A0A3Q0KJQ5_SCHMA Loading...

G_PROTEIN_RECEP_F2_4 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KJQ5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 711 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	39.5	Very low	53.1	Low	184 Å²	184	84 Å²	84	91%	0.906	39%	0.393	S	S	*	.				0	-50.4	0	-86.7	178.7	-178.2	0	0	114.9	K3 R4 F5	M1-K3 VanDerWaalsContact C-N 3.35Å; M1-K3 PolarHBondContact O-N 3.17Å; M1-R4 WeakPolarHBondContact O-CA 3.32Å; M1-R4 VanDerWaalsContact O-CB 3.25Å; M1-R4 WeakPolarHBondContact O-CB 3.44Å; M1-R4 PolarHBondContact O-N 3.04Å; M1-F5 PolarHBondContact O-N 3.34Å
2	I	36.1	Very low	54.6	Low	61 Å²	61	84.8 Å²	84.8	31%	0.313	40%	0.395	S	S	.	.	H	α-helix	trans	-70.1	-25.7	-173.6	-53.7	165.4	0	0	0	114.4	R4 R342	I2-R4 VanDerWaalsContact C-N 3.25Å; I2-R4 PolarHBondContact O-N 3.21Å; I2-R342 HydrophobicContact CD1-CG 4.34Å; I2-R342 HydrophobicContact CG2-CB 4.27Å; I2-R342 HydrophobicContact CG2-CG 3.75Å
3	K	38.6	Very low	56	Low	167 Å²	167	78.5 Å²	78.5	73%	0.726	37%	0.366	S	S	*	.	H	α-helix	trans	-65.5	-28.1	167.5	-80.1	-174.9	176.7	-177.6	0	112.5	M1	M1-K3 VanDerWaalsContact C-N 3.35Å; M1-K3 PolarHBondContact O-N 3.17Å
4	R	50.9	Low	57.4	Low	166 Å²	166	79.1 Å²	79.1	63%	0.626	37%	0.371	S	S	*	.	H	α-helix	trans	-73.5	-39.6	-177.9	-97.8	-179	-167.6	163.8	1.9	112	M1 I2 S6 S7 H8	M1-R4 WeakPolarHBondContact O-CA 3.32Å; M1-R4 VanDerWaalsContact O-CB 3.25Å; M1-R4 WeakPolarHBondContact O-CB 3.44Å; M1-R4 PolarHBondContact O-N 3.04Å; I2-R4 VanDerWaalsContact C-N 3.25Å; I2-R4 PolarHBondContact O-N 3.21Å; R4-S6 PolarHBondContact O-N 3.11Å; R4-S7 WeakPolarHBondContact O-CB 3.46Å; R4-S7 PolarHBondContact O-N 3.38Å; R4-S7 VanDerWaalsContact O-N 3.17Å; R4-H8 VanDerWaalsContact C-CD2 3.41Å; R4-H8 WeakPolarHBondContact CB-NE2 3.47Å; R4-H8 WeakPolarHBondContact O-CB 3.21Å; R4-H8 PolarHBondContact O-CD2 3.23Å; R4-H8 PolarHBondContact O-N 3.04Å
5	F	47.8	Very low	58.9	Low	17 Å²	17	79.4 Å²	79.4	8%	0.075	38%	0.375	C	S	.	.	H	α-helix	trans	-64.8	-44	-170.4	-163	-97.4	0	0	0	115	M1 S7 H8 T9 Q347 T465 I466 T469	M1-F5 PolarHBondContact O-N 3.34Å; F5-S7 VanDerWaalsContact C-N 3.31Å; F5-S7 PolarHBondContact O-N 3.38Å; F5-H8 PolarHBondContact O-N 3.28Å; F5-T9 HydrophobicContact CE1-CG2 4.28Å; F5-T9 PolarHBondContact O-N 3.44Å; F5-Q347 HydrophobicContact CD1-CB 4.12Å; F5-Q347 VanDerWaalsContact CD1-CD 3.41Å; F5-Q347 HydrophobicContact CD1-CG 4.12Å; F5-Q347 HydrophobicContact CE1-CB 4.09Å; F5-T465 HydrophobicContact CE1-CG2 4Å; F5-T465 HydrophobicContact CZ-CG2 3.77Å; F5-I466 HydrophobicContact CD2-CG1 4.3Å; F5-I466 HydrophobicContact CE2-CB 4.46Å; F5-I466 HydrophobicContact CE2-CG1 3.68Å; F5-T469 HydrophobicContact CZ-CG2 4.33Å; F5-T469 WeakPolarHBondContact CZ-OG1 3.32Å
6	S	50.6	Low	60.2	Low	21 Å²	21	75.1 Å²	75.1	15%	0.147	36%	0.355	C	S	.	.	H	α-helix	trans	-70.9	-27	175.6	-176.8	0	0	0	0	113	R4 T9 M350	R4-S6 PolarHBondContact O-N 3.11Å; S6-T9 PolarHBondContact O-OG1 3.23Å; S6-T9 VanDerWaalsContact O-OG1 3.12Å; S6-M350 WeakPolarHBondContact OG-CE 3.29Å
7	S	57	Low	61.2	Low	52 Å²	52	73.3 Å²	73.3	36%	0.364	35%	0.347	S	S	.	.	H	α-helix	trans	-67.7	-47	170.6	-149.7	0	0	0	0	109.1	R4 F5 T9 F10 E11	R4-S7 WeakPolarHBondContact O-CB 3.46Å; R4-S7 PolarHBondContact O-N 3.38Å; R4-S7 VanDerWaalsContact O-N 3.17Å; F5-S7 VanDerWaalsContact C-N 3.31Å; F5-S7 PolarHBondContact O-N 3.38Å; S7-T9 PolarHBondContact O-N 3.44Å; S7-F10 PolarHBondContact O-N 2.93Å; S7-E11 WeakPolarHBondContact CB-OE1 3.46Å; S7-E11 WeakPolarHBondContact O-CB 3.45Å; S7-E11 VanDerWaalsContact O-CG 3.24Å; S7-E11 WeakPolarHBondContact O-CG 3.25Å; S7-E11 PolarHBondContact O-N 3.35Å; S7-E11 PolarHBondContact OG-OE1 2.91Å
8	H	64	Low	62.3	Low	61 Å²	61	78.3 Å²	78.3	28%	0.282	36%	0.364	S	S	.	.	H	α-helix	trans	-62.4	-40.8	-178.5	-70.9	-42.2	0	0	0	113.3	R4 F5 F10 E11 F12	R4-H8 VanDerWaalsContact C-CD2 3.41Å; R4-H8 WeakPolarHBondContact CB-NE2 3.47Å; R4-H8 WeakPolarHBondContact O-CB 3.21Å; R4-H8 PolarHBondContact O-CD2 3.23Å; R4-H8 PolarHBondContact O-N 3.04Å; F5-H8 PolarHBondContact O-N 3.28Å; H8-F10 VanDerWaalsContact C-N 3.28Å; H8-F10 PolarHBondContact O-N 3.21Å; H8-E11 IonicContact CE1-OE2 3.32Å; H8-E11 IonicContact ND1-OE2 2.73Å; H8-E11 PolarHBondContact ND1-OE2 3.47Å; H8-E11 VanDerWaalsContact ND1-OE2 3.15Å; H8-E11 PolarHBondContact O-N 3.32Å; H8-F12 HydrophobicContact CB-CD2 3.99Å; H8-F12 HydrophobicContact CB-CE2 3.72Å; H8-F12 VanDerWaalsContact O-CB 3.24Å; H8-F12 WeakPolarHBondContact O-CB 3.48Å; H8-F12 WeakPolarHBondContact O-CD2 3.46Å; H8-F12 VanDerWaalsContact O-CG 3.24Å; H8-F12 WeakPolarHBondContact O-CG 3.41Å; H8-F12 PolarHBondContact O-N 3.31Å
9	T	65.2	Low	63.2	Low	5 Å²	5	78.3 Å²	78.3	3%	0.031	37%	0.366	C	S	.	.	H	α-helix	trans	-60.7	-39.6	176.9	49.2	0	0	0	0	112.4	F5 S6 S7 Q13 W398 T469	F5-T9 HydrophobicContact CE1-CG2 4.28Å; F5-T9 PolarHBondContact O-N 3.44Å; S6-T9 PolarHBondContact O-OG1 3.23Å; S6-T9 VanDerWaalsContact O-OG1 3.12Å; S7-T9 PolarHBondContact O-N 3.44Å; T9-Q13 WeakPolarHBondContact O-CG 3.27Å; T9-Q13 PolarHBondContact O-N 3.35Å; T9-W398 HydrophobicContact CG2-CH2 4.06Å; T9-T469 HydrophobicContact CG2-CG2 3.95Å
10	F	65.3	Low	64	Low	111 Å²	111	74.4 Å²	74.4	49%	0.487	35%	0.348	S	S	.	.	H	α-helix	trans	-75.3	-44.7	178.7	-169.4	-103	0	0	0	111.4	S7 H8 F12 Q13 I14 T354	S7-F10 PolarHBondContact O-N 2.93Å; H8-F10 VanDerWaalsContact C-N 3.28Å; H8-F10 PolarHBondContact O-N 3.21Å; F10-F12 PolarHBondContact O-N 3.23Å; F10-Q13 PolarHBondContact O-N 2.81Å; F10-I14 HydrophobicContact CD1-CD1 3.58Å; F10-I14 HydrophobicContact CD1-CG1 4.43Å; F10-I14 HydrophobicContact CE1-CD1 3.28Å; F10-I14 HydrophobicContact CE1-CG1 4.27Å; F10-I14 HydrophobicContact CZ-CD1 3.98Å; F10-I14 WeakPolarHBondContact O-CG1 3.38Å; F10-I14 PolarHBondContact O-N 3.24Å; F10-T354 HydrophobicContact CD2-CG2 3.9Å; F10-T354 HydrophobicContact CE2-CG2 4.16Å
11	E	68.7	Low	64.7	Low	79 Å²	79	73.9 Å²	73.9	37%	0.369	35%	0.347	S	S	.	.	H	α-helix	trans	-58.3	-44.9	174.1	-74.9	166.2	-162.6	0	0	111.6	S7 H8 Q13 I14 I15	S7-E11 WeakPolarHBondContact CB-OE1 3.46Å; S7-E11 WeakPolarHBondContact O-CB 3.45Å; S7-E11 VanDerWaalsContact O-CG 3.24Å; S7-E11 WeakPolarHBondContact O-CG 3.25Å; S7-E11 PolarHBondContact O-N 3.35Å; S7-E11 PolarHBondContact OG-OE1 2.91Å; H8-E11 IonicContact CE1-OE2 3.32Å; H8-E11 IonicContact ND1-OE2 2.73Å; H8-E11 PolarHBondContact ND1-OE2 3.47Å; H8-E11 VanDerWaalsContact ND1-OE2 3.15Å; H8-E11 PolarHBondContact O-N 3.32Å; E11-Q13 PolarHBondContact O-N 3.1Å; E11-I14 PolarHBondContact O-N 2.95Å; E11-I15 WeakPolarHBondContact O-CB 3.45Å; E11-I15 WeakPolarHBondContact O-CD1 3.49Å; E11-I15 WeakPolarHBondContact O-CG1 3.46Å; E11-I15 PolarHBondContact O-N 3.07Å
12	F	71.6	Confident	66.4	Low	94 Å²	94	67.4 Å²	67.4	41%	0.412	32%	0.32	S	S	.	.	H	α-helix	trans	-63.3	-42.1	177.7	-75.2	-54.7	0	0	0	111.4	H8 F10 I14 I15 I16 I473	H8-F12 HydrophobicContact CB-CD2 3.99Å; H8-F12 HydrophobicContact CB-CE2 3.72Å; H8-F12 VanDerWaalsContact O-CB 3.24Å; H8-F12 WeakPolarHBondContact O-CB 3.48Å; H8-F12 WeakPolarHBondContact O-CD2 3.46Å; H8-F12 VanDerWaalsContact O-CG 3.24Å; H8-F12 WeakPolarHBondContact O-CG 3.41Å; H8-F12 PolarHBondContact O-N 3.31Å; F10-F12 PolarHBondContact O-N 3.23Å; F12-I14 VanDerWaalsContact C-N 3.33Å; F12-I14 PolarHBondContact O-N 2.86Å; F12-I15 HydrophobicContact CD1-CD1 4.47Å; F12-I15 PolarHBondContact O-N 3.46Å; F12-I16 WeakPolarHBondContact O-CB 3.38Å; F12-I16 VanDerWaalsContact O-CD1 3.23Å; F12-I16 WeakPolarHBondContact O-CD1 3.12Å; F12-I16 WeakPolarHBondContact O-CG1 3.19Å; F12-I16 PolarHBondContact O-N 3.3Å; F12-I473 HydrophobicContact CB-CD1 3.84Å; F12-I473 HydrophobicContact CD2-CD1 4.34Å; F12-I473 HydrophobicContact CG-CD1 4.3Å
13	Q	72.9	Confident	68.2	Low	3 Å²	3	67.4 Å²	67.4	1%	0.014	32%	0.32	C	S	.	.	H	α-helix	trans	-63.8	-38.9	175	-72.6	-169.8	11	0	0	111.9	T9 F10 E11 I16 I17 G351	T9-Q13 WeakPolarHBondContact O-CG 3.27Å; T9-Q13 PolarHBondContact O-N 3.35Å; F10-Q13 PolarHBondContact O-N 2.81Å; E11-Q13 PolarHBondContact O-N 3.1Å; Q13-I16 PolarHBondContact O-N 3.19Å; Q13-I17 VanDerWaalsContact O-CG1 3.24Å; Q13-I17 WeakPolarHBondContact O-CG1 3.05Å; Q13-I17 PolarHBondContact O-N 3.2Å; Q13-G351 PolarHBondContact NE2-O 3.12Å
14	I	76	Confident	69.6	Low	86 Å²	86	59.5 Å²	59.5	44%	0.441	29%	0.285	S	S	.	.	H	α-helix	trans	-64.4	-44.8	173.8	-69.9	173.4	0	0	0	111.6	F10 E11 F12 I16 I17 Y18	F10-I14 HydrophobicContact CD1-CD1 3.58Å; F10-I14 HydrophobicContact CD1-CG1 4.43Å; F10-I14 HydrophobicContact CE1-CD1 3.28Å; F10-I14 HydrophobicContact CE1-CG1 4.27Å; F10-I14 HydrophobicContact CZ-CD1 3.98Å; F10-I14 WeakPolarHBondContact O-CG1 3.38Å; F10-I14 PolarHBondContact O-N 3.24Å; E11-I14 PolarHBondContact O-N 2.95Å; F12-I14 VanDerWaalsContact C-N 3.33Å; F12-I14 PolarHBondContact O-N 2.86Å; I14-I16 VanDerWaalsContact C-N 3.27Å; I14-I16 PolarHBondContact O-N 3.06Å; I14-I17 WeakPolarHBondContact O-CB 3.44Å; I14-I17 PolarHBondContact O-N 3.4Å; I14-Y18 PolarHBondContact O-N 3.36Å
15	I	78.9	Confident	69.9	Low	84 Å²	84	53.3 Å²	53.3	43%	0.431	27%	0.268	S	S	.	.	H	α-helix	trans	-60.5	-41.6	177.5	-70.3	162.5	0	0	0	109.8	E11 F12 Y18 I19	E11-I15 WeakPolarHBondContact O-CB 3.45Å; E11-I15 WeakPolarHBondContact O-CD1 3.49Å; E11-I15 WeakPolarHBondContact O-CG1 3.46Å; E11-I15 PolarHBondContact O-N 3.07Å; F12-I15 HydrophobicContact CD1-CD1 4.47Å; F12-I15 PolarHBondContact O-N 3.46Å; I15-Y18 WeakPolarHBondContact O-CB 3.4Å; I15-Y18 PolarHBondContact O-N 2.9Å; I15-I19 HydrophobicContact CG2-CD1 3.71Å; I15-I19 HydrophobicContact CG2-CG1 4.31Å; I15-I19 VanDerWaalsContact O-CG1 3.25Å; I15-I19 WeakPolarHBondContact O-CG1 3.4Å; I15-I19 PolarHBondContact O-N 3.24Å
16	I	79.7	Confident	70	Confident	10 Å²	10	57.7 Å²	57.7	5%	0.051	29%	0.287	C	S	.	.	H	α-helix	trans	-67.7	-42	177.7	-65.8	158.5	0	0	0	111	F12 Q13 I14 Y18 I19 L20 Y390 I473 L477	F12-I16 WeakPolarHBondContact O-CB 3.38Å; F12-I16 VanDerWaalsContact O-CD1 3.23Å; F12-I16 WeakPolarHBondContact O-CD1 3.12Å; F12-I16 WeakPolarHBondContact O-CG1 3.19Å; F12-I16 PolarHBondContact O-N 3.3Å; Q13-I16 PolarHBondContact O-N 3.19Å; I14-I16 VanDerWaalsContact C-N 3.27Å; I14-I16 PolarHBondContact O-N 3.06Å; I16-Y18 VanDerWaalsContact C-N 3.26Å; I16-Y18 PolarHBondContact O-N 3.45Å; I16-I19 PolarHBondContact O-N 2.78Å; I16-L20 HydrophobicContact CG2-CD1 3.77Å; I16-L20 HydrophobicContact CG2-CG 4.04Å; I16-L20 WeakPolarHBondContact O-CB 3.41Å; I16-L20 VanDerWaalsContact O-CG 3.26Å; I16-L20 WeakPolarHBondContact O-CG 3.39Å; I16-L20 PolarHBondContact O-N 3.43Å; I16-Y390 VanDerWaalsContact CD1-OH 3.23Å; I16-Y390 WeakPolarHBondContact CD1-OH 3.34Å; I16-Y390 HydrophobicContact CG2-CD1 4.23Å; I16-Y390 HydrophobicContact CG2-CD2 4.35Å; I16-Y390 HydrophobicContact CG2-CE1 3.72Å; I16-Y390 HydrophobicContact CG2-CE2 3.85Å; I16-I473 HydrophobicContact CD1-CB 4.34Å; I16-I473 HydrophobicContact CD1-CG1 4.31Å; I16-I473 HydrophobicContact CD1-CG2 3.36Å; I16-I473 HydrophobicContact CG1-CG2 4.5Å; I16-L477 HydrophobicContact CG2-CD2 4.06Å
17	I	78.5	Confident	69.7	Low	45 Å²	45	61 Å²	61	23%	0.231	30%	0.303	C	S	.	.	H	α-helix	trans	-54.8	-48.3	171.2	-69.7	162.6	0	0	0	109.2	Q13 I14 I19 L20 L21 F391	Q13-I17 VanDerWaalsContact O-CG1 3.24Å; Q13-I17 WeakPolarHBondContact O-CG1 3.05Å; Q13-I17 PolarHBondContact O-N 3.2Å; I14-I17 WeakPolarHBondContact O-CB 3.44Å; I14-I17 PolarHBondContact O-N 3.4Å; I17-I19 PolarHBondContact O-N 3.39Å; I17-L20 PolarHBondContact O-N 2.93Å; I17-L21 HydrophobicContact CG2-CD1 3.6Å; I17-L21 HydrophobicContact CG2-CG 4.07Å; I17-L21 VanDerWaalsContact O-CB 3.24Å; I17-L21 WeakPolarHBondContact O-CB 3.32Å; I17-L21 WeakPolarHBondContact O-CG 3.21Å; I17-L21 PolarHBondContact O-N 2.88Å; I17-F391 HydrophobicContact CD1-CE2 4.35Å; I17-F391 HydrophobicContact CD1-CZ 3.77Å; I17-F391 HydrophobicContact CG1-CE2 3.91Å; I17-F391 HydrophobicContact CG1-CZ 3.55Å
18	Y	80.7	Confident	68.9	Low	163 Å²	163	62.8 Å²	62.8	64%	0.639	31%	0.308	S	S	*	.	H	α-helix	trans	-61.9	-42.6	178.8	-175.5	-92.4	0	0	0	112.9	I14 I15 I16 L21 S22	I14-Y18 PolarHBondContact O-N 3.36Å; I15-Y18 WeakPolarHBondContact O-CB 3.4Å; I15-Y18 PolarHBondContact O-N 2.9Å; I16-Y18 VanDerWaalsContact C-N 3.26Å; I16-Y18 PolarHBondContact O-N 3.45Å; Y18-L21 PolarHBondContact O-N 3.19Å; Y18-S22 WeakPolarHBondContact O-CB 3.05Å; Y18-S22 PolarHBondContact O-N 3.41Å; Y18-S22 PolarHBondContact O-OG 2.93Å
19	I	78.9	Confident	67.5	Low	78 Å²	78	66.4 Å²	66.4	40%	0.4	33%	0.329	S	S	.	.	H	α-helix	trans	-63.3	-48.7	176.4	-70	165.9	0	0	0	110.4	I15 I16 I17 L21 S22 L23	I15-I19 HydrophobicContact CG2-CD1 3.71Å; I15-I19 HydrophobicContact CG2-CG1 4.31Å; I15-I19 VanDerWaalsContact O-CG1 3.25Å; I15-I19 WeakPolarHBondContact O-CG1 3.4Å; I15-I19 PolarHBondContact O-N 3.24Å; I16-I19 PolarHBondContact O-N 2.78Å; I17-I19 PolarHBondContact O-N 3.39Å; I19-L21 PolarHBondContact O-N 3.16Å; I19-S22 WeakPolarHBondContact O-CB 3.24Å; I19-S22 PolarHBondContact O-N 2.75Å; I19-S22 VanDerWaalsContact O-N 3.15Å; I19-L23 HydrophobicContact CG2-CD1 3.83Å; I19-L23 HydrophobicContact CG2-CG 4.36Å; I19-L23 WeakPolarHBondContact O-CB 3.19Å; I19-L23 VanDerWaalsContact O-CG 3.31Å; I19-L23 WeakPolarHBondContact O-CG 3.48Å; I19-L23 PolarHBondContact O-N 3.03Å
20	L	79.1	Confident	65.9	Low	1 Å²	1	70.6 Å²	70.6	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-64.4	-41.3	179.5	-67.4	177	0	0	0	111.2	I16 I17 S22 L23 S24 V386 L387 Y390 L477 V480	I16-L20 HydrophobicContact CG2-CD1 3.77Å; I16-L20 HydrophobicContact CG2-CG 4.04Å; I16-L20 WeakPolarHBondContact O-CB 3.41Å; I16-L20 VanDerWaalsContact O-CG 3.26Å; I16-L20 WeakPolarHBondContact O-CG 3.39Å; I16-L20 PolarHBondContact O-N 3.43Å; I17-L20 PolarHBondContact O-N 2.93Å; L20-S22 VanDerWaalsContact C-N 3.31Å; L20-S22 PolarHBondContact O-N 2.98Å; L20-L23 PolarHBondContact O-N 2.99Å; L20-S24 WeakPolarHBondContact O-CB 3.4Å; L20-S24 PolarHBondContact O-N 2.97Å; L20-S24 PolarHBondContact O-OG 2.77Å; L20-V386 HydrophobicContact CB-CG1 4.17Å; L20-V386 HydrophobicContact CD1-CG1 4.37Å; L20-V386 HydrophobicContact CD2-CG1 3.75Å; L20-V386 HydrophobicContact CG-CG1 4.3Å; L20-L387 HydrophobicContact CB-CD2 3.95Å; L20-L387 HydrophobicContact CD1-CD2 3.97Å; L20-Y390 HydrophobicContact CD1-CD1 3.91Å; L20-Y390 HydrophobicContact CD1-CD2 4.16Å; L20-Y390 HydrophobicContact CD1-CG 3.63Å; L20-L477 HydrophobicContact CD2-CD2 4.18Å; L20-V480 HydrophobicContact CD2-CG1 4.35Å
21	L	78.5	Confident	64.2	Low	64 Å²	64	66.6 Å²	66.6	34%	0.335	34%	0.341	S	S	.	.	H	α-helix	trans	-59.4	-41.9	172.1	-74.9	172.2	0	0	0	111.4	I17 Y18 I19 S24 S25 T383 L387	I17-L21 HydrophobicContact CG2-CD1 3.6Å; I17-L21 HydrophobicContact CG2-CG 4.07Å; I17-L21 VanDerWaalsContact O-CB 3.24Å; I17-L21 WeakPolarHBondContact O-CB 3.32Å; I17-L21 WeakPolarHBondContact O-CG 3.21Å; I17-L21 PolarHBondContact O-N 2.88Å; Y18-L21 PolarHBondContact O-N 3.19Å; I19-L21 PolarHBondContact O-N 3.16Å; L21-S24 WeakPolarHBondContact CA-OG 3.47Å; L21-S24 PolarHBondContact O-OG 2.73Å; L21-S25 WeakPolarHBondContact O-CB 3.43Å; L21-S25 PolarHBondContact O-N 3.4Å; L21-S25 PolarHBondContact O-OG 3.15Å; L21-T383 HydrophobicContact CD2-CG2 3.44Å; L21-T383 VanDerWaalsContact CD2-CG2 3.44Å; L21-L387 HydrophobicContact CD2-CD1 4.34Å
22	S	76	Confident	62.4	Low	48 Å²	48	67.5 Å²	67.5	34%	0.336	35%	0.349	S	S	.	.	H	α-helix	trans	-67	-42.4	178.5	-57.2	0	0	0	0	111.2	Y18 I19 L20 F26	Y18-S22 WeakPolarHBondContact O-CB 3.05Å; Y18-S22 PolarHBondContact O-N 3.41Å; Y18-S22 PolarHBondContact O-OG 2.93Å; I19-S22 WeakPolarHBondContact O-CB 3.24Å; I19-S22 PolarHBondContact O-N 2.75Å; I19-S22 VanDerWaalsContact O-N 3.15Å; L20-S22 VanDerWaalsContact C-N 3.31Å; L20-S22 PolarHBondContact O-N 2.98Å; S22-F26 PolarHBondContact O-N 3.23Å
23	L	72.4	Confident	60.6	Low	61 Å²	61	67.5 Å²	67.5	32%	0.319	35%	0.353	S	S	.	.	H	α-helix	trans	-68.3	-37.2	177.7	-70.5	170.5	0	0	0	112.5	I19 L20 L484	I19-L23 HydrophobicContact CG2-CD1 3.83Å; I19-L23 HydrophobicContact CG2-CG 4.36Å; I19-L23 WeakPolarHBondContact O-CB 3.19Å; I19-L23 VanDerWaalsContact O-CG 3.31Å; I19-L23 WeakPolarHBondContact O-CG 3.48Å; I19-L23 PolarHBondContact O-N 3.03Å; L20-L23 PolarHBondContact O-N 2.99Å; L23-L484 HydrophobicContact CB-CD2 3.91Å
24	S	68.3	Low	58.6	Low	0 Å²	0	71.9 Å²	71.9	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-80.6	-25.3	178.6	66	0	0	0	0	113.3	L20 L21 F26 T383	L20-S24 WeakPolarHBondContact O-CB 3.4Å; L20-S24 PolarHBondContact O-N 2.97Å; L20-S24 PolarHBondContact O-OG 2.77Å; L21-S24 WeakPolarHBondContact CA-OG 3.47Å; L21-S24 PolarHBondContact O-OG 2.73Å; S24-F26 VanDerWaalsContact C-N 3.32Å; S24-T383 VanDerWaalsContact CB-OG1 3.28Å; S24-T383 WeakPolarHBondContact CB-OG1 3.3Å; S24-T383 WeakPolarHBondContact OG-CB 3.33Å; S24-T383 PolarHBondContact OG-OG1 3.06Å
25	S	58.9	Low	56.5	Low	37 Å²	37	76.1 Å²	76.1	26%	0.259	40%	0.404	S	S	.	.	S	Bend	trans	-86.3	-0.8	174.7	-52.8	0	0	0	0	113.1	L21 D27 D28 L29	L21-S25 WeakPolarHBondContact O-CB 3.43Å; L21-S25 PolarHBondContact O-N 3.4Å; L21-S25 PolarHBondContact O-OG 3.15Å; S25-D27 PolarHBondContact O-N 3.1Å; S25-D27 VanDerWaalsContact O-N 3.11Å; S25-D28 PolarHBondContact O-N 3.26Å; S25-L29 PolarHBondContact O-N 3.27Å
26	F	49.5	Very low	54.3	Low	109 Å²	109	78.7 Å²	78.7	48%	0.478	42%	0.423	S	S	.	.	H	α-helix	trans	-57.3	-27.2	178.4	-127.6	-93.6	0	0	0	111.5	S22 S24 D28 L29 N30	S22-F26 PolarHBondContact O-N 3.23Å; S24-F26 VanDerWaalsContact C-N 3.32Å; F26-D28 PolarHBondContact O-N 3.23Å; F26-L29 PolarHBondContact O-N 2.65Å; F26-N30 HydrophobicContact CD1-CB 4.23Å; F26-N30 WeakPolarHBondContact CE1-ND2 3.4Å; F26-N30 WeakPolarHBondContact O-CB 3.41Å; F26-N30 PolarHBondContact O-N 3.28Å
27	D	44.6	Very low	52	Low	89 Å²	89	81.2 Å²	81.2	48%	0.476	44%	0.442	S	S	.	.	H	α-helix	trans	-70.9	-20.5	171.9	-78.1	-26	0	0	0	114.9	S25	S25-D27 PolarHBondContact O-N 3.1Å; S25-D27 VanDerWaalsContact O-N 3.11Å
28	D	39.2	Very low	49.7	Very low	90 Å²	90	83.1 Å²	83.1	48%	0.481	47%	0.465	S	S	.	.	H	α-helix	trans	-95.1	-9.1	177.9	-86.3	-27.7	0	0	0	112.7	S25 F26	S25-D28 PolarHBondContact O-N 3.26Å; F26-D28 PolarHBondContact O-N 3.23Å
29	L	35.3	Very low	47.3	Very low	138 Å²	138	84.8 Å²	84.8	72%	0.723	48%	0.475	S	S	*	.	H	α-helix	trans	-117.8	-21.8	180	-84.8	153.2	0	0	0	114.1	S25 F26 G31	S25-L29 PolarHBondContact O-N 3.27Å; F26-L29 PolarHBondContact O-N 2.65Å; L29-G31 PolarHBondContact O-N 2.82Å
30	N	30.3	Very low	45	Very low	93 Å²	93	88.1 Å²	88.1	50%	0.497	49%	0.487	S	S	.	.			trans	-96.8	61.3	171.7	-99.3	21.8	0	0	0	111.9	F26 D32	F26-N30 HydrophobicContact CD1-CB 4.23Å; F26-N30 WeakPolarHBondContact CE1-ND2 3.4Å; F26-N30 WeakPolarHBondContact O-CB 3.41Å; F26-N30 PolarHBondContact O-N 3.28Å; N30-D32 PolarHBondContact O-N 3.49Å
31	G	31.2	Very low	42.6	Very low	26 Å²	26	92.6 Å²	92.6	27%	0.268	52%	0.518	S	S	.	.			trans	-68.1	6.6	154	0	0	0	0	0	113.3	L29 D33 S47 Q49	L29-G31 PolarHBondContact O-N 2.82Å; G31-D33 PolarHBondContact O-N 3.47Å; G31-S47 PolarHBondContact O-OG 3.17Å; G31-Q49 VanDerWaalsContact CA-NE2 3.31Å; G31-Q49 VanDerWaalsContact O-CG 3.24Å; G31-Q49 WeakPolarHBondContact O-CG 3.46Å; G31-Q49 PolarHBondContact O-NE2 3.15Å; G31-Q49 PolarHBondContact O-OE1 3.07Å
32	D	30.2	Very low	40.2	Very low	98 Å²	98	97 Å²	97	52%	0.524	54%	0.537	S	S	.	.			trans	-95.5	91.7	-176.8	-125.8	-33.9	0	0	0	107.2	N30 S34 Q49	N30-D32 PolarHBondContact O-N 3.49Å; D32-S34 PolarHBondContact O-N 2.99Å; D32-Q49 PolarHBondContact OD1-OE1 2.72Å; D32-Q49 PolarHBondContact OD2-OE1 3.45Å
33	D	34.1	Very low	38.2	Very low	95 Å²	95	97.2 Å²	97.2	51%	0.508	54%	0.539	S	S	.	.			trans	-66.6	35.5	-172.7	-80.7	-53.3	0	0	0	114.6	G31 S37 S47	G31-D33 PolarHBondContact O-N 3.47Å; D33-S37 WeakPolarHBondContact O-CB 3.34Å; D33-S37 PolarHBondContact O-OG 3.35Å; D33-S47 VanDerWaalsContact OD2-CB 3.29Å; D33-S47 WeakPolarHBondContact OD2-CB 3.31Å
34	S	31	Very low	36.7	Very low	95 Å²	95	100.5 Å²	100.5	66%	0.664	56%	0.555	S	S	*	*	S	Bend	trans	-99.5	-7.5	-167.3	61.8	0	0	0	0	116.3	D32	D32-S34 PolarHBondContact O-N 2.99Å
35	M	30.5	Very low	35.4	Very low	175 Å²	175	103.6 Å²	103.6	86%	0.862	57%	0.574	S	S	*	*	S	Bend	trans	-139.5	-10.6	-177	-148.4	173.6	157.2	0	0	116.7
36	V	33.7	Very low	34.7	Very low	138 Å²	138	102.4 Å²	102.4	84%	0.836	57%	0.566	S	S	*	*	S	Bend	trans	-108	-7.1	175.6	-177.2	0	0	0	0	112	A38	V36-A38 VanDerWaalsContact C-N 3.28Å; V36-A38 PolarHBondContact O-N 2.81Å
37	S	30.5	Very low	34.4	Very low	62 Å²	62	98.3 Å²	98.3	43%	0.434	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-74.7	-8.4	179.5	51.7	0	0	0	0	114.7	D33 F39 K40	D33-S37 WeakPolarHBondContact O-CB 3.34Å; D33-S37 PolarHBondContact O-OG 3.35Å; S37-F39 PolarHBondContact O-N 3.07Å; S37-F39 VanDerWaalsContact O-N 3.16Å; S37-K40 PolarHBondContact O-N 3.05Å
38	A	30.9	Very low	34.5	Very low	86 Å²	86	98.4 Å²	98.4	71%	0.711	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-71.2	-7.6	-176.7	0	0	0	0	0	115.3	V36	V36-A38 VanDerWaalsContact C-N 3.28Å; V36-A38 PolarHBondContact O-N 2.81Å
39	F	29.8	Very low	35	Very low	198 Å²	198	97.5 Å²	97.5	87%	0.868	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-126.4	5.2	178.4	-92.8	-85.5	0	0	0	114.7	S37 S41	S37-F39 PolarHBondContact O-N 3.07Å; S37-F39 VanDerWaalsContact O-N 3.16Å; F39-S41 PolarHBondContact O-N 3.35Å
40	K	30.6	Very low	35.6	Very low	148 Å²	148	94.3 Å²	94.3	64%	0.643	54%	0.535	S	S	*	.			trans	-101.7	49.3	175	-146.1	178.3	-172.5	-175.9	0	110.4	S37 Q42	S37-K40 PolarHBondContact O-N 3.05Å; K40-Q42 PolarHBondContact O-N 3.21Å
41	S	28.3	Very low	36.5	Very low	94 Å²	94	91.9 Å²	91.9	66%	0.657	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	112.2	175.5	51.5	0	0	0	0	110.1	F39	F39-S41 PolarHBondContact O-N 3.35Å
42	Q	28.6	Very low	37.4	Very low	156 Å²	156	100.7 Å²	100.7	73%	0.729	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	127.1	14.9	156.6	-67.4	-174.3	-0.1	0	0	118.3	K40	K40-Q42 PolarHBondContact O-N 3.21Å
43	S	34.4	Very low	38.3	Very low	53 Å²	53	97.1 Å²	97.1	37%	0.371	54%	0.539	S	S	.	.			trans	-142.3	107.1	151.7	52.9	0	0	0	0	110.5	T45	S43-T45 PolarHBondContact O-N 3.34Å
44	I	40.1	Very low	38.9	Very low	131 Å²	131	99 Å²	99	67%	0.672	56%	0.556	S	S	*	*			trans	-66.9	97.4	173.3	-59.8	169.1	0	0	0	105.8
45	T	42.9	Very low	39.9	Very low	65 Å²	65	99.4 Å²	99.4	40%	0.399	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-92.3	123	172.2	17.7	0	0	0	0	107	S43 P248	S43-T45 PolarHBondContact O-N 3.34Å; T45-P248 HydrophobicContact CG2-CG 4.19Å
46	P	42.6	Very low	41	Very low	12 Å²	12	94.1 Å²	94.1	8%	0.078	55%	0.545	C	S	.	.	P	Polyproline II helix	trans	-70.7	136.5	-173.5	21.6	-30	0	0	0	113.2	C60 D73 W251	P46-C60 VanDerWaalsContact CB-SG 3.53Å; P46-C60 HydrophobicContact CG-CB 4.15Å; P46-C60 WeakPolarHBondContact CG-SG 3.49Å; P46-D73 WeakPolarHBondContact CA-OD2 3.49Å; P46-D73 WeakPolarHBondContact CB-OD1 3.27Å; P46-D73 WeakPolarHBondContact CB-OD2 3.4Å; P46-W251 HydrophobicContact CG-CZ2 4.08Å
47	S	44.4	Very low	42.4	Very low	23 Å²	23	92.8 Å²	92.8	16%	0.161	53%	0.533	C	S	.	.	P	Polyproline II helix	trans	-78	131.8	180	175.3	0	0	0	0	110.9	G31 D33 Q49 D73	G31-S47 PolarHBondContact O-OG 3.17Å; D33-S47 VanDerWaalsContact OD2-CB 3.29Å; D33-S47 WeakPolarHBondContact OD2-CB 3.31Å; S47-Q49 PolarHBondContact O-N 3.08Å; S47-Q49 VanDerWaalsContact O-N 3.16Å; S47-D73 PolarHBondContact N-OD2 3.01Å
48	P	45.7	Very low	44.4	Very low	91 Å²	91	90.5 Å²	90.5	59%	0.591	52%	0.517	S	S	*	.			trans	-79.2	15.2	-177.8	16.6	-8.1	0	0	0	115.5	T50	P48-T50 PolarHBondContact O-N 3.42Å
49	Q	50.3	Low	46.6	Very low	70 Å²	70	87.3 Å²	87.3	33%	0.327	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-0.2	-153.7	-89	-160.4	-23.2	0	0	120.9	G31 D32 S47	G31-Q49 VanDerWaalsContact CA-NE2 3.31Å; G31-Q49 VanDerWaalsContact O-CG 3.24Å; G31-Q49 WeakPolarHBondContact O-CG 3.46Å; G31-Q49 PolarHBondContact O-NE2 3.15Å; G31-Q49 PolarHBondContact O-OE1 3.07Å; D32-Q49 PolarHBondContact OD1-OE1 2.72Å; D32-Q49 PolarHBondContact OD2-OE1 3.45Å; S47-Q49 PolarHBondContact O-N 3.08Å; S47-Q49 VanDerWaalsContact O-N 3.16Å
50	T	47.9	Very low	48.8	Very low	71 Å²	71	77.9 Å²	77.9	44%	0.436	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.7	64	173.7	59.5	0	0	0	0	113.4	P48 K52 E72	P48-T50 PolarHBondContact O-N 3.42Å; T50-K52 PolarHBondContact O-N 3.45Å; T50-E72 WeakPolarHBondContact CB-OE2 3.39Å; T50-E72 VanDerWaalsContact CG2-OE2 3.25Å; T50-E72 WeakPolarHBondContact CG2-OE2 3.46Å; T50-E72 WeakPolarHBondContact OG1-CB 2.81Å; T50-E72 PolarHBondContact OG1-OE2 3.3Å
51	C	49	Very low	51.1	Low	43 Å²	43	71.4 Å²	71.4	29%	0.291	42%	0.418	S	S	.	.			trans	-75.4	112.3	175	-159.2	0	0	0	0	112.2	S53 N57 C58	C51-S53 PolarHBondContact O-N 2.93Å; C51-N57 VanDerWaalsContact SG-C 3.58Å; C51-C58 WeakPolarHBondContact CA-SG 3.33Å; C51-C58 HydrophobicContact CB-CB 3.68Å; C51-C58 WeakPolarHBondContact CB-SG 3.48Å; C51-C58 WeakPolarHBondContact SG-CA 3.33Å; C51-C58 WeakPolarHBondContact SG-CB 3.39Å; C51-C58 PolarHBondContact SG-N 3.45Å; C51-C58 CovalentContact SG-SG 2Å; C51-C58 PolarHBondContact SG-SG 2.98Å
52	K	49.4	Very low	53.4	Low	211 Å²	211	67.5 Å²	67.5	92%	0.917	39%	0.389	S	S	*	.			trans	-77.9	-2	172.9	-77.1	-176.5	-179.8	175.1	0	114.1	T50	T50-K52 PolarHBondContact O-N 3.45Å
53	S	50.1	Low	55.7	Low	23 Å²	23	61.2 Å²	61.2	16%	0.161	36%	0.361	C	S	.	.	S	Bend	trans	-80.3	134.1	-178.2	177.5	0	0	0	0	111.8	C51 T55	C51-S53 PolarHBondContact O-N 2.93Å; S53-T55 PolarHBondContact O-N 2.92Å; S53-T55 PolarHBondContact OG-N 3.31Å; S53-T55 PolarHBondContact OG-OG1 3.38Å; S53-T55 VanDerWaalsContact OG-OG1 3.06Å
54	P	46.3	Very low	57.8	Low	133 Å²	133	58.7 Å²	58.7	86%	0.864	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-9.8	176.7	24.6	-32.2	0	0	0	113.8
55	T	51.8	Low	59.5	Low	104 Å²	104	56.5 Å²	56.5	64%	0.638	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	43.1	-178.4	58.8	0	0	0	0	113.6	S53 N57	S53-T55 PolarHBondContact O-N 2.92Å; S53-T55 PolarHBondContact OG-N 3.31Å; S53-T55 PolarHBondContact OG-OG1 3.38Å; S53-T55 VanDerWaalsContact OG-OG1 3.06Å; T55-N57 PolarHBondContact O-N 2.85Å
56	G	54	Low	61	Low	64 Å²	64	60.5 Å²	60.5	66%	0.66	35%	0.348	S	S	*	.	S	Bend	trans	60.7	-3.8	150.9	0	0	0	0	0	120.9
57	N	63.2	Low	62.6	Low	110 Å²	110	64.8 Å²	64.8	59%	0.588	37%	0.365	S	S	*	.			trans	-149.2	130.9	171.8	-66.1	-57.5	0	0	0	109	C51 T55 F59	C51-N57 VanDerWaalsContact SG-C 3.58Å; T55-N57 PolarHBondContact O-N 2.85Å; N57-F59 HydrophobicContact CB-CE2 4.27Å; N57-F59 HydrophobicContact CB-CZ 3.96Å
58	C	71.9	Confident	64	Low	14 Å²	14	68.3 Å²	68.3	10%	0.095	39%	0.39	C	S	.	.			trans	-93.8	151.6	168.5	-89.2	0	0	0	0	110	C51 D69 C70	C51-C58 WeakPolarHBondContact CA-SG 3.33Å; C51-C58 HydrophobicContact CB-CB 3.68Å; C51-C58 WeakPolarHBondContact CB-SG 3.48Å; C51-C58 WeakPolarHBondContact SG-CA 3.33Å; C51-C58 WeakPolarHBondContact SG-CB 3.39Å; C51-C58 PolarHBondContact SG-N 3.45Å; C51-C58 CovalentContact SG-SG 2Å; C51-C58 PolarHBondContact SG-SG 2.98Å; C58-D69 CarbonylContact C-O 3.51Å; C58-D69 VanDerWaalsContact CA-O 3.24Å; C58-D69 WeakPolarHBondContact CA-O 3.48Å; C58-D69 VanDerWaalsContact CB-O 3.23Å; C58-D69 WeakPolarHBondContact CB-O 3.4Å; C58-D69 PolarHBondContact SG-O 3.25Å; C58-C70 PolarHBondContact SG-O 3.32Å
59	F	76.5	Confident	65.5	Low	20 Å²	20	64.5 Å²	64.5	9%	0.088	36%	0.364	C	S	.	.			trans	-123.3	137.9	177.1	-57.3	-78.9	0	0	0	109.4	N57 D61 C64 D69 C71 S250 R252 R253 P254	N57-F59 HydrophobicContact CB-CE2 4.27Å; N57-F59 HydrophobicContact CB-CZ 3.96Å; F59-D61 VanDerWaalsContact C-N 3.3Å; F59-D61 PolarHBondContact O-N 2.6Å; F59-C64 WeakPolarHBondContact O-CB 3.38Å; F59-D69 WeakPolarHBondContact CD2-OD2 3.42Å; F59-D69 PolarHBondContact N-O 3.35Å; F59-C71 VanDerWaalsContact C-SG 3.5Å; F59-S250 CarbonylContact C-O 3.46Å; F59-S250 WeakPolarHBondContact CA-O 3.45Å; F59-R252 WeakPolarHBondContact CE1-O 3.23Å; F59-R253 HydrophobicContact CD1-CB 4.17Å; F59-R253 HydrophobicContact CE1-CB 4.44Å; F59-R253 HydrophobicContact CG-CB 4.38Å; F59-P254 HydrophobicContact CZ-CG 4.28Å
60	C	77	Confident	66.7	Low	0 Å²	0	63 Å²	63	0%	0	36%	0.361	C	S	.	.			trans	-95.3	29.4	-177.8	-42.1	0	0	0	0	111.7	P46 C71 Y74 S250 W251	P46-C60 VanDerWaalsContact CB-SG 3.53Å; P46-C60 HydrophobicContact CG-CB 4.15Å; P46-C60 WeakPolarHBondContact CG-SG 3.49Å; C60-C71 WeakPolarHBondContact CA-SG 3.4Å; C60-C71 HydrophobicContact CB-CB 3.97Å; C60-C71 WeakPolarHBondContact CB-SG 3.39Å; C60-C71 PolarHBondContact N-SG 3.49Å; C60-C71 WeakPolarHBondContact SG-CB 3.48Å; C60-C71 CovalentContact SG-SG 2.03Å; C60-C71 PolarHBondContact SG-SG 3.45Å; C60-Y74 HydrophobicContact CB-CD2 4.14Å; C60-Y74 WeakPolarHBondContact O-CD2 3.47Å; C60-Y74 WeakPolarHBondContact O-CE2 3.24Å; C60-S250 PolarHBondContact N-O 3.35Å; C60-S250 VanDerWaalsContact SG-CB 3.53Å; C60-W251 HydrophobicContact CB-CD2 4.28Å; C60-W251 HydrophobicContact CB-CE3 4.45Å; C60-W251 HydrophobicContact CB-CH2 4.06Å; C60-W251 HydrophobicContact CB-CZ2 3.84Å; C60-W251 HydrophobicContact CB-CZ3 4.37Å; C60-W251 WeakPolarHBondContact O-CH2 3.44Å; C60-W251 WeakPolarHBondContact O-CZ3 3.32Å
61	D	78.9	Confident	68	Low	12 Å²	12	60 Å²	60	6%	0.064	34%	0.343	C	S	.	.	S	Bend	trans	-93	171.6	-177.8	66.4	-3.3	0	0	0	113.2	F59 I63 C64 Y74 W251 R253	F59-D61 VanDerWaalsContact C-N 3.3Å; F59-D61 PolarHBondContact O-N 2.6Å; D61-I63 PolarHBondContact O-N 3.16Å; D61-I63 VanDerWaalsContact O-N 3.1Å; D61-I63 PolarHBondContact OD1-N 2.92Å; D61-C64 WeakPolarHBondContact O-CB 3.39Å; D61-C64 PolarHBondContact O-N 3.49Å; D61-C64 PolarHBondContact O-SG 3Å; D61-C64 PolarHBondContact OD1-N 3.44Å; D61-Y74 WeakPolarHBondContact O-CE2 3.38Å; D61-W251 HydrophobicContact CB-CE3 4.45Å; D61-R253 IonicContact OD1-CZ 3.21Å; D61-R253 IonicContact OD1-NE 3.27Å; D61-R253 IonicContact OD1-NH2 2.93Å; D61-R253 PolarHBondContact OD1-NH2 2.92Å; D61-R253 IonicContact OD2-CZ 3.79Å; D61-R253 IonicContact OD2-NE 3.45Å; D61-R253 PolarHBondContact OD2-NE 3.49Å; D61-R253 IonicContact OD2-NH2 3.83Å
62	E	76.3	Confident	69	Low	11 Å²	11	64.4 Å²	64.4	5%	0.051	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-25.2	177.1	74.1	176	147.6	0	0	114.4	C64 Y74 G189 R190	E62-C64 PolarHBondContact O-N 3.25Å; E62-Y74 WeakPolarHBondContact CA-OH 3.37Å; E62-G189 PolarHBondContact N-O 3.38Å; E62-R190 HydrophobicContact CB-CG 4.36Å; E62-R190 VanDerWaalsContact CD-CG 3.47Å; E62-R190 HydrophobicContact CG-CG 4.16Å; E62-R190 WeakPolarHBondContact OE1-CD 3.36Å; E62-R190 WeakPolarHBondContact OE1-CG 3.22Å; E62-R190 IonicContact OE1-NE 2.79Å; E62-R190 PolarHBondContact OE1-NE 2.67Å; E62-R190 IonicContact OE2-CZ 2.61Å; E62-R190 VanDerWaalsContact OE2-CZ 3.23Å; E62-R190 IonicContact OE2-NE 3.35Å; E62-R190 PolarHBondContact OE2-NE 2.68Å; E62-R190 IonicContact OE2-NH2 3.05Å; E62-R190 PolarHBondContact OE2-NH2 2.91Å
63	I	77.3	Confident	69.9	Low	25 Å²	25	55.9 Å²	55.9	13%	0.128	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-16.6	179.5	-54.5	174	0	0	0	110.4	D61 V65 F66 K67	D61-I63 PolarHBondContact O-N 3.16Å; D61-I63 VanDerWaalsContact O-N 3.1Å; D61-I63 PolarHBondContact OD1-N 2.92Å; I63-V65 VanDerWaalsContact C-N 3.25Å; I63-V65 PolarHBondContact O-N 3.24Å; I63-F66 WeakPolarHBondContact O-CB 3.33Å; I63-F66 PolarHBondContact O-N 3.36Å; I63-K67 HydrophobicContact CG2-CD 3.69Å; I63-K67 HydrophobicContact CG2-CG 3.84Å; I63-K67 PolarHBondContact O-N 3.36Å
64	C	78.5	Confident	70.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-37.1	-173.3	85.9	0	0	0	0	113	F59 D61 E62 F66 K67 S68 D69 C70 Y74	F59-C64 WeakPolarHBondContact O-CB 3.38Å; D61-C64 WeakPolarHBondContact O-CB 3.39Å; D61-C64 PolarHBondContact O-N 3.49Å; D61-C64 PolarHBondContact O-SG 3Å; D61-C64 PolarHBondContact OD1-N 3.44Å; E62-C64 PolarHBondContact O-N 3.25Å; C64-F66 VanDerWaalsContact C-N 3.33Å; C64-K67 PolarHBondContact O-N 2.72Å; C64-S68 WeakPolarHBondContact O-CA 3.35Å; C64-S68 PolarHBondContact O-N 2.99Å; C64-D69 WeakPolarHBondContact CA-OD1 3.45Å; C64-D69 PolarHBondContact O-N 2.84Å; C64-C70 HydrophobicContact CB-CB 3.82Å; C64-C70 WeakPolarHBondContact CB-SG 3.27Å; C64-C70 PolarHBondContact O-SG 2.73Å; C64-C70 VanDerWaalsContact O-SG 3.36Å; C64-C70 WeakPolarHBondContact SG-CA 3.29Å; C64-C70 WeakPolarHBondContact SG-CB 3.44Å; C64-C70 CovalentContact SG-SG 2.05Å; C64-C70 PolarHBondContact SG-SG 3.47Å; C64-Y74 WeakPolarHBondContact SG-CD1 3.33Å; C64-Y74 VanDerWaalsContact SG-CG 3.56Å
65	V	75.4	Confident	72	Confident	84 Å²	84	57.2 Å²	57.2	51%	0.509	31%	0.313	S	S	.	.	H	α-helix	trans	-67.7	-40.3	179.3	179.7	0	0	0	0	109.6	I63 C70 Y74	I63-V65 VanDerWaalsContact C-N 3.25Å; I63-V65 PolarHBondContact O-N 3.24Å; V65-C70 PolarHBondContact N-SG 2.93Å; V65-Y74 HydrophobicContact CG2-CD1 4.25Å; V65-Y74 HydrophobicContact CG2-CE1 3.65Å
66	F	73.9	Confident	72.7	Confident	149 Å²	149	58.7 Å²	58.7	65%	0.654	32%	0.317	S	S	*	.	H	α-helix	trans	-68.7	-39.6	178	-179.8	-99.3	0	0	0	112.2	I63 C64	I63-F66 WeakPolarHBondContact O-CB 3.33Å; I63-F66 PolarHBondContact O-N 3.36Å; C64-F66 VanDerWaalsContact C-N 3.33Å
67	K	76.5	Confident	73.1	Confident	102 Å²	102	56.6 Å²	56.6	44%	0.443	29%	0.29	S	S	.	.	H	α-helix	trans	-89.5	-2.8	179.9	-75.3	-175.8	-178.9	171.5	0	114.7	I63 C64 D69	I63-K67 HydrophobicContact CG2-CD 3.69Å; I63-K67 HydrophobicContact CG2-CG 3.84Å; I63-K67 PolarHBondContact O-N 3.36Å; C64-K67 PolarHBondContact O-N 2.72Å; K67-D69 WeakPolarHBondContact CB-OD1 3.43Å; K67-D69 PolarHBondContact O-N 3.32Å
68	S	73.5	Confident	73.3	Confident	98 Å²	98	53.3 Å²	53.3	69%	0.685	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	35.6	-175.6	-58	0	0	0	0	113.6	C64	C64-S68 WeakPolarHBondContact O-CA 3.35Å; C64-S68 PolarHBondContact O-N 2.99Å
69	D	78.3	Confident	72.7	Confident	10 Å²	10	60.1 Å²	60.1	5%	0.053	30%	0.299	C	S	.	.			trans	-123.4	30.4	-179.2	66.5	-8	0	0	0	112.9	C58 F59 C64 K67 R253	C58-D69 CarbonylContact C-O 3.51Å; C58-D69 VanDerWaalsContact CA-O 3.24Å; C58-D69 WeakPolarHBondContact CA-O 3.48Å; C58-D69 VanDerWaalsContact CB-O 3.23Å; C58-D69 WeakPolarHBondContact CB-O 3.4Å; C58-D69 PolarHBondContact SG-O 3.25Å; F59-D69 WeakPolarHBondContact CD2-OD2 3.42Å; F59-D69 PolarHBondContact N-O 3.35Å; C64-D69 WeakPolarHBondContact CA-OD1 3.45Å; C64-D69 PolarHBondContact O-N 2.84Å; K67-D69 WeakPolarHBondContact CB-OD1 3.43Å; K67-D69 PolarHBondContact O-N 3.32Å; D69-R253 IonicContact OD1-CZ 3.79Å; D69-R253 IonicContact OD1-NH1 2.73Å; D69-R253 IonicContact OD1-NH2 3.51Å; D69-R253 PolarHBondContact OD1-NH2 2.96Å; D69-R253 IonicContact OD2-CZ 3.86Å; D69-R253 IonicContact OD2-NH1 3.25Å; D69-R253 PolarHBondContact OD2-NH1 3.48Å; D69-R253 IonicContact OD2-NH2 3.17Å; D69-R253 PolarHBondContact OD2-NH2 3.43Å
70	C	75.6	Confident	72	Confident	38 Å²	38	62.4 Å²	62.4	26%	0.257	31%	0.313	S	S	.	.			trans	-68.3	145.8	178.2	-65	0	0	0	0	114.2	C58 C64 V65	C58-C70 PolarHBondContact SG-O 3.32Å; C64-C70 HydrophobicContact CB-CB 3.82Å; C64-C70 WeakPolarHBondContact CB-SG 3.27Å; C64-C70 PolarHBondContact O-SG 2.73Å; C64-C70 VanDerWaalsContact O-SG 3.36Å; C64-C70 WeakPolarHBondContact SG-CA 3.29Å; C64-C70 WeakPolarHBondContact SG-CB 3.44Å; C64-C70 CovalentContact SG-SG 2.05Å; C64-C70 PolarHBondContact SG-SG 3.47Å; V65-C70 PolarHBondContact N-SG 2.93Å
71	C	74.8	Confident	70.9	Confident	8 Å²	8	69.2 Å²	69.2	5%	0.054	35%	0.354	C	S	.	.			trans	-64.5	155.7	161.5	-48.5	0	0	0	0	111.4	F59 C60 D73 Y74	F59-C71 VanDerWaalsContact C-SG 3.5Å; C60-C71 WeakPolarHBondContact CA-SG 3.4Å; C60-C71 HydrophobicContact CB-CB 3.97Å; C60-C71 WeakPolarHBondContact CB-SG 3.39Å; C60-C71 PolarHBondContact N-SG 3.49Å; C60-C71 WeakPolarHBondContact SG-CB 3.48Å; C60-C71 CovalentContact SG-SG 2.03Å; C60-C71 PolarHBondContact SG-SG 3.45Å; C71-D73 VanDerWaalsContact C-N 3.31Å; C71-D73 WeakPolarHBondContact CB-OD1 3.24Å; C71-D73 PolarHBondContact O-N 3.14Å; C71-Y74 WeakPolarHBondContact O-CB 3.32Å; C71-Y74 PolarHBondContact O-N 3.38Å
72	E	70.4	Confident	70	Confident	137 Å²	137	75.6 Å²	75.6	64%	0.64	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-38.7	-178.2	-165.2	163.5	-162.2	0	0	112.4	T50	T50-E72 WeakPolarHBondContact CB-OE2 3.39Å; T50-E72 VanDerWaalsContact CG2-OE2 3.25Å; T50-E72 WeakPolarHBondContact CG2-OE2 3.46Å; T50-E72 WeakPolarHBondContact OG1-CB 2.81Å; T50-E72 PolarHBondContact OG1-OE2 3.3Å
73	D	68.1	Low	69	Low	31 Å²	31	81 Å²	81	17%	0.166	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	3.3	-178.8	54.8	5.4	0	0	0	114	P46 S47 C71 K75 D76 F77	P46-D73 WeakPolarHBondContact CA-OD2 3.49Å; P46-D73 WeakPolarHBondContact CB-OD1 3.27Å; P46-D73 WeakPolarHBondContact CB-OD2 3.4Å; S47-D73 PolarHBondContact N-OD2 3.01Å; C71-D73 VanDerWaalsContact C-N 3.31Å; C71-D73 WeakPolarHBondContact CB-OD1 3.24Å; C71-D73 PolarHBondContact O-N 3.14Å; D73-K75 PolarHBondContact O-N 3.28Å; D73-K75 VanDerWaalsContact O-N 3.1Å; D73-D76 WeakPolarHBondContact O-CB 3.5Å; D73-D76 PolarHBondContact O-N 3.41Å; D73-F77 PolarHBondContact O-N 3.02Å
74	Y	71.4	Confident	68.2	Low	8 Å²	8	81.9 Å²	81.9	3%	0.031	42%	0.424	C	S	.	.	H	α-helix	trans	-55.3	-33.3	176.7	176.4	-104.4	0	0	0	112	C60 D61 E62 C64 V65 C71 D76 F77 R78	C60-Y74 HydrophobicContact CB-CD2 4.14Å; C60-Y74 WeakPolarHBondContact O-CD2 3.47Å; C60-Y74 WeakPolarHBondContact O-CE2 3.24Å; D61-Y74 WeakPolarHBondContact O-CE2 3.38Å; E62-Y74 WeakPolarHBondContact CA-OH 3.37Å; C64-Y74 WeakPolarHBondContact SG-CD1 3.33Å; C64-Y74 VanDerWaalsContact SG-CG 3.56Å; V65-Y74 HydrophobicContact CG2-CD1 4.25Å; V65-Y74 HydrophobicContact CG2-CE1 3.65Å; C71-Y74 WeakPolarHBondContact O-CB 3.32Å; C71-Y74 PolarHBondContact O-N 3.38Å; Y74-D76 VanDerWaalsContact C-N 3.3Å; Y74-D76 PolarHBondContact O-N 3.02Å; Y74-F77 PolarHBondContact O-N 2.82Å; Y74-R78 PolarHBondContact O-N 2.94Å; Y74-R78 PolarHBondContact OH-NH1 3.34Å
75	K	68.2	Low	67.3	Low	177 Å²	177	86.2 Å²	86.2	77%	0.77	45%	0.447	S	S	*	.	H	α-helix	trans	-64.7	-32.8	176.5	-69.2	-176.6	-179.7	178	0	113	D73 F77	D73-K75 PolarHBondContact O-N 3.28Å; D73-K75 VanDerWaalsContact O-N 3.1Å; K75-F77 VanDerWaalsContact C-N 3.33Å
76	D	66.8	Low	66.6	Low	135 Å²	135	85.9 Å²	85.9	72%	0.722	45%	0.448	S	S	*	.	H	α-helix	trans	-77	-27.4	179.8	-61	-26.7	0	0	0	111.2	D73 Y74	D73-D76 WeakPolarHBondContact O-CB 3.5Å; D73-D76 PolarHBondContact O-N 3.41Å; Y74-D76 VanDerWaalsContact C-N 3.3Å; Y74-D76 PolarHBondContact O-N 3.02Å
77	F	63.2	Low	66	Low	19 Å²	19	83.2 Å²	83.2	8%	0.083	45%	0.449	C	S	.	.	H	α-helix	trans	-77.6	-25.4	177.3	-159.9	-92.6	0	0	0	113	D73 Y74 K75 I184 S185 K186 D223 W251	D73-F77 PolarHBondContact O-N 3.02Å; Y74-F77 PolarHBondContact O-N 2.82Å; K75-F77 VanDerWaalsContact C-N 3.33Å; F77-I184 HydrophobicContact CE1-CG2 3.69Å; F77-I184 HydrophobicContact CZ-CG2 3.73Å; F77-S185 WeakPolarHBondContact CE1-O 3.47Å; F77-K186 HydrophobicContact CZ-CG 4.26Å; F77-D223 WeakPolarHBondContact CE2-OD2 2.88Å; F77-D223 VanDerWaalsContact CZ-OD2 3.32Å; F77-D223 WeakPolarHBondContact CZ-OD2 3.24Å; F77-W251 AromaticContact CD1-CH2 3.5Å; F77-W251 HydrophobicContact CD1-CH2 3.5Å; F77-W251 AromaticContact CD1-CZ2 3.82Å; F77-W251 HydrophobicContact CD1-CZ2 3.82Å; F77-W251 HydrophobicContact CD2-CZ2 4.16Å; F77-W251 AromaticContact CE1-CH2 3.43Å; F77-W251 HydrophobicContact CE1-CH2 3.43Å; F77-W251 VanDerWaalsContact CE1-CH2 3.43Å; F77-W251 AromaticContact CE1-CZ2 3.7Å; F77-W251 HydrophobicContact CE1-CZ2 3.7Å; F77-W251 HydrophobicContact CE1-CZ3 4.48Å; F77-W251 HydrophobicContact CE2-CZ2 4.06Å; F77-W251 HydrophobicContact CG-CH2 4.14Å; F77-W251 HydrophobicContact CG-CZ2 4.04Å; F77-W251 HydrophobicContact CZ-CH2 4.03Å; F77-W251 AromaticContact CZ-CZ2 3.83Å; F77-W251 HydrophobicContact CZ-CZ2 3.83Å
78	R	66.2	Low	65.5	Low	42 Å²	42	82.5 Å²	82.5	16%	0.158	45%	0.453	C	S	.	.			trans	-99	110.5	-173	-170.8	179.7	172.4	165	-4	111.6	Y74 D80 K82 V84	Y74-R78 PolarHBondContact O-N 2.94Å; Y74-R78 PolarHBondContact OH-NH1 3.34Å; R78-D80 WeakPolarHBondContact CD-O 3.48Å; R78-D80 WeakPolarHBondContact CG-O 3.24Å; R78-D80 PolarHBondContact NE-O 2.97Å; R78-K82 PolarHBondContact NH2-O 3.25Å; R78-V84 VanDerWaalsContact CZ-CG2 3.5Å
79	Q	60	Low	65.3	Low	156 Å²	156	80 Å²	80	73%	0.729	43%	0.431	S	S	*	.			trans	-75.4	-25.7	175.5	-71.4	-178.2	-5.1	0	0	113.3	V187	Q79-V187 PolarHBondContact N-O 3.46Å
80	D	61.3	Low	65.2	Low	69 Å²	69	80.6 Å²	80.6	37%	0.369	44%	0.435	S	S	.	.			trans	-90.6	116.5	179.7	-166.2	-6.7	0	0	0	112.2	R78 K82	R78-D80 WeakPolarHBondContact CD-O 3.48Å; R78-D80 WeakPolarHBondContact CG-O 3.24Å; R78-D80 PolarHBondContact NE-O 2.97Å; D80-K82 VanDerWaalsContact C-N 3.34Å; D80-K82 WeakPolarHBondContact OD1-CB 3.44Å; D80-K82 WeakPolarHBondContact OD1-CG 3.39Å; D80-K82 PolarHBondContact OD1-N 2.88Å
81	T	54.6	Low	65.4	Low	142 Å²	142	87 Å²	87	87%	0.871	46%	0.459	S	S	*	.			trans	-84	-1.5	179.1	34	0	0	0	0	114.1
82	K	59.7	Low	65.9	Low	147 Å²	147	88.3 Å²	88.3	64%	0.639	47%	0.468	S	S	*	.	S	Bend	trans	-71.7	138.6	-178.7	-69.9	178.9	-178	177.9	0	112.3	R78 D80 V84	R78-K82 PolarHBondContact NH2-O 3.25Å; D80-K82 VanDerWaalsContact C-N 3.34Å; D80-K82 WeakPolarHBondContact OD1-CB 3.44Å; D80-K82 WeakPolarHBondContact OD1-CG 3.39Å; D80-K82 PolarHBondContact OD1-N 2.88Å; K82-V84 PolarHBondContact O-N 3.11Å
