%	0.617	S	S	*	*			trans	-62.8	114	174.7	-85	-169.3	-170.8	0	0	109.7	F235 F239	F235-M237 PolarHBondContact O-N 3.03Å; M237-F239 PolarHBondContact O-N 2.89Å
238	R	45.3	Very low	46.3	Very low	190 Å²	190	122.4 Å²	122.4	72%	0.717	62%	0.622	S	S	*	*			trans	-74.1	105	157.1	-70.4	-174.2	176.6	176.3	1.9	106	D218 P236 V240	D218-R238 IonicContact OD1-CZ 3.7Å; D218-R238 IonicContact OD1-NH2 3.21Å; D218-R238 PolarHBondContact OD1-NH2 2.92Å; D218-R238 IonicContact OD2-NH2 2.65Å; P236-R238 PolarHBondContact O-N 3.01Å; P236-R238 VanDerWaalsContact O-N 3.1Å; R238-V240 VanDerWaalsContact C-N 3.3Å; R238-V240 PolarHBondContact O-N 2.78Å
239	F	37.5	Very low	45.5	Very low	200 Å²	200	123.4 Å²	123.4	88%	0.877	62%	0.623	S	S	*	*			trans	-57	93.3	174.8	-80.4	-89	0	0	0	109.8	M237	M237-F239 PolarHBondContact O-N 2.89Å
240	V	27.9	Very low	44.9	Very low	130 Å²	130	122.8 Å²	122.8	79%	0.788	62%	0.615	S	S	*	*			trans	-107.3	116.1	162.8	-171.7	0	0	0	0	105.1	R238 M242	R238-V240 VanDerWaalsContact C-N 3.3Å; R238-V240 PolarHBondContact O-N 2.78Å; V240-M242 PolarHBondContact O-N 3.37Å
241	G	28.6	Very low	44	Very low	79 Å²	79	118.8 Å²	118.8	81%	0.814	60%	0.601	S	S	*	*			trans	-47.3	117.6	-157.3	0	0	0	0	0	115.6
242	M	25.6	Very low	42.7	Very low	183 Å²	183	116 Å²	116	90%	0.901	60%	0.595	S	S	*	*			trans	-139	146.7	157	-85.3	-168.6	67.2	0	0	110.5	V240	V240-M242 PolarHBondContact O-N 3.37Å
243	S	30.3	Very low	41.3	Very low	101 Å²	101	115 Å²	115	71%	0.706	59%	0.594	S	S	*	*			trans	-67.5	130.8	-161	52.2	0	0	0	0	116	H245	S243-H245 VanDerWaalsContact C-N 3.29Å; S243-H245 PolarHBondContact O-N 2.77Å
244	G	28.7	Very low	39.2	Very low	70 Å²	70	119.5 Å²	119.5	72%	0.722	61%	0.614	S	S	*	*	S	Bend		62.7	-27.9	127.3	0	0	0	0	0	122.4
245	H	32	Very low	37	Very low	180 Å²	180	122.3 Å²	122.3	83%	0.833	63%	0.631	S	S	*	*			trans	-104.7	-5.2	-164.3	-103.2	-59.9	0	0	0	116.2	S243	S243-H245 VanDerWaalsContact C-N 3.29Å; S243-H245 PolarHBondContact O-N 2.77Å
246	L	31.5	Very low	34.6	Very low	109 Å²	109	123.7 Å²	123.7	57%	0.571	65%	0.654	S	S	*	*			trans	-88	1.8	-179.7	-75.5	166.1	0	0	0	114.9	Y248 Q249	L246-Y248 PolarHBondContact O-N 3.26Å; L246-Q249 PolarHBondContact O-N 2.57Å
247	R	28.8	Very low	33.2	Very low	215 Å²	215	124.9 Å²	124.9	81%	0.811	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-8	-174.3	-87.6	-171.7	175.6	-169.9	-0.4	116.1
248	Y	32.9	Very low	32.2	Very low	203 Å²	203	125.4 Å²	125.4	80%	0.796	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-22.7	-177.8	-136.5	-91.1	0	0	0	114.1	L246	L246-Y248 PolarHBondContact O-N 3.26Å
249	Q	31.7	Very low	31.5	Very low	135 Å²	135	122 Å²	122	63%	0.631	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-22.9	178.9	-71.5	-175.9	6.1	0	0	112.9	L246 L251 V252	L246-Q249 PolarHBondContact O-N 2.57Å; Q249-L251 VanDerWaalsContact C-N 3.25Å; Q249-L251 PolarHBondContact O-N 2.87Å; Q249-V252 PolarHBondContact O-N 3.2Å
250	D	33.3	Very low	31.2	Very low	106 Å²	106	118.3 Å²	118.3	57%	0.567	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-16	-179	-70.6	-32.7	0	0	0	114
251	L	32.5	Very low	31.2	Very low	95 Å²	95	119.2 Å²	119.2	50%	0.497	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.8	-16.4	174.2	-99.9	114.3	0	0	0	113.9	Q249 I253	Q249-L251 VanDerWaalsContact C-N 3.25Å; Q249-L251 PolarHBondContact O-N 2.87Å; L251-I253 VanDerWaalsContact C-N 3.35Å
252	V	34.1	Very low	31.4	Very low	77 Å²	77	122.2 Å²	122.2	47%	0.467	64%	0.639	S	S	.	*	G	3₁₀ helix	trans	-81.8	-17.4	-176.1	-177.3	0	0	0	0	111.9	Q249 E254 T255	Q249-V252 PolarHBondContact O-N 3.2Å; V252-E254 PolarHBondContact O-N 3.39Å; V252-T255 PolarHBondContact O-OG1 3.48Å
253	I	36.6	Very low	31.6	Very low	74 Å²	74	119.8 Å²	119.8	38%	0.379	63%	0.63	S	S	.	*	G	3₁₀ helix	trans	-76.6	-7.7	-176.2	-60.1	177.7	0	0	0	112.4	K231 M233 L251 T255	K231-I253 HydrophobicContact CB-CG2 4.44Å; K231-I253 HydrophobicContact CD-CG2 3.57Å; K231-I253 PolarHBondContact NZ-O 2.77Å; M233-I253 HydrophobicContact CE-CD1 3.9Å; L251-I253 VanDerWaalsContact C-N 3.35Å; I253-T255 PolarHBondContact O-N 2.94Å
254	E	31.1	Very low	31.8	Very low	159 Å²	159	120.1 Å²	120.1	74%	0.743	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-87.2	2.4	-178.5	-141.5	170.4	-152.9	0	0	115	V252 G256	V252-E254 PolarHBondContact O-N 3.39Å; E254-G256 PolarHBondContact O-N 2.75Å
255	T	30.6	Very low	32	Very low	59 Å²	59	125.1 Å²	125.1	36%	0.362	64%	0.638	S	S	.	*			trans	-84	82.5	174.7	44.4	0	0	0	0	110.9	V252 I253	V252-T255 PolarHBondContact O-OG1 3.48Å; I253-T255 PolarHBondContact O-N 2.94Å
256	G	27.8	Very low	31.8	Very low	56 Å²	56	119.1 Å²	119.1	58%	0.577	63%	0.625	S	S	*	*			trans	-73.7	124.5	159.8	0	0	0	0	0	110.2	E254	E254-G256 PolarHBondContact O-N 2.75Å
257	S	34.3	Very low	32	Very low	83 Å²	83	121.2 Å²	121.2	58%	0.58	64%	0.643	S	S	*	*			trans	30.6	102.7	151.8	-161.7	0	0	0	0	117.9	I259	S257-I259 PolarHBondContact O-N 2.92Å
258	W	36	Very low	32.7	Very low	130 Å²	130	116.2 Å²	116.2	49%	0.492	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.5	3.9	175.8	-71.9	87.5	0	0	0	117.6	A47 L274 L446	A47-W258 HydrophobicContact CB-CZ2 4.18Å; W258-L274 HydrophobicContact CH2-CD2 3.6Å; W258-L274 HydrophobicContact CZ2-CD2 3.81Å; W258-L446 HydrophobicContact CZ3-CD1 4.49Å
259	I	30.6	Very low	32.9	Very low	117 Å²	117	115.9 Å²	115.9	60%	0.6	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.4	-15	-162.9	-59.8	-178.7	0	0	0	115.4	S257	S257-I259 PolarHBondContact O-N 2.92Å
260	N	29.8	Very low	33.6	Very low	123 Å²	123	111.4 Å²	111.4	66%	0.658	61%	0.613	S	S	*	*	S	Bend	trans	-107.7	-11.4	-166.1	-72.1	-15.7	0	0	0	118.1
261	D	28.8	Very low	34.3	Very low	150 Å²	150	109.4 Å²	109.4	80%	0.802	61%	0.606	S	S	*	*			trans	-128.7	68.2	-179.1	-63.1	-40.5	0	0	0	111.2	D263	D261-D263 PolarHBondContact O-N 3.48Å
262	I	33.2	Very low	34.6	Very low	142 Å²	142	110.7 Å²	110.7	73%	0.728	62%	0.618	S	S	*	*			trans	-89.6	90.1	158.7	-57.1	176.2	0	0	0	106.5
263	D	30	Very low	35.4	Very low	131 Å²	131	109.5 Å²	109.5	70%	0.701	61%	0.607	S	S	*	*			trans	-68	135.8	166.1	-89.4	-33.8	0	0	0	109.5	D261 I265	D261-D263 PolarHBondContact O-N 3.48Å; D263-I265 PolarHBondContact O-N 3.41Å; D263-I265 VanDerWaalsContact O-N 3.11Å
264	P	33.4	Very low	36.5	Very low	109 Å²	109	106.7 Å²	106.7	71%	0.708	59%	0.592	S	S	*	*	S	Bend	trans	-73.4	110.8	-177.7	29	-30.4	0	0	0	109.7
265	I	32.9	Very low	38.7	Very low	174 Å²	174	102.9 Å²	102.9	89%	0.892	58%	0.577	S	S	*	*	S	Bend	trans	69.1	86.8	158	-48.8	171.3	0	0	0	113.9	D263	D263-I265 PolarHBondContact O-N 3.41Å; D263-I265 VanDerWaalsContact O-N 3.11Å
266	G	28.8	Very low	41.5	Very low	55 Å²	55	100.1 Å²	100.1	57%	0.567	56%	0.56	S	S	*	*	S	Bend	trans	-177	111.4	164.1	0	0	0	0	0	110.9	I268	G266-I268 PolarHBondContact O-N 3.18Å
267	T	34.5	Very low	44.4	Very low	153 Å²	153	101.3 Å²	101.3	94%	0.939	55%	0.551	S	S	*	*			trans	8.8	74.8	168.4	-5	0	0	0	0	116.4	K269	T267-K269 PolarHBondContact O-N 3.47Å
268	I	43.5	Very low	46.9	Very low	109 Å²	109	99.5 Å²	99.5	56%	0.559	54%	0.538	S	S	*	.			trans	-75.2	100.6	170.4	-57.3	174.6	0	0	0	106.6	G266 E270	G266-I268 PolarHBondContact O-N 3.18Å; I268-E270 PolarHBondContact O-N 3.27Å
269	K	38.3	Very low	49.4	Very low	196 Å²	196	93.8 Å²	93.8	85%	0.852	52%	0.518	S	S	*	.			trans	-72	107.4	153.9	-107.3	-178.1	174.4	-178.8	0	105	T267	T267-K269 PolarHBondContact O-N 3.47Å
270	E	45	Very low	52.4	Low	41 Å²	41	90.1 Å²	90.1	19%	0.192	50%	0.498	C	S	.	.			trans	-48.4	140.1	164.7	-81.1	-171.7	143.2	0	0	108.1	I268 T272 L274 K449	I268-E270 PolarHBondContact O-N 3.27Å; E270-T272 PolarHBondContact O-N 3.28Å; E270-L274 HydrophobicContact CB-CB 4.19Å; E270-K449 IonicContact OE1-NZ 3.26Å; E270-K449 PolarHBondContact OE1-NZ 2.66Å; E270-K449 IonicContact OE2-NZ 3.66Å; E270-K449 PolarHBondContact OE2-NZ 3.18Å
271	P	47.7	Very low	55.3	Low	65 Å²	65	89 Å²	89	42%	0.422	49%	0.492	S	S	.	.			trans	-47.9	137.2	173	-24.3	30.9	0	0	0	109.6	H273 L274	P271-H273 WeakPolarHBondContact CB-CE1 3.35Å; P271-H273 WeakPolarHBondContact CB-NE2 3.28Å; P271-H273 PolarHBondContact O-N 2.94Å; P271-L274 HydrophobicContact CB-CD1 4.18Å; P271-L274 HydrophobicContact CG-CD1 3.9Å; P271-L274 WeakPolarHBondContact O-CB 3.37Å; P271-L274 PolarHBondContact O-N 3.1Å
272	T	39.7	Very low	58.3	Low	122 Å²	122	84.7 Å²	84.7	75%	0.748	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-57.5	-14.5	-169.8	48	0	0	0	0	115	E270 L274 C278	E270-T272 PolarHBondContact O-N 3.28Å; T272-L274 VanDerWaalsContact C-N 3.34Å; T272-C278 PolarHBondContact O-SG 3.29Å
273	H	50.8	Low	61.1	Low	52 Å²	52	78 Å²	78	24%	0.241	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-83.3	-3.7	174.8	53.9	-97.4	0	0	0	114.3	P271	P271-H273 WeakPolarHBondContact CB-CE1 3.35Å; P271-H273 WeakPolarHBondContact CB-NE2 3.28Å; P271-H273 PolarHBondContact O-N 2.94Å
274	L	59.7	Low	64.1	Low	15 Å²	15	74.3 Å²	74.3	8%	0.079	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-107.4	15.5	179.9	-81	154	0	0	0	113	A47 W258 E270 P271 T272 F398	A47-L274 HydrophobicContact CB-CD2 3.74Å; W258-L274 HydrophobicContact CH2-CD2 3.6Å; W258-L274 HydrophobicContact CZ2-CD2 3.81Å; E270-L274 HydrophobicContact CB-CB 4.19Å; P271-L274 HydrophobicContact CB-CD1 4.18Å; P271-L274 HydrophobicContact CG-CD1 3.9Å; P271-L274 WeakPolarHBondContact O-CB 3.37Å; P271-L274 PolarHBondContact O-N 3.1Å; T272-L274 VanDerWaalsContact C-N 3.34Å; L274-F398 WeakPolarHBondContact O-CD1 3.12Å; L274-F398 WeakPolarHBondContact O-CE1 3.24Å
275	D	77.7	Confident	66.9	Low	78 Å²	78	73.5 Å²	73.5	42%	0.417	40%	0.404	S	S	.	.	S	Bend	trans	-81.4	151.2	171.1	-171.1	9.1	0	0	0	110.8	M277 C278 L279	D275-M277 PolarHBondContact O-N 3.27Å; D275-M277 VanDerWaalsContact O-N 3.16Å; D275-C278 WeakPolarHBondContact O-CB 3.48Å; D275-C278 PolarHBondContact O-N 3.12Å; D275-L279 PolarHBondContact O-N 2.65Å
276	F	88.6	Confident	69.7	Low	2 Å²	2	66.2 Å²	66.2	1%	0.009	37%	0.366	C	S	.	.	H	α-helix	trans	-56.3	-31.7	177.1	177.1	-104.3	0	0	0	111.9	C278 L279 Q280 K391 L394 Q395 F398	F276-C278 VanDerWaalsContact C-N 3.27Å; F276-C278 PolarHBondContact O-N 3.39Å; F276-L279 HydrophobicContact CD2-CD2 4.04Å; F276-L279 HydrophobicContact CE2-CD2 4.12Å; F276-L279 WeakPolarHBondContact O-CB 3.48Å; F276-L279 PolarHBondContact O-N 2.93Å; F276-Q280 HydrophobicContact CE1-CB 4.11Å; F276-Q280 HydrophobicContact CE1-CG 4.48Å; F276-Q280 HydrophobicContact CZ-CB 4.26Å; F276-Q280 WeakPolarHBondContact O-CB 3.35Å; F276-Q280 PolarHBondContact O-N 2.93Å; F276-K391 HydrophobicContact CE1-CG 4.46Å; F276-K391 HydrophobicContact CZ-CG 3.92Å; F276-L394 HydrophobicContact CD2-CB 3.67Å; F276-L394 HydrophobicContact CE2-CB 3.49Å; F276-L394 VanDerWaalsContact CE2-CB 3.49Å; F276-L394 HydrophobicContact CE2-CD1 4.07Å; F276-L394 HydrophobicContact CE2-CG 4.43Å; F276-L394 HydrophobicContact CZ-CB 4.45Å; F276-Q395 HydrophobicContact CD1-CB 3.68Å; F276-Q395 HydrophobicContact CD1-CG 3.74Å; F276-Q395 HydrophobicContact CE1-CB 3.64Å; F276-Q395 HydrophobicContact CE1-CG 3.91Å; F276-Q395 HydrophobicContact CG-CB 4.26Å; F276-Q395 HydrophobicContact CZ-CB 4.18Å; F276-F398 HydrophobicContact CB-CB 3.81Å; F276-F398 HydrophobicContact CB-CD1 4.01Å; F276-F398 HydrophobicContact CB-CG 3.89Å; F276-F398 HydrophobicContact CD2-CD2 4.32Å; F276-F398 HydrophobicContact CD2-CG 4.48Å; F276-F398 VanDerWaalsContact N-CD1 3.26Å
277	M	89	Confident	72.8	Confident	80 Å²	80	64.6 Å²	64.6	39%	0.394	35%	0.345	S	S	.	.	H	α-helix	trans	-59.1	-36.4	175	-69.6	-67.8	122	0	0	112.6	D275 N281	D275-M277 PolarHBondContact O-N 3.27Å; D275-M277 VanDerWaalsContact O-N 3.16Å; M277-N281 VanDerWaalsContact O-CB 3.31Å; M277-N281 WeakPolarHBondContact O-CB 3.41Å; M277-N281 PolarHBondContact O-N 3.49Å; M277-N281 PolarHBondContact O-ND2 3.14Å
278	C	86.7	Confident	75.7	Confident	45 Å²	45	61.8 Å²	61.8	30%	0.304	32%	0.317	S	S	.	.	H	α-helix	trans	-67.9	-46.8	176	-69.1	0	0	0	0	111.1	T272 D275 F276 Q280 N281 E282	T272-C278 PolarHBondContact O-SG 3.29Å; D275-C278 WeakPolarHBondContact O-CB 3.48Å; D275-C278 PolarHBondContact O-N 3.12Å; F276-C278 VanDerWaalsContact C-N 3.27Å; F276-C278 PolarHBondContact O-N 3.39Å; C278-Q280 VanDerWaalsContact C-N 3.32Å; C278-Q280 PolarHBondContact O-N 3.29Å; C278-N281 PolarHBondContact O-N 3.18Å; C278-E282 WeakPolarHBondContact O-CB 3.39Å; C278-E282 PolarHBondContact O-N 3.39Å
279	L	89.6	Confident	78	Confident	11 Å²	11	58 Å²	58	6%	0.058	30%	0.298	C	S	.	.	H	α-helix	trans	-56.3	-48.3	174.1	170.7	63.3	0	0	0	111.1	L46 D275 F276 E282 V283 L394 F398 Y456	L46-L279 HydrophobicContact CD2-CD1 3.31Å; D275-L279 PolarHBondContact O-N 2.65Å; F276-L279 HydrophobicContact CD2-CD2 4.04Å; F276-L279 HydrophobicContact CE2-CD2 4.12Å; F276-L279 WeakPolarHBondContact O-CB 3.48Å; F276-L279 PolarHBondContact O-N 2.93Å; L279-E282 PolarHBondContact O-N 3.04Å; L279-V283 HydrophobicContact CD1-CG2 4.01Å; L279-V283 VanDerWaalsContact O-CG2 3.29Å; L279-V283 WeakPolarHBondContact O-CG2 3.45Å; L279-V283 PolarHBondContact O-N 3.11Å; L279-L394 HydrophobicContact CD2-CD1 4.07Å; L279-F398 HydrophobicContact CB-CZ 4.38Å; L279-F398 HydrophobicContact CD2-CE2 3.78Å; L279-F398 HydrophobicContact CD2-CZ 3.99Å; L279-Y456 HydrophobicContact CD2-CD1 4.28Å; L279-Y456 HydrophobicContact CG-CD1 4.22Å
280	Q	92.4	Very high	80.6	Confident	39 Å²	39	48.6 Å²	48.6	18%	0.182	26%	0.257	C	S	.	.	H	α-helix	trans	-62.2	-47.7	-178.9	-173.3	175.4	23	0	0	111.4	F276 C278 E282 V283 S284	F276-Q280 HydrophobicContact CE1-CB 4.11Å; F276-Q280 HydrophobicContact CE1-CG 4.48Å; F276-Q280 HydrophobicContact CZ-CB 4.26Å; F276-Q280 WeakPolarHBondContact O-CB 3.35Å; F276-Q280 PolarHBondContact O-N 2.93Å; C278-Q280 VanDerWaalsContact C-N 3.32Å; C278-Q280 PolarHBondContact O-N 3.29Å; Q280-E282 VanDerWaalsContact C-N 3.33Å; Q280-E282 PolarHBondContact O-N 3.33Å; Q280-V283 PolarHBondContact O-N 3.16Å; Q280-S284 VanDerWaalsContact O-CB 3.31Å; Q280-S284 WeakPolarHBondContact O-CB 3.39Å; Q280-S284 PolarHBondContact O-N 2.89Å; Q280-S284 PolarHBondContact O-OG 3.36Å
281	N	91.3	Very high	82.8	Confident	100 Å²	100	48.7 Å²	48.7	54%	0.535	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-41.6	177.8	-71.4	-19.6	0	0	0	111.8	M277 C278 S284 E285	M277-N281 VanDerWaalsContact O-CB 3.31Å; M277-N281 WeakPolarHBondContact O-CB 3.41Å; M277-N281 PolarHBondContact O-N 3.49Å; M277-N281 PolarHBondContact O-ND2 3.14Å; C278-N281 PolarHBondContact O-N 3.18Å; N281-S284 PolarHBondContact O-N 2.85Å; N281-E285 WeakPolarHBondContact O-CB 3.37Å; N281-E285 WeakPolarHBondContact O-CG 3.47Å; N281-E285 PolarHBondContact O-N 2.74Å
282	E	90.7	Very high	84.9	Confident	60 Å²	60	49.8 Å²	49.8	28%	0.28	26%	0.264	S	S	.	.	H	α-helix	trans	-60.9	-51.4	177.3	-174.9	176.6	150.8	0	0	111.2	L46 C278 L279 Q280 S284 E285 Q286 Y358	L46-E282 WeakPolarHBondContact CA-OE1 3.45Å; L46-E282 HydrophobicContact CD2-CG 4.28Å; L46-E282 WeakPolarHBondContact CD2-OE1 3.44Å; L46-E282 VanDerWaalsContact CG-OE1 3.25Å; L46-E282 WeakPolarHBondContact CG-OE1 3.47Å; L46-E282 PolarHBondContact N-OE1 3.21Å; C278-E282 WeakPolarHBondContact O-CB 3.39Å; C278-E282 PolarHBondContact O-N 3.39Å; L279-E282 PolarHBondContact O-N 3.04Å; Q280-E282 VanDerWaalsContact C-N 3.33Å; Q280-E282 PolarHBondContact O-N 3.33Å; E282-S284 VanDerWaalsContact C-N 3.35Å; E282-S284 PolarHBondContact O-N 3.23Å; E282-E285 PolarHBondContact O-N 2.9Å; E282-Q286 WeakPolarHBondContact O-CG 3.46Å; E282-Q286 PolarHBondContact O-N 3.08Å; E282-Y358 HydrophobicContact CG-CE2 4.11Å; E282-Y358 WeakPolarHBondContact OE1-CE2 3.48Å
283	V	92.8	Very high	87.3	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.012	24%	0.235	C	C	.	.	H	α-helix	trans	-58.9	-47	177.2	173.7	0	0	0	0	110.5	L279 Q280 E285 Q286 T287 Y358 Y456	L279-V283 HydrophobicContact CD1-CG2 4.01Å; L279-V283 VanDerWaalsContact O-CG2 3.29Å; L279-V283 WeakPolarHBondContact O-CG2 3.45Å; L279-V283 PolarHBondContact O-N 3.11Å; Q280-V283 PolarHBondContact O-N 3.16Å; V283-E285 PolarHBondContact O-N 3.49Å; V283-Q286 PolarHBondContact O-N 3.33Å; V283-T287 HydrophobicContact CG1-CG2 4.43Å; V283-T287 WeakPolarHBondContact O-CG2 3.29Å; V283-T287 PolarHBondContact O-N 3.41Å; V283-T287 PolarHBondContact O-OG1 2.87Å; V283-T287 VanDerWaalsContact O-OG1 3.09Å; V283-Y358 WeakPolarHBondContact CG2-OH 3.4Å; V283-Y456 HydrophobicContact CB-CD1 4.46Å; V283-Y456 HydrophobicContact CB-CE1 3.92Å; V283-Y456 HydrophobicContact CG1-CD1 4.44Å; V283-Y456 HydrophobicContact CG1-CE1 3.94Å; V283-Y456 HydrophobicContact CG2-CD1 3.83Å; V283-Y456 HydrophobicContact CG2-CE1 3.76Å
284	S	93.5	Very high	89.2	Confident	53 Å²	53	45.9 Å²	45.9	37%	0.371	25%	0.246	S	C	.	.	H	α-helix	trans	-61.2	-41.9	-179.9	-68.6	0	0	0	0	112.9	Q280 N281 E282 T287 R288	Q280-S284 VanDerWaalsContact O-CB 3.31Å; Q280-S284 WeakPolarHBondContact O-CB 3.39Å; Q280-S284 PolarHBondContact O-N 2.89Å; Q280-S284 PolarHBondContact O-OG 3.36Å; N281-S284 PolarHBondContact O-N 2.85Å; E282-S284 VanDerWaalsContact C-N 3.35Å; E282-S284 PolarHBondContact O-N 3.23Å; S284-T287 WeakPolarHBondContact CA-OG1 3.5Å; S284-T287 PolarHBondContact O-N 2.85Å; S284-T287 PolarHBondContact O-OG1 3.35Å; S284-R288 VanDerWaalsContact O-CB 3.31Å; S284-R288 WeakPolarHBondContact O-CB 3.29Å; S284-R288 PolarHBondContact O-N 3.44Å
285	E	92.2	Very high	90.8	Very high	91 Å²	91	50.2 Å²	50.2	43%	0.425	26%	0.264	S	S	.	.	H	α-helix	trans	-64.6	-43.4	175.5	-77.6	-57.6	130.2	0	0	111.7	N281 E282 V283 R288 L289	N281-E285 WeakPolarHBondContact O-CB 3.37Å; N281-E285 WeakPolarHBondContact O-CG 3.47Å; N281-E285 PolarHBondContact O-N 2.74Å; E282-E285 PolarHBondContact O-N 2.9Å; V283-E285 PolarHBondContact O-N 3.49Å; E285-R288 PolarHBondContact O-N 3.47Å; E285-R288 IonicContact OE1-NE 2.89Å; E285-R288 IonicContact OE2-CZ 3.83Å; E285-R288 IonicContact OE2-NE 2.7Å; E285-R288 PolarHBondContact OE2-NE 3.37Å; E285-R288 IonicContact OE2-NH2 3.55Å; E285-R288 PolarHBondContact OE2-NH2 3.49Å; E285-L289 VanDerWaalsContact O-CG 3.28Å; E285-L289 WeakPolarHBondContact O-CG 3.35Å; E285-L289 PolarHBondContact O-N 3.27Å
286	Q	92.1	Very high	91.5	Very high	21 Å²	21	52.2 Å²	52.2	10%	0.098	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-44	177.2	-62.3	-45.8	-72.1	0	0	111.7	E282 V283 R288 L289 L290 L355 Y358 F461	E282-Q286 WeakPolarHBondContact O-CG 3.46Å; E282-Q286 PolarHBondContact O-N 3.08Å; V283-Q286 PolarHBondContact O-N 3.33Å; Q286-R288 VanDerWaalsContact C-N 3.32Å; Q286-R288 PolarHBondContact O-N 2.83Å; Q286-L289 PolarHBondContact O-N 3.49Å; Q286-L290 WeakPolarHBondContact O-CB 3.48Å; Q286-L290 PolarHBondContact O-N 3.5Å; Q286-L355 HydrophobicContact CB-CD2 4.37Å; Q286-Y358 HydrophobicContact CB-CD1 4.06Å; Q286-Y358 HydrophobicContact CB-CE1 3.98Å; Q286-Y358 HydrophobicContact CB-CG 4.44Å; Q286-Y358 HydrophobicContact CG-CD1 3.85Å; Q286-Y358 HydrophobicContact CG-CD2 3.7Å; Q286-Y358 HydrophobicContact CG-CE1 3.83Å; Q286-Y358 HydrophobicContact CG-CE2 3.66Å; Q286-Y358 HydrophobicContact CG-CG 3.77Å; Q286-F461 HydrophobicContact CB-CD2 4.45Å; Q286-F461 HydrophobicContact CB-CE2 4.16Å
287	T	93.5	Very high	91.7	Very high	22 Å²	22	53.1 Å²	53.1	14%	0.135	28%	0.281	C	S	.	.	H	α-helix	trans	-65.3	-35.7	177.1	51.4	0	0	0	0	112.3	V283 S284 L290 A291 Q464	V283-T287 HydrophobicContact CG1-CG2 4.43Å; V283-T287 WeakPolarHBondContact O-CG2 3.29Å; V283-T287 PolarHBondContact O-N 3.41Å; V283-T287 PolarHBondContact O-OG1 2.87Å; V283-T287 VanDerWaalsContact O-OG1 3.09Å; S284-T287 WeakPolarHBondContact CA-OG1 3.5Å; S284-T287 PolarHBondContact O-N 2.85Å; S284-T287 PolarHBondContact O-OG1 3.35Å; T287-L290 WeakPolarHBondContact O-CB 3.28Å; T287-L290 PolarHBondContact O-N 2.96Å; T287-A291 PolarHBondContact O-N 3.43Å; T287-Q464 HydrophobicContact CG2-CB 4.3Å