83	P	56.1	Low	66.5	Low	124 Å²	124	83.9 Å²	83.9	81%	0.805	45%	0.449	S	S	*	.			trans	-58.3	131.1	172.9	23.3	-30.7	0	0	0	109.9	D85	P83-D85 PolarHBondContact O-N 3.44Å
84	V	59.7	Low	67.3	Low	43 Å²	43	83.7 Å²	83.7	26%	0.261	45%	0.45	S	S	.	.			trans	-72.7	112.9	178.1	-172.9	0	0	0	0	107.6	R78 K82 S86 I89	R78-V84 VanDerWaalsContact CZ-CG2 3.5Å; K82-V84 PolarHBondContact O-N 3.11Å; V84-S86 PolarHBondContact O-N 3.36Å; V84-I89 HydrophobicContact CG1-CD1 3.65Å; V84-I89 HydrophobicContact CG1-CG1 3.48Å; V84-I89 VanDerWaalsContact CG1-CG1 3.48Å
85	D	60.1	Low	67.7	Low	91 Å²	91	83.4 Å²	83.4	49%	0.487	45%	0.449	S	S	.	.			trans	-73.1	121.7	168.9	-170.6	-9.7	0	0	0	108.6	P83 S87 T88	P83-D85 PolarHBondContact O-N 3.44Å; D85-S87 PolarHBondContact O-N 2.67Å; D85-S87 PolarHBondContact OD1-N 2.79Å; D85-S87 PolarHBondContact OD1-OG 3.14Å; D85-S87 PolarHBondContact OD2-OG 3.42Å; D85-T88 HydrophobicContact CB-CG2 4.35Å; D85-T88 PolarHBondContact O-N 3.19Å; D85-T88 PolarHBondContact O-OG1 2.73Å
86	S	60	Low	68	Low	77 Å²	77	75.9 Å²	75.9	54%	0.538	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-51.8	-26.3	178.4	56.8	0	0	0	0	114	V84 T88	V84-S86 PolarHBondContact O-N 3.36Å; S86-T88 VanDerWaalsContact C-N 3.28Å; S86-T88 PolarHBondContact O-N 3.49Å
87	S	61.6	Low	67.9	Low	94 Å²	94	69.7 Å²	69.7	66%	0.657	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-73.1	-18.4	178.2	66.8	0	0	0	0	113.8	D85	D85-S87 PolarHBondContact O-N 2.67Å; D85-S87 PolarHBondContact OD1-N 2.79Å; D85-S87 PolarHBondContact OD1-OG 3.14Å; D85-S87 PolarHBondContact OD2-OG 3.42Å
88	T	66.1	Low	68	Low	87 Å²	87	69.5 Å²	69.5	53%	0.534	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-99.7	-5.2	-176.7	60.8	0	0	0	0	114.3	D85 S86 P90	D85-T88 HydrophobicContact CB-CG2 4.35Å; D85-T88 PolarHBondContact O-N 3.19Å; D85-T88 PolarHBondContact O-OG1 2.73Å; S86-T88 VanDerWaalsContact C-N 3.28Å; S86-T88 PolarHBondContact O-N 3.49Å; T88-P90 WeakPolarHBondContact O-CD 3.19Å
89	I	69.8	Low	68	Low	45 Å²	45	68.3 Å²	68.3	23%	0.231	38%	0.381	C	S	.	.	S	Bend	trans	-73.1	120.5	179.7	-62.3	177.4	0	0	0	108.9	V84 K91	V84-I89 HydrophobicContact CG1-CD1 3.65Å; V84-I89 HydrophobicContact CG1-CG1 3.48Å; V84-I89 VanDerWaalsContact CG1-CG1 3.48Å; I89-K91 PolarHBondContact O-N 3.35Å
90	P	75.6	Confident	68.2	Low	22 Å²	22	61.8 Å²	61.8	14%	0.143	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-58.6	139.3	174.5	-23.1	34.7	0	0	0	110.8	T88 S92 I117	T88-P90 WeakPolarHBondContact O-CD 3.19Å; P90-S92 PolarHBondContact O-N 3.41Å; P90-I117 HydrophobicContact CB-CD1 3.92Å; P90-I117 HydrophobicContact CB-CG1 4.16Å; P90-I117 HydrophobicContact CB-CG2 3.95Å; P90-I117 HydrophobicContact CG-CD1 3.99Å
91	K	80.1	Confident	68.6	Low	173 Å²	173	58.6 Å²	58.6	75%	0.752	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-62.3	122.1	177	-169.2	178	-179.8	-177.6	0	109.9	I89	I89-K91 PolarHBondContact O-N 3.35Å
92	S	83.9	Confident	69.3	Low	35 Å²	35	52.9 Å²	52.9	25%	0.245	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	153.4	170.7	48.9	0	0	0	0	111.4	P90 E115 A116	P90-S92 PolarHBondContact O-N 3.41Å; S92-E115 WeakPolarHBondContact CB-OE1 3.21Å; S92-E115 WeakPolarHBondContact OG-CG 3.35Å; S92-E115 PolarHBondContact OG-OE1 3.12Å; S92-A116 WeakPolarHBondContact CA-O 3.45Å
93	D	84.4	Confident	69.5	Low	45 Å²	45	48.9 Å²	48.9	24%	0.241	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	167.7	170	-157	-4.5	0	0	0	110	A116 A118 H119 R136	D93-A116 PolarHBondContact N-O 2.76Å; D93-A116 PolarHBondContact O-N 2.93Å; D93-A116 VanDerWaalsContact O-O 3.1Å; D93-A118 HydrophobicContact CB-CB 4.28Å; D93-H119 IonicContact OD2-CE1 3.31Å; D93-H119 PolarHBondContact OD2-CE1 3.48Å; D93-R136 IonicContact OD2-CZ 2.96Å; D93-R136 IonicContact OD2-NE 2.87Å; D93-R136 PolarHBondContact OD2-NE 2.83Å; D93-R136 IonicContact OD2-NH2 3.42Å; D93-R136 PolarHBondContact OD2-NH2 3.38Å
94	C	83.6	Confident	69.8	Low	26 Å²	26	46.2 Å²	46.2	18%	0.176	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.4	-179.4	-75.3	0	0	0	0	111.5	W113 C255 K258	C94-W113 HydrophobicContact CB-CE3 3.95Å; C94-W113 WeakPolarHBondContact O-CZ3 3.39Å; C94-C255 WeakPolarHBondContact CA-SG 3.24Å; C94-C255 HydrophobicContact CB-CB 4.19Å; C94-C255 WeakPolarHBondContact CB-SG 3.38Å; C94-C255 WeakPolarHBondContact SG-CB 3.42Å; C94-C255 CovalentContact SG-SG 2.02Å; C94-C255 PolarHBondContact SG-SG 2.92Å; C94-K258 HydrophobicContact CB-CD 4.29Å
95	V	81	Confident	69.5	Low	2 Å²	2	49.4 Å²	49.4	1%	0.012	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	146.2	179.2	-173.8	0	0	0	0	110.2	W113 F114 A116 A118 A193	V95-W113 WeakPolarHBondContact O-CA 3.34Å; V95-F114 HydrophobicContact CB-CE1 4.25Å; V95-F114 HydrophobicContact CB-CZ 4.35Å; V95-F114 HydrophobicContact CG1-CE1 4.37Å; V95-F114 HydrophobicContact CG1-CZ 4.47Å; V95-F114 PolarHBondContact N-O 3.43Å; V95-F114 VanDerWaalsContact O-CD1 3.31Å; V95-F114 WeakPolarHBondContact O-CD1 3.48Å; V95-F114 PolarHBondContact O-N 3.09Å; V95-A116 HydrophobicContact CG2-CB 4.21Å; V95-A118 HydrophobicContact CG2-CB 4.15Å; V95-A193 HydrophobicContact CG2-CB 3.87Å
96	H	73.3	Confident	69.1	Low	20 Å²	20	50.9 Å²	50.9	9%	0.093	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	128.1	174.1	-81.2	-98	0	0	0	111.4	A98 R99 W113	H96-A98 PolarHBondContact ND1-O 3.41Å; H96-R99 HydrophobicContact CB-CG 3.68Å; H96-W113 AromaticContact CD2-CE3 3.93Å; H96-W113 AromaticContact CD2-CH2 3.16Å; H96-W113 WeakPolarHBondContact CD2-CH2 3.17Å; H96-W113 AromaticContact CD2-CZ2 3.61Å; H96-W113 AromaticContact CD2-CZ3 3.32Å; H96-W113 WeakPolarHBondContact CD2-CZ3 3.41Å; H96-W113 AromaticContact CE1-CE2 3.67Å; H96-W113 AromaticContact CE1-CH2 3.73Å; H96-W113 AromaticContact CE1-CZ2 3.32Å; H96-W113 WeakPolarHBondContact CE1-CZ2 3.48Å; H96-W113 AromaticContact NE2-CE2 3.68Å; H96-W113 AromaticContact NE2-CH2 2.87Å; H96-W113 WeakPolarHBondContact NE2-CH2 3.38Å; H96-W113 AromaticContact NE2-CZ2 2.95Å; H96-W113 WeakPolarHBondContact NE2-CZ2 3.4Å; H96-W113 AromaticContact NE2-CZ3 3.6Å
97	S	66.3	Low	68.7	Low	5 Å²	5	50.4 Å²	50.4	4%	0.035	29%	0.286	C	S	.	.	S	Bend	trans	-77	-29.5	169.9	77.2	0	0	0	0	112.6	S112 N244 S245	S97-S112 WeakPolarHBondContact CB-O 3.36Å; S97-S112 PolarHBondContact N-O 3.33Å; S97-S112 PolarHBondContact OG-O 3.26Å; S97-S112 VanDerWaalsContact OG-O 3.08Å; S97-S112 PolarHBondContact OG-OG 3.35Å; S97-N244 PolarHBondContact O-OD1 3.47Å; S97-N244 VanDerWaalsContact O-OD1 3.11Å; S97-S245 PolarHBondContact O-N 3.03Å; S97-S245 VanDerWaalsContact O-N 3.14Å; S97-S245 PolarHBondContact O-OG 3Å
98	A	64.3	Low	68.2	Low	14 Å²	14	48.8 Å²	48.8	12%	0.116	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137	176.2	0	0	0	0	0	109.4	H96 A243 N244	H96-A98 PolarHBondContact ND1-O 3.41Å; A98-A243 CarbonylContact C-O 3.48Å; A98-A243 WeakPolarHBondContact CA-O 3.38Å; A98-N244 HydrophobicContact CB-CB 4.28Å
99	R	66.3	Low	67.7	Low	18 Å²	18	52.4 Å²	52.4	7%	0.068	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	128.2	178.3	-68	-175.6	-167	153.8	24.1	110	H96 S135 M180 V242 A243	H96-R99 HydrophobicContact CB-CG 3.68Å; R99-S135 VanDerWaalsContact CZ-O 3.27Å; R99-S135 PolarHBondContact NH2-O 3.26Å; R99-M180 HydrophobicContact CB-CE 4.02Å; R99-M180 HydrophobicContact CB-SD 4.17Å; R99-M180 HydrophobicContact CG-CE 4.36Å; R99-M180 HydrophobicContact CG-SD 4.42Å; R99-V242 CarbonylContact O-C 3.49Å; R99-V242 WeakPolarHBondContact O-CA 3.29Å; R99-A243 PolarHBondContact N-O 3.28Å; R99-A243 PolarHBondContact O-N 3.31Å
100	T	64.3	Low	66.9	Low	18 Å²	18	54.1 Å²	54.1	11%	0.11	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	122.4	171.9	41.1	0	0	0	0	107.9	L107 E108 H110 C241 V242	T100-L107 PolarHBondContact OG1-O 3.33Å; T100-E108 WeakPolarHBondContact O-CA 3.38Å; T100-E108 WeakPolarHBondContact O-CG 3.37Å; T100-H110 HydrophobicContact CG2-CB 4.4Å; T100-C241 CarbonylContact C-O 3.02Å; T100-C241 VanDerWaalsContact CA-O 3.29Å; T100-C241 WeakPolarHBondContact CA-O 3.32Å; T100-V242 HydrophobicContact CG2-CG1 4.25Å; T100-V242 HydrophobicContact CG2-CG2 4.02Å
101	F	70	Confident	66	Low	3 Å²	3	54.5 Å²	54.5	1%	0.013	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	135.9	175.1	53.7	-75.7	0	0	0	108.7	I140 F142 I172 V229 C241 A243	F101-I140 HydrophobicContact CB-CB 4.39Å; F101-I140 HydrophobicContact CD1-CD1 3.77Å; F101-I140 HydrophobicContact CD2-CB 3.82Å; F101-I140 HydrophobicContact CD2-CD1 4.09Å; F101-I140 HydrophobicContact CD2-CG2 3.98Å; F101-I140 HydrophobicContact CE1-CD1 3.63Å; F101-I140 HydrophobicContact CE2-CB 4.2Å; F101-I140 HydrophobicContact CE2-CD1 3.91Å; F101-I140 HydrophobicContact CE2-CG2 3.96Å; F101-I140 HydrophobicContact CG-CB 4.08Å; F101-I140 HydrophobicContact CG-CD1 4.02Å; F101-I140 HydrophobicContact CZ-CD1 3.7Å; F101-F142 HydrophobicContact CD2-CD1 4.33Å; F101-F142 AromaticContact CD2-CE1 3.46Å; F101-F142 HydrophobicContact CD2-CE1 3.46Å; F101-F142 VanDerWaalsContact CD2-CE1 3.46Å; F101-F142 HydrophobicContact CD2-CE2 4.25Å; F101-F142 AromaticContact CD2-CZ 3.4Å; F101-F142 HydrophobicContact CD2-CZ 3.4Å; F101-F142 VanDerWaalsContact CD2-CZ 3.4Å; F101-F142 HydrophobicContact CE2-CD1 4.17Å; F101-F142 AromaticContact CE2-CE1 3.31Å; F101-F142 HydrophobicContact CE2-CE1 3.31Å; F101-F142 AromaticContact CE2-CZ 3.73Å; F101-F142 HydrophobicContact CE2-CZ 3.73Å; F101-F142 HydrophobicContact CG-CZ 4.45Å; F101-I172 HydrophobicContact CE2-CD1 3.63Å; F101-I172 HydrophobicContact CE2-CG1 4.41Å; F101-I172 HydrophobicContact CZ-CD1 3.61Å; F101-V229 HydrophobicContact CE1-CG1 4.46Å; F101-V229 HydrophobicContact CZ-CG1 3.96Å; F101-C241 HydrophobicContact CD1-CB 3.97Å; F101-C241 HydrophobicContact CD2-CB 3.76Å; F101-C241 HydrophobicContact CE1-CB 3.53Å; F101-C241 HydrophobicContact CE2-CB 3.33Å; F101-C241 HydrophobicContact CG-CB 4.07Å; F101-C241 HydrophobicContact CZ-CB 3.18Å; F101-C241 PolarHBondContact N-O 3.04Å; F101-C241 PolarHBondContact O-N 3.25Å; F101-A243 HydrophobicContact CE1-CB 3.93Å
102	S	68.7	Low	65.2	Low	21 Å²	21	48 Å²	48	15%	0.147	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	165.7	-179.6	52	0	0	0	0	110.4	V104 R239	S102-V104 PolarHBondContact O-N 3.02Å; S102-V104 VanDerWaalsContact O-N 3.09Å; S102-V104 PolarHBondContact OG-O 3.04Å; S102-R239 WeakPolarHBondContact CA-O 3.48Å; S102-R239 WeakPolarHBondContact CB-O 3.43Å
103	D	64.2	Low	64.8	Low	64 Å²	64	49.1 Å²	49.1	34%	0.342	27%	0.266	S	S	.	.	S	Bend	trans	-57.2	-23.9	173.2	-66.6	-56.5	0	0	0	112.1	F142 R239	D103-F142 VanDerWaalsContact OD1-CD2 3.3Å; D103-F142 WeakPolarHBondContact OD1-CD2 3.41Å; D103-R239 PolarHBondContact N-O 2.91Å; D103-R239 IonicContact OD1-CZ 3.85Å; D103-R239 IonicContact OD1-NE 3.66Å; D103-R239 PolarHBondContact OD1-NE 3.27Å; D103-R239 IonicContact OD1-NH2 2.79Å; D103-R239 PolarHBondContact OD1-NH2 3.4Å; D103-R239 WeakPolarHBondContact OD2-CB 3.24Å; D103-R239 IonicContact OD2-CZ 3.24Å; D103-R239 PolarHBondContact OD2-N 2.92Å; D103-R239 IonicContact OD2-NE 3.23Å; D103-R239 PolarHBondContact OD2-NE 3.48Å; D103-R239 IonicContact OD2-NH2 3.55Å
104	V	61.6	Low	64.6	Low	67 Å²	67	47.2 Å²	47.2	41%	0.406	26%	0.256	S	S	.	.	S	Bend	trans	-95.8	126.9	173.5	-166.2	0	0	0	0	109.9	S102 D106	S102-V104 PolarHBondContact O-N 3.02Å; S102-V104 VanDerWaalsContact O-N 3.09Å; S102-V104 PolarHBondContact OG-O 3.04Å; V104-D106 HydrophobicContact CG1-CB 4.39Å; V104-D106 PolarHBondContact O-N 3.27Å
105	T	55.1	Low	64.7	Low	111 Å²	111	48.1 Å²	48.1	68%	0.681	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-62.5	-10.4	-176.9	48.4	0	0	0	0	115
106	D	51.1	Low	65.1	Low	122 Å²	122	48.2 Å²	48.2	65%	0.652	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-93.3	-4.8	-166.2	-79.2	-25	0	0	0	115.5	V104	V104-D106 HydrophobicContact CG1-CB 4.39Å; V104-D106 PolarHBondContact O-N 3.27Å
107	L	51.8	Low	65.9	Low	66 Å²	66	47.5 Å²	47.5	35%	0.346	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-93.6	-3.2	-178.4	-83.3	91.4	0	0	0	115.2	T100 K109 L240	T100-L107 PolarHBondContact OG1-O 3.33Å; L107-K109 PolarHBondContact O-N 2.66Å; L107-L240 HydrophobicContact CD2-CD1 3.95Å
108	E	51.6	Low	66.9	Low	60 Å²	60	47.3 Å²	47.3	28%	0.28	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	0.1	-174.7	-73.5	-173.6	162.8	0	0	115.4	T100 H110	T100-E108 WeakPolarHBondContact O-CA 3.38Å; T100-E108 WeakPolarHBondContact O-CG 3.37Å; E108-H110 PolarHBondContact O-N 3.19Å
109	K	54.3	Low	68	Low	164 Å²	164	49.8 Å²	49.8	71%	0.713	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	9.1	-170.9	-66.6	179.2	-176.8	165.5	0	115.4	L107	L107-K109 PolarHBondContact O-N 2.66Å
110	H	53.7	Low	69	Low	80 Å²	80	50.5 Å²	50.5	37%	0.37	27%	0.27	S	S	.	.			trans	-111.3	118.2	-176.3	-61.7	-52.8	0	0	0	112.3	T100 E108	T100-H110 HydrophobicContact CG2-CB 4.4Å; E108-H110 PolarHBondContact O-N 3.19Å
111	G	57.3	Low	70.1	Confident	30 Å²	30	52.7 Å²	52.7	31%	0.309	29%	0.285	S	S	.	.	S	Bend	trans	168.8	160.2	175.8	0	0	0	0	0	112.9
112	S	63.3	Low	70.8	Confident	38 Å²	38	61.4 Å²	61.4	27%	0.266	33%	0.33	S	S	.	.			trans	-76.7	137.7	167.6	35.9	0	0	0	0	110.3	S97	S97-S112 WeakPolarHBondContact CB-O 3.36Å; S97-S112 PolarHBondContact N-O 3.33Å; S97-S112 PolarHBondContact OG-O 3.26Å; S97-S112 VanDerWaalsContact OG-O 3.08Å; S97-S112 PolarHBondContact OG-OG 3.35Å
113	W	74.1	Confident	71.4	Confident	58 Å²	58	64.5 Å²	64.5	22%	0.22	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	139.7	177.3	-63.6	81.3	0	0	0	109.8	C94 V95 H96 C255 K258	C94-W113 HydrophobicContact CB-CE3 3.95Å; C94-W113 WeakPolarHBondContact O-CZ3 3.39Å; V95-W113 WeakPolarHBondContact O-CA 3.34Å; H96-W113 AromaticContact CD2-CE3 3.93Å; H96-W113 AromaticContact CD2-CH2 3.16Å; H96-W113 WeakPolarHBondContact CD2-CH2 3.17Å; H96-W113 AromaticContact CD2-CZ2 3.61Å; H96-W113 AromaticContact CD2-CZ3 3.32Å; H96-W113 WeakPolarHBondContact CD2-CZ3 3.41Å; H96-W113 AromaticContact CE1-CE2 3.67Å; H96-W113 AromaticContact CE1-CH2 3.73Å; H96-W113 AromaticContact CE1-CZ2 3.32Å; H96-W113 WeakPolarHBondContact CE1-CZ2 3.48Å; H96-W113 AromaticContact NE2-CE2 3.68Å; H96-W113 AromaticContact NE2-CH2 2.87Å; H96-W113 WeakPolarHBondContact NE2-CH2 3.38Å; H96-W113 AromaticContact NE2-CZ2 2.95Å; H96-W113 WeakPolarHBondContact NE2-CZ2 3.4Å; H96-W113 AromaticContact NE2-CZ3 3.6Å; W113-C255 HydrophobicContact CB-CB 4.25Å; W113-K258 HydrophobicContact CD2-CD 3.63Å; W113-K258 HydrophobicContact CE3-CD 3.92Å; W113-K258 HydrophobicContact CG-CD 4.01Å; W113-K258 HydrophobicContact CH2-CD 4.32Å; W113-K258 HydrophobicContact CZ2-CD 4.06Å; W113-K258 HydrophobicContact CZ3-CD 4.28Å
114	F	81.1	Confident	72.3	Confident	4 Å²	4	63 Å²	63	2%	0.018	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	156.7	172.7	71.9	-76.3	0	0	0	110.6	V95 A116 P182 V191 L247 R252 R253	V95-F114 HydrophobicContact CB-CE1 4.25Å; V95-F114 HydrophobicContact CB-CZ 4.35Å; V95-F114 HydrophobicContact CG1-CE1 4.37Å; V95-F114 HydrophobicContact CG1-CZ 4.47Å; V95-F114 PolarHBondContact N-O 3.43Å; V95-F114 VanDerWaalsContact O-CD1 3.31Å; V95-F114 WeakPolarHBondContact O-CD1 3.48Å; V95-F114 PolarHBondContact O-N 3.09Å; F114-A116 HydrophobicContact CD2-CB 4.17Å; F114-A116 HydrophobicContact CE2-CB 3.7Å; F114-A116 HydrophobicContact CZ-CB 4.44Å; F114-P182 HydrophobicContact CE2-CB 4.24Å; F114-P182 HydrophobicContact CZ-CB 3.98Å; F114-P182 HydrophobicContact CZ-CG 4.18Å; F114-V191 HydrophobicContact CE2-CG1 4.02Å; F114-L247 HydrophobicContact CD2-CD2 3.75Å; F114-L247 HydrophobicContact CE2-CD2 3.53Å; F114-L247 HydrophobicContact CZ-CD2 4.18Å; F114-R252 HydrophobicContact CB-CB 4.34Å; F114-R252 HydrophobicContact CB-CG 4.25Å; F114-R252 HydrophobicContact CG-CG 4.37Å; F114-R253 CarbonylContact C-O 3.44Å; F114-R253 VanDerWaalsContact CA-O 3.27Å; F114-R253 WeakPolarHBondContact CA-O 3.36Å
115	E	86.1	Confident	73.5	Confident	46 Å²	46	63 Å²	63	22%	0.215	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	126.1	179.7	-171.8	171	-166.2	0	0	110.2	S92 R253	S92-E115 WeakPolarHBondContact CB-OE1 3.21Å; S92-E115 WeakPolarHBondContact OG-CG 3.35Å; S92-E115 PolarHBondContact OG-OE1 3.12Å; E115-R253 HydrophobicContact CB-CB 4.26Å; E115-R253 PolarHBondContact N-O 2.9Å; E115-R253 WeakPolarHBondContact OE2-CD 3.12Å
116	A	88.8	Confident	75	Confident	3 Å²	3	64 Å²	64	3%	0.025	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	157.8	177.7	0	0	0	0	0	111.6	S92 D93 V95 F114 A118 V191 A193	S92-A116 WeakPolarHBondContact CA-O 3.45Å; D93-A116 PolarHBondContact N-O 2.76Å; D93-A116 PolarHBondContact O-N 2.93Å; D93-A116 VanDerWaalsContact O-O 3.1Å; V95-A116 HydrophobicContact CG2-CB 4.21Å; F114-A116 HydrophobicContact CD2-CB 4.17Å; F114-A116 HydrophobicContact CE2-CB 3.7Å; F114-A116 HydrophobicContact CZ-CB 4.44Å; A116-A118 PolarHBondContact O-N 2.84Å; A116-V191 HydrophobicContact CB-CG1 4.12Å; A116-A193 HydrophobicContact CB-CB 4.27Å
117	I	89.4	Confident	76.6	Confident	6 Å²	6	63.6 Å²	63.6	3%	0.031	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	113.9	175.4	-59.8	167.9	0	0	0	108.9	P90 R190 V191 Y192 A193 H201	P90-I117 HydrophobicContact CB-CD1 3.92Å; P90-I117 HydrophobicContact CB-CG1 4.16Å; P90-I117 HydrophobicContact CB-CG2 3.95Å; P90-I117 HydrophobicContact CG-CD1 3.99Å; I117-R190 HydrophobicContact CD1-CB 3.98Å; I117-R190 HydrophobicContact CD1-CG 4.12Å; I117-V191 PolarHBondContact N-O 2.95Å; I117-Y192 HydrophobicContact CB-CD1 3.82Å; I117-Y192 HydrophobicContact CB-CE1 4.19Å; I117-Y192 HydrophobicContact CD1-CD1 4.14Å; I117-Y192 HydrophobicContact CD1-CE1 3.76Å; I117-Y192 HydrophobicContact CG2-CD1 3.98Å; I117-Y192 HydrophobicContact CG2-CE1 4.12Å; I117-A193 WeakPolarHBondContact O-CB 3.27Å; I117-A193 PolarHBondContact O-N 3.02Å; I117-H201 WeakPolarHBondContact CG2-NE2 3.31Å
118	A	87.2	Confident	78	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.353	C	S	.	.			trans	-123.7	10.3	-175.3	0	0	0	0	0	113.6	D93 V95 A116 C132 R136 A193	D93-A118 HydrophobicContact CB-CB 4.28Å; V95-A118 HydrophobicContact CG2-CB 4.15Å; A116-A118 PolarHBondContact O-N 2.84Å; A118-C132 PolarHBondContact O-SG 3.06Å; A118-R136 HydrophobicContact CB-CG 4.14Å; A118-A193 HydrophobicContact CB-CB 3.91Å
119	H	88.4	Confident	79.7	Confident	67 Å²	67	61.3 Å²	61.3	31%	0.31	35%	0.35	S	S	.	.			trans	-128.7	145.3	179.5	-60.4	98.8	0	0	0	110.8	D93 H201	D93-H119 IonicContact OD2-CE1 3.31Å; D93-H119 PolarHBondContact OD2-CE1 3.48Å; H119-H201 PolarHBondContact O-NE2 2.94Å
120	C	87.8	Confident	81.1	Confident	33 Å²	33	58.2 Å²	58.2	22%	0.223	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-97.7	153.9	177.2	-63	0	0	0	0	111.7	T124 A129 C132 C200	C120-T124 HydrophobicContact CB-CG2 4.33Å; C120-A129 HydrophobicContact CB-CB 4.31Å; C120-C132 VanDerWaalsContact SG-CB 3.5Å; C120-C132 VanDerWaalsContact SG-SG 3.62Å; C120-C200 WeakPolarHBondContact CA-SG 3.42Å; C120-C200 HydrophobicContact CB-CB 3.6Å; C120-C200 WeakPolarHBondContact CB-SG 3.45Å; C120-C200 WeakPolarHBondContact SG-CB 3.31Å; C120-C200 CovalentContact SG-SG 2.04Å; C120-C200 PolarHBondContact SG-SG 3.33Å
121	P	87	Confident	82.6	Confident	63 Å²	63	59.6 Å²	59.6	41%	0.409	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-65	157.5	175.4	26.8	-32.9	0	0	0	112.3	G123 T124 C200	P121-G123 PolarHBondContact O-N 3.49Å; P121-T124 PolarHBondContact O-N 2.95Å; P121-T124 PolarHBondContact O-OG1 2.99Å; P121-T124 VanDerWaalsContact O-OG1 3.13Å; P121-C200 WeakPolarHBondContact CD-O 3.4Å; P121-C200 WeakPolarHBondContact CG-O 3.32Å
122	L	84.1	Confident	84	Confident	186 Å²	186	58.1 Å²	58.1	97%	0.974	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	128.4	175.4	-66.9	170.5	0	0	0	109.7
123	G	81.2	Confident	85	Confident	86 Å²	86	59.3 Å²	59.3	89%	0.887	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.6	-8.4	-179.6	0	0	0	0	0	115.2	P121	P121-G123 PolarHBondContact O-N 3.49Å
124	T	84.3	Confident	85.4	Confident	32 Å²	32	61.8 Å²	61.8	20%	0.196	35%	0.345	C	S	.	.	S	Bend	trans	-65.2	146.3	169.8	-51	0	0	0	0	110.9	C120 P121 N126 I128 C200	C120-T124 HydrophobicContact CB-CG2 4.33Å; P121-T124 PolarHBondContact O-N 2.95Å; P121-T124 PolarHBondContact O-OG1 2.99Å; P121-T124 VanDerWaalsContact O-OG1 3.13Å; T124-N126 PolarHBondContact O-N 3.21Å; T124-I128 HydrophobicContact CG2-CB 4.06Å; T124-I128 HydrophobicContact CG2-CG2 4.24Å; T124-C200 HydrophobicContact CG2-CB 3.68Å
125	S	86.9	Confident	85	Confident	68 Å²	68	61.6 Å²	61.6	48%	0.476	34%	0.344	S	S	.	.			trans	-50	133	169.7	172.9	0	0	0	0	111.6	E127 I128 A129	S125-E127 PolarHBondContact O-N 3.01Å; S125-E127 VanDerWaalsContact O-N 3.09Å; S125-E127 PolarHBondContact OG-N 3.32Å; S125-I128 PolarHBondContact O-N 3.25Å; S125-I128 VanDerWaalsContact O-N 3.17Å; S125-A129 PolarHBondContact O-N 3.1Å
126	N	85.9	Confident	84.4	Confident	131 Å²	131	63 Å²	63	70%	0.701	35%	0.347	S	S	*	.	H	α-helix	trans	-53.9	-31.6	178.4	-73.6	-19.5	0	0	0	112.4	T124 N130	T124-N126 PolarHBondContact O-N 3.21Å; N126-N130 VanDerWaalsContact O-CB 3.26Å; N126-N130 WeakPolarHBondContact O-CB 3.18Å; N126-N130 PolarHBondContact O-N 2.94Å; N126-N130 PolarHBondContact O-ND2 3.46Å
127	E	83.7	Confident	83.4	Confident	114 Å²	114	69 Å²	69	53%	0.533	38%	0.379	S	S	.	.	H	α-helix	trans	-66.2	-48.9	-179.8	-170.1	177.6	-179.5	0	0	112.1	S125 N130 R131	S125-E127 PolarHBondContact O-N 3.01Å; S125-E127 VanDerWaalsContact O-N 3.09Å; S125-E127 PolarHBondContact OG-N 3.32Å; E127-N130 PolarHBondContact O-N 2.94Å; E127-R131 WeakPolarHBondContact O-CG 3.36Å; E127-R131 PolarHBondContact O-N 2.85Å; E127-R131 VanDerWaalsContact O-N 3.12Å; E127-R131 IonicContact OE1-CZ 3.11Å; E127-R131 IonicContact OE1-NE 3.26Å; E127-R131 IonicContact OE1-NH2 3.34Å; E127-R131 PolarHBondContact OE1-NH2 3.28Å
128	I	82.9	Confident	82.3	Confident	51 Å²	51	69.4 Å²	69.4	26%	0.262	38%	0.381	S	S	.	.	H	α-helix	trans	-68.2	-42	179	-57.4	174.5	0	0	0	109.9	T124 S125 N130 R131 C132 D196 I199 C200	T124-I128 HydrophobicContact CG2-CB 4.06Å; T124-I128 HydrophobicContact CG2-CG2 4.24Å; S125-I128 PolarHBondContact O-N 3.25Å; S125-I128 VanDerWaalsContact O-N 3.17Å; I128-N130 VanDerWaalsContact C-N 3.31Å; I128-N130 PolarHBondContact O-N 2.9Å; I128-R131 PolarHBondContact O-N 3.31Å; I128-C132 PolarHBondContact O-N 2.95Å; I128-D196 HydrophobicContact CG2-CB 4.45Å; I128-I199 HydrophobicContact CD1-CG2 4.42Å; I128-I199 HydrophobicContact CG2-CG2 4.46Å; I128-C200 HydrophobicContact CG2-CB 3.88Å
129	A	85.7	Confident	81.3	Confident	27 Å²	27	73 Å²	73	22%	0.223	40%	0.403	C	S	.	.	H	α-helix	trans	-59.8	-41.2	177.3	0	0	0	0	0	112.1	C120 S125 N133	C120-A129 HydrophobicContact CB-CB 4.31Å; S125-A129 PolarHBondContact O-N 3.1Å; A129-N133 WeakPolarHBondContact O-CB 3.42Å; A129-N133 PolarHBondContact O-N 3.39Å
130	N	85.3	Confident	80.4	Confident	100 Å²	100	70.2 Å²	70.2	54%	0.535	39%	0.39	S	S	.	.	H	α-helix	trans	-65.9	-41.5	175.9	-75.5	-20.4	0	0	0	112.1	N126 E127 I128 N133 K134	N126-N130 VanDerWaalsContact O-CB 3.26Å; N126-N130 WeakPolarHBondContact O-CB 3.18Å; N126-N130 PolarHBondContact O-N 2.94Å; N126-N130 PolarHBondContact O-ND2 3.46Å; E127-N130 PolarHBondContact O-N 2.94Å; I128-N130 VanDerWaalsContact C-N 3.31Å; I128-N130 PolarHBondContact O-N 2.9Å; N130-N133 PolarHBondContact O-N 3.41Å; N130-K134 WeakPolarHBondContact O-CG 3.27Å; N130-K134 PolarHBondContact O-N 3.01Å
131	R	83.8	Confident	79.4	Confident	108 Å²	108	73 Å²	73	41%	0.408	40%	0.403	S	S	.	.	H	α-helix	trans	-65.8	-41.6	176.7	-67.9	177.7	-171	-163	2.9	112.1	E127 I128 K134 L179 N194 D196	E127-R131 WeakPolarHBondContact O-CG 3.36Å; E127-R131 PolarHBondContact O-N 2.85Å; E127-R131 VanDerWaalsContact O-N 3.12Å; E127-R131 IonicContact OE1-CZ 3.11Å; E127-R131 IonicContact OE1-NE 3.26Å; E127-R131 IonicContact OE1-NH2 3.34Å; E127-R131 PolarHBondContact OE1-NH2 3.28Å; I128-R131 PolarHBondContact O-N 3.31Å; R131-K134 PolarHBondContact O-N 3.38Å; R131-L179 HydrophobicContact CB-CD2 4.25Å; R131-L179 VanDerWaalsContact O-CD2 3.27Å; R131-L179 WeakPolarHBondContact O-CD2 3.31Å; R131-N194 PolarHBondContact O-ND2 3.48Å; R131-N194 VanDerWaalsContact O-ND2 3.1Å; R131-D196 HydrophobicContact CB-CB 3.95Å
132	C	86.4	Confident	78.6	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-60.2	-48.1	173.8	172.1	0	0	0	0	111.9	A118 C120 I128 K134 S135 D196 C197	A118-C132 PolarHBondContact O-SG 3.06Å; C120-C132 VanDerWaalsContact SG-CB 3.5Å; C120-C132 VanDerWaalsContact SG-SG 3.62Å; I128-C132 PolarHBondContact O-N 2.95Å; C132-K134 VanDerWaalsContact C-N 3.33Å; C132-K134 PolarHBondContact O-N 2.76Å; C132-S135 WeakPolarHBondContact O-CB 3.2Å; C132-S135 PolarHBondContact O-N 2.92Å; C132-S135 PolarHBondContact O-OG 3Å; C132-D196 HydrophobicContact CB-CB 4.42Å; C132-C197 WeakPolarHBondContact CA-SG 3.34Å; C132-C197 HydrophobicContact CB-CB 4.02Å; C132-C197 WeakPolarHBondContact CB-SG 3.41Å; C132-C197 PolarHBondContact O-SG 3.03Å; C132-C197 WeakPolarHBondContact SG-CA 3.47Å; C132-C197 WeakPolarHBondContact SG-CB 3.44Å; C132-C197 CovalentContact SG-SG 2.04Å; C132-C197 PolarHBondContact SG-SG 3.05Å
133	N	85.4	Confident	77.7	Confident	62 Å²	62	65 Å²	65	33%	0.332	36%	0.356	S	S	.	.	H	α-helix	trans	-69	-27.5	-176.8	-167.9	21.5	0	0	0	113.3	A129 N130 S135 R136	A129-N133 WeakPolarHBondContact O-CB 3.42Å; A129-N133 PolarHBondContact O-N 3.39Å; N130-N133 PolarHBondContact O-N 3.41Å; N133-S135 PolarHBondContact O-N 3.39Å; N133-R136 PolarHBondContact O-N 3.39Å; N133-R136 WeakPolarHBondContact OD1-CD 3.28Å; N133-R136 PolarHBondContact OD1-NH1 3.25Å
134	K	81.6	Confident	76.9	Confident	111 Å²	111	65.3 Å²	65.3	48%	0.483	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-18.8	175.9	-86.5	-177.9	179.4	-171.5	0	113.8	N130 R131 C132 R136 L138 L179	N130-K134 WeakPolarHBondContact O-CG 3.27Å; N130-K134 PolarHBondContact O-N 3.01Å; R131-K134 PolarHBondContact O-N 3.38Å; C132-K134 VanDerWaalsContact C-N 3.33Å; C132-K134 PolarHBondContact O-N 2.76Å; K134-R136 PolarHBondContact O-N 3.09Å; K134-R136 VanDerWaalsContact O-N 3.11Å; K134-L138 WeakPolarHBondContact O-CB 3.36Å; K134-L138 PolarHBondContact O-N 2.95Å; K134-L179 HydrophobicContact CB-CD1 4.15Å; K134-L179 HydrophobicContact CD-CD1 4.03Å
135	S	73.9	Confident	75.6	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-12.8	173.1	62.5	0	0	0	0	113.9	R99 C132 N133 A193	R99-S135 VanDerWaalsContact CZ-O 3.27Å; R99-S135 PolarHBondContact NH2-O 3.26Å; C132-S135 WeakPolarHBondContact O-CB 3.2Å; C132-S135 PolarHBondContact O-N 2.92Å; C132-S135 PolarHBondContact O-OG 3Å; N133-S135 PolarHBondContact O-N 3.39Å; S135-A193 WeakPolarHBondContact OG-CB 3.14Å
136	R	72.7	Confident	73.8	Confident	75 Å²	75	66.4 Å²	66.4	28%	0.283	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-45.8	-179.1	-66.6	163.2	67.4	-116.5	-7.8	112.5	D93 A118 N133 K134	D93-R136 IonicContact OD2-CZ 2.96Å; D93-R136 IonicContact OD2-NE 2.87Å; D93-R136 PolarHBondContact OD2-NE 2.83Å; D93-R136 IonicContact OD2-NH2 3.42Å; D93-R136 PolarHBondContact OD2-NH2 3.38Å; A118-R136 HydrophobicContact CB-CG 4.14Å; N133-R136 PolarHBondContact O-N 3.39Å; N133-R136 WeakPolarHBondContact OD1-CD 3.28Å; N133-R136 PolarHBondContact OD1-NH1 3.25Å; K134-R136 PolarHBondContact O-N 3.09Å; K134-R136 VanDerWaalsContact O-N 3.11Å
137	D	67.2	Low	71.9	Confident	130 Å²	130	68.5 Å²	68.5	70%	0.695	36%	0.359	S	S	*	.	S	Bend	trans	-125.9	49.1	-171.7	-56	-45.8	0	0	0	110.8	V139	D137-V139 PolarHBondContact O-N 3.32Å
138	L	66.8	Low	69.9	Low	14 Å²	14	71.8 Å²	71.8	7%	0.073	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-79.2	117.4	-178.9	-170.3	64.5	0	0	0	110.7	K134 I140 D176 L179 M180	K134-L138 WeakPolarHBondContact O-CB 3.36Å; K134-L138 PolarHBondContact O-N 2.95Å; L138-I140 HydrophobicContact CD2-CG1 4.38Å; L138-I140 HydrophobicContact CG-CG1 4.47Å; L138-D176 WeakPolarHBondContact CD2-O 3.43Å; L138-L179 HydrophobicContact CD1-CB 4.5Å; L138-L179 HydrophobicContact CD1-CD1 3.8Å; L138-L179 HydrophobicContact CD2-CB 3.91Å; L138-M180 HydrophobicContact CD2-CE 3.47Å; L138-M180 VanDerWaalsContact CD2-CE 3.47Å; L138-M180 HydrophobicContact CD2-CG 3.7Å; L138-M180 HydrophobicContact CD2-SD 4.46Å; L138-M180 HydrophobicContact CG-CE 4.23Å
139	V	66.5	Low	67.9	Low	76 Å²	76	77 Å²	77	46%	0.461	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-95.5	116.3	165.9	-177.9	0	0	0	0	107.8	D137	D137-V139 PolarHBondContact O-N 3.32Å
140	I	69.9	Low	65.7	Low	7 Å²	7	81.6 Å²	81.6	4%	0.036	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-87.9	122.5	169.4	-61	172.8	0	0	0	108.3	F101 L138 I172 D176 M180	F101-I140 HydrophobicContact CB-CB 4.39Å; F101-I140 HydrophobicContact CD1-CD1 3.77Å; F101-I140 HydrophobicContact CD2-CB 3.82Å; F101-I140 HydrophobicContact CD2-CD1 4.09Å; F101-I140 HydrophobicContact CD2-CG2 3.98Å; F101-I140 HydrophobicContact CE1-CD1 3.63Å; F101-I140 HydrophobicContact CE2-CB 4.2Å; F101-I140 HydrophobicContact CE2-CD1 3.91Å; F101-I140 HydrophobicContact CE2-CG2 3.96Å; F101-I140 HydrophobicContact CG-CB 4.08Å; F101-I140 HydrophobicContact CG-CD1 4.02Å; F101-I140 HydrophobicContact CZ-CD1 3.7Å; L138-I140 HydrophobicContact CD2-CG1 4.38Å; L138-I140 HydrophobicContact CG-CG1 4.47Å; I140-I172 HydrophobicContact CG2-CG2 3.88Å; I140-D176 HydrophobicContact CG1-CB 4.22Å; I140-M180 HydrophobicContact CD1-CE 3.06Å; I140-M180 HydrophobicContact CD1-SD 4.1Å; I140-M180 HydrophobicContact CG1-CE 3.5Å; I140-M180 VanDerWaalsContact CG1-CE 3.5Å
141	N	67	Low	63.5	Low	93 Å²	93	81 Å²	81	50%	0.497	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-91.1	136.9	167.6	-64.5	-26.7	0	0	0	110.2
142	F	69.3	Low	61.6	Low	23 Å²	23	82.7 Å²	82.7	10%	0.101	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-77.1	127.1	169.8	-60.9	-64.5	0	0	0	110.2	F101 D103 F170 R239 C241	F101-F142 HydrophobicContact CD2-CD1 4.33Å; F101-F142 AromaticContact CD2-CE1 3.46Å; F101-F142 HydrophobicContact CD2-CE1 3.46Å; F101-F142 VanDerWaalsContact CD2-CE1 3.46Å; F101-F142 HydrophobicContact CD2-CE2 4.25Å; F101-F142 AromaticContact CD2-CZ 3.4Å; F101-F142 HydrophobicContact CD2-CZ 3.4Å; F101-F142 VanDerWaalsContact CD2-CZ 3.4Å; F101-F142 HydrophobicContact CE2-CD1 4.17Å; F101-F142 AromaticContact CE2-CE1 3.31Å; F101-F142 HydrophobicContact CE2-CE1 3.31Å; F101-F142 AromaticContact CE2-CZ 3.73Å; F101-F142 HydrophobicContact CE2-CZ 3.73Å; F101-F142 HydrophobicContact CG-CZ 4.45Å; D103-F142 VanDerWaalsContact OD1-CD2 3.3Å; D103-F142 WeakPolarHBondContact OD1-CD2 3.41Å; F142-F170 HydrophobicContact CB-CD2 4.29Å; F142-F170 AromaticContact CD1-CD2 3.3Å; F142-F170 HydrophobicContact CD1-CD2 3.3Å; F142-F170 AromaticContact CD1-CE2 3.33Å; F142-F170 HydrophobicContact CD1-CE2 3.33Å; F142-F170 HydrophobicContact CD1-CG 4.32Å; F142-F170 HydrophobicContact CD1-CZ 4.41Å; F142-F170 AromaticContact CE1-CD2 3.89Å; F142-F170 HydrophobicContact CE1-CD2 3.89Å; F142-F170 AromaticContact CE1-CE2 3.43Å; F142-F170 HydrophobicContact CE1-CE2 3.43Å; F142-F170 VanDerWaalsContact CE1-CE2 3.43Å; F142-F170 HydrophobicContact CE1-CZ 4.19Å; F142-F170 HydrophobicContact CG-CD2 4.14Å; F142-F170 HydrophobicContact CG-CE2 4.5Å; F142-R239 VanDerWaalsContact CB-CZ 3.42Å; F142-R239 HydrophobicContact CE2-CB 3.94Å; F142-R239 HydrophobicContact CZ-CB 4Å; F142-C241 HydrophobicContact CE1-CB 4.19Å; F142-C241 WeakPolarHBondContact CE1-SG 3.37Å; F142-C241 HydrophobicContact CZ-CB 4.11Å
143	D	66	Low	59.9	Low	56 Å²	56	86.1 Å²	86.1	30%	0.299	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	100.8	172.5	-75	-39.5	0	0	0	109	A145 F160 R171 R173	D143-A145 PolarHBondContact O-N 2.72Å; D143-F160 HydrophobicContact CB-CE1 4.39Å; D143-F160 WeakPolarHBondContact OD2-CE1 3.42Å; D143-R171 HydrophobicContact CB-CB 4.24Å; D143-R171 PolarHBondContact N-O 3.3Å; D143-R171 PolarHBondContact O-N 3.32Å; D143-R173 IonicContact OD1-NH1 3.06Å; D143-R173 IonicContact OD2-CZ 2.88Å; D143-R173 IonicContact OD2-NH1 2.68Å; D143-R173 PolarHBondContact OD2-NH1 2.83Å
144	D	62.5	Low	58.2	Low	93 Å²	93	87.6 Å²	87.6	50%	0.497	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	123.6	176.2	-75.5	-48.1	0	0	0	110.9	S146 R239	D144-S146 VanDerWaalsContact C-N 3.35Å; D144-S146 PolarHBondContact O-N 2.91Å; D144-R239 IonicContact OD1-CZ 3.54Å; D144-R239 IonicContact OD1-NH1 3.54Å; D144-R239 PolarHBondContact OD1-NH1 2.8Å; D144-R239 IonicContact OD1-NH2 2.76Å; D144-R239 IonicContact OD2-CZ 3.31Å; D144-R239 IonicContact OD2-NH1 2.73Å; D144-R239 IonicContact OD2-NH2 3.53Å; D144-R239 PolarHBondContact OD2-NH2 3.18Å
145	A	57.5	Low	56.5	Low	34 Å²	34	85.8 Å²	85.8	28%	0.281	48%	0.479	S	S	.	.			trans	-72.2	89.9	177.5	0	0	0	0	0	109.6	D143 L147	D143-A145 PolarHBondContact O-N 2.72Å; A145-L147 PolarHBondContact O-N 3.37Å
146	S	49.4	Very low	55.4	Low	89 Å²	89	92.8 Å²	92.8	62%	0.622	51%	0.509	S	S	*	.			trans	-63.8	126.6	169.8	79.7	0	0	0	0	109.6	D144 K148	D144-S146 VanDerWaalsContact C-N 3.35Å; D144-S146 PolarHBondContact O-N 2.91Å; S146-K148 PolarHBondContact O-N 3.15Å
147	L	46.5	Very low	54.3	Low	176 Å²	176	91 Å²	91	92%	0.921	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	20.3	-176.2	-120.5	112.8	0	0	0	115.1	A145	A145-L147 PolarHBondContact O-N 3.37Å
148	K	41.3	Very low	53.7	Low	183 Å²	183	90.3 Å²	90.3	80%	0.796	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127	6.4	-164.6	-85.7	-172.7	176.2	-179.8	0	117.9	S146	S146-K148 PolarHBondContact O-N 3.15Å
149	H	41.5	Very low	53.5	Low	161 Å²	161	95.1 Å²	95.1	75%	0.745	52%	0.518	S	S	*	.			trans	-127.8	82.1	174.3	-91.9	-69.5	0	0	0	113.2	S151	H149-S151 PolarHBondContact O-N 3.28Å
150	T	38.3	Very low	53.4	Low	122 Å²	122	94.1 Å²	94.1	75%	0.748	51%	0.508	S	S	*	.			trans	-90.4	24.2	-176.5	-11.7	0	0	0	0	114.7	I153	T150-I153 HydrophobicContact CG2-CD1 3.88Å
151	S	40.8	Very low	53.2	Low	88 Å²	88	97 Å²	97	62%	0.615	52%	0.523	S	S	*	.	S	Bend	trans	-139.6	59.7	-168.5	67	0	0	0	0	114.4	H149	H149-S151 PolarHBondContact O-N 3.28Å
152	N	44	Very low	53	Low	143 Å²	143	95.8 Å²	95.8	77%	0.765	52%	0.521	S	S	*	.			trans	172.1	48.9	151.5	-98.4	-17.2	0	0	0	111.1
153	I	49.2	Very low	52.6	Low	73 Å²	73	96.4 Å²	96.4	37%	0.374	53%	0.526	S	S	.	.	H	α-helix	trans	-78.7	-24.5	-159.2	-69.4	167.6	0	0	0	113.8	T150 N157	T150-I153 HydrophobicContact CG2-CD1 3.88Å; I153-N157 WeakPolarHBondContact CG2-ND2 3.32Å; I153-N157 WeakPolarHBondContact O-CB 3.27Å; I153-N157 PolarHBondContact O-N 2.93Å; I153-N157 PolarHBondContact O-ND2 3.41Å; I153-N157 PolarHBondContact O-OD1 3.23Å
154	S	49.7	Very low	52.2	Low	92 Å²	92	99.6 Å²	99.6	64%	0.643	54%	0.543	S	S	*	.	H	α-helix	trans	-68.9	-44.8	-172.1	169.5	0	0	0	0	114.6
155	A	47.2	Very low	52	Low	73 Å²	73	96.5 Å²	96.5	60%	0.603	53%	0.526	S	S	*	.	H	α-helix	trans	-81.3	-32.7	-177.4	0	0	0	0	0	113.2
156	K	49.4	Very low	51.8	Low	147 Å²	147	97.4 Å²	97.4	64%	0.639	53%	0.534	S	S	*	.	H	α-helix	trans	-72.5	-33.7	179.7	-86.3	-174.1	174.5	-176.3	0	112.7	K158 H159 F160	K156-K158 PolarHBondContact O-N 3.2Å; K156-K158 VanDerWaalsContact O-N 3.16Å; K156-H159 PolarHBondContact O-N 3.49Å; K156-H159 VanDerWaalsContact O-N 3.17Å; K156-F160 VanDerWaalsContact O-CD2 3.23Å; K156-F160 WeakPolarHBondContact O-CD2 3.41Å
157	N	51.2	Low	52	Low	37 Å²	37	99.4 Å²	99.4	20%	0.198	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	-63.7	-21.3	-177.1	-77.9	3.6	0	0	0	114.2	I153 H159 F160	I153-N157 WeakPolarHBondContact CG2-ND2 3.32Å; I153-N157 WeakPolarHBondContact O-CB 3.27Å; I153-N157 PolarHBondContact O-N 2.93Å; I153-N157 PolarHBondContact O-ND2 3.41Å; I153-N157 PolarHBondContact O-OD1 3.23Å; N157-H159 PolarHBondContact O-N 2.92Å; N157-F160 PolarHBondContact O-N 3.38Å
158	K	53	Low	52.6	Low	116 Å²	116	93.7 Å²	93.7	50%	0.504	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-66.3	-20.3	177	-68.2	-172.1	176.5	-173.2	0	113.3	K156	K156-K158 PolarHBondContact O-N 3.2Å; K156-K158 VanDerWaalsContact O-N 3.16Å
159	H	64.2	Low	53.5	Low	115 Å²	115	88.1 Å²	88.1	53%	0.532	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-98.3	0.2	-175.2	-64.1	-72.4	0	0	0	114.6	K156 N157 R173 T174	K156-H159 PolarHBondContact O-N 3.49Å; K156-H159 VanDerWaalsContact O-N 3.17Å; N157-H159 PolarHBondContact O-N 2.92Å; H159-R173 CarbonylContact O-C 3.5Å; H159-R173 VanDerWaalsContact O-CA 3.27Å; H159-R173 WeakPolarHBondContact O-CA 3.44Å; H159-T174 PolarHBondContact O-N 3.08Å; H159-T174 PolarHBondContact O-OG1 3.46Å
160	F	63.7	Low	54.6	Low	55 Å²	55	80.4 Å²	80.4	24%	0.241	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	142.8	-175.1	-62.8	-88.8	0	0	0	112.8	D143 K156 N157 R171 I172 R173 T174	D143-F160 HydrophobicContact CB-CE1 4.39Å; D143-F160 WeakPolarHBondContact OD2-CE1 3.42Å; K156-F160 VanDerWaalsContact O-CD2 3.23Å; K156-F160 WeakPolarHBondContact O-CD2 3.41Å; N157-F160 PolarHBondContact O-N 3.38Å; F160-R171 HydrophobicContact CB-CB 4.14Å; F160-R171 HydrophobicContact CB-CG 4.48Å; F160-R171 HydrophobicContact CD1-CB 3.85Å; F160-R171 HydrophobicContact CG-CB 4.29Å; F160-I172 CarbonylContact C-O 3.53Å; F160-I172 VanDerWaalsContact CA-O 3.32Å; F160-I172 WeakPolarHBondContact CA-O 3.19Å; F160-R173 HydrophobicContact CD1-CG 3.68Å; F160-R173 HydrophobicContact CE1-CG 3.3Å; F160-R173 HydrophobicContact CZ-CG 4.01Å; F160-T174 PolarHBondContact N-OG1 3.33Å
161	I	64.9	Low	56.1	Low	68 Å²	68	78.8 Å²	78.8	35%	0.349	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	112.6	164.5	-51.7	-161.8	0	0	0	107.2	L163 R171 I172 I177	I161-L163 HydrophobicContact CG2-CD1 4.38Å; I161-L163 HydrophobicContact CG2-CG 4.42Å; I161-R171 CarbonylContact O-C 3.59Å; I161-R171 WeakPolarHBondContact O-CA 3.34Å; I161-I172 PolarHBondContact N-O 3.29Å; I161-I172 PolarHBondContact O-N 3Å; I161-I177 HydrophobicContact CB-CD1 4.36Å; I161-I177 HydrophobicContact CD1-CD1 3.31Å; I161-I177 HydrophobicContact CG1-CD1 3.94Å
162	S	62.8	Low	57.5	Low	67 Å²	67	74.6 Å²	74.6	47%	0.469	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.5	172.9	-58	0	0	0	0	109.3
163	L	62.4	Low	58.8	Low	37 Å²	37	70.4 Å²	70.4	19%	0.194	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	122.2	176.5	-75.9	136.5	0	0	0	108.2	I161 F170 I172 V229	I161-L163 HydrophobicContact CG2-CD1 4.38Å; I161-L163 HydrophobicContact CG2-CG 4.42Å; L163-F170 HydrophobicContact CB-CD1 4.05Å; L163-F170 HydrophobicContact CB-CE1 3.28Å; L163-F170 HydrophobicContact CB-CE2 4.05Å; L163-F170 HydrophobicContact CB-CZ 3.34Å; L163-F170 HydrophobicContact CD1-CE1 4.43Å; L163-F170 HydrophobicContact CD1-CE2 3.76Å; L163-F170 HydrophobicContact CD1-CZ 3.6Å; L163-F170 HydrophobicContact CG-CE1 4.4Å; L163-F170 HydrophobicContact CG-CZ 4Å; L163-F170 PolarHBondContact N-O 2.95Å; L163-F170 VanDerWaalsContact O-CD1 3.24Å; L163-F170 WeakPolarHBondContact O-CD1 3.46Å; L163-F170 WeakPolarHBondContact O-CE1 3.43Å; L163-F170 PolarHBondContact O-N 3.29Å; L163-I172 HydrophobicContact CD1-CD1 3.31Å; L163-I172 HydrophobicContact CD1-CG1 3.76Å; L163-V229 HydrophobicContact CD1-CG1 4.47Å
164	D	57.2	Low	59.8	Low	123 Å²	123	68.4 Å²	68.4	66%	0.658	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	112	175.9	-65.9	-42	0	0	0	109.1	T169	D164-T169 WeakPolarHBondContact OD1-CB 3.43Å; D164-T169 WeakPolarHBondContact OD1-CG2 3.47Å; D164-T169 PolarHBondContact OD1-OG1 3.47Å
165	L	58.2	Low	60.9	Low	27 Å²	27	68.9 Å²	68.9	14%	0.141	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	160.7	156.3	-67.9	113.5	0	0	0	108.8	F167 L168 F170 C231 T233	L165-F167 PolarHBondContact O-N 3.22Å; L165-L168 PolarHBondContact N-O 2.87Å; L165-L168 PolarHBondContact O-N 2.93Å; L165-F170 HydrophobicContact CD1-CD1 3.51Å; L165-F170 HydrophobicContact CD1-CE1 3.07Å; L165-F170 HydrophobicContact CD1-CZ 4.06Å; L165-F170 HydrophobicContact CG-CE1 4.29Å; L165-C231 HydrophobicContact CD1-CB 4.32Å; L165-C231 HydrophobicContact CD2-CB 4.35Å; L165-T233 HydrophobicContact CD2-CG2 3.87Å
166	A	53.1	Low	62.3	Low	54 Å²	54	65.9 Å²	65.9	45%	0.446	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.1	-23.9	-173.2	0	0	0	0	0	116.8
167	F	53.3	Low	63.4	Low	131 Å²	131	59.7 Å²	59.7	58%	0.575	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.9	-0.9	-179	-29.7	-74.2	0	0	0	113.8	L165 N294	L165-F167 PolarHBondContact O-N 3.22Å; F167-N294 HydrophobicContact CE1-CB 3.82Å
168	L	59	Low	64.6	Low	55 Å²	55	65.2 Å²	65.2	29%	0.288	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	114.9	-167.5	-74.5	162	0	0	0	109.8	L165	L165-L168 PolarHBondContact N-O 2.87Å; L165-L168 PolarHBondContact O-N 2.93Å
169	T	59.7	Low	65.8	Low	66 Å²	66	60.2 Å²	60.2	41%	0.405	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	118.8	164.4	-53.4	0	0	0	0	108.6	D164	D164-T169 WeakPolarHBondContact OD1-CB 3.43Å; D164-T169 WeakPolarHBondContact OD1-CG2 3.47Å; D164-T169 PolarHBondContact OD1-OG1 3.47Å
170	F	65.4	Low	66.3	Low	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	160	175.7	73	-75.7	0	0	0	109.6	F142 L163 L165 I172 C231 R239	F142-F170 HydrophobicContact CB-CD2 4.29Å; F142-F170 AromaticContact CD1-CD2 3.3Å; F142-F170 HydrophobicContact CD1-CD2 3.3Å; F142-F170 AromaticContact CD1-CE2 3.33Å; F142-F170 HydrophobicContact CD1-CE2 3.33Å; F142-F170 HydrophobicContact CD1-CG 4.32Å; F142-F170 HydrophobicContact CD1-CZ 4.41Å; F142-F170 AromaticContact CE1-CD2 3.89Å; F142-F170 HydrophobicContact CE1-CD2 3.89Å; F142-F170 AromaticContact CE1-CE2 3.43Å; F142-F170 HydrophobicContact CE1-CE2 3.43Å; F142-F170 VanDerWaalsContact CE1-CE2 3.43Å; F142-F170 HydrophobicContact CE1-CZ 4.19Å; F142-F170 HydrophobicContact CG-CD2 4.14Å; F142-F170 HydrophobicContact CG-CE2 4.5Å; L163-F170 HydrophobicContact CB-CD1 4.05Å; L163-F170 HydrophobicContact CB-CE1 3.28Å; L163-F170 HydrophobicContact CB-CE2 4.05Å; L163-F170 HydrophobicContact CB-CZ 3.34Å; L163-F170 HydrophobicContact CD1-CE1 4.43Å; L163-F170 HydrophobicContact CD1-CE2 3.76Å; L163-F170 HydrophobicContact CD1-CZ 3.6Å; L163-F170 HydrophobicContact CG-CE1 4.4Å; L163-F170 HydrophobicContact CG-CZ 4Å; L163-F170 PolarHBondContact N-O 2.95Å; L163-F170 VanDerWaalsContact O-CD1 3.24Å; L163-F170 WeakPolarHBondContact O-CD1 3.46Å; L163-F170 WeakPolarHBondContact O-CE1 3.43Å; L163-F170 PolarHBondContact O-N 3.29Å; L165-F170 HydrophobicContact CD1-CD1 3.51Å; L165-F170 HydrophobicContact CD1-CE1 3.07Å; L165-F170 HydrophobicContact CD1-CZ 4.06Å; L165-F170 HydrophobicContact CG-CE1 4.29Å; F170-I172 HydrophobicContact CD2-CG1 4.2Å; F170-I172 HydrophobicContact CE2-CD1 3.89Å; F170-I172 HydrophobicContact CE2-CG1 3.72Å; F170-C231 HydrophobicContact CZ-CB 4.14Å; F170-C231 VanDerWaalsContact CZ-SG 3.6Å; F170-R239 VanDerWaalsContact CB-NH1 3.33Å
171	R	69.8	Low	67	Low	87 Å²	87	53.6 Å²	53.6	33%	0.328	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	140.8	-177	-64.5	178.8	-176.2	162	3.6	109.9	D143 F160 I161	D143-R171 HydrophobicContact CB-CB 4.24Å; D143-R171 PolarHBondContact N-O 3.3Å; D143-R171 PolarHBondContact O-N 3.32Å; F160-R171 HydrophobicContact CB-CB 4.14Å; F160-R171 HydrophobicContact CB-CG 4.48Å; F160-R171 HydrophobicContact CD1-CB 3.85Å; F160-R171 HydrophobicContact CG-CB 4.29Å; I161-R171 CarbonylContact O-C 3.59Å; I161-R171 WeakPolarHBondContact O-CA 3.34Å
172	I	70.6	Confident	68	Low	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.3	169.4	-57.8	177.4	0	0	0	107.7	F101 I140 F160 I161 L163 F170 T174 I177 V229	F101-I172 HydrophobicContact CE2-CD1 3.63Å; F101-I172 HydrophobicContact CE2-CG1 4.41Å; F101-I172 HydrophobicContact CZ-CD1 3.61Å; I140-I172 HydrophobicContact CG2-CG2 3.88Å; F160-I172 CarbonylContact C-O 3.53Å; F160-I172 VanDerWaalsContact CA-O 3.32Å; F160-I172 WeakPolarHBondContact CA-O 3.19Å; I161-I172 PolarHBondContact N-O 3.29Å; I161-I172 PolarHBondContact O-N 3Å; L163-I172 HydrophobicContact CD1-CD1 3.31Å; L163-I172 HydrophobicContact CD1-CG1 3.76Å; F170-I172 HydrophobicContact CD2-CG1 4.2Å; F170-I172 HydrophobicContact CE2-CD1 3.89Å; F170-I172 HydrophobicContact CE2-CG1 3.72Å; I172-T174 PolarHBondContact O-N 2.96Å; I172-I177 HydrophobicContact CB-CD1 4.16Å; I172-I177 HydrophobicContact CG2-CD1 3.66Å; I172-I177 HydrophobicContact CG2-CG1 3.78Å; I172-V229 HydrophobicContact CD1-CG1 4.12Å
173	R	71.8	Confident	69.2	Low	55 Å²	55	47.3 Å²	47.3	21%	0.208	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	131.6	175.4	-69.3	-176.8	-60.3	-84.9	-8.5	110.9	D143 H159 F160 E175 D176 I177	D143-R173 IonicContact OD1-NH1 3.06Å; D143-R173 IonicContact OD2-CZ 2.88Å; D143-R173 IonicContact OD2-NH1 2.68Å; D143-R173 PolarHBondContact OD2-NH1 2.83Å; H159-R173 CarbonylContact O-C 3.5Å; H159-R173 VanDerWaalsContact O-CA 3.27Å; H159-R173 WeakPolarHBondContact O-CA 3.44Å; F160-R173 HydrophobicContact CD1-CG 3.68Å; F160-R173 HydrophobicContact CE1-CG 3.3Å; F160-R173 HydrophobicContact CZ-CG 4.01Å; R173-E175 HydrophobicContact CB-CG 3.65Å; R173-E175 VanDerWaalsContact CD-OE1 3.24Å; R173-E175 WeakPolarHBondContact CD-OE1 3.25Å; R173-E175 IonicContact NE-OE1 3.81Å; R173-E175 PolarHBondContact NE-OE1 3.44Å; R173-E175 PolarHBondContact O-N 3.46Å; R173-D176 IonicContact CZ-OD2 3.21Å; R173-D176 IonicContact NE-OD2 2.71Å; R173-D176 PolarHBondContact NE-OD2 3.3Å; R173-D176 IonicContact NH2-OD2 3.54Å; R173-D176 PolarHBondContact NH2-OD2 2.93Å; R173-D176 PolarHBondContact O-N 3.47Å; R173-I177 PolarHBondContact O-N 2.97Å
174	T	70.4	Confident	70.3	Confident	31 Å²	31	45.6 Å²	45.6	19%	0.19	23%	0.225	C	C	.	.	H	α-helix	trans	-60.2	-32.2	179.3	-50.5	0	0	0	0	111.5	H159 F160 I172 I177 R178	H159-T174 PolarHBondContact O-N 3.08Å; H159-T174 PolarHBondContact O-OG1 3.46Å; F160-T174 PolarHBondContact N-OG1 3.33Å; I172-T174 PolarHBondContact O-N 2.96Å; T174-I177 PolarHBondContact O-N 3.45Å; T174-R178 WeakPolarHBondContact O-CG 3.44Å; T174-R178 PolarHBondContact O-N 2.7Å
175	E	72.4	Confident	71.6	Confident	103 Å²	103	39.7 Å²	39.7	48%	0.481	19%	0.194	S	C	.	.	H	α-helix	trans	-58.8	-43.3	173	46.9	172.4	-161.9	0	0	112.5	R173 I177 R178 L179	R173-E175 HydrophobicContact CB-CG 3.65Å; R173-E175 VanDerWaalsContact CD-OE1 3.24Å; R173-E175 WeakPolarHBondContact CD-OE1 3.25Å; R173-E175 IonicContact NE-OE1 3.81Å; R173-E175 PolarHBondContact NE-OE1 3.44Å; R173-E175 PolarHBondContact O-N 3.46Å; E175-I177 VanDerWaalsContact C-N 3.28Å; E175-I177 PolarHBondContact O-N 3.1Å; E175-R178 PolarHBondContact O-N 2.9Å; E175-L179 WeakPolarHBondContact O-CG 3.46Å; E175-L179 PolarHBondContact O-N 3.3Å; E175-L179 VanDerWaalsContact O-N 3.13Å
176	D	76.2	Confident	72.5	Confident	10 Å²	10	40.9 Å²	40.9	5%	0.053	20%	0.198	C	C	.	.	H	α-helix	trans	-66.1	-35.2	-179.3	-67.1	-27.7	0	0	0	111	L138 I140 R173 L179	L138-D176 WeakPolarHBondContact CD2-O 3.43Å; I140-D176 HydrophobicContact CG1-CB 4.22Å; R173-D176 IonicContact CZ-OD2 3.21Å; R173-D176 IonicContact NE-OD2 2.71Å; R173-D176 PolarHBondContact NE-OD2 3.3Å; R173-D176 IonicContact NH2-OD2 3.54Å; R173-D176 PolarHBondContact NH2-OD2 2.93Å; R173-D176 PolarHBondContact O-N 3.47Å; D176-L179 PolarHBondContact O-N 3.46Å
177	I	73.1	Confident	73.4	Confident	16 Å²	16	40.7 Å²	40.7	8%	0.082	19%	0.191	C	C	.	.	H	α-helix	trans	-71.4	-39.5	176	-65.7	171.2	0	0	0	111.3	I161 I172 R173 T174 E175 L179 M180 V227 V229	I161-I177 HydrophobicContact CB-CD1 4.36Å; I161-I177 HydrophobicContact CD1-CD1 3.31Å; I161-I177 HydrophobicContact CG1-CD1 3.94Å; I172-I177 HydrophobicContact CB-CD1 4.16Å; I172-I177 HydrophobicContact CG2-CD1 3.66Å; I172-I177 HydrophobicContact CG2-CG1 3.78Å; R173-I177 PolarHBondContact O-N 2.97Å; T174-I177 PolarHBondContact O-N 3.45Å; E175-I177 VanDerWaalsContact C-N 3.28Å; E175-I177 PolarHBondContact O-N 3.1Å; I177-L179 PolarHBondContact O-N 2.94Å; I177-M180 WeakPolarHBondContact O-CB 3.45Å; I177-M180 PolarHBondContact O-N 3.1Å; I177-V227 HydrophobicContact CG2-CB 3.93Å; I177-V227 HydrophobicContact CG2-CG1 4.01Å; I177-V227 HydrophobicContact CG2-CG2 4.39Å; I177-V229 HydrophobicContact CD1-CG2 4.22Å
178	R	75.9	Confident	74.5	Confident	153 Å²	153	35.6 Å²	35.6	58%	0.577	17%	0.17	S	C	*	.	H	α-helix	trans	-59.6	-34.6	175.4	-74.4	175.6	-179.4	-173.6	1	111.9	T174 E175 M180 A181	T174-R178 WeakPolarHBondContact O-CG 3.44Å; T174-R178 PolarHBondContact O-N 2.7Å; E175-R178 PolarHBondContact O-N 2.9Å; R178-M180 PolarHBondContact O-N 3.18Å; R178-A181 PolarHBondContact O-N 3.39Å
179	L	78	Confident	75.4	Confident	11 Å²	11	33 Å²	33	6%	0.058	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-12.2	176.2	-66.4	174.5	0	0	0	113.9	R131 K134 L138 E175 D176 I177	R131-L179 HydrophobicContact CB-CD2 4.25Å; R131-L179 VanDerWaalsContact O-CD2 3.27Å; R131-L179 WeakPolarHBondContact O-CD2 3.31Å; K134-L179 HydrophobicContact CB-CD1 4.15Å; K134-L179 HydrophobicContact CD-CD1 4.03Å; L138-L179 HydrophobicContact CD1-CB 4.5Å; L138-L179 HydrophobicContact CD1-CD1 3.8Å; L138-L179 HydrophobicContact CD2-CB 3.91Å; E175-L179 WeakPolarHBondContact O-CG 3.46Å; E175-L179 PolarHBondContact O-N 3.3Å; E175-L179 VanDerWaalsContact O-N 3.13Å; D176-L179 PolarHBondContact O-N 3.46Å; I177-L179 PolarHBondContact O-N 2.94Å
180	M	74	Confident	76.6	Confident	13 Å²	13	32.1 Å²	32.1	6%	0.064	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-10.4	176	-56.5	-164.4	173.1	0	0	114.1	R99 L138 I140 I177 R178 P182 A243	R99-M180 HydrophobicContact CB-CE 4.02Å; R99-M180 HydrophobicContact CB-SD 4.17Å; R99-M180 HydrophobicContact CG-CE 4.36Å; R99-M180 HydrophobicContact CG-SD 4.42Å; L138-M180 HydrophobicContact CD2-CE 3.47Å; L138-M180 VanDerWaalsContact CD2-CE 3.47Å; L138-M180 HydrophobicContact CD2-CG 3.7Å; L138-M180 HydrophobicContact CD2-SD 4.46Å; L138-M180 HydrophobicContact CG-CE 4.23Å; I140-M180 HydrophobicContact CD1-CE 3.06Å; I140-M180 HydrophobicContact CD1-SD 4.1Å; I140-M180 HydrophobicContact CG1-CE 3.5Å; I140-M180 VanDerWaalsContact CG1-CE 3.5Å; I177-M180 WeakPolarHBondContact O-CB 3.45Å; I177-M180 PolarHBondContact O-N 3.1Å; R178-M180 PolarHBondContact O-N 3.18Å; M180-P182 WeakPolarHBondContact O-CD 3.12Å; M180-A243 HydrophobicContact SD-CB 3.63Å
181	A	79.8	Confident	77.7	Confident	18 Å²	18	32.6 Å²	32.6	15%	0.149	15%	0.148	C	C	.	.			trans	-89.1	104.9	-172.7	0	0	0	0	0	110.7	R178 N194 V227	R178-A181 PolarHBondContact O-N 3.39Å; A181-N194 WeakPolarHBondContact O-CA 3.23Å; A181-V227 HydrophobicContact CB-CG2 3.62Å
182	P	85.7	Confident	78.7	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.006	13%	0.132	C	C	.	.			trans	-65.1	149.4	174.7	29.4	-34.3	0	0	0	110.3	F114 M180 Y192 S245 L247	F114-P182 HydrophobicContact CE2-CB 4.24Å; F114-P182 HydrophobicContact CZ-CB 3.98Å; F114-P182 HydrophobicContact CZ-CG 4.18Å; M180-P182 WeakPolarHBondContact O-CD 3.12Å; P182-Y192 VanDerWaalsContact CA-O 3.28Å; P182-Y192 WeakPolarHBondContact CA-O 3.41Å; P182-Y192 WeakPolarHBondContact CB-O 3.5Å; P182-S245 VanDerWaalsContact CD-CB 3.43Å; P182-L247 HydrophobicContact CB-CD2 4.36Å; P182-L247 HydrophobicContact CG-CB 4.08Å; P182-L247 HydrophobicContact CG-CD1 4.35Å; P182-L247 HydrophobicContact CG-CD2 4.26Å; P182-L247 HydrophobicContact CG-CG 4.48Å
183	V	86.9	Confident	79.5	Confident	3 Å²	3	28.5 Å²	28.5	2%	0.018	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	145.8	176.1	-60.4	0	0	0	0	109.8	Y192 L195 A198 L222 D223 L224	V183-Y192 HydrophobicContact CG2-CD2 4.41Å; V183-Y192 PolarHBondContact N-O 3.39Å; V183-Y192 VanDerWaalsContact N-O 3.1Å; V183-Y192 PolarHBondContact O-N 3.46Å; V183-L195 HydrophobicContact CG1-CB 4.48Å; V183-A198 HydrophobicContact CG2-CB 3.7Å; V183-L222 HydrophobicContact CB-CD2 4.34Å; V183-L222 HydrophobicContact CG2-CD1 4.36Å; V183-L222 HydrophobicContact CG2-CD2 4.12Å; V183-D223 WeakPolarHBondContact CA-O 3.43Å; V183-L224 HydrophobicContact CG1-CD2 4.23Å
184	I	85.8	Confident	80.2	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.9	176.4	-58	167.6	0	0	0	108.5	F77 R190 V191 L222 D223 F225 L247 W251	F77-I184 HydrophobicContact CE1-CG2 3.69Å; F77-I184 HydrophobicContact CZ-CG2 3.73Å; I184-R190 WeakPolarHBondContact CA-O 3.17Å; I184-V191 HydrophobicContact CG1-CG2 4.39Å; I184-L222 CarbonylContact O-C 3.56Å; I184-L222 VanDerWaalsContact O-CA 3.24Å; I184-L222 WeakPolarHBondContact O-CA 3.44Å; I184-L222 WeakPolarHBondContact O-CD2 3.48Å; I184-D223 HydrophobicContact CB-CB 4.31Å; I184-D223 PolarHBondContact N-O 3.35Å; I184-D223 PolarHBondContact O-N 3.27Å; I184-F225 HydrophobicContact CB-CE2 4.41Å; I184-F225 HydrophobicContact CD1-CE2 3.41Å; I184-F225 VanDerWaalsContact CD1-CE2 3.41Å; I184-F225 HydrophobicContact CD1-CZ 3.53Å; I184-F225 HydrophobicContact CG1-CE2 3.72Å; I184-F225 HydrophobicContact CG1-CZ 4.34Å; I184-L247 HydrophobicContact CD1-CD1 3.73Å; I184-L247 HydrophobicContact CG1-CD1 3.97Å; I184-W251 HydrophobicContact CD1-CB 4.01Å; I184-W251 HydrophobicContact CD1-CD2 3.51Å; I184-W251 HydrophobicContact CD1-CE3 4.06Å; I184-W251 HydrophobicContact CD1-CG 3.45Å; I184-W251 VanDerWaalsContact CD1-CG 3.45Å; I184-W251 HydrophobicContact CD1-CZ2 4.41Å; I184-W251 HydrophobicContact CG1-CD2 4.35Å; I184-W251 HydrophobicContact CG1-CE3 4.43Å; I184-W251 HydrophobicContact CG1-CG 4.5Å; I184-W251 HydrophobicContact CG2-CD2 4.41Å; I184-W251 HydrophobicContact CG2-CE3 4.1Å; I184-W251 HydrophobicContact CG2-CH2 3.79Å; I184-W251 HydrophobicContact CG2-CZ2 4.15Å; I184-W251 HydrophobicContact CG2-CZ3 3.74Å
185	S	84	Confident	80.9	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	123.2	171.3	173.3	0	0	0	0	111.9	F77 V187 N188 G189 R190	F77-S185 WeakPolarHBondContact CE1-O 3.47Å; S185-V187 PolarHBondContact O-N 3.44Å; S185-V187 PolarHBondContact OG-N 2.86Å; S185-N188 WeakPolarHBondContact CB-OD1 3.43Å; S185-N188 PolarHBondContact OG-OD1 3.48Å; S185-G189 VanDerWaalsContact O-CA 3.3Å; S185-G189 WeakPolarHBondContact O-CA 3.46Å; S185-G189 PolarHBondContact O-N 3.09Å; S185-R190 PolarHBondContact N-O 3.32Å
186	K	77.3	Confident	81.5	Confident	52 Å²	52	22.6 Å²	22.6	23%	0.226	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.1	174	-66.1	-177.8	174.2	178.5	0	113.5	F77 S219 Q220 R221 D223	F77-K186 HydrophobicContact CZ-CG 4.26Å; K186-S219 PolarHBondContact NZ-O 3.36Å; K186-Q220 WeakPolarHBondContact CD-O 3.4Å; K186-R221 PolarHBondContact N-O 3.16Å; K186-D223 WeakPolarHBondContact CE-OD1 3.36Å; K186-D223 VanDerWaalsContact CE-OD2 3.26Å; K186-D223 WeakPolarHBondContact CE-OD2 3.34Å; K186-D223 IonicContact NZ-OD1 2.86Å; K186-D223 PolarHBondContact NZ-OD1 2.91Å; K186-D223 VanDerWaalsContact NZ-OD1 3.11Å
187	V	73.2	Confident	82.2	Confident	49 Å²	49	22.1 Å²	22.1	30%	0.297	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-45.5	-177.7	-177.9	0	0	0	0	110.6	Q79 S185	Q79-V187 PolarHBondContact N-O 3.46Å; S185-V187 PolarHBondContact O-N 3.44Å; S185-V187 PolarHBondContact OG-N 2.86Å
188	N	75.5	Confident	82.8	Confident	25 Å²	25	21.4 Å²	21.4	13%	0.134	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-4.5	-170.8	57.5	22.7	0	0	0	114.6	S185 R190	S185-N188 WeakPolarHBondContact CB-OD1 3.43Å; S185-N188 PolarHBondContact OG-OD1 3.48Å; N188-R190 VanDerWaalsContact C-N 3.29Å; N188-R190 HydrophobicContact CB-CG 4.29Å; N188-R190 WeakPolarHBondContact ND2-CD 3.45Å; N188-R190 PolarHBondContact ND2-NH1 3.34Å; N188-R190 PolarHBondContact O-N 3.02Å; N188-R190 VanDerWaalsContact OD1-CB 3.24Å; N188-R190 WeakPolarHBondContact OD1-CB 3.35Å; N188-R190 VanDerWaalsContact OD1-CG 3.29Å; N188-R190 WeakPolarHBondContact OD1-CG 3.5Å; N188-R190 PolarHBondContact OD1-N 3.07Å
189	G	78.2	Confident	83.3	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.			trans	66.1	30.7	-176.5	0	0	0	0	0	112.9	E62 S185 W251	E62-G189 PolarHBondContact N-O 3.38Å; S185-G189 VanDerWaalsContact O-CA 3.3Å; S185-G189 WeakPolarHBondContact O-CA 3.46Å; S185-G189 PolarHBondContact O-N 3.09Å; G189-W251 VanDerWaalsContact O-CZ3 3.31Å; G189-W251 WeakPolarHBondContact O-CZ3 3.37Å
190	R	85.6	Confident	83.7	Confident	47 Å²	47	17.1 Å²	17.1	18%	0.177	9%	0.09	C	C	.	.			trans	-87.5	137.3	174.6	-70.9	-177.8	-179.8	137.6	9.9	111.3	E62 I117 I184 S185 N188 Y192	E62-R190 HydrophobicContact CB-CG 4.36Å; E62-R190 VanDerWaalsContact CD-CG 3.47Å; E62-R190 HydrophobicContact CG-CG 4.16Å; E62-R190 WeakPolarHBondContact OE1-CD 3.36Å; E62-R190 WeakPolarHBondContact OE1-CG 3.22Å; E62-R190 IonicContact OE1-NE 2.79Å; E62-R190 PolarHBondContact OE1-NE 2.67Å; E62-R190 IonicContact OE2-CZ 2.61Å; E62-R190 VanDerWaalsContact OE2-CZ 3.23Å; E62-R190 IonicContact OE2-NE 3.35Å; E62-R190 PolarHBondContact OE2-NE 2.68Å; E62-R190 IonicContact OE2-NH2 3.05Å; E62-R190 PolarHBondContact OE2-NH2 2.91Å; I117-R190 HydrophobicContact CD1-CB 3.98Å; I117-R190 HydrophobicContact CD1-CG 4.12Å; I184-R190 WeakPolarHBondContact CA-O 3.17Å; S185-R190 PolarHBondContact N-O 3.32Å; N188-R190 VanDerWaalsContact C-N 3.29Å; N188-R190 HydrophobicContact CB-CG 4.29Å; N188-R190 WeakPolarHBondContact ND2-CD 3.45Å; N188-R190 PolarHBondContact ND2-NH1 3.34Å; N188-R190 PolarHBondContact O-N 3.02Å; N188-R190 VanDerWaalsContact OD1-CB 3.24Å; N188-R190 WeakPolarHBondContact OD1-CB 3.35Å; N188-R190 VanDerWaalsContact OD1-CG 3.29Å; N188-R190 WeakPolarHBondContact OD1-CG 3.5Å; N188-R190 PolarHBondContact OD1-N 3.07Å; R190-Y192 HydrophobicContact CB-CD2 4.29Å; R190-Y192 HydrophobicContact CB-CE2 3.6Å; R190-Y192 WeakPolarHBondContact CD-OH 3.21Å
191	V	88.4	Confident	84.3	Confident	10 Å²	10	18.5 Å²	18.5	6%	0.061	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	115	172.3	-174.2	0	0	0	0	108.9	F114 A116 I117 I184 L247 W251	F114-V191 HydrophobicContact CE2-CG1 4.02Å; A116-V191 HydrophobicContact CB-CG1 4.12Å; I117-V191 PolarHBondContact N-O 2.95Å; I184-V191 HydrophobicContact CG1-CG2 4.39Å; V191-L247 HydrophobicContact CG1-CD2 3.9Å; V191-W251 HydrophobicContact CG2-CB 4.24Å; V191-W251 HydrophobicContact CG2-CE3 3.73Å; V191-W251 HydrophobicContact CG2-CZ3 4.48Å
192	Y	89.4	Confident	84.4	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	143.8	175.4	-62.6	-85.3	0	0	0	110.2	I117 P182 V183 R190 N194 C197 A198 H201 V203	I117-Y192 HydrophobicContact CB-CD1 3.82Å; I117-Y192 HydrophobicContact CB-CE1 4.19Å; I117-Y192 HydrophobicContact CD1-CD1 4.14Å; I117-Y192 HydrophobicContact CD1-CE1 3.76Å; I117-Y192 HydrophobicContact CG2-CD1 3.98Å; I117-Y192 HydrophobicContact CG2-CE1 4.12Å; P182-Y192 VanDerWaalsContact CA-O 3.28Å; P182-Y192 WeakPolarHBondContact CA-O 3.41Å; P182-Y192 WeakPolarHBondContact CB-O 3.5Å; V183-Y192 HydrophobicContact CG2-CD2 4.41Å; V183-Y192 PolarHBondContact N-O 3.39Å; V183-Y192 VanDerWaalsContact N-O 3.1Å; V183-Y192 PolarHBondContact O-N 3.46Å; R190-Y192 HydrophobicContact CB-CD2 4.29Å; R190-Y192 HydrophobicContact CB-CE2 3.6Å; R190-Y192 WeakPolarHBondContact CD-OH 3.21Å; Y192-N194 VanDerWaalsContact C-N 3.27Å; Y192-N194 PolarHBondContact O-N 3.15Å; Y192-C197 HydrophobicContact CD1-CB 4.16Å; Y192-A198 HydrophobicContact CD1-CB 4.36Å; Y192-A198 HydrophobicContact CD2-CB 3.82Å; Y192-A198 HydrophobicContact CE2-CB 4.27Å; Y192-A198 HydrophobicContact CG-CB 3.86Å; Y192-H201 HydrophobicContact CE1-CB 3.7Å; Y192-H201 AromaticContact CE1-CD2 3.74Å; Y192-H201 AromaticContact CE1-CG 3.79Å; Y192-V203 HydrophobicContact CE2-CG2 3.95Å; Y192-V203 WeakPolarHBondContact OH-CG2 3.27Å
193	A	87.9	Confident	84.1	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.008	12%	0.12	C	C	.	.	S	Bend	trans	-63.5	-34	-177.6	0	0	0	0	0	113	V95 A116 I117 A118 S135	V95-A193 HydrophobicContact CG2-CB 3.87Å; A116-A193 HydrophobicContact CB-CB 4.27Å; I117-A193 WeakPolarHBondContact O-CB 3.27Å; I117-A193 PolarHBondContact O-N 3.02Å; A118-A193 HydrophobicContact CB-CB 3.91Å; S135-A193 WeakPolarHBondContact OG-CB 3.14Å
194	N	87	Confident	83.4	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	-154.2	176.6	172.7	64	29.4	0	0	0	111.3	R131 A181 Y192 D196 C197 A198	R131-N194 PolarHBondContact O-ND2 3.48Å; R131-N194 VanDerWaalsContact O-ND2 3.1Å; A181-N194 WeakPolarHBondContact O-CA 3.23Å; Y192-N194 VanDerWaalsContact C-N 3.27Å; Y192-N194 PolarHBondContact O-N 3.15Å; N194-D196 VanDerWaalsContact C-N 3.33Å; N194-D196 PolarHBondContact O-N 3.46Å; N194-D196 WeakPolarHBondContact OD1-CB 3.31Å; N194-D196 PolarHBondContact OD1-N 3.21Å; N194-D196 VanDerWaalsContact OD1-N 3.12Å; N194-C197 WeakPolarHBondContact O-CB 3.43Å; N194-C197 PolarHBondContact O-N 3.29Å; N194-C197 PolarHBondContact OD1-N 2.96Å; N194-C197 PolarHBondContact OD1-SG 3.35Å; N194-A198 PolarHBondContact O-N 2.86Å
195	L	84.4	Confident	82	Confident	38 Å²	38	27 Å²	27	20%	0.199	15%	0.145	C	C	.	.	H	α-helix	trans	-59.8	-39.7	178.2	178.5	59.2	0	0	0	112.9	V183 C197 A198 I199 L204 L218 L222	V183-L195 HydrophobicContact CG1-CB 4.48Å; L195-C197 VanDerWaalsContact C-N 3.28Å; L195-C197 PolarHBondContact O-N 2.89Å; L195-A198 WeakPolarHBondContact O-CB 3.37Å; L195-A198 PolarHBondContact O-N 3.46Å; L195-I199 HydrophobicContact CD1-CD1 4.42Å; L195-I199 HydrophobicContact CD1-CG1 4.43Å; L195-I199 HydrophobicContact CG-CD1 3.98Å; L195-I199 HydrophobicContact CG-CG1 4.46Å; L195-I199 WeakPolarHBondContact O-CG1 3.48Å; L195-I199 PolarHBondContact O-N 3.26Å; L195-L204 HydrophobicContact CD1-CD1 4.37Å; L195-L218 HydrophobicContact CD1-CD1 3.61Å; L195-L218 HydrophobicContact CD2-CD1 4.18Å; L195-L222 HydrophobicContact CD1-CD1 3.45Å; L195-L222 VanDerWaalsContact CD1-CD1 3.45Å
196	D	86.5	Confident	80.4	Confident	28 Å²	28	30.7 Å²	30.7	15%	0.15	17%	0.171	C	C	.	.	H	α-helix	trans	-63.2	-34.4	179.3	-60.9	-74.7	0	0	0	112.1	I128 R131 C132 N194 I199 C200	I128-D196 HydrophobicContact CG2-CB 4.45Å; R131-D196 HydrophobicContact CB-CB 3.95Å; C132-D196 HydrophobicContact CB-CB 4.42Å; N194-D196 VanDerWaalsContact C-N 3.33Å; N194-D196 PolarHBondContact O-N 3.46Å; N194-D196 WeakPolarHBondContact OD1-CB 3.31Å; N194-D196 PolarHBondContact OD1-N 3.21Å; N194-D196 VanDerWaalsContact OD1-N 3.12Å; D196-I199 PolarHBondContact O-N 2.67Å; D196-C200 PolarHBondContact O-N 2.97Å
197	C	89.2	Confident	78.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.3	-39.2	172.2	-63.2	0	0	0	0	111.8	C132 Y192 N194 L195 I199 C200 H201	C132-C197 WeakPolarHBondContact CA-SG 3.34Å; C132-C197 HydrophobicContact CB-CB 4.02Å; C132-C197 WeakPolarHBondContact CB-SG 3.41Å; C132-C197 PolarHBondContact O-SG 3.03Å; C132-C197 WeakPolarHBondContact SG-CA 3.47Å; C132-C197 WeakPolarHBondContact SG-CB 3.44Å; C132-C197 CovalentContact SG-SG 2.04Å; C132-C197 PolarHBondContact SG-SG 3.05Å; Y192-C197 HydrophobicContact CD1-CB 4.16Å; N194-C197 WeakPolarHBondContact O-CB 3.43Å; N194-C197 PolarHBondContact O-N 3.29Å; N194-C197 PolarHBondContact OD1-N 2.96Å; N194-C197 PolarHBondContact OD1-SG 3.35Å; L195-C197 VanDerWaalsContact C-N 3.28Å; L195-C197 PolarHBondContact O-N 2.89Å; C197-I199 VanDerWaalsContact C-N 3.33Å; C197-C200 PolarHBondContact O-N 3.41Å; C197-C200 PolarHBondContact O-SG 3.34Å; C197-H201 PolarHBondContact O-CD2 3.48Å; C197-H201 VanDerWaalsContact O-CD2 3.25Å; C197-H201 PolarHBondContact O-N 3.2Å
198	A	87.2	Confident	77.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.9	-36.6	174.3	0	0	0	0	0	112.1	V183 Y192 N194 L195 H201 V203 L222	V183-A198 HydrophobicContact CG2-CB 3.7Å; Y192-A198 HydrophobicContact CD1-CB 4.36Å; Y192-A198 HydrophobicContact CD2-CB 3.82Å; Y192-A198 HydrophobicContact CE2-CB 4.27Å; Y192-A198 HydrophobicContact CG-CB 3.86Å; N194-A198 PolarHBondContact O-N 2.86Å; L195-A198 WeakPolarHBondContact O-CB 3.37Å; L195-A198 PolarHBondContact O-N 3.46Å; A198-H201 PolarHBondContact O-N 3.41Å; A198-V203 WeakPolarHBondContact O-CB 3.46Å; A198-V203 WeakPolarHBondContact O-CG2 3.47Å; A198-V203 PolarHBondContact O-N 2.8Å; A198-L222 HydrophobicContact CB-CD1 4.17Å; A198-L222 HydrophobicContact CB-CD2 4.03Å
199	I	84.5	Confident	75.7	Confident	62 Å²	62	39.5 Å²	39.5	32%	0.318	23%	0.23	S	C	.	.	H	α-helix	trans	-64	-45.6	175.9	-68.5	165.9	0	0	0	110.7	I128 L195 D196 C197 H201 D202 L204	I128-I199 HydrophobicContact CD1-CG2 4.42Å; I128-I199 HydrophobicContact CG2-CG2 4.46Å; L195-I199 HydrophobicContact CD1-CD1 4.42Å; L195-I199 HydrophobicContact CD1-CG1 4.43Å; L195-I199 HydrophobicContact CG-CD1 3.98Å; L195-I199 HydrophobicContact CG-CG1 4.46Å; L195-I199 WeakPolarHBondContact O-CG1 3.48Å; L195-I199 PolarHBondContact O-N 3.26Å; D196-I199 PolarHBondContact O-N 2.67Å; C197-I199 VanDerWaalsContact C-N 3.33Å; I199-H201 PolarHBondContact O-N 3.45Å; I199-D202 PolarHBondContact O-N 3.4Å; I199-L204 HydrophobicContact CG1-CD1 3.78Å
200	C	87.6	Confident	73.9	Confident	12 Å²	12	42.4 Å²	42.4	8%	0.081	26%	0.259	C	S	.	.	H	α-helix	trans	-70.4	-16.8	-177.7	72.2	0	0	0	0	114.8	C120 P121 T124 I128 D196 C197 D202	C120-C200 WeakPolarHBondContact CA-SG 3.42Å; C120-C200 HydrophobicContact CB-CB 3.6Å; C120-C200 WeakPolarHBondContact CB-SG 3.45Å; C120-C200 WeakPolarHBondContact SG-CB 3.31Å; C120-C200 CovalentContact SG-SG 2.04Å; C120-C200 PolarHBondContact SG-SG 3.33Å; P121-C200 WeakPolarHBondContact CD-O 3.4Å; P121-C200 WeakPolarHBondContact CG-O 3.32Å; T124-C200 HydrophobicContact CG2-CB 3.68Å; I128-C200 HydrophobicContact CG2-CB 3.88Å; D196-C200 PolarHBondContact O-N 2.97Å; C197-C200 PolarHBondContact O-N 3.41Å; C197-C200 PolarHBondContact O-SG 3.34Å; C200-D202 VanDerWaalsContact C-N 3.29Å
201	H	87.1	Confident	71.8	Confident	42 Å²	42	48 Å²	48	19%	0.194	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	18.9	170.4	-77.9	-82	0	0	0	113.1	I117 H119 Y192 C197 A198 I199 V203	I117-H201 WeakPolarHBondContact CG2-NE2 3.31Å; H119-H201 PolarHBondContact O-NE2 2.94Å; Y192-H201 HydrophobicContact CE1-CB 3.7Å; Y192-H201 AromaticContact CE1-CD2 3.74Å; Y192-H201 AromaticContact CE1-CG 3.79Å; C197-H201 PolarHBondContact O-CD2 3.48Å; C197-H201 VanDerWaalsContact O-CD2 3.25Å; C197-H201 PolarHBondContact O-N 3.2Å; A198-H201 PolarHBondContact O-N 3.41Å; I199-H201 PolarHBondContact O-N 3.45Å; H201-V203 HydrophobicContact CB-CG2 4.4Å; H201-V203 PolarHBondContact O-N 3.41Å; H201-V203 VanDerWaalsContact O-N 3.12Å
202	D	81.2	Confident	70	Confident	109 Å²	109	54.3 Å²	54.3	58%	0.583	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	20.8	169.8	-146.6	52.4	0	0	0	114.5	I199 C200 L204 S205	I199-D202 PolarHBondContact O-N 3.4Å; C200-D202 VanDerWaalsContact C-N 3.29Å; D202-L204 PolarHBondContact O-N 2.88Å; D202-L204 VanDerWaalsContact O-N 3.16Å; D202-S205 WeakPolarHBondContact O-CB 3.3Å; D202-S205 PolarHBondContact O-N 3.38Å; D202-S205 PolarHBondContact O-OG 2.81Å; D202-S205 WeakPolarHBondContact OD1-CB 3.28Å; D202-S205 PolarHBondContact OD1-OG 3.22Å; D202-S205 WeakPolarHBondContact OD2-CB 3.45Å; D202-S205 PolarHBondContact OD2-OG 3.33Å
203	V	78.7	Confident	68.1	Low	12 Å²	12	57 Å²	57	7%	0.073	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-25.9	-176	-179.1	0	0	0	0	112.1	Y192 A198 H201 R221 L222	Y192-V203 HydrophobicContact CE2-CG2 3.95Å; Y192-V203 WeakPolarHBondContact OH-CG2 3.27Å; A198-V203 WeakPolarHBondContact O-CB 3.46Å; A198-V203 WeakPolarHBondContact O-CG2 3.47Å; A198-V203 PolarHBondContact O-N 2.8Å; H201-V203 HydrophobicContact CB-CG2 4.4Å; H201-V203 PolarHBondContact O-N 3.41Å; H201-V203 VanDerWaalsContact O-N 3.12Å; V203-R221 VanDerWaalsContact O-CD 3.26Å; V203-R221 WeakPolarHBondContact O-CD 3.45Å; V203-R221 PolarHBondContact O-NH1 3.38Å; V203-L222 HydrophobicContact CG1-CD2 4.09Å
204	L	72.8	Confident	66.2	Low	14 Å²	14	62.9 Å²	62.9	7%	0.073	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	5.2	-174.9	-73.3	120	0	0	0	114.9	L195 I199 D202 S206 L218 L222	L195-L204 HydrophobicContact CD1-CD1 4.37Å; I199-L204 HydrophobicContact CG1-CD1 3.78Å; D202-L204 PolarHBondContact O-N 2.88Å; D202-L204 VanDerWaalsContact O-N 3.16Å; L204-S206 VanDerWaalsContact C-N 3.34Å; L204-S206 PolarHBondContact O-N 3.24Å; L204-L218 HydrophobicContact CD2-CD1 3.85Å; L204-L222 HydrophobicContact CD1-CD1 3.88Å
205	S	55.8	Low	64.7	Low	67 Å²	67	64.5 Å²	64.5	47%	0.469	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	10.9	-153.1	69.6	0	0	0	0	119.8	D202	D202-S205 WeakPolarHBondContact O-CB 3.3Å; D202-S205 PolarHBondContact O-N 3.38Å; D202-S205 PolarHBondContact O-OG 2.81Å; D202-S205 WeakPolarHBondContact OD1-CB 3.28Å; D202-S205 PolarHBondContact OD1-OG 3.22Å; D202-S205 WeakPolarHBondContact OD2-CB 3.45Å; D202-S205 PolarHBondContact OD2-OG 3.33Å
206	S	50.2	Low	63.5	Low	77 Å²	77	64.9 Å²	64.9	54%	0.538	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	0.6	177.9	61.5	0	0	0	0	115.5	L204 R221	L204-S206 VanDerWaalsContact C-N 3.34Å; L204-S206 PolarHBondContact O-N 3.24Å; S206-R221 PolarHBondContact OG-NH2 2.91Å
207	T	45.6	Very low	62.4	Low	85 Å²	85	65.2 Å²	65.2	52%	0.521	39%	0.393	S	S	.	.	S	Bend	trans	-148.9	11.6	-166.6	42.4	0	0	0	0	117.6
208	V	44.9	Very low	61.4	Low	82 Å²	82	66.2 Å²	66.2	50%	0.497	40%	0.399	S	S	.	.			trans	-118.4	87.2	-175	-169.1	0	0	0	0	111.6
209	T	38.3	Very low	60.4	Low	144 Å²	144	68.9 Å²	68.9	88%	0.883	42%	0.417	S	S	*	.			trans	-108.1	105.1	160.2	48.4	0	0	0	0	108
210	G	39.4	Very low	59.8	Low	60 Å²	60	72.6 Å²	72.6	62%	0.619	43%	0.434	S	S	*	.	S	Bend	trans	95.8	126	173.1	0	0	0	0	0	114.8
211	D	40.9	Very low	59.3	Low	166 Å²	166	75.7 Å²	75.7	89%	0.888	44%	0.443	S	S	*	.	S	Bend	trans	32.9	106.9	160.6	-57.5	-22.7	0	0	0	119.6
212	E	50.7	Low	58.9	Low	141 Å²	141	73.8 Å²	73.8	66%	0.659	43%	0.434	S	S	*	.	S	Bend	trans	58.3	128.6	173	-69.9	-154	132.3	0	0	117.5	M214	E212-M214 PolarHBondContact O-N 2.86Å
213	P	50	Low	58.8	Low	58 Å²	58	69.5 Å²	69.5	38%	0.377	41%	0.412	S	S	.	.			trans	-62.4	113.5	178.3	26	-31.9	0	0	0	109.9	G215 L218	P213-G215 PolarHBondContact O-N 3.48Å; P213-G215 VanDerWaalsContact O-N 3.16Å; P213-L218 HydrophobicContact CB-CD1 4.35Å
214	M	48.1	Very low	58.7	Low	123 Å²	123	72.8 Å²	72.8	61%	0.606	43%	0.429	S	S	*	.			trans	-51.8	120.7	171.7	-130.6	-165.5	180	0	0	108.9	E212 S216 V217 L218	E212-M214 PolarHBondContact O-N 2.86Å; M214-S216 PolarHBondContact O-N 3.26Å; M214-V217 PolarHBondContact O-N 2.87Å; M214-L218 PolarHBondContact O-N 2.88Å
215	G	56.7	Low	58.7	Low	34 Å²	34	73.8 Å²	73.8	35%	0.351	43%	0.432	S	S	.	.	H	α-helix	trans	-56.1	-23.4	-168.3	0	0	0	0	0	115.6	P213 S219	P213-G215 PolarHBondContact O-N 3.48Å; P213-G215 VanDerWaalsContact O-N 3.16Å; G215-S219 PolarHBondContact O-N 3.48Å; G215-S219 PolarHBondContact O-OG 3.34Å
216	S	57.8	Low	59.4	Low	46 Å²	46	76.2 Å²	76.2	32%	0.322	44%	0.44	S	S	.	.	H	α-helix	trans	-70.6	-37.2	176.3	55.7	0	0	0	0	113.5	M214 S219 Q220	M214-S216 PolarHBondContact O-N 3.26Å; S216-S219 PolarHBondContact O-OG 3.27Å; S216-S219 VanDerWaalsContact O-OG 3.1Å; S216-Q220 VanDerWaalsContact O-CG 3.24Å; S216-Q220 WeakPolarHBondContact O-CG 3.04Å; S216-Q220 PolarHBondContact O-N 3.44Å
217	V	64.5	Low	60.2	Low	35 Å²	35	74.1 Å²	74.1	21%	0.212	42%	0.424	C	S	.	.	H	α-helix	trans	-72.7	-36.3	178.3	-179.8	0	0	0	0	110.3	M214 Q220 R221	M214-V217 PolarHBondContact O-N 2.87Å; V217-Q220 PolarHBondContact O-N 3.22Å; V217-R221 PolarHBondContact O-N 3.32Å
218	L	67.7	Low	61.1	Low	22 Å²	22	74.1 Å²	74.1	12%	0.115	42%	0.417	C	S	.	.	H	α-helix	trans	-62.2	-49.2	178.4	-162.2	73.9	0	0	0	111.1	L195 L204 P213 M214 Q220 R221 L222 L224	L195-L218 HydrophobicContact CD1-CD1 3.61Å; L195-L218 HydrophobicContact CD2-CD1 4.18Å; L204-L218 HydrophobicContact CD2-CD1 3.85Å; P213-L218 HydrophobicContact CB-CD1 4.35Å; M214-L218 PolarHBondContact O-N 2.88Å; L218-Q220 VanDerWaalsContact C-N 3.31Å; L218-Q220 PolarHBondContact O-N 3.28Å; L218-R221 PolarHBondContact O-N 2.9Å; L218-L222 HydrophobicContact CD1-CD1 3.9Å; L218-L222 WeakPolarHBondContact O-CA 3.44Å; L218-L222 WeakPolarHBondContact O-CB 3.18Å; L218-L222 PolarHBondContact O-N 3.41Å; L218-L224 HydrophobicContact CD2-CD1 3.9Å; L218-L224 HydrophobicContact CD2-CD2 3.56Å; L218-L224 HydrophobicContact CD2-CG 4.34Å; L218-L224 HydrophobicContact CG-CD1 3.96Å; L218-L224 HydrophobicContact CG-CD2 4.08Å
219	S	66.2	Low	62.1	Low	55 Å²	55	72.1 Å²	72.1	39%	0.385	41%	0.405	S	S	.	.	H	α-helix	trans	-69.9	-24.7	-179.4	62.7	0	0	0	0	113.6	K186 G215 S216	K186-S219 PolarHBondContact NZ-O 3.36Å; G215-S219 PolarHBondContact O-N 3.48Å; G215-S219 PolarHBondContact O-OG 3.34Å; S216-S219 PolarHBondContact O-OG 3.27Å; S216-S219 VanDerWaalsContact O-OG 3.1Å
220	Q	72.4	Confident	63.3	Low	141 Å²	141	71.2 Å²	71.2	66%	0.659	39%	0.39	S	S	*	.	H	α-helix	trans	-71.3	-32.8	175.7	-78.9	175.3	6.2	0	0	113.1	K186 S216 V217 L218	K186-Q220 WeakPolarHBondContact CD-O 3.4Å; S216-Q220 VanDerWaalsContact O-CG 3.24Å; S216-Q220 WeakPolarHBondContact O-CG 3.04Å; S216-Q220 PolarHBondContact O-N 3.44Å; V217-Q220 PolarHBondContact O-N 3.22Å; L218-Q220 VanDerWaalsContact C-N 3.31Å; L218-Q220 PolarHBondContact O-N 3.28Å
221	R	75.3	Confident	64.6	Low	77 Å²	77	69.3 Å²	69.3	29%	0.291	37%	0.367	S	S	.	.	H	α-helix	trans	-109.6	-21.8	-175.2	-68.6	-161.5	175.1	-172.9	5	114.8	K186 V203 S206 V217 L218	K186-R221 PolarHBondContact N-O 3.16Å; V203-R221 VanDerWaalsContact O-CD 3.26Å; V203-R221 WeakPolarHBondContact O-CD 3.45Å; V203-R221 PolarHBondContact O-NH1 3.38Å; S206-R221 PolarHBondContact OG-NH2 2.91Å; V217-R221 PolarHBondContact O-N 3.32Å; L218-R221 PolarHBondContact O-N 2.9Å
222	L	80.2	Confident	65.6	Low	1 Å²	1	67.4 Å²	67.4	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.6	-178.8	-65.7	172.5	0	0	0	110.8	V183 I184 L195 A198 V203 L204 L218	V183-L222 HydrophobicContact CB-CD2 4.34Å; V183-L222 HydrophobicContact CG2-CD1 4.36Å; V183-L222 HydrophobicContact CG2-CD2 4.12Å; I184-L222 CarbonylContact O-C 3.56Å; I184-L222 VanDerWaalsContact O-CA 3.24Å; I184-L222 WeakPolarHBondContact O-CA 3.44Å; I184-L222 WeakPolarHBondContact O-CD2 3.48Å; L195-L222 HydrophobicContact CD1-CD1 3.45Å; L195-L222 VanDerWaalsContact CD1-CD1 3.45Å; A198-L222 HydrophobicContact CB-CD1 4.17Å; A198-L222 HydrophobicContact CB-CD2 4.03Å; V203-L222 HydrophobicContact CG1-CD2 4.09Å; L204-L222 HydrophobicContact CD1-CD1 3.88Å; L218-L222 HydrophobicContact CD1-CD1 3.9Å; L218-L222 WeakPolarHBondContact O-CA 3.44Å; L218-L222 WeakPolarHBondContact O-CB 3.18Å; L218-L222 PolarHBondContact O-N 3.41Å
223	D	78.1	Confident	66.3	Low	19 Å²	19	63.3 Å²	63.3	10%	0.102	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	122.4	158.9	-73.8	-49.3	0	0	0	109	F77 V183 I184 K186 F225	F77-D223 WeakPolarHBondContact CE2-OD2 2.88Å; F77-D223 VanDerWaalsContact CZ-OD2 3.32Å; F77-D223 WeakPolarHBondContact CZ-OD2 3.24Å; V183-D223 WeakPolarHBondContact CA-O 3.43Å; I184-D223 HydrophobicContact CB-CB 4.31Å; I184-D223 PolarHBondContact N-O 3.35Å; I184-D223 PolarHBondContact O-N 3.27Å; K186-D223 WeakPolarHBondContact CE-OD1 3.36Å; K186-D223 VanDerWaalsContact CE-OD2 3.26Å; K186-D223 WeakPolarHBondContact CE-OD2 3.34Å; K186-D223 IonicContact NZ-OD1 2.86Å; K186-D223 PolarHBondContact NZ-OD1 2.91Å; K186-D223 VanDerWaalsContact NZ-OD1 3.11Å; D223-F225 HydrophobicContact CB-CE2 4.05Å; D223-F225 HydrophobicContact CB-CZ 4.1Å
224	L	76.7	Confident	66.9	Low	82 Å²	82	65.8 Å²	65.8	43%	0.429	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	139.8	-179.8	-59.6	120.1	0	0	0	109.3	V183 L218	V183-L224 HydrophobicContact CG1-CD2 4.23Å; L218-L224 HydrophobicContact CD2-CD1 3.9Å; L218-L224 HydrophobicContact CD2-CD2 3.56Å; L218-L224 HydrophobicContact CD2-CG 4.34Å; L218-L224 HydrophobicContact CG-CD1 3.96Å; L218-L224 HydrophobicContact CG-CD2 4.08Å
225	F	74.3	Confident	67.5	Low	35 Å²	35	65.5 Å²	65.5	15%	0.154	33%	0.334	C	S	.	.			trans	-117.7	136.5	180	-62.5	-82.9	0	0	0	110.7	I184 D223 L246 L247 P248	I184-F225 HydrophobicContact CB-CE2 4.41Å; I184-F225 HydrophobicContact CD1-CE2 3.41Å; I184-F225 VanDerWaalsContact CD1-CE2 3.41Å; I184-F225 HydrophobicContact CD1-CZ 3.53Å; I184-F225 HydrophobicContact CG1-CE2 3.72Å; I184-F225 HydrophobicContact CG1-CZ 4.34Å; D223-F225 HydrophobicContact CB-CE2 4.05Å; D223-F225 HydrophobicContact CB-CZ 4.1Å; F225-L246 VanDerWaalsContact CD1-O 3.23Å; F225-L246 WeakPolarHBondContact CD1-O 3.37Å; F225-L247 HydrophobicContact CD2-CD1 3.98Å; F225-L247 HydrophobicContact CE2-CD1 3.82Å; F225-L247 HydrophobicContact CZ-CD1 4.27Å; F225-P248 HydrophobicContact CE1-CG 3.79Å; F225-P248 HydrophobicContact CZ-CG 4.2Å
226	N	69.4	Low	67.5	Low	117 Å²	117	71.5 Å²	71.5	63%	0.626	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-67.9	144.4	177.2	-66.9	-14.7	0	0	0	111	F228 L246	N226-F228 HydrophobicContact CB-CE2 3.75Å; N226-F228 HydrophobicContact CB-CZ 4.12Å; N226-L246 PolarHBondContact O-N 2.91Å
227	V	67.4	Low	67.6	Low	33 Å²	33	74 Å²	74	20%	0.2	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	127.9	171.7	-179.4	0	0	0	0	108.6	I177 A181 V229 A243 N244	I177-V227 HydrophobicContact CG2-CB 3.93Å; I177-V227 HydrophobicContact CG2-CG1 4.01Å; I177-V227 HydrophobicContact CG2-CG2 4.39Å; A181-V227 HydrophobicContact CB-CG2 3.62Å; V227-V229 HydrophobicContact CG1-CG2 4.38Å; V227-A243 HydrophobicContact CG1-CB 4.13Å; V227-N244 WeakPolarHBondContact CA-O 3.38Å
228	F	63.9	Low	67.6	Low	85 Å²	85	74.9 Å²	74.9	37%	0.373	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	124.1	178.6	-65.9	-96.2	0	0	0	108.6	N226 A243 N244 L246	N226-F228 HydrophobicContact CB-CE2 3.75Å; N226-F228 HydrophobicContact CB-CZ 4.12Å; F228-A243 CarbonylContact O-C 3.58Å; F228-A243 VanDerWaalsContact O-CA 3.26Å; F228-A243 WeakPolarHBondContact O-CA 3.48Å; F228-N244 PolarHBondContact N-O 3.17Å; F228-N244 PolarHBondContact O-N 3.02Å; F228-L246 HydrophobicContact CD2-CD1 4.07Å; F228-L246 HydrophobicContact CD2-CG 3.83Å; F228-L246 HydrophobicContact CE2-CB 4.39Å; F228-L246 HydrophobicContact CE2-CD1 3.12Å; F228-L246 HydrophobicContact CE2-CD2 4.35Å; F228-L246 HydrophobicContact CE2-CG 3.36Å; F228-L246 HydrophobicContact CZ-CD1 3.57Å; F228-L246 HydrophobicContact CZ-CG 4.26Å
229	V	66.4	Low	67.7	Low	40 Å²	40	74.6 Å²	74.6	24%	0.242	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124.6	176.7	-174.6	0	0	0	0	108.3	F101 L163 I172 I177 V227 V242 A243	F101-V229 HydrophobicContact CE1-CG1 4.46Å; F101-V229 HydrophobicContact CZ-CG1 3.96Å; L163-V229 HydrophobicContact CD1-CG1 4.47Å; I172-V229 HydrophobicContact CD1-CG1 4.12Å; I177-V229 HydrophobicContact CD1-CG2 4.22Å; V227-V229 HydrophobicContact CG1-CG2 4.38Å; V229-V242 WeakPolarHBondContact CA-O 3.24Å; V229-A243 HydrophobicContact CG2-CB 4.1Å
230	H	62.4	Low	67.9	Low	126 Å²	126	73.1 Å²	73.1	58%	0.583	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.9	173.8	-176.4	71.9	0	0	0	109.7	C241 V242	H230-C241 CarbonylContact O-C 3.49Å; H230-C241 VanDerWaalsContact O-CA 3.27Å; H230-C241 WeakPolarHBondContact O-CA 3.43Å; H230-V242 PolarHBondContact N-O 3.49Å; H230-V242 PolarHBondContact O-N 3.37Å
231	C	67.1	Low	67.9	Low	20 Å²	20	66.4 Å²	66.4	14%	0.135	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.9	-175.4	-62.4	0	0	0	0	110.9	L165 F170 L240 C241	L165-C231 HydrophobicContact CD1-CB 4.32Å; L165-C231 HydrophobicContact CD2-CB 4.35Å; F170-C231 HydrophobicContact CZ-CB 4.14Å; F170-C231 VanDerWaalsContact CZ-SG 3.6Å; C231-L240 CarbonylContact C-O 3.53Å; C231-L240 WeakPolarHBondContact CA-O 3.3Å; C231-C241 HydrophobicContact CB-CB 4.13Å; C231-C241 WeakPolarHBondContact CB-SG 3.5Å; C231-C241 WeakPolarHBondContact SG-CB 3.48Å; C231-C241 CovalentContact SG-SG 2.03Å; C231-C241 PolarHBondContact SG-SG 2.99Å
232	R	63	Low	67.6	Low	125 Å²	125	65.3 Å²	65.3	47%	0.472	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	155.3	171.8	67.4	178.4	-172.8	155.1	5	110.4	L240	R232-L240 HydrophobicContact CG-CB 4.33Å; R232-L240 PolarHBondContact N-O 3.03Å; R232-L240 PolarHBondContact O-N 2.98Å
233	T	64.7	Low	67.1	Low	55 Å²	55	65.4 Å²	65.4	34%	0.337	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	137.6	164	53	0	0	0	0	109	L165 D238	L165-T233 HydrophobicContact CD2-CG2 3.87Å; T233-D238 WeakPolarHBondContact CA-O 3.21Å
234	F	63.2	Low	66.6	Low	110 Å²	110	67 Å²	67	48%	0.482	34%	0.34	S	S	.	.	S	Bend	trans	-113.2	-26.5	175.1	-176.3	-103.5	0	0	0	112.5	D238	F234-D238 PolarHBondContact N-O 2.89Å
235	H	60.2	Low	66.2	Low	117 Å²	117	63.4 Å²	63.4	54%	0.542	32%	0.322	S	S	.	.	S	Bend	trans	-131.3	168.3	165.5	-80.2	-67.7	0	0	0	109.4	T237 D238	H235-T237 PolarHBondContact O-N 3.48Å; H235-D238 HydrophobicContact CB-CB 4.17Å; H235-D238 PolarHBondContact O-N 2.83Å; H235-D238 VanDerWaalsContact O-N 3.1Å
236	D	56.8	Low	65.8	Low	160 Å²	160	65.6 Å²	65.6	86%	0.856	34%	0.335	S	S	*	.	S	Bend	trans	-51.1	-24.6	-170	-74.5	-29.2	0	0	0	114.3
237	T	59.3	Low	66	Low	99 Å²	99	60 Å²	60	61%	0.607	31%	0.305	S	S	*	.	S	Bend	trans	-122	-16.3	176.9	53	0	0	0	0	114.8	H235	H235-T237 PolarHBondContact O-N 3.48Å
238	D	65.2	Low	66.2	Low	54 Å²	54	59.9 Å²	59.9	29%	0.289	31%	0.305	S	S	.	.			trans	-94.1	123.4	-165.8	-60.2	-15.7	0	0	0	111.1	T233 F234 H235	T233-D238 WeakPolarHBondContact CA-O 3.21Å; F234-D238 PolarHBondContact N-O 2.89Å; H235-D238 HydrophobicContact CB-CB 4.17Å; H235-D238 PolarHBondContact O-N 2.83Å; H235-D238 VanDerWaalsContact O-N 3.1Å
239	R	69.5	Low	66.5	Low	15 Å²	15	63 Å²	63	6%	0.057	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	137.7	-179.8	-59.9	166.3	-72.2	-160.4	-8.6	109.8	S102 D103 F142 D144 F170	S102-R239 WeakPolarHBondContact CA-O 3.48Å; S102-R239 WeakPolarHBondContact CB-O 3.43Å; D103-R239 PolarHBondContact N-O 2.91Å; D103-R239 IonicContact OD1-CZ 3.85Å; D103-R239 IonicContact OD1-NE 3.66Å; D103-R239 PolarHBondContact OD1-NE 3.27Å; D103-R239 IonicContact OD1-NH2 2.79Å; D103-R239 PolarHBondContact OD1-NH2 3.4Å; D103-R239 WeakPolarHBondContact OD2-CB 3.24Å; D103-R239 IonicContact OD2-CZ 3.24Å; D103-R239 PolarHBondContact OD2-N 2.92Å; D103-R239 IonicContact OD2-NE 3.23Å; D103-R239 PolarHBondContact OD2-NE 3.48Å; D103-R239 IonicContact OD2-NH2 3.55Å; F142-R239 VanDerWaalsContact CB-CZ 3.42Å; F142-R239 HydrophobicContact CE2-CB 3.94Å; F142-R239 HydrophobicContact CZ-CB 4Å; D144-R239 IonicContact OD1-CZ 3.54Å; D144-R239 IonicContact OD1-NH1 3.54Å; D144-R239 PolarHBondContact OD1-NH1 2.8Å; D144-R239 IonicContact OD1-NH2 2.76Å; D144-R239 IonicContact OD2-CZ 3.31Å; D144-R239 IonicContact OD2-NH1 2.73Å; D144-R239 IonicContact OD2-NH2 3.53Å; D144-R239 PolarHBondContact OD2-NH2 3.18Å; F170-R239 VanDerWaalsContact CB-NH1 3.33Å
240	L	70.2	Confident	66.7	Low	24 Å²	24	61.5 Å²	61.5	13%	0.126	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	116.3	169.1	177.7	64.2	0	0	0	108.6	L107 C231 R232	L107-L240 HydrophobicContact CD2-CD1 3.95Å; C231-L240 CarbonylContact C-O 3.53Å; C231-L240 WeakPolarHBondContact CA-O 3.3Å; R232-L240 HydrophobicContact CG-CB 4.33Å; R232-L240 PolarHBondContact N-O 3.03Å; R232-L240 PolarHBondContact O-N 2.98Å