288	R	94.3	Very high	91.9	Very high	93 Å²	93	49.4 Å²	49.4	35%	0.351	26%	0.262	S	S	.	.	H	α-helix	trans	-64.2	-48.7	176.2	-174.4	-171.1	63.9	65.6	5	111.4	S284 E285 Q286 L290 A291 E292	S284-R288 VanDerWaalsContact O-CB 3.31Å; S284-R288 WeakPolarHBondContact O-CB 3.29Å; S284-R288 PolarHBondContact O-N 3.44Å; E285-R288 PolarHBondContact O-N 3.47Å; E285-R288 IonicContact OE1-NE 2.89Å; E285-R288 IonicContact OE2-CZ 3.83Å; E285-R288 IonicContact OE2-NE 2.7Å; E285-R288 PolarHBondContact OE2-NE 3.37Å; E285-R288 IonicContact OE2-NH2 3.55Å; E285-R288 PolarHBondContact OE2-NH2 3.49Å; Q286-R288 VanDerWaalsContact C-N 3.32Å; Q286-R288 PolarHBondContact O-N 2.83Å; R288-L290 PolarHBondContact O-N 3.49Å; R288-A291 WeakPolarHBondContact O-CB 3.48Å; R288-A291 PolarHBondContact O-N 3.29Å; R288-E292 IonicContact CZ-OE1 3.48Å; R288-E292 VanDerWaalsContact NH1-CD 3.28Å; R288-E292 IonicContact NH1-OE1 3.87Å; R288-E292 PolarHBondContact NH1-OE1 3.34Å; R288-E292 IonicContact NH1-OE2 2.78Å; R288-E292 PolarHBondContact NH1-OE2 3.43Å; R288-E292 WeakPolarHBondContact O-CG 3.46Å; R288-E292 PolarHBondContact O-N 2.9Å
289	L	92.5	Very high	92.3	Very high	29 Å²	29	53.3 Å²	53.3	15%	0.152	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-37.1	176.6	-69	171.7	0	0	0	111.7	E285 Q286 E292 W349 I350 L355	E285-L289 VanDerWaalsContact O-CG 3.28Å; E285-L289 WeakPolarHBondContact O-CG 3.35Å; E285-L289 PolarHBondContact O-N 3.27Å; Q286-L289 PolarHBondContact O-N 3.49Å; L289-E292 PolarHBondContact O-N 3.48Å; L289-W349 HydrophobicContact CD2-CE3 4.09Å; L289-W349 HydrophobicContact CD2-CH2 3.81Å; L289-W349 HydrophobicContact CD2-CZ3 3.3Å; L289-I350 HydrophobicContact CB-CG2 4.31Å; L289-I350 HydrophobicContact CD2-CG1 4.13Å; L289-L355 HydrophobicContact CB-CD1 4.23Å; L289-L355 HydrophobicContact CB-CD2 3.87Å; L289-L355 HydrophobicContact CD1-CD2 4.34Å
290	L	92.1	Very high	92.5	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-65.6	-40.6	176.5	-169.7	71.6	0	0	0	112.4	Q286 T287 R288 E292 L293 Q298 L355 F461 Q464 L465	Q286-L290 WeakPolarHBondContact O-CB 3.48Å; Q286-L290 PolarHBondContact O-N 3.5Å; T287-L290 WeakPolarHBondContact O-CB 3.28Å; T287-L290 PolarHBondContact O-N 2.96Å; R288-L290 PolarHBondContact O-N 3.49Å; L290-E292 PolarHBondContact O-N 3.16Å; L290-L293 HydrophobicContact CD1-CD1 3.7Å; L290-L293 WeakPolarHBondContact O-CB 3.15Å; L290-L293 WeakPolarHBondContact O-CG 3.37Å; L290-L293 PolarHBondContact O-N 3.09Å; L290-Q298 PolarHBondContact O-NE2 2.89Å; L290-L355 HydrophobicContact CD1-CD1 4.23Å; L290-F461 HydrophobicContact CB-CZ 4.43Å; L290-F461 HydrophobicContact CD1-CE1 3.58Å; L290-F461 HydrophobicContact CD1-CZ 3.65Å; L290-F461 HydrophobicContact CD2-CD1 3.34Å; L290-F461 HydrophobicContact CD2-CD2 4.34Å; L290-F461 HydrophobicContact CD2-CE1 3.19Å; L290-F461 HydrophobicContact CD2-CE2 4.2Å; L290-F461 HydrophobicContact CD2-CG 3.97Å; L290-F461 HydrophobicContact CD2-CZ 3.66Å; L290-F461 HydrophobicContact CG-CE1 3.98Å; L290-F461 HydrophobicContact CG-CZ 4.14Å; L290-Q464 HydrophobicContact CB-CG 4.34Å; L290-Q464 HydrophobicContact CD2-CB 4.15Å; L290-Q464 HydrophobicContact CD2-CG 3.95Å; L290-Q464 HydrophobicContact CG-CG 4.4Å; L290-L465 HydrophobicContact CD1-CD2 3.98Å; L290-L465 HydrophobicContact CD2-CD1 4.35Å; L290-L465 HydrophobicContact CD2-CD2 3.61Å; L290-L465 HydrophobicContact CD2-CG 3.58Å; L290-L465 HydrophobicContact CG-CD2 3.92Å; L290-L465 HydrophobicContact CG-CG 4.43Å
291	A	92.5	Very high	92.7	Very high	42 Å²	42	52.6 Å²	52.6	35%	0.347	28%	0.275	S	S	.	.	H	α-helix	trans	-63.8	-24.2	178.2	0	0	0	0	0	113.2	T287 R288 Q298 Q464	T287-A291 PolarHBondContact O-N 3.43Å; R288-A291 WeakPolarHBondContact O-CB 3.48Å; R288-A291 PolarHBondContact O-N 3.29Å; A291-Q298 PolarHBondContact O-NE2 3.35Å; A291-Q464 HydrophobicContact CB-CG 4.29Å
292	E	91.7	Very high	92.9	Very high	88 Å²	88	49.5 Å²	49.5	41%	0.411	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-9.3	179.6	-69.9	168.2	173.7	0	0	113.6	R288 L289 L290 W349 I350	R288-E292 IonicContact CZ-OE1 3.48Å; R288-E292 VanDerWaalsContact NH1-CD 3.28Å; R288-E292 IonicContact NH1-OE1 3.87Å; R288-E292 PolarHBondContact NH1-OE1 3.34Å; R288-E292 IonicContact NH1-OE2 2.78Å; R288-E292 PolarHBondContact NH1-OE2 3.43Å; R288-E292 WeakPolarHBondContact O-CG 3.46Å; R288-E292 PolarHBondContact O-N 2.9Å; L289-E292 PolarHBondContact O-N 3.48Å; L290-E292 PolarHBondContact O-N 3.16Å; E292-W349 WeakPolarHBondContact OE2-CH2 3.39Å; E292-W349 WeakPolarHBondContact OE2-CZ2 3.5Å; E292-I350 HydrophobicContact CB-CD1 3.5Å; E292-I350 VanDerWaalsContact CB-CD1 3.5Å
293	L	90.1	Very high	93.1	Very high	26 Å²	26	48.5 Å²	48.5	14%	0.136	26%	0.256	C	S	.	.	S	Bend	trans	-65.8	157.6	170	-61.9	178.9	0	0	0	110.9	L290 V297 Q298 I350 L352 L355	L290-L293 HydrophobicContact CD1-CD1 3.7Å; L290-L293 WeakPolarHBondContact O-CB 3.15Å; L290-L293 WeakPolarHBondContact O-CG 3.37Å; L290-L293 PolarHBondContact O-N 3.09Å; L293-V297 HydrophobicContact CB-CG1 4.49Å; L293-V297 HydrophobicContact CD1-CG1 4.08Å; L293-Q298 HydrophobicContact CB-CG 3.92Å; L293-Q298 PolarHBondContact O-NE2 2.97Å; L293-I350 HydrophobicContact CD2-CG2 3.82Å; L293-L352 HydrophobicContact CD1-CD1 3.64Å; L293-L355 HydrophobicContact CD1-CD1 4.16Å; L293-L355 HydrophobicContact CG-CD1 4.45Å
294	S	91.1	Very high	93.2	Very high	67 Å²	67	48.4 Å²	48.4	47%	0.469	26%	0.256	S	S	.	.			trans	-62.7	149.2	172.5	67.2	0	0	0	0	111.2	D296 V297 Q298	S294-D296 VanDerWaalsContact C-N 3.27Å; S294-D296 PolarHBondContact O-N 3.22Å; S294-V297 PolarHBondContact O-N 2.86Å; S294-V297 VanDerWaalsContact O-N 3.12Å; S294-V297 VanDerWaalsContact OG-CG2 3.22Å; S294-V297 WeakPolarHBondContact OG-CG2 3.41Å; S294-V297 PolarHBondContact OG-N 3.23Å; S294-Q298 WeakPolarHBondContact O-CG 3.36Å; S294-Q298 PolarHBondContact O-N 3.31Å
295	K	92.2	Very high	93.3	Very high	106 Å²	106	45.9 Å²	45.9	46%	0.461	24%	0.238	S	C	.	.	H	α-helix	trans	-58.7	-39.6	179.7	-64.8	-53.2	-158	156.2	0	112.3	V297 Q298 E299 E467 A468	K295-V297 VanDerWaalsContact C-N 3.33Å; K295-V297 PolarHBondContact O-N 2.99Å; K295-Q298 PolarHBondContact O-N 3Å; K295-E299 WeakPolarHBondContact O-CB 3.3Å; K295-E299 PolarHBondContact O-N 3.35Å; K295-E467 PolarHBondContact NZ-O 3.24Å; K295-A468 HydrophobicContact CD-CB 4.44Å; K295-A468 WeakPolarHBondContact CD-OXT 3.42Å; K295-A468 WeakPolarHBondContact CE-OXT 3.24Å; K295-A468 VanDerWaalsContact NZ-CA 3.29Å; K295-A468 PolarHBondContact NZ-OXT 2.65Å
296	D	92	Very high	93.4	Very high	119 Å²	119	43.9 Å²	43.9	64%	0.636	23%	0.23	S	C	*	.	H	α-helix	trans	-58.1	-43.7	175.5	-59.2	-16.3	0	0	0	112	S294 E299 V300	S294-D296 VanDerWaalsContact C-N 3.27Å; S294-D296 PolarHBondContact O-N 3.22Å; D296-E299 PolarHBondContact O-N 3.38Å; D296-V300 WeakPolarHBondContact O-CG2 3.08Å; D296-V300 PolarHBondContact O-N 3.09Å
297	V	92.8	Very high	93.4	Very high	22 Å²	22	49.6 Å²	49.6	13%	0.133	26%	0.256	C	S	.	.	H	α-helix	trans	-67.7	-44.1	177.7	172.3	0	0	0	0	110.3	L293 S294 K295 E299 V300 V301 L352	L293-V297 HydrophobicContact CB-CG1 4.49Å; L293-V297 HydrophobicContact CD1-CG1 4.08Å; S294-V297 PolarHBondContact O-N 2.86Å; S294-V297 VanDerWaalsContact O-N 3.12Å; S294-V297 VanDerWaalsContact OG-CG2 3.22Å; S294-V297 WeakPolarHBondContact OG-CG2 3.41Å; S294-V297 PolarHBondContact OG-N 3.23Å; K295-V297 VanDerWaalsContact C-N 3.33Å; K295-V297 PolarHBondContact O-N 2.99Å; V297-E299 VanDerWaalsContact C-N 3.33Å; V297-E299 PolarHBondContact O-N 3.46Å; V297-V300 PolarHBondContact O-N 2.92Å; V297-V301 HydrophobicContact CG1-CG2 4.22Å; V297-V301 WeakPolarHBondContact O-CB 3.35Å; V297-V301 VanDerWaalsContact O-CG2 3.23Å; V297-V301 WeakPolarHBondContact O-CG2 3.16Å; V297-V301 PolarHBondContact O-N 3.35Å; V297-L352 HydrophobicContact CG1-CD1 4.22Å; V297-L352 HydrophobicContact CG1-CD2 4.01Å
298	Q	94.1	Very high	93.4	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-59.9	-42.6	177.3	-66.6	-176.7	50.5	0	0	111.5	L290 A291 L293 S294 K295 V301 F302 L465 A468	L290-Q298 PolarHBondContact O-NE2 2.89Å; A291-Q298 PolarHBondContact O-NE2 3.35Å; L293-Q298 HydrophobicContact CB-CG 3.92Å; L293-Q298 PolarHBondContact O-NE2 2.97Å; S294-Q298 WeakPolarHBondContact O-CG 3.36Å; S294-Q298 PolarHBondContact O-N 3.31Å; K295-Q298 PolarHBondContact O-N 3Å; Q298-V301 PolarHBondContact O-N 2.98Å; Q298-F302 WeakPolarHBondContact O-CB 3.22Å; Q298-F302 PolarHBondContact O-N 3.38Å; Q298-L465 HydrophobicContact CB-CD2 4.22Å; Q298-L465 HydrophobicContact CG-CD2 4.49Å; Q298-A468 HydrophobicContact CB-CB 3.55Å; Q298-A468 HydrophobicContact CG-CB 4.47Å
299	E	94.7	Very high	93.3	Very high	127 Å²	127	44.2 Å²	44.2	59%	0.593	23%	0.233	S	C	*	.	H	α-helix	trans	-64.1	-44.2	178	-173.5	-178.1	176.1	0	0	112	K295 D296 V297 F302 S303	K295-E299 WeakPolarHBondContact O-CB 3.3Å; K295-E299 PolarHBondContact O-N 3.35Å; D296-E299 PolarHBondContact O-N 3.38Å; V297-E299 VanDerWaalsContact C-N 3.33Å; V297-E299 PolarHBondContact O-N 3.46Å; E299-F302 PolarHBondContact O-N 2.99Å; E299-S303 VanDerWaalsContact O-CB 3.29Å; E299-S303 WeakPolarHBondContact O-CB 3.43Å; E299-S303 PolarHBondContact O-N 2.72Å; E299-S303 PolarHBondContact O-OG 2.97Å
300	V	94.9	Very high	93	Very high	36 Å²	36	46.1 Å²	46.1	22%	0.218	25%	0.248	C	C	.	.	H	α-helix	trans	-63.3	-45.7	176.5	172.8	0	0	0	0	110.7	D296 V297 S303 S304 K336 E340	D296-V300 WeakPolarHBondContact O-CG2 3.08Å; D296-V300 PolarHBondContact O-N 3.09Å; V297-V300 PolarHBondContact O-N 2.92Å; V300-S303 PolarHBondContact O-OG 2.82Å; V300-S304 WeakPolarHBondContact O-CB 3.49Å; V300-S304 PolarHBondContact O-N 3.43Å; V300-S304 PolarHBondContact O-OG 2.99Å; V300-K336 HydrophobicContact CG1-CB 4.06Å; V300-E340 HydrophobicContact CB-CG 4.1Å; V300-E340 HydrophobicContact CG1-CG 3.64Å
301	V	94.9	Very high	92.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-49	178	169.7	0	0	0	0	110.5	V297 Q298 S304 F305 L352 I356 L465	V297-V301 HydrophobicContact CG1-CG2 4.22Å; V297-V301 WeakPolarHBondContact O-CB 3.35Å; V297-V301 VanDerWaalsContact O-CG2 3.23Å; V297-V301 WeakPolarHBondContact O-CG2 3.16Å; V297-V301 PolarHBondContact O-N 3.35Å; Q298-V301 PolarHBondContact O-N 2.98Å; V301-S304 PolarHBondContact O-N 2.95Å; V301-F305 HydrophobicContact CG1-CD2 3.69Å; V301-F305 HydrophobicContact CG1-CE2 3.73Å; V301-F305 VanDerWaalsContact O-CD2 3.27Å; V301-F305 WeakPolarHBondContact O-CD2 3.35Å; V301-F305 PolarHBondContact O-N 3.2Å; V301-L352 HydrophobicContact CG2-CD1 4.45Å; V301-I356 HydrophobicContact CB-CD1 4.31Å; V301-I356 HydrophobicContact CG1-CD1 3.48Å; V301-I356 VanDerWaalsContact CG1-CD1 3.48Å; V301-I356 HydrophobicContact CG2-CD1 3.78Å; V301-L465 HydrophobicContact CB-CD2 4.42Å; V301-L465 HydrophobicContact CG1-CD1 3.92Å; V301-L465 HydrophobicContact CG1-CD2 4.07Å
302	F	95.9	Very high	92.6	Very high	35 Å²	35	50.1 Å²	50.1	15%	0.154	26%	0.26	C	S	.	.	H	α-helix	trans	-61	-56	-178.9	-176	-125.6	0	0	0	112.3	Q298 E299 S304 F305 L306 V378 L465	Q298-F302 WeakPolarHBondContact O-CB 3.22Å; Q298-F302 PolarHBondContact O-N 3.38Å; E299-F302 PolarHBondContact O-N 2.99Å; F302-S304 PolarHBondContact O-N 3.33Å; F302-F305 PolarHBondContact O-N 3.27Å; F302-F305 VanDerWaalsContact O-N 3.16Å; F302-L306 HydrophobicContact CD1-CD1 4.08Å; F302-L306 HydrophobicContact CD2-CD1 4.5Å; F302-L306 HydrophobicContact CD2-CG 4.31Å; F302-L306 HydrophobicContact CE1-CD1 3.61Å; F302-L306 HydrophobicContact CE1-CG 4.41Å; F302-L306 HydrophobicContact CE2-CD1 4.09Å; F302-L306 HydrophobicContact CE2-CD2 4.04Å; F302-L306 HydrophobicContact CE2-CG 4.07Å; F302-L306 HydrophobicContact CZ-CD1 3.64Å; F302-L306 HydrophobicContact CZ-CD2 4.24Å; F302-L306 HydrophobicContact CZ-CG 4.14Å; F302-L306 WeakPolarHBondContact O-CG 3.19Å; F302-L306 PolarHBondContact O-N 3.37Å; F302-V378 HydrophobicContact CE2-CG1 4.15Å; F302-V378 HydrophobicContact CZ-CG1 3.55Å; F302-L465 HydrophobicContact CB-CB 3.9Å; F302-L465 HydrophobicContact CB-CD1 4.47Å; F302-L465 HydrophobicContact CD2-CB 3.44Å; F302-L465 VanDerWaalsContact CD2-CB 3.44Å; F302-L465 HydrophobicContact CD2-CD1 4.33Å; F302-L465 HydrophobicContact CD2-CG 4.5Å; F302-L465 HydrophobicContact CE2-CB 4.21Å; F302-L465 HydrophobicContact CG-CB 3.92Å
303	S	94.8	Very high	92.4	Very high	38 Å²	38	50.5 Å²	50.5	27%	0.266	27%	0.265	S	S	.	.	H	α-helix	trans	-57.8	-38.7	179.5	59.7	0	0	0	0	111.2	E299 V300 L306 H307	E299-S303 VanDerWaalsContact O-CB 3.29Å; E299-S303 WeakPolarHBondContact O-CB 3.43Å; E299-S303 PolarHBondContact O-N 2.72Å; E299-S303 PolarHBondContact O-OG 2.97Å; V300-S303 PolarHBondContact O-OG 2.82Å; S303-L306 PolarHBondContact O-N 3.34Å; S303-H307 PolarHBondContact O-CD2 3.09Å; S303-H307 PolarHBondContact O-N 3.21Å
304	S	95.8	Very high	92.5	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.007	27%	0.268	C	S	.	.	H	α-helix	trans	-66.2	-45.9	178.2	-59.7	0	0	0	0	112	V300 V301 F302 H307 M308 P333	V300-S304 WeakPolarHBondContact O-CB 3.49Å; V300-S304 PolarHBondContact O-N 3.43Å; V300-S304 PolarHBondContact O-OG 2.99Å; V301-S304 PolarHBondContact O-N 2.95Å; F302-S304 PolarHBondContact O-N 3.33Å; S304-H307 PolarHBondContact O-N 3.06Å; S304-M308 VanDerWaalsContact O-CG 3.29Å; S304-M308 WeakPolarHBondContact O-CG 3.36Å; S304-M308 PolarHBondContact O-N 3.29Å; S304-P333 WeakPolarHBondContact CB-O 3.46Å; S304-P333 PolarHBondContact OG-O 3.28Å
305	F	95.7	Very high	92.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62	-43.8	175.7	-86.8	-67.2	0	0	0	112.4	V301 F302 H307 M308 L309 L315 I337 I356 L359 L360 L363	V301-F305 HydrophobicContact CG1-CD2 3.69Å; V301-F305 HydrophobicContact CG1-CE2 3.73Å; V301-F305 VanDerWaalsContact O-CD2 3.27Å; V301-F305 WeakPolarHBondContact O-CD2 3.35Å; V301-F305 PolarHBondContact O-N 3.2Å; F302-F305 PolarHBondContact O-N 3.27Å; F302-F305 VanDerWaalsContact O-N 3.16Å; F305-H307 PolarHBondContact O-N 3.08Å; F305-M308 HydrophobicContact CD1-CE 3.97Å; F305-M308 HydrophobicContact CE1-CE 4.27Å; F305-M308 HydrophobicContact CG-CE 4.36Å; F305-M308 CarbonylContact O-C 3.48Å; F305-M308 PolarHBondContact O-N 3.21Å; F305-L309 WeakPolarHBondContact O-CG 3.22Å; F305-L309 PolarHBondContact O-N 2.77Å; F305-L315 HydrophobicContact CD1-CD2 3.98Å; F305-L315 HydrophobicContact CE1-CD2 4.05Å; F305-I337 HydrophobicContact CD2-CD1 4.3Å; F305-I337 HydrophobicContact CE2-CD1 4.11Å; F305-I337 HydrophobicContact CZ-CD1 4.43Å; F305-I356 HydrophobicContact CE2-CD1 3.86Å; F305-I356 HydrophobicContact CE2-CG2 4.4Å; F305-I356 HydrophobicContact CZ-CD1 4.49Å; F305-I356 HydrophobicContact CZ-CG2 4.02Å; F305-L359 HydrophobicContact CD1-CD2 4.03Å; F305-L359 HydrophobicContact CD2-CD2 3.65Å; F305-L359 HydrophobicContact CE1-CD2 3.88Å; F305-L359 HydrophobicContact CE1-CG 4.11Å; F305-L359 HydrophobicContact CE2-CD2 3.49Å; F305-L359 VanDerWaalsContact CE2-CD2 3.49Å; F305-L359 HydrophobicContact CE2-CG 4.35Å; F305-L359 HydrophobicContact CG-CD2 3.93Å; F305-L359 HydrophobicContact CZ-CB 4.29Å; F305-L359 HydrophobicContact CZ-CD2 3.61Å; F305-L359 HydrophobicContact CZ-CG 3.99Å; F305-L360 HydrophobicContact CE1-CD2 3.67Å; F305-L360 HydrophobicContact CE1-CG 3.99Å; F305-L360 HydrophobicContact CZ-CD2 4.2Å; F305-L360 HydrophobicContact CZ-CG 4.03Å; F305-L363 HydrophobicContact CD1-CD1 3.95Å; F305-L363 HydrophobicContact CE1-CD1 3.95Å
306	L	93	Very high	92.6	Very high	48 Å²	48	43.4 Å²	43.4	25%	0.251	23%	0.227	S	C	.	.	H	α-helix	trans	-56.3	-40	177.7	-69.4	-176.7	0	0	0	112.7	F302 S303 M308 L309 V378	F302-L306 HydrophobicContact CD1-CD1 4.08Å; F302-L306 HydrophobicContact CD2-CD1 4.5Å; F302-L306 HydrophobicContact CD2-CG 4.31Å; F302-L306 HydrophobicContact CE1-CD1 3.61Å; F302-L306 HydrophobicContact CE1-CG 4.41Å; F302-L306 HydrophobicContact CE2-CD1 4.09Å; F302-L306 HydrophobicContact CE2-CD2 4.04Å; F302-L306 HydrophobicContact CE2-CG 4.07Å; F302-L306 HydrophobicContact CZ-CD1 3.64Å; F302-L306 HydrophobicContact CZ-CD2 4.24Å; F302-L306 HydrophobicContact CZ-CG 4.14Å; F302-L306 WeakPolarHBondContact O-CG 3.19Å; F302-L306 PolarHBondContact O-N 3.37Å; S303-L306 PolarHBondContact O-N 3.34Å; L306-M308 VanDerWaalsContact C-N 3.3Å; L306-M308 PolarHBondContact O-N 2.74Å; L306-L309 HydrophobicContact CD2-CD1 4.06Å; L306-V378 HydrophobicContact CD1-CG1 4.13Å; L306-V378 HydrophobicContact CD2-CB 3.85Å; L306-V378 HydrophobicContact CD2-CG1 3.73Å; L306-V378 HydrophobicContact CD2-CG2 3.59Å
307	H	91.9	Very high	92.6	Very high	141 Å²	141	40.6 Å²	40.6	65%	0.653	21%	0.212	S	C	*	.	H	α-helix	trans	-72	-21.7	176.2	-74.6	-60.7	0	0	0	114	S303 S304 F305 P333	S303-H307 PolarHBondContact O-CD2 3.09Å; S303-H307 PolarHBondContact O-N 3.21Å; S304-H307 PolarHBondContact O-N 3.06Å; F305-H307 PolarHBondContact O-N 3.08Å; H307-P333 HydrophobicContact CB-CB 4.12Å; H307-P333 HydrophobicContact CB-CG 3.57Å
308	M	94.6	Very high	92.7	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-99.2	-15	-178.9	-63.9	-176.3	-56.5	0	0	114	S304 F305 L306 C310 D311 V314 L315 L318 P333 G334 I337	S304-M308 VanDerWaalsContact O-CG 3.29Å; S304-M308 WeakPolarHBondContact O-CG 3.36Å; S304-M308 PolarHBondContact O-N 3.29Å; F305-M308 HydrophobicContact CD1-CE 3.97Å; F305-M308 HydrophobicContact CE1-CE 4.27Å; F305-M308 HydrophobicContact CG-CE 4.36Å; F305-M308 CarbonylContact O-C 3.48Å; F305-M308 PolarHBondContact O-N 3.21Å; L306-M308 VanDerWaalsContact C-N 3.3Å; L306-M308 PolarHBondContact O-N 2.74Å; M308-C310 PolarHBondContact O-N 2.96Å; M308-C310 VanDerWaalsContact O-N 3.15Å; M308-D311 CarbonylContact O-C 3.57Å; M308-D311 WeakPolarHBondContact O-CA 3.12Å; M308-D311 PolarHBondContact O-N 2.92Å; M308-V314 HydrophobicContact CB-CG1 4.47Å; M308-V314 HydrophobicContact CG-CG1 3.75Å; M308-V314 HydrophobicContact SD-CG1 3.59Å; M308-V314 VanDerWaalsContact SD-CG1 3.59Å; M308-L315 HydrophobicContact CB-CD2 3.68Å; M308-L315 HydrophobicContact CB-CG 4.05Å; M308-L315 HydrophobicContact CE-CD2 4.13Å; M308-L315 WeakPolarHBondContact O-CG 3.26Å; M308-L318 HydrophobicContact CE-CD2 3.85Å; M308-L318 HydrophobicContact SD-CD2 4.31Å; M308-P333 HydrophobicContact CG-CB 3.78Å; M308-P333 HydrophobicContact CG-CG 4.16Å; M308-P333 HydrophobicContact SD-CB 4.1Å; M308-G334 PolarHBondContact SD-N 2.62Å; M308-I337 HydrophobicContact CE-CD1 3.59Å
309	L	91.7	Very high	92.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-39.5	-175.8	-82.3	173.5	0	0	0	112	F305 L306 D311 L363 L371 L374 A375 L462	F305-L309 WeakPolarHBondContact O-CG 3.22Å; F305-L309 PolarHBondContact O-N 2.77Å; L306-L309 HydrophobicContact CD2-CD1 4.06Å; L309-D311 VanDerWaalsContact C-N 3.26Å; L309-D311 PolarHBondContact O-N 3.18Å; L309-L363 HydrophobicContact CD2-CD1 4.09Å; L309-L363 HydrophobicContact CD2-CD2 3.84Å; L309-L371 HydrophobicContact CD2-CD2 4.4Å; L309-L371 WeakPolarHBondContact O-CB 3.38Å; L309-L374 HydrophobicContact CD1-CB 4.2Å; L309-L374 HydrophobicContact CD2-CB 4.44Å; L309-L374 HydrophobicContact CD2-CD1 4.5Å; L309-A375 HydrophobicContact CB-CB 4.19Å; L309-A375 HydrophobicContact CD1-CB 3.98Å; L309-L462 HydrophobicContact CD1-CD1 4.36Å
310	C	86.2	Confident	92.5	Very high	69 Å²	69	34.8 Å²	34.8	47%	0.466	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	3.9	178.7	-57.3	0	0	0	0	114.4	M308	M308-C310 PolarHBondContact O-N 2.96Å; M308-C310 VanDerWaalsContact O-N 3.15Å