241	C	71.6	Confident	67.4	Low	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	146.3	175	-68.7	0	0	0	0	111.2	T100 F101 F142 H230 C231	T100-C241 CarbonylContact C-O 3.02Å; T100-C241 VanDerWaalsContact CA-O 3.29Å; T100-C241 WeakPolarHBondContact CA-O 3.32Å; F101-C241 HydrophobicContact CD1-CB 3.97Å; F101-C241 HydrophobicContact CD2-CB 3.76Å; F101-C241 HydrophobicContact CE1-CB 3.53Å; F101-C241 HydrophobicContact CE2-CB 3.33Å; F101-C241 HydrophobicContact CG-CB 4.07Å; F101-C241 HydrophobicContact CZ-CB 3.18Å; F101-C241 PolarHBondContact N-O 3.04Å; F101-C241 PolarHBondContact O-N 3.25Å; F142-C241 HydrophobicContact CE1-CB 4.19Å; F142-C241 WeakPolarHBondContact CE1-SG 3.37Å; F142-C241 HydrophobicContact CZ-CB 4.11Å; H230-C241 CarbonylContact O-C 3.49Å; H230-C241 VanDerWaalsContact O-CA 3.27Å; H230-C241 WeakPolarHBondContact O-CA 3.43Å; C231-C241 HydrophobicContact CB-CB 4.13Å; C231-C241 WeakPolarHBondContact CB-SG 3.5Å; C231-C241 WeakPolarHBondContact SG-CB 3.48Å; C231-C241 CovalentContact SG-SG 2.03Å; C231-C241 PolarHBondContact SG-SG 2.99Å
242	V	69.8	Low	67.9	Low	55 Å²	55	58.6 Å²	58.6	33%	0.333	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	115.4	176	-168.7	0	0	0	0	107.8	R99 T100 V229 H230	R99-V242 CarbonylContact O-C 3.49Å; R99-V242 WeakPolarHBondContact O-CA 3.29Å; T100-V242 HydrophobicContact CG2-CG1 4.25Å; T100-V242 HydrophobicContact CG2-CG2 4.02Å; V229-V242 WeakPolarHBondContact CA-O 3.24Å; H230-V242 PolarHBondContact N-O 3.49Å; H230-V242 PolarHBondContact O-N 3.37Å
243	A	70.8	Confident	68.7	Low	3 Å²	3	53.1 Å²	53.1	3%	0.025	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	131.6	171.1	0	0	0	0	0	109.7	A98 R99 F101 M180 V227 F228 V229	A98-A243 CarbonylContact C-O 3.48Å; A98-A243 WeakPolarHBondContact CA-O 3.38Å; R99-A243 PolarHBondContact N-O 3.28Å; R99-A243 PolarHBondContact O-N 3.31Å; F101-A243 HydrophobicContact CE1-CB 3.93Å; M180-A243 HydrophobicContact SD-CB 3.63Å; V227-A243 HydrophobicContact CG1-CB 4.13Å; F228-A243 CarbonylContact O-C 3.58Å; F228-A243 VanDerWaalsContact O-CA 3.26Å; F228-A243 WeakPolarHBondContact O-CA 3.48Å; V229-A243 HydrophobicContact CG2-CB 4.1Å
244	N	66.3	Low	69.3	Low	52 Å²	52	53.2 Å²	53.2	28%	0.278	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	137.1	-179.6	-167	11.7	0	0	0	111.4	S97 A98 V227 F228	S97-N244 PolarHBondContact O-OD1 3.47Å; S97-N244 VanDerWaalsContact O-OD1 3.11Å; A98-N244 HydrophobicContact CB-CB 4.28Å; V227-N244 WeakPolarHBondContact CA-O 3.38Å; F228-N244 PolarHBondContact N-O 3.17Å; F228-N244 PolarHBondContact O-N 3.02Å
245	S	69.3	Low	70.1	Confident	6 Å²	6	48.7 Å²	48.7	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.6	177.9	57	0	0	0	0	112.1	S97 P182 L247	S97-S245 PolarHBondContact O-N 3.03Å; S97-S245 VanDerWaalsContact O-N 3.14Å; S97-S245 PolarHBondContact O-OG 3Å; P182-S245 VanDerWaalsContact CD-CB 3.43Å; S245-L247 PolarHBondContact O-N 3.49Å; S245-L247 VanDerWaalsContact O-N 3.12Å
246	L	66.2	Low	70.5	Confident	81 Å²	81	47.9 Å²	47.9	42%	0.424	26%	0.263	S	S	.	.			trans	-83.3	40.5	178.8	-79.3	-175	0	0	0	114.2	F225 N226 F228 P248	F225-L246 VanDerWaalsContact CD1-O 3.23Å; F225-L246 WeakPolarHBondContact CD1-O 3.37Å; N226-L246 PolarHBondContact O-N 2.91Å; F228-L246 HydrophobicContact CD2-CD1 4.07Å; F228-L246 HydrophobicContact CD2-CG 3.83Å; F228-L246 HydrophobicContact CE2-CB 4.39Å; F228-L246 HydrophobicContact CE2-CD1 3.12Å; F228-L246 HydrophobicContact CE2-CD2 4.35Å; F228-L246 HydrophobicContact CE2-CG 3.36Å; F228-L246 HydrophobicContact CZ-CD1 3.57Å; F228-L246 HydrophobicContact CZ-CG 4.26Å; L246-P248 WeakPolarHBondContact O-CD 3.48Å
247	L	72.9	Confident	70.7	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.264	C	S	.	.			trans	-64.8	125.7	174.8	-168.6	64.4	0	0	0	109.7	F114 P182 I184 V191 F225 S245 W251 R252	F114-L247 HydrophobicContact CD2-CD2 3.75Å; F114-L247 HydrophobicContact CE2-CD2 3.53Å; F114-L247 HydrophobicContact CZ-CD2 4.18Å; P182-L247 HydrophobicContact CB-CD2 4.36Å; P182-L247 HydrophobicContact CG-CB 4.08Å; P182-L247 HydrophobicContact CG-CD1 4.35Å; P182-L247 HydrophobicContact CG-CD2 4.26Å; P182-L247 HydrophobicContact CG-CG 4.48Å; I184-L247 HydrophobicContact CD1-CD1 3.73Å; I184-L247 HydrophobicContact CG1-CD1 3.97Å; V191-L247 HydrophobicContact CG1-CD2 3.9Å; F225-L247 HydrophobicContact CD2-CD1 3.98Å; F225-L247 HydrophobicContact CE2-CD1 3.82Å; F225-L247 HydrophobicContact CZ-CD1 4.27Å; S245-L247 PolarHBondContact O-N 3.49Å; S245-L247 VanDerWaalsContact O-N 3.12Å; L247-W251 HydrophobicContact CD1-CB 3.9Å; L247-W251 HydrophobicContact CD2-CB 4.33Å; L247-W251 HydrophobicContact CG-CB 3.96Å; L247-R252 HydrophobicContact CB-CG 4Å; L247-R252 HydrophobicContact CD2-CG 3.65Å; L247-R252 HydrophobicContact CG-CG 3.89Å; L247-R252 PolarHBondContact O-NE 2.85Å; L247-R252 PolarHBondContact O-NH2 2.87Å
248	P	72.1	Confident	70.6	Confident	29 Å²	29	47.5 Å²	47.5	19%	0.188	25%	0.253	C	S	.	.			trans	-61.1	153	180	-20.5	31	0	0	0	111	T45 F225 L246 S250 W251 R252	T45-P248 HydrophobicContact CG2-CG 4.19Å; F225-P248 HydrophobicContact CE1-CG 3.79Å; F225-P248 HydrophobicContact CZ-CG 4.2Å; L246-P248 WeakPolarHBondContact O-CD 3.48Å; P248-S250 PolarHBondContact O-N 3.26Å; P248-W251 PolarHBondContact O-N 3.4Å; P248-R252 PolarHBondContact O-N 2.93Å
249	R	68.9	Low	69.8	Low	150 Å²	150	56.2 Å²	56.2	57%	0.566	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-61.4	-34.3	-176.9	-70.8	-177.8	-177.4	-173.6	-3.1	112.6	W251 R252 N375	R249-W251 PolarHBondContact O-N 2.82Å; R249-W251 VanDerWaalsContact O-N 3.14Å; R249-R252 PolarHBondContact O-N 3.43Å; R249-N375 PolarHBondContact NH2-O 3.06Å
250	S	72.1	Confident	68.7	Low	10 Å²	10	62 Å²	62	7%	0.07	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-58.8	-20.5	175.2	46.8	0	0	0	0	113.6	F59 C60 P248	F59-S250 CarbonylContact C-O 3.46Å; F59-S250 WeakPolarHBondContact CA-O 3.45Å; C60-S250 PolarHBondContact N-O 3.35Å; C60-S250 VanDerWaalsContact SG-CB 3.53Å; P248-S250 PolarHBondContact O-N 3.26Å
251	W	77	Confident	67.2	Low	5 Å²	5	67.4 Å²	67.4	2%	0.019	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-106.5	-5.1	177.6	-63.2	101.7	0	0	0	113.4	P46 C60 D61 F77 I184 G189 V191 L247 P248 R249 R253	P46-W251 HydrophobicContact CG-CZ2 4.08Å; C60-W251 HydrophobicContact CB-CD2 4.28Å; C60-W251 HydrophobicContact CB-CE3 4.45Å; C60-W251 HydrophobicContact CB-CH2 4.06Å; C60-W251 HydrophobicContact CB-CZ2 3.84Å; C60-W251 HydrophobicContact CB-CZ3 4.37Å; C60-W251 WeakPolarHBondContact O-CH2 3.44Å; C60-W251 WeakPolarHBondContact O-CZ3 3.32Å; D61-W251 HydrophobicContact CB-CE3 4.45Å; F77-W251 AromaticContact CD1-CH2 3.5Å; F77-W251 HydrophobicContact CD1-CH2 3.5Å; F77-W251 AromaticContact CD1-CZ2 3.82Å; F77-W251 HydrophobicContact CD1-CZ2 3.82Å; F77-W251 HydrophobicContact CD2-CZ2 4.16Å; F77-W251 AromaticContact CE1-CH2 3.43Å; F77-W251 HydrophobicContact CE1-CH2 3.43Å; F77-W251 VanDerWaalsContact CE1-CH2 3.43Å; F77-W251 AromaticContact CE1-CZ2 3.7Å; F77-W251 HydrophobicContact CE1-CZ2 3.7Å; F77-W251 HydrophobicContact CE1-CZ3 4.48Å; F77-W251 HydrophobicContact CE2-CZ2 4.06Å; F77-W251 HydrophobicContact CG-CH2 4.14Å; F77-W251 HydrophobicContact CG-CZ2 4.04Å; F77-W251 HydrophobicContact CZ-CH2 4.03Å; F77-W251 AromaticContact CZ-CZ2 3.83Å; F77-W251 HydrophobicContact CZ-CZ2 3.83Å; I184-W251 HydrophobicContact CD1-CB 4.01Å; I184-W251 HydrophobicContact CD1-CD2 3.51Å; I184-W251 HydrophobicContact CD1-CE3 4.06Å; I184-W251 HydrophobicContact CD1-CG 3.45Å; I184-W251 VanDerWaalsContact CD1-CG 3.45Å; I184-W251 HydrophobicContact CD1-CZ2 4.41Å; I184-W251 HydrophobicContact CG1-CD2 4.35Å; I184-W251 HydrophobicContact CG1-CE3 4.43Å; I184-W251 HydrophobicContact CG1-CG 4.5Å; I184-W251 HydrophobicContact CG2-CD2 4.41Å; I184-W251 HydrophobicContact CG2-CE3 4.1Å; I184-W251 HydrophobicContact CG2-CH2 3.79Å; I184-W251 HydrophobicContact CG2-CZ2 4.15Å; I184-W251 HydrophobicContact CG2-CZ3 3.74Å; G189-W251 VanDerWaalsContact O-CZ3 3.31Å; G189-W251 WeakPolarHBondContact O-CZ3 3.37Å; V191-W251 HydrophobicContact CG2-CB 4.24Å; V191-W251 HydrophobicContact CG2-CE3 3.73Å; V191-W251 HydrophobicContact CG2-CZ3 4.48Å; L247-W251 HydrophobicContact CD1-CB 3.9Å; L247-W251 HydrophobicContact CD2-CB 4.33Å; L247-W251 HydrophobicContact CG-CB 3.96Å; P248-W251 PolarHBondContact O-N 3.4Å; R249-W251 PolarHBondContact O-N 2.82Å; R249-W251 VanDerWaalsContact O-N 3.14Å; W251-R253 PolarHBondContact O-N 3.29Å
252	R	76.9	Confident	65.4	Low	80 Å²	80	75.7 Å²	75.7	30%	0.302	37%	0.372	S	S	.	.			trans	-95.8	73.5	-176.8	-83.1	-172.2	-78.9	170.6	-15.7	112.1	F59 F114 L247 P248 R249	F59-R252 WeakPolarHBondContact CE1-O 3.23Å; F114-R252 HydrophobicContact CB-CB 4.34Å; F114-R252 HydrophobicContact CB-CG 4.25Å; F114-R252 HydrophobicContact CG-CG 4.37Å; L247-R252 HydrophobicContact CB-CG 4Å; L247-R252 HydrophobicContact CD2-CG 3.65Å; L247-R252 HydrophobicContact CG-CG 3.89Å; L247-R252 PolarHBondContact O-NE 2.85Å; L247-R252 PolarHBondContact O-NH2 2.87Å; P248-R252 PolarHBondContact O-N 2.93Å; R249-R252 PolarHBondContact O-N 3.43Å
253	R	79.8	Confident	63.6	Low	9 Å²	9	77.2 Å²	77.2	3%	0.034	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-64.8	126.3	174.4	-172.6	174.8	-71.5	-82.3	10.9	110.5	F59 D61 D69 F114 E115 W251	F59-R253 HydrophobicContact CD1-CB 4.17Å; F59-R253 HydrophobicContact CE1-CB 4.44Å; F59-R253 HydrophobicContact CG-CB 4.38Å; D61-R253 IonicContact OD1-CZ 3.21Å; D61-R253 IonicContact OD1-NE 3.27Å; D61-R253 IonicContact OD1-NH2 2.93Å; D61-R253 PolarHBondContact OD1-NH2 2.92Å; D61-R253 IonicContact OD2-CZ 3.79Å; D61-R253 IonicContact OD2-NE 3.45Å; D61-R253 PolarHBondContact OD2-NE 3.49Å; D61-R253 IonicContact OD2-NH2 3.83Å; D69-R253 IonicContact OD1-CZ 3.79Å; D69-R253 IonicContact OD1-NH1 2.73Å; D69-R253 IonicContact OD1-NH2 3.51Å; D69-R253 PolarHBondContact OD1-NH2 2.96Å; D69-R253 IonicContact OD2-CZ 3.86Å; D69-R253 IonicContact OD2-NH1 3.25Å; D69-R253 PolarHBondContact OD2-NH1 3.48Å; D69-R253 IonicContact OD2-NH2 3.17Å; D69-R253 PolarHBondContact OD2-NH2 3.43Å; F114-R253 CarbonylContact C-O 3.44Å; F114-R253 VanDerWaalsContact CA-O 3.27Å; F114-R253 WeakPolarHBondContact CA-O 3.36Å; E115-R253 HydrophobicContact CB-CB 4.26Å; E115-R253 PolarHBondContact N-O 2.9Å; E115-R253 WeakPolarHBondContact OE2-CD 3.12Å; W251-R253 PolarHBondContact O-N 3.29Å
254	P	77.7	Confident	61.7	Low	58 Å²	58	85.2 Å²	85.2	38%	0.377	42%	0.42	S	S	.	.	B	Isolated β-bridge	trans	-75.2	144.2	-177.3	29	-34.1	0	0	0	112.1	F59 A256 F260	F59-P254 HydrophobicContact CZ-CG 4.28Å; P254-A256 PolarHBondContact O-N 3.26Å; P254-F260 HydrophobicContact CB-CZ 4.26Å
255	C	78.8	Confident	60	Low	14 Å²	14	86.8 Å²	86.8	10%	0.095	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-68.9	125	177	-77.9	0	0	0	0	113.3	C94 W113 N257 K258	C94-C255 WeakPolarHBondContact CA-SG 3.24Å; C94-C255 HydrophobicContact CB-CB 4.19Å; C94-C255 WeakPolarHBondContact CB-SG 3.38Å; C94-C255 WeakPolarHBondContact SG-CB 3.42Å; C94-C255 CovalentContact SG-SG 2.02Å; C94-C255 PolarHBondContact SG-SG 2.92Å; W113-C255 HydrophobicContact CB-CB 4.25Å; C255-N257 VanDerWaalsContact C-N 3.31Å; C255-N257 PolarHBondContact O-N 2.83Å; C255-K258 HydrophobicContact CB-CB 4.34Å
256	A	68.9	Low	58	Low	100 Å²	100	92.2 Å²	92.2	83%	0.826	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-30.3	-176.7	0	0	0	0	0	114.6	P254	P254-A256 PolarHBondContact O-N 3.26Å
257	N	61	Low	56.1	Low	164 Å²	164	96.5 Å²	96.5	88%	0.877	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	7.1	-170.2	-78.7	-15.9	0	0	0	115.5	C255	C255-N257 VanDerWaalsContact C-N 3.31Å; C255-N257 PolarHBondContact O-N 2.83Å
258	K	57.8	Low	54.1	Low	88 Å²	88	102.8 Å²	102.8	38%	0.383	52%	0.515	S	S	.	.			trans	-114.5	103	174.7	-68.2	-168.1	178.6	-178.5	0	109	C94 W113 C255 F260	C94-K258 HydrophobicContact CB-CD 4.29Å; W113-K258 HydrophobicContact CD2-CD 3.63Å; W113-K258 HydrophobicContact CE3-CD 3.92Å; W113-K258 HydrophobicContact CG-CD 4.01Å; W113-K258 HydrophobicContact CH2-CD 4.32Å; W113-K258 HydrophobicContact CZ2-CD 4.06Å; W113-K258 HydrophobicContact CZ3-CD 4.28Å; C255-K258 HydrophobicContact CB-CB 4.34Å; K258-F260 PolarHBondContact O-N 2.83Å
259	R	47.5	Very low	52	Low	236 Å²	236	107.1 Å²	107.1	89%	0.891	54%	0.541	S	S	*	.			trans	-56.6	131.2	170.2	-100.4	-177.4	-177.4	170.6	2.2	108	L261	R259-L261 PolarHBondContact O-N 3.38Å
260	F	46.2	Very low	49.9	Very low	136 Å²	136	108.8 Å²	108.8	60%	0.596	55%	0.553	S	S	*	*			trans	-55.5	91.2	164.1	-65	-89.3	0	0	0	108.3	P254 K258 K262	P254-F260 HydrophobicContact CB-CZ 4.26Å; K258-F260 PolarHBondContact O-N 2.83Å; F260-K262 PolarHBondContact O-N 3.42Å
261	L	38.6	Very low	48.1	Very low	139 Å²	139	110.9 Å²	110.9	73%	0.728	57%	0.567	S	S	*	*			trans	-68.4	87.4	157.7	-82.5	151.3	0	0	0	104.5	R259	R259-L261 PolarHBondContact O-N 3.38Å
262	K	34.8	Very low	46.5	Very low	174 Å²	174	113.8 Å²	113.8	76%	0.757	58%	0.583	S	S	*	*			trans	-44.6	135.5	157.8	-100.5	-178.1	175.1	-179.7	0	105.7	F260 Q264	F260-K262 PolarHBondContact O-N 3.42Å; K262-Q264 PolarHBondContact O-N 3.2Å
263	P	32.3	Very low	45.2	Very low	87 Å²	87	110.6 Å²	110.6	57%	0.565	57%	0.573	S	S	*	*			trans	-48.7	111.5	173.6	20.2	-30.3	0	0	0	106.9	S265	P263-S265 PolarHBondContact O-N 2.78Å
264	Q	30.1	Very low	44.2	Very low	171 Å²	171	116.5 Å²	116.5	80%	0.799	60%	0.601	S	S	*	*			trans	-71	90.1	174.4	-167.3	175.3	24.4	0	0	103.1	K262 T266	K262-Q264 PolarHBondContact O-N 3.2Å; Q264-T266 VanDerWaalsContact C-N 3.26Å; Q264-T266 PolarHBondContact O-N 3.14Å
265	S	30.3	Very low	43.7	Very low	85 Å²	85	113.9 Å²	113.9	59%	0.594	58%	0.584	S	S	*	*			trans	-24.6	83.6	174.2	155.9	0	0	0	0	112.1	P263 Q267	P263-S265 PolarHBondContact O-N 2.78Å; S265-Q267 PolarHBondContact O-N 3.27Å
266	T	28.3	Very low	43.5	Very low	120 Å²	120	115.8 Å²	115.8	74%	0.736	59%	0.59	S	S	*	*			trans	-82	102.1	155.5	47.3	0	0	0	0	104.2	Q264	Q264-T266 VanDerWaalsContact C-N 3.26Å; Q264-T266 PolarHBondContact O-N 3.14Å
267	Q	26.8	Very low	44	Very low	171 Å²	171	111.4 Å²	111.4	80%	0.799	55%	0.552	S	S	*	*	S	Bend	trans	43.9	100	160	-86.3	148.9	-59.3	0	0	115.1	S265	S265-Q267 PolarHBondContact O-N 3.27Å
268	E	30.6	Very low	44.8	Very low	132 Å²	132	105.1 Å²	105.1	62%	0.617	52%	0.518	S	S	*	.				-147.1	100.1	71.6	-61.2	-167.8	156.5	0	0	111.8	F270	E268-F270 PolarHBondContact O-N 3Å; E268-F270 VanDerWaalsContact O-N 3.1Å
269	V	27.8	Very low	45.7	Very low	121 Å²	121	101.5 Å²	101.5	73%	0.733	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	20.1	165.3	-179.6	0	0	0	0	111.2
270	F	25.3	Very low	47.4	Very low	184 Å²	184	90.4 Å²	90.4	81%	0.807	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.4	48.8	170.4	-82.7	-77.2	0	0	0	111.9	E268 L272	E268-F270 PolarHBondContact O-N 3Å; E268-F270 VanDerWaalsContact O-N 3.1Å; F270-L272 PolarHBondContact O-N 3.41Å
271	S	34.1	Very low	49.1	Very low	54 Å²	54	84.2 Å²	84.2	38%	0.378	43%	0.434	S	S	.	.			trans	-82.5	94.3	154.9	-165.4	0	0	0	0	107.2	S273	S271-S273 PolarHBondContact O-N 3Å; S271-S273 VanDerWaalsContact O-N 3.17Å
272	L	43.5	Very low	50.9	Low	66 Å²	66	78.3 Å²	78.3	35%	0.346	40%	0.403	S	S	.	.			trans	-45.8	123.3	157.4	-125.7	92.3	0	0	0	105.2	F270 E274 D313 L317	F270-L272 PolarHBondContact O-N 3.41Å; L272-E274 PolarHBondContact O-N 3.42Å; L272-D313 HydrophobicContact CD2-CB 3.93Å; L272-L317 HydrophobicContact CD1-CD2 4.16Å
273	S	48.5	Very low	52.7	Low	14 Å²	14	72.6 Å²	72.6	10%	0.098	38%	0.381	C	S	.	.			trans	-37.2	140.8	-171	44.9	0	0	0	0	113	S271 F275	S271-S273 PolarHBondContact O-N 3Å; S271-S273 VanDerWaalsContact O-N 3.17Å; S273-F275 CarbonylContact O-C 3.48Å; S273-F275 PolarHBondContact O-N 3.23Å; S273-F275 PolarHBondContact OG-O 3.33Å
274	E	59.4	Low	54.3	Low	132 Å²	132	68.5 Å²	68.5	62%	0.617	35%	0.354	S	S	*	.	S	Bend	trans	-45.4	-24.6	168.7	-77.6	172.8	-176.2	0	0	112.5	L272	L272-E274 PolarHBondContact O-N 3.42Å
275	F	66.6	Low	55.9	Low	3 Å²	3	65.5 Å²	65.5	1%	0.013	34%	0.34	C	S	.	.	S	Bend	trans	-95	116.8	175.7	-174.4	-109.2	0	0	0	113.1	S273 E279 F280 L366 L388 W543	S273-F275 CarbonylContact O-C 3.48Å; S273-F275 PolarHBondContact O-N 3.23Å; S273-F275 PolarHBondContact OG-O 3.33Å; F275-E279 HydrophobicContact CD2-CB 4.26Å; F275-E279 WeakPolarHBondContact CD2-OE2 3.26Å; F275-E279 HydrophobicContact CE2-CB 3.92Å; F275-F280 HydrophobicContact CD1-CZ 4.47Å; F275-F280 HydrophobicContact CE1-CD1 4.03Å; F275-F280 AromaticContact CE1-CE1 3.35Å; F275-F280 HydrophobicContact CE1-CE1 3.35Å; F275-F280 HydrophobicContact CE1-CE2 4.1Å; F275-F280 AromaticContact CE1-CZ 3.37Å; F275-F280 HydrophobicContact CE1-CZ 3.37Å; F275-F280 AromaticContact CZ-CD1 3.64Å; F275-F280 HydrophobicContact CZ-CD1 3.64Å; F275-F280 AromaticContact CZ-CE1 3.41Å; F275-F280 HydrophobicContact CZ-CE1 3.41Å; F275-F280 VanDerWaalsContact CZ-CE1 3.41Å; F275-F280 HydrophobicContact CZ-CG 4.3Å; F275-F280 AromaticContact CZ-CZ 3.89Å; F275-F280 HydrophobicContact CZ-CZ 3.89Å; F275-L366 HydrophobicContact CB-CD2 4.14Å; F275-L366 HydrophobicContact CD1-CD2 3.6Å; F275-L366 HydrophobicContact CG-CD2 4.31Å; F275-L388 HydrophobicContact CE1-CD2 4.05Å; F275-W543 HydrophobicContact CD2-CB 4.22Å; F275-W543 HydrophobicContact CE2-CB 3.41Å; F275-W543 VanDerWaalsContact CE2-CB 3.41Å; F275-W543 AromaticContact CE2-CD1 3.87Å; F275-W543 HydrophobicContact CE2-CD2 4.47Å; F275-W543 AromaticContact CE2-CG 3.64Å; F275-W543 HydrophobicContact CE2-CG 3.64Å; F275-W543 HydrophobicContact CZ-CB 3.64Å; F275-W543 AromaticContact CZ-CD2 3.99Å; F275-W543 HydrophobicContact CZ-CD2 3.99Å; F275-W543 HydrophobicContact CZ-CE3 4.48Å; F275-W543 AromaticContact CZ-CG 3.61Å; F275-W543 HydrophobicContact CZ-CG 3.61Å
276	K	75.1	Confident	57.2	Low	54 Å²	54	63.1 Å²	63.1	24%	0.235	32%	0.321	C	S	.	.			trans	-100.9	156.3	-179	-58.2	179.4	-179.3	-161	0	112.9	H278 E279 D313	K276-H278 VanDerWaalsContact C-N 3.29Å; K276-H278 PolarHBondContact O-N 2.72Å; K276-E279 HydrophobicContact CB-CG 4.39Å; K276-E279 VanDerWaalsContact CB-OE1 3.29Å; K276-E279 WeakPolarHBondContact CB-OE1 3.23Å; K276-E279 WeakPolarHBondContact CG-OE1 3.22Å; K276-E279 PolarHBondContact N-OE1 3.4Å; K276-E279 WeakPolarHBondContact O-CB 3.35Å; K276-E279 PolarHBondContact O-N 2.92Å; K276-D313 IonicContact NZ-OD2 3.68Å; K276-D313 PolarHBondContact NZ-OD2 3.27Å
277	W	78.8	Confident	58.7	Low	8 Å²	8	58.1 Å²	58.1	3%	0.03	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-61.8	-31	-176.8	-168.5	-88.8	0	0	0	114.2	E279 F280 Q316 L359 L360 Y363 W626	W277-E279 PolarHBondContact O-N 3.02Å; W277-F280 AromaticContact CD2-CD2 3.99Å; W277-F280 HydrophobicContact CD2-CD2 3.99Å; W277-F280 AromaticContact CD2-CE2 3.81Å; W277-F280 HydrophobicContact CD2-CE2 3.81Å; W277-F280 HydrophobicContact CE3-CD2 4.23Å; W277-F280 AromaticContact CE3-CE2 3.57Å; W277-F280 HydrophobicContact CE3-CE2 3.57Å; W277-F280 HydrophobicContact CG-CD2 4.13Å; W277-F280 HydrophobicContact CG-CE2 4.26Å; W277-F280 AromaticContact CZ3-CE2 3.97Å; W277-F280 HydrophobicContact CZ3-CE2 3.97Å; W277-F280 WeakPolarHBondContact O-CD2 3.47Å; W277-Q316 HydrophobicContact CB-CG 4.3Å; W277-L359 HydrophobicContact CH2-CD2 4.06Å; W277-L359 HydrophobicContact CH2-CG 4.17Å; W277-L359 HydrophobicContact CZ2-CD2 4.47Å; W277-L360 HydrophobicContact CH2-CD2 3.72Å; W277-L360 HydrophobicContact CZ2-CD2 4.43Å; W277-L360 HydrophobicContact CZ3-CD2 4.07Å; W277-Y363 HydrophobicContact CB-CE2 4.38Å; W277-Y363 AromaticContact CE3-CD1 3.4Å; W277-Y363 HydrophobicContact CE3-CD1 3.4Å; W277-Y363 AromaticContact CE3-CD2 3.63Å; W277-Y363 HydrophobicContact CE3-CD2 3.63Å; W277-Y363 AromaticContact CE3-CE1 3.56Å; W277-Y363 HydrophobicContact CE3-CE1 3.56Å; W277-Y363 AromaticContact CE3-CE2 3.81Å; W277-Y363 HydrophobicContact CE3-CE2 3.81Å; W277-Y363 AromaticContact CE3-CG 3.43Å; W277-Y363 HydrophobicContact CE3-CG 3.43Å; W277-Y363 VanDerWaalsContact CE3-CG 3.43Å; W277-Y363 AromaticContact CE3-CZ 3.77Å; W277-Y363 AromaticContact CZ3-CD1 3.55Å; W277-Y363 HydrophobicContact CZ3-CD1 3.55Å; W277-Y363 AromaticContact CZ3-CD2 3.96Å; W277-Y363 HydrophobicContact CZ3-CD2 3.96Å; W277-Y363 HydrophobicContact CZ3-CE1 4.2Å; W277-Y363 AromaticContact CZ3-CG 3.41Å; W277-Y363 HydrophobicContact CZ3-CG 3.41Å; W277-Y363 VanDerWaalsContact CZ3-CG 3.41Å; W277-Y363 PolarHBondContact N-OH 3.27Å; W277-W626 HydrophobicContact CZ2-CH2 4.24Å
278	H	78	Confident	59.9	Low	32 Å²	32	52.6 Å²	52.6	15%	0.148	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-71	-22.4	178.4	67.4	-87.9	0	0	0	112.5	K276 F280 V282 A646	K276-H278 VanDerWaalsContact C-N 3.29Å; K276-H278 PolarHBondContact O-N 2.72Å; H278-F280 PolarHBondContact O-N 3.41Å; H278-V282 VanDerWaalsContact O-CG2 3.31Å; H278-V282 WeakPolarHBondContact O-CG2 3.43Å; H278-A646 HydrophobicContact CB-CB 3.58Å
279	E	77.8	Confident	60.5	Low	12 Å²	12	51.4 Å²	51.4	6%	0.056	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-67.5	-16	179.9	-66.7	169.6	-132.2	0	0	112.9	F275 K276 W277 L281 V282 R541	F275-E279 HydrophobicContact CD2-CB 4.26Å; F275-E279 WeakPolarHBondContact CD2-OE2 3.26Å; F275-E279 HydrophobicContact CE2-CB 3.92Å; K276-E279 HydrophobicContact CB-CG 4.39Å; K276-E279 VanDerWaalsContact CB-OE1 3.29Å; K276-E279 WeakPolarHBondContact CB-OE1 3.23Å; K276-E279 WeakPolarHBondContact CG-OE1 3.22Å; K276-E279 PolarHBondContact N-OE1 3.4Å; K276-E279 WeakPolarHBondContact O-CB 3.35Å; K276-E279 PolarHBondContact O-N 2.92Å; W277-E279 PolarHBondContact O-N 3.02Å; E279-L281 VanDerWaalsContact C-N 3.29Å; E279-L281 PolarHBondContact O-N 3.01Å; E279-V282 PolarHBondContact O-N 2.9Å; E279-R541 IonicContact OE2-NH2 3.87Å; E279-R541 PolarHBondContact OE2-NH2 3.28Å
280	F	82.2	Confident	61.4	Low	3 Å²	3	50.5 Å²	50.5	1%	0.013	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-58.2	-35.7	179.9	-79	-57.4	0	0	0	114.6	F275 W277 H278 Y363 L388 F392 W543 F550 F554	F275-F280 HydrophobicContact CD1-CZ 4.47Å; F275-F280 HydrophobicContact CE1-CD1 4.03Å; F275-F280 AromaticContact CE1-CE1 3.35Å; F275-F280 HydrophobicContact CE1-CE1 3.35Å; F275-F280 HydrophobicContact CE1-CE2 4.1Å; F275-F280 AromaticContact CE1-CZ 3.37Å; F275-F280 HydrophobicContact CE1-CZ 3.37Å; F275-F280 AromaticContact CZ-CD1 3.64Å; F275-F280 HydrophobicContact CZ-CD1 3.64Å; F275-F280 AromaticContact CZ-CE1 3.41Å; F275-F280 HydrophobicContact CZ-CE1 3.41Å; F275-F280 VanDerWaalsContact CZ-CE1 3.41Å; F275-F280 HydrophobicContact CZ-CG 4.3Å; F275-F280 AromaticContact CZ-CZ 3.89Å; F275-F280 HydrophobicContact CZ-CZ 3.89Å; W277-F280 AromaticContact CD2-CD2 3.99Å; W277-F280 HydrophobicContact CD2-CD2 3.99Å; W277-F280 AromaticContact CD2-CE2 3.81Å; W277-F280 HydrophobicContact CD2-CE2 3.81Å; W277-F280 HydrophobicContact CE3-CD2 4.23Å; W277-F280 AromaticContact CE3-CE2 3.57Å; W277-F280 HydrophobicContact CE3-CE2 3.57Å; W277-F280 HydrophobicContact CG-CD2 4.13Å; W277-F280 HydrophobicContact CG-CE2 4.26Å; W277-F280 AromaticContact CZ3-CE2 3.97Å; W277-F280 HydrophobicContact CZ3-CE2 3.97Å; W277-F280 WeakPolarHBondContact O-CD2 3.47Å; H278-F280 PolarHBondContact O-N 3.41Å; F280-Y363 AromaticContact CE2-CD2 3.99Å; F280-Y363 HydrophobicContact CE2-CD2 3.99Å; F280-Y363 HydrophobicContact CE2-CE2 4.27Å; F280-Y363 HydrophobicContact CZ-CD2 4.05Å; F280-L388 HydrophobicContact CE1-CD1 3.93Å; F280-L388 HydrophobicContact CE1-CD2 3.39Å; F280-L388 HydrophobicContact CE1-CG 3.6Å; F280-L388 HydrophobicContact CZ-CD1 3.72Å; F280-L388 HydrophobicContact CZ-CD2 3.81Å; F280-L388 HydrophobicContact CZ-CG 3.95Å; F280-F392 HydrophobicContact CB-CE2 3.72Å; F280-F392 HydrophobicContact CB-CZ 3.94Å; F280-F392 HydrophobicContact CD1-CD2 4.2Å; F280-F392 AromaticContact CD1-CE2 3.9Å; F280-F392 HydrophobicContact CD1-CE2 3.9Å; F280-F392 AromaticContact CD2-CE2 3.85Å; F280-F392 HydrophobicContact CD2-CE2 3.85Å; F280-F392 HydrophobicContact CE1-CD2 4.49Å; F280-F392 HydrophobicContact CE1-CE2 4.48Å; F280-F392 HydrophobicContact CE2-CE2 4.48Å; F280-F392 HydrophobicContact CG-CD2 4.31Å; F280-F392 AromaticContact CG-CE2 3.57Å; F280-F392 HydrophobicContact CG-CE2 3.57Å; F280-F392 HydrophobicContact CG-CZ 4.3Å; F280-W543 HydrophobicContact CB-CZ2 4.45Å; F280-W543 AromaticContact CD1-CD2 3.98Å; F280-W543 HydrophobicContact CD1-CD2 3.98Å; F280-W543 AromaticContact CD1-CE2 3.74Å; F280-W543 HydrophobicContact CD1-CE3 4.1Å; F280-W543 AromaticContact CD1-CH2 3.72Å; F280-W543 HydrophobicContact CD1-CH2 3.72Å; F280-W543 AromaticContact CD1-CZ2 3.62Å; F280-W543 HydrophobicContact CD1-CZ2 3.62Å; F280-W543 AromaticContact CD1-CZ3 3.96Å; F280-W543 HydrophobicContact CD1-CZ3 3.96Å; F280-W543 HydrophobicContact CE1-CD2 4.25Å; F280-W543 HydrophobicContact CE1-CE3 4.01Å; F280-W543 HydrophobicContact CE1-CH2 4.14Å; F280-W543 HydrophobicContact CE1-CZ2 4.41Å; F280-W543 AromaticContact CE1-CZ3 3.94Å; F280-W543 HydrophobicContact CE1-CZ3 3.94Å; F280-W543 WeakPolarHBondContact O-CZ2 3.04Å; F280-W543 PolarHBondContact O-NE1 3.44Å; F280-F550 WeakPolarHBondContact O-CE2 3.4Å; F280-F554 VanDerWaalsContact O-CE1 3.31Å; F280-F554 WeakPolarHBondContact O-CE1 3.42Å
281	L	81.5	Confident	62.3	Low	7 Å²	7	47.5 Å²	47.5	4%	0.037	24%	0.237	C	C	.	.	S	Bend	trans	-113.1	1	-176.4	-77.3	166.1	0	0	0	113.2	E279 F554 L555 T558 W626 Q629 L630 S633	E279-L281 VanDerWaalsContact C-N 3.29Å; E279-L281 PolarHBondContact O-N 3.01Å; L281-F554 HydrophobicContact CD2-CE1 3.78Å; L281-F554 HydrophobicContact CD2-CZ 4.44Å; L281-F554 HydrophobicContact CG-CE1 4.47Å; L281-L555 HydrophobicContact CD2-CD1 4.26Å; L281-T558 HydrophobicContact CD2-CG2 4.47Å; L281-W626 HydrophobicContact CD1-CE3 3.88Å; L281-W626 HydrophobicContact CD1-CZ3 4.16Å; L281-Q629 HydrophobicContact CB-CG 4.34Å; L281-Q629 HydrophobicContact CD1-CB 4.09Å; L281-Q629 HydrophobicContact CD1-CG 3.4Å; L281-Q629 VanDerWaalsContact CD1-CG 3.4Å; L281-Q629 HydrophobicContact CG-CG 4.45Å; L281-L630 HydrophobicContact CD2-CD1 4.3Å; L281-S633 VanDerWaalsContact O-CB 3.3Å; L281-S633 WeakPolarHBondContact O-CB 3.32Å
282	V	76.4	Confident	62.4	Low	15 Å²	15	47.6 Å²	47.6	9%	0.091	25%	0.246	C	C	.	.	S	Bend	trans	-84.8	137.7	176.1	175.8	0	0	0	0	109.1	H278 E279 N286 Y287	H278-V282 VanDerWaalsContact O-CG2 3.31Å; H278-V282 WeakPolarHBondContact O-CG2 3.43Å; E279-V282 PolarHBondContact O-N 2.9Å; V282-N286 HydrophobicContact CG1-CB 4.21Å; V282-Y287 HydrophobicContact CB-CD1 4.44Å; V282-Y287 HydrophobicContact CG1-CD1 4.18Å
283	L	72.9	Confident	62.2	Low	54 Å²	54	49.1 Å²	49.1	28%	0.283	25%	0.254	S	S	.	.			trans	-60	137.7	176.7	-73.2	164.6	0	0	0	110.6	Q285 N286 F550 I551	L283-Q285 PolarHBondContact O-N 3.23Å; L283-N286 PolarHBondContact O-N 3.38Å; L283-F550 HydrophobicContact CD2-CD1 4.09Å; L283-F550 HydrophobicContact CD2-CE1 4.2Å; L283-I551 HydrophobicContact CD2-CD1 4.36Å; L283-I551 HydrophobicContact CD2-CG1 4.23Å
284	P	66.9	Low	61.7	Low	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-55.6	-28.7	-175.5	-25.2	30.9	0	0	0	116.1	Y287 I288 F544 T545 H547 F550	P284-Y287 HydrophobicContact CB-CE1 3.91Å; P284-Y287 WeakPolarHBondContact CB-OH 3.31Å; P284-Y287 HydrophobicContact CG-CE1 4.26Å; P284-I288 WeakPolarHBondContact O-CB 3.5Å; P284-I288 VanDerWaalsContact O-CD1 3.27Å; P284-I288 WeakPolarHBondContact O-CD1 3.37Å; P284-I288 WeakPolarHBondContact O-CG1 3.49Å; P284-I288 PolarHBondContact O-N 2.94Å; P284-F544 HydrophobicContact CG-CB 4.48Å; P284-F544 WeakPolarHBondContact CG-O 3.21Å; P284-T545 WeakPolarHBondContact CB-O 3.49Å; P284-H547 WeakPolarHBondContact CB-ND1 3.27Å; P284-F550 HydrophobicContact CG-CB 3.91Å; P284-F550 HydrophobicContact CG-CD1 4.39Å; P284-F550 HydrophobicContact CG-CG 4.07Å
285	Q	62.3	Low	60.9	Low	108 Å²	108	54.2 Å²	54.2	51%	0.505	28%	0.284	S	S	.	.	H	α-helix	trans	-68.7	-47.2	-173.7	-126	148.9	18.5	0	0	109.1	L283 Y287 I288 E289 H547	L283-Q285 PolarHBondContact O-N 3.23Å; Q285-Y287 PolarHBondContact O-N 3.49Å; Q285-I288 PolarHBondContact O-N 3.31Å; Q285-E289 WeakPolarHBondContact O-CB 3.47Å; Q285-E289 PolarHBondContact O-N 2.87Å; Q285-H547 WeakPolarHBondContact CA-CE1 3.3Å; Q285-H547 WeakPolarHBondContact CB-CE1 2.92Å; Q285-H547 WeakPolarHBondContact CG-CE1 2.94Å; Q285-H547 WeakPolarHBondContact CG-NE2 3.47Å; Q285-H547 PolarHBondContact N-CE1 2.06Å; Q285-H547 PolarHBondContact N-ND1 3.48Å; Q285-H547 PolarHBondContact NE2-CD2 3.37Å; Q285-H547 PolarHBondContact NE2-NE2 3.35Å; Q285-H547 VanDerWaalsContact NE2-NE2 3.2Å; Q285-H547 PolarHBondContact OE1-CD2 2.87Å
286	N	57.6	Low	59.6	Low	36 Å²	36	63.8 Å²	63.8	19%	0.193	33%	0.329	C	S	.	.	H	α-helix	trans	-65.6	-42.2	-174.2	-62	-14.2	0	0	0	111.1	V282 L283 E289 F290	V282-N286 HydrophobicContact CG1-CB 4.21Å; L283-N286 PolarHBondContact O-N 3.38Å; N286-E289 PolarHBondContact O-N 2.98Å; N286-F290 WeakPolarHBondContact O-CD2 3.04Å; N286-F290 WeakPolarHBondContact O-CG 3.33Å; N286-F290 PolarHBondContact O-N 3.03Å
287	Y	61.7	Low	58.1	Low	14 Å²	14	64.3 Å²	64.3	6%	0.055	35%	0.35	C	S	.	.	H	α-helix	trans	-77.4	-26.7	179.5	71.5	-116.3	0	0	0	113.7	V282 P284 Q285 E289 R541 F544	V282-Y287 HydrophobicContact CB-CD1 4.44Å; V282-Y287 HydrophobicContact CG1-CD1 4.18Å; P284-Y287 HydrophobicContact CB-CE1 3.91Å; P284-Y287 WeakPolarHBondContact CB-OH 3.31Å; P284-Y287 HydrophobicContact CG-CE1 4.26Å; Q285-Y287 PolarHBondContact O-N 3.49Å; Y287-E289 VanDerWaalsContact C-N 3.34Å; Y287-R541 VanDerWaalsContact CE2-CZ 3.4Å; Y287-R541 VanDerWaalsContact CE2-NH1 3.29Å; Y287-F544 PolarHBondContact OH-O 2.96Å
288	I	51.2	Low	56.4	Low	55 Å²	55	70 Å²	70	28%	0.282	38%	0.381	S	S	.	.	H	α-helix	trans	-70.9	-38.5	172.5	-65.6	165.8	0	0	0	109.4	P284 Q285 F290 D291	P284-I288 WeakPolarHBondContact O-CB 3.5Å; P284-I288 VanDerWaalsContact O-CD1 3.27Å; P284-I288 WeakPolarHBondContact O-CD1 3.37Å; P284-I288 WeakPolarHBondContact O-CG1 3.49Å; P284-I288 PolarHBondContact O-N 2.94Å; Q285-I288 PolarHBondContact O-N 3.31Å; I288-F290 VanDerWaalsContact C-N 3.35Å; I288-D291 PolarHBondContact O-N 3.46Å
289	E	43.1	Very low	55.1	Low	107 Å²	107	74.7 Å²	74.7	50%	0.5	41%	0.411	S	S	.	.	H	α-helix	trans	-72.8	-27	177.3	-161.8	176.5	-176.6	0	0	112.4	Q285 N286 Y287 D291 G292 L293	Q285-E289 WeakPolarHBondContact O-CB 3.47Å; Q285-E289 PolarHBondContact O-N 2.87Å; N286-E289 PolarHBondContact O-N 2.98Å; Y287-E289 VanDerWaalsContact C-N 3.34Å; E289-D291 PolarHBondContact O-N 2.89Å; E289-G292 WeakPolarHBondContact O-CA 3.45Å; E289-G292 PolarHBondContact O-N 2.71Å; E289-L293 HydrophobicContact CG-CD1 3.57Å; E289-L293 PolarHBondContact O-N 3.31Å; E289-L293 VanDerWaalsContact O-N 3.11Å
290	F	46.2	Very low	53.5	Low	102 Å²	102	83.3 Å²	83.3	45%	0.447	45%	0.448	S	S	.	.	H	α-helix	trans	-60.6	-26	171.7	-92.2	-65.9	0	0	0	113.5	N286 I288 G292 P636 T639	N286-F290 WeakPolarHBondContact O-CD2 3.04Å; N286-F290 WeakPolarHBondContact O-CG 3.33Å; N286-F290 PolarHBondContact O-N 3.03Å; I288-F290 VanDerWaalsContact C-N 3.35Å; F290-G292 VanDerWaalsContact C-N 3.28Å; F290-P636 WeakPolarHBondContact CZ-O 3.39Å; F290-T639 HydrophobicContact CD1-CG2 4.38Å; F290-T639 HydrophobicContact CE1-CG2 3.42Å; F290-T639 VanDerWaalsContact CE1-CG2 3.42Å; F290-T639 HydrophobicContact CE2-CG2 4.32Å; F290-T639 HydrophobicContact CZ-CG2 3.41Å; F290-T639 VanDerWaalsContact CZ-CG2 3.41Å
291	D	44.5	Very low	52.2	Low	122 Å²	122	84.1 Å²	84.1	65%	0.652	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-16.9	172.1	-76.1	-26.2	0	0	0	112.4	I288 E289	I288-D291 PolarHBondContact O-N 3.46Å; E289-D291 PolarHBondContact O-N 2.89Å
292	G	36.8	Very low	51.2	Low	55 Å²	55	85.8 Å²	85.8	57%	0.567	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-11.5	-175.5	0	0	0	0	0	116.2	E289 F290	E289-G292 WeakPolarHBondContact O-CA 3.45Å; E289-G292 PolarHBondContact O-N 2.71Å; F290-G292 VanDerWaalsContact C-N 3.28Å
293	L	38.6	Very low	50.8	Low	98 Å²	98	92.3 Å²	92.3	51%	0.513	50%	0.497	S	S	.	.			trans	-102.7	82.1	-175	-113.6	121.9	0	0	0	112.5	E289	E289-L293 HydrophobicContact CG-CD1 3.57Å; E289-L293 PolarHBondContact O-N 3.31Å; E289-L293 VanDerWaalsContact O-N 3.11Å
294	N	39	Very low	50.8	Low	106 Å²	106	94 Å²	94	57%	0.567	51%	0.51	S	S	*	.			trans	-126.9	77.3	161	-83.3	-37.2	0	0	0	109.9	F167 E296	F167-N294 HydrophobicContact CE1-CB 3.82Å; N294-E296 PolarHBondContact O-N 3.3Å
295	N	42.8	Very low	51.1	Low	147 Å²	147	97.5 Å²	97.5	79%	0.786	53%	0.528	S	S	*	.			trans	-62.4	131.6	164.2	-76.4	-23.3	0	0	0	110.1	G297	N295-G297 PolarHBondContact O-N 3.47Å; N295-G297 VanDerWaalsContact O-N 3.16Å
296	E	37.9	Very low	51.4	Low	204 Å²	204	99 Å²	99	95%	0.953	53%	0.529	S	S	*	.	S	Bend	trans	-52.4	107.3	177	-57.8	176	121.5	0	0	110.9	N294	N294-E296 PolarHBondContact O-N 3.3Å
297	G	43.8	Very low	52.4	Low	66 Å²	66	101.4 Å²	101.4	68%	0.68	55%	0.545	S	S	*	.			trans	-175.2	-16.5	177.9	0	0	0	0	0	120.5	N295	N295-G297 PolarHBondContact O-N 3.47Å; N295-G297 VanDerWaalsContact O-N 3.16Å
298	L	43.5	Very low	53.2	Low	127 Å²	127	104.2 Å²	104.2	67%	0.665	56%	0.56	S	S	*	*			trans	-143.1	57.7	-171.6	-144.2	79.3	0	0	0	115.2	K300 G301 S302	L298-K300 PolarHBondContact O-N 3.02Å; L298-K300 VanDerWaalsContact O-N 3.07Å; L298-G301 PolarHBondContact O-N 3.06Å; L298-G301 VanDerWaalsContact O-N 3.12Å; L298-S302 PolarHBondContact O-N 2.99Å
299	V	50.3	Low	54.4	Low	131 Å²	131	103.5 Å²	103.5	79%	0.794	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-21.7	-174.2	179.8	0	0	0	0	114.5
300	K	44.9	Very low	56.1	Low	192 Å²	192	101.7 Å²	101.7	84%	0.835	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-30.3	174	-80.2	-178.1	177.9	176.3	0	114.7	L298 S302	L298-K300 PolarHBondContact O-N 3.02Å; L298-K300 VanDerWaalsContact O-N 3.07Å; K300-S302 VanDerWaalsContact C-N 3.35Å
301	G	54	Low	58	Low	21 Å²	21	100.9 Å²	100.9	22%	0.216	56%	0.558	C	S	.	*	H	α-helix	trans	-72.2	-30	178.4	0	0	0	0	0	113	L298 K303 T304 I305	L298-G301 PolarHBondContact O-N 3.06Å; L298-G301 VanDerWaalsContact O-N 3.12Å; G301-K303 PolarHBondContact O-N 3Å; G301-T304 PolarHBondContact O-N 2.85Å; G301-I305 VanDerWaalsContact O-CG1 3.3Å; G301-I305 WeakPolarHBondContact O-CG1 3.26Å; G301-I305 PolarHBondContact O-N 3.34Å; G301-I305 VanDerWaalsContact O-N 3.13Å
302	S	61.5	Low	59.9	Low	42 Å²	42	96.4 Å²	96.4	29%	0.294	53%	0.534	S	S	.	.	H	α-helix	trans	-62.1	-36.2	-177.5	177.4	0	0	0	0	114.2	L298 K300 R306	L298-S302 PolarHBondContact O-N 2.99Å; K300-S302 VanDerWaalsContact C-N 3.35Å; S302-R306 WeakPolarHBondContact O-CB 3.33Å; S302-R306 WeakPolarHBondContact O-CG 3.34Å; S302-R306 PolarHBondContact O-N 3.49Å; S302-R306 PolarHBondContact O-NE 2.86Å; S302-R306 PolarHBondContact OG-NE 3.23Å; S302-R306 VanDerWaalsContact OG-NE 3.13Å; S302-R306 PolarHBondContact OG-NH2 3.45Å
303	K	67.2	Low	62	Low	151 Å²	151	94.9 Å²	94.9	66%	0.657	51%	0.513	S	S	*	.	H	α-helix	trans	-69.1	-45.2	179.8	-70	-171.4	180	-175.6	0	112.1	G301 R306 T307	G301-K303 PolarHBondContact O-N 3Å; K303-R306 PolarHBondContact O-N 3.35Å; K303-T307 WeakPolarHBondContact O-CB 3.45Å; K303-T307 PolarHBondContact O-N 3.02Å; K303-T307 PolarHBondContact O-OG1 2.86Å
304	T	73.9	Confident	64.2	Low	90 Å²	90	95.1 Å²	95.1	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-64.3	-43.6	178.7	-50.6	0	0	0	0	111	G301 T307 I308	G301-T304 PolarHBondContact O-N 2.85Å; T304-T307 PolarHBondContact O-N 3.17Å; T304-I308 HydrophobicContact CG2-CD1 4.03Å; T304-I308 VanDerWaalsContact O-CG1 3.3Å; T304-I308 WeakPolarHBondContact O-CG1 3.44Å; T304-I308 PolarHBondContact O-N 3.49Å
305	I	71.7	Confident	66.7	Low	73 Å²	73	93.6 Å²	93.6	37%	0.374	51%	0.505	S	S	.	.	H	α-helix	trans	-62.2	-50	177.7	-66.5	167.5	0	0	0	110.6	G301 T307 I308 E309	G301-I305 VanDerWaalsContact O-CG1 3.3Å; G301-I305 WeakPolarHBondContact O-CG1 3.26Å; G301-I305 PolarHBondContact O-N 3.34Å; G301-I305 VanDerWaalsContact O-N 3.13Å; I305-T307 PolarHBondContact O-N 2.83Å; I305-I308 PolarHBondContact O-N 2.71Å; I305-I308 VanDerWaalsContact O-N 3.11Å; I305-E309 HydrophobicContact CG2-CG 4.34Å; I305-E309 WeakPolarHBondContact O-CG 3.31Å; I305-E309 PolarHBondContact O-N 3.38Å
306	R	70.2	Confident	68.9	Low	141 Å²	141	87.2 Å²	87.2	53%	0.532	47%	0.471	S	S	.	.	H	α-helix	trans	-57	-37.4	176.2	-79.4	-173.5	-90.4	-175.3	-9.1	113	S302 K303 S310	S302-R306 WeakPolarHBondContact O-CB 3.33Å; S302-R306 WeakPolarHBondContact O-CG 3.34Å; S302-R306 PolarHBondContact O-N 3.49Å; S302-R306 PolarHBondContact O-NE 2.86Å; S302-R306 PolarHBondContact OG-NE 3.23Å; S302-R306 VanDerWaalsContact OG-NE 3.13Å; S302-R306 PolarHBondContact OG-NH2 3.45Å; K303-R306 PolarHBondContact O-N 3.35Å; R306-S310 WeakPolarHBondContact O-CB 3.47Å; R306-S310 PolarHBondContact O-N 2.8Å; R306-S310 PolarHBondContact O-OG 2.81Å
307	T	76.7	Confident	71.2	Confident	85 Å²	85	80.2 Å²	80.2	52%	0.521	44%	0.439	S	S	.	.	H	α-helix	trans	-66.7	-46.7	176.3	-53.2	0	0	0	0	111.1	K303 T304 I305 E309 S310 V311	K303-T307 WeakPolarHBondContact O-CB 3.45Å; K303-T307 PolarHBondContact O-N 3.02Å; K303-T307 PolarHBondContact O-OG1 2.86Å; T304-T307 PolarHBondContact O-N 3.17Å; I305-T307 PolarHBondContact O-N 2.83Å; T307-E309 VanDerWaalsContact C-N 3.32Å; T307-E309 PolarHBondContact O-N 3.47Å; T307-S310 PolarHBondContact O-N 3.24Å; T307-V311 VanDerWaalsContact O-CG2 3.31Å; T307-V311 WeakPolarHBondContact O-CG2 3.28Å; T307-V311 PolarHBondContact O-N 3.24Å
308	I	80.4	Confident	73.5	Confident	73 Å²	73	82 Å²	82	37%	0.374	43%	0.432	S	S	.	.	H	α-helix	trans	-59.3	-45.4	176.6	-69	165.2	0	0	0	110.5	T304 I305 S310 V311 L312	T304-I308 HydrophobicContact CG2-CD1 4.03Å; T304-I308 VanDerWaalsContact O-CG1 3.3Å; T304-I308 WeakPolarHBondContact O-CG1 3.44Å; T304-I308 PolarHBondContact O-N 3.49Å; I305-I308 PolarHBondContact O-N 2.71Å; I305-I308 VanDerWaalsContact O-N 3.11Å; I308-S310 PolarHBondContact O-N 3.36Å; I308-V311 PolarHBondContact O-N 2.82Å; I308-L312 HydrophobicContact CG2-CD1 3.92Å; I308-L312 HydrophobicContact CG2-CG 4.38Å; I308-L312 WeakPolarHBondContact O-CG 3.36Å; I308-L312 PolarHBondContact O-N 2.91Å
309	E	75.9	Confident	75.9	Confident	41 Å²	41	77.4 Å²	77.4	19%	0.192	41%	0.41	C	S	.	.	H	α-helix	trans	-60.8	-44	177.9	-70.3	-171	140.2	0	0	112.3	I305 T307 V311 L312 D313 R643	I305-E309 HydrophobicContact CG2-CG 4.34Å; I305-E309 WeakPolarHBondContact O-CG 3.31Å; I305-E309 PolarHBondContact O-N 3.38Å; T307-E309 VanDerWaalsContact C-N 3.32Å; T307-E309 PolarHBondContact O-N 3.47Å; E309-V311 PolarHBondContact O-N 3.44Å; E309-L312 PolarHBondContact O-N 3.27Å; E309-D313 WeakPolarHBondContact O-CB 3.35Å; E309-D313 PolarHBondContact O-N 3.35Å; E309-R643 IonicContact OE1-CZ 3.65Å; E309-R643 IonicContact OE1-NE 2.73Å; E309-R643 PolarHBondContact OE1-NE 3.44Å; E309-R643 IonicContact OE1-NH2 2.78Å; E309-R643 PolarHBondContact OE1-NH2 3.37Å; E309-R643 IonicContact OE2-NH2 2.81Å; E309-R643 PolarHBondContact OE2-NH2 2.73Å
310	S	78.6	Confident	77.9	Confident	68 Å²	68	71.1 Å²	71.1	48%	0.476	37%	0.372	S	S	.	.	H	α-helix	trans	-63.5	-41	177.1	-57.6	0	0	0	0	111.9	R306 T307 I308 D313 I314	R306-S310 WeakPolarHBondContact O-CB 3.47Å; R306-S310 PolarHBondContact O-N 2.8Å; R306-S310 PolarHBondContact O-OG 2.81Å; T307-S310 PolarHBondContact O-N 3.24Å; I308-S310 PolarHBondContact O-N 3.36Å; S310-D313 PolarHBondContact O-N 2.9Å; S310-I314 WeakPolarHBondContact O-CG1 3.47Å; S310-I314 PolarHBondContact O-N 3.22Å
311	V	85.8	Confident	80.3	Confident	86 Å²	86	66.2 Å²	66.2	52%	0.521	35%	0.354	S	S	.	.	H	α-helix	trans	-64.8	-43.2	176.3	170.9	0	0	0	0	111.2	T307 I308 E309 D313 I314 L315	T307-V311 VanDerWaalsContact O-CG2 3.31Å; T307-V311 WeakPolarHBondContact O-CG2 3.28Å; T307-V311 PolarHBondContact O-N 3.24Å; I308-V311 PolarHBondContact O-N 2.82Å; E309-V311 PolarHBondContact O-N 3.44Å; V311-D313 VanDerWaalsContact C-N 3.31Å; V311-D313 PolarHBondContact O-N 3.39Å; V311-I314 PolarHBondContact O-N 2.86Å; V311-L315 WeakPolarHBondContact O-CB 3.43Å; V311-L315 PolarHBondContact O-N 3.2Å
312	L	84.4	Confident	82.2	Confident	27 Å²	27	69 Å²	69	14%	0.141	36%	0.363	C	S	.	.	H	α-helix	trans	-62.4	-39.5	175.7	-72.8	171.2	0	0	0	111.6	I308 E309 L315 Q316 R643	I308-L312 HydrophobicContact CG2-CD1 3.92Å; I308-L312 HydrophobicContact CG2-CG 4.38Å; I308-L312 WeakPolarHBondContact O-CG 3.36Å; I308-L312 PolarHBondContact O-N 2.91Å; E309-L312 PolarHBondContact O-N 3.27Å; L312-L315 PolarHBondContact O-N 3.23Å; L312-Q316 VanDerWaalsContact O-CB 3.23Å; L312-Q316 WeakPolarHBondContact O-CB 3.41Å; L312-Q316 PolarHBondContact O-N 2.84Å; L312-R643 HydrophobicContact CD1-CB 3.98Å
313	D	80.7	Confident	83.9	Confident	23 Å²	23	67 Å²	67	12%	0.123	35%	0.349	C	S	.	.	H	α-helix	trans	-67.3	-39.2	179.2	-72.3	-16.4	0	0	0	111.5	L272 K276 E309 S310 V311 Q316 L317 R643	L272-D313 HydrophobicContact CD2-CB 3.93Å; K276-D313 IonicContact NZ-OD2 3.68Å; K276-D313 PolarHBondContact NZ-OD2 3.27Å; E309-D313 WeakPolarHBondContact O-CB 3.35Å; E309-D313 PolarHBondContact O-N 3.35Å; S310-D313 PolarHBondContact O-N 2.9Å; V311-D313 VanDerWaalsContact C-N 3.31Å; V311-D313 PolarHBondContact O-N 3.39Å; D313-Q316 WeakPolarHBondContact O-CB 3.27Å; D313-L317 PolarHBondContact O-N 2.86Å; D313-L317 VanDerWaalsContact O-N 3.14Å; D313-R643 IonicContact OD1-NH1 3.19Å; D313-R643 PolarHBondContact OD1-NH1 3.03Å; D313-R643 IonicContact OD2-NH1 3.55Å; D313-R643 PolarHBondContact OD2-NH1 3.44Å