311	D	88.5	Confident	92.4	Very high	68 Å²	68	35 Å²	35	36%	0.364	18%	0.182	S	C	.	.			trans	-128.3	87.8	-176.3	-166	-28.1	0	0	0	110.8	M308 L309 D313 V314 L315	M308-D311 CarbonylContact O-C 3.57Å; M308-D311 WeakPolarHBondContact O-CA 3.12Å; M308-D311 PolarHBondContact O-N 2.92Å; L309-D311 VanDerWaalsContact C-N 3.26Å; L309-D311 PolarHBondContact O-N 3.18Å; D311-D313 VanDerWaalsContact C-N 3.26Å; D311-D313 PolarHBondContact O-N 3.37Å; D311-D313 PolarHBondContact OD1-N 3.23Å; D311-V314 HydrophobicContact CB-CB 4.19Å; D311-V314 HydrophobicContact CB-CG2 4.21Å; D311-V314 PolarHBondContact O-N 3.14Å; D311-V314 WeakPolarHBondContact OD1-CG2 2.97Å; D311-V314 PolarHBondContact OD1-N 2.93Å; D311-V314 VanDerWaalsContact OD1-N 3.16Å; D311-V314 VanDerWaalsContact OD2-CG2 3.23Å; D311-V314 WeakPolarHBondContact OD2-CG2 3.46Å; D311-L315 PolarHBondContact O-N 3.4Å; D311-L315 VanDerWaalsContact O-N 3.15Å
312	R	87.8	Confident	92.2	Very high	58 Å²	58	35 Å²	35	22%	0.219	18%	0.182	C	C	.	.	H	α-helix	trans	-58.8	-38.9	-179.6	178.5	-178.4	-62	-83.6	-7.4	112	V314 L315 Y316 M364 L366 D368	R312-V314 VanDerWaalsContact C-N 3.32Å; R312-V314 PolarHBondContact O-N 2.92Å; R312-L315 PolarHBondContact O-N 3.28Å; R312-Y316 WeakPolarHBondContact O-CB 3.45Å; R312-Y316 PolarHBondContact O-N 3Å; R312-M364 HydrophobicContact CG-CE 4.3Å; R312-M364 HydrophobicContact CG-SD 4.33Å; R312-M364 PolarHBondContact NH1-O 2.89Å; R312-L366 PolarHBondContact NH1-O 3.49Å; R312-L366 PolarHBondContact NH2-O 3.48Å; R312-D368 IonicContact CZ-OD1 3.2Å; R312-D368 IonicContact NE-OD1 3.93Å; R312-D368 PolarHBondContact NE-OD1 3.02Å; R312-D368 VanDerWaalsContact NH2-N 3.12Å; R312-D368 IonicContact NH2-OD1 2.69Å; R312-D368 PolarHBondContact NH2-OD1 2.78Å
313	D	86.8	Confident	91.9	Very high	97 Å²	97	33.4 Å²	33.4	52%	0.519	18%	0.175	S	C	.	.	H	α-helix	trans	-65.6	-42.3	-173.9	-70.1	-23.1	0	0	0	109.8	D311 Y316 D317	D311-D313 VanDerWaalsContact C-N 3.26Å; D311-D313 PolarHBondContact O-N 3.37Å; D311-D313 PolarHBondContact OD1-N 3.23Å; D313-Y316 PolarHBondContact O-N 3.44Å; D313-D317 WeakPolarHBondContact O-CB 3.49Å; D313-D317 PolarHBondContact O-N 3.2Å
314	V	92.1	Very high	91.6	Very high	34 Å²	34	32.5 Å²	32.5	21%	0.206	17%	0.167	C	C	.	.	H	α-helix	trans	-63.6	-42.8	174.2	177.5	0	0	0	0	111.7	M308 D311 R312 Y316 D317 L318 M330	M308-V314 HydrophobicContact CB-CG1 4.47Å; M308-V314 HydrophobicContact CG-CG1 3.75Å; M308-V314 HydrophobicContact SD-CG1 3.59Å; M308-V314 VanDerWaalsContact SD-CG1 3.59Å; D311-V314 HydrophobicContact CB-CB 4.19Å; D311-V314 HydrophobicContact CB-CG2 4.21Å; D311-V314 PolarHBondContact O-N 3.14Å; D311-V314 WeakPolarHBondContact OD1-CG2 2.97Å; D311-V314 PolarHBondContact OD1-N 2.93Å; D311-V314 VanDerWaalsContact OD1-N 3.16Å; D311-V314 VanDerWaalsContact OD2-CG2 3.23Å; D311-V314 WeakPolarHBondContact OD2-CG2 3.46Å; R312-V314 VanDerWaalsContact C-N 3.32Å; R312-V314 PolarHBondContact O-N 2.92Å; V314-Y316 PolarHBondContact O-N 3.4Å; V314-D317 PolarHBondContact O-N 2.97Å; V314-L318 WeakPolarHBondContact O-CB 3.4Å; V314-L318 PolarHBondContact O-N 2.9Å; V314-M330 HydrophobicContact CB-CE 4.44Å; V314-M330 HydrophobicContact CG1-CE 3.56Å; V314-M330 WeakPolarHBondContact O-CE 3.36Å
315	L	94.2	Very high	91.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.5	-43.6	174.7	-69.3	170.7	0	0	0	111.9	F305 M308 D311 R312 L318 M319 L360 L363 M364 L371	F305-L315 HydrophobicContact CD1-CD2 3.98Å; F305-L315 HydrophobicContact CE1-CD2 4.05Å; M308-L315 HydrophobicContact CB-CD2 3.68Å; M308-L315 HydrophobicContact CB-CG 4.05Å; M308-L315 HydrophobicContact CE-CD2 4.13Å; M308-L315 WeakPolarHBondContact O-CG 3.26Å; D311-L315 PolarHBondContact O-N 3.4Å; D311-L315 VanDerWaalsContact O-N 3.15Å; R312-L315 PolarHBondContact O-N 3.28Å; L315-L318 PolarHBondContact O-N 3.42Å; L315-M319 WeakPolarHBondContact O-CB 3.31Å; L315-M319 PolarHBondContact O-N 2.84Å; L315-L360 HydrophobicContact CB-CD2 4.19Å; L315-L360 HydrophobicContact CD2-CD2 3.77Å; L315-L363 HydrophobicContact CD1-CD1 4.48Å; L315-L363 HydrophobicContact CD2-CD1 4.26Å; L315-M364 HydrophobicContact CB-CE 3.47Å; L315-M364 VanDerWaalsContact CB-CE 3.47Å; L315-M364 HydrophobicContact CD1-CE 3.92Å; L315-M364 HydrophobicContact CG-CE 4.34Å; L315-L371 HydrophobicContact CD1-CD1 4.05Å
316	Y	91.4	Very high	90.7	Very high	16 Å²	16	40 Å²	40	6%	0.063	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-44.8	178.8	178.3	-97.4	0	0	0	111.6	C26 R312 D313 V314 L318 M319 K320 M364	C26-Y316 HydrophobicContact CB-CD1 4.14Å; C26-Y316 HydrophobicContact CB-CE1 3.85Å; R312-Y316 WeakPolarHBondContact O-CB 3.45Å; R312-Y316 PolarHBondContact O-N 3Å; D313-Y316 PolarHBondContact O-N 3.44Å; V314-Y316 PolarHBondContact O-N 3.4Å; Y316-L318 PolarHBondContact O-N 2.89Å; Y316-M319 HydrophobicContact CD2-CE 3.68Å; Y316-M319 HydrophobicContact CE2-CE 3.79Å; Y316-M319 WeakPolarHBondContact O-CB 3.28Å; Y316-M319 PolarHBondContact O-N 2.93Å; Y316-K320 HydrophobicContact CE1-CD 4.17Å; Y316-K320 VanDerWaalsContact O-CB 3.27Å; Y316-K320 WeakPolarHBondContact O-CB 3.34Å; Y316-K320 PolarHBondContact O-N 3.36Å; Y316-M364 HydrophobicContact CD2-SD 4.44Å
317	D	92.4	Very high	90.3	Very high	59 Å²	59	41.1 Å²	41.1	32%	0.316	21%	0.21	S	C	.	.	H	α-helix	trans	-63.3	-41.5	178.7	-79.6	-17.7	0	0	0	111.5	D313 V314 K320 M321 M330	D313-D317 WeakPolarHBondContact O-CB 3.49Å; D313-D317 PolarHBondContact O-N 3.2Å; V314-D317 PolarHBondContact O-N 2.97Å; D317-K320 PolarHBondContact O-N 2.9Å; D317-M321 WeakPolarHBondContact O-CB 3.27Å; D317-M321 WeakPolarHBondContact O-CG 3.29Å; D317-M321 PolarHBondContact O-N 3.24Å; D317-M330 HydrophobicContact CB-CE 4.25Å
318	L	94.9	Very high	89.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.6	-49.4	173	179.4	61.3	0	0	0	111.1	M308 V314 L315 Y316 K320 M321 L322 M330 I337 L338 L360	M308-L318 HydrophobicContact CE-CD2 3.85Å; M308-L318 HydrophobicContact SD-CD2 4.31Å; V314-L318 WeakPolarHBondContact O-CB 3.4Å; V314-L318 PolarHBondContact O-N 2.9Å; L315-L318 PolarHBondContact O-N 3.42Å; Y316-L318 PolarHBondContact O-N 2.89Å; L318-K320 VanDerWaalsContact C-N 3.26Å; L318-K320 PolarHBondContact O-N 3.05Å; L318-M321 PolarHBondContact O-N 3.34Å; L318-L322 HydrophobicContact CD1-CD1 4.34Å; L318-L322 HydrophobicContact CD1-CG 4.26Å; L318-L322 HydrophobicContact CG-CD1 4.34Å; L318-L322 WeakPolarHBondContact O-CG 3.44Å; L318-L322 PolarHBondContact O-N 3.07Å; L318-M330 HydrophobicContact CB-CE 4.15Å; L318-M330 HydrophobicContact CB-SD 4.16Å; L318-M330 HydrophobicContact CD1-SD 4.26Å; L318-I337 HydrophobicContact CD2-CB 4.47Å; L318-I337 HydrophobicContact CD2-CD1 3.78Å; L318-I337 HydrophobicContact CD2-CG2 4.44Å; L318-L338 HydrophobicContact CD1-CD2 3.77Å; L318-L338 HydrophobicContact CD1-CG 3.95Å; L318-L360 HydrophobicContact CB-CD1 4.47Å; L318-L360 HydrophobicContact CD2-CD1 4.03Å; L318-L360 HydrophobicContact CD2-CD2 4.38Å; L318-L360 HydrophobicContact CG-CD1 3.9Å
319	M	93.3	Very high	89.5	Confident	3 Å²	3	43.1 Å²	43.1	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-55.8	-44.8	177.4	-177.1	-170.1	67.9	0	0	111	L315 Y316 L322 E323 L357 L360 Q361 M364	L315-M319 WeakPolarHBondContact O-CB 3.31Å; L315-M319 PolarHBondContact O-N 2.84Å; Y316-M319 HydrophobicContact CD2-CE 3.68Å; Y316-M319 HydrophobicContact CE2-CE 3.79Å; Y316-M319 WeakPolarHBondContact O-CB 3.28Å; Y316-M319 PolarHBondContact O-N 2.93Å; M319-L322 PolarHBondContact O-N 3.02Å; M319-E323 HydrophobicContact CG-CG 4.45Å; M319-E323 WeakPolarHBondContact O-CB 3.34Å; M319-E323 WeakPolarHBondContact O-CG 3.22Å; M319-E323 PolarHBondContact O-N 3.27Å; M319-L357 HydrophobicContact CG-CD2 4.17Å; M319-L360 HydrophobicContact CB-CB 4.09Å; M319-L360 HydrophobicContact CB-CD1 4.06Å; M319-L360 HydrophobicContact CB-CG 4.49Å; M319-L360 HydrophobicContact CG-CB 4.2Å; M319-Q361 HydrophobicContact SD-CG 4.36Å; M319-M364 HydrophobicContact CE-CG 4.13Å; M319-M364 HydrophobicContact SD-CB 4.49Å; M319-M364 HydrophobicContact SD-CG 3.7Å
320	K	91.4	Very high	89.5	Confident	25 Å²	25	44.1 Å²	44.1	11%	0.109	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-46.8	178.8	170.7	172.6	179.1	-172.3	0	112.3	D29 I53 Y316 D317 L318 L322 E323 L324	D29-K320 IonicContact OD1-NZ 3.72Å; D29-K320 PolarHBondContact OD1-NZ 2.86Å; D29-K320 IonicContact OD2-NZ 3.69Å; D29-K320 PolarHBondContact OD2-NZ 3.36Å; I53-K320 HydrophobicContact CG2-CB 4.45Å; I53-K320 HydrophobicContact CG2-CD 4.05Å; I53-K320 HydrophobicContact CG2-CG 3.68Å; Y316-K320 HydrophobicContact CE1-CD 4.17Å; Y316-K320 VanDerWaalsContact O-CB 3.27Å; Y316-K320 WeakPolarHBondContact O-CB 3.34Å; Y316-K320 PolarHBondContact O-N 3.36Å; D317-K320 PolarHBondContact O-N 2.9Å; L318-K320 VanDerWaalsContact C-N 3.26Å; L318-K320 PolarHBondContact O-N 3.05Å; K320-L322 VanDerWaalsContact C-N 3.3Å; K320-L322 PolarHBondContact O-N 3.48Å; K320-E323 PolarHBondContact O-N 3Å; K320-L324 HydrophobicContact CG-CD1 3.88Å; K320-L324 WeakPolarHBondContact O-CB 3.39Å; K320-L324 VanDerWaalsContact O-CG 3.27Å; K320-L324 WeakPolarHBondContact O-CG 3.16Å; K320-L324 PolarHBondContact O-N 2.75Å
321	M	92.5	Very high	89.6	Confident	42 Å²	42	47 Å²	47	21%	0.207	24%	0.244	C	C	.	.	H	α-helix	trans	-57.7	-44.9	175.9	-78.1	-165.5	-164.2	0	0	111.2	D317 L318 L324 N325 Q326 M330 L338	D317-M321 WeakPolarHBondContact O-CB 3.27Å; D317-M321 WeakPolarHBondContact O-CG 3.29Å; D317-M321 PolarHBondContact O-N 3.24Å; L318-M321 PolarHBondContact O-N 3.34Å; M321-L324 PolarHBondContact O-N 3.03Å; M321-N325 PolarHBondContact O-N 3.45Å; M321-N325 VanDerWaalsContact O-N 3.17Å; M321-Q326 WeakPolarHBondContact CB-O 3.29Å; M321-Q326 PolarHBondContact O-N 3.15Å; M321-M330 HydrophobicContact CE-CB 4.15Å; M321-M330 HydrophobicContact CE-CG 4.37Å; M321-M330 HydrophobicContact CE-SD 4.42Å; M321-M330 HydrophobicContact SD-CB 4.16Å; M321-M330 HydrophobicContact SD-SD 4.29Å; M321-L338 HydrophobicContact SD-CD1 3.84Å
322	L	91.7	Very high	89.8	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.9	-45.7	178.7	-63.3	-176.7	0	0	0	112.7	L318 M319 K320 L324 N325 L327 L338 L341 K353 I356 L357 L360	L318-L322 HydrophobicContact CD1-CD1 4.34Å; L318-L322 HydrophobicContact CD1-CG 4.26Å; L318-L322 HydrophobicContact CG-CD1 4.34Å; L318-L322 WeakPolarHBondContact O-CG 3.44Å; L318-L322 PolarHBondContact O-N 3.07Å; M319-L322 PolarHBondContact O-N 3.02Å; K320-L322 VanDerWaalsContact C-N 3.3Å; K320-L322 PolarHBondContact O-N 3.48Å; L322-L324 VanDerWaalsContact C-N 3.26Å; L322-L324 PolarHBondContact O-N 2.83Å; L322-N325 PolarHBondContact O-N 2.93Å; L322-L327 HydrophobicContact CD2-CD2 4.05Å; L322-L338 HydrophobicContact CD2-CD2 3.7Å; L322-L341 HydrophobicContact CD1-CD1 4.38Å; L322-L341 HydrophobicContact CD2-CD1 3.38Å; L322-K353 HydrophobicContact CD2-CG 4.37Å; L322-K353 WeakPolarHBondContact O-CE 3.38Å; L322-K353 PolarHBondContact O-NZ 3.31Å; L322-I356 HydrophobicContact CD1-CB 4.11Å; L322-I356 HydrophobicContact CD1-CG2 3.52Å; L322-L357 HydrophobicContact CB-CD1 4.22Å; L322-L357 HydrophobicContact CB-CD2 3.58Å; L322-L357 HydrophobicContact CB-CG 3.85Å; L322-L357 HydrophobicContact CD1-CD2 4.26Å; L322-L357 HydrophobicContact CD1-CG 4.19Å; L322-L360 HydrophobicContact CD1-CD1 3.91Å
323	E	89.4	Confident	90.1	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-60.9	-35	176.8	-78.6	-72.9	179.3	0	0	112.4	Q40 T42 I53 K148 M319 K320 N325 L357 Q361	Q40-E323 PolarHBondContact NE2-O 3.17Å; T42-E323 WeakPolarHBondContact CB-OE1 3.38Å; T42-E323 HydrophobicContact CG2-CG 3.85Å; I53-E323 HydrophobicContact CD1-CB 3.57Å; I53-E323 HydrophobicContact CD1-CG 3.82Å; K148-E323 IonicContact NZ-OE2 3.46Å; K148-E323 PolarHBondContact NZ-OE2 2.65Å; M319-E323 HydrophobicContact CG-CG 4.45Å; M319-E323 WeakPolarHBondContact O-CB 3.34Å; M319-E323 WeakPolarHBondContact O-CG 3.22Å; M319-E323 PolarHBondContact O-N 3.27Å; K320-E323 PolarHBondContact O-N 3Å; E323-N325 VanDerWaalsContact C-N 3.29Å; E323-N325 PolarHBondContact O-N 3.37Å; E323-L357 HydrophobicContact CG-CD2 3.87Å; E323-Q361 PolarHBondContact OE1-NE2 2.83Å
324	L	89.1	Confident	90.4	Very high	18 Å²	18	40.3 Å²	40.3	9%	0.094	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	3.8	177.2	-62.6	178.1	0	0	0	113.6	Q40 I53 V55 K320 M321 L322 Q326	Q40-L324 HydrophobicContact CB-CD2 4.45Å; I53-L324 HydrophobicContact CG2-CD1 3.89Å; I53-L324 HydrophobicContact CG2-CD2 4.06Å; I53-L324 HydrophobicContact CG2-CG 4.02Å; V55-L324 HydrophobicContact CG1-CD2 4.05Å; K320-L324 HydrophobicContact CG-CD1 3.88Å; K320-L324 WeakPolarHBondContact O-CB 3.39Å; K320-L324 VanDerWaalsContact O-CG 3.27Å; K320-L324 WeakPolarHBondContact O-CG 3.16Å; K320-L324 PolarHBondContact O-N 2.75Å; M321-L324 PolarHBondContact O-N 3.03Å; L322-L324 VanDerWaalsContact C-N 3.26Å; L322-L324 PolarHBondContact O-N 2.83Å; L324-Q326 HydrophobicContact CB-CG 3.91Å; L324-Q326 PolarHBondContact O-N 3.21Å
325	N	86.4	Confident	90.5	Very high	63 Å²	63	39 Å²	39	34%	0.337	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	36	-173.9	-68.8	-81.9	0	0	0	113.5	T142 D146 M321 L322 E323 K353	T142-N325 HydrophobicContact CG2-CB 3.66Å; T142-N325 WeakPolarHBondContact CG2-ND2 3.25Å; D146-N325 PolarHBondContact OD2-ND2 3.07Å; M321-N325 PolarHBondContact O-N 3.45Å; M321-N325 VanDerWaalsContact O-N 3.17Å; L322-N325 PolarHBondContact O-N 2.93Å; E323-N325 VanDerWaalsContact C-N 3.29Å; E323-N325 PolarHBondContact O-N 3.37Å; N325-K353 VanDerWaalsContact CG-NZ 3.28Å; N325-K353 PolarHBondContact OD1-NZ 2.77Å
326	Q	85.5	Confident	90.5	Very high	95 Å²	95	44.1 Å²	44.1	44%	0.444	24%	0.242	S	C	.	.			trans	-100.7	96.4	177.8	-64.3	178.2	9.4	0	0	108.8	M321 L324 G328	M321-Q326 WeakPolarHBondContact CB-O 3.29Å; M321-Q326 PolarHBondContact O-N 3.15Å; L324-Q326 HydrophobicContact CB-CG 3.91Å; L324-Q326 PolarHBondContact O-N 3.21Å; Q326-G328 PolarHBondContact O-N 2.56Å; Q326-G328 VanDerWaalsContact O-N 3.12Å
327	L	83.4	Confident	90.6	Very high	73 Å²	73	43.3 Å²	43.3	38%	0.382	24%	0.239	S	C	.	.			trans	-84.8	38.3	170.4	-59.9	178.5	0	0	0	111.1	L322 L338 L341 R342	L322-L327 HydrophobicContact CD2-CD2 4.05Å; L327-L338 HydrophobicContact CD2-CD2 3.82Å; L327-L341 HydrophobicContact CD2-CB 4.09Å; L327-L341 HydrophobicContact CD2-CD1 4.21Å; L327-R342 HydrophobicContact CB-CG 4.15Å; L327-R342 HydrophobicContact CD1-CG 4.14Å; L327-R342 VanDerWaalsContact O-CZ 3.29Å; L327-R342 PolarHBondContact O-NE 3.01Å; L327-R342 PolarHBondContact O-NH2 3.41Å
328	G	83.2	Confident	90.7	Very high	37 Å²	37	40.5 Å²	40.5	38%	0.381	22%	0.224	S	C	.	.			trans	-65.4	-177.5	-179.7	0	0	0	0	0	112.5	Q326 L338 R342	Q326-G328 PolarHBondContact O-N 2.56Å; Q326-G328 VanDerWaalsContact O-N 3.12Å; G328-L338 WeakPolarHBondContact O-CD1 3.44Å; G328-R342 PolarHBondContact O-NH2 3.06Å
329	H	87.1	Confident	90.5	Very high	147 Å²	147	43.9 Å²	43.9	68%	0.681	24%	0.242	S	C	*	.			trans	-74.9	136	175.9	-175.2	61.8	0	0	0	110.6	D331	H329-D331 IonicContact CE1-OD1 2.77Å; H329-D331 IonicContact NE2-OD1 2.7Å; H329-D331 PolarHBondContact NE2-OD1 2.73Å
330	M	91.5	Very high	90.5	Very high	21 Å²	21	44.9 Å²	44.9	10%	0.103	25%	0.247	C	C	.	.			trans	-138.3	134.9	172.5	-176.9	172.8	-179.9	0	0	106.9	V314 D317 L318 M321 G335 L338	V314-M330 HydrophobicContact CB-CE 4.44Å; V314-M330 HydrophobicContact CG1-CE 3.56Å; V314-M330 WeakPolarHBondContact O-CE 3.36Å; D317-M330 HydrophobicContact CB-CE 4.25Å; L318-M330 HydrophobicContact CB-CE 4.15Å; L318-M330 HydrophobicContact CB-SD 4.16Å; L318-M330 HydrophobicContact CD1-SD 4.26Å; M321-M330 HydrophobicContact CE-CB 4.15Å; M321-M330 HydrophobicContact CE-CG 4.37Å; M321-M330 HydrophobicContact CE-SD 4.42Å; M321-M330 HydrophobicContact SD-CB 4.16Å; M321-M330 HydrophobicContact SD-SD 4.29Å; M330-G335 WeakPolarHBondContact O-CA 3.27Å; M330-L338 HydrophobicContact CB-CD1 3.69Å; M330-L338 HydrophobicContact SD-CD1 4.42Å
331	D	89.5	Confident	90.4	Very high	129 Å²	129	44.4 Å²	44.4	69%	0.69	25%	0.245	S	C	*	.			trans	-75.9	156.6	177.4	-71.8	-54.8	0	0	0	111.5	H329	H329-D331 IonicContact CE1-OD1 2.77Å; H329-D331 IonicContact NE2-OD1 2.7Å; H329-D331 PolarHBondContact NE2-OD1 2.73Å
332	G	92.4	Very high	90.2	Very high	48 Å²	48	47.6 Å²	47.6	50%	0.495	26%	0.255	S	S	.	.	H	α-helix	trans	73	-151.5	169.6	0	0	0	0	0	114.9	G334 G335 K336	G332-G334 VanDerWaalsContact C-N 3.34Å; G332-G334 PolarHBondContact O-N 2.77Å; G332-G335 PolarHBondContact O-N 2.7Å; G332-K336 PolarHBondContact O-N 3.16Å
333	P	93.2	Very high	89.9	Confident	35 Å²	35	54 Å²	54	23%	0.227	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-35.1	-172.5	-19	29.4	0	0	0	113.9	S304 H307 M308 G335 K336 I337	S304-P333 WeakPolarHBondContact CB-O 3.46Å; S304-P333 PolarHBondContact OG-O 3.28Å; H307-P333 HydrophobicContact CB-CB 4.12Å; H307-P333 HydrophobicContact CB-CG 3.57Å; M308-P333 HydrophobicContact CG-CB 3.78Å; M308-P333 HydrophobicContact CG-CG 4.16Å; M308-P333 HydrophobicContact SD-CB 4.1Å; P333-G335 VanDerWaalsContact C-N 3.28Å; P333-G335 PolarHBondContact O-N 2.87Å; P333-K336 WeakPolarHBondContact O-CB 3.45Å; P333-K336 PolarHBondContact O-N 3.45Å; P333-K336 VanDerWaalsContact O-N 3.16Å; P333-I337 PolarHBondContact O-N 2.9Å
334	G	93.2	Very high	89	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.6	-37.8	175.5	0	0	0	0	0	112.2	M308 G332 K336 I337 L338	M308-G334 PolarHBondContact SD-N 2.62Å; G332-G334 VanDerWaalsContact C-N 3.34Å; G332-G334 PolarHBondContact O-N 2.77Å; G334-K336 VanDerWaalsContact C-N 3.32Å; G334-K336 PolarHBondContact O-N 3.36Å; G334-I337 PolarHBondContact O-N 2.97Å; G334-L338 WeakPolarHBondContact O-CG 3.41Å; G334-L338 PolarHBondContact O-N 3.41Å; G334-L338 VanDerWaalsContact O-N 3.1Å
335	G	94.2	Very high	87.3	Confident	6 Å²	6	60.6 Å²	60.6	6%	0.062	33%	0.326	C	S	.	.	H	α-helix	trans	-58.6	-40	173.3	0	0	0	0	0	113.7	M330 G332 P333 I337 L338 D339	M330-G335 WeakPolarHBondContact O-CA 3.27Å; G332-G335 PolarHBondContact O-N 2.7Å; P333-G335 VanDerWaalsContact C-N 3.28Å; P333-G335 PolarHBondContact O-N 2.87Å; G335-I337 VanDerWaalsContact C-N 3.34Å; G335-I337 PolarHBondContact O-N 2.99Å; G335-L338 WeakPolarHBondContact O-CB 3.36Å; G335-L338 PolarHBondContact O-N 3.42Å; G335-D339 VanDerWaalsContact O-CG 3.26Å; G335-D339 PolarHBondContact O-N 3.32Å
336	K	94.5	Very high	85.5	Confident	108 Å²	108	62.2 Å²	62.2	47%	0.47	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-40.6	177.7	-62.1	-178.2	179.4	-179.8	0	112.1	V300 G332 P333 G334 D339 E340	V300-K336 HydrophobicContact CG1-CB 4.06Å; G332-K336 PolarHBondContact O-N 3.16Å; P333-K336 WeakPolarHBondContact O-CB 3.45Å; P333-K336 PolarHBondContact O-N 3.45Å; P333-K336 VanDerWaalsContact O-N 3.16Å; G334-K336 VanDerWaalsContact C-N 3.32Å; G334-K336 PolarHBondContact O-N 3.36Å; K336-D339 PolarHBondContact O-N 3.48Å; K336-E340 PolarHBondContact O-N 3.24Å; K336-E340 VanDerWaalsContact O-N 3.08Å
337	I	94.1	Very high	83.8	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-64.3	-42.7	174.9	-65.2	174.3	0	0	0	110.5	F305 M308 L318 P333 G334 G335 D339 E340 L341 I356	F305-I337 HydrophobicContact CD2-CD1 4.3Å; F305-I337 HydrophobicContact CE2-CD1 4.11Å; F305-I337 HydrophobicContact CZ-CD1 4.43Å; M308-I337 HydrophobicContact CE-CD1 3.59Å; L318-I337 HydrophobicContact CD2-CB 4.47Å; L318-I337 HydrophobicContact CD2-CD1 3.78Å; L318-I337 HydrophobicContact CD2-CG2 4.44Å; P333-I337 PolarHBondContact O-N 2.9Å; G334-I337 PolarHBondContact O-N 2.97Å; G335-I337 VanDerWaalsContact C-N 3.34Å; G335-I337 PolarHBondContact O-N 2.99Å; I337-D339 VanDerWaalsContact C-N 3.29Å; I337-D339 PolarHBondContact O-N 2.9Å; I337-E340 PolarHBondContact O-N 3.35Å; I337-L341 HydrophobicContact CG2-CD1 4.11Å; I337-L341 WeakPolarHBondContact O-CG 3.38Å; I337-L341 PolarHBondContact O-N 2.9Å; I337-I356 HydrophobicContact CG2-CD1 4.33Å; I337-I356 HydrophobicContact CG2-CG1 4.17Å; I337-I356 HydrophobicContact CG2-CG2 4.01Å