314	I	85.5	Confident	85.2	Confident	103 Å²	103	60.3 Å²	60.3	53%	0.528	32%	0.322	S	S	.	.	H	α-helix	trans	-65.6	-46.1	171.9	-66.7	166.2	0	0	0	111.1	S310 V311 Q316 L317 L318	S310-I314 WeakPolarHBondContact O-CG1 3.47Å; S310-I314 PolarHBondContact O-N 3.22Å; V311-I314 PolarHBondContact O-N 2.86Å; I314-Q316 VanDerWaalsContact C-N 3.3Å; I314-Q316 PolarHBondContact O-N 3.47Å; I314-L317 WeakPolarHBondContact O-CB 3.4Å; I314-L317 PolarHBondContact O-N 3.5Å; I314-L318 HydrophobicContact CG2-CD1 4.34Å; I314-L318 WeakPolarHBondContact O-CG 3.47Å; I314-L318 PolarHBondContact O-N 2.75Å
315	L	90.2	Very high	86.3	Confident	75 Å²	75	62.2 Å²	62.2	39%	0.393	32%	0.323	S	S	.	.	H	α-helix	trans	-63	-40.1	-179.8	-174.5	60	0	0	0	111.1	V311 L312 L317 L318 V319 L647	V311-L315 WeakPolarHBondContact O-CB 3.43Å; V311-L315 PolarHBondContact O-N 3.2Å; L312-L315 PolarHBondContact O-N 3.23Å; L315-L317 PolarHBondContact O-N 3.4Å; L315-L318 PolarHBondContact O-N 3.23Å; L315-V319 WeakPolarHBondContact O-CG2 3.32Å; L315-V319 PolarHBondContact O-N 2.94Å; L315-L647 HydrophobicContact CB-CD1 4.36Å; L315-L647 HydrophobicContact CD2-CD1 4.3Å; L315-L647 HydrophobicContact CD2-CD2 3.55Å; L315-L647 HydrophobicContact CG-CD1 3.89Å; L315-L647 HydrophobicContact CG-CD2 4.09Å
316	Q	89.6	Confident	87.4	Confident	13 Å²	13	59 Å²	59	6%	0.061	31%	0.307	C	S	.	.	H	α-helix	trans	-56.6	-47.9	173.3	177.3	68.1	0.5	0	0	111.6	W277 L312 D313 I314 L318 V319 C320 A646 L647 S650	W277-Q316 HydrophobicContact CB-CG 4.3Å; L312-Q316 VanDerWaalsContact O-CB 3.23Å; L312-Q316 WeakPolarHBondContact O-CB 3.41Å; L312-Q316 PolarHBondContact O-N 2.84Å; D313-Q316 WeakPolarHBondContact O-CB 3.27Å; I314-Q316 VanDerWaalsContact C-N 3.3Å; I314-Q316 PolarHBondContact O-N 3.47Å; Q316-L318 PolarHBondContact O-N 3.41Å; Q316-V319 PolarHBondContact O-N 3.18Å; Q316-C320 WeakPolarHBondContact O-CB 3.47Å; Q316-C320 PolarHBondContact O-N 3.08Å; Q316-C320 PolarHBondContact O-SG 2.97Å; Q316-C320 VanDerWaalsContact O-SG 3.35Å; Q316-A646 PolarHBondContact NE2-O 3.43Å; Q316-A646 PolarHBondContact OE1-O 2.95Å; Q316-L647 HydrophobicContact CB-CD1 4.3Å; Q316-S650 VanDerWaalsContact CD-OG 3.29Å; Q316-S650 PolarHBondContact NE2-OG 3.2Å; Q316-S650 PolarHBondContact OE1-OG 3.27Å
317	L	87.3	Confident	88.6	Confident	56 Å²	56	52.3 Å²	52.3	29%	0.293	28%	0.282	S	S	.	.	H	α-helix	trans	-58.8	-47.5	177.5	177.5	64.9	0	0	0	111.5	L272 D313 I314 L315 V319 C320 I321 L364	L272-L317 HydrophobicContact CD1-CD2 4.16Å; D313-L317 PolarHBondContact O-N 2.86Å; D313-L317 VanDerWaalsContact O-N 3.14Å; I314-L317 WeakPolarHBondContact O-CB 3.4Å; I314-L317 PolarHBondContact O-N 3.5Å; L315-L317 PolarHBondContact O-N 3.4Å; L317-V319 VanDerWaalsContact C-N 3.34Å; L317-V319 PolarHBondContact O-N 2.93Å; L317-C320 PolarHBondContact O-N 2.93Å; L317-I321 HydrophobicContact CD1-CD1 4.15Å; L317-I321 HydrophobicContact CD1-CG1 4.46Å; L317-I321 HydrophobicContact CG-CD1 4.04Å; L317-I321 WeakPolarHBondContact O-CG1 3.24Å; L317-I321 PolarHBondContact O-N 3.07Å; L317-L364 HydrophobicContact CD1-CD2 3.52Å
318	L	91.8	Very high	89.4	Confident	103 Å²	103	52.1 Å²	52.1	54%	0.539	28%	0.277	S	S	.	.	H	α-helix	trans	-60.6	-43	178.3	-67.5	175.4	0	0	0	111.8	I314 L315 Q316 I321 L322	I314-L318 HydrophobicContact CG2-CD1 4.34Å; I314-L318 WeakPolarHBondContact O-CG 3.47Å; I314-L318 PolarHBondContact O-N 2.75Å; L315-L318 PolarHBondContact O-N 3.23Å; Q316-L318 PolarHBondContact O-N 3.41Å; L318-I321 PolarHBondContact O-N 3.28Å; L318-L322 WeakPolarHBondContact O-CB 3.18Å; L318-L322 PolarHBondContact O-N 3.09Å
319	V	94	Very high	90	Very high	31 Å²	31	50.9 Å²	50.9	19%	0.188	27%	0.273	C	S	.	.	H	α-helix	trans	-65.4	-41.8	177	171.8	0	0	0	0	111.3	L315 Q316 L317 I321 L322 S323 L647 S650 G651	L315-V319 WeakPolarHBondContact O-CG2 3.32Å; L315-V319 PolarHBondContact O-N 2.94Å; Q316-V319 PolarHBondContact O-N 3.18Å; L317-V319 VanDerWaalsContact C-N 3.34Å; L317-V319 PolarHBondContact O-N 2.93Å; V319-I321 PolarHBondContact O-N 3.33Å; V319-L322 PolarHBondContact O-N 3.37Å; V319-S323 VanDerWaalsContact O-CB 3.32Å; V319-S323 WeakPolarHBondContact O-CB 3.3Å; V319-S323 PolarHBondContact O-N 3.33Å; V319-S323 PolarHBondContact O-OG 3.26Å; V319-L647 HydrophobicContact CB-CD1 4.21Å; V319-L647 HydrophobicContact CG2-CD1 3.86Å; V319-S650 WeakPolarHBondContact CG1-OG 3.34Å; V319-G651 VanDerWaalsContact CG1-CA 3.42Å
320	C	92.5	Very high	90.8	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-44.8	174.8	-76	0	0	0	0	112.1	Q316 L317 S323 A324 L360 L364	Q316-C320 WeakPolarHBondContact O-CB 3.47Å; Q316-C320 PolarHBondContact O-N 3.08Å; Q316-C320 PolarHBondContact O-SG 2.97Å; Q316-C320 VanDerWaalsContact O-SG 3.35Å; L317-C320 PolarHBondContact O-N 2.93Å; C320-S323 PolarHBondContact O-N 3.41Å; C320-A324 WeakPolarHBondContact O-CB 3.12Å; C320-A324 PolarHBondContact O-N 2.59Å; C320-L360 HydrophobicContact CB-CD2 4.1Å; C320-L364 HydrophobicContact CB-CD2 4.06Å
321	I	93.6	Very high	91.4	Very high	88 Å²	88	47.2 Å²	47.2	45%	0.451	25%	0.249	S	C	.	.	H	α-helix	trans	-62.7	-46.3	177.1	-67.8	167.1	0	0	0	110.5	L317 L318 V319 S323 A324 F325 L364	L317-I321 HydrophobicContact CD1-CD1 4.15Å; L317-I321 HydrophobicContact CD1-CG1 4.46Å; L317-I321 HydrophobicContact CG-CD1 4.04Å; L317-I321 WeakPolarHBondContact O-CG1 3.24Å; L317-I321 PolarHBondContact O-N 3.07Å; L318-I321 PolarHBondContact O-N 3.28Å; V319-I321 PolarHBondContact O-N 3.33Å; I321-S323 VanDerWaalsContact C-N 3.33Å; I321-S323 PolarHBondContact O-N 3.24Å; I321-A324 PolarHBondContact O-N 3.16Å; I321-F325 WeakPolarHBondContact O-CB 3.39Å; I321-F325 PolarHBondContact O-N 3.36Å; I321-L364 HydrophobicContact CG1-CD1 4.34Å; I321-L364 HydrophobicContact CG1-CD2 4.15Å
322	L	95.7	Very high	91.6	Very high	80 Å²	80	46.7 Å²	46.7	42%	0.419	24%	0.243	S	C	.	.	H	α-helix	trans	-61.3	-43	177.2	-179.3	62.6	0	0	0	111.6	L318 V319 F325 S326 A654 F658	L318-L322 WeakPolarHBondContact O-CB 3.18Å; L318-L322 PolarHBondContact O-N 3.09Å; V319-L322 PolarHBondContact O-N 3.37Å; L322-F325 PolarHBondContact O-N 3.02Å; L322-S326 WeakPolarHBondContact O-CB 3.37Å; L322-S326 PolarHBondContact O-N 2.86Å; L322-S326 PolarHBondContact O-OG 3.07Å; L322-A654 HydrophobicContact CG-CB 4.34Å; L322-F658 HydrophobicContact CD1-CE2 4.44Å; L322-F658 HydrophobicContact CD1-CZ 4.25Å; L322-F658 HydrophobicContact CD2-CE2 4.43Å; L322-F658 HydrophobicContact CG-CE2 4.44Å
323	S	96.6	Very high	91.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.7	-49.9	174.6	-80.8	0	0	0	0	111.4	V319 C320 I321 F325 S326 L327 S650 A654	V319-S323 VanDerWaalsContact O-CB 3.32Å; V319-S323 WeakPolarHBondContact O-CB 3.3Å; V319-S323 PolarHBondContact O-N 3.33Å; V319-S323 PolarHBondContact O-OG 3.26Å; C320-S323 PolarHBondContact O-N 3.41Å; I321-S323 VanDerWaalsContact C-N 3.33Å; I321-S323 PolarHBondContact O-N 3.24Å; S323-F325 PolarHBondContact O-N 3.02Å; S323-S326 PolarHBondContact O-N 3.39Å; S323-S326 PolarHBondContact O-OG 2.9Å; S323-L327 WeakPolarHBondContact O-CG 3.45Å; S323-L327 PolarHBondContact O-N 2.96Å; S323-S650 WeakPolarHBondContact CB-O 3.31Å; S323-S650 PolarHBondContact OG-O 2.84Å; S323-A654 WeakPolarHBondContact OG-CB 3.13Å; S323-A654 PolarHBondContact OG-N 3.35Å
324	A	95	Very high	92.2	Very high	11 Å²	11	46 Å²	46	9%	0.091	24%	0.239	C	C	.	.	H	α-helix	trans	-58.9	-45.8	178.1	0	0	0	0	0	111.8	C320 I321 L327 L328 L357 L360 L364	C320-A324 WeakPolarHBondContact O-CB 3.12Å; C320-A324 PolarHBondContact O-N 2.59Å; I321-A324 PolarHBondContact O-N 3.16Å; A324-L327 PolarHBondContact O-N 3.44Å; A324-L328 WeakPolarHBondContact O-CB 3.46Å; A324-L328 PolarHBondContact O-N 2.89Å; A324-L357 HydrophobicContact CB-CD1 3.99Å; A324-L357 WeakPolarHBondContact O-CD1 3.48Å; A324-L360 HydrophobicContact CB-CB 4.38Å; A324-L360 HydrophobicContact CB-CD1 4.36Å; A324-L364 HydrophobicContact CB-CD1 4.39Å
325	F	95.8	Very high	92.2	Very high	130 Å²	130	42.1 Å²	42.1	57%	0.57	22%	0.224	S	C	*	.	H	α-helix	trans	-61.2	-46.7	176.9	-179.8	-99.6	0	0	0	112.3	I321 L322 S323 L327 L328 V329	I321-F325 WeakPolarHBondContact O-CB 3.39Å; I321-F325 PolarHBondContact O-N 3.36Å; L322-F325 PolarHBondContact O-N 3.02Å; S323-F325 PolarHBondContact O-N 3.02Å; F325-L327 VanDerWaalsContact C-N 3.34Å; F325-L327 PolarHBondContact O-N 2.94Å; F325-L328 WeakPolarHBondContact O-CB 3.26Å; F325-L328 PolarHBondContact O-N 3.31Å; F325-V329 HydrophobicContact CD1-CG2 4.32Å; F325-V329 HydrophobicContact CE1-CG2 3.9Å; F325-V329 HydrophobicContact CE2-CG2 4.37Å; F325-V329 HydrophobicContact CZ-CG2 3.92Å; F325-V329 WeakPolarHBondContact O-CG2 3.46Å; F325-V329 PolarHBondContact O-N 3.46Å
326	S	95.4	Very high	91.9	Very high	5 Å²	5	46.7 Å²	46.7	4%	0.035	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-38.8	-179.9	74.6	0	0	0	0	113	L322 S323 V329 L330 G653 A654	L322-S326 WeakPolarHBondContact O-CB 3.37Å; L322-S326 PolarHBondContact O-N 2.86Å; L322-S326 PolarHBondContact O-OG 3.07Å; S323-S326 PolarHBondContact O-N 3.39Å; S323-S326 PolarHBondContact O-OG 2.9Å; S326-V329 PolarHBondContact O-N 2.95Å; S326-L330 WeakPolarHBondContact O-CB 3.1Å; S326-L330 PolarHBondContact O-N 3.3Å; S326-G653 PolarHBondContact OG-O 2.62Å; S326-A654 WeakPolarHBondContact OG-CA 3.44Å; S326-A654 PolarHBondContact OG-N 3.43Å
327	L	95	Very high	91.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-69.8	-39.1	177.6	-71.6	173.5	0	0	0	110.9	S323 A324 F325 L330 L331 A353 M356 L357 L360	S323-L327 WeakPolarHBondContact O-CG 3.45Å; S323-L327 PolarHBondContact O-N 2.96Å; A324-L327 PolarHBondContact O-N 3.44Å; F325-L327 VanDerWaalsContact C-N 3.34Å; F325-L327 PolarHBondContact O-N 2.94Å; L327-L330 HydrophobicContact CD2-CD2 4.39Å; L327-L330 WeakPolarHBondContact O-CB 3.38Å; L327-L330 PolarHBondContact O-N 3.34Å; L327-L331 WeakPolarHBondContact O-CB 3.47Å; L327-L331 VanDerWaalsContact O-CG 3.31Å; L327-L331 WeakPolarHBondContact O-CG 3.32Å; L327-L331 PolarHBondContact O-N 3.27Å; L327-A353 HydrophobicContact CD2-CB 3.86Å; L327-M356 HydrophobicContact CD1-CB 3.66Å; L327-L357 HydrophobicContact CB-CB 4.4Å; L327-L357 HydrophobicContact CB-CD1 4.5Å; L327-L357 HydrophobicContact CD1-CB 4.44Å; L327-L360 HydrophobicContact CD1-CD1 4Å
328	L	94.1	Very high	91.3	Very high	82 Å²	82	52.3 Å²	52.3	43%	0.429	26%	0.26	S	S	.	.	H	α-helix	trans	-59.8	-47.7	173.4	-178.3	64.7	0	0	0	111.1	A324 F325 L330 L331 I332 L357	A324-L328 WeakPolarHBondContact O-CB 3.46Å; A324-L328 PolarHBondContact O-N 2.89Å; F325-L328 WeakPolarHBondContact O-CB 3.26Å; F325-L328 PolarHBondContact O-N 3.31Å; L328-L330 PolarHBondContact O-N 3.36Å; L328-L331 PolarHBondContact O-N 2.66Å; L328-I332 HydrophobicContact CD1-CD1 4.29Å; L328-I332 HydrophobicContact CG-CD1 4.03Å; L328-I332 VanDerWaalsContact O-CG1 3.27Å; L328-I332 WeakPolarHBondContact O-CG1 3.47Å; L328-I332 PolarHBondContact O-N 2.99Å; L328-L357 HydrophobicContact CD1-CD2 4.38Å
329	V	93.3	Very high	90.8	Very high	46 Å²	46	52.3 Å²	52.3	28%	0.279	26%	0.258	S	S	.	.	H	α-helix	trans	-60.9	-44.5	176	175.1	0	0	0	0	111.1	F325 S326 L331 I332 V333 L661	F325-V329 HydrophobicContact CD1-CG2 4.32Å; F325-V329 HydrophobicContact CE1-CG2 3.9Å; F325-V329 HydrophobicContact CE2-CG2 4.37Å; F325-V329 HydrophobicContact CZ-CG2 3.92Å; F325-V329 WeakPolarHBondContact O-CG2 3.46Å; F325-V329 PolarHBondContact O-N 3.46Å; S326-V329 PolarHBondContact O-N 2.95Å; V329-L331 PolarHBondContact O-N 2.82Å; V329-I332 PolarHBondContact O-N 3.3Å; V329-V333 HydrophobicContact CG1-CG2 4.28Å; V329-V333 WeakPolarHBondContact O-CG2 3.47Å; V329-V333 PolarHBondContact O-N 3.45Å; V329-L661 HydrophobicContact CB-CD1 4.49Å; V329-L661 HydrophobicContact CG1-CD1 3.85Å
330	L	91.9	Very high	90.1	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-55.7	-50.6	176	-179.9	72.7	0	0	0	111.4	S326 L327 L328 I332 V333 Y334 L349 A353 L661	S326-L330 WeakPolarHBondContact O-CB 3.1Å; S326-L330 PolarHBondContact O-N 3.3Å; L327-L330 HydrophobicContact CD2-CD2 4.39Å; L327-L330 WeakPolarHBondContact O-CB 3.38Å; L327-L330 PolarHBondContact O-N 3.34Å; L328-L330 PolarHBondContact O-N 3.36Å; L330-I332 VanDerWaalsContact C-N 3.35Å; L330-I332 PolarHBondContact O-N 3.33Å; L330-V333 PolarHBondContact O-N 2.98Å; L330-Y334 HydrophobicContact CD1-CD2 3.7Å; L330-Y334 HydrophobicContact CD1-CE1 4.46Å; L330-Y334 HydrophobicContact CD1-CE2 3.54Å; L330-Y334 HydrophobicContact CD1-CG 4.26Å; L330-Y334 HydrophobicContact CG-CD2 4.43Å; L330-Y334 WeakPolarHBondContact O-CB 3.37Å; L330-Y334 PolarHBondContact O-N 2.88Å; L330-L349 HydrophobicContact CD2-CG 4.48Å; L330-A353 HydrophobicContact CD2-CB 3.92Å; L330-L661 HydrophobicContact CD1-CD2 4.28Å; L330-L661 HydrophobicContact CD1-CG 4.12Å
331	L	91.6	Very high	89.5	Confident	31 Å²	31	53.3 Å²	53.3	16%	0.162	26%	0.258	C	S	.	.	H	α-helix	trans	-61.3	-41.6	179.2	-73	169.5	0	0	0	111.8	L327 L328 V329 G335 M350 A353 T354 L357	L327-L331 WeakPolarHBondContact O-CB 3.47Å; L327-L331 VanDerWaalsContact O-CG 3.31Å; L327-L331 WeakPolarHBondContact O-CG 3.32Å; L327-L331 PolarHBondContact O-N 3.27Å; L328-L331 PolarHBondContact O-N 2.66Å; V329-L331 PolarHBondContact O-N 2.82Å; L331-G335 WeakPolarHBondContact O-CA 3.32Å; L331-G335 PolarHBondContact O-N 3.33Å; L331-M350 HydrophobicContact CD2-CB 4.08Å; L331-M350 HydrophobicContact CD2-CG 4.27Å; L331-A353 HydrophobicContact CD2-CB 3.97Å; L331-A353 HydrophobicContact CG-CB 4.15Å; L331-T354 WeakPolarHBondContact CD2-OG1 3.25Å; L331-L357 HydrophobicContact CD1-CD2 3.73Å
332	I	89.6	Confident	88.6	Confident	74 Å²	74	55.7 Å²	55.7	38%	0.379	26%	0.262	S	S	.	.	H	α-helix	trans	-62.7	-49.4	176.8	-68.4	166	0	0	0	110.7	L328 V329 L330 K336	L328-I332 HydrophobicContact CD1-CD1 4.29Å; L328-I332 HydrophobicContact CG-CD1 4.03Å; L328-I332 VanDerWaalsContact O-CG1 3.27Å; L328-I332 WeakPolarHBondContact O-CG1 3.47Å; L328-I332 PolarHBondContact O-N 2.99Å; V329-I332 PolarHBondContact O-N 3.3Å; L330-I332 VanDerWaalsContact C-N 3.35Å; L330-I332 PolarHBondContact O-N 3.33Å; I332-K336 HydrophobicContact CG2-CD 4.18Å; I332-K336 VanDerWaalsContact O-CB 3.32Å; I332-K336 WeakPolarHBondContact O-CB 3.25Å; I332-K336 WeakPolarHBondContact O-CG 3.37Å; I332-K336 PolarHBondContact O-N 3.29Å
333	V	89.4	Confident	87.7	Confident	24 Å²	24	58 Å²	58	15%	0.145	27%	0.265	C	S	.	.	H	α-helix	trans	-65.8	-48.7	-177.5	172.5	0	0	0	0	111	V329 L330 T337 L661	V329-V333 HydrophobicContact CG1-CG2 4.28Å; V329-V333 WeakPolarHBondContact O-CG2 3.47Å; V329-V333 PolarHBondContact O-N 3.45Å; L330-V333 PolarHBondContact O-N 2.98Å; V333-T337 WeakPolarHBondContact O-CB 3.44Å; V333-T337 PolarHBondContact O-N 2.96Å; V333-T337 PolarHBondContact O-OG1 3.11Å; V333-L661 HydrophobicContact CB-CD2 3.89Å; V333-L661 HydrophobicContact CG1-CD2 3.93Å; V333-L661 HydrophobicContact CG2-CD2 3.96Å
334	Y	88	Confident	86.8	Confident	13 Å²	13	60 Å²	60	5%	0.051	28%	0.277	C	S	.	.	H	α-helix	trans	-71.8	-34	-177.9	-82.8	-131.9	0	0	0	111.9	L330 F340 N346 L349 S660 L661	L330-Y334 HydrophobicContact CD1-CD2 3.7Å; L330-Y334 HydrophobicContact CD1-CE1 4.46Å; L330-Y334 HydrophobicContact CD1-CE2 3.54Å; L330-Y334 HydrophobicContact CD1-CG 4.26Å; L330-Y334 HydrophobicContact CG-CD2 4.43Å; L330-Y334 WeakPolarHBondContact O-CB 3.37Å; L330-Y334 PolarHBondContact O-N 2.88Å; Y334-F340 HydrophobicContact CD1-CB 4.25Å; Y334-F340 AromaticContact CD2-CD2 3.97Å; Y334-F340 HydrophobicContact CD2-CD2 3.97Å; Y334-F340 HydrophobicContact CD2-CE2 4.5Å; Y334-F340 HydrophobicContact CE2-CD2 4.06Å; Y334-F340 HydrophobicContact CE2-CE2 4.25Å; Y334-F340 HydrophobicContact CG-CB 4.3Å; Y334-F340 HydrophobicContact CG-CD2 4.26Å; Y334-N346 HydrophobicContact CD1-CB 3.93Å; Y334-N346 HydrophobicContact CE1-CB 4.03Å; Y334-L349 HydrophobicContact CE1-CD2 3.86Å; Y334-S660 PolarHBondContact OH-O 2.88Å; Y334-L661 HydrophobicContact CE2-CD2 4.43Å
335	G	85.3	Confident	86.2	Confident	21 Å²	21	62 Å²	62	22%	0.216	29%	0.29	C	S	.	.	H	α-helix	trans	-68.9	-42.4	175.9	0	0	0	0	0	112.9	L331 R341	L331-G335 WeakPolarHBondContact O-CA 3.32Å; L331-G335 PolarHBondContact O-N 3.33Å; G335-R341 PolarHBondContact O-NH1 3.47Å
336	K	85.1	Confident	85.7	Confident	170 Å²	170	56.8 Å²	56.8	74%	0.739	27%	0.268	S	S	*	.	H	α-helix	trans	-75.8	-35.5	178.3	-73.7	-174.3	174.5	176.2	0	112.8	I332 R338	I332-K336 HydrophobicContact CG2-CD 4.18Å; I332-K336 VanDerWaalsContact O-CB 3.32Å; I332-K336 WeakPolarHBondContact O-CB 3.25Å; I332-K336 WeakPolarHBondContact O-CG 3.37Å; I332-K336 PolarHBondContact O-N 3.29Å; K336-R338 PolarHBondContact O-N 3.4Å
337	T	84.2	Confident	85.2	Confident	24 Å²	24	57 Å²	57	15%	0.147	27%	0.269	C	S	.	.			trans	-77.4	108.5	-176.1	-55.2	0	0	0	0	111.5	V333 E339 F340 R341 L669	V333-T337 WeakPolarHBondContact O-CB 3.44Å; V333-T337 PolarHBondContact O-N 2.96Å; V333-T337 PolarHBondContact O-OG1 3.11Å; T337-E339 VanDerWaalsContact C-N 3.26Å; T337-E339 HydrophobicContact CG2-CB 4.33Å; T337-E339 PolarHBondContact O-N 2.79Å; T337-F340 HydrophobicContact CG2-CB 4.35Å; T337-F340 HydrophobicContact CG2-CD2 3.66Å; T337-F340 HydrophobicContact CG2-CE2 4.06Å; T337-F340 HydrophobicContact CG2-CG 3.93Å; T337-F340 PolarHBondContact O-N 3.45Å; T337-F340 VanDerWaalsContact O-N 3.15Å; T337-R341 PolarHBondContact O-N 3.4Å; T337-L669 HydrophobicContact CG2-CD1 4.05Å; T337-L669 HydrophobicContact CG2-CD2 3.87Å
338	R	80.4	Confident	84.8	Confident	163 Å²	163	57.1 Å²	57.1	62%	0.615	27%	0.269	S	S	*	.	H	α-helix	trans	-56.1	-38.9	-178.3	-176.6	179.7	179.6	-177.2	-0.5	112.6	K336 R342	K336-R338 PolarHBondContact O-N 3.4Å; R338-R342 WeakPolarHBondContact O-CG 3.28Å; R338-R342 PolarHBondContact O-N 3.2Å
339	E	79.3	Confident	84.6	Confident	104 Å²	104	53.5 Å²	53.5	49%	0.486	25%	0.251	S	S	.	.	H	α-helix	trans	-62.6	-44.7	-179.7	-168.1	-175.9	157.5	0	0	111.5	T337 R342 R343	T337-E339 VanDerWaalsContact C-N 3.26Å; T337-E339 HydrophobicContact CG2-CB 4.33Å; T337-E339 PolarHBondContact O-N 2.79Å; E339-R342 PolarHBondContact O-N 2.69Å; E339-R343 IonicContact OE1-CZ 2.71Å; E339-R343 IonicContact OE1-NH2 3.47Å; E339-R343 PolarHBondContact OE1-NH2 3.41Å
340	F	81.3	Confident	84.4	Confident	7 Å²	7	51.6 Å²	51.6	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-69.5	-42.5	180	-64.1	-23.7	0	0	0	112.6	Y334 T337 R342 R343 N346 S664 L669	Y334-F340 HydrophobicContact CD1-CB 4.25Å; Y334-F340 AromaticContact CD2-CD2 3.97Å; Y334-F340 HydrophobicContact CD2-CD2 3.97Å; Y334-F340 HydrophobicContact CD2-CE2 4.5Å; Y334-F340 HydrophobicContact CE2-CD2 4.06Å; Y334-F340 HydrophobicContact CE2-CE2 4.25Å; Y334-F340 HydrophobicContact CG-CB 4.3Å; Y334-F340 HydrophobicContact CG-CD2 4.26Å; T337-F340 HydrophobicContact CG2-CB 4.35Å; T337-F340 HydrophobicContact CG2-CD2 3.66Å; T337-F340 HydrophobicContact CG2-CE2 4.06Å; T337-F340 HydrophobicContact CG2-CG 3.93Å; T337-F340 PolarHBondContact O-N 3.45Å; T337-F340 VanDerWaalsContact O-N 3.15Å; F340-R342 PolarHBondContact O-N 2.98Å; F340-R342 VanDerWaalsContact O-N 3.1Å; F340-R343 PolarHBondContact O-N 3.13Å; F340-R343 VanDerWaalsContact O-N 3.1Å; F340-N346 WeakPolarHBondContact CA-ND2 3.44Å; F340-N346 WeakPolarHBondContact CB-ND2 3.46Å; F340-N346 WeakPolarHBondContact O-CB 3.43Å; F340-N346 PolarHBondContact O-ND2 2.65Å; F340-S664 WeakPolarHBondContact CE2-OG 3.41Å; F340-S664 VanDerWaalsContact CZ-CB 3.47Å; F340-S664 WeakPolarHBondContact CZ-OG 3.28Å; F340-L669 HydrophobicContact CD2-CD1 4.22Å; F340-L669 HydrophobicContact CE1-CD1 4.09Å; F340-L669 HydrophobicContact CE2-CD1 3.18Å; F340-L669 HydrophobicContact CZ-CD1 3.08Å
341	R	79.1	Confident	84.3	Confident	44 Å²	44	51.5 Å²	51.5	17%	0.166	24%	0.238	C	C	.	.	H	α-helix	trans	-60.2	-22.4	177.1	-169.6	172.7	63.1	-135.9	-1.1	113.7	G335 T337 Q347 M350	G335-R341 PolarHBondContact O-NH1 3.47Å; T337-R341 PolarHBondContact O-N 3.4Å; R341-Q347 WeakPolarHBondContact O-CG 3.38Å; R341-Q347 PolarHBondContact O-NE2 3.46Å; R341-M350 HydrophobicContact CG-CE 4.36Å
342	R	74.2	Confident	84.4	Confident	139 Å²	139	50 Å²	50	53%	0.525	23%	0.23	S	C	.	.	H	α-helix	trans	-80.9	-22.6	178.3	-70.4	-179.1	90.6	165	4.4	113.5	I2 R338 E339 F340	I2-R342 HydrophobicContact CD1-CG 4.34Å; I2-R342 HydrophobicContact CG2-CB 4.27Å; I2-R342 HydrophobicContact CG2-CG 3.75Å; R338-R342 WeakPolarHBondContact O-CG 3.28Å; R338-R342 PolarHBondContact O-N 3.2Å; E339-R342 PolarHBondContact O-N 2.69Å; F340-R342 PolarHBondContact O-N 2.98Å; F340-R342 VanDerWaalsContact O-N 3.1Å
343	R	77.5	Confident	84.6	Confident	128 Å²	128	46.5 Å²	46.5	48%	0.483	21%	0.213	S	C	.	.	S	Bend	trans	-81.6	125.1	-177.3	-61.6	-173.6	-171.9	-163	4.2	109.5	E339 F340 S345 N346 Q347	E339-R343 IonicContact OE1-CZ 2.71Å; E339-R343 IonicContact OE1-NH2 3.47Å; E339-R343 PolarHBondContact OE1-NH2 3.41Å; F340-R343 PolarHBondContact O-N 3.13Å; F340-R343 VanDerWaalsContact O-N 3.1Å; R343-S345 VanDerWaalsContact C-N 3.34Å; R343-S345 PolarHBondContact O-N 3.47Å; R343-N346 HydrophobicContact CB-CB 4.17Å; R343-N346 WeakPolarHBondContact O-CB 3.46Å; R343-N346 PolarHBondContact O-N 3.15Å; R343-Q347 PolarHBondContact O-N 2.89Å; R343-Q347 VanDerWaalsContact O-N 3.07Å
344	V	78.3	Confident	84.7	Confident	42 Å²	42	45.7 Å²	45.7	26%	0.255	21%	0.208	S	C	.	.	H	α-helix	trans	-54.7	-46.8	-179.5	169	0	0	0	0	112.1	N346 Q347 L348 I461 T465	V344-N346 VanDerWaalsContact C-N 3.26Å; V344-N346 PolarHBondContact O-N 2.91Å; V344-Q347 WeakPolarHBondContact O-CB 3.42Å; V344-Q347 PolarHBondContact O-N 3.38Å; V344-L348 HydrophobicContact CG1-CD1 4.42Å; V344-L348 WeakPolarHBondContact O-CG 3.34Å; V344-L348 PolarHBondContact O-N 3.49Å; V344-I461 HydrophobicContact CG2-CG2 4.34Å; V344-T465 HydrophobicContact CG1-CG2 3.65Å; V344-T465 VanDerWaalsContact CG1-OG1 3.31Å; V344-T465 WeakPolarHBondContact CG1-OG1 3.19Å
345	S	82.1	Confident	85	Confident	53 Å²	53	45.1 Å²	45.1	37%	0.371	21%	0.205	S	C	.	.	H	α-helix	trans	-57.6	-39	177.7	170.3	0	0	0	0	112.3	R343 L348 L349 H402	R343-S345 VanDerWaalsContact C-N 3.34Å; R343-S345 PolarHBondContact O-N 3.47Å; S345-L348 PolarHBondContact O-N 2.79Å; S345-L349 WeakPolarHBondContact O-CB 3.33Å; S345-L349 PolarHBondContact O-N 3.48Å; S345-H402 PolarHBondContact OG-NE2 3.5Å
346	N	85	Confident	85.4	Confident	20 Å²	20	44.5 Å²	44.5	11%	0.107	20%	0.197	C	C	.	.	H	α-helix	trans	-71	-30.8	176.8	-69.8	-6.4	0	0	0	112.6	Y334 F340 R343 V344 L349 M350	Y334-N346 HydrophobicContact CD1-CB 3.93Å; Y334-N346 HydrophobicContact CE1-CB 4.03Å; F340-N346 WeakPolarHBondContact CA-ND2 3.44Å; F340-N346 WeakPolarHBondContact CB-ND2 3.46Å; F340-N346 WeakPolarHBondContact O-CB 3.43Å; F340-N346 PolarHBondContact O-ND2 2.65Å; R343-N346 HydrophobicContact CB-CB 4.17Å; R343-N346 WeakPolarHBondContact O-CB 3.46Å; R343-N346 PolarHBondContact O-N 3.15Å; V344-N346 VanDerWaalsContact C-N 3.26Å; V344-N346 PolarHBondContact O-N 2.91Å; N346-L349 PolarHBondContact O-N 3.3Å; N346-M350 VanDerWaalsContact O-CG 3.29Å; N346-M350 WeakPolarHBondContact O-CG 3.38Å; N346-M350 PolarHBondContact O-N 3.48Å
347	Q	84.3	Confident	85.9	Confident	11 Å²	11	37.3 Å²	37.3	5%	0.051	17%	0.167	C	C	.	.	H	α-helix	trans	-66.7	-44.1	173.7	-66.3	173	-15.9	0	0	111.3	F5 R341 R343 V344 L349 M350 G351	F5-Q347 HydrophobicContact CD1-CB 4.12Å; F5-Q347 VanDerWaalsContact CD1-CD 3.41Å; F5-Q347 HydrophobicContact CD1-CG 4.12Å; F5-Q347 HydrophobicContact CE1-CB 4.09Å; R341-Q347 WeakPolarHBondContact O-CG 3.38Å; R341-Q347 PolarHBondContact O-NE2 3.46Å; R343-Q347 PolarHBondContact O-N 2.89Å; R343-Q347 VanDerWaalsContact O-N 3.07Å; V344-Q347 WeakPolarHBondContact O-CB 3.42Å; V344-Q347 PolarHBondContact O-N 3.38Å; Q347-L349 VanDerWaalsContact C-N 3.33Å; Q347-M350 HydrophobicContact CB-CE 4.47Å; Q347-M350 HydrophobicContact CG-CE 4.21Å; Q347-M350 PolarHBondContact O-N 2.94Å; Q347-G351 PolarHBondContact O-N 3.44Å
348	L	87.5	Confident	86.3	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-63.8	-40.3	174.7	-60.7	-177.3	0	0	0	111.4	V344 S345 G351 L352 W398 T401 S405 T465	V344-L348 HydrophobicContact CG1-CD1 4.42Å; V344-L348 WeakPolarHBondContact O-CG 3.34Å; V344-L348 PolarHBondContact O-N 3.49Å; S345-L348 PolarHBondContact O-N 2.79Å; L348-G351 PolarHBondContact O-N 3.3Å; L348-L352 PolarHBondContact O-N 3.21Å; L348-W398 HydrophobicContact CD2-CZ3 3.96Å; L348-T401 HydrophobicContact CD1-CG2 4.16Å; L348-T401 HydrophobicContact CD2-CG2 3.69Å; L348-T401 HydrophobicContact CG-CG2 4.46Å; L348-S405 VanDerWaalsContact CD1-CB 3.44Å; L348-T465 HydrophobicContact CD2-CG2 4.31Å
349	L	89.4	Confident	86.9	Confident	6 Å²	6	29.5 Å²	29.5	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-62.4	-40.4	174.5	-177.3	64.3	0	0	0	112.1	L330 Y334 S345 N346 Q347 L352 A353 T621	L330-L349 HydrophobicContact CD2-CG 4.48Å; Y334-L349 HydrophobicContact CE1-CD2 3.86Å; S345-L349 WeakPolarHBondContact O-CB 3.33Å; S345-L349 PolarHBondContact O-N 3.48Å; N346-L349 PolarHBondContact O-N 3.3Å; Q347-L349 VanDerWaalsContact C-N 3.33Å; L349-L352 PolarHBondContact O-N 3.4Å; L349-A353 VanDerWaalsContact O-CB 3.27Å; L349-A353 WeakPolarHBondContact O-CB 3.45Å; L349-A353 PolarHBondContact O-N 3.24Å; L349-T621 HydrophobicContact CD1-CG2 4.42Å
350	M	88.9	Confident	87.5	Confident	5 Å²	5	24.8 Å²	24.8	3%	0.025	12%	0.116	C	C	.	.	H	α-helix	trans	-63.7	-40.3	173.2	-73.3	-173.9	-59.6	0	0	111.5	S6 L331 R341 N346 Q347 A353 T354	S6-M350 WeakPolarHBondContact OG-CE 3.29Å; L331-M350 HydrophobicContact CD2-CB 4.08Å; L331-M350 HydrophobicContact CD2-CG 4.27Å; R341-M350 HydrophobicContact CG-CE 4.36Å; N346-M350 VanDerWaalsContact O-CG 3.29Å; N346-M350 WeakPolarHBondContact O-CG 3.38Å; N346-M350 PolarHBondContact O-N 3.48Å; Q347-M350 HydrophobicContact CB-CE 4.47Å; Q347-M350 HydrophobicContact CG-CE 4.21Å; Q347-M350 PolarHBondContact O-N 2.94Å; M350-A353 PolarHBondContact O-N 3.21Å; M350-T354 WeakPolarHBondContact O-CB 3.5Å; M350-T354 PolarHBondContact O-N 2.84Å; M350-T354 PolarHBondContact O-OG1 3.38Å
351	G	90.1	Very high	88	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.3	-48.3	174.6	0	0	0	0	0	112.8	Q13 Q347 L348 T354 S355	Q13-G351 PolarHBondContact NE2-O 3.12Å; Q347-G351 PolarHBondContact O-N 3.44Å; L348-G351 PolarHBondContact O-N 3.3Å; G351-T354 PolarHBondContact O-N 3.33Å; G351-S355 PolarHBondContact O-N 3.37Å
352	L	93.2	Very high	88.4	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60	-45.8	173.8	176.9	59.9	0	0	0	112.3	L348 L349 T354 S355 M356 T395 W398 M399 T621 L656	L348-L352 PolarHBondContact O-N 3.21Å; L349-L352 PolarHBondContact O-N 3.4Å; L352-T354 VanDerWaalsContact C-N 3.28Å; L352-T354 PolarHBondContact O-N 2.92Å; L352-S355 PolarHBondContact O-N 3.48Å; L352-S355 PolarHBondContact O-OG 3.5Å; L352-M356 HydrophobicContact CD1-CG 4.25Å; L352-M356 WeakPolarHBondContact O-CG 3.49Å; L352-M356 PolarHBondContact O-N 3.47Å; L352-T395 HydrophobicContact CD1-CG2 3.76Å; L352-W398 HydrophobicContact CB-CB 3.99Å; L352-W398 HydrophobicContact CD1-CB 3.89Å; L352-M399 HydrophobicContact CD1-CG 3.54Å; L352-M399 HydrophobicContact CD2-CG 4Å; L352-M399 HydrophobicContact CG-CG 4.44Å; L352-T621 HydrophobicContact CD2-CG2 4.11Å; L352-L656 HydrophobicContact CD2-CD1 4.2Å
353	A	94.1	Very high	89	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.008	11%	0.11	C	C	.	.	H	α-helix	trans	-63.4	-36.6	178.8	0	0	0	0	0	111.8	L327 L330 L331 L349 M350 L357	L327-A353 HydrophobicContact CD2-CB 3.86Å; L330-A353 HydrophobicContact CD2-CB 3.92Å; L331-A353 HydrophobicContact CD2-CB 3.97Å; L331-A353 HydrophobicContact CG-CB 4.15Å; L349-A353 VanDerWaalsContact O-CB 3.27Å; L349-A353 WeakPolarHBondContact O-CB 3.45Å; L349-A353 PolarHBondContact O-N 3.24Å; M350-A353 PolarHBondContact O-N 3.21Å; A353-L357 VanDerWaalsContact O-CB 3.24Å; A353-L357 WeakPolarHBondContact O-CB 3.29Å; A353-L357 PolarHBondContact O-N 2.89Å
354	T	92.2	Very high	89.4	Confident	7 Å²	7	17.5 Å²	17.5	4%	0.043	10%	0.098	C	C	.	.	H	α-helix	trans	-69.4	-43.5	177.7	-44.8	0	0	0	0	110.8	F10 L331 M350 G351 L352 M356 L357 C358	F10-T354 HydrophobicContact CD2-CG2 3.9Å; F10-T354 HydrophobicContact CE2-CG2 4.16Å; L331-T354 WeakPolarHBondContact CD2-OG1 3.25Å; M350-T354 WeakPolarHBondContact O-CB 3.5Å; M350-T354 PolarHBondContact O-N 2.84Å; M350-T354 PolarHBondContact O-OG1 3.38Å; G351-T354 PolarHBondContact O-N 3.33Å; L352-T354 VanDerWaalsContact C-N 3.28Å; L352-T354 PolarHBondContact O-N 2.92Å; T354-M356 PolarHBondContact O-N 2.75Å; T354-L357 PolarHBondContact O-N 3.02Å; T354-C358 PolarHBondContact O-N 2.99Å; T354-C358 PolarHBondContact O-SG 2.97Å
355	S	93.9	Very high	89.5	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.2	-41.5	177.6	69.6	0	0	0	0	112.5	G351 L352 C358 L359 T395	G351-S355 PolarHBondContact O-N 3.37Å; L352-S355 PolarHBondContact O-N 3.48Å; L352-S355 PolarHBondContact O-OG 3.5Å; S355-C358 PolarHBondContact O-N 3.42Å; S355-L359 PolarHBondContact O-N 3.27Å; S355-T395 WeakPolarHBondContact OG-CA 3.4Å; S355-T395 PolarHBondContact OG-OG1 3.07Å; S355-T395 VanDerWaalsContact OG-OG1 3.06Å
356	M	94.6	Very high	89.1	Confident	8 Å²	8	15.8 Å²	15.8	4%	0.039	9%	0.086	C	C	.	.	H	α-helix	trans	-64.8	-41.6	174.9	-72.1	-90.6	77.3	0	0	112.5	L327 L352 T354 L359 L360 T395 W626	L327-M356 HydrophobicContact CD1-CB 3.66Å; L352-M356 HydrophobicContact CD1-CG 4.25Å; L352-M356 WeakPolarHBondContact O-CG 3.49Å; L352-M356 PolarHBondContact O-N 3.47Å; T354-M356 PolarHBondContact O-N 2.75Å; M356-L359 HydrophobicContact CE-CD2 3.6Å; M356-L359 PolarHBondContact O-N 3.27Å; M356-L360 WeakPolarHBondContact O-CB 3.47Å; M356-L360 WeakPolarHBondContact O-CG 3.47Å; M356-L360 PolarHBondContact O-N 3.2Å; M356-T395 HydrophobicContact CE-CG2 3.17Å; M356-T395 VanDerWaalsContact CE-OG1 3.31Å; M356-T395 WeakPolarHBondContact CE-OG1 3.34Å; M356-T395 HydrophobicContact CG-CG2 3.75Å; M356-T395 HydrophobicContact SD-CG2 3.5Å; M356-T395 VanDerWaalsContact SD-CG2 3.5Å; M356-W626 HydrophobicContact CE-CZ2 4.14Å
357	L	94.5	Very high	88.2	Confident	20 Å²	20	16.2 Å²	16.2	11%	0.105	9%	0.09	C	C	.	.	H	α-helix	trans	-62.9	-46.6	177.4	179.7	62.5	0	0	0	110.7	A324 L327 L328 L331 A353 T354 L359 L360 L361	A324-L357 HydrophobicContact CB-CD1 3.99Å; A324-L357 WeakPolarHBondContact O-CD1 3.48Å; L327-L357 HydrophobicContact CB-CB 4.4Å; L327-L357 HydrophobicContact CB-CD1 4.5Å; L327-L357 HydrophobicContact CD1-CB 4.44Å; L328-L357 HydrophobicContact CD1-CD2 4.38Å; L331-L357 HydrophobicContact CD1-CD2 3.73Å; A353-L357 VanDerWaalsContact O-CB 3.24Å; A353-L357 WeakPolarHBondContact O-CB 3.29Å; A353-L357 PolarHBondContact O-N 2.89Å; T354-L357 PolarHBondContact O-N 3.02Å; L357-L359 PolarHBondContact O-N 2.85Å; L357-L360 PolarHBondContact O-N 3.26Å; L357-L361 HydrophobicContact CD1-CD1 4.23Å; L357-L361 HydrophobicContact CD1-CG 4.16Å; L357-L361 HydrophobicContact CG-CD1 4.02Å; L357-L361 HydrophobicContact CG-CG 4.37Å; L357-L361 WeakPolarHBondContact O-CB 3.35Å; L357-L361 VanDerWaalsContact O-CG 3.27Å; L357-L361 WeakPolarHBondContact O-CG 3.24Å; L357-L361 PolarHBondContact O-N 3.09Å
358	C	92.8	Very high	87.3	Confident	22 Å²	22	20.9 Å²	20.9	15%	0.149	12%	0.115	C	C	.	.	H	α-helix	trans	-59.9	-44.8	176.3	-68.5	0	0	0	0	111.8	T354 S355 L360 L361 I362 F391	T354-C358 PolarHBondContact O-N 2.99Å; T354-C358 PolarHBondContact O-SG 2.97Å; S355-C358 PolarHBondContact O-N 3.42Å; C358-L360 PolarHBondContact O-N 3.08Å; C358-L361 PolarHBondContact O-N 2.93Å; C358-I362 WeakPolarHBondContact O-CD1 3.2Å; C358-I362 VanDerWaalsContact O-CG1 3.3Å; C358-I362 WeakPolarHBondContact O-CG1 3.28Å; C358-I362 PolarHBondContact O-N 3.3Å; C358-F391 HydrophobicContact CB-CD1 3.51Å; C358-F391 HydrophobicContact CB-CD2 3.95Å; C358-F391 HydrophobicContact CB-CE1 3.36Å; C358-F391 HydrophobicContact CB-CE2 3.81Å; C358-F391 HydrophobicContact CB-CG 3.82Å; C358-F391 HydrophobicContact CB-CZ 3.52Å
359	L	92.7	Very high	86.1	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-57.4	-47.9	175.6	-176.2	66.2	0	0	0	111.8	W277 S355 M356 L357 I362 Y363 L388 F391 F392	W277-L359 HydrophobicContact CH2-CD2 4.06Å; W277-L359 HydrophobicContact CH2-CG 4.17Å; W277-L359 HydrophobicContact CZ2-CD2 4.47Å; S355-L359 PolarHBondContact O-N 3.27Å; M356-L359 HydrophobicContact CE-CD2 3.6Å; M356-L359 PolarHBondContact O-N 3.27Å; L357-L359 PolarHBondContact O-N 2.85Å; L359-I362 PolarHBondContact O-N 3.44Å; L359-Y363 WeakPolarHBondContact O-CB 3.28Å; L359-Y363 PolarHBondContact O-N 2.98Å; L359-L388 HydrophobicContact CD1-CD1 3.77Å; L359-L388 HydrophobicContact CD1-CG 4.46Å; L359-F391 HydrophobicContact CB-CB 3.98Å; L359-F391 HydrophobicContact CD1-CB 4.14Å; L359-F392 HydrophobicContact CD1-CB 4.2Å; L359-F392 HydrophobicContact CD1-CD2 3.98Å; L359-F392 HydrophobicContact CD2-CD2 3.79Å; L359-F392 HydrophobicContact CD2-CE2 4.32Å; L359-F392 HydrophobicContact CD2-CG 4.28Å
360	L	92.5	Very high	84.8	Confident	6 Å²	6	25.2 Å²	25.2	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-64.8	-41.3	179.4	-74.1	169	0	0	0	112.1	W277 C320 A324 L327 M356 L357 C358 Y363 L364	W277-L360 HydrophobicContact CH2-CD2 3.72Å; W277-L360 HydrophobicContact CZ2-CD2 4.43Å; W277-L360 HydrophobicContact CZ3-CD2 4.07Å; C320-L360 HydrophobicContact CB-CD2 4.1Å; A324-L360 HydrophobicContact CB-CB 4.38Å; A324-L360 HydrophobicContact CB-CD1 4.36Å; L327-L360 HydrophobicContact CD1-CD1 4Å; M356-L360 WeakPolarHBondContact O-CB 3.47Å; M356-L360 WeakPolarHBondContact O-CG 3.47Å; M356-L360 PolarHBondContact O-N 3.2Å; L357-L360 PolarHBondContact O-N 3.26Å; C358-L360 PolarHBondContact O-N 3.08Å; L360-Y363 PolarHBondContact O-N 3.49Å; L360-L364 WeakPolarHBondContact O-CB 3.11Å; L360-L364 WeakPolarHBondContact O-CG 3.46Å; L360-L364 PolarHBondContact O-N 2.87Å
361	L	91	Very high	83.1	Confident	86 Å²	86	29 Å²	29	45%	0.45	16%	0.157	S	C	.	.	H	α-helix	trans	-63.7	-45.1	177.6	-70.7	175.7	0	0	0	111.3	L357 C358 Y363 L364 T365	L357-L361 HydrophobicContact CD1-CD1 4.23Å; L357-L361 HydrophobicContact CD1-CG 4.16Å; L357-L361 HydrophobicContact CG-CD1 4.02Å; L357-L361 HydrophobicContact CG-CG 4.37Å; L357-L361 WeakPolarHBondContact O-CB 3.35Å; L357-L361 VanDerWaalsContact O-CG 3.27Å; L357-L361 WeakPolarHBondContact O-CG 3.24Å; L357-L361 PolarHBondContact O-N 3.09Å; C358-L361 PolarHBondContact O-N 2.93Å; L361-Y363 PolarHBondContact O-N 3.35Å; L361-L364 PolarHBondContact O-N 3.29Å; L361-T365 WeakPolarHBondContact O-CB 3.28Å; L361-T365 VanDerWaalsContact O-CG2 3.29Å; L361-T365 WeakPolarHBondContact O-CG2 3.35Å; L361-T365 PolarHBondContact O-N 3.01Å; L361-T365 PolarHBondContact O-OG1 2.93Å
362	I	88	Confident	81.2	Confident	20 Å²	20	36.8 Å²	36.8	10%	0.103	19%	0.194	C	C	.	.	H	α-helix	trans	-59.2	-48.8	176.6	-67.5	157.4	0	0	0	110.2	C358 L359 L364 T365 L366 V384 L387 L388 F391	C358-I362 WeakPolarHBondContact O-CD1 3.2Å; C358-I362 VanDerWaalsContact O-CG1 3.3Å; C358-I362 WeakPolarHBondContact O-CG1 3.28Å; C358-I362 PolarHBondContact O-N 3.3Å; L359-I362 PolarHBondContact O-N 3.44Å; I362-L364 PolarHBondContact O-N 2.94Å; I362-T365 PolarHBondContact O-N 2.94Å; I362-T365 PolarHBondContact O-OG1 3.39Å; I362-L366 PolarHBondContact O-N 3.41Å; I362-V384 HydrophobicContact CG2-CG1 4.19Å; I362-L387 HydrophobicContact CD1-CB 3.64Å; I362-L387 HydrophobicContact CD1-CD1 4.48Å; I362-L388 HydrophobicContact CG2-CB 4.47Å; I362-L388 HydrophobicContact CG2-CD1 3.99Å; I362-F391 HydrophobicContact CD1-CD2 3.34Å; I362-F391 HydrophobicContact CD1-CE2 3.75Å; I362-F391 HydrophobicContact CD1-CG 4.36Å
363	Y	86.7	Confident	79	Confident	15 Å²	15	41.4 Å²	41.4	6%	0.059	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-45.1	177.9	177.4	-103.1	0	0	0	113.1	W277 F280 L359 L360 L361 T365 L366	W277-Y363 HydrophobicContact CB-CE2 4.38Å; W277-Y363 AromaticContact CE3-CD1 3.4Å; W277-Y363 HydrophobicContact CE3-CD1 3.4Å; W277-Y363 AromaticContact CE3-CD2 3.63Å; W277-Y363 HydrophobicContact CE3-CD2 3.63Å; W277-Y363 AromaticContact CE3-CE1 3.56Å; W277-Y363 HydrophobicContact CE3-CE1 3.56Å; W277-Y363 AromaticContact CE3-CE2 3.81Å; W277-Y363 HydrophobicContact CE3-CE2 3.81Å; W277-Y363 AromaticContact CE3-CG 3.43Å; W277-Y363 HydrophobicContact CE3-CG 3.43Å; W277-Y363 VanDerWaalsContact CE3-CG 3.43Å; W277-Y363 AromaticContact CE3-CZ 3.77Å; W277-Y363 AromaticContact CZ3-CD1 3.55Å; W277-Y363 HydrophobicContact CZ3-CD1 3.55Å; W277-Y363 AromaticContact CZ3-CD2 3.96Å; W277-Y363 HydrophobicContact CZ3-CD2 3.96Å; W277-Y363 HydrophobicContact CZ3-CE1 4.2Å; W277-Y363 AromaticContact CZ3-CG 3.41Å; W277-Y363 HydrophobicContact CZ3-CG 3.41Å; W277-Y363 VanDerWaalsContact CZ3-CG 3.41Å; W277-Y363 PolarHBondContact N-OH 3.27Å; F280-Y363 AromaticContact CE2-CD2 3.99Å; F280-Y363 HydrophobicContact CE2-CD2 3.99Å; F280-Y363 HydrophobicContact CE2-CE2 4.27Å; F280-Y363 HydrophobicContact CZ-CD2 4.05Å; L359-Y363 WeakPolarHBondContact O-CB 3.28Å; L359-Y363 PolarHBondContact O-N 2.98Å; L360-Y363 PolarHBondContact O-N 3.49Å; L361-Y363 PolarHBondContact O-N 3.35Å; Y363-T365 VanDerWaalsContact C-N 3.29Å; Y363-T365 PolarHBondContact O-N 2.91Å; Y363-L366 WeakPolarHBondContact O-CB 3.3Å; Y363-L366 PolarHBondContact O-N 3.48Å
364	L	86	Confident	76.7	Confident	43 Å²	43	47 Å²	47	23%	0.225	24%	0.244	C	C	.	.	H	α-helix	trans	-66.9	-30.1	178.9	-71.4	170.7	0	0	0	112.5	L317 C320 I321 A324 L360 L361 I362	L317-L364 HydrophobicContact CD1-CD2 3.52Å; C320-L364 HydrophobicContact CB-CD2 4.06Å; I321-L364 HydrophobicContact CG1-CD1 4.34Å; I321-L364 HydrophobicContact CG1-CD2 4.15Å; A324-L364 HydrophobicContact CB-CD1 4.39Å; L360-L364 WeakPolarHBondContact O-CB 3.11Å; L360-L364 WeakPolarHBondContact O-CG 3.46Å; L360-L364 PolarHBondContact O-N 2.87Å; L361-L364 PolarHBondContact O-N 3.29Å; I362-L364 PolarHBondContact O-N 2.94Å
365	T	79.3	Confident	74.3	Confident	59 Å²	59	52.5 Å²	52.5	36%	0.362	27%	0.273	S	S	.	.	H	α-helix	trans	-85.5	-8	176.1	60.1	0	0	0	0	113.8	L361 I362 Y363 L368 L369	L361-T365 WeakPolarHBondContact O-CB 3.28Å; L361-T365 VanDerWaalsContact O-CG2 3.29Å; L361-T365 WeakPolarHBondContact O-CG2 3.35Å; L361-T365 PolarHBondContact O-N 3.01Å; L361-T365 PolarHBondContact O-OG1 2.93Å; I362-T365 PolarHBondContact O-N 2.94Å; I362-T365 PolarHBondContact O-OG1 3.39Å; Y363-T365 VanDerWaalsContact C-N 3.29Å; Y363-T365 PolarHBondContact O-N 2.91Å; T365-L368 PolarHBondContact O-N 2.87Å; T365-L369 WeakPolarHBondContact O-CG 3.25Å; T365-L369 PolarHBondContact O-N 3.26Å; T365-L369 WeakPolarHBondContact OG1-CD1 3.47Å
366	L	75.1	Confident	71.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-51.5	-49.5	-177	-166.8	66.5	0	0	0	113.7	F275 I362 Y363 L368 L369 I370 V384 P542	F275-L366 HydrophobicContact CB-CD2 4.14Å; F275-L366 HydrophobicContact CD1-CD2 3.6Å; F275-L366 HydrophobicContact CG-CD2 4.31Å; I362-L366 PolarHBondContact O-N 3.41Å; Y363-L366 WeakPolarHBondContact O-CB 3.3Å; Y363-L366 PolarHBondContact O-N 3.48Å; L366-L368 VanDerWaalsContact C-N 3.29Å; L366-L368 PolarHBondContact O-N 3.47Å; L366-L369 PolarHBondContact O-N 3.43Å; L366-I370 HydrophobicContact CD1-CD1 3.75Å; L366-I370 HydrophobicContact CD1-CG1 4.38Å; L366-I370 HydrophobicContact CG-CD1 3.8Å; L366-I370 WeakPolarHBondContact O-CG1 3.33Å; L366-I370 PolarHBondContact O-N 3.04Å; L366-I370 VanDerWaalsContact O-N 3.1Å; L366-V384 HydrophobicContact CD1-CB 4.39Å; L366-V384 HydrophobicContact CD1-CG1 3.15Å; L366-P542 HydrophobicContact CD1-CG 3.61Å; L366-P542 HydrophobicContact CD2-CG 4.17Å; L366-P542 HydrophobicContact CG-CG 4.39Å
367	P	65.1	Low	69.4	Low	30 Å²	30	55.2 Å²	55.2	20%	0.195	30%	0.297	C	S	.	.	H	α-helix	trans	-65.7	-34.3	-179.3	-17.2	32.4	0	0	0	111.8	N371	P367-N371 WeakPolarHBondContact O-CB 3.36Å; P367-N371 PolarHBondContact O-N 3.34Å; P367-N371 PolarHBondContact O-ND2 3.25Å
368	L	65.5	Low	67.7	Low	109 Å²	109	57.3 Å²	57.3	57%	0.571	31%	0.313	S	S	*	.	H	α-helix	trans	-70.7	-45.2	178.4	-73.9	81.7	0	0	0	110.9	T365 L366 I370 Q372	T365-L368 PolarHBondContact O-N 2.87Å; L366-L368 VanDerWaalsContact C-N 3.29Å; L366-L368 PolarHBondContact O-N 3.47Å; L368-I370 VanDerWaalsContact C-N 3.31Å; L368-I370 PolarHBondContact O-N 3.01Å; L368-Q372 WeakPolarHBondContact O-CB 3.38Å; L368-Q372 PolarHBondContact O-N 3.17Å; L368-Q372 VanDerWaalsContact O-N 3.12Å
369	L	63.5	Low	66.4	Low	77 Å²	77	56.3 Å²	56.3	40%	0.403	31%	0.307	S	S	.	.	H	α-helix	trans	-64.9	-36	-177.3	-70.9	169.4	0	0	0	112.4	T365 L366 V384	T365-L369 WeakPolarHBondContact O-CG 3.25Å; T365-L369 PolarHBondContact O-N 3.26Å; T365-L369 WeakPolarHBondContact OG1-CD1 3.47Å; L366-L369 PolarHBondContact O-N 3.43Å; L369-V384 HydrophobicContact CB-CG2 4.32Å; L369-V384 HydrophobicContact CD1-CG2 3.69Å
370	I	61.3	Low	65.4	Low	22 Å²	22	58 Å²	58	11%	0.113	32%	0.319	C	S	.	.	H	α-helix	trans	-83.4	-41.8	-179.1	-62.8	175.3	0	0	0	111.3	L366 L368 Q372 K540 P542	L366-I370 HydrophobicContact CD1-CD1 3.75Å; L366-I370 HydrophobicContact CD1-CG1 4.38Å; L366-I370 HydrophobicContact CG-CD1 3.8Å; L366-I370 WeakPolarHBondContact O-CG1 3.33Å; L366-I370 PolarHBondContact O-N 3.04Å; L366-I370 VanDerWaalsContact O-N 3.1Å; L368-I370 VanDerWaalsContact C-N 3.31Å; L368-I370 PolarHBondContact O-N 3.01Å; I370-Q372 PolarHBondContact O-N 3.33Å; I370-K540 WeakPolarHBondContact CD1-O 3.24Å; I370-K540 HydrophobicContact CG2-CB 3.73Å; I370-K540 HydrophobicContact CG2-CD 3.81Å; I370-K540 HydrophobicContact CG2-CG 3.54Å; I370-P542 HydrophobicContact CD1-CG 4.2Å