338	L	93.5	Very high	82.5	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-63	-36.6	175.8	-64.4	-179.6	0	0	0	112	L318 M321 L322 L327 G328 M330 G334 G335 L341 R342	L318-L338 HydrophobicContact CD1-CD2 3.77Å; L318-L338 HydrophobicContact CD1-CG 3.95Å; M321-L338 HydrophobicContact SD-CD1 3.84Å; L322-L338 HydrophobicContact CD2-CD2 3.7Å; L327-L338 HydrophobicContact CD2-CD2 3.82Å; G328-L338 WeakPolarHBondContact O-CD1 3.44Å; M330-L338 HydrophobicContact CB-CD1 3.69Å; M330-L338 HydrophobicContact SD-CD1 4.42Å; G334-L338 WeakPolarHBondContact O-CG 3.41Å; G334-L338 PolarHBondContact O-N 3.41Å; G334-L338 VanDerWaalsContact O-N 3.1Å; G335-L338 WeakPolarHBondContact O-CB 3.36Å; G335-L338 PolarHBondContact O-N 3.42Å; L338-L341 HydrophobicContact CD2-CD1 4.26Å; L338-L341 PolarHBondContact O-N 3.35Å; L338-R342 WeakPolarHBondContact O-CG 3.31Å; L338-R342 PolarHBondContact O-N 2.92Å
339	D	92.1	Very high	82	Confident	70 Å²	70	72.2 Å²	72.2	37%	0.374	38%	0.38	S	S	.	.	H	α-helix	trans	-63.5	-42.7	175.4	-68.3	-18.1	0	0	0	111.5	G335 K336 I337 R342 K343	G335-D339 VanDerWaalsContact O-CG 3.26Å; G335-D339 PolarHBondContact O-N 3.32Å; K336-D339 PolarHBondContact O-N 3.48Å; I337-D339 VanDerWaalsContact C-N 3.29Å; I337-D339 PolarHBondContact O-N 2.9Å; D339-R342 PolarHBondContact O-N 2.93Å; D339-R342 IonicContact OD1-CZ 2.63Å; D339-R342 IonicContact OD1-NH1 2.86Å; D339-R342 PolarHBondContact OD1-NH1 3.45Å; D339-K343 WeakPolarHBondContact O-CG 3.31Å; D339-K343 PolarHBondContact O-N 3.46Å; D339-K343 VanDerWaalsContact O-N 3.09Å
340	E	91.7	Very high	81.4	Confident	25 Å²	25	65.6 Å²	65.6	12%	0.117	35%	0.35	C	S	.	.	H	α-helix	trans	-62	-43.2	173.2	-67.6	-50.5	131.3	0	0	112	V300 K336 I337 R342 K343 D344 L352	V300-E340 HydrophobicContact CB-CG 4.1Å; V300-E340 HydrophobicContact CG1-CG 3.64Å; K336-E340 PolarHBondContact O-N 3.24Å; K336-E340 VanDerWaalsContact O-N 3.08Å; I337-E340 PolarHBondContact O-N 3.35Å; E340-R342 PolarHBondContact O-N 3.25Å; E340-K343 WeakPolarHBondContact O-CB 3.38Å; E340-K343 PolarHBondContact O-N 3.03Å; E340-K343 VanDerWaalsContact O-N 3.08Å; E340-K343 IonicContact OE1-NZ 4Å; E340-K343 PolarHBondContact OE1-NZ 3.42Å; E340-K343 IonicContact OE2-NZ 2.88Å; E340-D344 PolarHBondContact O-N 3.47Å; E340-L352 HydrophobicContact CB-CD2 4.29Å
341	L	90.6	Very high	81.1	Confident	15 Å²	15	68 Å²	68	8%	0.079	36%	0.363	C	S	.	.	H	α-helix	trans	-63.4	-28.6	175.6	-73.2	168	0	0	0	113.3	L322 L327 I337 L338 L352 K353	L322-L341 HydrophobicContact CD1-CD1 4.38Å; L322-L341 HydrophobicContact CD2-CD1 3.38Å; L327-L341 HydrophobicContact CD2-CB 4.09Å; L327-L341 HydrophobicContact CD2-CD1 4.21Å; I337-L341 HydrophobicContact CG2-CD1 4.11Å; I337-L341 WeakPolarHBondContact O-CG 3.38Å; I337-L341 PolarHBondContact O-N 2.9Å; L338-L341 HydrophobicContact CD2-CD1 4.26Å; L338-L341 PolarHBondContact O-N 3.35Å; L341-L352 HydrophobicContact CD2-CB 3.8Å; L341-L352 HydrophobicContact CD2-CD2 3.81Å; L341-L352 HydrophobicContact CD2-CG 3.61Å; L341-L352 HydrophobicContact CG-CD2 4.21Å; L341-L352 HydrophobicContact CG-CG 4.39Å; L341-K353 HydrophobicContact CD2-CB 3.88Å
342	R	88.6	Confident	81.2	Confident	108 Å²	108	62.2 Å²	62.2	41%	0.408	33%	0.332	S	S	.	.	H	α-helix	trans	-77.4	-28.5	173.9	-71.1	-172.8	-146	113.9	9.6	112.6	L327 G328 L338 D339 E340 D344	L327-R342 HydrophobicContact CB-CG 4.15Å; L327-R342 HydrophobicContact CD1-CG 4.14Å; L327-R342 VanDerWaalsContact O-CZ 3.29Å; L327-R342 PolarHBondContact O-NE 3.01Å; L327-R342 PolarHBondContact O-NH2 3.41Å; G328-R342 PolarHBondContact O-NH2 3.06Å; L338-R342 WeakPolarHBondContact O-CG 3.31Å; L338-R342 PolarHBondContact O-N 2.92Å; D339-R342 PolarHBondContact O-N 2.93Å; D339-R342 IonicContact OD1-CZ 2.63Å; D339-R342 IonicContact OD1-NH1 2.86Å; D339-R342 PolarHBondContact OD1-NH1 3.45Å; E340-R342 PolarHBondContact O-N 3.25Å; R342-D344 VanDerWaalsContact C-N 3.29Å
343	K	85.6	Confident	81.1	Confident	136 Å²	136	61.6 Å²	61.6	59%	0.591	32%	0.316	S	S	*	.	H	α-helix	trans	-73	-24.9	172.6	-66.4	171	-168.6	171	0	112	D339 E340 S345	D339-K343 WeakPolarHBondContact O-CG 3.31Å; D339-K343 PolarHBondContact O-N 3.46Å; D339-K343 VanDerWaalsContact O-N 3.09Å; E340-K343 WeakPolarHBondContact O-CB 3.38Å; E340-K343 PolarHBondContact O-N 3.03Å; E340-K343 VanDerWaalsContact O-N 3.08Å; E340-K343 IonicContact OE1-NZ 4Å; E340-K343 PolarHBondContact OE1-NZ 3.42Å; E340-K343 IonicContact OE2-NZ 2.88Å; K343-S345 PolarHBondContact O-N 2.87Å
344	D	69.6	Low	80.9	Confident	60 Å²	60	62 Å²	62	32%	0.321	32%	0.316	S	S	.	.			trans	-67.6	71.7	174.2	-164.1	3	0	0	0	110.6	E340 R342 S346	E340-D344 PolarHBondContact O-N 3.47Å; R342-D344 VanDerWaalsContact C-N 3.29Å; D344-S346 PolarHBondContact O-N 3.12Å; D344-S346 VanDerWaalsContact O-N 3.15Å
345	S	53.7	Low	80.8	Confident	97 Å²	97	62.1 Å²	62.1	68%	0.678	32%	0.317	S	S	*	.			trans	-80.7	95.2	178.8	62.2	0	0	0	0	109	K343	K343-S345 PolarHBondContact O-N 2.87Å
346	S	48	Very low	80.8	Confident	96 Å²	96	61.9 Å²	61.9	67%	0.671	31%	0.314	S	S	*	.	S	Bend	trans	43.4	112.5	154.6	64.3	0	0	0	0	117	D344	D344-S346 PolarHBondContact O-N 3.12Å; D344-S346 VanDerWaalsContact O-N 3.15Å
347	L	49.7	Very low	80.6	Confident	177 Å²	177	57.1 Å²	57.1	93%	0.927	29%	0.294	S	S	*	.			trans	110.5	16.3	167.5	-58.3	156.3	0	0	0	116.4
348	S	57.6	Low	80.5	Confident	59 Å²	59	57.2 Å²	57.2	41%	0.413	29%	0.294	S	S	.	.			trans	-71.5	128	156.5	171.9	0	0	0	0	109.1	I350	S348-I350 WeakPolarHBondContact CB-O 3.48Å; S348-I350 PolarHBondContact O-N 3.29Å; S348-I350 WeakPolarHBondContact OG-CA 3.41Å; S348-I350 WeakPolarHBondContact OG-CB 3.29Å; S348-I350 PolarHBondContact OG-N 2.79Å; S348-I350 VanDerWaalsContact OG-N 3.07Å; S348-I350 PolarHBondContact OG-O 3.17Å
349	W	71.8	Confident	80.5	Confident	179 Å²	179	57.2 Å²	57.2	68%	0.678	29%	0.294	S	S	*	.	S	Bend	trans	-68.1	-13.7	170.8	65.8	-85.9	0	0	0	111.8	L289 E292	L289-W349 HydrophobicContact CD2-CE3 4.09Å; L289-W349 HydrophobicContact CD2-CH2 3.81Å; L289-W349 HydrophobicContact CD2-CZ3 3.3Å; E292-W349 WeakPolarHBondContact OE2-CH2 3.39Å; E292-W349 WeakPolarHBondContact OE2-CZ2 3.5Å
350	I	73.6	Confident	80.6	Confident	9 Å²	9	53.9 Å²	53.9	5%	0.046	28%	0.276	C	S	.	.	S	Bend	trans	-94.1	118	170.1	-54.8	168.7	0	0	0	108	L289 E292 L293 S348 L352 L355	L289-I350 HydrophobicContact CB-CG2 4.31Å; L289-I350 HydrophobicContact CD2-CG1 4.13Å; E292-I350 HydrophobicContact CB-CD1 3.5Å; E292-I350 VanDerWaalsContact CB-CD1 3.5Å; L293-I350 HydrophobicContact CD2-CG2 3.82Å; S348-I350 WeakPolarHBondContact CB-O 3.48Å; S348-I350 PolarHBondContact O-N 3.29Å; S348-I350 WeakPolarHBondContact OG-CA 3.41Å; S348-I350 WeakPolarHBondContact OG-CB 3.29Å; S348-I350 PolarHBondContact OG-N 2.79Å; S348-I350 VanDerWaalsContact OG-N 3.07Å; S348-I350 PolarHBondContact OG-O 3.17Å; I350-L352 PolarHBondContact O-N 3.43Å; I350-L355 HydrophobicContact CG2-CD1 3.55Å
351	N	86.6	Confident	80.6	Confident	72 Å²	72	53.7 Å²	53.7	39%	0.385	28%	0.275	S	S	.	.			trans	-90.3	100.5	176.6	-177.2	-10.7	0	0	0	109.7	K353 D354 L355	N351-K353 PolarHBondContact O-N 2.96Å; N351-K353 VanDerWaalsContact OD1-CB 3.29Å; N351-K353 WeakPolarHBondContact OD1-CB 3.31Å; N351-K353 PolarHBondContact OD1-N 3.16Å; N351-K353 VanDerWaalsContact OD1-N 3.16Å; N351-D354 HydrophobicContact CB-CB 4.01Å; N351-D354 VanDerWaalsContact CG-CG 3.48Å; N351-D354 PolarHBondContact ND2-OD1 3.43Å; N351-D354 PolarHBondContact ND2-OD2 3.45Å; N351-D354 WeakPolarHBondContact O-CB 3.34Å; N351-D354 PolarHBondContact O-N 3.24Å; N351-D354 VanDerWaalsContact O-N 3.12Å; N351-D354 PolarHBondContact OD1-N 3.29Å; N351-L355 PolarHBondContact O-N 3.31Å
352	L	90.4	Very high	80.7	Confident	6 Å²	6	53 Å²	53	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-57	-40.4	-179.8	178.4	59.8	0	0	0	111.5	L293 V297 V301 E340 L341 I350 D354 L355 I356	L293-L352 HydrophobicContact CD1-CD1 3.64Å; V297-L352 HydrophobicContact CG1-CD1 4.22Å; V297-L352 HydrophobicContact CG1-CD2 4.01Å; V301-L352 HydrophobicContact CG2-CD1 4.45Å; E340-L352 HydrophobicContact CB-CD2 4.29Å; L341-L352 HydrophobicContact CD2-CB 3.8Å; L341-L352 HydrophobicContact CD2-CD2 3.81Å; L341-L352 HydrophobicContact CD2-CG 3.61Å; L341-L352 HydrophobicContact CG-CD2 4.21Å; L341-L352 HydrophobicContact CG-CG 4.39Å; I350-L352 PolarHBondContact O-N 3.43Å; L352-D354 VanDerWaalsContact C-N 3.27Å; L352-D354 PolarHBondContact O-N 3.35Å; L352-L355 WeakPolarHBondContact O-CB 3.28Å; L352-L355 PolarHBondContact O-N 2.91Å; L352-L355 VanDerWaalsContact O-N 3.16Å; L352-I356 HydrophobicContact CD1-CD1 4.14Å; L352-I356 HydrophobicContact CD1-CG1 3.97Å; L352-I356 HydrophobicContact CG-CG1 4.2Å; L352-I356 VanDerWaalsContact O-CG1 3.28Å; L352-I356 WeakPolarHBondContact O-CG1 2.78Å; L352-I356 PolarHBondContact O-N 3.48Å
353	K	90.8	Very high	81	Confident	35 Å²	35	47.8 Å²	47.8	15%	0.152	25%	0.252	C	S	.	.	H	α-helix	trans	-56.6	-43.5	178.4	-178	-165.2	171.6	-164.8	0	111.6	L322 N325 L341 N351 I356 L357	L322-K353 HydrophobicContact CD2-CG 4.37Å; L322-K353 WeakPolarHBondContact O-CE 3.38Å; L322-K353 PolarHBondContact O-NZ 3.31Å; N325-K353 VanDerWaalsContact CG-NZ 3.28Å; N325-K353 PolarHBondContact OD1-NZ 2.77Å; L341-K353 HydrophobicContact CD2-CB 3.88Å; N351-K353 PolarHBondContact O-N 2.96Å; N351-K353 VanDerWaalsContact OD1-CB 3.29Å; N351-K353 WeakPolarHBondContact OD1-CB 3.31Å; N351-K353 PolarHBondContact OD1-N 3.16Å; N351-K353 VanDerWaalsContact OD1-N 3.16Å; K353-I356 PolarHBondContact O-N 3.3Å; K353-L357 HydrophobicContact CG-CD1 4.17Å; K353-L357 WeakPolarHBondContact O-CB 3Å; K353-L357 WeakPolarHBondContact O-CG 3.49Å; K353-L357 PolarHBondContact O-N 2.69Å
354	D	88.3	Confident	81.3	Confident	44 Å²	44	42.1 Å²	42.1	24%	0.235	23%	0.228	C	C	.	.	H	α-helix	trans	-67.2	-38.1	-179.3	-77.8	-2.7	0	0	0	112.1	R45 N351 L352 Y358	R45-D354 IonicContact CZ-OD2 3.59Å; R45-D354 IonicContact NH1-OD2 2.81Å; R45-D354 IonicContact NH2-OD1 3.75Å; R45-D354 PolarHBondContact NH2-OD1 3.12Å; R45-D354 IonicContact NH2-OD2 3.21Å; R45-D354 PolarHBondContact NH2-OD2 3Å; N351-D354 HydrophobicContact CB-CB 4.01Å; N351-D354 VanDerWaalsContact CG-CG 3.48Å; N351-D354 PolarHBondContact ND2-OD1 3.43Å; N351-D354 PolarHBondContact ND2-OD2 3.45Å; N351-D354 WeakPolarHBondContact O-CB 3.34Å; N351-D354 PolarHBondContact O-N 3.24Å; N351-D354 VanDerWaalsContact O-N 3.12Å; N351-D354 PolarHBondContact OD1-N 3.29Å; L352-D354 VanDerWaalsContact C-N 3.27Å; L352-D354 PolarHBondContact O-N 3.35Å; D354-Y358 WeakPolarHBondContact O-CB 3.29Å; D354-Y358 PolarHBondContact O-N 3.2Å
355	L	91.7	Very high	82.3	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.016	22%	0.224	C	C	.	.	H	α-helix	trans	-64.6	-45	175.3	-69.6	177	0	0	0	111.6	Q286 L289 L290 L293 I350 N351 L352 Y358 L359 F461	Q286-L355 HydrophobicContact CB-CD2 4.37Å; L289-L355 HydrophobicContact CB-CD1 4.23Å; L289-L355 HydrophobicContact CB-CD2 3.87Å; L289-L355 HydrophobicContact CD1-CD2 4.34Å; L290-L355 HydrophobicContact CD1-CD1 4.23Å; L293-L355 HydrophobicContact CD1-CD1 4.16Å; L293-L355 HydrophobicContact CG-CD1 4.45Å; I350-L355 HydrophobicContact CG2-CD1 3.55Å; N351-L355 PolarHBondContact O-N 3.31Å; L352-L355 WeakPolarHBondContact O-CB 3.28Å; L352-L355 PolarHBondContact O-N 2.91Å; L352-L355 VanDerWaalsContact O-N 3.16Å; L355-Y358 WeakPolarHBondContact O-CB 3.46Å; L355-Y358 PolarHBondContact O-N 2.69Å; L355-L359 PolarHBondContact O-N 3.15Å; L355-F461 HydrophobicContact CB-CZ 4.09Å; L355-F461 VanDerWaalsContact O-CZ 3.31Å; L355-F461 WeakPolarHBondContact O-CZ 3.49Å
356	I	93.8	Very high	84.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.7	-43	177.6	-60.5	-60	0	0	0	110.8	V301 F305 L322 I337 L352 K353 Y358 L359 L360	V301-I356 HydrophobicContact CB-CD1 4.31Å; V301-I356 HydrophobicContact CG1-CD1 3.48Å; V301-I356 VanDerWaalsContact CG1-CD1 3.48Å; V301-I356 HydrophobicContact CG2-CD1 3.78Å; F305-I356 HydrophobicContact CE2-CD1 3.86Å; F305-I356 HydrophobicContact CE2-CG2 4.4Å; F305-I356 HydrophobicContact CZ-CD1 4.49Å; F305-I356 HydrophobicContact CZ-CG2 4.02Å; L322-I356 HydrophobicContact CD1-CB 4.11Å; L322-I356 HydrophobicContact CD1-CG2 3.52Å; I337-I356 HydrophobicContact CG2-CD1 4.33Å; I337-I356 HydrophobicContact CG2-CG1 4.17Å; I337-I356 HydrophobicContact CG2-CG2 4.01Å; L352-I356 HydrophobicContact CD1-CD1 4.14Å; L352-I356 HydrophobicContact CD1-CG1 3.97Å; L352-I356 HydrophobicContact CG-CG1 4.2Å; L352-I356 VanDerWaalsContact O-CG1 3.28Å; L352-I356 WeakPolarHBondContact O-CG1 2.78Å; L352-I356 PolarHBondContact O-N 3.48Å; K353-I356 PolarHBondContact O-N 3.3Å; I356-Y358 VanDerWaalsContact C-N 3.33Å; I356-Y358 PolarHBondContact O-N 3.16Å; I356-L359 PolarHBondContact O-N 3.43Å; I356-L360 HydrophobicContact CG2-CD1 3.74Å; I356-L360 HydrophobicContact CG2-CG 4.38Å; I356-L360 WeakPolarHBondContact O-CB 3.42Å; I356-L360 VanDerWaalsContact O-CG 3.31Å; I356-L360 WeakPolarHBondContact O-CG 3.42Å; I356-L360 PolarHBondContact O-N 3.4Å
357	L	91.5	Very high	85.8	Confident	9 Å²	9	33.2 Å²	33.2	5%	0.047	17%	0.168	C	C	.	.	H	α-helix	trans	-61.5	-40.5	175.4	-83.1	175.7	0	0	0	112.2	M319 L322 E323 K353 L359 L360 Q361	M319-L357 HydrophobicContact CG-CD2 4.17Å; L322-L357 HydrophobicContact CB-CD1 4.22Å; L322-L357 HydrophobicContact CB-CD2 3.58Å; L322-L357 HydrophobicContact CB-CG 3.85Å; L322-L357 HydrophobicContact CD1-CD2 4.26Å; L322-L357 HydrophobicContact CD1-CG 4.19Å; E323-L357 HydrophobicContact CG-CD2 3.87Å; K353-L357 HydrophobicContact CG-CD1 4.17Å; K353-L357 WeakPolarHBondContact O-CB 3Å; K353-L357 WeakPolarHBondContact O-CG 3.49Å; K353-L357 PolarHBondContact O-N 2.69Å; L357-L359 PolarHBondContact O-N 3.07Å; L357-L360 PolarHBondContact O-N 3.44Å; L357-Q361 WeakPolarHBondContact O-CB 3.38Å; L357-Q361 VanDerWaalsContact O-CG 3.22Å; L357-Q361 WeakPolarHBondContact O-CG 3.36Å; L357-Q361 PolarHBondContact O-N 3.26Å
358	Y	91.6	Very high	87.4	Confident	1 Å²	1	26.7 Å²	26.7	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-56.7	-50.4	176.6	176.8	-92.8	0	0	0	111.8	R45 L46 E282 V283 Q286 D354 L355 I356 Q361 A362 F461	R45-Y358 HydrophobicContact CB-CD2 3.95Å; R45-Y358 HydrophobicContact CB-CE2 4.45Å; L46-Y358 HydrophobicContact CD1-CE2 3.85Å; L46-Y358 HydrophobicContact CD2-CE2 4.16Å; L46-Y358 HydrophobicContact CG-CE2 3.74Å; E282-Y358 HydrophobicContact CG-CE2 4.11Å; E282-Y358 WeakPolarHBondContact OE1-CE2 3.48Å; V283-Y358 WeakPolarHBondContact CG2-OH 3.4Å; Q286-Y358 HydrophobicContact CB-CD1 4.06Å; Q286-Y358 HydrophobicContact CB-CE1 3.98Å; Q286-Y358 HydrophobicContact CB-CG 4.44Å; Q286-Y358 HydrophobicContact CG-CD1 3.85Å; Q286-Y358 HydrophobicContact CG-CD2 3.7Å; Q286-Y358 HydrophobicContact CG-CE1 3.83Å; Q286-Y358 HydrophobicContact CG-CE2 3.66Å; Q286-Y358 HydrophobicContact CG-CG 3.77Å; D354-Y358 WeakPolarHBondContact O-CB 3.29Å; D354-Y358 PolarHBondContact O-N 3.2Å; L355-Y358 WeakPolarHBondContact O-CB 3.46Å; L355-Y358 PolarHBondContact O-N 2.69Å; I356-Y358 VanDerWaalsContact C-N 3.33Å; I356-Y358 PolarHBondContact O-N 3.16Å; Y358-Q361 PolarHBondContact O-N 2.87Å; Y358-A362 PolarHBondContact O-N 2.86Å; Y358-A362 VanDerWaalsContact O-N 3.16Å; Y358-F461 AromaticContact CD1-CD2 3.76Å; Y358-F461 HydrophobicContact CD1-CD2 3.76Å; Y358-F461 AromaticContact CD1-CE2 3.76Å; Y358-F461 HydrophobicContact CD1-CE2 3.76Å; Y358-F461 HydrophobicContact CE1-CD2 4.01Å; Y358-F461 HydrophobicContact CE1-CE2 4.41Å
359	L	94.3	Very high	88.7	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64	-46.5	177.8	176.2	56.3	0	0	0	111.4	F305 L355 I356 L357 Q361 A362 L363 F461 L465	F305-L359 HydrophobicContact CD1-CD2 4.03Å; F305-L359 HydrophobicContact CD2-CD2 3.65Å; F305-L359 HydrophobicContact CE1-CD2 3.88Å; F305-L359 HydrophobicContact CE1-CG 4.11Å; F305-L359 HydrophobicContact CE2-CD2 3.49Å; F305-L359 VanDerWaalsContact CE2-CD2 3.49Å; F305-L359 HydrophobicContact CE2-CG 4.35Å; F305-L359 HydrophobicContact CG-CD2 3.93Å; F305-L359 HydrophobicContact CZ-CB 4.29Å; F305-L359 HydrophobicContact CZ-CD2 3.61Å; F305-L359 HydrophobicContact CZ-CG 3.99Å; L355-L359 PolarHBondContact O-N 3.15Å; I356-L359 PolarHBondContact O-N 3.43Å; L357-L359 PolarHBondContact O-N 3.07Å; L359-Q361 VanDerWaalsContact C-N 3.3Å; L359-Q361 PolarHBondContact O-N 2.93Å; L359-A362 PolarHBondContact O-N 2.89Å; L359-A362 VanDerWaalsContact O-N 3.16Å; L359-L363 HydrophobicContact CD1-CD1 3.98Å; L359-L363 HydrophobicContact CD1-CD2 4.24Å; L359-L363 HydrophobicContact CD1-CG 3.86Å; L359-L363 HydrophobicContact CG-CD1 3.89Å; L359-L363 HydrophobicContact CG-CG 4.23Å; L359-L363 WeakPolarHBondContact O-CG 3.25Å; L359-L363 PolarHBondContact O-N 2.63Å; L359-F461 HydrophobicContact CB-CD1 4.07Å; L359-F461 HydrophobicContact CB-CD2 4.47Å; L359-F461 HydrophobicContact CB-CE1 4.04Å; L359-F461 HydrophobicContact CB-CE2 4.47Å; L359-F461 HydrophobicContact CB-CG 4.24Å; L359-F461 HydrophobicContact CB-CZ 4.25Å; L359-F461 HydrophobicContact CD1-CB 4.08Å; L359-F461 HydrophobicContact CD1-CD1 4.39Å; L359-F461 HydrophobicContact CD1-CG 4.31Å; L359-F461 HydrophobicContact CD2-CD1 3.6Å; L359-F461 HydrophobicContact CD2-CE1 3.92Å; L359-F461 HydrophobicContact CD2-CG 4.32Å; L359-F461 HydrophobicContact CG-CD1 4.23Å; L359-L465 HydrophobicContact CD2-CD1 4.44Å
360	L	94.1	Very high	89.5	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-57.8	-43.3	179.2	-75.1	166.5	0	0	0	112.1	F305 L315 L318 M319 L322 I356 L357 A362 L363 M364	F305-L360 HydrophobicContact CE1-CD2 3.67Å; F305-L360 HydrophobicContact CE1-CG 3.99Å; F305-L360 HydrophobicContact CZ-CD2 4.2Å; F305-L360 HydrophobicContact CZ-CG 4.03Å; L315-L360 HydrophobicContact CB-CD2 4.19Å; L315-L360 HydrophobicContact CD2-CD2 3.77Å; L318-L360 HydrophobicContact CB-CD1 4.47Å; L318-L360 HydrophobicContact CD2-CD1 4.03Å; L318-L360 HydrophobicContact CD2-CD2 4.38Å; L318-L360 HydrophobicContact CG-CD1 3.9Å; M319-L360 HydrophobicContact CB-CB 4.09Å; M319-L360 HydrophobicContact CB-CD1 4.06Å; M319-L360 HydrophobicContact CB-CG 4.49Å; M319-L360 HydrophobicContact CG-CB 4.2Å; L322-L360 HydrophobicContact CD1-CD1 3.91Å; I356-L360 HydrophobicContact CG2-CD1 3.74Å; I356-L360 HydrophobicContact CG2-CG 4.38Å; I356-L360 WeakPolarHBondContact O-CB 3.42Å; I356-L360 VanDerWaalsContact O-CG 3.31Å; I356-L360 WeakPolarHBondContact O-CG 3.42Å; I356-L360 PolarHBondContact O-N 3.4Å; L357-L360 PolarHBondContact O-N 3.44Å; L360-A362 PolarHBondContact O-N 3.43Å; L360-L363 PolarHBondContact O-N 2.92Å; L360-M364 WeakPolarHBondContact O-CB 3.28Å; L360-M364 VanDerWaalsContact O-CG 3.27Å; L360-M364 WeakPolarHBondContact O-CG 3.45Å; L360-M364 PolarHBondContact O-N 2.79Å
361	Q	91.3	Very high	90.4	Very high	21 Å²	21	17.4 Å²	17.4	10%	0.098	10%	0.095	C	C	.	.	H	α-helix	trans	-62.9	-41.3	177.8	-73.1	176.3	-0.8	0	0	112	S43 M319 E323 L357 Y358 L359 M364	S43-Q361 PolarHBondContact O-NE2 2.96Å; S43-Q361 PolarHBondContact O-OE1 3.46Å; M319-Q361 HydrophobicContact SD-CG 4.36Å; E323-Q361 PolarHBondContact OE1-NE2 2.83Å; L357-Q361 WeakPolarHBondContact O-CB 3.38Å; L357-Q361 VanDerWaalsContact O-CG 3.22Å; L357-Q361 WeakPolarHBondContact O-CG 3.36Å; L357-Q361 PolarHBondContact O-N 3.26Å; Y358-Q361 PolarHBondContact O-N 2.87Å; L359-Q361 VanDerWaalsContact C-N 3.3Å; L359-Q361 PolarHBondContact O-N 2.93Å; Q361-M364 PolarHBondContact O-N 2.85Å
362	A	93.2	Very high	90.5	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.4	-46.4	174.1	0	0	0	0	0	111.4	L46 Y358 L359 L360 M364 V365 A454 S458	L46-A362 HydrophobicContact CD1-CB 4.47Å; Y358-A362 PolarHBondContact O-N 2.86Å; Y358-A362 VanDerWaalsContact O-N 3.16Å; L359-A362 PolarHBondContact O-N 2.89Å; L359-A362 VanDerWaalsContact O-N 3.16Å; L360-A362 PolarHBondContact O-N 3.43Å; A362-M364 VanDerWaalsContact C-N 3.29Å; A362-M364 PolarHBondContact O-N 2.92Å; A362-V365 WeakPolarHBondContact O-CB 3.43Å; A362-V365 PolarHBondContact O-N 3.02Å; A362-V365 VanDerWaalsContact O-N 3.16Å; A362-A454 HydrophobicContact CB-CB 4.49Å; A362-A454 WeakPolarHBondContact O-CB 3.26Å; A362-S458 WeakPolarHBondContact CB-OG 3.47Å
363	L	94.3	Very high	90.4	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.8	-35.6	177.5	-65.5	175.1	0	0	0	112.3	F305 L309 L315 L359 L360 V365 L366 L371 L374	F305-L363 HydrophobicContact CD1-CD1 3.95Å; F305-L363 HydrophobicContact CE1-CD1 3.95Å; L309-L363 HydrophobicContact CD2-CD1 4.09Å; L309-L363 HydrophobicContact CD2-CD2 3.84Å; L315-L363 HydrophobicContact CD1-CD1 4.48Å; L315-L363 HydrophobicContact CD2-CD1 4.26Å; L359-L363 HydrophobicContact CD1-CD1 3.98Å; L359-L363 HydrophobicContact CD1-CD2 4.24Å; L359-L363 HydrophobicContact CD1-CG 3.86Å; L359-L363 HydrophobicContact CG-CD1 3.89Å; L359-L363 HydrophobicContact CG-CG 4.23Å; L359-L363 WeakPolarHBondContact O-CG 3.25Å; L359-L363 PolarHBondContact O-N 2.63Å; L360-L363 PolarHBondContact O-N 2.92Å; L363-V365 PolarHBondContact O-N 3.35Å; L363-L366 HydrophobicContact CD2-CD1 4.32Å; L363-L366 WeakPolarHBondContact O-CB 3.47Å; L363-L366 PolarHBondContact O-N 3.04Å; L363-L366 VanDerWaalsContact O-N 3.08Å; L363-L371 HydrophobicContact CB-CD2 3.83Å; L363-L371 HydrophobicContact CD2-CD2 3.68Å; L363-L371 HydrophobicContact CG-CD2 4.29Å; L363-L374 HydrophobicContact CD2-CD1 3.83Å
364	M	91	Very high	90.6	Very high	17 Å²	17	15.3 Å²	15.3	8%	0.084	9%	0.089	C	C	.	.	H	α-helix	trans	-67.6	-15.5	178.8	-73.9	-53.1	94.7	0	0	114.5	R312 L315 Y316 M319 L360 Q361 A362	R312-M364 HydrophobicContact CG-CE 4.3Å; R312-M364 HydrophobicContact CG-SD 4.33Å; R312-M364 PolarHBondContact NH1-O 2.89Å; L315-M364 HydrophobicContact CB-CE 3.47Å; L315-M364 VanDerWaalsContact CB-CE 3.47Å; L315-M364 HydrophobicContact CD1-CE 3.92Å; L315-M364 HydrophobicContact CG-CE 4.34Å; Y316-M364 HydrophobicContact CD2-SD 4.44Å; M319-M364 HydrophobicContact CE-CG 4.13Å; M319-M364 HydrophobicContact SD-CB 4.49Å; M319-M364 HydrophobicContact SD-CG 3.7Å; L360-M364 WeakPolarHBondContact O-CB 3.28Å; L360-M364 VanDerWaalsContact O-CG 3.27Å; L360-M364 WeakPolarHBondContact O-CG 3.45Å; L360-M364 PolarHBondContact O-N 2.79Å; Q361-M364 PolarHBondContact O-N 2.85Å; A362-M364 VanDerWaalsContact C-N 3.29Å; A362-M364 PolarHBondContact O-N 2.92Å
365	V	90.5	Very high	90.7	Very high	40 Å²	40	13.6 Å²	13.6	24%	0.242	8%	0.081	C	C	.	.	H	α-helix	trans	-79.6	-31.8	172.5	174.2	0	0	0	0	111.4	L48 A362 L363 M450 A454	L48-V365 HydrophobicContact CD1-CG2 3.95Å; L48-V365 HydrophobicContact CD2-CG1 4.5Å; L48-V365 HydrophobicContact CD2-CG2 3.72Å; L48-V365 HydrophobicContact CG-CG2 4.27Å; A362-V365 WeakPolarHBondContact O-CB 3.43Å; A362-V365 PolarHBondContact O-N 3.02Å; A362-V365 VanDerWaalsContact O-N 3.16Å; L363-V365 PolarHBondContact O-N 3.35Å; V365-M450 HydrophobicContact CB-SD 4.47Å; V365-M450 HydrophobicContact CG1-CG 4.28Å; V365-M450 HydrophobicContact CG1-SD 3.46Å; V365-M450 WeakPolarHBondContact CG1-SD 3.23Å; V365-M450 HydrophobicContact CG2-SD 4.17Å; V365-A454 HydrophobicContact CB-CB 3.57Å; V365-A454 HydrophobicContact CG1-CB 3.59Å; V365-A454 HydrophobicContact CG2-CB 4.11Å
366	L	91.6	Very high	90.5	Very high	2 Å²	2	15.4 Å²	15.4	1%	0.01	9%	0.09	C	C	.	.	S	Bend	trans	-74.1	154.1	-176.7	-55.1	-176.7	0	0	0	111.4	R312 L363 Q370 L371 L374 A454 L455	R312-L366 PolarHBondContact NH1-O 3.49Å; R312-L366 PolarHBondContact NH2-O 3.48Å; L363-L366 HydrophobicContact CD2-CD1 4.32Å; L363-L366 WeakPolarHBondContact O-CB 3.47Å; L363-L366 PolarHBondContact O-N 3.04Å; L363-L366 VanDerWaalsContact O-N 3.08Å; L366-Q370 VanDerWaalsContact CA-OE1 3.31Å; L366-Q370 HydrophobicContact CB-CB 3.96Å; L366-L371 HydrophobicContact CB-CD2 4.05Å; L366-L371 HydrophobicContact CB-CG 4.38Å; L366-L371 HydrophobicContact CD1-CD2 4.31Å; L366-L374 HydrophobicContact CD1-CD1 3.54Å; L366-A454 HydrophobicContact CD2-CB 4.04Å; L366-L455 HydrophobicContact CD1-CD1 4.35Å; L366-L455 HydrophobicContact CD2-CB 4.04Å
367	S	84.6	Confident	90.4	Very high	24 Å²	24	15.4 Å²	15.4	17%	0.168	9%	0.09	C	C	.	.			trans	-76.5	162.7	175.2	82.4	0	0	0	0	112.1	T369 Q370 L371 E430	S367-T369 PolarHBondContact O-N 2.8Å; S367-Q370 WeakPolarHBondContact O-CB 3.41Å; S367-Q370 PolarHBondContact O-N 2.97Å; S367-Q370 WeakPolarHBondContact OG-CG 3.21Å; S367-Q370 PolarHBondContact OG-N 2.73Å; S367-L371 WeakPolarHBondContact O-CG 3.46Å; S367-L371 PolarHBondContact O-N 3.34Å; S367-E430 VanDerWaalsContact CB-OE2 3.28Å; S367-E430 WeakPolarHBondContact CB-OE2 3.31Å; S367-E430 PolarHBondContact OG-OE2 3.26Å
368	D	83	Confident	90.5	Very high	40 Å²	40	16 Å²	16	21%	0.214	9%	0.094	C	C	.	.	H	α-helix	trans	-60.2	-38.3	179.5	-49.6	-30.4	0	0	0	111.1	S2 T4 R312 Q370 L371 C372	S2-D368 WeakPolarHBondContact CB-OD2 3.39Å; S2-D368 PolarHBondContact OG-OD2 3.37Å; T4-D368 WeakPolarHBondContact CG2-OD2 2.86Å; R312-D368 IonicContact CZ-OD1 3.2Å; R312-D368 IonicContact NE-OD1 3.93Å; R312-D368 PolarHBondContact NE-OD1 3.02Å; R312-D368 VanDerWaalsContact NH2-N 3.12Å; R312-D368 IonicContact NH2-OD1 2.69Å; R312-D368 PolarHBondContact NH2-OD1 2.78Å; D368-Q370 VanDerWaalsContact C-N 3.34Å; D368-Q370 PolarHBondContact O-N 3.16Å; D368-L371 PolarHBondContact O-N 3.18Å; D368-C372 PolarHBondContact O-N 2.7Å; D368-C372 VanDerWaalsContact O-N 3.07Å; D368-C372 PolarHBondContact O-SG 2.9Å; D368-C372 VanDerWaalsContact O-SG 3.39Å
369	T	84.2	Confident	90.2	Very high	46 Å²	46	19.8 Å²	19.8	28%	0.282	11%	0.112	S	C	.	.	H	α-helix	trans	-57.7	-48.9	174.2	-53.8	0	0	0	0	110.3	S367 L371 C372 L373 E426 E430	S367-T369 PolarHBondContact O-N 2.8Å; T369-L371 VanDerWaalsContact C-N 3.33Å; T369-L371 PolarHBondContact O-N 3.42Å; T369-C372 PolarHBondContact O-N 2.93Å; T369-L373 HydrophobicContact CG2-CD1 3.89Å; T369-L373 HydrophobicContact CG2-CG 4.37Å; T369-L373 VanDerWaalsContact O-CG 3.25Å; T369-L373 WeakPolarHBondContact O-CG 3.42Å; T369-L373 PolarHBondContact O-N 2.94Å; T369-E426 HydrophobicContact CG2-CG 4.31Å; T369-E430 HydrophobicContact CG2-CG 4.26Å
370	Q	90.2	Very high	89.9	Confident	3 Å²	3	22.2 Å²	22.2	1%	0.014	12%	0.124	C	C	.	.	H	α-helix	trans	-62	-40.8	179.6	-70.2	176.9	-53.9	0	0	112.4	L366 S367 D368 C372 L373 L374 L427 E430 C431	L366-Q370 VanDerWaalsContact CA-OE1 3.31Å; L366-Q370 HydrophobicContact CB-CB 3.96Å; S367-Q370 WeakPolarHBondContact O-CB 3.41Å; S367-Q370 PolarHBondContact O-N 2.97Å; S367-Q370 WeakPolarHBondContact OG-CG 3.21Å; S367-Q370 PolarHBondContact OG-N 2.73Å; D368-Q370 VanDerWaalsContact C-N 3.34Å; D368-Q370 PolarHBondContact O-N 3.16Å; Q370-C372 PolarHBondContact O-N 3.44Å; Q370-L373 PolarHBondContact O-N 2.98Å; Q370-L374 WeakPolarHBondContact O-CG 3.19Å; Q370-L374 PolarHBondContact O-N 2.82Å; Q370-L427 HydrophobicContact CB-CD2 3.97Å; Q370-L427 HydrophobicContact CG-CD2 4.12Å; Q370-L427 PolarHBondContact NE2-O 2.9Å; Q370-E430 VanDerWaalsContact CD-CB 3.5Å; Q370-E430 HydrophobicContact CG-CB 3.36Å; Q370-E430 HydrophobicContact CG-CG 4.15Å; Q370-C431 PolarHBondContact NE2-SG 3.24Å
371	L	91.2	Very high	89.9	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-63.5	-42.5	178.4	-60	173.2	0	0	0	111.9	L309 L315 L363 L366 S367 D368 T369 L373 L374 A375	L309-L371 HydrophobicContact CD2-CD2 4.4Å; L309-L371 WeakPolarHBondContact O-CB 3.38Å; L315-L371 HydrophobicContact CD1-CD1 4.05Å; L363-L371 HydrophobicContact CB-CD2 3.83Å; L363-L371 HydrophobicContact CD2-CD2 3.68Å; L363-L371 HydrophobicContact CG-CD2 4.29Å; L366-L371 HydrophobicContact CB-CD2 4.05Å; L366-L371 HydrophobicContact CB-CG 4.38Å; L366-L371 HydrophobicContact CD1-CD2 4.31Å; S367-L371 WeakPolarHBondContact O-CG 3.46Å; S367-L371 PolarHBondContact O-N 3.34Å; D368-L371 PolarHBondContact O-N 3.18Å; T369-L371 VanDerWaalsContact C-N 3.33Å; T369-L371 PolarHBondContact O-N 3.42Å; L371-L373 PolarHBondContact O-N 2.8Å; L371-L374 WeakPolarHBondContact O-CB 3.27Å; L371-L374 PolarHBondContact O-N 3.47Å; L371-A375 PolarHBondContact O-N 2.96Å
372	C	88.9	Confident	90.1	Very high	48 Å²	48	31.8 Å²	31.8	32%	0.324	16%	0.16	S	C	.	.	H	α-helix	trans	-62.8	-40.6	173	-67.4	0	0	0	0	112.4	D368 T369 Q370 L374 A375 L376	D368-C372 PolarHBondContact O-N 2.7Å; D368-C372 VanDerWaalsContact O-N 3.07Å; D368-C372 PolarHBondContact O-SG 2.9Å; D368-C372 VanDerWaalsContact O-SG 3.39Å; T369-C372 PolarHBondContact O-N 2.93Å; Q370-C372 PolarHBondContact O-N 3.44Å; C372-L374 VanDerWaalsContact C-N 3.32Å; C372-L374 PolarHBondContact O-N 3.36Å; C372-A375 WeakPolarHBondContact O-CB 3.4Å; C372-A375 PolarHBondContact O-N 3.11Å; C372-L376 PolarHBondContact O-N 2.85Å
373	L	89.1	Confident	90.2	Very high	21 Å²	21	31.9 Å²	31.9	11%	0.11	16%	0.16	C	C	.	.	H	α-helix	trans	-66.6	-33.7	177.1	-69.6	169.3	0	0	0	112	T369 Q370 L371 A375 L376 S377 I423 E426 L427	T369-L373 HydrophobicContact CG2-CD1 3.89Å; T369-L373 HydrophobicContact CG2-CG 4.37Å; T369-L373 VanDerWaalsContact O-CG 3.25Å; T369-L373 WeakPolarHBondContact O-CG 3.42Å; T369-L373 PolarHBondContact O-N 2.94Å; Q370-L373 PolarHBondContact O-N 2.98Å; L371-L373 PolarHBondContact O-N 2.8Å; L373-A375 VanDerWaalsContact C-N 3.3Å; L373-A375 PolarHBondContact O-N 3.29Å; L373-L376 HydrophobicContact CD2-CD1 4.32Å; L373-L376 PolarHBondContact O-N 3.16Å; L373-S377 PolarHBondContact O-N 3.05Å; L373-S377 PolarHBondContact O-OG 2.74Å; L373-S377 VanDerWaalsContact O-OG 3.12Å; L373-I423 HydrophobicContact CB-CG2 4.33Å; L373-I423 HydrophobicContact CD2-CG1 4.34Å; L373-I423 HydrophobicContact CD2-CG2 4.13Å; L373-E426 HydrophobicContact CD1-CB 3.75Å; L373-E426 HydrophobicContact CD1-CG 3.45Å; L373-E426 VanDerWaalsContact CD1-CG 3.45Å; L373-L427 HydrophobicContact CB-CD1 4.47Å; L373-L427 HydrophobicContact CB-CD2 3.65Å; L373-L427 HydrophobicContact CB-CG 3.86Å; L373-L427 HydrophobicContact CD1-CD2 4.17Å; L373-L427 HydrophobicContact CD1-CG 4.09Å
374	L	94.7	Very high	90.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.6	-39.1	173.1	-75	176.7	0	0	0	111.8	L309 L363 L366 Q370 L371 C372 L376 S377 V378 L427 L455 L459 L462	L309-L374 HydrophobicContact CD1-CB 4.2Å; L309-L374 HydrophobicContact CD2-CB 4.44Å; L309-L374 HydrophobicContact CD2-CD1 4.5Å; L363-L374 HydrophobicContact CD2-CD1 3.83Å; L366-L374 HydrophobicContact CD1-CD1 3.54Å; Q370-L374 WeakPolarHBondContact O-CG 3.19Å; Q370-L374 PolarHBondContact O-N 2.82Å; L371-L374 WeakPolarHBondContact O-CB 3.27Å; L371-L374 PolarHBondContact O-N 3.47Å; C372-L374 VanDerWaalsContact C-N 3.32Å; C372-L374 PolarHBondContact O-N 3.36Å; L374-L376 VanDerWaalsContact C-N 3.35Å; L374-S377 WeakPolarHBondContact O-CB 3.49Å; L374-S377 PolarHBondContact O-N 2.94Å; L374-V378 VanDerWaalsContact O-CG2 3.27Å; L374-V378 WeakPolarHBondContact O-CG2 3.03Å; L374-V378 PolarHBondContact O-N 3.2Å; L374-L427 HydrophobicContact CD2-CD2 4.42Å; L374-L427 HydrophobicContact CG-CD2 4.35Å; L374-L455 HydrophobicContact CD2-CD1 3.97Å; L374-L459 HydrophobicContact CD2-CD2 3.41Å; L374-L459 VanDerWaalsContact CD2-CD2 3.41Å; L374-L459 HydrophobicContact CD2-CG 3.99Å; L374-L462 HydrophobicContact CB-CD1 4.28Å; L374-L462 HydrophobicContact CD1-CD1 4.27Å; L374-L462 HydrophobicContact CD2-CD1 4.45Å
375	A	90.4	Very high	90.6	Very high	9 Å²	9	37.3 Å²	37.3	7%	0.074	19%	0.19	C	C	.	.	H	α-helix	trans	-62.1	-43.7	175	0	0	0	0	0	111.3	L309 L371 C372 L373 V378 E379	L309-A375 HydrophobicContact CB-CB 4.19Å; L309-A375 HydrophobicContact CD1-CB 3.98Å; L371-A375 PolarHBondContact O-N 2.96Å; C372-A375 WeakPolarHBondContact O-CB 3.4Å; C372-A375 PolarHBondContact O-N 3.11Å; L373-A375 VanDerWaalsContact C-N 3.3Å; L373-A375 PolarHBondContact O-N 3.29Å; A375-V378 WeakPolarHBondContact O-CB 3.48Å; A375-V378 PolarHBondContact O-N 2.91Å; A375-E379 PolarHBondContact O-N 3.33Å; A375-E379 VanDerWaalsContact O-N 3.15Å
376	L	86.5	Confident	91	Very high	41 Å²	41	35.5 Å²	35.5	22%	0.215	18%	0.179	C	C	.	.	H	α-helix	trans	-64.4	-39.3	174.4	-68.1	173	0	0	0	112.2	L182 C372 L373 L374 V378 E379 M380 I423	L182-L376 HydrophobicContact CD1-CD2 4.21Å; C372-L376 PolarHBondContact O-N 2.85Å; L373-L376 HydrophobicContact CD2-CD1 4.32Å; L373-L376 PolarHBondContact O-N 3.16Å; L374-L376 VanDerWaalsContact C-N 3.35Å; L376-V378 VanDerWaalsContact C-N 3.27Å; L376-V378 PolarHBondContact O-N 3.38Å; L376-E379 PolarHBondContact O-N 3.42Å; L376-M380 WeakPolarHBondContact O-CB 3.37Å; L376-M380 WeakPolarHBondContact O-CG 3.4Å; L376-M380 PolarHBondContact O-N 3.44Å; L376-I423 HydrophobicContact CB-CD1 4.17Å
377	S	92.8	Very high	91.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-37.5	175.8	-70.3	0	0	0	0	112.7	L373 L374 R381 L382 Q386	L373-S377 PolarHBondContact O-N 3.05Å; L373-S377 PolarHBondContact O-OG 2.74Å; L373-S377 VanDerWaalsContact O-OG 3.12Å; L374-S377 WeakPolarHBondContact O-CB 3.49Å; L374-S377 PolarHBondContact O-N 2.94Å; S377-R381 PolarHBondContact O-N 3.48Å; S377-R381 VanDerWaalsContact O-N 3.15Å; S377-L382 PolarHBondContact O-N 2.78Å; S377-Q386 VanDerWaalsContact OG-CD 3.24Å; S377-Q386 PolarHBondContact OG-NE2 3.21Å; S377-Q386 PolarHBondContact OG-OE1 2.81Å
378	V	92.2	Very high	91.9	Very high	20 Å²	20	38.7 Å²	38.7	12%	0.121	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-51.5	174.3	176.5	0	0	0	0	110	F302 L306 L374 A375 L376 M380 R381 L383	F302-V378 HydrophobicContact CE2-CG1 4.15Å; F302-V378 HydrophobicContact CZ-CG1 3.55Å; L306-V378 HydrophobicContact CD1-CG1 4.13Å; L306-V378 HydrophobicContact CD2-CB 3.85Å; L306-V378 HydrophobicContact CD2-CG1 3.73Å; L306-V378 HydrophobicContact CD2-CG2 3.59Å; L374-V378 VanDerWaalsContact O-CG2 3.27Å; L374-V378 WeakPolarHBondContact O-CG2 3.03Å; L374-V378 PolarHBondContact O-N 3.2Å; A375-V378 WeakPolarHBondContact O-CB 3.48Å; A375-V378 PolarHBondContact O-N 2.91Å; L376-V378 VanDerWaalsContact C-N 3.27Å; L376-V378 PolarHBondContact O-N 3.38Å; V378-M380 VanDerWaalsContact C-N 3.29Å; V378-M380 PolarHBondContact O-N 2.87Å; V378-R381 PolarHBondContact O-N 2.76Å; V378-L383 HydrophobicContact CB-CD1 4.47Å; V378-L383 HydrophobicContact CG2-CD1 3.84Å; V378-L383 HydrophobicContact CG2-CD2 4.18Å; V378-L383 HydrophobicContact CG2-CG 4.35Å
379	E	86.7	Confident	92.6	Very high	81 Å²	81	36.8 Å²	36.8	38%	0.379	18%	0.182	S	C	.	.	H	α-helix	trans	-58.8	-42.2	-177.8	-172.6	177.6	174.7	0	0	111.8	A375 L376 R381	A375-E379 PolarHBondContact O-N 3.33Å; A375-E379 VanDerWaalsContact O-N 3.15Å; L376-E379 PolarHBondContact O-N 3.42Å; E379-R381 VanDerWaalsContact C-N 3.26Å; E379-R381 PolarHBondContact O-N 2.65Å
380	M	88.5	Confident	93.2	Very high	51 Å²	51	34.7 Å²	34.7	25%	0.251	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	3.7	178.7	-65.1	-170.4	68.5	0	0	113.8	I178 L376 V378 L382 E419 I423	I178-M380 HydrophobicContact CD1-CE 4.12Å; I178-M380 HydrophobicContact CD1-CG 4.41Å; I178-M380 HydrophobicContact CD1-SD 4.05Å; L376-M380 WeakPolarHBondContact O-CB 3.37Å; L376-M380 WeakPolarHBondContact O-CG 3.4Å; L376-M380 PolarHBondContact O-N 3.44Å; V378-M380 VanDerWaalsContact C-N 3.29Å; V378-M380 PolarHBondContact O-N 2.87Å; M380-L382 HydrophobicContact CB-CD1 3.89Å; M380-L382 HydrophobicContact CB-CD2 4.06Å; M380-L382 HydrophobicContact CB-CG 3.64Å; M380-L382 PolarHBondContact O-N 3.05Å; M380-L382 HydrophobicContact SD-CD1 4.49Å; M380-E419 HydrophobicContact CE-CB 3.87Å; M380-I423 HydrophobicContact SD-CD1 3.35Å; M380-I423 WeakPolarHBondContact SD-CD1 3.33Å
381	R	93.6	Very high	93.5	Very high	210 Å²	210	36.3 Å²	36.3	79%	0.792	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.3	39	179.7	-54.9	-178.8	179.4	-170.2	-2.9	113.3	S377 V378 E379	S377-R381 PolarHBondContact O-N 3.48Å; S377-R381 VanDerWaalsContact O-N 3.15Å; V378-R381 PolarHBondContact O-N 2.76Å; E379-R381 VanDerWaalsContact C-N 3.26Å; E379-R381 PolarHBondContact O-N 2.65Å
382	L	94.2	Very high	93.7	Very high	12 Å²	12	37.8 Å²	37.8	6%	0.063	19%	0.186	C	C	.	.			trans	-85.8	-16.7	-177.8	-54.4	178.9	0	0	0	112.8	S377 M380 H385 Q386 L416 I423	S377-L382 PolarHBondContact O-N 2.78Å; M380-L382 HydrophobicContact CB-CD1 3.89Å; M380-L382 HydrophobicContact CB-CD2 4.06Å; M380-L382 HydrophobicContact CB-CG 3.64Å; M380-L382 PolarHBondContact O-N 3.05Å; M380-L382 HydrophobicContact SD-CD1 4.49Å; L382-H385 PolarHBondContact O-N 3.02Å; L382-H385 VanDerWaalsContact O-N 3.11Å; L382-Q386 HydrophobicContact CB-CG 4.15Å; L382-Q386 WeakPolarHBondContact O-CG 3.35Å; L382-Q386 PolarHBondContact O-N 3.48Å; L382-L416 HydrophobicContact CB-CD2 4.16Å; L382-L416 HydrophobicContact CD2-CD2 4.05Å; L382-I423 HydrophobicContact CD1-CB 4.33Å; L382-I423 HydrophobicContact CD1-CD1 4.16Å; L382-I423 HydrophobicContact CD1-CG2 4.22Å
383	L	96.5	Very high	94	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-50.9	-50.1	-169	-55.9	176.7	0	0	0	114.2	V378 H385 Q386 V387 L459 L462 Q463	V378-L383 HydrophobicContact CB-CD1 4.47Å; V378-L383 HydrophobicContact CG2-CD1 3.84Å; V378-L383 HydrophobicContact CG2-CD2 4.18Å; V378-L383 HydrophobicContact CG2-CG 4.35Å; L383-H385 VanDerWaalsContact C-N 3.25Å; L383-H385 PolarHBondContact O-N 2.78Å; L383-Q386 PolarHBondContact O-N 3.2Å; L383-Q386 VanDerWaalsContact O-N 3.13Å; L383-V387 WeakPolarHBondContact O-CG2 3.31Å; L383-V387 PolarHBondContact O-N 3.3Å; L383-L459 HydrophobicContact CD2-CD2 3.66Å; L383-L462 HydrophobicContact CD1-CB 4.08Å; L383-Q463 HydrophobicContact CB-CB 4.1Å; L383-Q463 HydrophobicContact CB-CG 4.42Å; L383-Q463 HydrophobicContact CD1-CB 4.39Å
384	P	96.6	Very high	94.3	Very high	55 Å²	55	34.6 Å²	34.6	36%	0.357	17%	0.166	S	C	.	.	H	α-helix	trans	-60.7	-37	-176.7	-22.7	34.7	0	0	0	112.8	E388 Q463	P384-E388 PolarHBondContact O-N 2.68Å; P384-Q463 HydrophobicContact CG-CG 4.4Å
385	H	97.5	Very high	94.2	Very high	76 Å²	76	39.5 Å²	39.5	35%	0.352	19%	0.189	S	C	.	.	H	α-helix	trans	-74.7	-37.8	179.3	-53.1	106.7	0	0	0	111.5	L382 L383 L389 P415 L416	L382-H385 PolarHBondContact O-N 3.02Å; L382-H385 VanDerWaalsContact O-N 3.11Å; L383-H385 VanDerWaalsContact C-N 3.25Å; L383-H385 PolarHBondContact O-N 2.78Å; H385-L389 WeakPolarHBondContact O-CB 3.43Å; H385-L389 PolarHBondContact O-N 3.06Å; H385-P415 HydrophobicContact CB-CG 4.08Å; H385-P415 WeakPolarHBondContact CD2-CB 3.43Å; H385-P415 WeakPolarHBondContact CD2-CG 3.3Å; H385-P415 WeakPolarHBondContact NE2-CB 3.46Å; H385-L416 HydrophobicContact CB-CD1 4.28Å; H385-L416 HydrophobicContact CB-CD2 3.72Å; H385-L416 HydrophobicContact CB-CG 3.87Å
386	Q	97.7	Very high	94.2	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-68.2	-40.4	176.3	-71.3	178.4	-20.2	0	0	112	S377 L382 L383 L389 V390 L416 T424 L459	S377-Q386 VanDerWaalsContact OG-CD 3.24Å; S377-Q386 PolarHBondContact OG-NE2 3.21Å; S377-Q386 PolarHBondContact OG-OE1 2.81Å; L382-Q386 HydrophobicContact CB-CG 4.15Å; L382-Q386 WeakPolarHBondContact O-CG 3.35Å; L382-Q386 PolarHBondContact O-N 3.48Å; L383-Q386 PolarHBondContact O-N 3.2Å; L383-Q386 VanDerWaalsContact O-N 3.13Å; Q386-L389 PolarHBondContact O-N 2.9Å; Q386-V390 WeakPolarHBondContact O-CB 3.39Å; Q386-V390 VanDerWaalsContact O-CG2 3.27Å; Q386-V390 WeakPolarHBondContact O-CG2 3.46Å; Q386-V390 PolarHBondContact O-N 3.01Å; Q386-L416 HydrophobicContact CG-CD2 4.2Å; Q386-T424 HydrophobicContact CG-CG2 3.96Å; Q386-T424 PolarHBondContact NE2-OG1 3.48Å; Q386-L459 HydrophobicContact CB-CD1 3.86Å; Q386-L459 HydrophobicContact CB-CD2 4.04Å