371	N	52.9	Low	64.7	Low	84 Å²	84	58 Å²	58	45%	0.449	32%	0.319	S	S	.	.	H	α-helix	trans	-77.8	-20.4	-175.5	-68.5	-33.9	0	0	0	113.7	P367 K373	P367-N371 WeakPolarHBondContact O-CB 3.36Å; P367-N371 PolarHBondContact O-N 3.34Å; P367-N371 PolarHBondContact O-ND2 3.25Å; N371-K373 VanDerWaalsContact C-N 3.3Å; N371-K373 PolarHBondContact O-N 3.36Å
372	Q	49.9	Very low	64.2	Low	164 Å²	164	54.2 Å²	54.2	77%	0.766	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	0.8	-173.9	-158	172.6	-5.5	0	0	113.9	L368 I370	L368-Q372 WeakPolarHBondContact O-CB 3.38Å; L368-Q372 PolarHBondContact O-N 3.17Å; L368-Q372 VanDerWaalsContact O-N 3.12Å; I370-Q372 PolarHBondContact O-N 3.33Å
373	K	47.8	Very low	63.9	Low	97 Å²	97	54.1 Å²	54.1	42%	0.422	30%	0.3	S	S	.	.			trans	-144.5	51.6	-165.8	-143	163.9	170.9	179.6	0	115.9	N371 N375 S376	N371-K373 VanDerWaalsContact C-N 3.3Å; N371-K373 PolarHBondContact O-N 3.36Å; K373-N375 PolarHBondContact O-N 2.89Å; K373-S376 WeakPolarHBondContact CE-O 3.16Å; K373-S376 WeakPolarHBondContact CE-OG 3.41Å; K373-S376 WeakPolarHBondContact CG-O 3.42Å; K373-S376 PolarHBondContact NZ-OG 3.01Å; K373-S376 PolarHBondContact O-N 3.4Å
374	D	45	Very low	63.7	Low	119 Å²	119	53.7 Å²	53.7	64%	0.636	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-15.6	166.5	-77.4	-24.5	0	0	0	113.4
375	N	41.3	Very low	63.8	Low	121 Å²	121	51.6 Å²	51.6	65%	0.647	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	6.8	-173.7	-86.8	-0.4	0	0	0	116.3	R249 K373	R249-N375 PolarHBondContact NH2-O 3.06Å; K373-N375 PolarHBondContact O-N 2.89Å
376	S	37.3	Very low	64.3	Low	36 Å²	36	48.9 Å²	48.9	25%	0.252	27%	0.271	S	S	.	.	S	Bend	trans	-156.4	114.9	174.6	158.4	0	0	0	0	113.6	K373	K373-S376 WeakPolarHBondContact CE-O 3.16Å; K373-S376 WeakPolarHBondContact CE-OG 3.41Å; K373-S376 WeakPolarHBondContact CG-O 3.42Å; K373-S376 PolarHBondContact NZ-OG 3.01Å; K373-S376 PolarHBondContact O-N 3.4Å
377	G	50.2	Low	65.1	Low	30 Å²	30	49.7 Å²	49.7	31%	0.309	28%	0.276	S	S	.	.			trans	73.4	121.2	152.5	0	0	0	0	0	116.7	G379 S380	G377-G379 PolarHBondContact O-N 3.47Å; G377-S380 PolarHBondContact O-N 3.29Å
378	S	57.8	Low	66.3	Low	63 Å²	63	48.3 Å²	48.3	44%	0.441	27%	0.266	S	S	.	.	H	α-helix	trans	-48.4	-21.4	155.7	40.4	0	0	0	0	112.8	S380 C381 L382	S378-S380 PolarHBondContact O-N 2.97Å; S378-C381 PolarHBondContact O-N 3.48Å; S378-L382 WeakPolarHBondContact O-CB 3.37Å; S378-L382 PolarHBondContact O-N 3.1Å
379	G	66.5	Low	67.6	Low	2 Å²	2	43.1 Å²	43.1	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-57.4	-37.1	179.7	0	0	0	0	0	115.3	G377 L382 T383	G377-G379 PolarHBondContact O-N 3.47Å; G379-L382 PolarHBondContact O-N 3.06Å; G379-T383 WeakPolarHBondContact O-CB 3.32Å; G379-T383 PolarHBondContact O-N 3.25Å; G379-T383 PolarHBondContact O-OG1 2.83Å
380	S	70.4	Confident	69.1	Low	34 Å²	34	39.4 Å²	39.4	24%	0.238	22%	0.22	C	C	.	.	H	α-helix	trans	-69.8	-43.1	-178.7	64.2	0	0	0	0	112.3	G377 S378 T383 V384	G377-S380 PolarHBondContact O-N 3.29Å; S378-S380 PolarHBondContact O-N 2.97Å; S380-T383 WeakPolarHBondContact O-CB 3.27Å; S380-T383 PolarHBondContact O-N 3.27Å; S380-V384 VanDerWaalsContact O-CG2 3.29Å; S380-V384 WeakPolarHBondContact O-CG2 3.22Å; S380-V384 PolarHBondContact O-N 3.36Å
381	C	77.4	Confident	70.7	Confident	7 Å²	7	38.5 Å²	38.5	5%	0.047	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-45.7	174.5	-179	0	0	0	0	110.4	S378 T383 V384 A385 C534 R539	S378-C381 PolarHBondContact O-N 3.48Å; C381-T383 VanDerWaalsContact C-N 3.34Å; C381-T383 PolarHBondContact O-N 2.65Å; C381-V384 WeakPolarHBondContact O-CB 3.34Å; C381-V384 PolarHBondContact O-N 3.44Å; C381-A385 PolarHBondContact O-N 2.98Å; C381-C534 HydrophobicContact CB-CB 3.75Å; C381-C534 WeakPolarHBondContact CB-SG 3.41Å; C381-C534 PolarHBondContact O-SG 2.83Å; C381-C534 WeakPolarHBondContact SG-CB 3.37Å; C381-C534 CovalentContact SG-SG 2.03Å; C381-C534 PolarHBondContact SG-SG 3.08Å; C381-R539 PolarHBondContact SG-O 3.11Å
382	L	80.8	Confident	72.6	Confident	7 Å²	7	34.5 Å²	34.5	4%	0.037	19%	0.194	C	C	.	.	H	α-helix	trans	-61.4	-44	179	-177.8	61.7	0	0	0	111.4	S378 G379 V384 A385 V386 L484 N487 Q488 F533 C534	S378-L382 WeakPolarHBondContact O-CB 3.37Å; S378-L382 PolarHBondContact O-N 3.1Å; G379-L382 PolarHBondContact O-N 3.06Å; L382-V384 VanDerWaalsContact C-N 3.32Å; L382-V384 PolarHBondContact O-N 3.46Å; L382-A385 WeakPolarHBondContact O-CB 3.4Å; L382-A385 PolarHBondContact O-N 3.41Å; L382-A385 VanDerWaalsContact O-N 3.15Å; L382-V386 HydrophobicContact CD1-CG2 4.3Å; L382-V386 HydrophobicContact CG-CG2 4.45Å; L382-V386 VanDerWaalsContact O-CG2 3.28Å; L382-V386 WeakPolarHBondContact O-CG2 3.32Å; L382-V386 PolarHBondContact O-N 2.93Å; L382-L484 HydrophobicContact CD1-CD1 3.95Å; L382-L484 HydrophobicContact CD2-CD1 4.02Å; L382-L484 HydrophobicContact CG-CD1 4.11Å; L382-N487 WeakPolarHBondContact CD1-ND2 3.42Å; L382-Q488 HydrophobicContact CD2-CG 4.4Å; L382-F533 HydrophobicContact CD1-CB 4.04Å; L382-F533 HydrophobicContact CD1-CD2 4.47Å; L382-C534 PolarHBondContact N-SG 3.42Å; L382-C534 VanDerWaalsContact N-SG 3.4Å
383	T	82.1	Confident	74.8	Confident	18 Å²	18	26.9 Å²	26.9	11%	0.11	16%	0.158	C	C	.	.	H	α-helix	trans	-55.3	-49.5	175.2	-64.6	0	0	0	0	111.3	L21 S24 G379 S380 C381 A385 V386 L387	L21-T383 HydrophobicContact CD2-CG2 3.44Å; L21-T383 VanDerWaalsContact CD2-CG2 3.44Å; S24-T383 VanDerWaalsContact CB-OG1 3.28Å; S24-T383 WeakPolarHBondContact CB-OG1 3.3Å; S24-T383 WeakPolarHBondContact OG-CB 3.33Å; S24-T383 PolarHBondContact OG-OG1 3.06Å; G379-T383 WeakPolarHBondContact O-CB 3.32Å; G379-T383 PolarHBondContact O-N 3.25Å; G379-T383 PolarHBondContact O-OG1 2.83Å; S380-T383 WeakPolarHBondContact O-CB 3.27Å; S380-T383 PolarHBondContact O-N 3.27Å; C381-T383 VanDerWaalsContact C-N 3.34Å; C381-T383 PolarHBondContact O-N 2.65Å; T383-A385 VanDerWaalsContact C-N 3.35Å; T383-A385 PolarHBondContact O-N 3.43Å; T383-V386 PolarHBondContact O-N 3.49Å; T383-L387 HydrophobicContact CG2-CD1 3.85Å; T383-L387 HydrophobicContact CG2-CG 4.42Å; T383-L387 WeakPolarHBondContact O-CB 3.36Å; T383-L387 VanDerWaalsContact O-CG 3.26Å; T383-L387 WeakPolarHBondContact O-CG 3.47Å; T383-L387 PolarHBondContact O-N 3.42Å
384	V	83.5	Confident	77	Confident	5 Å²	5	22.2 Å²	22.2	3%	0.03	14%	0.138	C	C	.	.	H	α-helix	trans	-60.1	-46.9	177	166.7	0	0	0	0	110.5	I362 L366 L369 S380 C381 L382 V386 L387 L388 P542	I362-V384 HydrophobicContact CG2-CG1 4.19Å; L366-V384 HydrophobicContact CD1-CB 4.39Å; L366-V384 HydrophobicContact CD1-CG1 3.15Å; L369-V384 HydrophobicContact CB-CG2 4.32Å; L369-V384 HydrophobicContact CD1-CG2 3.69Å; S380-V384 VanDerWaalsContact O-CG2 3.29Å; S380-V384 WeakPolarHBondContact O-CG2 3.22Å; S380-V384 PolarHBondContact O-N 3.36Å; C381-V384 WeakPolarHBondContact O-CB 3.34Å; C381-V384 PolarHBondContact O-N 3.44Å; L382-V384 VanDerWaalsContact C-N 3.32Å; L382-V384 PolarHBondContact O-N 3.46Å; V384-V386 VanDerWaalsContact C-N 3.35Å; V384-V386 PolarHBondContact O-N 3.15Å; V384-L387 PolarHBondContact O-N 3.24Å; V384-L388 WeakPolarHBondContact O-CB 3.44Å; V384-L388 PolarHBondContact O-N 3.35Å; V384-P542 HydrophobicContact CB-CB 4.23Å; V384-P542 HydrophobicContact CG1-CB 3.7Å; V384-P542 HydrophobicContact CG1-CG 3.93Å
385	A	86.5	Confident	79.4	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-58.1	-46.3	-179.6	0	0	0	0	0	112.1	C381 L382 T383 L388 H389 F533 P542	C381-A385 PolarHBondContact O-N 2.98Å; L382-A385 WeakPolarHBondContact O-CB 3.4Å; L382-A385 PolarHBondContact O-N 3.41Å; L382-A385 VanDerWaalsContact O-N 3.15Å; T383-A385 VanDerWaalsContact C-N 3.35Å; T383-A385 PolarHBondContact O-N 3.43Å; A385-L388 PolarHBondContact O-N 2.92Å; A385-H389 WeakPolarHBondContact O-CB 3.48Å; A385-H389 PolarHBondContact O-N 3.44Å; A385-F533 HydrophobicContact CB-CB 3.92Å; A385-F533 HydrophobicContact CB-CD1 4.01Å; A385-F533 HydrophobicContact CB-CD2 4.4Å; A385-F533 HydrophobicContact CB-CG 3.88Å; A385-P542 VanDerWaalsContact CA-O 3.28Å; A385-P542 WeakPolarHBondContact CA-O 3.48Å; A385-P542 HydrophobicContact CB-CB 3.93Å; A385-P542 VanDerWaalsContact CB-O 3.27Å; A385-P542 WeakPolarHBondContact CB-O 3.26Å
386	V	90.5	Very high	82	Confident	1 Å²	1	10.9 Å²	10.9	1%	0.006	8%	0.077	C	C	.	.	H	α-helix	trans	-64.3	-47.3	178.9	171.8	0	0	0	0	111.6	L20 L382 T383 V384 L388 H389 Y390 V480 L484	L20-V386 HydrophobicContact CB-CG1 4.17Å; L20-V386 HydrophobicContact CD1-CG1 4.37Å; L20-V386 HydrophobicContact CD2-CG1 3.75Å; L20-V386 HydrophobicContact CG-CG1 4.3Å; L382-V386 HydrophobicContact CD1-CG2 4.3Å; L382-V386 HydrophobicContact CG-CG2 4.45Å; L382-V386 VanDerWaalsContact O-CG2 3.28Å; L382-V386 WeakPolarHBondContact O-CG2 3.32Å; L382-V386 PolarHBondContact O-N 2.93Å; T383-V386 PolarHBondContact O-N 3.49Å; V384-V386 VanDerWaalsContact C-N 3.35Å; V384-V386 PolarHBondContact O-N 3.15Å; V386-L388 VanDerWaalsContact C-N 3.33Å; V386-L388 PolarHBondContact O-N 2.89Å; V386-H389 PolarHBondContact O-N 2.86Å; V386-Y390 WeakPolarHBondContact O-CB 3.46Å; V386-Y390 PolarHBondContact O-N 2.57Å; V386-V480 HydrophobicContact CG1-CG1 3.8Å; V386-L484 HydrophobicContact CG1-CD2 4.3Å; V386-L484 HydrophobicContact CG2-CB 4.34Å; V386-L484 HydrophobicContact CG2-CD1 3.62Å; V386-L484 HydrophobicContact CG2-CD2 4.01Å; V386-L484 HydrophobicContact CG2-CG 4.2Å
387	L	90.9	Very high	84.7	Confident	18 Å²	18	9.2 Å²	9.2	9%	0.094	7%	0.065	C	C	.	.	H	α-helix	trans	-64.2	-42	179	-69.6	172.9	0	0	0	111	L20 L21 I362 T383 V384 Y390 F391	L20-L387 HydrophobicContact CB-CD2 3.95Å; L20-L387 HydrophobicContact CD1-CD2 3.97Å; L21-L387 HydrophobicContact CD2-CD1 4.34Å; I362-L387 HydrophobicContact CD1-CB 3.64Å; I362-L387 HydrophobicContact CD1-CD1 4.48Å; T383-L387 HydrophobicContact CG2-CD1 3.85Å; T383-L387 HydrophobicContact CG2-CG 4.42Å; T383-L387 WeakPolarHBondContact O-CB 3.36Å; T383-L387 VanDerWaalsContact O-CG 3.26Å; T383-L387 WeakPolarHBondContact O-CG 3.47Å; T383-L387 PolarHBondContact O-N 3.42Å; V384-L387 PolarHBondContact O-N 3.24Å; L387-Y390 PolarHBondContact O-N 3.4Å; L387-F391 HydrophobicContact CB-CD2 4.45Å; L387-F391 HydrophobicContact CD2-CE2 4.19Å; L387-F391 WeakPolarHBondContact O-CD2 3.45Å; L387-F391 PolarHBondContact O-N 2.97Å
388	L	90.7	Very high	86.9	Confident	0 Å²	0	7.8 Å²	7.8	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-61.5	-49.7	178	-164.3	71.4	0	0	0	110.8	F275 F280 L359 I362 V384 A385 V386 Y390 F391 F392 W543	F275-L388 HydrophobicContact CE1-CD2 4.05Å; F280-L388 HydrophobicContact CE1-CD1 3.93Å; F280-L388 HydrophobicContact CE1-CD2 3.39Å; F280-L388 HydrophobicContact CE1-CG 3.6Å; F280-L388 HydrophobicContact CZ-CD1 3.72Å; F280-L388 HydrophobicContact CZ-CD2 3.81Å; F280-L388 HydrophobicContact CZ-CG 3.95Å; L359-L388 HydrophobicContact CD1-CD1 3.77Å; L359-L388 HydrophobicContact CD1-CG 4.46Å; I362-L388 HydrophobicContact CG2-CB 4.47Å; I362-L388 HydrophobicContact CG2-CD1 3.99Å; V384-L388 WeakPolarHBondContact O-CB 3.44Å; V384-L388 PolarHBondContact O-N 3.35Å; A385-L388 PolarHBondContact O-N 2.92Å; V386-L388 VanDerWaalsContact C-N 3.33Å; V386-L388 PolarHBondContact O-N 2.89Å; L388-Y390 PolarHBondContact O-N 3.44Å; L388-F391 PolarHBondContact O-N 3.49Å; L388-F392 VanDerWaalsContact O-CB 3.3Å; L388-F392 WeakPolarHBondContact O-CB 3.23Å; L388-F392 PolarHBondContact O-N 3.37Å; L388-F392 VanDerWaalsContact O-N 3.12Å; L388-W543 HydrophobicContact CB-CZ3 4.3Å; L388-W543 HydrophobicContact CD2-CE3 3.7Å; L388-W543 HydrophobicContact CD2-CZ3 3.91Å; L388-W543 HydrophobicContact CG-CE3 4.22Å; L388-W543 HydrophobicContact CG-CZ3 3.9Å
389	H	93.7	Very high	88.6	Confident	0 Å²	0	4.8 Å²	4.8	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-57.9	-46.1	175.8	-176.3	-161.5	0	0	0	111.7	A385 V386 L393 V480 F533 W543 F544 W553 F554	A385-H389 WeakPolarHBondContact O-CB 3.48Å; A385-H389 PolarHBondContact O-N 3.44Å; V386-H389 PolarHBondContact O-N 2.86Å; H389-L393 WeakPolarHBondContact NE2-CD1 3.49Å; H389-L393 PolarHBondContact O-N 2.84Å; H389-V480 HydrophobicContact CB-CG2 4.38Å; H389-F533 AromaticContact ND1-CZ 3.97Å; H389-W543 HydrophobicContact CB-CZ3 4.47Å; H389-F544 AromaticContact CE1-CZ 3.64Å; H389-F544 AromaticContact ND1-CZ 3.93Å; H389-F544 AromaticContact NE2-CZ 3.73Å; H389-W553 PolarHBondContact NE2-O 2.85Å; H389-F554 AromaticContact CD2-CD2 3.81Å
390	Y	94.9	Very high	89.9	Confident	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-61.3	-54.8	177.8	174.1	-99	0	0	0	113	I16 L20 V386 L387 L388 F392 L393 A394 P476 L477 V480	I16-Y390 VanDerWaalsContact CD1-OH 3.23Å; I16-Y390 WeakPolarHBondContact CD1-OH 3.34Å; I16-Y390 HydrophobicContact CG2-CD1 4.23Å; I16-Y390 HydrophobicContact CG2-CD2 4.35Å; I16-Y390 HydrophobicContact CG2-CE1 3.72Å; I16-Y390 HydrophobicContact CG2-CE2 3.85Å; L20-Y390 HydrophobicContact CD1-CD1 3.91Å; L20-Y390 HydrophobicContact CD1-CD2 4.16Å; L20-Y390 HydrophobicContact CD1-CG 3.63Å; V386-Y390 WeakPolarHBondContact O-CB 3.46Å; V386-Y390 PolarHBondContact O-N 2.57Å; L387-Y390 PolarHBondContact O-N 3.4Å; L388-Y390 PolarHBondContact O-N 3.44Å; Y390-F392 PolarHBondContact O-N 3.46Å; Y390-L393 PolarHBondContact O-N 3.11Å; Y390-A394 HydrophobicContact CE1-CB 4.17Å; Y390-A394 VanDerWaalsContact O-CB 3.22Å; Y390-A394 WeakPolarHBondContact O-CB 3.36Å; Y390-A394 PolarHBondContact O-N 2.95Å; Y390-P476 HydrophobicContact CD2-CB 3.7Å; Y390-P476 HydrophobicContact CE2-CB 3.7Å; Y390-P476 HydrophobicContact CE2-CG 4.31Å; Y390-L477 HydrophobicContact CD2-CD2 3.72Å; Y390-L477 HydrophobicContact CD2-CG 4.29Å; Y390-L477 HydrophobicContact CE2-CD2 3.67Å; Y390-L477 HydrophobicContact CE2-CG 3.86Å; Y390-V480 HydrophobicContact CD2-CG2 4.49Å
391	F	94.3	Very high	91	Very high	2 Å²	2	3 Å²	3	1%	0.009	2%	0.017	C	C	.	.	H	α-helix	trans	-68.2	-26.9	-174	-79.5	-65.7	0	0	0	113.1	I17 C358 L359 I362 L387 L388 T395	I17-F391 HydrophobicContact CD1-CE2 4.35Å; I17-F391 HydrophobicContact CD1-CZ 3.77Å; I17-F391 HydrophobicContact CG1-CE2 3.91Å; I17-F391 HydrophobicContact CG1-CZ 3.55Å; C358-F391 HydrophobicContact CB-CD1 3.51Å; C358-F391 HydrophobicContact CB-CD2 3.95Å; C358-F391 HydrophobicContact CB-CE1 3.36Å; C358-F391 HydrophobicContact CB-CE2 3.81Å; C358-F391 HydrophobicContact CB-CG 3.82Å; C358-F391 HydrophobicContact CB-CZ 3.52Å; L359-F391 HydrophobicContact CB-CB 3.98Å; L359-F391 HydrophobicContact CD1-CB 4.14Å; I362-F391 HydrophobicContact CD1-CD2 3.34Å; I362-F391 HydrophobicContact CD1-CE2 3.75Å; I362-F391 HydrophobicContact CD1-CG 4.36Å; L387-F391 HydrophobicContact CB-CD2 4.45Å; L387-F391 HydrophobicContact CD2-CE2 4.19Å; L387-F391 WeakPolarHBondContact O-CD2 3.45Å; L387-F391 PolarHBondContact O-N 2.97Å; L388-F391 PolarHBondContact O-N 3.49Å; F391-T395 WeakPolarHBondContact O-CB 3.35Å; F391-T395 PolarHBondContact O-N 3.34Å; F391-T395 PolarHBondContact O-OG1 3.16Å
392	F	93.8	Very high	91.6	Very high	1 Å²	1	3 Å²	3	0%	0.004	2%	0.017	C	C	.	.	H	α-helix	trans	-67.8	-51.8	173.9	-148.5	-68.4	0	0	0	110.9	F280 L359 L388 Y390 A394 T395 F396 F554 W626	F280-F392 HydrophobicContact CB-CE2 3.72Å; F280-F392 HydrophobicContact CB-CZ 3.94Å; F280-F392 HydrophobicContact CD1-CD2 4.2Å; F280-F392 AromaticContact CD1-CE2 3.9Å; F280-F392 HydrophobicContact CD1-CE2 3.9Å; F280-F392 AromaticContact CD2-CE2 3.85Å; F280-F392 HydrophobicContact CD2-CE2 3.85Å; F280-F392 HydrophobicContact CE1-CD2 4.49Å; F280-F392 HydrophobicContact CE1-CE2 4.48Å; F280-F392 HydrophobicContact CE2-CE2 4.48Å; F280-F392 HydrophobicContact CG-CD2 4.31Å; F280-F392 AromaticContact CG-CE2 3.57Å; F280-F392 HydrophobicContact CG-CE2 3.57Å; F280-F392 HydrophobicContact CG-CZ 4.3Å; L359-F392 HydrophobicContact CD1-CB 4.2Å; L359-F392 HydrophobicContact CD1-CD2 3.98Å; L359-F392 HydrophobicContact CD2-CD2 3.79Å; L359-F392 HydrophobicContact CD2-CE2 4.32Å; L359-F392 HydrophobicContact CD2-CG 4.28Å; L388-F392 VanDerWaalsContact O-CB 3.3Å; L388-F392 WeakPolarHBondContact O-CB 3.23Å; L388-F392 PolarHBondContact O-N 3.37Å; L388-F392 VanDerWaalsContact O-N 3.12Å; Y390-F392 PolarHBondContact O-N 3.46Å; F392-A394 PolarHBondContact O-N 2.81Å; F392-T395 WeakPolarHBondContact O-CB 3.15Å; F392-T395 PolarHBondContact O-N 2.71Å; F392-F396 HydrophobicContact CD1-CD2 4.06Å; F392-F396 AromaticContact CD1-CE2 3.33Å; F392-F396 HydrophobicContact CD1-CE2 3.33Å; F392-F396 HydrophobicContact CD1-CZ 4.13Å; F392-F396 HydrophobicContact CE1-CD2 4.41Å; F392-F396 AromaticContact CE1-CE2 3.3Å; F392-F396 HydrophobicContact CE1-CE2 3.3Å; F392-F396 AromaticContact CE1-CZ 3.66Å; F392-F396 HydrophobicContact CE1-CZ 3.66Å; F392-F396 VanDerWaalsContact O-CD2 3.32Å; F392-F396 WeakPolarHBondContact O-CD2 3.09Å; F392-F396 PolarHBondContact O-N 3.47Å; F392-F554 HydrophobicContact CB-CE2 3.94Å; F392-F554 AromaticContact CD1-CE2 3.46Å; F392-F554 HydrophobicContact CD1-CE2 3.46Å; F392-F554 VanDerWaalsContact CD1-CE2 3.46Å; F392-F554 AromaticContact CD1-CZ 3.34Å; F392-F554 HydrophobicContact CD1-CZ 3.34Å; F392-F554 HydrophobicContact CD2-CZ 4.36Å; F392-F554 HydrophobicContact CE1-CE1 4.44Å; F392-F554 HydrophobicContact CE1-CE2 4.06Å; F392-F554 AromaticContact CE1-CZ 3.43Å; F392-F554 HydrophobicContact CE1-CZ 3.43Å; F392-F554 VanDerWaalsContact CE1-CZ 3.43Å; F392-F554 HydrophobicContact CE2-CZ 4.44Å; F392-F554 AromaticContact CG-CE2 3.75Å; F392-F554 HydrophobicContact CG-CE2 3.75Å; F392-F554 AromaticContact CG-CZ 3.83Å; F392-F554 HydrophobicContact CG-CZ 3.83Å; F392-F554 AromaticContact CZ-CZ 3.98Å; F392-F554 HydrophobicContact CZ-CZ 3.98Å; F392-W626 HydrophobicContact CE1-CE3 4.34Å; F392-W626 HydrophobicContact CE1-CH2 4.09Å; F392-W626 AromaticContact CE1-CZ3 3.82Å; F392-W626 HydrophobicContact CE1-CZ3 3.82Å; F392-W626 HydrophobicContact CE2-CH2 4.03Å; F392-W626 HydrophobicContact CE2-CZ3 4.15Å; F392-W626 HydrophobicContact CZ-CE3 4.2Å; F392-W626 AromaticContact CZ-CH2 3.56Å; F392-W626 HydrophobicContact CZ-CH2 3.56Å; F392-W626 AromaticContact CZ-CZ3 3.3Å; F392-W626 HydrophobicContact CZ-CZ3 3.3Å
393	L	95.3	Very high	92	Very high	3 Å²	3	2.7 Å²	2.7	2%	0.016	2%	0.015	C	C	.	.	H	α-helix	trans	-63.9	-39.9	175.1	-74.4	-179.5	0	0	0	112.4	H389 Y390 T395 F396 A397 P476 F479 V480 F554 P557	H389-L393 WeakPolarHBondContact NE2-CD1 3.49Å; H389-L393 PolarHBondContact O-N 2.84Å; Y390-L393 PolarHBondContact O-N 3.11Å; L393-T395 VanDerWaalsContact C-N 3.26Å; L393-T395 PolarHBondContact O-N 2.86Å; L393-F396 PolarHBondContact O-N 2.82Å; L393-A397 WeakPolarHBondContact O-CB 3.43Å; L393-A397 PolarHBondContact O-N 2.93Å; L393-P476 HydrophobicContact CB-CB 3.8Å; L393-P476 HydrophobicContact CB-CG 4.17Å; L393-F479 HydrophobicContact CD1-CB 3.83Å; L393-F479 HydrophobicContact CD1-CG 4.42Å; L393-V480 HydrophobicContact CD1-CG2 4.31Å; L393-F554 HydrophobicContact CD2-CD2 4.19Å; L393-F554 HydrophobicContact CG-CD2 4.3Å; L393-P557 HydrophobicContact CD2-CB 4.16Å; L393-P557 HydrophobicContact CD2-CG 4.04Å
394	A	94.8	Very high	92.3	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-59.4	-39.7	176.9	0	0	0	0	0	111.2	Y390 F392 A397 W398 P476	Y390-A394 HydrophobicContact CE1-CB 4.17Å; Y390-A394 VanDerWaalsContact O-CB 3.22Å; Y390-A394 WeakPolarHBondContact O-CB 3.36Å; Y390-A394 PolarHBondContact O-N 2.95Å; F392-A394 PolarHBondContact O-N 2.81Å; A394-A397 PolarHBondContact O-N 3.08Å; A394-W398 WeakPolarHBondContact O-CB 3.33Å; A394-W398 PolarHBondContact O-N 2.94Å; A394-P476 VanDerWaalsContact CA-CG 3.43Å; A394-P476 HydrophobicContact CB-CB 4.48Å; A394-P476 HydrophobicContact CB-CG 3.9Å
395	T	94.7	Very high	92.4	Very high	1 Å²	1	5.4 Å²	5.4	1%	0.006	3%	0.03	C	C	.	.	H	α-helix	trans	-59.9	-49.6	175.5	-62.6	0	0	0	0	111.6	L352 S355 M356 F391 F392 L393 A397 W398 M399	L352-T395 HydrophobicContact CD1-CG2 3.76Å; S355-T395 WeakPolarHBondContact OG-CA 3.4Å; S355-T395 PolarHBondContact OG-OG1 3.07Å; S355-T395 VanDerWaalsContact OG-OG1 3.06Å; M356-T395 HydrophobicContact CE-CG2 3.17Å; M356-T395 VanDerWaalsContact CE-OG1 3.31Å; M356-T395 WeakPolarHBondContact CE-OG1 3.34Å; M356-T395 HydrophobicContact CG-CG2 3.75Å; M356-T395 HydrophobicContact SD-CG2 3.5Å; M356-T395 VanDerWaalsContact SD-CG2 3.5Å; F391-T395 WeakPolarHBondContact O-CB 3.35Å; F391-T395 PolarHBondContact O-N 3.34Å; F391-T395 PolarHBondContact O-OG1 3.16Å; F392-T395 WeakPolarHBondContact O-CB 3.15Å; F392-T395 PolarHBondContact O-N 2.71Å; L393-T395 VanDerWaalsContact C-N 3.26Å; L393-T395 PolarHBondContact O-N 2.86Å; T395-A397 VanDerWaalsContact C-N 3.3Å; T395-A397 PolarHBondContact O-N 3.26Å; T395-W398 PolarHBondContact O-N 3.38Å; T395-M399 HydrophobicContact CG2-CE 3.73Å; T395-M399 HydrophobicContact CG2-SD 4.41Å; T395-M399 WeakPolarHBondContact O-CG 3.13Å; T395-M399 PolarHBondContact O-N 2.91Å
396	F	95.5	Very high	92.3	Very high	1 Å²	1	6.3 Å²	6.3	0%	0.004	4%	0.035	C	C	.	.	H	α-helix	trans	-61	-40.9	176.2	-66.7	-65.8	0	0	0	112.3	F392 L393 W398 M399 S400 T558 L561 L562 W626	F392-F396 HydrophobicContact CD1-CD2 4.06Å; F392-F396 AromaticContact CD1-CE2 3.33Å; F392-F396 HydrophobicContact CD1-CE2 3.33Å; F392-F396 HydrophobicContact CD1-CZ 4.13Å; F392-F396 HydrophobicContact CE1-CD2 4.41Å; F392-F396 AromaticContact CE1-CE2 3.3Å; F392-F396 HydrophobicContact CE1-CE2 3.3Å; F392-F396 AromaticContact CE1-CZ 3.66Å; F392-F396 HydrophobicContact CE1-CZ 3.66Å; F392-F396 VanDerWaalsContact O-CD2 3.32Å; F392-F396 WeakPolarHBondContact O-CD2 3.09Å; F392-F396 PolarHBondContact O-N 3.47Å; L393-F396 PolarHBondContact O-N 2.82Å; F396-W398 VanDerWaalsContact C-N 3.33Å; F396-W398 PolarHBondContact O-N 3.18Å; F396-M399 HydrophobicContact CB-CE 4.37Å; F396-M399 HydrophobicContact CD1-CE 3.21Å; F396-M399 HydrophobicContact CE1-CE 3.6Å; F396-M399 HydrophobicContact CG-CE 3.99Å; F396-M399 PolarHBondContact O-N 3.07Å; F396-S400 PolarHBondContact O-N 3.25Å; F396-S400 PolarHBondContact O-OG 3.18Å; F396-T558 HydrophobicContact CD1-CG2 4.41Å; F396-T558 HydrophobicContact CD2-CG2 3.69Å; F396-T558 HydrophobicContact CE1-CG2 4.1Å; F396-T558 HydrophobicContact CE2-CG2 3.18Å; F396-T558 HydrophobicContact CG-CG2 4.27Å; F396-T558 HydrophobicContact CZ-CG2 3.48Å; F396-T558 VanDerWaalsContact CZ-CG2 3.48Å; F396-L561 HydrophobicContact CB-CB 4Å; F396-L561 HydrophobicContact CB-CD1 3.63Å; F396-L561 HydrophobicContact CB-CG 4.46Å; F396-L562 HydrophobicContact CD1-CD1 4.4Å; F396-L562 HydrophobicContact CD1-CD2 3.83Å; F396-L562 HydrophobicContact CD1-CG 3.88Å; F396-L562 HydrophobicContact CE1-CD1 3.85Å; F396-L562 HydrophobicContact CE1-CD2 3.68Å; F396-L562 HydrophobicContact CE1-CG 3.79Å; F396-L562 HydrophobicContact CZ-CD1 4.29Å; F396-W626 HydrophobicContact CE1-CB 3.81Å; F396-W626 AromaticContact CE1-CD1 3.95Å; F396-W626 AromaticContact CE1-CD2 3.91Å; F396-W626 HydrophobicContact CE1-CD2 3.91Å; F396-W626 HydrophobicContact CE1-CE3 4.48Å; F396-W626 AromaticContact CE1-CG 3.61Å; F396-W626 HydrophobicContact CE1-CG 3.61Å; F396-W626 HydrophobicContact CZ-CB 4.27Å; F396-W626 AromaticContact CZ-CD2 3.81Å; F396-W626 HydrophobicContact CZ-CD2 3.81Å; F396-W626 AromaticContact CZ-CE3 3.95Å; F396-W626 HydrophobicContact CZ-CE3 3.95Å; F396-W626 AromaticContact CZ-CG 3.98Å; F396-W626 HydrophobicContact CZ-CG 3.98Å
397	A	95.2	Very high	91.9	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-64.7	-36.6	178.1	0	0	0	0	0	112.3	L393 A394 T395 S400 T401 A472 L475 P476	L393-A397 WeakPolarHBondContact O-CB 3.43Å; L393-A397 PolarHBondContact O-N 2.93Å; A394-A397 PolarHBondContact O-N 3.08Å; T395-A397 VanDerWaalsContact C-N 3.3Å; T395-A397 PolarHBondContact O-N 3.26Å; A397-S400 PolarHBondContact O-N 2.89Å; A397-T401 VanDerWaalsContact O-CB 3.27Å; A397-T401 WeakPolarHBondContact O-CB 3.45Å; A397-T401 PolarHBondContact O-N 3.38Å; A397-T401 PolarHBondContact O-OG1 3.18Å; A397-A472 HydrophobicContact CB-CB 4.42Å; A397-L475 HydrophobicContact CB-CD2 4.31Å; A397-P476 HydrophobicContact CB-CG 4.16Å
398	W	94.8	Very high	91.3	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-66.8	-42	171.4	-82.2	113.2	0	0	0	112.2	T9 L348 L352 A394 T395 F396 T401 H402 T469 A472 I473	T9-W398 HydrophobicContact CG2-CH2 4.06Å; L348-W398 HydrophobicContact CD2-CZ3 3.96Å; L352-W398 HydrophobicContact CB-CB 3.99Å; L352-W398 HydrophobicContact CD1-CB 3.89Å; A394-W398 WeakPolarHBondContact O-CB 3.33Å; A394-W398 PolarHBondContact O-N 2.94Å; T395-W398 PolarHBondContact O-N 3.38Å; F396-W398 VanDerWaalsContact C-N 3.33Å; F396-W398 PolarHBondContact O-N 3.18Å; W398-T401 PolarHBondContact O-N 3.44Å; W398-H402 WeakPolarHBondContact O-CB 2.9Å; W398-H402 PolarHBondContact O-N 2.91Å; W398-T469 HydrophobicContact CH2-CG2 3.74Å; W398-T469 HydrophobicContact CZ2-CG2 4.43Å; W398-A472 HydrophobicContact CD2-CB 3.71Å; W398-A472 HydrophobicContact CE3-CB 4Å; W398-A472 HydrophobicContact CG-CB 4.07Å; W398-A472 HydrophobicContact CZ2-CB 4.28Å; W398-A472 HydrophobicContact CZ3-CB 4.4Å; W398-I473 HydrophobicContact CZ2-CG1 4.4Å
399	M	94.6	Very high	90.7	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-61.3	-43.9	174.3	-67.9	-172	-73.9	0	0	111.1	L352 T395 F396 H402 G403 N565 T621 L622 G623 Q652	L352-M399 HydrophobicContact CD1-CG 3.54Å; L352-M399 HydrophobicContact CD2-CG 4Å; L352-M399 HydrophobicContact CG-CG 4.44Å; T395-M399 HydrophobicContact CG2-CE 3.73Å; T395-M399 HydrophobicContact CG2-SD 4.41Å; T395-M399 WeakPolarHBondContact O-CG 3.13Å; T395-M399 PolarHBondContact O-N 2.91Å; F396-M399 HydrophobicContact CB-CE 4.37Å; F396-M399 HydrophobicContact CD1-CE 3.21Å; F396-M399 HydrophobicContact CE1-CE 3.6Å; F396-M399 HydrophobicContact CG-CE 3.99Å; F396-M399 PolarHBondContact O-N 3.07Å; M399-H402 WeakPolarHBondContact O-CB 3.43Å; M399-H402 PolarHBondContact O-N 2.95Å; M399-G403 PolarHBondContact O-N 3.28Å; M399-N565 WeakPolarHBondContact CB-ND2 3.5Å; M399-T621 WeakPolarHBondContact CG-O 3.34Å; M399-L622 WeakPolarHBondContact O-CD2 3.39Å; M399-G623 WeakPolarHBondContact SD-CA 3.36Å; M399-Q652 PolarHBondContact SD-NE2 2.88Å; M399-Q652 VanDerWaalsContact SD-NE2 3.41Å
400	S	93.9	Very high	89.7	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-66.4	-39	175.7	-61.7	0	0	0	0	113.2	F396 A397 H402 G403 L404 L561 N565	F396-S400 PolarHBondContact O-N 3.25Å; F396-S400 PolarHBondContact O-OG 3.18Å; A397-S400 PolarHBondContact O-N 2.89Å; S400-H402 VanDerWaalsContact C-N 3.33Å; S400-H402 PolarHBondContact O-N 2.93Å; S400-G403 PolarHBondContact O-N 3.07Å; S400-L404 WeakPolarHBondContact O-CB 3.45Å; S400-L404 VanDerWaalsContact O-CG 3.31Å; S400-L404 WeakPolarHBondContact O-CG 3.39Å; S400-L404 PolarHBondContact O-N 3.44Å; S400-L561 WeakPolarHBondContact OG-CD2 3.29Å; S400-L561 PolarHBondContact OG-O 3.41Å; S400-N565 WeakPolarHBondContact CA-OD1 3.24Å; S400-N565 WeakPolarHBondContact CB-OD1 3.4Å; S400-N565 PolarHBondContact N-OD1 2.96Å; S400-N565 PolarHBondContact OG-ND2 3.24Å; S400-N565 PolarHBondContact OG-OD1 2.68Å
401	T	92	Very high	88.5	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.1	-43.4	172.6	-71.4	0	0	0	0	111.8	L348 A397 W398 L404 S405 S468	L348-T401 HydrophobicContact CD1-CG2 4.16Å; L348-T401 HydrophobicContact CD2-CG2 3.69Å; L348-T401 HydrophobicContact CG-CG2 4.46Å; A397-T401 VanDerWaalsContact O-CB 3.27Å; A397-T401 WeakPolarHBondContact O-CB 3.45Å; A397-T401 PolarHBondContact O-N 3.38Å; A397-T401 PolarHBondContact O-OG1 3.18Å; W398-T401 PolarHBondContact O-N 3.44Å; T401-L404 PolarHBondContact O-N 3.29Å; T401-S405 WeakPolarHBondContact O-CB 3.22Å; T401-S405 PolarHBondContact O-N 3.47Å; T401-S468 PolarHBondContact OG1-O 2.82Å
402	H	90.2	Very high	87.5	Confident	7 Å²	7	14.6 Å²	14.6	3%	0.032	8%	0.083	C	C	.	.	H	α-helix	trans	-62.2	-44.2	174.2	-167.9	-84.1	0	0	0	111	S345 W398 M399 S400 S405 L406 T621	S345-H402 PolarHBondContact OG-NE2 3.5Å; W398-H402 WeakPolarHBondContact O-CB 2.9Å; W398-H402 PolarHBondContact O-N 2.91Å; M399-H402 WeakPolarHBondContact O-CB 3.43Å; M399-H402 PolarHBondContact O-N 2.95Å; S400-H402 VanDerWaalsContact C-N 3.33Å; S400-H402 PolarHBondContact O-N 2.93Å; H402-S405 WeakPolarHBondContact O-CB 3.11Å; H402-S405 PolarHBondContact O-N 2.95Å; H402-L406 WeakPolarHBondContact O-CG 3.37Å; H402-L406 PolarHBondContact O-N 3.22Å; H402-T621 WeakPolarHBondContact ND1-CG2 3.34Å
403	G	90.2	Very high	86.7	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-59	-48.9	175.4	0	0	0	0	0	113.7	M399 S400 S405 L406 I407 I568	M399-G403 PolarHBondContact O-N 3.28Å; S400-G403 PolarHBondContact O-N 3.07Å; G403-S405 VanDerWaalsContact C-N 3.29Å; G403-S405 PolarHBondContact O-N 3.48Å; G403-L406 WeakPolarHBondContact O-CB 3.28Å; G403-L406 PolarHBondContact O-N 3.43Å; G403-I407 PolarHBondContact O-N 2.76Å; G403-I407 VanDerWaalsContact O-N 3.09Å; G403-I568 WeakPolarHBondContact O-CG2 3.28Å
404	L	88	Confident	85.9	Confident	57 Å²	57	24.2 Å²	24.2	30%	0.298	13%	0.131	S	C	.	.	H	α-helix	trans	-59.9	-43.1	176.7	-71	172.3	0	0	0	110.3	S400 T401 L406 I407 N408 I568	S400-L404 WeakPolarHBondContact O-CB 3.45Å; S400-L404 VanDerWaalsContact O-CG 3.31Å; S400-L404 WeakPolarHBondContact O-CG 3.39Å; S400-L404 PolarHBondContact O-N 3.44Å; T401-L404 PolarHBondContact O-N 3.29Å; L404-L406 VanDerWaalsContact C-N 3.27Å; L404-L406 PolarHBondContact O-N 3.36Å; L404-I407 PolarHBondContact O-N 3.23Å; L404-N408 WeakPolarHBondContact O-CB 3Å; L404-N408 PolarHBondContact O-N 2.82Å; L404-N408 PolarHBondContact O-ND2 3.12Å; L404-I568 HydrophobicContact CD2-CD1 4.09Å; L404-I568 HydrophobicContact CG-CD1 4.24Å
405	S	84.9	Confident	85.1	Confident	22 Å²	22	24.4 Å²	24.4	15%	0.154	13%	0.132	C	C	.	.	H	α-helix	trans	-59.2	-37	175.2	-171.4	0	0	0	0	112.6	L348 T401 H402 G403 N408 T409	L348-S405 VanDerWaalsContact CD1-CB 3.44Å; T401-S405 WeakPolarHBondContact O-CB 3.22Å; T401-S405 PolarHBondContact O-N 3.47Å; H402-S405 WeakPolarHBondContact O-CB 3.11Å; H402-S405 PolarHBondContact O-N 2.95Å; G403-S405 VanDerWaalsContact C-N 3.29Å; G403-S405 PolarHBondContact O-N 3.48Å; S405-N408 PolarHBondContact O-N 2.94Å; S405-T409 WeakPolarHBondContact O-CB 3.34Å; S405-T409 PolarHBondContact O-N 3.37Å; S405-T409 PolarHBondContact O-OG1 3.3Å
406	L	84.6	Confident	84.4	Confident	20 Å²	20	26 Å²	26	11%	0.105	14%	0.143	C	C	.	.	H	α-helix	trans	-66.2	-51.5	177.2	-70.5	166.6	0	0	0	111.8	H402 G403 L404 N408 T409 F410 V572 L618 L622	H402-L406 WeakPolarHBondContact O-CG 3.37Å; H402-L406 PolarHBondContact O-N 3.22Å; G403-L406 WeakPolarHBondContact O-CB 3.28Å; G403-L406 PolarHBondContact O-N 3.43Å; L404-L406 VanDerWaalsContact C-N 3.27Å; L404-L406 PolarHBondContact O-N 3.36Å; L406-N408 PolarHBondContact O-N 3.06Å; L406-T409 WeakPolarHBondContact O-CA 3.23Å; L406-T409 WeakPolarHBondContact O-CB 3.24Å; L406-T409 PolarHBondContact O-N 3.14Å; L406-F410 HydrophobicContact CD2-CE2 4.29Å; L406-F410 WeakPolarHBondContact O-CD2 3.01Å; L406-F410 PolarHBondContact O-N 3.21Å; L406-V572 HydrophobicContact CB-CG2 4.32Å; L406-L618 HydrophobicContact CD1-CD2 3.58Å; L406-L618 HydrophobicContact CD2-CD2 3.98Å; L406-L618 HydrophobicContact CG-CD2 4.45Å; L406-L622 HydrophobicContact CD1-CD1 4.23Å; L406-L622 HydrophobicContact CD1-CD2 4.26Å; L406-L622 HydrophobicContact CD1-CG 4.49Å
407	I	82.2	Confident	83.9	Confident	23 Å²	23	29.6 Å²	29.6	12%	0.118	16%	0.159	C	C	.	.	H	α-helix	trans	-53.1	-46	175.4	-78.9	173.1	0	0	0	110.6	G403 L404 T409 F410 G411 G412 I568 M571 V572	G403-I407 PolarHBondContact O-N 2.76Å; G403-I407 VanDerWaalsContact O-N 3.09Å; L404-I407 PolarHBondContact O-N 3.23Å; I407-T409 PolarHBondContact O-N 3.37Å; I407-F410 PolarHBondContact O-N 3.16Å; I407-G411 PolarHBondContact O-N 3.39Å; I407-G412 WeakPolarHBondContact O-CA 2.92Å; I407-G412 PolarHBondContact O-N 3.41Å; I407-I568 HydrophobicContact CD1-CB 3.87Å; I407-I568 HydrophobicContact CD1-CD1 3.89Å; I407-I568 HydrophobicContact CD1-CG1 3.41Å; I407-I568 VanDerWaalsContact CD1-CG1 3.41Å; I407-I568 HydrophobicContact CD1-CG2 3.72Å; I407-I568 HydrophobicContact CG1-CG1 4.46Å; I407-I568 HydrophobicContact CG1-CG2 3.86Å; I407-M571 HydrophobicContact CD1-CE 3.36Å; I407-M571 HydrophobicContact CG1-CE 4.24Å; I407-V572 HydrophobicContact CG1-CG2 4.03Å
408	N	79.9	Confident	83.3	Confident	27 Å²	27	29.6 Å²	29.6	14%	0.144	16%	0.159	C	C	.	.	H	α-helix	trans	-65.6	-29.8	-179.9	-66.6	-38.1	0	0	0	112.7	L404 S405 L406 R451 R464	L404-N408 WeakPolarHBondContact O-CB 3Å; L404-N408 PolarHBondContact O-N 2.82Å; L404-N408 PolarHBondContact O-ND2 3.12Å; S405-N408 PolarHBondContact O-N 2.94Å; L406-N408 PolarHBondContact O-N 3.06Å; N408-R451 PolarHBondContact O-NH1 3.38Å; N408-R464 PolarHBondContact ND2-NE 3.5Å; N408-R464 PolarHBondContact ND2-NH1 3.41Å; N408-R464 PolarHBondContact ND2-NH2 3.1Å; N408-R464 PolarHBondContact OD1-NH1 3.14Å; N408-R464 PolarHBondContact OD1-NH2 3.27Å
409	T	76.4	Confident	82.8	Confident	86 Å²	86	29.9 Å²	29.9	53%	0.528	16%	0.162	S	C	.	.	H	α-helix	trans	-72	-41.8	175.3	-57.2	0	0	0	0	110.8	S405 L406 I407 G411 R451	S405-T409 WeakPolarHBondContact O-CB 3.34Å; S405-T409 PolarHBondContact O-N 3.37Å; S405-T409 PolarHBondContact O-OG1 3.3Å; L406-T409 WeakPolarHBondContact O-CA 3.23Å; L406-T409 WeakPolarHBondContact O-CB 3.24Å; L406-T409 PolarHBondContact O-N 3.14Å; I407-T409 PolarHBondContact O-N 3.37Å; T409-G411 VanDerWaalsContact C-N 3.3Å; T409-G411 PolarHBondContact O-N 3.02Å; T409-R451 PolarHBondContact O-NH1 3.19Å
410	F	74.2	Confident	82.4	Confident	48 Å²	48	35.1 Å²	35.1	21%	0.211	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	7	-175.8	-72.8	-68.5	0	0	0	116.1	L406 I407 T415 V572 Y575 I576	L406-F410 HydrophobicContact CD2-CE2 4.29Å; L406-F410 WeakPolarHBondContact O-CD2 3.01Å; L406-F410 PolarHBondContact O-N 3.21Å; I407-F410 PolarHBondContact O-N 3.16Å; F410-T415 HydrophobicContact CB-CG2 4.34Å; F410-T415 PolarHBondContact O-OG1 3.05Å; F410-V572 HydrophobicContact CD2-CG1 3.81Å; F410-V572 HydrophobicContact CD2-CG2 4.3Å; F410-V572 HydrophobicContact CE2-CG1 3.67Å; F410-Y575 HydrophobicContact CB-CD1 4.02Å; F410-Y575 HydrophobicContact CB-CE1 4.25Å; F410-Y575 AromaticContact CD1-CD1 3.79Å; F410-Y575 HydrophobicContact CD1-CD1 3.79Å; F410-Y575 AromaticContact CD1-CE1 3.86Å; F410-Y575 HydrophobicContact CD1-CE1 3.86Å; F410-Y575 HydrophobicContact CG-CD1 4.12Å; F410-Y575 HydrophobicContact CG-CE1 4.45Å; F410-I576 HydrophobicContact CE1-CG1 4.48Å; F410-I576 HydrophobicContact CZ-CD1 4.3Å; F410-I576 HydrophobicContact CZ-CG1 4.32Å
411	G	68	Low	82	Confident	2 Å²	2	35.5 Å²	35.5	2%	0.021	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	117.4	-3.5	175.9	0	0	0	0	0	115.2	I407 T409 L413 H414 T415	I407-G411 PolarHBondContact O-N 3.39Å; T409-G411 VanDerWaalsContact C-N 3.3Å; T409-G411 PolarHBondContact O-N 3.02Å; G411-L413 PolarHBondContact O-N 3.03Å; G411-H414 PolarHBondContact O-N 3.02Å; G411-T415 WeakPolarHBondContact CA-OG1 3.46Å; G411-T415 PolarHBondContact N-OG1 3.24Å
412	G	74.1	Confident	81.6	Confident	9 Å²	9	37.6 Å²	37.6	9%	0.093	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	-123.6	174	0	0	0	0	0	112.7	I407 H414 T415 C416	I407-G412 WeakPolarHBondContact O-CA 2.92Å; I407-G412 PolarHBondContact O-N 3.41Å; G412-H414 PolarHBondContact O-N 2.94Å; G412-T415 PolarHBondContact N-OG1 3.2Å; G412-T415 WeakPolarHBondContact O-CB 3.47Å; G412-T415 PolarHBondContact O-N 3.1Å; G412-T415 VanDerWaalsContact O-N 3.15Å; G412-T415 PolarHBondContact O-OG1 3.22Å; G412-C416 PolarHBondContact O-N 3.14Å
413	L	77.6	Confident	81.4	Confident	128 Å²	128	40.1 Å²	40.1	67%	0.67	22%	0.216	S	C	*	.	H	α-helix	trans	-59.8	-33.1	179.8	-168.7	69.3	0	0	0	112.2	G411 T415 C416 Q417	G411-L413 PolarHBondContact O-N 3.03Å; L413-T415 PolarHBondContact O-N 2.87Å; L413-C416 WeakPolarHBondContact O-CB 3.27Å; L413-C416 PolarHBondContact O-N 3.23Å; L413-Q417 WeakPolarHBondContact O-CG 3.03Å; L413-Q417 PolarHBondContact O-N 3.47Å
414	H	78.3	Confident	81.2	Confident	78 Å²	78	45.3 Å²	45.3	36%	0.361	24%	0.238	S	C	.	.	H	α-helix	trans	-64.2	-39.9	177.1	-69.7	-69.5	0	0	0	112.2	G411 G412 C416 Q417 V418 T444	G411-H414 PolarHBondContact O-N 3.02Å; G412-H414 PolarHBondContact O-N 2.94Å; H414-C416 VanDerWaalsContact C-N 3.3Å; H414-C416 PolarHBondContact O-N 3.4Å; H414-Q417 PolarHBondContact O-N 3.39Å; H414-V418 WeakPolarHBondContact O-CG2 3.4Å; H414-V418 PolarHBondContact O-N 3.5Å; H414-T444 HydrophobicContact CB-CG2 3.94Å
415	T	76.6	Confident	81	Confident	3 Å²	3	45 Å²	45	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-45.5	173.8	-40.8	0	0	0	0	110.7	F410 G411 G412 L413 V418 C419 Y575	F410-T415 HydrophobicContact CB-CG2 4.34Å; F410-T415 PolarHBondContact O-OG1 3.05Å; G411-T415 WeakPolarHBondContact CA-OG1 3.46Å; G411-T415 PolarHBondContact N-OG1 3.24Å; G412-T415 PolarHBondContact N-OG1 3.2Å; G412-T415 WeakPolarHBondContact O-CB 3.47Å; G412-T415 PolarHBondContact O-N 3.1Å; G412-T415 VanDerWaalsContact O-N 3.15Å; G412-T415 PolarHBondContact O-OG1 3.22Å; L413-T415 PolarHBondContact O-N 2.87Å; T415-V418 PolarHBondContact O-N 3.06Å; T415-C419 PolarHBondContact O-N 2.74Å; T415-C419 PolarHBondContact O-SG 3.43Å; T415-C419 VanDerWaalsContact O-SG 3.32Å; T415-Y575 HydrophobicContact CG2-CD1 4.16Å; T415-Y575 HydrophobicContact CG2-CD2 3.75Å; T415-Y575 HydrophobicContact CG2-CG 3.59Å
416	C	81.6	Confident	81	Confident	36 Å²	36	50.5 Å²	50.5	24%	0.243	26%	0.256	C	S	.	.	H	α-helix	trans	-61.2	-45.7	176.5	-177.2	0	0	0	0	111.4	G412 L413 H414 V418 C419 L420 M571	G412-C416 PolarHBondContact O-N 3.14Å; L413-C416 WeakPolarHBondContact O-CB 3.27Å; L413-C416 PolarHBondContact O-N 3.23Å; H414-C416 VanDerWaalsContact C-N 3.3Å; H414-C416 PolarHBondContact O-N 3.4Å; C416-V418 VanDerWaalsContact C-N 3.32Å; C416-V418 PolarHBondContact O-N 3.5Å; C416-C419 PolarHBondContact O-N 3.25Å; C416-L420 WeakPolarHBondContact O-CB 3.31Å; C416-L420 VanDerWaalsContact O-CG 3.32Å; C416-L420 WeakPolarHBondContact O-CG 3.41Å; C416-L420 PolarHBondContact O-N 3.34Å; C416-M571 HydrophobicContact CB-SD 4.15Å
417	Q	84.3	Confident	81.1	Confident	75 Å²	75	55.9 Å²	55.9	35%	0.35	28%	0.284	S	S	.	.	H	α-helix	trans	-61.4	-38	177.6	-72	176.4	-8	0	0	113.1	L413 H414 A421 K440	L413-Q417 WeakPolarHBondContact O-CG 3.03Å; L413-Q417 PolarHBondContact O-N 3.47Å; H414-Q417 PolarHBondContact O-N 3.39Å; Q417-A421 WeakPolarHBondContact O-CB 3.43Å; Q417-A421 PolarHBondContact O-N 2.92Å; Q417-K440 HydrophobicContact CB-CD 4.48Å
418	V	83.3	Confident	81.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-67.3	-47.5	175	171.3	0	0	0	0	110.5	H414 T415 C416 L420 A421 Y422 L437 K440 Y441 T444 L578	H414-V418 WeakPolarHBondContact O-CG2 3.4Å; H414-V418 PolarHBondContact O-N 3.5Å; T415-V418 PolarHBondContact O-N 3.06Å; C416-V418 VanDerWaalsContact C-N 3.32Å; C416-V418 PolarHBondContact O-N 3.5Å; V418-L420 PolarHBondContact O-N 3.02Å; V418-A421 PolarHBondContact O-N 3.4Å; V418-Y422 WeakPolarHBondContact O-CB 3.34Å; V418-Y422 PolarHBondContact O-N 2Å; V418-L437 HydrophobicContact CG1-CD1 4.21Å; V418-K440 HydrophobicContact CG2-CB 4.01Å; V418-Y441 HydrophobicContact CG1-CD2 4.26Å; V418-T444 WeakPolarHBondContact CG2-OG1 3.28Å; V418-L578 HydrophobicContact CG1-CD2 3.58Å
419	C	84.6	Confident	81.2	Confident	7 Å²	7	66.5 Å²	66.5	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-60.5	-45.8	177.5	-71.4	0	0	0	0	111.9	T415 C416 Y422 V423 M571 M574	T415-C419 PolarHBondContact O-N 2.74Å; T415-C419 PolarHBondContact O-SG 3.43Å; T415-C419 VanDerWaalsContact O-SG 3.32Å; C416-C419 PolarHBondContact O-N 3.25Å; C419-Y422 PolarHBondContact O-N 3.26Å; C419-V423 WeakPolarHBondContact O-CG2 3.4Å; C419-V423 PolarHBondContact O-N 3.2Å; C419-M571 PolarHBondContact SG-O 3.44Å; C419-M574 HydrophobicContact CB-CE 3.78Å
420	L	86	Confident	81.4	Confident	110 Å²	110	67.6 Å²	67.6	58%	0.576	33%	0.325	S	S	*	.	H	α-helix	trans	-63.7	-41.1	176.4	-71.3	173.7	0	0	0	112	C416 V418 Y422 V423 K424	C416-L420 WeakPolarHBondContact O-CB 3.31Å; C416-L420 VanDerWaalsContact O-CG 3.32Å; C416-L420 WeakPolarHBondContact O-CG 3.41Å; C416-L420 PolarHBondContact O-N 3.34Å; V418-L420 PolarHBondContact O-N 3.02Å; L420-Y422 VanDerWaalsContact C-N 3.34Å; L420-V423 PolarHBondContact O-N 3.42Å; L420-K424 VanDerWaalsContact O-CB 3.3Å; L420-K424 WeakPolarHBondContact O-CB 3.43Å; L420-K424 PolarHBondContact O-N 3.05Å
421	A	84.6	Confident	81.3	Confident	8 Å²	8	69.7 Å²	69.7	7%	0.066	35%	0.346	C	S	.	.	H	α-helix	trans	-64.5	-38.8	174.9	0	0	0	0	0	112	Q417 V418 K424 F425 L437 K440	Q417-A421 WeakPolarHBondContact O-CB 3.43Å; Q417-A421 PolarHBondContact O-N 2.92Å; V418-A421 PolarHBondContact O-N 3.4Å; A421-K424 PolarHBondContact O-N 3.45Å; A421-F425 VanDerWaalsContact O-CB 3.28Å; A421-F425 WeakPolarHBondContact O-CB 3.46Å; A421-F425 PolarHBondContact O-N 2.91Å; A421-L437 HydrophobicContact CB-CD1 3.97Å; A421-K440 HydrophobicContact CB-CD 3.74Å