387	V	97.8	Very high	94.5	Very high	9 Å²	9	40.9 Å²	40.9	6%	0.055	20%	0.199	C	C	.	.	H	α-helix	trans	-57.4	-51.6	175.5	170.2	0	0	0	0	110.6	L383 L389 V390 K391 Y456 L459	L383-V387 WeakPolarHBondContact O-CG2 3.31Å; L383-V387 PolarHBondContact O-N 3.3Å; V387-L389 PolarHBondContact O-N 2.89Å; V387-V390 PolarHBondContact O-N 2.89Å; V387-K391 VanDerWaalsContact O-CB 3.23Å; V387-K391 WeakPolarHBondContact O-CB 3.35Å; V387-K391 PolarHBondContact O-N 2.9Å; V387-Y456 HydrophobicContact CG1-CD2 4.41Å; V387-Y456 HydrophobicContact CG1-CE2 3.91Å; V387-L459 HydrophobicContact CG2-CB 3.53Å
388	E	97.5	Very high	94.3	Very high	84 Å²	84	41.3 Å²	41.3	39%	0.393	20%	0.201	S	C	.	.	H	α-helix	trans	-67.7	-36	-180	-76.3	-58.5	151.3	0	0	112.7	P384 K391 S392 L412	P384-E388 PolarHBondContact O-N 2.68Å; E388-K391 IonicContact OE1-NZ 3.03Å; E388-K391 PolarHBondContact OE1-NZ 2.97Å; E388-K391 IonicContact OE2-NZ 2.67Å; E388-K391 PolarHBondContact OE2-NZ 3.18Å; E388-S392 WeakPolarHBondContact O-CB 2.86Å; E388-S392 PolarHBondContact O-N 3.22Å; E388-L412 HydrophobicContact CB-CD2 4.42Å
389	L	97.6	Very high	93.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.5	-52	174.1	-173.9	70.9	0	0	0	111.4	H385 Q386 V387 K391 S392 I393 L408 L412 L413 L416 T424 L428	H385-L389 WeakPolarHBondContact O-CB 3.43Å; H385-L389 PolarHBondContact O-N 3.06Å; Q386-L389 PolarHBondContact O-N 2.9Å; V387-L389 PolarHBondContact O-N 2.89Å; L389-K391 VanDerWaalsContact C-N 3.32Å; L389-K391 PolarHBondContact O-N 3.09Å; L389-S392 WeakPolarHBondContact O-CB 3.5Å; L389-S392 PolarHBondContact O-N 2.86Å; L389-S392 VanDerWaalsContact O-N 3.13Å; L389-S392 PolarHBondContact O-OG 2.81Å; L389-I393 WeakPolarHBondContact O-CG1 3.43Å; L389-I393 PolarHBondContact O-N 3.45Å; L389-L408 HydrophobicContact CD1-CD2 3.92Å; L389-L412 HydrophobicContact CD1-CB 3.78Å; L389-L412 HydrophobicContact CD1-CD1 4.3Å; L389-L413 HydrophobicContact CD1-CD2 3.91Å; L389-L413 HydrophobicContact CD2-CD2 4.22Å; L389-L416 HydrophobicContact CD2-CD1 4Å; L389-T424 HydrophobicContact CD2-CG2 3.44Å; L389-T424 VanDerWaalsContact CD2-CG2 3.44Å; L389-L428 HydrophobicContact CD2-CD1 4.07Å
390	V	97.2	Very high	93.7	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-62.1	-41.8	-179	175.3	0	0	0	0	110.8	Q386 V387 S392 I393 L394 L428 L452 L455 Y456 L459	Q386-V390 WeakPolarHBondContact O-CB 3.39Å; Q386-V390 VanDerWaalsContact O-CG2 3.27Å; Q386-V390 WeakPolarHBondContact O-CG2 3.46Å; Q386-V390 PolarHBondContact O-N 3.01Å; V387-V390 PolarHBondContact O-N 2.89Å; V390-S392 VanDerWaalsContact C-N 3.34Å; V390-S392 PolarHBondContact O-N 3.17Å; V390-I393 WeakPolarHBondContact O-CB 3.3Å; V390-I393 PolarHBondContact O-N 3.46Å; V390-I393 VanDerWaalsContact O-N 3.14Å; V390-L394 HydrophobicContact CG1-CD1 3.88Å; V390-L394 HydrophobicContact CG1-CG 4.36Å; V390-L394 PolarHBondContact O-N 2.8Å; V390-L428 HydrophobicContact CG2-CD2 4.07Å; V390-L452 HydrophobicContact CG1-CD2 4.35Å; V390-L455 HydrophobicContact CG2-CD2 3.92Å; V390-L455 HydrophobicContact CG2-CG 4.3Å; V390-Y456 HydrophobicContact CG1-CD2 4.5Å; V390-L459 HydrophobicContact CG2-CD1 3.86Å
391	K	96.2	Very high	93.4	Very high	38 Å²	38	45.3 Å²	45.3	17%	0.165	22%	0.218	C	C	.	.	H	α-helix	trans	-58.9	-42.6	173.4	172.4	168.4	161.1	-147.8	0	112.6	F276 V387 E388 L389 I393 L394 Q395 Y456	F276-K391 HydrophobicContact CE1-CG 4.46Å; F276-K391 HydrophobicContact CZ-CG 3.92Å; V387-K391 VanDerWaalsContact O-CB 3.23Å; V387-K391 WeakPolarHBondContact O-CB 3.35Å; V387-K391 PolarHBondContact O-N 2.9Å; E388-K391 IonicContact OE1-NZ 3.03Å; E388-K391 PolarHBondContact OE1-NZ 2.97Å; E388-K391 IonicContact OE2-NZ 2.67Å; E388-K391 PolarHBondContact OE2-NZ 3.18Å; L389-K391 VanDerWaalsContact C-N 3.32Å; L389-K391 PolarHBondContact O-N 3.09Å; K391-I393 PolarHBondContact O-N 2.82Å; K391-L394 PolarHBondContact O-N 2.99Å; K391-Q395 WeakPolarHBondContact O-CB 3.05Å; K391-Q395 PolarHBondContact O-N 2.73Å; K391-Y456 HydrophobicContact CB-CD2 4.25Å; K391-Y456 HydrophobicContact CB-CE2 3.82Å; K391-Y456 HydrophobicContact CD-CE2 4.23Å; K391-Y456 HydrophobicContact CG-CE2 4.45Å
392	S	95.8	Very high	92.8	Very high	33 Å²	33	42.4 Å²	42.4	23%	0.231	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-25.3	177.5	81.2	0	0	0	0	113.4	E388 L389 V390 P396 L412	E388-S392 WeakPolarHBondContact O-CB 2.86Å; E388-S392 PolarHBondContact O-N 3.22Å; L389-S392 WeakPolarHBondContact O-CB 3.5Å; L389-S392 PolarHBondContact O-N 2.86Å; L389-S392 VanDerWaalsContact O-N 3.13Å; L389-S392 PolarHBondContact O-OG 2.81Å; V390-S392 VanDerWaalsContact C-N 3.34Å; V390-S392 PolarHBondContact O-N 3.17Å; S392-P396 WeakPolarHBondContact O-CD 3.41Å; S392-P396 VanDerWaalsContact O-CG 3.28Å; S392-P396 WeakPolarHBondContact O-CG 3.5Å; S392-L412 VanDerWaalsContact CB-CD1 3.45Å; S392-L412 VanDerWaalsContact OG-CD1 3.26Å; S392-L412 WeakPolarHBondContact OG-CD1 3.17Å
393	I	95.5	Very high	92.5	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-80.3	-48.4	173.8	-60.5	166.2	0	0	0	109.9	L389 V390 K391 N397 F406 L408 L428 L433 W444 L452	L389-I393 WeakPolarHBondContact O-CG1 3.43Å; L389-I393 PolarHBondContact O-N 3.45Å; V390-I393 WeakPolarHBondContact O-CB 3.3Å; V390-I393 PolarHBondContact O-N 3.46Å; V390-I393 VanDerWaalsContact O-N 3.14Å; K391-I393 PolarHBondContact O-N 2.82Å; I393-N397 WeakPolarHBondContact O-CB 3.19Å; I393-N397 PolarHBondContact O-ND2 3.15Å; I393-F406 HydrophobicContact CD1-CE2 4.37Å; I393-F406 HydrophobicContact CG1-CE2 3.95Å; I393-F406 HydrophobicContact CG1-CZ 4.38Å; I393-F406 HydrophobicContact CG2-CE1 4.22Å; I393-F406 HydrophobicContact CG2-CE2 4.07Å; I393-F406 HydrophobicContact CG2-CZ 3.77Å; I393-L408 HydrophobicContact CD1-CD2 3.73Å; I393-L408 HydrophobicContact CG1-CD2 3.59Å; I393-L428 HydrophobicContact CD1-CD1 3.87Å; I393-L428 HydrophobicContact CD1-CD2 3.72Å; I393-L428 HydrophobicContact CD1-CG 4.47Å; I393-L433 HydrophobicContact CD1-CD1 4.34Å; I393-L433 HydrophobicContact CG2-CD1 4.32Å; I393-W444 HydrophobicContact CG2-CE3 4.42Å; I393-L452 HydrophobicContact CG2-CD1 4.27Å
394	L	94.2	Very high	92.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.3	-53.3	-176.4	-74.8	169.5	0	0	0	111.7	F276 L279 V390 K391 N397 F398 W444 L452 Y456	F276-L394 HydrophobicContact CD2-CB 3.67Å; F276-L394 HydrophobicContact CE2-CB 3.49Å; F276-L394 VanDerWaalsContact CE2-CB 3.49Å; F276-L394 HydrophobicContact CE2-CD1 4.07Å; F276-L394 HydrophobicContact CE2-CG 4.43Å; F276-L394 HydrophobicContact CZ-CB 4.45Å; L279-L394 HydrophobicContact CD2-CD1 4.07Å; V390-L394 HydrophobicContact CG1-CD1 3.88Å; V390-L394 HydrophobicContact CG1-CG 4.36Å; V390-L394 PolarHBondContact O-N 2.8Å; K391-L394 PolarHBondContact O-N 2.99Å; L394-N397 PolarHBondContact O-N 3.37Å; L394-N397 VanDerWaalsContact O-N 3.07Å; L394-F398 HydrophobicContact CB-CD2 4.48Å; L394-F398 HydrophobicContact CD2-CD2 3.81Å; L394-F398 HydrophobicContact CD2-CE2 4.01Å; L394-F398 VanDerWaalsContact O-CB 3.31Å; L394-F398 WeakPolarHBondContact O-CB 3.43Å; L394-F398 PolarHBondContact O-N 2.83Å; L394-W444 HydrophobicContact CD2-CH2 4.13Å; L394-W444 HydrophobicContact CD2-CZ3 4.26Å; L394-L452 HydrophobicContact CD2-CB 3.69Å; L394-L452 HydrophobicContact CG-CB 4.25Å; L394-Y456 HydrophobicContact CD1-CD1 4.43Å; L394-Y456 HydrophobicContact CD1-CG 4.02Å
395	Q	93.4	Very high	92	Very high	102 Å²	102	50.2 Å²	50.2	48%	0.477	25%	0.251	S	S	.	.	H	α-helix	trans	-51.9	-50	-169.4	-178	178.2	-3.5	0	0	115.2	F276 K391	F276-Q395 HydrophobicContact CD1-CB 3.68Å; F276-Q395 HydrophobicContact CD1-CG 3.74Å; F276-Q395 HydrophobicContact CE1-CB 3.64Å; F276-Q395 HydrophobicContact CE1-CG 3.91Å; F276-Q395 HydrophobicContact CG-CB 4.26Å; F276-Q395 HydrophobicContact CZ-CB 4.18Å; K391-Q395 WeakPolarHBondContact O-CB 3.05Å; K391-Q395 PolarHBondContact O-N 2.73Å
396	P	91.1	Very high	91.8	Very high	70 Å²	70	47.7 Å²	47.7	46%	0.455	24%	0.239	S	C	.	.	H	α-helix	trans	-77.4	-24.9	179.8	29.3	-34.5	0	0	0	113.6	S392 Y400	S392-P396 WeakPolarHBondContact O-CD 3.41Å; S392-P396 VanDerWaalsContact O-CG 3.28Å; S392-P396 WeakPolarHBondContact O-CG 3.5Å; P396-Y400 WeakPolarHBondContact O-CE2 3.06Å
397	N	91.9	Very high	91.7	Very high	9 Å²	9	51.6 Å²	51.6	5%	0.048	26%	0.264	C	S	.	.	H	α-helix	trans	-100.2	-20.6	-169.4	-62.1	-58.6	0	0	0	113.9	I393 L394 K399 Y400 W444	I393-N397 WeakPolarHBondContact O-CB 3.19Å; I393-N397 PolarHBondContact O-ND2 3.15Å; L394-N397 PolarHBondContact O-N 3.37Å; L394-N397 VanDerWaalsContact O-N 3.07Å; N397-K399 PolarHBondContact O-N 3.2Å; N397-Y400 PolarHBondContact O-N 3.42Å; N397-W444 HydrophobicContact CB-CB 4.24Å; N397-W444 HydrophobicContact CB-CD2 3.56Å; N397-W444 HydrophobicContact CB-CE3 3.74Å; N397-W444 HydrophobicContact CB-CG 3.78Å; N397-W444 HydrophobicContact CB-CZ2 4.5Å; N397-W444 HydrophobicContact CB-CZ3 4.27Å; N397-W444 PolarHBondContact O-NE1 2.94Å
398	F	88.9	Confident	91.5	Very high	9 Å²	9	51.3 Å²	51.3	4%	0.039	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-37.1	-167.3	-154.6	-107.9	0	0	0	114.9	L274 F276 L279 L394 Y400 K449 S453	L274-F398 WeakPolarHBondContact O-CD1 3.12Å; L274-F398 WeakPolarHBondContact O-CE1 3.24Å; F276-F398 HydrophobicContact CB-CB 3.81Å; F276-F398 HydrophobicContact CB-CD1 4.01Å; F276-F398 HydrophobicContact CB-CG 3.89Å; F276-F398 HydrophobicContact CD2-CD2 4.32Å; F276-F398 HydrophobicContact CD2-CG 4.48Å; F276-F398 VanDerWaalsContact N-CD1 3.26Å; L279-F398 HydrophobicContact CB-CZ 4.38Å; L279-F398 HydrophobicContact CD2-CE2 3.78Å; L279-F398 HydrophobicContact CD2-CZ 3.99Å; L394-F398 HydrophobicContact CB-CD2 4.48Å; L394-F398 HydrophobicContact CD2-CD2 3.81Å; L394-F398 HydrophobicContact CD2-CE2 4.01Å; L394-F398 VanDerWaalsContact O-CB 3.31Å; L394-F398 WeakPolarHBondContact O-CB 3.43Å; L394-F398 PolarHBondContact O-N 2.83Å; F398-Y400 PolarHBondContact O-N 3.39Å; F398-K449 HydrophobicContact CD2-CD 4.43Å; F398-K449 HydrophobicContact CD2-CG 4.1Å; F398-K449 HydrophobicContact CE2-CD 4.29Å; F398-K449 HydrophobicContact CE2-CG 3.78Å; F398-K449 HydrophobicContact CZ-CD 4.43Å; F398-K449 HydrophobicContact CZ-CG 4.26Å; F398-K449 WeakPolarHBondContact O-CE 3.46Å; F398-K449 PolarHBondContact O-NZ 2.93Å; F398-S453 WeakPolarHBondContact CE2-OG 3.45Å
399	K	84.6	Confident	91.2	Very high	116 Å²	116	52.6 Å²	52.6	50%	0.504	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-7.7	-175.5	68.6	-175.7	-177.4	-177	0	114.4	N397	N397-K399 PolarHBondContact O-N 3.2Å
400	Y	82.4	Confident	90.9	Very high	72 Å²	72	56.9 Å²	56.9	28%	0.282	30%	0.295	S	S	.	.			trans	-103.6	123	-171.4	-62.2	-68.5	0	0	0	111.5	P396 N397 F398 W402 I404 W444	P396-Y400 WeakPolarHBondContact O-CE2 3.06Å; N397-Y400 PolarHBondContact O-N 3.42Å; F398-Y400 PolarHBondContact O-N 3.39Å; Y400-W402 VanDerWaalsContact C-N 3.29Å; Y400-W402 AromaticContact CD1-CE2 3.89Å; Y400-W402 HydrophobicContact CD1-CH2 4.11Å; Y400-W402 AromaticContact CD1-CZ2 3.46Å; Y400-W402 HydrophobicContact CD1-CZ2 3.46Å; Y400-W402 VanDerWaalsContact CD1-CZ2 3.46Å; Y400-W402 AromaticContact CE1-CZ2 3.99Å; Y400-W402 HydrophobicContact CE1-CZ2 3.99Å; Y400-W402 HydrophobicContact CG-CZ2 4.46Å; Y400-W402 PolarHBondContact O-N 3.49Å; Y400-I404 HydrophobicContact CD1-CD1 3.73Å; Y400-I404 HydrophobicContact CD2-CD1 3.15Å; Y400-I404 HydrophobicContact CE1-CD1 4.24Å; Y400-I404 HydrophobicContact CE2-CD1 3.72Å; Y400-I404 HydrophobicContact CG-CD1 3.12Å; Y400-W444 PolarHBondContact O-NE1 3.45Å
401	P	81.9	Confident	90.8	Very high	49 Å²	49	63.3 Å²	63.3	32%	0.318	33%	0.325	S	S	.	.	S	Bend	trans	-87.6	10.1	178.1	34.7	-35.1	0	0	0	113.9	L446	P401-L446 HydrophobicContact CB-CD2 4.22Å
402	W	81.3	Confident	90.7	Very high	149 Å²	149	63.3 Å²	63.3	56%	0.564	33%	0.327	S	S	*	.	S	Bend	trans	-128.9	167.3	-179.6	55.9	77.4	0	0	0	111.6	Y400 I404	Y400-W402 VanDerWaalsContact C-N 3.29Å; Y400-W402 AromaticContact CD1-CE2 3.89Å; Y400-W402 HydrophobicContact CD1-CH2 4.11Å; Y400-W402 AromaticContact CD1-CZ2 3.46Å; Y400-W402 HydrophobicContact CD1-CZ2 3.46Å; Y400-W402 VanDerWaalsContact CD1-CZ2 3.46Å; Y400-W402 AromaticContact CE1-CZ2 3.99Å; Y400-W402 HydrophobicContact CE1-CZ2 3.99Å; Y400-W402 HydrophobicContact CG-CZ2 4.46Å; Y400-W402 PolarHBondContact O-N 3.49Å; W402-I404 PolarHBondContact O-N 3.28Å
403	N	87.9	Confident	90.5	Very high	95 Å²	95	62.5 Å²	62.5	51%	0.508	32%	0.32	S	S	.	.			trans	-69.7	127.2	-175.9	-65.2	-10	0	0	0	112	T443 W444	N403-T443 HydrophobicContact CB-CG2 3.88Å; N403-W444 WeakPolarHBondContact CA-O 3.49Å; N403-W444 PolarHBondContact OD1-O 3.36Å
404	I	89	Confident	90.3	Very high	30 Å²	30	65.3 Å²	65.3	15%	0.154	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	125.5	-177.8	-65.5	177.2	0	0	0	110.2	Y400 W402 F406 T443 W444	Y400-I404 HydrophobicContact CD1-CD1 3.73Å; Y400-I404 HydrophobicContact CD2-CD1 3.15Å; Y400-I404 HydrophobicContact CE1-CD1 4.24Å; Y400-I404 HydrophobicContact CE2-CD1 3.72Å; Y400-I404 HydrophobicContact CG-CD1 3.12Å; W402-I404 PolarHBondContact O-N 3.28Å; I404-F406 PolarHBondContact O-N 3.08Å; I404-T443 CarbonylContact O-C 3.47Å; I404-T443 WeakPolarHBondContact O-CA 3.46Å; I404-W444 HydrophobicContact CB-CB 4.24Å; I404-W444 PolarHBondContact N-O 2.95Å; I404-W444 WeakPolarHBondContact O-CB 3.33Å; I404-W444 PolarHBondContact O-N 3.29Å
405	P	92.9	Very high	90.3	Very high	109 Å²	109	68.1 Å²	68.1	71%	0.708	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	134.7	172.7	28.9	-33.4	0	0	0	110.3	S442	P405-S442 WeakPolarHBondContact CA-O 3.18Å
406	F	94.2	Very high	90.1	Very high	22 Å²	22	63.3 Å²	63.3	10%	0.096	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	163.7	171.3	68.4	-91.5	0	0	0	110.4	I393 I404 L408 L433 R441 S442 W444	I393-F406 HydrophobicContact CD1-CE2 4.37Å; I393-F406 HydrophobicContact CG1-CE2 3.95Å; I393-F406 HydrophobicContact CG1-CZ 4.38Å; I393-F406 HydrophobicContact CG2-CE1 4.22Å; I393-F406 HydrophobicContact CG2-CE2 4.07Å; I393-F406 HydrophobicContact CG2-CZ 3.77Å; I404-F406 PolarHBondContact O-N 3.08Å; F406-L408 HydrophobicContact CD2-CD2 4.24Å; F406-L408 HydrophobicContact CE2-CD2 3.71Å; F406-L408 HydrophobicContact CE2-CG 4.17Å; F406-L433 HydrophobicContact CE1-CD2 4.23Å; F406-L433 HydrophobicContact CZ-CD1 4.08Å; F406-L433 HydrophobicContact CZ-CD2 4.35Å; F406-R441 WeakPolarHBondContact O-CA 3.36Å; F406-S442 PolarHBondContact N-O 2.89Å; F406-S442 PolarHBondContact O-N 3.28Å; F406-S442 VanDerWaalsContact O-O 3.13Å; F406-W444 HydrophobicContact CD1-CB 4.06Å; F406-W444 HydrophobicContact CE1-CB 4.19Å
407	T	94.2	Very high	89.7	Confident	84 Å²	84	65.7 Å²	65.7	52%	0.515	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	127.3	177.6	-56.2	0	0	0	0	108.9	P440 R441	T407-P440 HydrophobicContact CG2-CB 4.34Å; T407-P440 HydrophobicContact CG2-CG 4.17Å; T407-R441 HydrophobicContact CG2-CG 4.24Å
408	L	93.9	Very high	89.2	Confident	3 Å²	3	68 Å²	68	2%	0.016	37%	0.37	C	S	.	.			trans	-68.4	135.6	175.8	-63.8	174.6	0	0	0	110.2	L389 I393 F406 L413 Y425 M435 P440	L389-L408 HydrophobicContact CD1-CD2 3.92Å; I393-L408 HydrophobicContact CD1-CD2 3.73Å; I393-L408 HydrophobicContact CG1-CD2 3.59Å; F406-L408 HydrophobicContact CD2-CD2 4.24Å; F406-L408 HydrophobicContact CE2-CD2 3.71Å; F406-L408 HydrophobicContact CE2-CG 4.17Å; L408-L413 HydrophobicContact CB-CD1 4.01Å; L408-L413 HydrophobicContact CB-CD2 4.35Å; L408-L413 HydrophobicContact CB-CG 4.34Å; L408-L413 HydrophobicContact CD1-CD2 4.19Å; L408-Y425 HydrophobicContact CD1-CE1 3.94Å; L408-M435 HydrophobicContact CD1-CE 3.64Å; L408-P440 HydrophobicContact CB-CB 4.16Å; L408-P440 PolarHBondContact N-O 3.23Å
409	Q	92.2	Very high	88.8	Confident	110 Å²	110	71 Å²	71	51%	0.514	38%	0.384	S	S	.	.			trans	-71	127.3	-178.8	-66.4	-173.3	1.4	0	0	110.2	Q411 L412 L413	Q409-Q411 PolarHBondContact O-N 3.25Å; Q409-Q411 VanDerWaalsContact O-N 3.1Å; Q409-L412 HydrophobicContact CB-CD1 4.13Å; Q409-L412 HydrophobicContact CB-CG 4.14Å; Q409-L412 PolarHBondContact O-N 3.33Å; Q409-L413 PolarHBondContact O-N 2.84Å
410	P	90.7	Very high	88.9	Confident	90 Å²	90	65.6 Å²	65.6	58%	0.584	36%	0.362	S	S	*	.	H	α-helix	trans	-54.9	-32	179.2	-27.7	35.1	0	0	0	113.6	L412 L413 A414	P410-L412 VanDerWaalsContact C-N 3.29Å; P410-L412 PolarHBondContact O-N 2.89Å; P410-L413 PolarHBondContact O-N 2.95Å; P410-A414 PolarHBondContact O-N 3.17Å
411	Q	94.5	Very high	89.2	Confident	138 Å²	138	63 Å²	63	65%	0.645	35%	0.353	S	S	*	.	H	α-helix	trans	-63.5	-34.2	178.9	-60.5	80.9	5.6	0	0	112.4	Q409 P415	Q409-Q411 PolarHBondContact O-N 3.25Å; Q409-Q411 VanDerWaalsContact O-N 3.1Å; Q411-P415 WeakPolarHBondContact O-CD 3.23Å
412	L	94.2	Very high	89.3	Confident	38 Å²	38	62.8 Å²	62.8	20%	0.199	36%	0.355	C	S	.	.	H	α-helix	trans	-80.2	-22.4	178.2	-60	177.1	0	0	0	112.1	E388 L389 S392 Q409 P410	E388-L412 HydrophobicContact CB-CD2 4.42Å; L389-L412 HydrophobicContact CD1-CB 3.78Å; L389-L412 HydrophobicContact CD1-CD1 4.3Å; S392-L412 VanDerWaalsContact CB-CD1 3.45Å; S392-L412 VanDerWaalsContact OG-CD1 3.26Å; S392-L412 WeakPolarHBondContact OG-CD1 3.17Å; Q409-L412 HydrophobicContact CB-CD1 4.13Å; Q409-L412 HydrophobicContact CB-CG 4.14Å; Q409-L412 PolarHBondContact O-N 3.33Å; P410-L412 VanDerWaalsContact C-N 3.29Å; P410-L412 PolarHBondContact O-N 2.89Å
413	L	92.1	Very high	89.6	Confident	15 Å²	15	56.2 Å²	56.2	8%	0.079	33%	0.331	C	S	.	.	H	α-helix	trans	-86.8	-27.9	177.2	-58.8	-178.9	0	0	0	113	L389 L408 Q409 P410 P415 L416 Q417 L421 Y425 P440	L389-L413 HydrophobicContact CD1-CD2 3.91Å; L389-L413 HydrophobicContact CD2-CD2 4.22Å; L408-L413 HydrophobicContact CB-CD1 4.01Å; L408-L413 HydrophobicContact CB-CD2 4.35Å; L408-L413 HydrophobicContact CB-CG 4.34Å; L408-L413 HydrophobicContact CD1-CD2 4.19Å; Q409-L413 PolarHBondContact O-N 2.84Å; P410-L413 PolarHBondContact O-N 2.95Å; L413-P415 VanDerWaalsContact C-CD 3.46Å; L413-L416 PolarHBondContact O-N 3.17Å; L413-Q417 PolarHBondContact O-NE2 3.24Å; L413-L421 HydrophobicContact CD2-CD1 3.95Å; L413-Y425 WeakPolarHBondContact CD1-OH 3.49Å; L413-Y425 HydrophobicContact CD2-CE1 3.93Å; L413-P440 HydrophobicContact CD1-CB 4.02Å
414	A	91.5	Very high	89.8	Confident	62 Å²	62	51.8 Å²	51.8	51%	0.512	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-52.7	-39.6	-179.8	0	0	0	0	0	115.5	P410 L416 Q417	P410-A414 PolarHBondContact O-N 3.17Å; A414-L416 VanDerWaalsContact C-N 3.32Å; A414-Q417 VanDerWaalsContact O-CG 3.25Å; A414-Q417 WeakPolarHBondContact O-CG 3.31Å
415	P	93.1	Very high	89.8	Confident	58 Å²	58	50.8 Å²	50.8	38%	0.377	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-79.2	-14.7	176.5	29.5	-34.7	0	0	0	113.8	H385 Q411 L413	H385-P415 HydrophobicContact CB-CG 4.08Å; H385-P415 WeakPolarHBondContact CD2-CB 3.43Å; H385-P415 WeakPolarHBondContact CD2-CG 3.3Å; H385-P415 WeakPolarHBondContact NE2-CB 3.46Å; Q411-P415 WeakPolarHBondContact O-CD 3.23Å; L413-P415 VanDerWaalsContact C-CD 3.46Å
416	L	89.1	Confident	89.5	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-95.3	14.4	-176.6	-68.2	170.9	0	0	0	112.3	L382 H385 Q386 L389 L413 A414 G420 L421 T424	L382-L416 HydrophobicContact CB-CD2 4.16Å; L382-L416 HydrophobicContact CD2-CD2 4.05Å; H385-L416 HydrophobicContact CB-CD1 4.28Å; H385-L416 HydrophobicContact CB-CD2 3.72Å; H385-L416 HydrophobicContact CB-CG 3.87Å; Q386-L416 HydrophobicContact CG-CD2 4.2Å; L389-L416 HydrophobicContact CD2-CD1 4Å; L413-L416 PolarHBondContact O-N 3.17Å; A414-L416 VanDerWaalsContact C-N 3.32Å; L416-G420 CarbonylContact O-C 3.56Å; L416-L421 WeakPolarHBondContact O-CA 3.5Å; L416-L421 WeakPolarHBondContact O-CB 3.35Å; L416-L421 PolarHBondContact O-N 3.43Å; L416-T424 HydrophobicContact CD1-CG2 3.98Å
417	Q	83.6	Confident	89.4	Confident	120 Å²	120	47.2 Å²	47.2	56%	0.561	28%	0.276	S	S	*	.			trans	-61.7	159	-170.3	-64	-64.6	-54.5	0	0	114.6	L413 A414 E419	L413-Q417 PolarHBondContact O-NE2 3.24Å; A414-Q417 VanDerWaalsContact O-CG 3.25Å; A414-Q417 WeakPolarHBondContact O-CG 3.31Å; Q417-E419 PolarHBondContact O-N 3.24Å
418	G	81.7	Confident	89.3	Confident	57 Å²	57	43.2 Å²	43.2	59%	0.588	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	-125.8	179.6	0	0	0	0	0	112.1	G420 L421 A422	G418-G420 VanDerWaalsContact C-N 3.31Å; G418-G420 PolarHBondContact O-N 2.79Å; G418-L421 WeakPolarHBondContact O-CB 3.47Å; G418-L421 PolarHBondContact O-N 3.21Å; G418-A422 PolarHBondContact O-N 3.12Å
419	E	80.9	Confident	89.1	Confident	73 Å²	73	47.7 Å²	47.7	34%	0.341	27%	0.272	S	S	.	.	H	α-helix	trans	-65.1	-33.8	-176.3	-68	154.8	161.9	0	0	112.3	I175 K176 M380 Q417 L421 A422 I423	I175-E419 HydrophobicContact CG2-CG 4.47Å; K176-E419 PolarHBondContact N-OE1 2.89Å; M380-E419 HydrophobicContact CE-CB 3.87Å; Q417-E419 PolarHBondContact O-N 3.24Å; E419-L421 PolarHBondContact O-N 3.46Å; E419-A422 PolarHBondContact O-N 3.44Å; E419-I423 WeakPolarHBondContact O-CG1 3.43Å; E419-I423 PolarHBondContact O-N 3.11Å
420	G	85.7	Confident	88.8	Confident	3 Å²	3	44.7 Å²	44.7	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-29.7	176.3	0	0	0	0	0	113.1	L416 G418 T424	L416-G420 CarbonylContact O-C 3.56Å; G418-G420 VanDerWaalsContact C-N 3.31Å; G418-G420 PolarHBondContact O-N 2.79Å; G420-T424 WeakPolarHBondContact O-CB 3.46Å; G420-T424 PolarHBondContact O-N 3.5Å; G420-T424 PolarHBondContact O-OG1 3.15Å
421	L	87.9	Confident	88.8	Confident	17 Å²	17	40.6 Å²	40.6	9%	0.089	23%	0.231	C	C	.	.	H	α-helix	trans	-78.4	-43.6	-175.4	-172.7	63.6	0	0	0	108.2	L413 L416 G418 E419 T424 Y425 L437	L413-L421 HydrophobicContact CD2-CD1 3.95Å; L416-L421 WeakPolarHBondContact O-CA 3.5Å; L416-L421 WeakPolarHBondContact O-CB 3.35Å; L416-L421 PolarHBondContact O-N 3.43Å; G418-L421 WeakPolarHBondContact O-CB 3.47Å; G418-L421 PolarHBondContact O-N 3.21Å; E419-L421 PolarHBondContact O-N 3.46Å; L421-T424 PolarHBondContact O-N 2.89Å; L421-Y425 HydrophobicContact CD1-CD1 3.77Å; L421-Y425 HydrophobicContact CD1-CE1 3.33Å; L421-Y425 HydrophobicContact CD1-CE2 4.49Å; L421-Y425 HydrophobicContact CG-CD1 4.2Å; L421-Y425 HydrophobicContact CG-CE1 4.08Å; L421-Y425 WeakPolarHBondContact O-CB 3.45Å; L421-Y425 WeakPolarHBondContact O-CD1 3.45Å; L421-Y425 PolarHBondContact O-N 3.06Å; L421-L437 HydrophobicContact CG-CD2 4.36Å
422	A	85.3	Confident	88.4	Confident	44 Å²	44	36.2 Å²	36.2	36%	0.364	22%	0.223	S	C	.	.	H	α-helix	trans	-58.7	-48.5	174.8	0	0	0	0	0	111.4	G418 E419 T424 Y425 E426 L437	G418-A422 PolarHBondContact O-N 3.12Å; E419-A422 PolarHBondContact O-N 3.44Å; A422-T424 VanDerWaalsContact C-N 3.32Å; A422-T424 PolarHBondContact O-N 2.96Å; A422-Y425 PolarHBondContact O-N 3.18Å; A422-E426 WeakPolarHBondContact O-CB 3.36Å; A422-E426 PolarHBondContact O-N 3.28Å; A422-L437 HydrophobicContact CB-CD2 4.34Å
423	I	87	Confident	88.1	Confident	11 Å²	11	34.6 Å²	34.6	6%	0.056	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-46	176.5	-69	166.5	0	0	0	110.8	L373 L376 M380 L382 E419 E426 L427	L373-I423 HydrophobicContact CB-CG2 4.33Å; L373-I423 HydrophobicContact CD2-CG1 4.34Å; L373-I423 HydrophobicContact CD2-CG2 4.13Å; L376-I423 HydrophobicContact CB-CD1 4.17Å; M380-I423 HydrophobicContact SD-CD1 3.35Å; M380-I423 WeakPolarHBondContact SD-CD1 3.33Å; L382-I423 HydrophobicContact CD1-CB 4.33Å; L382-I423 HydrophobicContact CD1-CD1 4.16Å; L382-I423 HydrophobicContact CD1-CG2 4.22Å; E419-I423 WeakPolarHBondContact O-CG1 3.43Å; E419-I423 PolarHBondContact O-N 3.11Å; I423-E426 PolarHBondContact O-N 2.94Å; I423-L427 HydrophobicContact CG2-CD1 4.35Å; I423-L427 WeakPolarHBondContact O-CG 3.42Å; I423-L427 PolarHBondContact O-N 3.32Å
424	T	91.7	Very high	87.9	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.018	25%	0.245	C	C	.	.	H	α-helix	trans	-68.6	-38.4	-177.5	-53.8	0	0	0	0	112.1	Q386 L389 L416 G420 L421 A422 L427 L428	Q386-T424 HydrophobicContact CG-CG2 3.96Å; Q386-T424 PolarHBondContact NE2-OG1 3.48Å; L389-T424 HydrophobicContact CD2-CG2 3.44Å; L389-T424 VanDerWaalsContact CD2-CG2 3.44Å; L416-T424 HydrophobicContact CD1-CG2 3.98Å; G420-T424 WeakPolarHBondContact O-CB 3.46Å; G420-T424 PolarHBondContact O-N 3.5Å; G420-T424 PolarHBondContact O-OG1 3.15Å; L421-T424 PolarHBondContact O-N 2.89Å; A422-T424 VanDerWaalsContact C-N 3.32Å; A422-T424 PolarHBondContact O-N 2.96Å; T424-L427 WeakPolarHBondContact O-CB 3.4Å; T424-L427 PolarHBondContact O-N 3.37Å; T424-L428 HydrophobicContact CG2-CD1 4.46Å; T424-L428 WeakPolarHBondContact O-CG 3.48Å; T424-L428 PolarHBondContact O-N 2.7Å; T424-L428 VanDerWaalsContact O-N 3.13Å
425	Y	90	Very high	87.5	Confident	9 Å²	9	39.7 Å²	39.7	4%	0.035	23%	0.225	C	C	.	.	H	α-helix	trans	-70.1	-39.2	179.1	-83.6	25.7	0	0	0	111.1	L408 L413 L421 A422 L427 L428 E429 M435 E436 L437	L408-Y425 HydrophobicContact CD1-CE1 3.94Å; L413-Y425 WeakPolarHBondContact CD1-OH 3.49Å; L413-Y425 HydrophobicContact CD2-CE1 3.93Å; L421-Y425 HydrophobicContact CD1-CD1 3.77Å; L421-Y425 HydrophobicContact CD1-CE1 3.33Å; L421-Y425 HydrophobicContact CD1-CE2 4.49Å; L421-Y425 HydrophobicContact CG-CD1 4.2Å; L421-Y425 HydrophobicContact CG-CE1 4.08Å; L421-Y425 WeakPolarHBondContact O-CB 3.45Å; L421-Y425 WeakPolarHBondContact O-CD1 3.45Å; L421-Y425 PolarHBondContact O-N 3.06Å; A422-Y425 PolarHBondContact O-N 3.18Å; Y425-L427 VanDerWaalsContact C-N 3.35Å; Y425-L427 PolarHBondContact O-N 2.93Å; Y425-L428 PolarHBondContact O-N 2.84Å; Y425-E429 WeakPolarHBondContact O-CB 3.33Å; Y425-E429 PolarHBondContact O-N 2.93Å; Y425-M435 HydrophobicContact CD1-CE 3.6Å; Y425-M435 HydrophobicContact CD2-CB 4.05Å; Y425-M435 HydrophobicContact CD2-CE 3.86Å; Y425-M435 HydrophobicContact CE1-CE 3.65Å; Y425-M435 HydrophobicContact CE2-CE 3.92Å; Y425-M435 HydrophobicContact CG-CB 4.21Å; Y425-M435 HydrophobicContact CG-CE 3.71Å; Y425-E436 WeakPolarHBondContact CE2-O 3.38Å; Y425-L437 HydrophobicContact CD2-CD2 4.03Å; Y425-L437 HydrophobicContact CG-CD2 4.45Å
426	E	86.7	Confident	86.8	Confident	53 Å²	53	42.4 Å²	42.4	25%	0.248	23%	0.233	C	C	.	.	H	α-helix	trans	-64	-39.6	173.9	-171.5	71.5	-159.6	0	0	111.6	T369 L373 A422 I423 L428 E429 E430	T369-E426 HydrophobicContact CG2-CG 4.31Å; L373-E426 HydrophobicContact CD1-CB 3.75Å; L373-E426 HydrophobicContact CD1-CG 3.45Å; L373-E426 VanDerWaalsContact CD1-CG 3.45Å; A422-E426 WeakPolarHBondContact O-CB 3.36Å; A422-E426 PolarHBondContact O-N 3.28Å; I423-E426 PolarHBondContact O-N 2.94Å; E426-L428 VanDerWaalsContact C-N 3.31Å; E426-L428 PolarHBondContact O-N 3.05Å; E426-E429 PolarHBondContact O-N 3.33Å; E426-E430 PolarHBondContact O-N 2.82Å
427	L	91.1	Very high	86.1	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-56.8	-44.8	172.8	-81	170.7	0	0	0	111.8	Q370 L373 L374 I423 T424 Y425 C431 L455	Q370-L427 HydrophobicContact CB-CD2 3.97Å; Q370-L427 HydrophobicContact CG-CD2 4.12Å; Q370-L427 PolarHBondContact NE2-O 2.9Å; L373-L427 HydrophobicContact CB-CD1 4.47Å; L373-L427 HydrophobicContact CB-CD2 3.65Å; L373-L427 HydrophobicContact CB-CG 3.86Å; L373-L427 HydrophobicContact CD1-CD2 4.17Å; L373-L427 HydrophobicContact CD1-CG 4.09Å; L374-L427 HydrophobicContact CD2-CD2 4.42Å; L374-L427 HydrophobicContact CG-CD2 4.35Å; I423-L427 HydrophobicContact CG2-CD1 4.35Å; I423-L427 WeakPolarHBondContact O-CG 3.42Å; I423-L427 PolarHBondContact O-N 3.32Å; T424-L427 WeakPolarHBondContact O-CB 3.4Å; T424-L427 PolarHBondContact O-N 3.37Å; Y425-L427 VanDerWaalsContact C-N 3.35Å; Y425-L427 PolarHBondContact O-N 2.93Å; L427-C431 PolarHBondContact O-N 2.83Å; L427-L455 HydrophobicContact CB-CD2 4.26Å; L427-L455 HydrophobicContact CD2-CD1 4.08Å
428	L	93.2	Very high	85.8	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-71.6	-36.1	179	-67.5	175.2	0	0	0	112.3	L389 V390 I393 T424 Y425 E426 C431 L433 M435 L452 L455	L389-L428 HydrophobicContact CD2-CD1 4.07Å; V390-L428 HydrophobicContact CG2-CD2 4.07Å; I393-L428 HydrophobicContact CD1-CD1 3.87Å; I393-L428 HydrophobicContact CD1-CD2 3.72Å; I393-L428 HydrophobicContact CD1-CG 4.47Å; T424-L428 HydrophobicContact CG2-CD1 4.46Å; T424-L428 WeakPolarHBondContact O-CG 3.48Å; T424-L428 PolarHBondContact O-N 2.7Å; T424-L428 VanDerWaalsContact O-N 3.13Å; Y425-L428 PolarHBondContact O-N 2.84Å; E426-L428 VanDerWaalsContact C-N 3.31Å; E426-L428 PolarHBondContact O-N 3.05Å; L428-C431 VanDerWaalsContact O-CB 3.3Å; L428-C431 WeakPolarHBondContact O-CB 3.19Å; L428-C431 PolarHBondContact O-N 3.35Å; L428-C431 VanDerWaalsContact O-N 3.16Å; L428-L433 HydrophobicContact CB-CD1 4.16Å; L428-L433 HydrophobicContact CD2-CD1 4.16Å; L428-L433 WeakPolarHBondContact O-CB 3.46Å; L428-L433 PolarHBondContact O-N 3Å; L428-M435 HydrophobicContact CB-CE 4.32Å; L428-M435 HydrophobicContact CB-CG 3.88Å; L428-M435 HydrophobicContact CB-SD 4.02Å; L428-M435 HydrophobicContact CD1-CE 3.66Å; L428-M435 HydrophobicContact CD1-SD 4.22Å; L428-L452 HydrophobicContact CD2-CD2 3.61Å; L428-L455 HydrophobicContact CD2-CD2 4.41Å
429	E	88.1	Confident	85.9	Confident	97 Å²	97	48.9 Å²	48.9	45%	0.453	26%	0.258	S	S	.	.	H	α-helix	trans	-67.3	-41.2	178.5	-173.3	167.7	-175.5	0	0	111.8	Y425 E426 C431 G432 L433 M435	Y425-E429 WeakPolarHBondContact O-CB 3.33Å; Y425-E429 PolarHBondContact O-N 2.93Å; E426-E429 PolarHBondContact O-N 3.33Å; E429-C431 PolarHBondContact O-N 3.24Å; E429-G432 WeakPolarHBondContact O-CA 3.2Å; E429-G432 PolarHBondContact O-N 2.87Å; E429-L433 VanDerWaalsContact CA-O 3.3Å; E429-L433 WeakPolarHBondContact CA-O 3.43Å; E429-M435 HydrophobicContact CB-CB 4.35Å; E429-M435 HydrophobicContact CB-CG 4.16Å
430	E	86.1	Confident	86.2	Confident	46 Å²	46	47.6 Å²	47.6	22%	0.215	26%	0.256	C	S	.	.	H	α-helix	trans	-68.9	-16.6	173.2	-73	-78.4	142.4	0	0	112.9	M1 S367 T369 Q370 E426 G432	M1-E430 PolarHBondContact N-OE1 2.67Å; M1-E430 PolarHBondContact N-OE2 3.47Å; S367-E430 VanDerWaalsContact CB-OE2 3.28Å; S367-E430 WeakPolarHBondContact CB-OE2 3.31Å; S367-E430 PolarHBondContact OG-OE2 3.26Å; T369-E430 HydrophobicContact CG2-CG 4.26Å; Q370-E430 VanDerWaalsContact CD-CB 3.5Å; Q370-E430 HydrophobicContact CG-CB 3.36Å; Q370-E430 HydrophobicContact CG-CG 4.15Å; E426-E430 PolarHBondContact O-N 2.82Å; E430-G432 PolarHBondContact O-N 2.76Å
431	C	90.7	Very high	86.4	Confident	4 Å²	4	55.7 Å²	55.7	3%	0.027	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-8.1	165.5	-73.6	0	0	0	0	113.3	Q370 L427 L428 E429 A448 P451 L452	Q370-C431 PolarHBondContact NE2-SG 3.24Å; L427-C431 PolarHBondContact O-N 2.83Å; L428-C431 VanDerWaalsContact O-CB 3.3Å; L428-C431 WeakPolarHBondContact O-CB 3.19Å; L428-C431 PolarHBondContact O-N 3.35Å; L428-C431 VanDerWaalsContact O-N 3.16Å; E429-C431 PolarHBondContact O-N 3.24Å; C431-A448 WeakPolarHBondContact O-CA 3.47Å; C431-A448 WeakPolarHBondContact O-CB 3.1Å; C431-P451 HydrophobicContact CB-CB 3.85Å; C431-L452 HydrophobicContact CB-CD2 3.86Å; C431-L452 HydrophobicContact CB-CG 3.81Å
432	G	86.1	Confident	86.6	Confident	46 Å²	46	55.2 Å²	55.2	47%	0.474	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.4	6.7	-178.6	0	0	0	0	0	114.8	E429 E430	E429-G432 WeakPolarHBondContact O-CA 3.2Å; E429-G432 PolarHBondContact O-N 2.87Å; E430-G432 PolarHBondContact O-N 2.76Å
433	L	89.3	Confident	86.9	Confident	4 Å²	4	56 Å²	56	2%	0.021	28%	0.284	C	S	.	.			trans	-81.8	150	172.7	-60.4	178.1	0	0	0	110.8	I393 F406 L428 E429 M435 A448 L452	I393-L433 HydrophobicContact CD1-CD1 4.34Å; I393-L433 HydrophobicContact CG2-CD1 4.32Å; F406-L433 HydrophobicContact CE1-CD2 4.23Å; F406-L433 HydrophobicContact CZ-CD1 4.08Å; F406-L433 HydrophobicContact CZ-CD2 4.35Å; L428-L433 HydrophobicContact CB-CD1 4.16Å; L428-L433 HydrophobicContact CD2-CD1 4.16Å; L428-L433 WeakPolarHBondContact O-CB 3.46Å; L428-L433 PolarHBondContact O-N 3Å; E429-L433 VanDerWaalsContact CA-O 3.3Å; E429-L433 WeakPolarHBondContact CA-O 3.43Å; L433-M435 HydrophobicContact CB-CG 4.32Å; L433-M435 HydrophobicContact CB-SD 4.02Å; L433-A448 HydrophobicContact CD2-CB 3.89Å; L433-A448 HydrophobicContact CG-CB 4.3Å; L433-L452 HydrophobicContact CD1-CD1 3.85Å; L433-L452 HydrophobicContact CD1-CD2 4.07Å; L433-L452 HydrophobicContact CD1-CG 4.49Å; L433-L452 HydrophobicContact CD2-CD1 4.21Å; L433-L452 HydrophobicContact CG-CD1 4.13Å
434	K	86.3	Confident	87.2	Confident	165 Å²	165	55.5 Å²	55.5	72%	0.717	28%	0.281	S	S	*	.			trans	-88.6	116	171.4	-66.4	-178.8	-178	177.3	0	109.1	S442	K434-S442 PolarHBondContact N-OG 2.93Å; K434-S442 VanDerWaalsContact O-CB 3.27Å; K434-S442 WeakPolarHBondContact O-CB 3.42Å; K434-S442 PolarHBondContact O-OG 3.36Å
435	M	84.1	Confident	87	Confident	19 Å²	19	58 Å²	58	9%	0.094	29%	0.294	C	S	.	.			trans	-118.9	139.1	-175.6	-57.7	-57.7	-62.4	0	0	110.5	L408 Y425 L428 E429 L433	L408-M435 HydrophobicContact CD1-CE 3.64Å; Y425-M435 HydrophobicContact CD1-CE 3.6Å; Y425-M435 HydrophobicContact CD2-CB 4.05Å; Y425-M435 HydrophobicContact CD2-CE 3.86Å; Y425-M435 HydrophobicContact CE1-CE 3.65Å; Y425-M435 HydrophobicContact CE2-CE 3.92Å; Y425-M435 HydrophobicContact CG-CB 4.21Å; Y425-M435 HydrophobicContact CG-CE 3.71Å; L428-M435 HydrophobicContact CB-CE 4.32Å; L428-M435 HydrophobicContact CB-CG 3.88Å; L428-M435 HydrophobicContact CB-SD 4.02Å; L428-M435 HydrophobicContact CD1-CE 3.66Å; L428-M435 HydrophobicContact CD1-SD 4.22Å; E429-M435 HydrophobicContact CB-CB 4.35Å; E429-M435 HydrophobicContact CB-CG 4.16Å; L433-M435 HydrophobicContact CB-CG 4.32Å; L433-M435 HydrophobicContact CB-SD 4.02Å
436	E	77.4	Confident	86.8	Confident	115 Å²	115	59.7 Å²	59.7	54%	0.537	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-137	120.1	179.5	-77.9	176	-171.8	0	0	108.2	Y425 N438 N439	Y425-E436 WeakPolarHBondContact CE2-O 3.38Å; E436-N438 PolarHBondContact O-N 2.84Å; E436-N439 HydrophobicContact CB-CB 3.84Å; E436-N439 CarbonylContact O-C 3.6Å; E436-N439 PolarHBondContact O-N 2.68Å; E436-N439 WeakPolarHBondContact OE2-CB 3.47Å; E436-N439 PolarHBondContact OE2-ND2 3.5Å
437	L	74.7	Confident	86.7	Confident	103 Å²	103	64.2 Å²	64.2	54%	0.539	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-31.6	-172.4	-72.3	171.5	0	0	0	114.5	L421 A422 Y425	L421-L437 HydrophobicContact CG-CD2 4.36Å; A422-L437 HydrophobicContact CB-CD2 4.34Å; Y425-L437 HydrophobicContact CD2-CD2 4.03Å; Y425-L437 HydrophobicContact CG-CD2 4.45Å
438	N	77.9	Confident	86.7	Confident	159 Å²	159	64.1 Å²	64.1	85%	0.85	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	4.1	-178.1	-62.3	-33.6	0	0	0	113.5	E436	E436-N438 PolarHBondContact O-N 2.84Å
439	N	83	Confident	86.6	Confident	53 Å²	53	64.3 Å²	64.3	28%	0.283	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-139.4	108.8	-173.3	179	8.6	0	0	0	110.5	E436 R441	E436-N439 HydrophobicContact CB-CB 3.84Å; E436-N439 CarbonylContact O-C 3.6Å; E436-N439 PolarHBondContact O-N 2.68Å; E436-N439 WeakPolarHBondContact OE2-CB 3.47Å; E436-N439 PolarHBondContact OE2-ND2 3.5Å; N439-R441 PolarHBondContact O-N 3.02Å; N439-R441 VanDerWaalsContact O-N 3.09Å; N439-R441 VanDerWaalsContact OD1-CB 3.25Å; N439-R441 WeakPolarHBondContact OD1-CB 3.22Å; N439-R441 WeakPolarHBondContact OD1-CG 3.33Å; N439-R441 PolarHBondContact OD1-N 3.4Å
440	P	87.5	Confident	86.6	Confident	46 Å²	46	63 Å²	63	30%	0.299	32%	0.32	S	S	.	.			trans	-74.6	2.3	-178.6	32.1	-36.4	0	0	0	113.2	T407 L408 L413	T407-P440 HydrophobicContact CG2-CB 4.34Å; T407-P440 HydrophobicContact CG2-CG 4.17Å; L408-P440 HydrophobicContact CB-CB 4.16Å; L408-P440 PolarHBondContact N-O 3.23Å; L413-P440 HydrophobicContact CD1-CB 4.02Å
441	R	90.6	Very high	86.8	Confident	173 Å²	173	61.9 Å²	61.9	65%	0.653	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	137.4	179.2	-62.1	-177.5	171.2	172	0.6	110.4	F406 T407 N439	F406-R441 WeakPolarHBondContact O-CA 3.36Å; T407-R441 HydrophobicContact CG2-CG 4.24Å; N439-R441 PolarHBondContact O-N 3.02Å; N439-R441 VanDerWaalsContact O-N 3.09Å; N439-R441 VanDerWaalsContact OD1-CB 3.25Å; N439-R441 WeakPolarHBondContact OD1-CB 3.22Å; N439-R441 WeakPolarHBondContact OD1-CG 3.33Å; N439-R441 PolarHBondContact OD1-N 3.4Å
442	S	92.6	Very high	87	Confident	7 Å²	7	61.7 Å²	61.7	5%	0.049	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	178.4	171.5	-168	0	0	0	0	109.8	P405 F406 K434	P405-S442 WeakPolarHBondContact CA-O 3.18Å; F406-S442 PolarHBondContact N-O 2.89Å; F406-S442 PolarHBondContact O-N 3.28Å; F406-S442 VanDerWaalsContact O-O 3.13Å; K434-S442 PolarHBondContact N-OG 2.93Å; K434-S442 VanDerWaalsContact O-CB 3.27Å; K434-S442 WeakPolarHBondContact O-CB 3.42Å; K434-S442 PolarHBondContact O-OG 3.36Å
443	T	91.9	Very high	87.4	Confident	61 Å²	61	59.9 Å²	59.9	37%	0.374	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	122.5	177.9	-55	0	0	0	0	108	N403 I404	N403-T443 HydrophobicContact CB-CG2 3.88Å; I404-T443 CarbonylContact O-C 3.47Å; I404-T443 WeakPolarHBondContact O-CA 3.46Å
444	W	91.6	Very high	87.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	140	169.3	172.8	-106.7	0	0	0	109.2	I393 L394 N397 Y400 N403 I404 F406 K449 L452	I393-W444 HydrophobicContact CG2-CE3 4.42Å; L394-W444 HydrophobicContact CD2-CH2 4.13Å; L394-W444 HydrophobicContact CD2-CZ3 4.26Å; N397-W444 HydrophobicContact CB-CB 4.24Å; N397-W444 HydrophobicContact CB-CD2 3.56Å; N397-W444 HydrophobicContact CB-CE3 3.74Å; N397-W444 HydrophobicContact CB-CG 3.78Å; N397-W444 HydrophobicContact CB-CZ2 4.5Å; N397-W444 HydrophobicContact CB-CZ3 4.27Å; N397-W444 PolarHBondContact O-NE1 2.94Å; Y400-W444 PolarHBondContact O-NE1 3.45Å; N403-W444 WeakPolarHBondContact CA-O 3.49Å; N403-W444 PolarHBondContact OD1-O 3.36Å; I404-W444 HydrophobicContact CB-CB 4.24Å; I404-W444 PolarHBondContact N-O 2.95Å; I404-W444 WeakPolarHBondContact O-CB 3.33Å; I404-W444 PolarHBondContact O-N 3.29Å; F406-W444 HydrophobicContact CD1-CB 4.06Å; F406-W444 HydrophobicContact CE1-CB 4.19Å; W444-K449 HydrophobicContact CH2-CB 3.8Å; W444-K449 HydrophobicContact CH2-CG 4.08Å; W444-K449 HydrophobicContact CZ2-CB 3.74Å; W444-K449 HydrophobicContact CZ2-CD 4.35Å; W444-K449 HydrophobicContact CZ2-CG 4.04Å; W444-L452 HydrophobicContact CE3-CD1 4.23Å; W444-L452 HydrophobicContact CH2-CD1 4.48Å; W444-L452 HydrophobicContact CZ3-CD1 3.58Å
445	D	88.2	Confident	88.1	Confident	55 Å²	55	51.9 Å²	51.9	29%	0.294	26%	0.261	S	S	.	.			trans	-133.7	140.7	174.7	-167.8	-50.6	0	0	0	107.9	E447 A448	D445-E447 PolarHBondContact O-N 3.05Å; D445-E447 WeakPolarHBondContact OD1-CB 3.48Å; D445-E447 PolarHBondContact OD1-N 3.06Å; D445-A448 HydrophobicContact CB-CB 4.47Å; D445-A448 WeakPolarHBondContact O-CB 3.47Å; D445-A448 PolarHBondContact O-N 2.92Å