422	Y	83.6	Confident	81.7	Confident	44 Å²	44	72.8 Å²	72.8	17%	0.173	37%	0.367	C	S	.	.	H	α-helix	trans	-65.8	-45.8	177.3	176.9	-99	0	0	0	111.6	V418 C419 L420 K424 F425 K426 L437 W577 L578	V418-Y422 WeakPolarHBondContact O-CB 3.34Å; V418-Y422 PolarHBondContact O-N 2Å; C419-Y422 PolarHBondContact O-N 3.26Å; L420-Y422 VanDerWaalsContact C-N 3.34Å; Y422-K424 VanDerWaalsContact C-N 3.35Å; Y422-F425 PolarHBondContact O-N 3.38Å; Y422-K426 HydrophobicContact CE1-CD 4.35Å; Y422-K426 WeakPolarHBondContact O-CB 3.29Å; Y422-K426 PolarHBondContact O-N 2.03Å; Y422-L437 HydrophobicContact CD2-CD2 3.89Å; Y422-W577 HydrophobicContact CE1-CZ3 4.05Å; Y422-W577 HydrophobicContact CE2-CZ3 4.04Å; Y422-W577 AromaticContact CZ-CZ3 3.5Å; Y422-W577 VanDerWaalsContact CZ-CZ3 3.5Å; Y422-W577 WeakPolarHBondContact OH-CH2 3.41Å; Y422-W577 WeakPolarHBondContact OH-CZ3 3.38Å; Y422-L578 HydrophobicContact CD2-CD1 4.16Å; Y422-L578 HydrophobicContact CE2-CD1 4.32Å
423	V	85.7	Confident	81.9	Confident	59 Å²	59	73 Å²	73	36%	0.358	37%	0.366	S	S	.	.	H	α-helix	trans	-60.5	-46.7	174.7	171.4	0	0	0	0	110.2	C419 L420 K426 I427 M574	C419-V423 WeakPolarHBondContact O-CG2 3.4Å; C419-V423 PolarHBondContact O-N 3.2Å; L420-V423 PolarHBondContact O-N 3.42Å; V423-K426 PolarHBondContact O-N 3.3Å; V423-I427 HydrophobicContact CG1-CD1 3.72Å; V423-I427 VanDerWaalsContact O-CG1 3.28Å; V423-I427 WeakPolarHBondContact O-CG1 3.12Å; V423-I427 PolarHBondContact O-N 3.45Å; V423-M574 HydrophobicContact CG2-SD 4.23Å
424	K	86.6	Confident	81.9	Confident	109 Å²	109	70.1 Å²	70.1	47%	0.474	35%	0.349	S	S	.	.	H	α-helix	trans	-57.7	-51.5	176.4	-170.9	-171.6	177.5	-137.5	0	111.5	L420 A421 Y422 K426 I427 T428 D433	L420-K424 VanDerWaalsContact O-CB 3.3Å; L420-K424 WeakPolarHBondContact O-CB 3.43Å; L420-K424 PolarHBondContact O-N 3.05Å; A421-K424 PolarHBondContact O-N 3.45Å; Y422-K424 VanDerWaalsContact C-N 3.35Å; K424-K426 VanDerWaalsContact C-N 3.29Å; K424-K426 PolarHBondContact O-N 3.11Å; K424-I427 PolarHBondContact O-N 3.41Å; K424-T428 HydrophobicContact CG-CG2 4.2Å; K424-T428 PolarHBondContact O-N 3.25Å; K424-T428 PolarHBondContact O-OG1 3.27Å; K424-D433 IonicContact NZ-OD1 3.34Å; K424-D433 PolarHBondContact NZ-OD1 2.7Å; K424-D433 IonicContact NZ-OD2 3.15Å
425	F	84.4	Confident	82	Confident	51 Å²	51	71.5 Å²	71.5	22%	0.224	36%	0.359	C	S	.	.	H	α-helix	trans	-55.6	-42.9	177.2	170.6	-109	0	0	0	112.2	A421 Y422 I427 R429 D433 E434 L437	A421-F425 VanDerWaalsContact O-CB 3.28Å; A421-F425 WeakPolarHBondContact O-CB 3.46Å; A421-F425 PolarHBondContact O-N 2.91Å; Y422-F425 PolarHBondContact O-N 3.38Å; F425-I427 VanDerWaalsContact C-N 3.31Å; F425-I427 PolarHBondContact O-N 3.36Å; F425-R429 WeakPolarHBondContact O-CA 3.31Å; F425-R429 PolarHBondContact O-N 2.9Å; F425-D433 HydrophobicContact CB-CB 4.07Å; F425-D433 HydrophobicContact CD2-CB 3.91Å; F425-E434 HydrophobicContact CD2-CB 4.04Å; F425-E434 HydrophobicContact CE2-CB 3.52Å; F425-E434 HydrophobicContact CE2-CG 4Å; F425-E434 HydrophobicContact CZ-CB 4.05Å; F425-E434 HydrophobicContact CZ-CG 3.99Å; F425-L437 HydrophobicContact CD1-CD2 4.21Å; F425-L437 HydrophobicContact CG-CD2 4.48Å
426	K	84.6	Confident	82.2	Confident	138 Å²	138	73.7 Å²	73.7	60%	0.6	38%	0.375	S	S	*	.	H	α-helix	trans	-67.1	-32.2	178.6	-166.9	172.6	-177.1	176	0	112.7	Y422 V423 K424	Y422-K426 HydrophobicContact CE1-CD 4.35Å; Y422-K426 WeakPolarHBondContact O-CB 3.29Å; Y422-K426 PolarHBondContact O-N 2.03Å; V423-K426 PolarHBondContact O-N 3.3Å; K424-K426 VanDerWaalsContact C-N 3.29Å; K424-K426 PolarHBondContact O-N 3.11Å
427	I	87.1	Confident	82.2	Confident	133 Å²	133	72.8 Å²	72.8	68%	0.682	37%	0.367	S	S	*	.	H	α-helix	trans	-76.2	-47.5	176.6	-66.9	166.6	0	0	0	111.1	V423 K424 F425	V423-I427 HydrophobicContact CG1-CD1 3.72Å; V423-I427 VanDerWaalsContact O-CG1 3.28Å; V423-I427 WeakPolarHBondContact O-CG1 3.12Å; V423-I427 PolarHBondContact O-N 3.45Å; K424-I427 PolarHBondContact O-N 3.41Å; F425-I427 VanDerWaalsContact C-N 3.31Å; F425-I427 PolarHBondContact O-N 3.36Å
428	T	86.2	Confident	82	Confident	52 Å²	52	75.8 Å²	75.8	32%	0.319	38%	0.376	S	S	.	.	H	α-helix	trans	-83.5	-28.9	-173.2	58.8	0	0	0	0	113.5	K424 Q430 D433	K424-T428 HydrophobicContact CG-CG2 4.2Å; K424-T428 PolarHBondContact O-N 3.25Å; K424-T428 PolarHBondContact O-OG1 3.27Å; T428-Q430 PolarHBondContact O-N 3.12Å; T428-Q430 VanDerWaalsContact O-N 3.14Å; T428-D433 WeakPolarHBondContact CB-OD2 3.39Å; T428-D433 PolarHBondContact OG1-OD2 3.48Å
429	R	78	Confident	82	Confident	220 Å²	220	82.8 Å²	82.8	83%	0.83	41%	0.406	S	S	*	.			trans	51.4	27	-171.9	-76.8	-178.9	152.8	166.7	-5.8	114.2	F425	F425-R429 WeakPolarHBondContact O-CA 3.31Å; F425-R429 PolarHBondContact O-N 2.9Å
430	Q	79.2	Confident	81.8	Confident	109 Å²	109	85.8 Å²	85.8	51%	0.509	42%	0.418	S	S	.	.			trans	-86.8	139.9	178.2	-70.8	-177.9	-6.5	0	0	111.7	T428 S432 D433	T428-Q430 PolarHBondContact O-N 3.12Å; T428-Q430 VanDerWaalsContact O-N 3.14Å; Q430-S432 VanDerWaalsContact C-N 3.29Å; Q430-S432 PolarHBondContact O-N 3.15Å; Q430-D433 PolarHBondContact O-N 3.16Å
431	S	73.4	Confident	81.5	Confident	92 Å²	92	82 Å²	82	64%	0.643	40%	0.397	S	S	*	.	H	α-helix	trans	-65.2	-32.4	179.1	79.5	0	0	0	0	112.8	D433 E434 D435	S431-D433 PolarHBondContact O-N 3.37Å; S431-E434 VanDerWaalsContact O-CB 3.31Å; S431-E434 WeakPolarHBondContact O-CB 3.21Å; S431-E434 PolarHBondContact O-N 3.32Å; S431-D435 PolarHBondContact O-N 3Å
432	S	76.6	Confident	81.2	Confident	67 Å²	67	84.1 Å²	84.1	47%	0.469	41%	0.41	S	S	.	.	H	α-helix	trans	-59.5	-33.4	175.4	57.4	0	0	0	0	112.8	Q430 S436	Q430-S432 VanDerWaalsContact C-N 3.29Å; Q430-S432 PolarHBondContact O-N 3.15Å; S432-S436 PolarHBondContact O-N 2.74Å
433	D	76.7	Confident	80.8	Confident	13 Å²	13	85.3 Å²	85.3	7%	0.07	42%	0.42	C	S	.	.	H	α-helix	trans	-74.6	-26.7	176.1	-77.5	-34.6	0	0	0	111.6	K424 F425 T428 Q430 S431 L437	K424-D433 IonicContact NZ-OD1 3.34Å; K424-D433 PolarHBondContact NZ-OD1 2.7Å; K424-D433 IonicContact NZ-OD2 3.15Å; F425-D433 HydrophobicContact CB-CB 4.07Å; F425-D433 HydrophobicContact CD2-CB 3.91Å; T428-D433 WeakPolarHBondContact CB-OD2 3.39Å; T428-D433 PolarHBondContact OG1-OD2 3.48Å; Q430-D433 PolarHBondContact O-N 3.16Å; S431-D433 PolarHBondContact O-N 3.37Å; D433-L437 VanDerWaalsContact O-CB 3.27Å; D433-L437 WeakPolarHBondContact O-CB 3.38Å; D433-L437 PolarHBondContact O-N 3.22Å
434	E	78.5	Confident	80.2	Confident	68 Å²	68	82.5 Å²	82.5	32%	0.318	40%	0.403	S	S	.	.	H	α-helix	trans	-67.2	-47.1	174.8	-161.9	-176	153.6	0	0	111.6	F425 S431 S436 L437 R438	F425-E434 HydrophobicContact CD2-CB 4.04Å; F425-E434 HydrophobicContact CE2-CB 3.52Å; F425-E434 HydrophobicContact CE2-CG 4Å; F425-E434 HydrophobicContact CZ-CB 4.05Å; F425-E434 HydrophobicContact CZ-CG 3.99Å; S431-E434 VanDerWaalsContact O-CB 3.31Å; S431-E434 WeakPolarHBondContact O-CB 3.21Å; S431-E434 PolarHBondContact O-N 3.32Å; E434-S436 VanDerWaalsContact C-N 3.33Å; E434-S436 PolarHBondContact O-N 3.44Å; E434-L437 WeakPolarHBondContact O-CB 3.4Å; E434-L437 PolarHBondContact O-N 3.32Å; E434-R438 WeakPolarHBondContact O-CG 3.32Å; E434-R438 PolarHBondContact O-N 3.3Å; E434-R438 IonicContact OE1-CZ 3.82Å; E434-R438 IonicContact OE1-NE 2.81Å; E434-R438 PolarHBondContact OE1-NE 2.89Å; E434-R438 IonicContact OE1-NH2 3.83Å; E434-R438 PolarHBondContact OE1-NH2 3.23Å
435	D	79.5	Confident	79.5	Confident	107 Å²	107	81.4 Å²	81.4	57%	0.572	40%	0.401	S	S	*	.	H	α-helix	trans	-63.8	-41.6	178.3	-72.2	-31.2	0	0	0	111.3	S431 L437 R438 K439	S431-D435 PolarHBondContact O-N 3Å; D435-L437 VanDerWaalsContact C-N 3.35Å; D435-L437 PolarHBondContact O-N 3.44Å; D435-R438 PolarHBondContact O-N 3.32Å; D435-K439 WeakPolarHBondContact O-CB 3.45Å; D435-K439 PolarHBondContact O-N 2.97Å
436	S	81.6	Confident	78.9	Confident	50 Å²	50	84.9 Å²	84.9	35%	0.35	42%	0.415	S	S	.	.	H	α-helix	trans	-60.3	-43.5	173.6	-174.9	0	0	0	0	112	S432 E434 K439 K440	S432-S436 PolarHBondContact O-N 2.74Å; E434-S436 VanDerWaalsContact C-N 3.33Å; E434-S436 PolarHBondContact O-N 3.44Å; S436-K439 PolarHBondContact O-N 3.38Å; S436-K440 WeakPolarHBondContact O-CB 3.29Å; S436-K440 WeakPolarHBondContact O-CG 3.44Å; S436-K440 PolarHBondContact O-N 2.98Å
437	L	80.9	Confident	78.1	Confident	16 Å²	16	79.5 Å²	79.5	8%	0.084	40%	0.396	C	S	.	.	H	α-helix	trans	-62.9	-48.4	175.9	175.5	65.1	0	0	0	111.6	V418 A421 Y422 F425 D433 E434 D435 K439 K440 Y441	V418-L437 HydrophobicContact CG1-CD1 4.21Å; A421-L437 HydrophobicContact CB-CD1 3.97Å; Y422-L437 HydrophobicContact CD2-CD2 3.89Å; F425-L437 HydrophobicContact CD1-CD2 4.21Å; F425-L437 HydrophobicContact CG-CD2 4.48Å; D433-L437 VanDerWaalsContact O-CB 3.27Å; D433-L437 WeakPolarHBondContact O-CB 3.38Å; D433-L437 PolarHBondContact O-N 3.22Å; E434-L437 WeakPolarHBondContact O-CB 3.4Å; E434-L437 PolarHBondContact O-N 3.32Å; D435-L437 VanDerWaalsContact C-N 3.35Å; D435-L437 PolarHBondContact O-N 3.44Å; L437-K439 VanDerWaalsContact C-N 3.32Å; L437-K439 PolarHBondContact O-N 3.43Å; L437-K440 PolarHBondContact O-N 3.38Å; L437-Y441 VanDerWaalsContact O-CB 3.24Å; L437-Y441 WeakPolarHBondContact O-CB 3.3Å; L437-Y441 PolarHBondContact O-N 2.93Å
438	R	80.3	Confident	76.9	Confident	139 Å²	139	75.2 Å²	75.2	53%	0.525	37%	0.373	S	S	.	.	H	α-helix	trans	-59.4	-42.8	177.6	-74.8	-178.7	-178.7	-162.2	7.3	111.6	E434 D435 Y441 S442	E434-R438 WeakPolarHBondContact O-CG 3.32Å; E434-R438 PolarHBondContact O-N 3.3Å; E434-R438 IonicContact OE1-CZ 3.82Å; E434-R438 IonicContact OE1-NE 2.81Å; E434-R438 PolarHBondContact OE1-NE 2.89Å; E434-R438 IonicContact OE1-NH2 3.83Å; E434-R438 PolarHBondContact OE1-NH2 3.23Å; D435-R438 PolarHBondContact O-N 3.32Å; R438-Y441 PolarHBondContact O-N 3.43Å; R438-S442 WeakPolarHBondContact O-CB 3.36Å; R438-S442 PolarHBondContact O-N 3.48Å
439	K	83	Confident	75.6	Confident	146 Å²	146	77 Å²	77	64%	0.635	38%	0.384	S	S	*	.	H	α-helix	trans	-60.8	-54	175.6	-174.3	177.6	-179.2	179	0	111.4	D435 S436 L437 Y441 S442 D443	D435-K439 WeakPolarHBondContact O-CB 3.45Å; D435-K439 PolarHBondContact O-N 2.97Å; S436-K439 PolarHBondContact O-N 3.38Å; L437-K439 VanDerWaalsContact C-N 3.32Å; L437-K439 PolarHBondContact O-N 3.43Å; K439-Y441 VanDerWaalsContact C-N 3.28Å; K439-Y441 PolarHBondContact O-N 2.74Å; K439-S442 WeakPolarHBondContact O-CB 3.44Å; K439-S442 PolarHBondContact O-N 3.16Å; K439-S442 VanDerWaalsContact O-N 3.16Å; K439-D443 VanDerWaalsContact O-CG 3.31Å; K439-D443 PolarHBondContact O-N 3.04Å
440	K	81.7	Confident	74.4	Confident	70 Å²	70	71.6 Å²	71.6	30%	0.304	37%	0.37	S	S	.	.	H	α-helix	trans	-58.4	-39.9	177.7	-76.4	177.1	175.7	-179.6	0	112.5	Q417 V418 A421 S436 L437 T444	Q417-K440 HydrophobicContact CB-CD 4.48Å; V418-K440 HydrophobicContact CG2-CB 4.01Å; A421-K440 HydrophobicContact CB-CD 3.74Å; S436-K440 WeakPolarHBondContact O-CB 3.29Å; S436-K440 WeakPolarHBondContact O-CG 3.44Å; S436-K440 PolarHBondContact O-N 2.98Å; L437-K440 PolarHBondContact O-N 3.38Å; K440-T444 WeakPolarHBondContact O-CB 3.34Å; K440-T444 PolarHBondContact O-N 3.48Å; K440-T444 PolarHBondContact O-OG1 3.34Å
441	Y	78.7	Confident	73.1	Confident	32 Å²	32	70.6 Å²	70.6	13%	0.125	36%	0.362	C	S	.	.	H	α-helix	trans	-63.5	-47.2	176.5	-179.2	-91.9	0	0	0	111.4	V418 L437 R438 K439 D443 T444 M445 L578 L579 N582	V418-Y441 HydrophobicContact CG1-CD2 4.26Å; L437-Y441 VanDerWaalsContact O-CB 3.24Å; L437-Y441 WeakPolarHBondContact O-CB 3.3Å; L437-Y441 PolarHBondContact O-N 2.93Å; R438-Y441 PolarHBondContact O-N 3.43Å; K439-Y441 VanDerWaalsContact C-N 3.28Å; K439-Y441 PolarHBondContact O-N 2.74Å; Y441-D443 PolarHBondContact O-N 3.33Å; Y441-T444 WeakPolarHBondContact O-CB 3.31Å; Y441-T444 PolarHBondContact O-N 3.07Å; Y441-M445 HydrophobicContact CE1-SD 4.1Å; Y441-M445 PolarHBondContact O-N 2.99Å; Y441-L578 HydrophobicContact CD2-CD2 3.64Å; Y441-L578 HydrophobicContact CD2-CG 4.24Å; Y441-L578 HydrophobicContact CE2-CD2 3.88Å; Y441-L578 HydrophobicContact CE2-CG 4.02Å; Y441-L579 HydrophobicContact CE2-CD2 4.39Å; Y441-L579 WeakPolarHBondContact OH-CD2 3.37Å; Y441-N582 VanDerWaalsContact CZ-ND2 3.31Å; Y441-N582 PolarHBondContact OH-ND2 2.91Å
442	S	78.3	Confident	72	Confident	51 Å²	51	75.1 Å²	75.1	36%	0.357	37%	0.37	S	S	.	.	H	α-helix	trans	-58.9	-45.7	175.6	-174.3	0	0	0	0	112.1	R438 K439 T444 M445 K446	R438-S442 WeakPolarHBondContact O-CB 3.36Å; R438-S442 PolarHBondContact O-N 3.48Å; K439-S442 WeakPolarHBondContact O-CB 3.44Å; K439-S442 PolarHBondContact O-N 3.16Å; K439-S442 VanDerWaalsContact O-N 3.16Å; S442-T444 VanDerWaalsContact C-N 3.31Å; S442-T444 PolarHBondContact O-N 3.1Å; S442-M445 PolarHBondContact O-N 3.4Å; S442-K446 WeakPolarHBondContact O-CG 3.21Å; S442-K446 PolarHBondContact O-N 3.49Å
443	D	76.3	Confident	70.7	Confident	69 Å²	69	78.6 Å²	78.6	37%	0.369	38%	0.383	S	S	.	.	H	α-helix	trans	-61.8	-40.7	177.3	-66.4	-23.2	0	0	0	111.6	K439 Y441 K446 S447	K439-D443 VanDerWaalsContact O-CG 3.31Å; K439-D443 PolarHBondContact O-N 3.04Å; Y441-D443 PolarHBondContact O-N 3.33Å; D443-K446 PolarHBondContact O-N 3.17Å; D443-S447 WeakPolarHBondContact O-CB 3.4Å; D443-S447 PolarHBondContact O-N 2.81Å
444	T	73.3	Confident	69.3	Low	1 Å²	1	82.6 Å²	82.6	1%	0.006	40%	0.404	C	S	.	.	H	α-helix	trans	-64.1	-43.5	175.4	-53.2	0	0	0	0	111.2	H414 V418 K440 Y441 S442 S447 M448 Y575	H414-T444 HydrophobicContact CB-CG2 3.94Å; V418-T444 WeakPolarHBondContact CG2-OG1 3.28Å; K440-T444 WeakPolarHBondContact O-CB 3.34Å; K440-T444 PolarHBondContact O-N 3.48Å; K440-T444 PolarHBondContact O-OG1 3.34Å; Y441-T444 WeakPolarHBondContact O-CB 3.31Å; Y441-T444 PolarHBondContact O-N 3.07Å; S442-T444 VanDerWaalsContact C-N 3.31Å; S442-T444 PolarHBondContact O-N 3.1Å; T444-S447 WeakPolarHBondContact O-CB 3.47Å; T444-S447 PolarHBondContact O-N 2.93Å; T444-S447 PolarHBondContact O-OG 2.91Å; T444-M448 HydrophobicContact CG2-CE 4.14Å; T444-M448 PolarHBondContact O-N 2.76Å; T444-Y575 HydrophobicContact CG2-CE2 4.36Å
445	M	71.3	Confident	67.6	Low	86 Å²	86	90.6 Å²	90.6	42%	0.424	43%	0.431	S	S	.	.	H	α-helix	trans	-64.4	-43.2	178.3	-163.7	157.1	178.3	0	0	111.6	Y441 S442 S447 M448 V449	Y441-M445 HydrophobicContact CE1-SD 4.1Å; Y441-M445 PolarHBondContact O-N 2.99Å; S442-M445 PolarHBondContact O-N 3.4Å; M445-S447 VanDerWaalsContact C-N 3.32Å; M445-S447 PolarHBondContact O-N 3.33Å; M445-M448 PolarHBondContact O-N 2.82Å; M445-V449 WeakPolarHBondContact O-CG2 3.4Å; M445-V449 PolarHBondContact O-N 3.28Å
446	K	72.9	Confident	65.9	Low	123 Å²	123	91.6 Å²	91.6	54%	0.535	44%	0.437	S	S	.	.	H	α-helix	trans	-57.5	-44.8	171	-72.4	175.6	-176.1	174.6	0	111.3	S442 D443 M448 V449 I450	S442-K446 WeakPolarHBondContact O-CG 3.21Å; S442-K446 PolarHBondContact O-N 3.49Å; D443-K446 PolarHBondContact O-N 3.17Å; K446-M448 VanDerWaalsContact C-N 3.27Å; K446-M448 PolarHBondContact O-N 2.86Å; K446-V449 PolarHBondContact O-N 3.13Å; K446-I450 WeakPolarHBondContact O-CB 3.3Å; K446-I450 WeakPolarHBondContact O-CD1 3.42Å; K446-I450 WeakPolarHBondContact O-CG1 3.07Å; K446-I450 PolarHBondContact O-N 3.5Å
447	S	66.8	Low	64.4	Low	26 Å²	26	92.1 Å²	92.1	18%	0.182	43%	0.433	C	S	.	.	H	α-helix	trans	-61.2	-34.2	178.6	84.6	0	0	0	0	112.9	D443 T444 M445 R451	D443-S447 WeakPolarHBondContact O-CB 3.4Å; D443-S447 PolarHBondContact O-N 2.81Å; T444-S447 WeakPolarHBondContact O-CB 3.47Å; T444-S447 PolarHBondContact O-N 2.93Å; T444-S447 PolarHBondContact O-OG 2.91Å; M445-S447 VanDerWaalsContact C-N 3.32Å; M445-S447 PolarHBondContact O-N 3.33Å; S447-R451 WeakPolarHBondContact O-CG 3.06Å; S447-R451 PolarHBondContact O-N 3.09Å
448	M	61.8	Low	63	Low	42 Å²	42	95.1 Å²	95.1	21%	0.207	46%	0.456	C	S	.	.	H	α-helix	trans	-79.3	-34.3	176.4	-73.9	-172.1	-75.2	0	0	113.5	T444 M445 K446 R451 Y575	T444-M448 HydrophobicContact CG2-CE 4.14Å; T444-M448 PolarHBondContact O-N 2.76Å; M445-M448 PolarHBondContact O-N 2.82Å; K446-M448 VanDerWaalsContact C-N 3.27Å; K446-M448 PolarHBondContact O-N 2.86Å; M448-R451 WeakPolarHBondContact O-CB 3.14Å; M448-R451 PolarHBondContact O-N 3.34Å; M448-Y575 HydrophobicContact CE-CE1 4.03Å; M448-Y575 WeakPolarHBondContact CE-OH 3.29Å; M448-Y575 HydrophobicContact SD-CE1 4.37Å
449	V	58.3	Low	62	Low	90 Å²	90	93.8 Å²	93.8	55%	0.545	46%	0.458	S	S	.	.	H	α-helix	trans	-66	-41.9	174	173.2	0	0	0	0	110.1	M445 K446 R451 K452	M445-V449 WeakPolarHBondContact O-CG2 3.4Å; M445-V449 PolarHBondContact O-N 3.28Å; K446-V449 PolarHBondContact O-N 3.13Å; V449-R451 VanDerWaalsContact C-N 3.27Å; V449-R451 PolarHBondContact O-N 3.46Å; V449-K452 PolarHBondContact O-N 3.43Å; V449-K452 VanDerWaalsContact O-N 3.11Å
450	I	53.1	Low	61.1	Low	107 Å²	107	90.3 Å²	90.3	55%	0.549	45%	0.452	S	S	.	.	H	α-helix	trans	-61.7	-36.1	175.9	-67.1	165	0	0	0	111	K446 K452 N453	K446-I450 WeakPolarHBondContact O-CB 3.3Å; K446-I450 WeakPolarHBondContact O-CD1 3.42Å; K446-I450 WeakPolarHBondContact O-CG1 3.07Å; K446-I450 PolarHBondContact O-N 3.5Å; I450-K452 PolarHBondContact O-N 2.73Å; I450-N453 PolarHBondContact O-N 2.69Å
451	R	53.3	Low	60	Low	87 Å²	87	91 Å²	91	33%	0.328	46%	0.458	S	S	.	.	H	α-helix	trans	-63.9	-20.3	175.7	-82.2	178.2	-177.4	179.2	-2.1	115.1	N408 T409 S447 M448 V449 N453	N408-R451 PolarHBondContact O-NH1 3.38Å; T409-R451 PolarHBondContact O-NH1 3.19Å; S447-R451 WeakPolarHBondContact O-CG 3.06Å; S447-R451 PolarHBondContact O-N 3.09Å; M448-R451 WeakPolarHBondContact O-CB 3.14Å; M448-R451 PolarHBondContact O-N 3.34Å; V449-R451 VanDerWaalsContact C-N 3.27Å; V449-R451 PolarHBondContact O-N 3.46Å; R451-N453 VanDerWaalsContact C-N 3.33Å
452	K	50	Low	59.3	Low	188 Å²	188	92.3 Å²	92.3	82%	0.817	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-20.3	176.4	-93.3	-177.2	173.3	177.7	0	113.4	V449 I450	V449-K452 PolarHBondContact O-N 3.43Å; V449-K452 VanDerWaalsContact O-N 3.11Å; I450-K452 PolarHBondContact O-N 2.73Å
453	N	48.1	Very low	59	Low	140 Å²	140	96.9 Å²	96.9	75%	0.749	48%	0.479	S	S	*	.	S	Bend	trans	-109.5	8.5	-164.1	-88.8	-3.4	0	0	0	117	I450 R451	I450-N453 PolarHBondContact O-N 2.69Å; R451-N453 VanDerWaalsContact C-N 3.33Å
454	L	47.5	Very low	58.7	Low	96 Å²	96	99.3 Å²	99.3	50%	0.503	48%	0.483	S	S	.	.			trans	-123.2	105.7	-178.2	-73	161.9	0	0	0	112.9	D456 Q457	L454-D456 PolarHBondContact O-N 2.98Å; L454-D456 VanDerWaalsContact O-N 3.17Å; L454-Q457 WeakPolarHBondContact O-CB 3.46Å; L454-Q457 PolarHBondContact O-N 2.86Å
455	R	42.2	Very low	58.5	Low	236 Å²	236	99.7 Å²	99.7	89%	0.891	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-25.7	172.5	-170.3	179.8	-94.8	-161.1	-2.4	112.3	Q457 S458	R455-Q457 VanDerWaalsContact C-N 3.32Å; R455-Q457 PolarHBondContact O-N 3.21Å; R455-S458 VanDerWaalsContact O-CB 3.32Å; R455-S458 WeakPolarHBondContact O-CB 3.49Å; R455-S458 PolarHBondContact O-N 2.91Å
456	D	44.6	Very low	58.6	Low	128 Å²	128	98.8 Å²	98.8	68%	0.684	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-20.4	176.9	-66.6	-30.5	0	0	0	114.2	L454 S458 I459	L454-D456 PolarHBondContact O-N 2.98Å; L454-D456 VanDerWaalsContact O-N 3.17Å; D456-S458 VanDerWaalsContact C-N 3.25Å; D456-S458 PolarHBondContact O-N 3.07Å; D456-I459 PolarHBondContact O-N 3.34Å
457	Q	50.7	Low	59.1	Low	61 Å²	61	99.7 Å²	99.7	29%	0.285	49%	0.486	S	S	.	.	H	α-helix	trans	-76.3	-15.3	177.5	-141.8	171.3	27	0	0	112.7	L454 R455 I459 S460 I461	L454-Q457 WeakPolarHBondContact O-CB 3.46Å; L454-Q457 PolarHBondContact O-N 2.86Å; R455-Q457 VanDerWaalsContact C-N 3.32Å; R455-Q457 PolarHBondContact O-N 3.21Å; Q457-I459 PolarHBondContact O-N 2.89Å; Q457-S460 PolarHBondContact O-N 3.44Å; Q457-I461 HydrophobicContact CB-CD1 4.43Å; Q457-I461 HydrophobicContact CG-CD1 4.31Å; Q457-I461 HydrophobicContact CG-CG1 4.43Å; Q457-I461 WeakPolarHBondContact O-CB 3.18Å; Q457-I461 VanDerWaalsContact O-CG1 3.27Å; Q457-I461 WeakPolarHBondContact O-CG1 3.46Å; Q457-I461 PolarHBondContact O-N 3.05Å
458	S	51.8	Low	59.7	Low	80 Å²	80	99.2 Å²	99.2	56%	0.559	48%	0.483	S	S	*	.	H	α-helix	trans	-55.1	-35.3	172.2	177.4	0	0	0	0	111.9	R455 D456 H462	R455-S458 VanDerWaalsContact O-CB 3.32Å; R455-S458 WeakPolarHBondContact O-CB 3.49Å; R455-S458 PolarHBondContact O-N 2.91Å; D456-S458 VanDerWaalsContact C-N 3.25Å; D456-S458 PolarHBondContact O-N 3.07Å; S458-H462 WeakPolarHBondContact O-CB 3.16Å; S458-H462 PolarHBondContact O-N 2.93Å; S458-H462 VanDerWaalsContact O-N 3.07Å
459	I	58.5	Low	60.7	Low	110 Å²	110	97.5 Å²	97.5	56%	0.564	47%	0.474	S	S	*	.	H	α-helix	trans	-75	-44.7	-179.4	-61.9	174.4	0	0	0	110.4	D456 Q457 H462 K463	D456-I459 PolarHBondContact O-N 3.34Å; Q457-I459 PolarHBondContact O-N 2.89Å; I459-H462 PolarHBondContact O-N 3.36Å; I459-K463 HydrophobicContact CG2-CD 4.42Å; I459-K463 WeakPolarHBondContact O-CB 3.16Å; I459-K463 WeakPolarHBondContact O-CG 2.98Å; I459-K463 PolarHBondContact O-N 2.85Å
460	S	63.4	Low	62	Low	74 Å²	74	97.2 Å²	97.2	52%	0.517	47%	0.469	S	S	.	.	H	α-helix	trans	-62.8	-46.5	177.7	172.9	0	0	0	0	112	Q457 H462 K463 R464	Q457-S460 PolarHBondContact O-N 3.44Å; S460-H462 VanDerWaalsContact C-N 3.35Å; S460-H462 PolarHBondContact O-N 3.06Å; S460-K463 PolarHBondContact O-N 3.36Å; S460-R464 WeakPolarHBondContact O-CB 3.34Å; S460-R464 PolarHBondContact O-N 3.27Å
461	I	60.1	Low	63.7	Low	84 Å²	84	95.1 Å²	95.1	43%	0.431	46%	0.456	S	S	.	.	H	α-helix	trans	-61.4	-45.6	176.4	-65.7	166.4	0	0	0	109.8	V344 Q457 R464 T465	V344-I461 HydrophobicContact CG2-CG2 4.34Å; Q457-I461 HydrophobicContact CB-CD1 4.43Å; Q457-I461 HydrophobicContact CG-CD1 4.31Å; Q457-I461 HydrophobicContact CG-CG1 4.43Å; Q457-I461 WeakPolarHBondContact O-CB 3.18Å; Q457-I461 VanDerWaalsContact O-CG1 3.27Å; Q457-I461 WeakPolarHBondContact O-CG1 3.46Å; Q457-I461 PolarHBondContact O-N 3.05Å; I461-R464 WeakPolarHBondContact O-CB 3.4Å; I461-R464 PolarHBondContact O-N 2.84Å; I461-T465 PolarHBondContact O-N 2.94Å; I461-T465 PolarHBondContact O-OG1 3.42Å
462	H	62.7	Low	65.5	Low	59 Å²	59	91 Å²	91	27%	0.273	44%	0.44	S	S	.	.	H	α-helix	trans	-65.8	-41.6	179.9	-168.1	-48.7	0	0	0	112.8	S458 I459 S460 R464 T465 I466	S458-H462 WeakPolarHBondContact O-CB 3.16Å; S458-H462 PolarHBondContact O-N 2.93Å; S458-H462 VanDerWaalsContact O-N 3.07Å; I459-H462 PolarHBondContact O-N 3.36Å; S460-H462 VanDerWaalsContact C-N 3.35Å; S460-H462 PolarHBondContact O-N 3.06Å; H462-R464 VanDerWaalsContact C-N 3.28Å; H462-R464 PolarHBondContact O-N 3.29Å; H462-T465 PolarHBondContact O-N 2.7Å; H462-I466 VanDerWaalsContact CE1-CD1 3.46Å; H462-I466 WeakPolarHBondContact CE1-CD1 3.44Å; H462-I466 WeakPolarHBondContact ND1-CD1 2.96Å; H462-I466 WeakPolarHBondContact O-CG1 3.27Å; H462-I466 PolarHBondContact O-N 3.47Å
463	K	72	Confident	67.4	Low	147 Å²	147	82.8 Å²	82.8	64%	0.639	41%	0.405	S	S	*	.	H	α-helix	trans	-59.2	-43.3	173.7	-79	-174.4	177.9	-174.1	0	110.7	I459 S460 I466 F467	I459-K463 HydrophobicContact CG2-CD 4.42Å; I459-K463 WeakPolarHBondContact O-CB 3.16Å; I459-K463 WeakPolarHBondContact O-CG 2.98Å; I459-K463 PolarHBondContact O-N 2.85Å; S460-K463 PolarHBondContact O-N 3.36Å; K463-I466 PolarHBondContact O-N 3.43Å; K463-F467 WeakPolarHBondContact O-CB 3.47Å; K463-F467 PolarHBondContact O-N 3.19Å
464	R	70.9	Confident	69.4	Low	120 Å²	120	79 Å²	79	45%	0.453	39%	0.387	S	S	.	.	H	α-helix	trans	-65.4	-41.1	177.3	-165.6	176.1	-166.5	175.2	4.8	112.5	N408 S460 I461 H462 F467 S468	N408-R464 PolarHBondContact ND2-NE 3.5Å; N408-R464 PolarHBondContact ND2-NH1 3.41Å; N408-R464 PolarHBondContact ND2-NH2 3.1Å; N408-R464 PolarHBondContact OD1-NH1 3.14Å; N408-R464 PolarHBondContact OD1-NH2 3.27Å; S460-R464 WeakPolarHBondContact O-CB 3.34Å; S460-R464 PolarHBondContact O-N 3.27Å; I461-R464 WeakPolarHBondContact O-CB 3.4Å; I461-R464 PolarHBondContact O-N 2.84Å; H462-R464 VanDerWaalsContact C-N 3.28Å; H462-R464 PolarHBondContact O-N 3.29Å; R464-F467 PolarHBondContact O-N 2.05Å; R464-S468 PolarHBondContact O-N 3.28Å; R464-S468 PolarHBondContact O-OG 3.07Å; R464-S468 VanDerWaalsContact O-OG 3.05Å
465	T	67.7	Low	71.6	Confident	10 Å²	10	76.3 Å²	76.3	6%	0.061	37%	0.373	C	S	.	.	H	α-helix	trans	-64.6	-40.6	175.8	-55.3	0	0	0	0	112.1	F5 V344 L348 I461 H462 S468 T469	F5-T465 HydrophobicContact CE1-CG2 4Å; F5-T465 HydrophobicContact CZ-CG2 3.77Å; V344-T465 HydrophobicContact CG1-CG2 3.65Å; V344-T465 VanDerWaalsContact CG1-OG1 3.31Å; V344-T465 WeakPolarHBondContact CG1-OG1 3.19Å; L348-T465 HydrophobicContact CD2-CG2 4.31Å; I461-T465 PolarHBondContact O-N 2.94Å; I461-T465 PolarHBondContact O-OG1 3.42Å; H462-T465 PolarHBondContact O-N 2.7Å; T465-S468 PolarHBondContact O-N 2.03Å; T465-T469 WeakPolarHBondContact O-CB 3.46Å; T465-T469 PolarHBondContact O-N 3.3Å; T465-T469 PolarHBondContact O-OG1 3.4Å
466	I	75.4	Confident	74.1	Confident	66 Å²	66	65.1 Å²	65.1	34%	0.338	33%	0.331	S	S	.	.	H	α-helix	trans	-59.1	-51.1	172	-69.3	161.8	0	0	0	109.4	F5 H462 K463 S468 T469 I470	F5-I466 HydrophobicContact CD2-CG1 4.3Å; F5-I466 HydrophobicContact CE2-CB 4.46Å; F5-I466 HydrophobicContact CE2-CG1 3.68Å; H462-I466 VanDerWaalsContact CE1-CD1 3.46Å; H462-I466 WeakPolarHBondContact CE1-CD1 3.44Å; H462-I466 WeakPolarHBondContact ND1-CD1 2.96Å; H462-I466 WeakPolarHBondContact O-CG1 3.27Å; H462-I466 PolarHBondContact O-N 3.47Å; K463-I466 PolarHBondContact O-N 3.43Å; I466-S468 VanDerWaalsContact C-N 3.35Å; I466-S468 PolarHBondContact O-N 3.32Å; I466-T469 WeakPolarHBondContact O-CB 3.37Å; I466-T469 PolarHBondContact O-N 3.3Å; I466-T469 VanDerWaalsContact O-N 3.1Å; I466-I470 HydrophobicContact CG2-CD1 3.75Å; I466-I470 HydrophobicContact CG2-CG1 4.35Å; I466-I470 WeakPolarHBondContact O-CG1 3.47Å; I466-I470 PolarHBondContact O-N 2.98Å
467	F	82	Confident	76.4	Confident	143 Å²	143	60.7 Å²	60.7	63%	0.627	31%	0.307	S	S	*	.	H	α-helix	trans	-58.4	-44.9	179.8	-179.6	-95.8	0	0	0	112.2	K463 R464 T469 I470 F471	K463-F467 WeakPolarHBondContact O-CB 3.47Å; K463-F467 PolarHBondContact O-N 3.19Å; R464-F467 PolarHBondContact O-N 2.05Å; F467-T469 VanDerWaalsContact C-N 3.3Å; F467-T469 PolarHBondContact O-N 3.34Å; F467-I470 PolarHBondContact O-N 3.1Å; F467-F471 WeakPolarHBondContact O-CB 3.32Å; F467-F471 PolarHBondContact O-N 3.17Å
468	S	80.5	Confident	78.5	Confident	16 Å²	16	61.8 Å²	61.8	11%	0.112	32%	0.321	C	S	.	.	H	α-helix	trans	-66.6	-31.7	177.1	-56.1	0	0	0	0	112.9	T401 R464 T465 I466 F471 A472	T401-S468 PolarHBondContact OG1-O 2.82Å; R464-S468 PolarHBondContact O-N 3.28Å; R464-S468 PolarHBondContact O-OG 3.07Å; R464-S468 VanDerWaalsContact O-OG 3.05Å; T465-S468 PolarHBondContact O-N 2.03Å; I466-S468 VanDerWaalsContact C-N 3.35Å; I466-S468 PolarHBondContact O-N 3.32Å; S468-F471 WeakPolarHBondContact O-CB 3.48Å; S468-F471 PolarHBondContact O-N 3.44Å; S468-A472 PolarHBondContact O-N 3.28Å
469	T	82	Confident	80.6	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-69.5	-42.9	174.3	-62.6	0	0	0	0	111.6	F5 T9 W398 T465 I466 F467 F471 A472 I473	F5-T469 HydrophobicContact CZ-CG2 4.33Å; F5-T469 WeakPolarHBondContact CZ-OG1 3.32Å; T9-T469 HydrophobicContact CG2-CG2 3.95Å; W398-T469 HydrophobicContact CH2-CG2 3.74Å; W398-T469 HydrophobicContact CZ2-CG2 4.43Å; T465-T469 WeakPolarHBondContact O-CB 3.46Å; T465-T469 PolarHBondContact O-N 3.3Å; T465-T469 PolarHBondContact O-OG1 3.4Å; I466-T469 WeakPolarHBondContact O-CB 3.37Å; I466-T469 PolarHBondContact O-N 3.3Å; I466-T469 VanDerWaalsContact O-N 3.1Å; F467-T469 VanDerWaalsContact C-N 3.3Å; F467-T469 PolarHBondContact O-N 3.34Å; T469-F471 VanDerWaalsContact C-N 3.31Å; T469-F471 PolarHBondContact O-N 2.78Å; T469-A472 PolarHBondContact O-N 3.16Å; T469-I473 HydrophobicContact CG2-CD1 4.05Å; T469-I473 WeakPolarHBondContact O-CG1 3.24Å; T469-I473 PolarHBondContact O-N 2.92Å
470	I	86.6	Confident	82.2	Confident	84 Å²	84	55.5 Å²	55.5	43%	0.431	28%	0.279	S	S	.	.	H	α-helix	trans	-59	-47.2	173.3	-66.7	168.5	0	0	0	109.1	I466 F467 A472 I473 T474	I466-I470 HydrophobicContact CG2-CD1 3.75Å; I466-I470 HydrophobicContact CG2-CG1 4.35Å; I466-I470 WeakPolarHBondContact O-CG1 3.47Å; I466-I470 PolarHBondContact O-N 2.98Å; F467-I470 PolarHBondContact O-N 3.1Å; I470-A472 PolarHBondContact O-N 3.25Å; I470-I473 WeakPolarHBondContact O-CB 2.84Å; I470-I473 PolarHBondContact O-N 2.96Å; I470-T474 HydrophobicContact CG2-CG2 3.73Å; I470-T474 WeakPolarHBondContact O-CG2 3.45Å; I470-T474 PolarHBondContact O-N 2.63Å; I470-T474 PolarHBondContact O-OG1 3.31Å
471	F	88.6	Confident	83.6	Confident	63 Å²	63	55.2 Å²	55.2	28%	0.276	27%	0.271	S	S	.	.	H	α-helix	trans	-55.1	-47	176.4	174.2	-95.7	0	0	0	113	F467 S468 T469 I473 T474 L475	F467-F471 WeakPolarHBondContact O-CB 3.32Å; F467-F471 PolarHBondContact O-N 3.17Å; S468-F471 WeakPolarHBondContact O-CB 3.48Å; S468-F471 PolarHBondContact O-N 3.44Å; T469-F471 VanDerWaalsContact C-N 3.31Å; T469-F471 PolarHBondContact O-N 2.78Å; F471-I473 PolarHBondContact O-N 2.9Å; F471-T474 PolarHBondContact O-N 3.26Å; F471-L475 HydrophobicContact CE1-CD2 4.08Å; F471-L475 HydrophobicContact CE2-CB 4.37Å; F471-L475 HydrophobicContact CE2-CD1 4.4Å; F471-L475 HydrophobicContact CE2-CD2 4.12Å; F471-L475 HydrophobicContact CZ-CD2 3.64Å; F471-L475 WeakPolarHBondContact O-CB 2.98Å; F471-L475 PolarHBondContact O-N 3.45Å
472	A	90.3	Very high	85.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.4	-25.2	178.6	0	0	0	0	0	113.5	A397 W398 S468 T469 I470 P476	A397-A472 HydrophobicContact CB-CB 4.42Å; W398-A472 HydrophobicContact CD2-CB 3.71Å; W398-A472 HydrophobicContact CE3-CB 4Å; W398-A472 HydrophobicContact CG-CB 4.07Å; W398-A472 HydrophobicContact CZ2-CB 4.28Å; W398-A472 HydrophobicContact CZ3-CB 4.4Å; S468-A472 PolarHBondContact O-N 3.28Å; T469-A472 PolarHBondContact O-N 3.16Å; I470-A472 PolarHBondContact O-N 3.25Å; A472-P476 WeakPolarHBondContact O-CD 3.34Å; A472-P476 WeakPolarHBondContact O-CG 3.23Å
473	I	89.4	Confident	86.5	Confident	16 Å²	16	50.6 Å²	50.6	8%	0.082	25%	0.252	C	S	.	.	H	α-helix	trans	-91	-46.6	-178.6	-78.5	165.4	0	0	0	111.6	F12 I16 W398 T469 I470 F471 P476	F12-I473 HydrophobicContact CB-CD1 3.84Å; F12-I473 HydrophobicContact CD2-CD1 4.34Å; F12-I473 HydrophobicContact CG-CD1 4.3Å; I16-I473 HydrophobicContact CD1-CB 4.34Å; I16-I473 HydrophobicContact CD1-CG1 4.31Å; I16-I473 HydrophobicContact CD1-CG2 3.36Å; I16-I473 HydrophobicContact CG1-CG2 4.5Å; W398-I473 HydrophobicContact CZ2-CG1 4.4Å; T469-I473 HydrophobicContact CG2-CD1 4.05Å; T469-I473 WeakPolarHBondContact O-CG1 3.24Å; T469-I473 PolarHBondContact O-N 2.92Å; I470-I473 WeakPolarHBondContact O-CB 2.84Å; I470-I473 PolarHBondContact O-N 2.96Å; F471-I473 PolarHBondContact O-N 2.9Å; I473-P476 WeakPolarHBondContact O-CD 3.17Å
474	T	90.4	Very high	87.3	Confident	60 Å²	60	43.9 Å²	43.9	37%	0.368	22%	0.223	S	C	.	.	H	α-helix	trans	-81.3	-35.3	-171.5	57.8	0	0	0	0	112.4	I470 F471 L477 C478	I470-T474 HydrophobicContact CG2-CG2 3.73Å; I470-T474 WeakPolarHBondContact O-CG2 3.45Å; I470-T474 PolarHBondContact O-N 2.63Å; I470-T474 PolarHBondContact O-OG1 3.31Å; F471-T474 PolarHBondContact O-N 3.26Å; T474-L477 WeakPolarHBondContact O-CB 3.26Å; T474-L477 PolarHBondContact O-N 3.35Å; T474-L477 VanDerWaalsContact O-N 3.09Å; T474-C478 PolarHBondContact O-N 3.38Å; T474-C478 VanDerWaalsContact O-N 3.16Å; T474-C478 PolarHBondContact O-SG 3.42Å; T474-C478 VanDerWaalsContact O-SG 3.37Å
475	L	93.7	Very high	88.1	Confident	40 Å²	40	41.6 Å²	41.6	21%	0.209	22%	0.223	C	C	.	.	H	α-helix	trans	-57	-48.4	-178.9	177.9	75.4	0	0	0	112.1	A397 F471 L477 C478 F479 L561	A397-L475 HydrophobicContact CB-CD2 4.31Å; F471-L475 HydrophobicContact CE1-CD2 4.08Å; F471-L475 HydrophobicContact CE2-CB 4.37Å; F471-L475 HydrophobicContact CE2-CD1 4.4Å; F471-L475 HydrophobicContact CE2-CD2 4.12Å; F471-L475 HydrophobicContact CZ-CD2 3.64Å; F471-L475 WeakPolarHBondContact O-CB 2.98Å; F471-L475 PolarHBondContact O-N 3.45Å; L475-L477 VanDerWaalsContact C-N 3.3Å; L475-L477 PolarHBondContact O-N 3.28Å; L475-C478 WeakPolarHBondContact O-CB 3.47Å; L475-C478 PolarHBondContact O-N 3.11Å; L475-F479 HydrophobicContact CD1-CE2 3.91Å; L475-F479 HydrophobicContact CG-CE2 4.29Å; L475-F479 VanDerWaalsContact O-CD2 3.31Å; L475-F479 WeakPolarHBondContact O-CD2 3.37Å; L475-L561 HydrophobicContact CD2-CD1 4.12Å; L475-L561 HydrophobicContact CD2-CD2 3.91Å
476	P	95.1	Very high	89	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.013	23%	0.226	C	C	.	.	H	α-helix	trans	-56.9	-40.6	174.2	-25.6	33.8	0	0	0	113.6	Y390 L393 A394 A397 A472 I473 C478 F479 V480	Y390-P476 HydrophobicContact CD2-CB 3.7Å; Y390-P476 HydrophobicContact CE2-CB 3.7Å; Y390-P476 HydrophobicContact CE2-CG 4.31Å; L393-P476 HydrophobicContact CB-CB 3.8Å; L393-P476 HydrophobicContact CB-CG 4.17Å; A394-P476 VanDerWaalsContact CA-CG 3.43Å; A394-P476 HydrophobicContact CB-CB 4.48Å; A394-P476 HydrophobicContact CB-CG 3.9Å; A397-P476 HydrophobicContact CB-CG 4.16Å; A472-P476 WeakPolarHBondContact O-CD 3.34Å; A472-P476 WeakPolarHBondContact O-CG 3.23Å; I473-P476 WeakPolarHBondContact O-CD 3.17Å; P476-C478 VanDerWaalsContact C-N 3.27Å; P476-C478 PolarHBondContact O-N 3.37Å; P476-F479 PolarHBondContact O-N 3.39Å; P476-F479 VanDerWaalsContact O-N 3.08Å; P476-V480 VanDerWaalsContact O-CG2 3.25Å; P476-V480 WeakPolarHBondContact O-CG2 3.42Å; P476-V480 PolarHBondContact O-N 2.94Å
477	L	93.1	Very high	89.3	Confident	35 Å²	35	40.3 Å²	40.3	18%	0.183	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-33.6	-179.3	-65.2	174.3	0	0	0	112.3	I16 L20 Y390 T474 L475 F479 V480 I481	I16-L477 HydrophobicContact CG2-CD2 4.06Å; L20-L477 HydrophobicContact CD2-CD2 4.18Å; Y390-L477 HydrophobicContact CD2-CD2 3.72Å; Y390-L477 HydrophobicContact CD2-CG 4.29Å; Y390-L477 HydrophobicContact CE2-CD2 3.67Å; Y390-L477 HydrophobicContact CE2-CG 3.86Å; T474-L477 WeakPolarHBondContact O-CB 3.26Å; T474-L477 PolarHBondContact O-N 3.35Å; T474-L477 VanDerWaalsContact O-N 3.09Å; L475-L477 VanDerWaalsContact C-N 3.3Å; L475-L477 PolarHBondContact O-N 3.28Å; L477-F479 PolarHBondContact O-N 3.33Å; L477-V480 PolarHBondContact O-N 3.49Å; L477-I481 HydrophobicContact CB-CD1 4.05Å; L477-I481 HydrophobicContact CB-CG1 4.48Å; L477-I481 HydrophobicContact CD2-CD1 4.42Å; L477-I481 WeakPolarHBondContact O-CB 3.25Å; L477-I481 WeakPolarHBondContact O-CG1 3.42Å; L477-I481 PolarHBondContact O-N 3.21Å
478	C	94.4	Very high	89.1	Confident	84 Å²	84	37.1 Å²	37.1	57%	0.568	20%	0.203	S	C	*	.	H	α-helix	trans	-62.2	-21.4	175.8	-62.8	0	0	0	0	113.8	T474 L475 P476 P482	T474-C478 PolarHBondContact O-N 3.38Å; T474-C478 VanDerWaalsContact O-N 3.16Å; T474-C478 PolarHBondContact O-SG 3.42Å; T474-C478 VanDerWaalsContact O-SG 3.37Å; L475-C478 WeakPolarHBondContact O-CB 3.47Å; L475-C478 PolarHBondContact O-N 3.11Å; P476-C478 VanDerWaalsContact C-N 3.27Å; P476-C478 PolarHBondContact O-N 3.37Å; C478-P482 VanDerWaalsContact O-CD 3.28Å; C478-P482 WeakPolarHBondContact O-CD 3.33Å; C478-P482 VanDerWaalsContact O-CG 3.28Å; C478-P482 WeakPolarHBondContact O-CG 3.3Å
479	F	95	Very high	88.8	Confident	56 Å²	56	41 Å²	41	25%	0.246	23%	0.225	C	C	.	.	H	α-helix	trans	-101.3	-37.7	175.6	-65.2	-83.4	0	0	0	112.1	L393 L475 P476 L477 A483 W553 P557	L393-F479 HydrophobicContact CD1-CB 3.83Å; L393-F479 HydrophobicContact CD1-CG 4.42Å; L475-F479 HydrophobicContact CD1-CE2 3.91Å; L475-F479 HydrophobicContact CG-CE2 4.29Å; L475-F479 VanDerWaalsContact O-CD2 3.31Å; L475-F479 WeakPolarHBondContact O-CD2 3.37Å; P476-F479 PolarHBondContact O-N 3.39Å; P476-F479 VanDerWaalsContact O-N 3.08Å; L477-F479 PolarHBondContact O-N 3.33Å; F479-A483 VanDerWaalsContact O-CB 3.3Å; F479-A483 WeakPolarHBondContact O-CB 3.1Å; F479-A483 PolarHBondContact O-N 2.97Å; F479-W553 HydrophobicContact CB-CE3 4.43Å; F479-W553 HydrophobicContact CD1-CE3 4.28Å; F479-P557 HydrophobicContact CD1-CB 4.31Å; F479-P557 HydrophobicContact CD1-CG 3.97Å; F479-P557 HydrophobicContact CD2-CB 4.17Å; F479-P557 HydrophobicContact CD2-CG 4.47Å; F479-P557 HydrophobicContact CE1-CB 3.99Å; F479-P557 HydrophobicContact CE1-CG 4.01Å; F479-P557 HydrophobicContact CE2-CB 3.86Å; F479-P557 HydrophobicContact CG-CB 4.4Å; F479-P557 HydrophobicContact CG-CG 4.22Å; F479-P557 HydrophobicContact CZ-CB 3.77Å; F479-P557 HydrophobicContact CZ-CG 4.3Å
480	V	94	Very high	88.1	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-72.5	-44	-176.3	176.3	0	0	0	0	112	L20 V386 H389 Y390 L393 P476 L477 A483 L484	L20-V480 HydrophobicContact CD2-CG1 4.35Å; V386-V480 HydrophobicContact CG1-CG1 3.8Å; H389-V480 HydrophobicContact CB-CG2 4.38Å; Y390-V480 HydrophobicContact CD2-CG2 4.49Å; L393-V480 HydrophobicContact CD1-CG2 4.31Å; P476-V480 VanDerWaalsContact O-CG2 3.25Å; P476-V480 WeakPolarHBondContact O-CG2 3.42Å; P476-V480 PolarHBondContact O-N 2.94Å; L477-V480 PolarHBondContact O-N 3.49Å; V480-A483 PolarHBondContact O-N 3.1Å; V480-L484 WeakPolarHBondContact O-CB 3.44Å; V480-L484 PolarHBondContact O-N 2.9Å
481	I	92.1	Very high	86.8	Confident	68 Å²	68	46 Å²	46	35%	0.349	24%	0.244	S	C	.	.	H	α-helix	trans	-64.5	-49.6	-177	-64.6	172.5	0	0	0	110.7	L477 A483 L484 V485	L477-I481 HydrophobicContact CB-CD1 4.05Å; L477-I481 HydrophobicContact CB-CG1 4.48Å; L477-I481 HydrophobicContact CD2-CD1 4.42Å; L477-I481 WeakPolarHBondContact O-CB 3.25Å; L477-I481 WeakPolarHBondContact O-CG1 3.42Å; L477-I481 PolarHBondContact O-N 3.21Å; I481-A483 VanDerWaalsContact C-N 3.34Å; I481-A483 PolarHBondContact O-N 3.45Å; I481-L484 PolarHBondContact O-N 2.98Å; I481-V485 HydrophobicContact CG2-CG2 4.35Å; I481-V485 WeakPolarHBondContact O-CG2 3.35Å; I481-V485 PolarHBondContact O-N 3.42Å
482	P	92.2	Very high	85.1	Confident	47 Å²	47	43.9 Å²	43.9	31%	0.305	24%	0.236	S	C	.	.	H	α-helix	trans	-62.2	-38.5	176.6	-25.4	37.3	0	0	0	113.3	C478 V485 L486 W553	C478-P482 VanDerWaalsContact O-CD 3.28Å; C478-P482 WeakPolarHBondContact O-CD 3.33Å; C478-P482 VanDerWaalsContact O-CG 3.28Å; C478-P482 WeakPolarHBondContact O-CG 3.3Å; P482-V485 PolarHBondContact O-N 3.27Å; P482-L486 WeakPolarHBondContact O-CB 3.31Å; P482-L486 WeakPolarHBondContact O-CG 3.44Å; P482-L486 PolarHBondContact O-N 3.49Å; P482-W553 HydrophobicContact CB-CH2 3.58Å; P482-W553 HydrophobicContact CB-CZ2 4.44Å; P482-W553 HydrophobicContact CB-CZ3 3.67Å; P482-W553 HydrophobicContact CG-CZ3 4.27Å
483	A	91.1	Very high	83.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-43.4	175.4	0	0	0	0	0	111.8	F479 V480 I481 L486 N487 P531 W553	F479-A483 VanDerWaalsContact O-CB 3.3Å; F479-A483 WeakPolarHBondContact O-CB 3.1Å; F479-A483 PolarHBondContact O-N 2.97Å; V480-A483 PolarHBondContact O-N 3.1Å; I481-A483 VanDerWaalsContact C-N 3.34Å; I481-A483 PolarHBondContact O-N 3.45Å; A483-L486 PolarHBondContact O-N 2.78Å; A483-N487 WeakPolarHBondContact O-CB 3.27Å; A483-N487 PolarHBondContact O-N 2.7Å; A483-P531 HydrophobicContact CB-CG 4.32Å; A483-P531 WeakPolarHBondContact O-CG 3.34Å; A483-W553 HydrophobicContact CB-CB 4.27Å; A483-W553 HydrophobicContact CB-CD2 3.97Å; A483-W553 HydrophobicContact CB-CE3 4.35Å; A483-W553 HydrophobicContact CB-CG 3.9Å
484	L	89.1	Confident	81	Confident	5 Å²	5	51.9 Å²	51.9	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-47.6	175.2	174.9	56.2	0	0	0	111.7	L23 L382 V386 V480 I481 L486 N487 Q488	L23-L484 HydrophobicContact CB-CD2 3.91Å; L382-L484 HydrophobicContact CD1-CD1 3.95Å; L382-L484 HydrophobicContact CD2-CD1 4.02Å; L382-L484 HydrophobicContact CG-CD1 4.11Å; V386-L484 HydrophobicContact CG1-CD2 4.3Å; V386-L484 HydrophobicContact CG2-CB 4.34Å; V386-L484 HydrophobicContact CG2-CD1 3.62Å; V386-L484 HydrophobicContact CG2-CD2 4.01Å; V386-L484 HydrophobicContact CG2-CG 4.2Å; V480-L484 WeakPolarHBondContact O-CB 3.44Å; V480-L484 PolarHBondContact O-N 2.9Å; I481-L484 PolarHBondContact O-N 2.98Å; L484-L486 VanDerWaalsContact C-N 3.34Å; L484-L486 PolarHBondContact O-N 2.79Å; L484-N487 WeakPolarHBondContact O-CB 3.42Å; L484-N487 PolarHBondContact O-N 2.8Å; L484-Q488 HydrophobicContact CD1-CG 4.22Å; L484-Q488 PolarHBondContact O-N 2.69Å
485	V	87.4	Confident	78.8	Confident	73 Å²	73	50.1 Å²	50.1	44%	0.442	27%	0.27	S	S	.	.	H	α-helix	trans	-59.4	-45.7	178.2	172.3	0	0	0	0	110.6	I481 P482 N487 Q488 V489	I481-V485 HydrophobicContact CG2-CG2 4.35Å; I481-V485 WeakPolarHBondContact O-CG2 3.35Å; I481-V485 PolarHBondContact O-N 3.42Å; P482-V485 PolarHBondContact O-N 3.27Å; V485-N487 VanDerWaalsContact C-N 3.33Å; V485-N487 PolarHBondContact O-N 3.3Å; V485-Q488 PolarHBondContact O-N 2.94Å; V485-V489 HydrophobicContact CG1-CG2 4.14Å; V485-V489 WeakPolarHBondContact O-CB 3.13Å; V485-V489 VanDerWaalsContact O-CG2 3.26Å; V485-V489 WeakPolarHBondContact O-CG2 3.15Å; V485-V489 PolarHBondContact O-N 2.96Å
486	L	85.8	Confident	76.2	Confident	26 Å²	26	56 Å²	56	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-64.2	-36.3	177.1	-73	175.6	0	0	0	113	P482 A483 L484 Q488 Y490 M526 F529 W553	P482-L486 WeakPolarHBondContact O-CB 3.31Å; P482-L486 WeakPolarHBondContact O-CG 3.44Å; P482-L486 PolarHBondContact O-N 3.49Å; A483-L486 PolarHBondContact O-N 2.78Å; L484-L486 VanDerWaalsContact C-N 3.34Å; L484-L486 PolarHBondContact O-N 2.79Å; L486-Q488 VanDerWaalsContact C-N 3.28Å; L486-Q488 PolarHBondContact O-N 3.11Å; L486-Y490 HydrophobicContact CD2-CD2 3.91Å; L486-Y490 HydrophobicContact CD2-CE2 3.96Å; L486-Y490 PolarHBondContact O-N 3.28Å; L486-M526 HydrophobicContact CD1-SD 4.41Å; L486-M526 HydrophobicContact CD2-CG 3.78Å; L486-M526 HydrophobicContact CD2-SD 3.51Å; L486-M526 VanDerWaalsContact CD2-SD 3.51Å; L486-F529 HydrophobicContact CD1-CB 4.17Å; L486-W553 HydrophobicContact CD1-CH2 4.41Å; L486-W553 HydrophobicContact CD1-CZ2 3.5Å; L486-W553 VanDerWaalsContact CD1-CZ2 3.5Å