446	L	85.8	Confident	88.7	Confident	44 Å²	44	51.4 Å²	51.4	23%	0.23	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-35.2	178.3	178.7	58.9	0	0	0	111.7	W258 P401 A448 K449	W258-L446 HydrophobicContact CZ3-CD1 4.49Å; P401-L446 HydrophobicContact CB-CD2 4.22Å; L446-A448 PolarHBondContact O-N 3.24Å; L446-K449 HydrophobicContact CD1-CB 4.44Å; L446-K449 HydrophobicContact CD1-CD 4.11Å; L446-K449 VanDerWaalsContact O-CB 3.22Å; L446-K449 WeakPolarHBondContact O-CB 3.48Å; L446-K449 PolarHBondContact O-N 3.37Å; L446-K449 VanDerWaalsContact O-N 3.07Å
447	E	85.7	Confident	89.6	Confident	148 Å²	148	46 Å²	46	69%	0.692	23%	0.232	S	C	*	.	H	α-helix	trans	-64.6	-23.6	177.3	-68	-66.3	140.8	0	0	112.1	D445 P451	D445-E447 PolarHBondContact O-N 3.05Å; D445-E447 WeakPolarHBondContact OD1-CB 3.48Å; D445-E447 PolarHBondContact OD1-N 3.06Å; E447-P451 WeakPolarHBondContact O-CD 3.49Å
448	A	89.8	Confident	90.6	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-80.5	-15.9	176.3	0	0	0	0	0	113.6	C431 L433 D445 L446 M450 P451 L452	C431-A448 WeakPolarHBondContact O-CA 3.47Å; C431-A448 WeakPolarHBondContact O-CB 3.1Å; L433-A448 HydrophobicContact CD2-CB 3.89Å; L433-A448 HydrophobicContact CG-CB 4.3Å; D445-A448 HydrophobicContact CB-CB 4.47Å; D445-A448 WeakPolarHBondContact O-CB 3.47Å; D445-A448 PolarHBondContact O-N 2.92Å; L446-A448 PolarHBondContact O-N 3.24Å; A448-M450 PolarHBondContact O-N 3.03Å; A448-P451 WeakPolarHBondContact O-CD 3.38Å; A448-L452 HydrophobicContact CB-CD1 3.96Å; A448-L452 VanDerWaalsContact O-CB 3.26Å; A448-L452 WeakPolarHBondContact O-CB 3.38Å; A448-L452 WeakPolarHBondContact O-CD1 3.22Å; A448-L452 VanDerWaalsContact O-CG 3.31Å; A448-L452 WeakPolarHBondContact O-CG 3.24Å; A448-L452 PolarHBondContact O-N 3.1Å
449	K	90.4	Very high	91.5	Very high	5 Å²	5	33.5 Å²	33.5	2%	0.022	17%	0.166	C	C	.	.	H	α-helix	trans	-56.4	-49.3	-177	-176.3	172.2	176	163	0	111.8	E270 F398 W444 L446 S453	E270-K449 IonicContact OE1-NZ 3.26Å; E270-K449 PolarHBondContact OE1-NZ 2.66Å; E270-K449 IonicContact OE2-NZ 3.66Å; E270-K449 PolarHBondContact OE2-NZ 3.18Å; F398-K449 HydrophobicContact CD2-CD 4.43Å; F398-K449 HydrophobicContact CD2-CG 4.1Å; F398-K449 HydrophobicContact CE2-CD 4.29Å; F398-K449 HydrophobicContact CE2-CG 3.78Å; F398-K449 HydrophobicContact CZ-CD 4.43Å; F398-K449 HydrophobicContact CZ-CG 4.26Å; F398-K449 WeakPolarHBondContact O-CE 3.46Å; F398-K449 PolarHBondContact O-NZ 2.93Å; W444-K449 HydrophobicContact CH2-CB 3.8Å; W444-K449 HydrophobicContact CH2-CG 4.08Å; W444-K449 HydrophobicContact CZ2-CB 3.74Å; W444-K449 HydrophobicContact CZ2-CD 4.35Å; W444-K449 HydrophobicContact CZ2-CG 4.04Å; L446-K449 HydrophobicContact CD1-CB 4.44Å; L446-K449 HydrophobicContact CD1-CD 4.11Å; L446-K449 VanDerWaalsContact O-CB 3.22Å; L446-K449 WeakPolarHBondContact O-CB 3.48Å; L446-K449 PolarHBondContact O-N 3.37Å; L446-K449 VanDerWaalsContact O-N 3.07Å; K449-S453 WeakPolarHBondContact O-CB 3.4Å; K449-S453 PolarHBondContact O-N 3.07Å; K449-S453 PolarHBondContact O-OG 3Å
450	M	88.5	Confident	92.2	Very high	69 Å²	69	31.6 Å²	31.6	34%	0.34	16%	0.157	S	C	.	.	H	α-helix	trans	-70.6	-50.4	-176.7	-179.1	-121.3	-60.8	0	0	112.2	L48 V365 A448 L452 S453 A454	L48-M450 HydrophobicContact CD2-CG 3.34Å; L48-M450 HydrophobicContact CD2-SD 4.07Å; V365-M450 HydrophobicContact CB-SD 4.47Å; V365-M450 HydrophobicContact CG1-CG 4.28Å; V365-M450 HydrophobicContact CG1-SD 3.46Å; V365-M450 WeakPolarHBondContact CG1-SD 3.23Å; V365-M450 HydrophobicContact CG2-SD 4.17Å; A448-M450 PolarHBondContact O-N 3.03Å; M450-L452 VanDerWaalsContact C-N 3.35Å; M450-L452 PolarHBondContact O-N 2.84Å; M450-S453 WeakPolarHBondContact O-CB 3.5Å; M450-S453 PolarHBondContact O-N 3.33Å; M450-A454 PolarHBondContact O-N 3.42Å
451	P	91.6	Very high	92.6	Very high	23 Å²	23	29.4 Å²	29.4	15%	0.149	14%	0.143	C	C	.	.	H	α-helix	trans	-57	-42.1	174.2	-27.1	35.5	0	0	0	114	C431 E447 A448 S453 A454 L455	C431-P451 HydrophobicContact CB-CB 3.85Å; E447-P451 WeakPolarHBondContact O-CD 3.49Å; A448-P451 WeakPolarHBondContact O-CD 3.38Å; P451-S453 VanDerWaalsContact C-N 3.33Å; P451-S453 PolarHBondContact O-N 3.31Å; P451-A454 PolarHBondContact O-N 3.11Å; P451-L455 WeakPolarHBondContact O-CB 3.43Å; P451-L455 PolarHBondContact O-N 2.83Å
452	L	94.4	Very high	92.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-67.1	-35.6	177.7	-75.4	165.9	0	0	0	112.2	V390 I393 L394 L428 C431 L433 W444 A448 M450 L455 Y456	V390-L452 HydrophobicContact CG1-CD2 4.35Å; I393-L452 HydrophobicContact CG2-CD1 4.27Å; L394-L452 HydrophobicContact CD2-CB 3.69Å; L394-L452 HydrophobicContact CG-CB 4.25Å; L428-L452 HydrophobicContact CD2-CD2 3.61Å; C431-L452 HydrophobicContact CB-CD2 3.86Å; C431-L452 HydrophobicContact CB-CG 3.81Å; L433-L452 HydrophobicContact CD1-CD1 3.85Å; L433-L452 HydrophobicContact CD1-CD2 4.07Å; L433-L452 HydrophobicContact CD1-CG 4.49Å; L433-L452 HydrophobicContact CD2-CD1 4.21Å; L433-L452 HydrophobicContact CG-CD1 4.13Å; W444-L452 HydrophobicContact CE3-CD1 4.23Å; W444-L452 HydrophobicContact CH2-CD1 4.48Å; W444-L452 HydrophobicContact CZ3-CD1 3.58Å; A448-L452 HydrophobicContact CB-CD1 3.96Å; A448-L452 VanDerWaalsContact O-CB 3.26Å; A448-L452 WeakPolarHBondContact O-CB 3.38Å; A448-L452 WeakPolarHBondContact O-CD1 3.22Å; A448-L452 VanDerWaalsContact O-CG 3.31Å; A448-L452 WeakPolarHBondContact O-CG 3.24Å; A448-L452 PolarHBondContact O-N 3.1Å; M450-L452 VanDerWaalsContact C-N 3.35Å; M450-L452 PolarHBondContact O-N 2.84Å; L452-L455 PolarHBondContact O-N 2.8Å; L452-Y456 WeakPolarHBondContact O-CB 3.5Å; L452-Y456 PolarHBondContact O-N 3.18Å
453	S	93.5	Very high	93	Very high	9 Å²	9	22.7 Å²	22.7	6%	0.063	12%	0.118	C	C	.	.	H	α-helix	trans	-64.9	-43.5	175.7	-56.1	0	0	0	0	111.2	F398 K449 M450 P451 Y456 G457	F398-S453 WeakPolarHBondContact CE2-OG 3.45Å; K449-S453 WeakPolarHBondContact O-CB 3.4Å; K449-S453 PolarHBondContact O-N 3.07Å; K449-S453 PolarHBondContact O-OG 3Å; M450-S453 WeakPolarHBondContact O-CB 3.5Å; M450-S453 PolarHBondContact O-N 3.33Å; P451-S453 VanDerWaalsContact C-N 3.33Å; P451-S453 PolarHBondContact O-N 3.31Å; S453-Y456 PolarHBondContact O-N 2.9Å; S453-G457 PolarHBondContact O-N 2.89Å
454	A	94.5	Very high	93.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.4	-39.9	174.5	0	0	0	0	0	112.1	L48 A362 V365 L366 M450 P451 G457 S458	L48-A454 HydrophobicContact CD2-CB 4.39Å; A362-A454 HydrophobicContact CB-CB 4.49Å; A362-A454 WeakPolarHBondContact O-CB 3.26Å; V365-A454 HydrophobicContact CB-CB 3.57Å; V365-A454 HydrophobicContact CG1-CB 3.59Å; V365-A454 HydrophobicContact CG2-CB 4.11Å; L366-A454 HydrophobicContact CD2-CB 4.04Å; M450-A454 PolarHBondContact O-N 3.42Å; P451-A454 PolarHBondContact O-N 3.11Å; A454-G457 PolarHBondContact O-N 3.48Å; A454-S458 VanDerWaalsContact O-CB 3.32Å; A454-S458 WeakPolarHBondContact O-CB 3.3Å; A454-S458 PolarHBondContact O-N 2.81Å; A454-S458 PolarHBondContact O-OG 2.8Å
455	L	96.7	Very high	93.3	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-63.8	-45.7	176	-179.6	61.8	0	0	0	110.8	L366 L374 V390 L427 L428 P451 L452 S458 L459	L366-L455 HydrophobicContact CD1-CD1 4.35Å; L366-L455 HydrophobicContact CD2-CB 4.04Å; L374-L455 HydrophobicContact CD2-CD1 3.97Å; V390-L455 HydrophobicContact CG2-CD2 3.92Å; V390-L455 HydrophobicContact CG2-CG 4.3Å; L427-L455 HydrophobicContact CB-CD2 4.26Å; L427-L455 HydrophobicContact CD2-CD1 4.08Å; L428-L455 HydrophobicContact CD2-CD2 4.41Å; P451-L455 WeakPolarHBondContact O-CB 3.43Å; P451-L455 PolarHBondContact O-N 2.83Å; L452-L455 PolarHBondContact O-N 2.8Å; L455-S458 PolarHBondContact O-N 3.26Å; L455-L459 HydrophobicContact CD1-CD1 3.92Å; L455-L459 HydrophobicContact CD1-CG 3.97Å; L455-L459 HydrophobicContact CD2-CD1 4.48Å; L455-L459 HydrophobicContact CG-CD1 3.78Å; L455-L459 HydrophobicContact CG-CG 4.29Å; L455-L459 WeakPolarHBondContact O-CB 3.47Å; L455-L459 VanDerWaalsContact O-CG 3.24Å; L455-L459 WeakPolarHBondContact O-CG 3.33Å; L455-L459 PolarHBondContact O-N 2.71Å
456	Y	96.7	Very high	93.4	Very high	9 Å²	9	21.8 Å²	21.8	4%	0.035	11%	0.114	C	C	.	.	H	α-helix	trans	-57.2	-52.2	175.6	177.2	-115.3	0	0	0	111.5	L279 V283 V387 V390 K391 L394 L452 S453 S458 L459 S460	L279-Y456 HydrophobicContact CD2-CD1 4.28Å; L279-Y456 HydrophobicContact CG-CD1 4.22Å; V283-Y456 HydrophobicContact CB-CD1 4.46Å; V283-Y456 HydrophobicContact CB-CE1 3.92Å; V283-Y456 HydrophobicContact CG1-CD1 4.44Å; V283-Y456 HydrophobicContact CG1-CE1 3.94Å; V283-Y456 HydrophobicContact CG2-CD1 3.83Å; V283-Y456 HydrophobicContact CG2-CE1 3.76Å; V387-Y456 HydrophobicContact CG1-CD2 4.41Å; V387-Y456 HydrophobicContact CG1-CE2 3.91Å; V390-Y456 HydrophobicContact CG1-CD2 4.5Å; K391-Y456 HydrophobicContact CB-CD2 4.25Å; K391-Y456 HydrophobicContact CB-CE2 3.82Å; K391-Y456 HydrophobicContact CD-CE2 4.23Å; K391-Y456 HydrophobicContact CG-CE2 4.45Å; L394-Y456 HydrophobicContact CD1-CD1 4.43Å; L394-Y456 HydrophobicContact CD1-CG 4.02Å; L452-Y456 WeakPolarHBondContact O-CB 3.5Å; L452-Y456 PolarHBondContact O-N 3.18Å; S453-Y456 PolarHBondContact O-N 2.9Å; Y456-S458 PolarHBondContact O-N 3.19Å; Y456-L459 PolarHBondContact O-N 2.83Å; Y456-S460 WeakPolarHBondContact O-CB 3.5Å; Y456-S460 PolarHBondContact O-N 3.07Å; Y456-S460 PolarHBondContact O-OG 3.47Å; Y456-S460 VanDerWaalsContact O-OG 3.09Å
457	G	95.1	Very high	93.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59	-45.3	177.6	0	0	0	0	0	112.6	S453 A454 S460 F461	S453-G457 PolarHBondContact O-N 2.89Å; A454-G457 PolarHBondContact O-N 3.48Å; G457-S460 PolarHBondContact O-N 3.08Å; G457-F461 VanDerWaalsContact O-CB 3.31Å; G457-F461 WeakPolarHBondContact O-CB 3.37Å; G457-F461 PolarHBondContact O-N 2.84Å
458	S	96.5	Very high	92.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.2	-46.9	179.5	-56.8	0	0	0	0	112	A362 A454 L455 Y456 F461 L462	A362-S458 WeakPolarHBondContact CB-OG 3.47Å; A454-S458 VanDerWaalsContact O-CB 3.32Å; A454-S458 WeakPolarHBondContact O-CB 3.3Å; A454-S458 PolarHBondContact O-N 2.81Å; A454-S458 PolarHBondContact O-OG 2.8Å; L455-S458 PolarHBondContact O-N 3.26Å; Y456-S458 PolarHBondContact O-N 3.19Å; S458-F461 PolarHBondContact O-N 3.25Å; S458-L462 WeakPolarHBondContact O-CB 3.47Å; S458-L462 VanDerWaalsContact O-CG 3.24Å; S458-L462 WeakPolarHBondContact O-CG 3.3Å; S458-L462 PolarHBondContact O-N 2.76Å
459	L	97.7	Very high	93	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-62.1	-46.2	178.2	-73.3	168.9	0	0	0	111.6	L374 L383 Q386 V387 V390 L455 Y456 F461 L462 Q463	L374-L459 HydrophobicContact CD2-CD2 3.41Å; L374-L459 VanDerWaalsContact CD2-CD2 3.41Å; L374-L459 HydrophobicContact CD2-CG 3.99Å; L383-L459 HydrophobicContact CD2-CD2 3.66Å; Q386-L459 HydrophobicContact CB-CD1 3.86Å; Q386-L459 HydrophobicContact CB-CD2 4.04Å; V387-L459 HydrophobicContact CG2-CB 3.53Å; V390-L459 HydrophobicContact CG2-CD1 3.86Å; L455-L459 HydrophobicContact CD1-CD1 3.92Å; L455-L459 HydrophobicContact CD1-CG 3.97Å; L455-L459 HydrophobicContact CD2-CD1 4.48Å; L455-L459 HydrophobicContact CG-CD1 3.78Å; L455-L459 HydrophobicContact CG-CG 4.29Å; L455-L459 WeakPolarHBondContact O-CB 3.47Å; L455-L459 VanDerWaalsContact O-CG 3.24Å; L455-L459 WeakPolarHBondContact O-CG 3.33Å; L455-L459 PolarHBondContact O-N 2.71Å; Y456-L459 PolarHBondContact O-N 2.83Å; L459-F461 VanDerWaalsContact C-N 3.35Å; L459-F461 PolarHBondContact O-N 3.08Å; L459-L462 PolarHBondContact O-N 2.92Å; L459-Q463 VanDerWaalsContact O-CB 3.27Å; L459-Q463 WeakPolarHBondContact O-CB 3.35Å; L459-Q463 PolarHBondContact O-N 2.84Å
460	S	96.8	Very high	93.1	Very high	12 Å²	12	22.5 Å²	22.5	8%	0.084	13%	0.129	C	C	.	.	H	α-helix	trans	-63.2	-41	179.3	-64.1	0	0	0	0	112.2	Y456 G457 Q463 Q464	Y456-S460 WeakPolarHBondContact O-CB 3.5Å; Y456-S460 PolarHBondContact O-N 3.07Å; Y456-S460 PolarHBondContact O-OG 3.47Å; Y456-S460 VanDerWaalsContact O-OG 3.09Å; G457-S460 PolarHBondContact O-N 3.08Å; S460-Q463 PolarHBondContact O-N 2.75Å; S460-Q464 PolarHBondContact O-N 3.17Å
461	F	95.4	Very high	93.3	Very high	1 Å²	1	19.9 Å²	19.9	0%	0.004	12%	0.117	C	C	.	.	H	α-helix	trans	-68.7	-44.8	178.9	-150.2	-76.6	0	0	0	111.7	Q286 L290 L355 Y358 L359 G457 S458 L459 Q463 Q464 L465	Q286-F461 HydrophobicContact CB-CD2 4.45Å; Q286-F461 HydrophobicContact CB-CE2 4.16Å; L290-F461 HydrophobicContact CB-CZ 4.43Å; L290-F461 HydrophobicContact CD1-CE1 3.58Å; L290-F461 HydrophobicContact CD1-CZ 3.65Å; L290-F461 HydrophobicContact CD2-CD1 3.34Å; L290-F461 HydrophobicContact CD2-CD2 4.34Å; L290-F461 HydrophobicContact CD2-CE1 3.19Å; L290-F461 HydrophobicContact CD2-CE2 4.2Å; L290-F461 HydrophobicContact CD2-CG 3.97Å; L290-F461 HydrophobicContact CD2-CZ 3.66Å; L290-F461 HydrophobicContact CG-CE1 3.98Å; L290-F461 HydrophobicContact CG-CZ 4.14Å; L355-F461 HydrophobicContact CB-CZ 4.09Å; L355-F461 VanDerWaalsContact O-CZ 3.31Å; L355-F461 WeakPolarHBondContact O-CZ 3.49Å; Y358-F461 AromaticContact CD1-CD2 3.76Å; Y358-F461 HydrophobicContact CD1-CD2 3.76Å; Y358-F461 AromaticContact CD1-CE2 3.76Å; Y358-F461 HydrophobicContact CD1-CE2 3.76Å; Y358-F461 HydrophobicContact CE1-CD2 4.01Å; Y358-F461 HydrophobicContact CE1-CE2 4.41Å; L359-F461 HydrophobicContact CB-CD1 4.07Å; L359-F461 HydrophobicContact CB-CD2 4.47Å; L359-F461 HydrophobicContact CB-CE1 4.04Å; L359-F461 HydrophobicContact CB-CE2 4.47Å; L359-F461 HydrophobicContact CB-CG 4.24Å; L359-F461 HydrophobicContact CB-CZ 4.25Å; L359-F461 HydrophobicContact CD1-CB 4.08Å; L359-F461 HydrophobicContact CD1-CD1 4.39Å; L359-F461 HydrophobicContact CD1-CG 4.31Å; L359-F461 HydrophobicContact CD2-CD1 3.6Å; L359-F461 HydrophobicContact CD2-CE1 3.92Å; L359-F461 HydrophobicContact CD2-CG 4.32Å; L359-F461 HydrophobicContact CG-CD1 4.23Å; G457-F461 VanDerWaalsContact O-CB 3.31Å; G457-F461 WeakPolarHBondContact O-CB 3.37Å; G457-F461 PolarHBondContact O-N 2.84Å; S458-F461 PolarHBondContact O-N 3.25Å; L459-F461 VanDerWaalsContact C-N 3.35Å; L459-F461 PolarHBondContact O-N 3.08Å; F461-Q463 VanDerWaalsContact C-N 3.32Å; F461-Q463 PolarHBondContact O-N 3.18Å; F461-Q464 PolarHBondContact O-N 2.82Å; F461-L465 HydrophobicContact CD1-CD1 3.89Å; F461-L465 HydrophobicContact CD1-CG 4.27Å; F461-L465 HydrophobicContact CE1-CD1 4.12Å; F461-L465 WeakPolarHBondContact O-CG 3.23Å; F461-L465 PolarHBondContact O-N 3.06Å
462	L	96.3	Very high	93.4	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.5	-37.3	175.5	-71.3	173.1	0	0	0	111.8	L309 L374 L383 S458 L459 L465 S466	L309-L462 HydrophobicContact CD1-CD1 4.36Å; L374-L462 HydrophobicContact CB-CD1 4.28Å; L374-L462 HydrophobicContact CD1-CD1 4.27Å; L374-L462 HydrophobicContact CD2-CD1 4.45Å; L383-L462 HydrophobicContact CD1-CB 4.08Å; S458-L462 WeakPolarHBondContact O-CB 3.47Å; S458-L462 VanDerWaalsContact O-CG 3.24Å; S458-L462 WeakPolarHBondContact O-CG 3.3Å; S458-L462 PolarHBondContact O-N 2.76Å; L459-L462 PolarHBondContact O-N 2.92Å; L462-L465 PolarHBondContact O-N 2.81Å; L462-S466 WeakPolarHBondContact O-CB 3.41Å; L462-S466 PolarHBondContact O-N 2.89Å
463	Q	96.5	Very high	93.4	Very high	39 Å²	39	21 Å²	21	18%	0.182	12%	0.123	C	C	.	.	H	α-helix	trans	-60.5	-50.4	174.4	-177	-172.2	-23	0	0	110.2	L383 P384 L459 S460 F461 L465 S466 E467	L383-Q463 HydrophobicContact CB-CB 4.1Å; L383-Q463 HydrophobicContact CB-CG 4.42Å; L383-Q463 HydrophobicContact CD1-CB 4.39Å; P384-Q463 HydrophobicContact CG-CG 4.4Å; L459-Q463 VanDerWaalsContact O-CB 3.27Å; L459-Q463 WeakPolarHBondContact O-CB 3.35Å; L459-Q463 PolarHBondContact O-N 2.84Å; S460-Q463 PolarHBondContact O-N 2.75Å; F461-Q463 VanDerWaalsContact C-N 3.32Å; F461-Q463 PolarHBondContact O-N 3.18Å; Q463-L465 VanDerWaalsContact C-N 3.28Å; Q463-L465 PolarHBondContact O-N 2.88Å; Q463-S466 PolarHBondContact O-N 2.71Å; Q463-S466 PolarHBondContact O-OG 3.05Å; Q463-E467 WeakPolarHBondContact CG-OE1 3.43Å; Q463-E467 PolarHBondContact NE2-OE1 3.12Å; Q463-E467 WeakPolarHBondContact O-CG 3.46Å; Q463-E467 PolarHBondContact O-N 3.24Å
464	Q	95.8	Very high	93.4	Very high	41 Å²	41	21.8 Å²	21.8	19%	0.192	13%	0.127	C	C	.	.	H	α-helix	trans	-58.3	-41.2	179.3	-179.9	57.9	69.8	0	0	112.2	T287 L290 A291 S460 F461 S466 E467	T287-Q464 HydrophobicContact CG2-CB 4.3Å; L290-Q464 HydrophobicContact CB-CG 4.34Å; L290-Q464 HydrophobicContact CD2-CB 4.15Å; L290-Q464 HydrophobicContact CD2-CG 3.95Å; L290-Q464 HydrophobicContact CG-CG 4.4Å; A291-Q464 HydrophobicContact CB-CG 4.29Å; S460-Q464 PolarHBondContact O-N 3.17Å; F461-Q464 PolarHBondContact O-N 2.82Å; Q464-S466 VanDerWaalsContact C-N 3.33Å; Q464-E467 PolarHBondContact O-N 2.78Å
465	L	93.8	Very high	93.3	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-67	-32.8	175.9	-74.7	175.9	0	0	0	113.1	L290 Q298 V301 F302 L359 F461 L462 Q463 E467 A468	L290-L465 HydrophobicContact CD1-CD2 3.98Å; L290-L465 HydrophobicContact CD2-CD1 4.35Å; L290-L465 HydrophobicContact CD2-CD2 3.61Å; L290-L465 HydrophobicContact CD2-CG 3.58Å; L290-L465 HydrophobicContact CG-CD2 3.92Å; L290-L465 HydrophobicContact CG-CG 4.43Å; Q298-L465 HydrophobicContact CB-CD2 4.22Å; Q298-L465 HydrophobicContact CG-CD2 4.49Å; V301-L465 HydrophobicContact CB-CD2 4.42Å; V301-L465 HydrophobicContact CG1-CD1 3.92Å; V301-L465 HydrophobicContact CG1-CD2 4.07Å; F302-L465 HydrophobicContact CB-CB 3.9Å; F302-L465 HydrophobicContact CB-CD1 4.47Å; F302-L465 HydrophobicContact CD2-CB 3.44Å; F302-L465 VanDerWaalsContact CD2-CB 3.44Å; F302-L465 HydrophobicContact CD2-CD1 4.33Å; F302-L465 HydrophobicContact CD2-CG 4.5Å; F302-L465 HydrophobicContact CE2-CB 4.21Å; F302-L465 HydrophobicContact CG-CB 3.92Å; L359-L465 HydrophobicContact CD2-CD1 4.44Å; F461-L465 HydrophobicContact CD1-CD1 3.89Å; F461-L465 HydrophobicContact CD1-CG 4.27Å; F461-L465 HydrophobicContact CE1-CD1 4.12Å; F461-L465 WeakPolarHBondContact O-CG 3.23Å; F461-L465 PolarHBondContact O-N 3.06Å; L462-L465 PolarHBondContact O-N 2.81Å; Q463-L465 VanDerWaalsContact C-N 3.28Å; Q463-L465 PolarHBondContact O-N 2.88Å; L465-E467 PolarHBondContact O-N 3.24Å; L465-A468 WeakPolarHBondContact O-CB 3.41Å; L465-A468 PolarHBondContact O-N 3.1Å
466	S	91.1	Very high	93	Very high	55 Å²	55	25.1 Å²	25.1	39%	0.385	15%	0.146	S	C	.	.	H	α-helix	trans	-74.2	-16.3	178.5	74.5	0	0	0	0	113.8	L462 Q463 Q464 A468	L462-S466 WeakPolarHBondContact O-CB 3.41Å; L462-S466 PolarHBondContact O-N 2.89Å; Q463-S466 PolarHBondContact O-N 2.71Å; Q463-S466 PolarHBondContact O-OG 3.05Å; Q464-S466 VanDerWaalsContact C-N 3.33Å; S466-A468 VanDerWaalsContact C-N 3.31Å
467	E	86.1	Confident	92.7	Very high	105 Å²	105	26.4 Å²	26.4	49%	0.491	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	3.2	175.2	-65.6	172.8	-169.4	0	0	112.3	K295 Q463 Q464 L465	K295-E467 PolarHBondContact NZ-O 3.24Å; Q463-E467 WeakPolarHBondContact CG-OE1 3.43Å; Q463-E467 PolarHBondContact NE2-OE1 3.12Å; Q463-E467 WeakPolarHBondContact O-CG 3.46Å; Q463-E467 PolarHBondContact O-N 3.24Å; Q464-E467 PolarHBondContact O-N 2.78Å; L465-E467 PolarHBondContact O-N 3.24Å
468	A	71.9	Confident	92.5	Very high	62 Å²	62	28.8 Å²	28.8	51%	0.512	17%	0.169	S	C	.	.			trans	-63.3	0	178.2	0	0	0	0	0	112.7	K295 Q298 L465 S466	K295-A468 HydrophobicContact CD-CB 4.44Å; K295-A468 WeakPolarHBondContact CD-OXT 3.42Å; K295-A468 WeakPolarHBondContact CE-OXT 3.24Å; K295-A468 VanDerWaalsContact NZ-CA 3.29Å; K295-A468 PolarHBondContact NZ-OXT 2.65Å; Q298-A468 HydrophobicContact CB-CB 3.55Å; Q298-A468 HydrophobicContact CG-CB 4.47Å; L465-A468 WeakPolarHBondContact O-CB 3.41Å; L465-A468 PolarHBondContact O-N 3.1Å; S466-A468 VanDerWaalsContact C-N 3.31Å

Retrieved 468 of 468 residues in 926.5 ms (Link to these results)

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