487	N	82.8	Confident	73.2	Confident	22 Å²	22	61 Å²	61	12%	0.118	33%	0.329	C	S	.	.	H	α-helix	trans	-64.7	-32.4	175.8	-163.3	79	0	0	0	113	L382 A483 L484 V485 N530 P531 G532 F533	L382-N487 WeakPolarHBondContact CD1-ND2 3.42Å; A483-N487 WeakPolarHBondContact O-CB 3.27Å; A483-N487 PolarHBondContact O-N 2.7Å; L484-N487 WeakPolarHBondContact O-CB 3.42Å; L484-N487 PolarHBondContact O-N 2.8Å; V485-N487 VanDerWaalsContact C-N 3.33Å; V485-N487 PolarHBondContact O-N 3.3Å; N487-N530 PolarHBondContact OD1-OD1 3.28Å; N487-P531 HydrophobicContact CB-CG 3.7Å; N487-G532 PolarHBondContact OD1-N 3.45Å; N487-F533 HydrophobicContact CB-CD2 4.33Å; N487-F533 PolarHBondContact ND2-O 2.8Å; N487-F533 PolarHBondContact OD1-N 3.5Å
488	Q	77.8	Confident	70.1	Confident	76 Å²	76	68.6 Å²	68.6	36%	0.355	36%	0.364	S	S	.	.	H	α-helix	trans	-83.9	-38.2	179.9	-73	178.6	-36.6	0	0	112.3	L382 L484 V485 L486	L382-Q488 HydrophobicContact CD2-CG 4.4Å; L484-Q488 HydrophobicContact CD1-CG 4.22Å; L484-Q488 PolarHBondContact O-N 2.69Å; V485-Q488 PolarHBondContact O-N 2.94Å; L486-Q488 VanDerWaalsContact C-N 3.28Å; L486-Q488 PolarHBondContact O-N 3.11Å
489	V	74.3	Confident	67.2	Low	97 Å²	97	73.2 Å²	73.2	59%	0.588	38%	0.379	S	S	*	.	H	α-helix	trans	-79.2	-38.2	-175.7	176.2	0	0	0	0	112.2	V485	V485-V489 HydrophobicContact CG1-CG2 4.14Å; V485-V489 WeakPolarHBondContact O-CB 3.13Å; V485-V489 VanDerWaalsContact O-CG2 3.26Å; V485-V489 WeakPolarHBondContact O-CG2 3.15Å; V485-V489 PolarHBondContact O-N 2.96Å
490	Y	66.2	Low	63.9	Low	78 Å²	78	76.3 Å²	76.3	31%	0.306	41%	0.408	S	S	.	.			trans	-110.3	132.6	-178	-63.8	-85.6	0	0	0	109.1	L486 M526 N530	L486-Y490 HydrophobicContact CD2-CD2 3.91Å; L486-Y490 HydrophobicContact CD2-CE2 3.96Å; L486-Y490 PolarHBondContact O-N 3.28Å; Y490-M526 HydrophobicContact CD1-CB 4.27Å; Y490-M526 HydrophobicContact CD1-CG 4.26Å; Y490-M526 HydrophobicContact CD2-CB 4.46Å; Y490-M526 HydrophobicContact CD2-CG 3.61Å; Y490-M526 HydrophobicContact CE1-CB 3.98Å; Y490-M526 HydrophobicContact CE1-CG 3.99Å; Y490-M526 HydrophobicContact CE2-CB 4.2Å; Y490-M526 HydrophobicContact CE2-CG 3.29Å; Y490-M526 HydrophobicContact CG-CG 4.1Å; Y490-N530 PolarHBondContact O-ND2 3.3Å
491	Q	61	Low	60.7	Low	118 Å²	118	79.2 Å²	79.2	55%	0.551	44%	0.438	S	S	*	.			trans	-108	127.8	165.1	-89.5	176.8	-13.2	0	0	108.1	E493 S494	Q491-E493 PolarHBondContact O-N 3.3Å; Q491-E493 VanDerWaalsContact O-N 3.14Å; Q491-S494 PolarHBondContact O-N 2.75Å; Q491-S494 PolarHBondContact O-OG 2.86Å; Q491-S494 VanDerWaalsContact O-OG 3.11Å
492	P	52.4	Low	57.6	Low	17 Å²	17	83.1 Å²	83.1	11%	0.11	46%	0.46	C	S	.	.	G	3₁₀ helix	trans	-65.4	-20.1	-173	23.4	-29.5	0	0	0	113.1	S494 L535	P492-S494 VanDerWaalsContact C-N 3.28Å; P492-S494 PolarHBondContact O-N 2.87Å; P492-L535 HydrophobicContact CG-CD1 3.64Å; P492-L535 HydrophobicContact CG-CD2 3.26Å; P492-L535 HydrophobicContact CG-CG 4.09Å
493	E	50.4	Low	54.5	Low	118 Å²	118	90 Å²	90	55%	0.551	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-72.3	-16.3	-179.7	-72.7	179.2	-179.4	0	0	113.8	Q491	Q491-E493 PolarHBondContact O-N 3.3Å; Q491-E493 VanDerWaalsContact O-N 3.14Å
494	S	43.5	Very low	51.5	Low	67 Å²	67	99.3 Å²	99.3	47%	0.469	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-87.7	-6.4	-176.4	65.7	0	0	0	0	115.1	Q491 P492 C519	Q491-S494 PolarHBondContact O-N 2.75Å; Q491-S494 PolarHBondContact O-OG 2.86Å; Q491-S494 VanDerWaalsContact O-OG 3.11Å; P492-S494 VanDerWaalsContact C-N 3.28Å; P492-S494 PolarHBondContact O-N 2.87Å; S494-C519 PolarHBondContact O-SG 2.62Å
495	C	44.4	Very low	48.5	Very low	22 Å²	22	106 Å²	106	15%	0.149	57%	0.565	C	S	.	*	S	Bend	trans	-142.5	20.2	-172.8	-79.9	0	0	0	0	116.1	P497 C519 S523	C495-P497 VanDerWaalsContact O-CD 3.28Å; C495-P497 WeakPolarHBondContact O-CD 3.38Å; C495-C519 WeakPolarHBondContact CA-SG 3.31Å; C495-C519 HydrophobicContact CB-CB 4.04Å; C495-C519 WeakPolarHBondContact CB-SG 2.87Å; C495-C519 WeakPolarHBondContact SG-CB 2.74Å; C495-C519 CovalentContact SG-SG 2.06Å; C495-C519 PolarHBondContact SG-SG 3.1Å; C495-S523 PolarHBondContact SG-OG 3.44Å; C495-S523 VanDerWaalsContact SG-OG 3.36Å
496	Q	37.7	Very low	46	Very low	164 Å²	164	108.8 Å²	108.8	77%	0.766	57%	0.573	S	S	*	*			trans	-87.5	115.6	168.6	-71.7	-155.5	-66	0	0	110.5
497	P	32.7	Very low	43.3	Very low	106 Å²	106	112.8 Å²	112.8	69%	0.688	60%	0.595	S	S	*	*			trans	-68.4	132.7	157.1	20.6	-12.6	0	0	0	107.2	C495 M499	C495-P497 VanDerWaalsContact O-CD 3.28Å; C495-P497 WeakPolarHBondContact O-CD 3.38Å; P497-M499 PolarHBondContact O-N 3Å
498	E	29	Very low	40.7	Very low	196 Å²	196	121.2 Å²	121.2	92%	0.916	63%	0.63	S	S	*	*			trans	-49.1	103.1	167.3	-77.2	177.4	147.3	0	0	108.6	S500	E498-S500 VanDerWaalsContact C-N 3.34Å; E498-S500 PolarHBondContact O-N 2.96Å
499	M	32	Very low	38.4	Very low	180 Å²	180	121 Å²	121	89%	0.887	63%	0.634	S	S	*	*			trans	-71.8	100.7	168.5	-86.3	-152.6	-66.6	0	0	107.3	P497 G501	P497-M499 PolarHBondContact O-N 3Å; M499-G501 PolarHBondContact O-N 3.47Å
500	S	25.9	Very low	36.3	Very low	122 Å²	122	125.2 Å²	125.2	85%	0.853	64%	0.641	S	S	*	*			trans	-39.7	111.5	159.2	52	0	0	0	0	112	E498	E498-S500 VanDerWaalsContact C-N 3.34Å; E498-S500 PolarHBondContact O-N 2.96Å
501	G	26.7	Very low	34.6	Very low	61 Å²	61	128.2 Å²	128.2	63%	0.629	67%	0.667	S	S	*	*			trans	-155.2	120.2	163.9	0	0	0	0	0	107.1	M499	M499-G501 PolarHBondContact O-N 3.47Å
502	D	26.4	Very low	33.1	Very low	151 Å²	151	126.7 Å²	126.7	81%	0.807	67%	0.669	S	S	*	*	S	Bend	trans	86.9	79	173.3	-51.7	-19.7	0	0	0	117.8	Y504	D502-Y504 PolarHBondContact O-N 2.89Å; D502-Y504 VanDerWaalsContact O-N 3.11Å
503	H	28.3	Very low	31.9	Very low	192 Å²	192	137 Å²	137	89%	0.889	71%	0.706	S	S	*	*				53.8	44.1	129.3	-113.2	-66.6	0	0	0	119.3
504	Y	27.6	Very low	31.1	Very low	194 Å²	194	139.1 Å²	139.1	76%	0.761	72%	0.716	S	S	*	*			trans	-133.1	118.3	158	-80.1	-85.7	0	0	0	111.4	D502 H506	D502-Y504 PolarHBondContact O-N 2.89Å; D502-Y504 VanDerWaalsContact O-N 3.11Å; Y504-H506 VanDerWaalsContact C-N 3.35Å; Y504-H506 PolarHBondContact O-N 3.48Å
505	T	27	Very low	30.5	Very low	147 Å²	147	142.4 Å²	142.4	90%	0.902	72%	0.724	S	S	*	*			trans	-61.8	90.6	170.3	46.9	0	0	0	0	109.5
506	H	35.2	Very low	30	Very low	131 Å²	131	148.8 Å²	148.8	61%	0.606	75%	0.751	S	S	*	*			trans	-98.3	111.4	163.7	-101.9	-82.5	0	0	0	109.9	Y504	Y504-H506 VanDerWaalsContact C-N 3.35Å; Y504-H506 PolarHBondContact O-N 3.48Å
507	D	29	Very low	30.1	Very low	109 Å²	109	145.4 Å²	145.4	58%	0.583	74%	0.739	S	S	*	*			trans	-60.4	128	178.9	-163.7	3.7	0	0	0	110.5	T509	D507-T509 PolarHBondContact O-N 2.87Å
508	K	27.7	Very low	30.3	Very low	199 Å²	199	148 Å²	148	87%	0.865	75%	0.746	S	S	*	*			trans	-69.8	90.7	176.8	-73.3	173.8	175.7	172	0	108.4
509	T	28.9	Very low	31.3	Very low	71 Å²	71	141 Å²	141	44%	0.436	72%	0.719	S	S	.	*			trans	-153.6	116.1	166	13	0	0	0	0	111.8	D507	D507-T509 PolarHBondContact O-N 2.87Å
510	Y	29.7	Very low	32.5	Very low	187 Å²	187	135.4 Å²	135.4	73%	0.733	70%	0.697	S	S	*	*			trans	74.2	68.2	157.3	-70.5	-87.6	0	0	0	119.6
511	V	31.9	Very low	34.1	Very low	141 Å²	141	137.8 Å²	137.8	86%	0.855	70%	0.695	S	S	*	*	S	Bend	trans	-140.3	113.4	138.4	-178.6	0	0	0	0	108.3
512	S	28.4	Very low	35.9	Very low	85 Å²	85	139.6 Å²	139.6	59%	0.594	69%	0.694	S	S	*	*			trans	23.3	92.4	162.2	-50.1	0	0	0	0	119.3	E514	S512-E514 PolarHBondContact O-N 3.24Å
513	R	28.6	Very low	37.6	Very low	233 Å²	233	133.2 Å²	133.2	88%	0.879	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	26.5	171.4	-150.8	-175.7	-165	126.1	1.2	114.3
514	E	31.9	Very low	39.3	Very low	164 Å²	164	126.5 Å²	126.5	77%	0.766	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.5	12.1	-178.4	-92.5	-179.5	159	0	0	113.9	S512	S512-E514 PolarHBondContact O-N 3.24Å
515	Q	32.4	Very low	41.2	Very low	135 Å²	135	121.9 Å²	121.9	63%	0.631	62%	0.624	S	S	*	*			trans	-127.3	34.3	166.8	-139.1	162.3	1.1	0	0	111.4	N517	Q515-N517 PolarHBondContact O-N 3.31Å
516	E	32.6	Very low	43.4	Very low	157 Å²	157	117.5 Å²	117.5	73%	0.734	59%	0.594	S	S	*	*			trans	-69.8	78	155.4	-162.4	168.8	-154.7	0	0	105.8	N518	E516-N518 PolarHBondContact O-N 3.28Å
517	N	39.8	Very low	45	Very low	93 Å²	93	112.1 Å²	112.1	50%	0.497	57%	0.571	S	S	.	*			trans	-51.3	117.6	164.1	-84.1	-15.8	0	0	0	105.1	Q515 C519	Q515-N517 PolarHBondContact O-N 3.31Å; N517-C519 PolarHBondContact O-N 2.89Å
518	N	37.5	Very low	47.3	Very low	159 Å²	159	111.2 Å²	111.2	85%	0.85	57%	0.566	S	S	*	*			trans	-51.7	88.5	170.2	-85.4	-24.4	0	0	0	108	E516 S520	E516-N518 PolarHBondContact O-N 3.28Å; N518-S520 PolarHBondContact O-N 3.38Å
519	C	50.6	Low	50	Low	50 Å²	50	105 Å²	105	34%	0.338	54%	0.539	S	S	.	.			trans	-72.5	94.4	169	-68.7	0	0	0	0	104.5	S494 C495 N517 S523	S494-C519 PolarHBondContact O-SG 2.62Å; C495-C519 WeakPolarHBondContact CA-SG 3.31Å; C495-C519 HydrophobicContact CB-CB 4.04Å; C495-C519 WeakPolarHBondContact CB-SG 2.87Å; C495-C519 WeakPolarHBondContact SG-CB 2.74Å; C495-C519 CovalentContact SG-SG 2.06Å; C495-C519 PolarHBondContact SG-SG 3.1Å; N517-C519 PolarHBondContact O-N 2.89Å; C519-S523 WeakPolarHBondContact CA-OG 3.1Å; C519-S523 WeakPolarHBondContact CB-OG 3.4Å
520	S	56.1	Low	52.6	Low	62 Å²	62	101.6 Å²	101.6	43%	0.434	52%	0.519	S	S	.	.			trans	-52.3	150.1	167.6	53.5	0	0	0	0	108.5	N518 T522 S523 S524	N518-S520 PolarHBondContact O-N 3.38Å; S520-T522 WeakPolarHBondContact CB-OG1 3.12Å; S520-T522 PolarHBondContact O-N 3.44Å; S520-T522 PolarHBondContact OG-OG1 3.03Å; S520-S523 PolarHBondContact N-OG 2.76Å; S520-S523 PolarHBondContact O-N 3.22Å; S520-S523 PolarHBondContact O-OG 2.73Å; S520-S524 PolarHBondContact O-N 3.33Å
521	E	60.2	Low	55.2	Low	173 Å²	173	92.7 Å²	92.7	81%	0.808	48%	0.484	S	S	*	.	H	α-helix	trans	-50.1	-28.1	175	-68.5	-175.9	155.4	0	0	112.5	S524 L525	E521-S524 PolarHBondContact O-OG 3.16Å; E521-L525 WeakPolarHBondContact O-CB 3.23Å; E521-L525 PolarHBondContact O-N 3.37Å; E521-L525 VanDerWaalsContact O-N 3.1Å
522	T	63.6	Low	57.4	Low	98 Å²	98	86 Å²	86	60%	0.601	44%	0.443	S	S	*	.	H	α-helix	trans	-66.8	-36.4	173.8	54.5	0	0	0	0	113.8	S520 M526	S520-T522 WeakPolarHBondContact CB-OG1 3.12Å; S520-T522 PolarHBondContact O-N 3.44Å; S520-T522 PolarHBondContact OG-OG1 3.03Å; T522-M526 VanDerWaalsContact O-CB 3.25Å; T522-M526 WeakPolarHBondContact O-CB 3.33Å; T522-M526 PolarHBondContact O-N 2.94Å
523	S	62.1	Low	60	Low	17 Å²	17	82.2 Å²	82.2	12%	0.119	42%	0.416	C	S	.	.	H	α-helix	trans	-76.2	-33.5	179.8	72.6	0	0	0	0	112.2	C495 C519 S520 M526 S527	C495-S523 PolarHBondContact SG-OG 3.44Å; C495-S523 VanDerWaalsContact SG-OG 3.36Å; C519-S523 WeakPolarHBondContact CA-OG 3.1Å; C519-S523 WeakPolarHBondContact CB-OG 3.4Å; S520-S523 PolarHBondContact N-OG 2.76Å; S520-S523 PolarHBondContact O-N 3.22Å; S520-S523 PolarHBondContact O-OG 2.73Å; S523-M526 PolarHBondContact O-N 3.1Å; S523-S527 WeakPolarHBondContact O-CB 3.26Å; S523-S527 PolarHBondContact O-N 3.03Å
524	S	63.8	Low	62.2	Low	52 Å²	52	71.8 Å²	71.8	36%	0.364	38%	0.378	S	S	.	.	H	α-helix	trans	-70.7	-36.8	173.4	67.1	0	0	0	0	112.1	S520 E521 S527	S520-S524 PolarHBondContact O-N 3.33Å; E521-S524 PolarHBondContact O-OG 3.16Å; S524-S527 PolarHBondContact O-OG 2.76Å
525	L	68.8	Low	63.8	Low	96 Å²	96	65.3 Å²	65.3	50%	0.503	35%	0.349	S	S	.	.	H	α-helix	trans	-67.6	-40.7	172.5	-174.5	152.9	0	0	0	111	E521 N528 F529	E521-L525 WeakPolarHBondContact O-CB 3.23Å; E521-L525 PolarHBondContact O-N 3.37Å; E521-L525 VanDerWaalsContact O-N 3.1Å; L525-N528 PolarHBondContact O-N 2.9Å; L525-F529 HydrophobicContact CD2-CD2 3.88Å; L525-F529 HydrophobicContact CD2-CE2 3.47Å; L525-F529 VanDerWaalsContact CD2-CE2 3.47Å; L525-F529 HydrophobicContact CG-CE2 4.12Å; L525-F529 WeakPolarHBondContact O-CD2 3.17Å
526	M	72.4	Confident	64.9	Low	55 Å²	55	63.2 Å²	63.2	27%	0.271	34%	0.34	S	S	.	.	H	α-helix	trans	-72.5	-29.1	-179.2	-157.1	62.1	75.9	0	0	113.2	L486 Y490 T522 S523 N528 F529 N530	L486-M526 HydrophobicContact CD1-SD 4.41Å; L486-M526 HydrophobicContact CD2-CG 3.78Å; L486-M526 HydrophobicContact CD2-SD 3.51Å; L486-M526 VanDerWaalsContact CD2-SD 3.51Å; Y490-M526 HydrophobicContact CD1-CB 4.27Å; Y490-M526 HydrophobicContact CD1-CG 4.26Å; Y490-M526 HydrophobicContact CD2-CB 4.46Å; Y490-M526 HydrophobicContact CD2-CG 3.61Å; Y490-M526 HydrophobicContact CE1-CB 3.98Å; Y490-M526 HydrophobicContact CE1-CG 3.99Å; Y490-M526 HydrophobicContact CE2-CB 4.2Å; Y490-M526 HydrophobicContact CE2-CG 3.29Å; Y490-M526 HydrophobicContact CG-CG 4.1Å; T522-M526 VanDerWaalsContact O-CB 3.25Å; T522-M526 WeakPolarHBondContact O-CB 3.33Å; T522-M526 PolarHBondContact O-N 2.94Å; S523-M526 PolarHBondContact O-N 3.1Å; M526-N528 VanDerWaalsContact C-N 3.26Å; M526-N528 PolarHBondContact O-N 3.4Å; M526-F529 PolarHBondContact O-N 3.19Å; M526-F529 VanDerWaalsContact O-N 3.11Å; M526-N530 PolarHBondContact O-N 2.83Å
527	S	69.6	Low	65.7	Low	18 Å²	18	62.7 Å²	62.7	13%	0.126	34%	0.335	C	S	.	.	H	α-helix	trans	-63.1	-32.4	174.6	73.3	0	0	0	0	112.3	S523 S524 F529 N530	S523-S527 WeakPolarHBondContact O-CB 3.26Å; S523-S527 PolarHBondContact O-N 3.03Å; S524-S527 PolarHBondContact O-OG 2.76Å; S527-F529 VanDerWaalsContact C-N 3.27Å; S527-F529 PolarHBondContact O-N 3.05Å; S527-N530 VanDerWaalsContact O-CB 3.26Å; S527-N530 WeakPolarHBondContact O-CB 3.27Å; S527-N530 PolarHBondContact O-N 3.18Å
528	N	76	Confident	66.7	Low	91 Å²	91	61.7 Å²	61.7	49%	0.487	33%	0.325	S	S	.	.	H	α-helix	trans	-66.8	-26.9	174.5	-71.3	-31.4	0	0	0	113.3	L525 M526 V546 A548 A549	L525-N528 PolarHBondContact O-N 2.9Å; M526-N528 VanDerWaalsContact C-N 3.26Å; M526-N528 PolarHBondContact O-N 3.4Å; N528-V546 WeakPolarHBondContact O-CG1 3.49Å; N528-A548 HydrophobicContact CB-CB 4.49Å; N528-A548 WeakPolarHBondContact O-CB 3.46Å; N528-A549 PolarHBondContact O-N 3.41Å
529	F	84.8	Confident	67.7	Low	67 Å²	67	60.8 Å²	60.8	29%	0.294	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-3.8	178.6	-66.4	-61.2	0	0	0	113.7	L486 L525 M526 S527 L552 W553	L486-F529 HydrophobicContact CD1-CB 4.17Å; L525-F529 HydrophobicContact CD2-CD2 3.88Å; L525-F529 HydrophobicContact CD2-CE2 3.47Å; L525-F529 VanDerWaalsContact CD2-CE2 3.47Å; L525-F529 HydrophobicContact CG-CE2 4.12Å; L525-F529 WeakPolarHBondContact O-CD2 3.17Å; M526-F529 PolarHBondContact O-N 3.19Å; M526-F529 VanDerWaalsContact O-N 3.11Å; S527-F529 VanDerWaalsContact C-N 3.27Å; S527-F529 PolarHBondContact O-N 3.05Å; F529-L552 HydrophobicContact CD1-CD2 3.38Å; F529-L552 HydrophobicContact CE1-CD2 3.66Å; F529-L552 HydrophobicContact CG-CD2 4.36Å; F529-W553 PolarHBondContact O-NE1 3.49Å
530	N	83.6	Confident	68.3	Low	1 Å²	1	62.1 Å²	62.1	1%	0.005	31%	0.31	C	S	.	.			trans	-70.3	124	174.6	-173.6	-23.3	0	0	0	110.4	N487 Y490 M526 S527 G532 V546 A549	N487-N530 PolarHBondContact OD1-OD1 3.28Å; Y490-N530 PolarHBondContact O-ND2 3.3Å; M526-N530 PolarHBondContact O-N 2.83Å; S527-N530 VanDerWaalsContact O-CB 3.26Å; S527-N530 WeakPolarHBondContact O-CB 3.27Å; S527-N530 PolarHBondContact O-N 3.18Å; N530-G532 PolarHBondContact O-N 3.07Å; N530-G532 PolarHBondContact OD1-N 3.43Å; N530-V546 VanDerWaalsContact O-CB 3.23Å; N530-V546 WeakPolarHBondContact O-CB 3.2Å; N530-V546 VanDerWaalsContact O-CG2 3.24Å; N530-V546 WeakPolarHBondContact O-CG2 3.34Å; N530-A549 VanDerWaalsContact C-CB 3.44Å; N530-A549 WeakPolarHBondContact O-CB 3.45Å
531	P	85.7	Confident	68.9	Low	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.294	C	S	.	.			trans	-63.8	-24.7	179.2	27.8	-36.2	0	0	0	114	A483 N487 F533 F544 T545 A549	A483-P531 HydrophobicContact CB-CG 4.32Å; A483-P531 WeakPolarHBondContact O-CG 3.34Å; N487-P531 HydrophobicContact CB-CG 3.7Å; P531-F533 HydrophobicContact CB-CD1 4.07Å; P531-F533 HydrophobicContact CB-CD2 3.83Å; P531-F533 HydrophobicContact CB-CE1 3.78Å; P531-F533 HydrophobicContact CB-CE2 3.53Å; P531-F533 HydrophobicContact CB-CG 4.1Å; P531-F533 HydrophobicContact CB-CZ 3.51Å; P531-F533 HydrophobicContact CG-CD2 3.58Å; P531-F533 HydrophobicContact CG-CE2 3.5Å; P531-F533 HydrophobicContact CG-CG 4.18Å; P531-F533 HydrophobicContact CG-CZ 4.05Å; P531-F544 HydrophobicContact CB-CD1 3.49Å; P531-F544 VanDerWaalsContact CB-CD1 3.49Å; P531-F544 HydrophobicContact CB-CE1 3.52Å; P531-F544 CarbonylContact O-C 3.56Å; P531-F544 WeakPolarHBondContact O-CA 3.38Å; P531-T545 PolarHBondContact O-N 3.11Å; P531-A549 HydrophobicContact CB-CB 4.47Å
532	G	78.1	Confident	69.7	Low	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.256	C	S	.	.			trans	67.8	36	-179.3	0	0	0	0	0	113	N487 N530 C534 L535 T545	N487-G532 PolarHBondContact OD1-N 3.45Å; N530-G532 PolarHBondContact O-N 3.07Å; N530-G532 PolarHBondContact OD1-N 3.43Å; G532-C534 PolarHBondContact O-N 3.3Å; G532-L535 WeakPolarHBondContact O-CG 3.32Å; G532-T545 WeakPolarHBondContact CA-OG1 3.37Å; G532-T545 WeakPolarHBondContact O-CG2 3.37Å; G532-T545 PolarHBondContact O-OG1 3.33Å
533	F	81.6	Confident	70.7	Confident	5 Å²	5	47.6 Å²	47.6	2%	0.022	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	125.8	174	-59.1	-43.6	0	0	0	110.2	L382 A385 H389 N487 P531 L535 F544	L382-F533 HydrophobicContact CD1-CB 4.04Å; L382-F533 HydrophobicContact CD1-CD2 4.47Å; A385-F533 HydrophobicContact CB-CB 3.92Å; A385-F533 HydrophobicContact CB-CD1 4.01Å; A385-F533 HydrophobicContact CB-CD2 4.4Å; A385-F533 HydrophobicContact CB-CG 3.88Å; H389-F533 AromaticContact ND1-CZ 3.97Å; N487-F533 HydrophobicContact CB-CD2 4.33Å; N487-F533 PolarHBondContact ND2-O 2.8Å; N487-F533 PolarHBondContact OD1-N 3.5Å; P531-F533 HydrophobicContact CB-CD1 4.07Å; P531-F533 HydrophobicContact CB-CD2 3.83Å; P531-F533 HydrophobicContact CB-CE1 3.78Å; P531-F533 HydrophobicContact CB-CE2 3.53Å; P531-F533 HydrophobicContact CB-CG 4.1Å; P531-F533 HydrophobicContact CB-CZ 3.51Å; P531-F533 HydrophobicContact CG-CD2 3.58Å; P531-F533 HydrophobicContact CG-CE2 3.5Å; P531-F533 HydrophobicContact CG-CG 4.18Å; P531-F533 HydrophobicContact CG-CZ 4.05Å; F533-L535 VanDerWaalsContact C-N 3.31Å; F533-L535 PolarHBondContact O-N 3.18Å; F533-F544 AromaticContact CE1-CD1 3.89Å; F533-F544 HydrophobicContact CE1-CD1 3.89Å; F533-F544 AromaticContact CE1-CD2 3.76Å; F533-F544 HydrophobicContact CE1-CD2 3.76Å; F533-F544 AromaticContact CE1-CE1 3.98Å; F533-F544 HydrophobicContact CE1-CE1 3.98Å; F533-F544 AromaticContact CE1-CE2 3.85Å; F533-F544 HydrophobicContact CE1-CE2 3.85Å; F533-F544 AromaticContact CE1-CG 3.78Å; F533-F544 HydrophobicContact CE1-CG 3.78Å; F533-F544 AromaticContact CE1-CZ 3.96Å; F533-F544 HydrophobicContact CE1-CZ 3.96Å; F533-F544 HydrophobicContact CZ-CD1 4.1Å; F533-F544 HydrophobicContact CZ-CD2 4.26Å; F533-F544 AromaticContact CZ-CE1 3.71Å; F533-F544 HydrophobicContact CZ-CE1 3.71Å; F533-F544 AromaticContact CZ-CE2 3.88Å; F533-F544 HydrophobicContact CZ-CE2 3.88Å; F533-F544 HydrophobicContact CZ-CG 4.36Å; F533-F544 AromaticContact CZ-CZ 3.59Å; F533-F544 HydrophobicContact CZ-CZ 3.59Å
534	C	75.2	Confident	71.9	Confident	14 Å²	14	46.8 Å²	46.8	10%	0.095	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	40.8	171.7	-51.9	0	0	0	0	114.1	C381 L382 G532 R541	C381-C534 HydrophobicContact CB-CB 3.75Å; C381-C534 WeakPolarHBondContact CB-SG 3.41Å; C381-C534 PolarHBondContact O-SG 2.83Å; C381-C534 WeakPolarHBondContact SG-CB 3.37Å; C381-C534 CovalentContact SG-SG 2.03Å; C381-C534 PolarHBondContact SG-SG 3.08Å; L382-C534 PolarHBondContact N-SG 3.42Å; L382-C534 VanDerWaalsContact N-SG 3.4Å; G532-C534 PolarHBondContact O-N 3.3Å; C534-R541 PolarHBondContact N-O 3.44Å
535	L	66.4	Low	72.4	Confident	29 Å²	29	45 Å²	45	15%	0.152	21%	0.208	C	C	.	.			trans	-55.2	152.7	174.8	-67.8	176.4	0	0	0	111.9	P492 G532 F533 K537 Y538 R539 T545	P492-L535 HydrophobicContact CG-CD1 3.64Å; P492-L535 HydrophobicContact CG-CD2 3.26Å; P492-L535 HydrophobicContact CG-CG 4.09Å; G532-L535 WeakPolarHBondContact O-CG 3.32Å; F533-L535 VanDerWaalsContact C-N 3.31Å; F533-L535 PolarHBondContact O-N 3.18Å; L535-K537 PolarHBondContact O-N 3.01Å; L535-Y538 CarbonylContact O-C 3.59Å; L535-Y538 WeakPolarHBondContact O-CA 3.42Å; L535-Y538 PolarHBondContact O-N 2.71Å; L535-R539 PolarHBondContact O-N 2.74Å; L535-T545 HydrophobicContact CD1-CG2 4.45Å; L535-T545 VanDerWaalsContact CD1-OG1 3.27Å; L535-T545 WeakPolarHBondContact CD1-OG1 3.09Å
536	M	54.1	Low	73	Confident	90 Å²	90	41.8 Å²	41.8	44%	0.443	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-55.6	-38.4	-178.8	-67.4	-62.8	170	0	0	112.2	Y538	M536-Y538 VanDerWaalsContact C-N 3.29Å; M536-Y538 PolarHBondContact O-N 3.14Å
537	K	50.2	Low	73.4	Confident	146 Å²	146	41.2 Å²	41.2	64%	0.635	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-62.3	-30.1	173.3	-168.4	174.8	-179	-177.6	0	113.9	L535	L535-K537 PolarHBondContact O-N 3.01Å
538	Y	61	Low	74.2	Confident	73 Å²	73	42.4 Å²	42.4	29%	0.286	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-131.6	55.2	-175.9	-54.3	-72.5	0	0	0	111.3	L535 M536 K540 R541 T545	L535-Y538 CarbonylContact O-C 3.59Å; L535-Y538 WeakPolarHBondContact O-CA 3.42Å; L535-Y538 PolarHBondContact O-N 2.71Å; M536-Y538 VanDerWaalsContact C-N 3.29Å; M536-Y538 PolarHBondContact O-N 3.14Å; Y538-K540 PolarHBondContact O-N 3.2Å; Y538-R541 PolarHBondContact O-N 2.99Å; Y538-T545 HydrophobicContact CD2-CG2 4.33Å
539	R	57.7	Low	74.7	Confident	139 Å²	139	38.1 Å²	38.1	53%	0.525	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-18.7	-172.8	-166.5	-176.1	-72.9	-179.7	-2	114.4	C381 L535	C381-R539 PolarHBondContact SG-O 3.11Å; L535-R539 PolarHBondContact O-N 2.74Å
540	K	62.7	Low	74.9	Confident	79 Å²	79	34.9 Å²	34.9	34%	0.343	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	6	-178.2	-62.9	-168.4	177.3	-175.7	0	114.5	I370 Y538 P542	I370-K540 WeakPolarHBondContact CD1-O 3.24Å; I370-K540 HydrophobicContact CG2-CB 3.73Å; I370-K540 HydrophobicContact CG2-CD 3.81Å; I370-K540 HydrophobicContact CG2-CG 3.54Å; Y538-K540 PolarHBondContact O-N 3.2Å; K540-P542 WeakPolarHBondContact O-CD 3.41Å
541	R	68.9	Low	75.3	Confident	27 Å²	27	38.3 Å²	38.3	10%	0.102	18%	0.181	C	C	.	.			trans	-105.7	100.6	-177.9	-170	166.2	-103.7	163.2	-8	111.2	E279 Y287 C534 Y538 W543	E279-R541 IonicContact OE2-NH2 3.87Å; E279-R541 PolarHBondContact OE2-NH2 3.28Å; Y287-R541 VanDerWaalsContact CE2-CZ 3.4Å; Y287-R541 VanDerWaalsContact CE2-NH1 3.29Å; C534-R541 PolarHBondContact N-O 3.44Å; Y538-R541 PolarHBondContact O-N 2.99Å; R541-W543 PolarHBondContact O-N 2.99Å; R541-W543 VanDerWaalsContact O-N 3.11Å
542	P	77.5	Confident	75.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.			trans	-86.8	39.5	-178.5	36.4	-35	0	0	0	112	L366 I370 V384 A385 K540	L366-P542 HydrophobicContact CD1-CG 3.61Å; L366-P542 HydrophobicContact CD2-CG 4.17Å; L366-P542 HydrophobicContact CG-CG 4.39Å; I370-P542 HydrophobicContact CD1-CG 4.2Å; V384-P542 HydrophobicContact CB-CB 4.23Å; V384-P542 HydrophobicContact CG1-CB 3.7Å; V384-P542 HydrophobicContact CG1-CG 3.93Å; A385-P542 VanDerWaalsContact CA-O 3.28Å; A385-P542 WeakPolarHBondContact CA-O 3.48Å; A385-P542 HydrophobicContact CB-CB 3.93Å; A385-P542 VanDerWaalsContact CB-O 3.27Å; A385-P542 WeakPolarHBondContact CB-O 3.26Å; K540-P542 WeakPolarHBondContact O-CD 3.41Å
543	W	84.9	Confident	76.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	-141.4	168	-178.4	-158.4	-118.3	0	0	0	111.2	F275 F280 L388 H389 R541 T545 F550 F554	F275-W543 HydrophobicContact CD2-CB 4.22Å; F275-W543 HydrophobicContact CE2-CB 3.41Å; F275-W543 VanDerWaalsContact CE2-CB 3.41Å; F275-W543 AromaticContact CE2-CD1 3.87Å; F275-W543 HydrophobicContact CE2-CD2 4.47Å; F275-W543 AromaticContact CE2-CG 3.64Å; F275-W543 HydrophobicContact CE2-CG 3.64Å; F275-W543 HydrophobicContact CZ-CB 3.64Å; F275-W543 AromaticContact CZ-CD2 3.99Å; F275-W543 HydrophobicContact CZ-CD2 3.99Å; F275-W543 HydrophobicContact CZ-CE3 4.48Å; F275-W543 AromaticContact CZ-CG 3.61Å; F275-W543 HydrophobicContact CZ-CG 3.61Å; F280-W543 HydrophobicContact CB-CZ2 4.45Å; F280-W543 AromaticContact CD1-CD2 3.98Å; F280-W543 HydrophobicContact CD1-CD2 3.98Å; F280-W543 AromaticContact CD1-CE2 3.74Å; F280-W543 HydrophobicContact CD1-CE3 4.1Å; F280-W543 AromaticContact CD1-CH2 3.72Å; F280-W543 HydrophobicContact CD1-CH2 3.72Å; F280-W543 AromaticContact CD1-CZ2 3.62Å; F280-W543 HydrophobicContact CD1-CZ2 3.62Å; F280-W543 AromaticContact CD1-CZ3 3.96Å; F280-W543 HydrophobicContact CD1-CZ3 3.96Å; F280-W543 HydrophobicContact CE1-CD2 4.25Å; F280-W543 HydrophobicContact CE1-CE3 4.01Å; F280-W543 HydrophobicContact CE1-CH2 4.14Å; F280-W543 HydrophobicContact CE1-CZ2 4.41Å; F280-W543 AromaticContact CE1-CZ3 3.94Å; F280-W543 HydrophobicContact CE1-CZ3 3.94Å; F280-W543 WeakPolarHBondContact O-CZ2 3.04Å; F280-W543 PolarHBondContact O-NE1 3.44Å; L388-W543 HydrophobicContact CB-CZ3 4.3Å; L388-W543 HydrophobicContact CD2-CE3 3.7Å; L388-W543 HydrophobicContact CD2-CZ3 3.91Å; L388-W543 HydrophobicContact CG-CE3 4.22Å; L388-W543 HydrophobicContact CG-CZ3 3.9Å; H389-W543 HydrophobicContact CB-CZ3 4.47Å; R541-W543 PolarHBondContact O-N 2.99Å; R541-W543 VanDerWaalsContact O-N 3.11Å; W543-T545 PolarHBondContact O-N 3.27Å; W543-F550 HydrophobicContact CZ2-CE2 4.33Å; W543-F550 AromaticContact NE1-CE2 3.72Å; W543-F554 HydrophobicContact CH2-CD2 4.12Å; W543-F554 HydrophobicContact CH2-CE1 4.37Å; W543-F554 AromaticContact CH2-CE2 3.72Å; W543-F554 HydrophobicContact CH2-CE2 3.72Å; W543-F554 AromaticContact CH2-CZ 3.82Å; W543-F554 HydrophobicContact CH2-CZ 3.82Å; W543-F554 HydrophobicContact CZ2-CD1 4.09Å; W543-F554 HydrophobicContact CZ2-CD2 4.26Å; W543-F554 AromaticContact CZ2-CE1 3.75Å; W543-F554 HydrophobicContact CZ2-CE1 3.75Å; W543-F554 AromaticContact CZ2-CE2 3.95Å; W543-F554 HydrophobicContact CZ2-CE2 3.95Å; W543-F554 HydrophobicContact CZ2-CG 4.3Å; W543-F554 AromaticContact CZ2-CZ 3.65Å; W543-F554 HydrophobicContact CZ2-CZ 3.65Å
544	F	86.8	Confident	77	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.202	C	C	.	.			trans	-59.5	128.4	-175.6	-68.8	-93.2	0	0	0	111.9	P284 Y287 H389 P531 F533 A549 F550 W553 F554	P284-F544 HydrophobicContact CG-CB 4.48Å; P284-F544 WeakPolarHBondContact CG-O 3.21Å; Y287-F544 PolarHBondContact OH-O 2.96Å; H389-F544 AromaticContact CE1-CZ 3.64Å; H389-F544 AromaticContact ND1-CZ 3.93Å; H389-F544 AromaticContact NE2-CZ 3.73Å; P531-F544 HydrophobicContact CB-CD1 3.49Å; P531-F544 VanDerWaalsContact CB-CD1 3.49Å; P531-F544 HydrophobicContact CB-CE1 3.52Å; P531-F544 CarbonylContact O-C 3.56Å; P531-F544 WeakPolarHBondContact O-CA 3.38Å; F533-F544 AromaticContact CE1-CD1 3.89Å; F533-F544 HydrophobicContact CE1-CD1 3.89Å; F533-F544 AromaticContact CE1-CD2 3.76Å; F533-F544 HydrophobicContact CE1-CD2 3.76Å; F533-F544 AromaticContact CE1-CE1 3.98Å; F533-F544 HydrophobicContact CE1-CE1 3.98Å; F533-F544 AromaticContact CE1-CE2 3.85Å; F533-F544 HydrophobicContact CE1-CE2 3.85Å; F533-F544 AromaticContact CE1-CG 3.78Å; F533-F544 HydrophobicContact CE1-CG 3.78Å; F533-F544 AromaticContact CE1-CZ 3.96Å; F533-F544 HydrophobicContact CE1-CZ 3.96Å; F533-F544 HydrophobicContact CZ-CD1 4.1Å; F533-F544 HydrophobicContact CZ-CD2 4.26Å; F533-F544 AromaticContact CZ-CE1 3.71Å; F533-F544 HydrophobicContact CZ-CE1 3.71Å; F533-F544 AromaticContact CZ-CE2 3.88Å; F533-F544 HydrophobicContact CZ-CE2 3.88Å; F533-F544 HydrophobicContact CZ-CG 4.36Å; F533-F544 AromaticContact CZ-CZ 3.59Å; F533-F544 HydrophobicContact CZ-CZ 3.59Å; F544-A549 HydrophobicContact CD1-CB 4.44Å; F544-F550 HydrophobicContact CB-CB 3.78Å; F544-F550 HydrophobicContact CB-CD2 3.83Å; F544-F550 HydrophobicContact CB-CG 4.24Å; F544-F550 HydrophobicContact CD1-CB 4.19Å; F544-F550 AromaticContact CD2-CD2 3.67Å; F544-F550 HydrophobicContact CD2-CD2 3.67Å; F544-F550 HydrophobicContact CD2-CE2 4.41Å; F544-F550 HydrophobicContact CE2-CD2 4.39Å; F544-F550 HydrophobicContact CG-CB 3.99Å; F544-F550 AromaticContact CG-CD2 3.8Å; F544-F550 HydrophobicContact CG-CD2 3.8Å; F544-F550 HydrophobicContact CG-CG 4.41Å; F544-W553 HydrophobicContact CE1-CB 3.76Å; F544-W553 HydrophobicContact CE1-CG 4.43Å; F544-W553 HydrophobicContact CZ-CB 3.89Å; F544-F554 HydrophobicContact CD2-CB 4.48Å; F544-F554 HydrophobicContact CE2-CB 3.7Å; F544-F554 HydrophobicContact CE2-CG 4.18Å; F544-F554 HydrophobicContact CZ-CB 3.87Å
545	T	75	Confident	77.8	Confident	14 Å²	14	43.5 Å²	43.5	9%	0.086	21%	0.205	C	C	.	.			trans	-101.6	-22.4	173.7	61.3	0	0	0	0	112.6	P284 P531 G532 L535 Y538 W543	P284-T545 WeakPolarHBondContact CB-O 3.49Å; P531-T545 PolarHBondContact O-N 3.11Å; G532-T545 WeakPolarHBondContact CA-OG1 3.37Å; G532-T545 WeakPolarHBondContact O-CG2 3.37Å; G532-T545 PolarHBondContact O-OG1 3.33Å; L535-T545 HydrophobicContact CD1-CG2 4.45Å; L535-T545 VanDerWaalsContact CD1-OG1 3.27Å; L535-T545 WeakPolarHBondContact CD1-OG1 3.09Å; Y538-T545 HydrophobicContact CD2-CG2 4.33Å; W543-T545 PolarHBondContact O-N 3.27Å
546	V	79.9	Confident	79.1	Confident	29 Å²	29	45.7 Å²	45.7	18%	0.176	22%	0.219	C	C	.	.			trans	-97.8	127.6	-177.3	-177.4	0	0	0	0	110.5	N528 N530 A549 F550	N528-V546 WeakPolarHBondContact O-CG1 3.49Å; N530-V546 VanDerWaalsContact O-CB 3.23Å; N530-V546 WeakPolarHBondContact O-CB 3.2Å; N530-V546 VanDerWaalsContact O-CG2 3.24Å; N530-V546 WeakPolarHBondContact O-CG2 3.34Å; V546-A549 HydrophobicContact CB-CB 4.07Å; V546-A549 HydrophobicContact CG1-CB 4.26Å; V546-F550 WeakPolarHBondContact O-CB 3.45Å; V546-F550 PolarHBondContact O-N 2.76Å
547	H	82.4	Confident	81	Confident	44 Å²	44	41.8 Å²	41.8	20%	0.204	20%	0.201	C	C	.	.	H	α-helix	trans	-64.1	-47.7	-174.4	-46.7	-49.4	0	0	0	113.6	P284 Q285 A549 F550 I551	P284-H547 WeakPolarHBondContact CB-ND1 3.27Å; Q285-H547 WeakPolarHBondContact CA-CE1 3.3Å; Q285-H547 WeakPolarHBondContact CB-CE1 2.92Å; Q285-H547 WeakPolarHBondContact CG-CE1 2.94Å; Q285-H547 WeakPolarHBondContact CG-NE2 3.47Å; Q285-H547 PolarHBondContact N-CE1 2.06Å; Q285-H547 PolarHBondContact N-ND1 3.48Å; Q285-H547 PolarHBondContact NE2-CD2 3.37Å; Q285-H547 PolarHBondContact NE2-NE2 3.35Å; Q285-H547 VanDerWaalsContact NE2-NE2 3.2Å; Q285-H547 PolarHBondContact OE1-CD2 2.87Å; H547-A549 VanDerWaalsContact C-N 3.31Å; H547-A549 PolarHBondContact O-N 2.64Å; H547-F550 PolarHBondContact O-N 3.01Å; H547-I551 WeakPolarHBondContact O-CG1 3.36Å; H547-I551 PolarHBondContact O-N 3.24Å
548	A	85.3	Confident	83.1	Confident	43 Å²	43	34.9 Å²	34.9	36%	0.355	17%	0.17	S	C	.	.	H	α-helix	trans	-62	-42.2	-177.6	0	0	0	0	0	111.2	N528 I551 L552	N528-A548 HydrophobicContact CB-CB 4.49Å; N528-A548 WeakPolarHBondContact O-CB 3.46Å; A548-I551 PolarHBondContact O-N 3.36Å; A548-L552 WeakPolarHBondContact O-CB 3.39Å; A548-L552 PolarHBondContact O-N 2.98Å
549	A	87.3	Confident	84.6	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.1	-43.8	174.2	0	0	0	0	0	112.8	N528 N530 P531 F544 V546 H547 I551 L552 W553	N528-A549 PolarHBondContact O-N 3.41Å; N530-A549 VanDerWaalsContact C-CB 3.44Å; N530-A549 WeakPolarHBondContact O-CB 3.45Å; P531-A549 HydrophobicContact CB-CB 4.47Å; F544-A549 HydrophobicContact CD1-CB 4.44Å; V546-A549 HydrophobicContact CB-CB 4.07Å; V546-A549 HydrophobicContact CG1-CB 4.26Å; H547-A549 VanDerWaalsContact C-N 3.31Å; H547-A549 PolarHBondContact O-N 2.64Å; A549-I551 VanDerWaalsContact C-N 3.32Å; A549-I551 PolarHBondContact O-N 2.89Å; A549-L552 PolarHBondContact O-N 2.99Å; A549-W553 WeakPolarHBondContact O-CB 3.44Å; A549-W553 PolarHBondContact O-N 3.28Å
550	F	89.5	Confident	86.3	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.1	-44.3	174.5	175.6	-107.8	0	0	0	112.1	F280 L283 P284 W543 F544 V546 H547 F554 L555	F280-F550 WeakPolarHBondContact O-CE2 3.4Å; L283-F550 HydrophobicContact CD2-CD1 4.09Å; L283-F550 HydrophobicContact CD2-CE1 4.2Å; P284-F550 HydrophobicContact CG-CB 3.91Å; P284-F550 HydrophobicContact CG-CD1 4.39Å; P284-F550 HydrophobicContact CG-CG 4.07Å; W543-F550 HydrophobicContact CZ2-CE2 4.33Å; W543-F550 AromaticContact NE1-CE2 3.72Å; F544-F550 HydrophobicContact CB-CB 3.78Å; F544-F550 HydrophobicContact CB-CD2 3.83Å; F544-F550 HydrophobicContact CB-CG 4.24Å; F544-F550 HydrophobicContact CD1-CB 4.19Å; F544-F550 AromaticContact CD2-CD2 3.67Å; F544-F550 HydrophobicContact CD2-CD2 3.67Å; F544-F550 HydrophobicContact CD2-CE2 4.41Å; F544-F550 HydrophobicContact CE2-CD2 4.39Å; F544-F550 HydrophobicContact CG-CB 3.99Å; F544-F550 AromaticContact CG-CD2 3.8Å; F544-F550 HydrophobicContact CG-CD2 3.8Å; F544-F550 HydrophobicContact CG-CG 4.41Å; V546-F550 WeakPolarHBondContact O-CB 3.45Å; V546-F550 PolarHBondContact O-N 2.76Å; H547-F550 PolarHBondContact O-N 3.01Å; F550-F554 HydrophobicContact CD2-CB 4.35Å; F550-F554 HydrophobicContact CD2-CD1 4.04Å; F550-F554 HydrophobicContact CE2-CB 4.48Å; F550-F554 AromaticContact CE2-CD1 3.35Å; F550-F554 HydrophobicContact CE2-CD1 3.35Å; F550-F554 AromaticContact CE2-CE1 3.88Å; F550-F554 HydrophobicContact CE2-CE1 3.88Å; F550-F554 HydrophobicContact CE2-CG 4.24Å; F550-F554 AromaticContact CZ-CD1 3.84Å; F550-F554 HydrophobicContact CZ-CD1 3.84Å; F550-F554 HydrophobicContact CZ-CE1 4.21Å; F550-F554 WeakPolarHBondContact O-CB 3.31Å; F550-F554 PolarHBondContact O-N 3.02Å; F550-L555 HydrophobicContact CE1-CB 4.32Å; F550-L555 HydrophobicContact CE1-CD1 4.42Å; F550-L555 HydrophobicContact CE1-CD2 4.39Å; F550-L555 PolarHBondContact O-N 3.13Å
551	I	91	Very high	87.9	Confident	72 Å²	72	27.8 Å²	27.8	37%	0.369	16%	0.16	S	C	.	.	I	π-helix	trans	-62.6	-52.1	178.8	-68.8	168.3	0	0	0	110.1	L283 H547 A548 A549 L555 V556	L283-I551 HydrophobicContact CD2-CD1 4.36Å; L283-I551 HydrophobicContact CD2-CG1 4.23Å; H547-I551 WeakPolarHBondContact O-CG1 3.36Å; H547-I551 PolarHBondContact O-N 3.24Å; A548-I551 PolarHBondContact O-N 3.36Å; A549-I551 VanDerWaalsContact C-N 3.32Å; A549-I551 PolarHBondContact O-N 2.89Å; I551-L555 HydrophobicContact CG1-CD2 4.29Å; I551-L555 PolarHBondContact O-N 2.02Å; I551-V556 HydrophobicContact CG2-CG2 4.01Å; I551-V556 WeakPolarHBondContact O-CB 3.45Å; I551-V556 VanDerWaalsContact O-CG2 3.31Å; I551-V556 WeakPolarHBondContact O-CG2 3.44Å; I551-V556 PolarHBondContact O-N 2.82Å
552	L	92.5	Very high	89.1	Confident	67 Å²	67	26.7 Å²	26.7	35%	0.351	16%	0.156	S	C	.	.	I	π-helix	trans	-65.8	-52.3	-174.9	-179.9	65.7	0	0	0	112.6	F529 A548 A549 P557	F529-L552 HydrophobicContact CD1-CD2 3.38Å; F529-L552 HydrophobicContact CE1-CD2 3.66Å; F529-L552 HydrophobicContact CG-CD2 4.36Å; A548-L552 WeakPolarHBondContact O-CB 3.39Å; A548-L552 PolarHBondContact O-N 2.98Å; A549-L552 PolarHBondContact O-N 2.99Å; L552-P557 WeakPolarHBondContact O-CD 3.49Å
553	W	93.7	Very high	89.9	Confident	34 Å²	34	29 Å²	29	13%	0.129	18%	0.175	C	C	.	.	I	π-helix	trans	-86	-13.8	-168.5	-61.9	118.5	0	0	0	113.9	H389 F479 P482 A483 L486 F529 F544 A549	H389-W553 PolarHBondContact NE2-O 2.85Å; F479-W553 HydrophobicContact CB-CE3 4.43Å; F479-W553 HydrophobicContact CD1-CE3 4.28Å; P482-W553 HydrophobicContact CB-CH2 3.58Å; P482-W553 HydrophobicContact CB-CZ2 4.44Å; P482-W553 HydrophobicContact CB-CZ3 3.67Å; P482-W553 HydrophobicContact CG-CZ3 4.27Å; A483-W553 HydrophobicContact CB-CB 4.27Å; A483-W553 HydrophobicContact CB-CD2 3.97Å; A483-W553 HydrophobicContact CB-CE3 4.35Å; A483-W553 HydrophobicContact CB-CG 3.9Å; L486-W553 HydrophobicContact CD1-CH2 4.41Å; L486-W553 HydrophobicContact CD1-CZ2 3.5Å; L486-W553 VanDerWaalsContact CD1-CZ2 3.5Å; F529-W553 PolarHBondContact O-NE1 3.49Å; F544-W553 HydrophobicContact CE1-CB 3.76Å; F544-W553 HydrophobicContact CE1-CG 4.43Å; F544-W553 HydrophobicContact CZ-CB 3.89Å; A549-W553 WeakPolarHBondContact O-CB 3.44Å; A549-W553 PolarHBondContact O-N 3.28Å
554	F	93.9	Very high	90.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.192	C	C	.	.	I	π-helix	trans	-136.4	-54.4	-174.1	-177.6	-102.6	0	0	0	114.3	F280 L281 H389 F392 L393 W543 F544 F550 P557 T558	F280-F554 VanDerWaalsContact O-CE1 3.31Å; F280-F554 WeakPolarHBondContact O-CE1 3.42Å; L281-F554 HydrophobicContact CD2-CE1 3.78Å; L281-F554 HydrophobicContact CD2-CZ 4.44Å; L281-F554 HydrophobicContact CG-CE1 4.47Å; H389-F554 AromaticContact CD2-CD2 3.81Å; F392-F554 HydrophobicContact CB-CE2 3.94Å; F392-F554 AromaticContact CD1-CE2 3.46Å; F392-F554 HydrophobicContact CD1-CE2 3.46Å; F392-F554 VanDerWaalsContact CD1-CE2 3.46Å; F392-F554 AromaticContact CD1-CZ 3.34Å; F392-F554 HydrophobicContact CD1-CZ 3.34Å; F392-F554 HydrophobicContact CD2-CZ 4.36Å; F392-F554 HydrophobicContact CE1-CE1 4.44Å; F392-F554 HydrophobicContact CE1-CE2 4.06Å; F392-F554 AromaticContact CE1-CZ 3.43Å; F392-F554 HydrophobicContact CE1-CZ 3.43Å; F392-F554 VanDerWaalsContact CE1-CZ 3.43Å; F392-F554 HydrophobicContact CE2-CZ 4.44Å; F392-F554 AromaticContact CG-CE2 3.75Å; F392-F554 HydrophobicContact CG-CE2 3.75Å; F392-F554 AromaticContact CG-CZ 3.83Å; F392-F554 HydrophobicContact CG-CZ 3.83Å; F392-F554 AromaticContact CZ-CZ 3.98Å; F392-F554 HydrophobicContact CZ-CZ 3.98Å; L393-F554 HydrophobicContact CD2-CD2 4.19Å; L393-F554 HydrophobicContact CG-CD2 4.3Å; W543-F554 HydrophobicContact CH2-CD2 4.12Å; W543-F554 HydrophobicContact CH2-CE1 4.37Å; W543-F554 AromaticContact CH2-CE2 3.72Å; W543-F554 HydrophobicContact CH2-CE2 3.72Å; W543-F554 AromaticContact CH2-CZ 3.82Å; W543-F554 HydrophobicContact CH2-CZ 3.82Å; W543-F554 HydrophobicContact CZ2-CD1 4.09Å; W543-F554 HydrophobicContact CZ2-CD2 4.26Å; W543-F554 AromaticContact CZ2-CE1 3.75Å; W543-F554 HydrophobicContact CZ2-CE1 3.75Å; W543-F554 AromaticContact CZ2-CE2 3.95Å; W543-F554 HydrophobicContact CZ2-CE2 3.95Å; W543-F554 HydrophobicContact CZ2-CG 4.3Å; W543-F554 AromaticContact CZ2-CZ 3.65Å; W543-F554 HydrophobicContact CZ2-CZ 3.65Å; F544-F554 HydrophobicContact CD2-CB 4.48Å; F544-F554 HydrophobicContact CE2-CB 3.7Å; F544-F554 HydrophobicContact CE2-CG 4.18Å; F544-F554 HydrophobicContact CZ-CB 3.87Å; F550-F554 HydrophobicContact CD2-CB 4.35Å; F550-F554 HydrophobicContact CD2-CD1 4.04Å; F550-F554 HydrophobicContact CE2-CB 4.48Å; F550-F554 AromaticContact CE2-CD1 3.35Å; F550-F554 HydrophobicContact CE2-CD1 3.35Å; F550-F554 AromaticContact CE2-CE1 3.88Å; F550-F554 HydrophobicContact CE2-CE1 3.88Å; F550-F554 HydrophobicContact CE2-CG 4.24Å; F550-F554 AromaticContact CZ-CD1 3.84Å; F550-F554 HydrophobicContact CZ-CD1 3.84Å; F550-F554 HydrophobicContact CZ-CE1 4.21Å; F550-F554 WeakPolarHBondContact O-CB 3.31Å; F550-F554 PolarHBondContact O-N 3.02Å; F554-P557 WeakPolarHBondContact O-CD 3.48Å; F554-P557 WeakPolarHBondContact O-CG 3.17Å; F554-T558 WeakPolarHBondContact O-CB 2.91Å; F554-T558 PolarHBondContact O-N 3.08Å; F554-T558 VanDerWaalsContact O-N 3.08Å; F554-T558 PolarHBondContact O-OG1 2.86Å
555	L	92.3	Very high	90.7	Very high	28 Å²	28	32.3 Å²	32.3	15%	0.147	19%	0.192	C	C	.	.	I	π-helix	trans	-68.6	-45	-172.3	-167.4	64.5	0	0	0	112.3	L281 F550 I551 T559 L630	L281-L555 HydrophobicContact CD2-CD1 4.26Å; F550-L555 HydrophobicContact CE1-CB 4.32Å; F550-L555 HydrophobicContact CE1-CD1 4.42Å; F550-L555 HydrophobicContact CE1-CD2 4.39Å; F550-L555 PolarHBondContact O-N 3.13Å; I551-L555 HydrophobicContact CG1-CD2 4.29Å; I551-L555 PolarHBondContact O-N 2.02Å; L555-T559 VanDerWaalsContact O-CB 3.22Å; L555-T559 WeakPolarHBondContact O-CB 3.46Å; L555-T559 PolarHBondContact O-N 2.92Å; L555-T559 PolarHBondContact O-OG1 3.18Å; L555-L630 HydrophobicContact CD1-CD1 3.75Å
556	V	93.7	Very high	91.6	Very high	74 Å²	74	33.2 Å²	33.2	45%	0.448	20%	0.199	S	C	.	.	H	α-helix	trans	-59	-57.3	176.9	168.9	0	0	0	0	111.7	I551 T558 T559 S560	I551-V556 HydrophobicContact CG2-CG2 4.01Å; I551-V556 WeakPolarHBondContact O-CB 3.45Å; I551-V556 VanDerWaalsContact O-CG2 3.31Å; I551-V556 WeakPolarHBondContact O-CG2 3.44Å; I551-V556 PolarHBondContact O-N 2.82Å; V556-T558 VanDerWaalsContact C-N 3.31Å; V556-T558 PolarHBondContact O-N 2.56Å; V556-T559 PolarHBondContact O-N 3.11Å; V556-S560 PolarHBondContact O-N 3.14Å; V556-S560 PolarHBondContact O-OG 3.37Å; V556-S560 VanDerWaalsContact O-OG 3.09Å
557	P	95	Very high	92.2	Very high	9 Å²	9	36.4 Å²	36.4	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-39.6	-179.6	19.9	-30.5	0	0	0	112.6	L393 F479 L552 F554 L561	L393-P557 HydrophobicContact CD2-CB 4.16Å; L393-P557 HydrophobicContact CD2-CG 4.04Å; F479-P557 HydrophobicContact CD1-CB 4.31Å; F479-P557 HydrophobicContact CD1-CG 3.97Å; F479-P557 HydrophobicContact CD2-CB 4.17Å; F479-P557 HydrophobicContact CD2-CG 4.47Å; F479-P557 HydrophobicContact CE1-CB 3.99Å; F479-P557 HydrophobicContact CE1-CG 4.01Å; F479-P557 HydrophobicContact CE2-CB 3.86Å; F479-P557 HydrophobicContact CG-CB 4.4Å; F479-P557 HydrophobicContact CG-CG 4.22Å; F479-P557 HydrophobicContact CZ-CB 3.77Å; F479-P557 HydrophobicContact CZ-CG 4.3Å; L552-P557 WeakPolarHBondContact O-CD 3.49Å; F554-P557 WeakPolarHBondContact O-CD 3.48Å; F554-P557 WeakPolarHBondContact O-CG 3.17Å; P557-L561 VanDerWaalsContact O-CG 3.25Å; P557-L561 WeakPolarHBondContact O-CG 3.33Å; P557-L561 PolarHBondContact O-N 3.26Å
558	T	93.4	Very high	92.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-48.3	176.5	-65.2	0	0	0	0	111.9	L281 F396 F554 V556 S560 L561 L562	L281-T558 HydrophobicContact CD2-CG2 4.47Å; F396-T558 HydrophobicContact CD1-CG2 4.41Å; F396-T558 HydrophobicContact CD2-CG2 3.69Å; F396-T558 HydrophobicContact CE1-CG2 4.1Å; F396-T558 HydrophobicContact CE2-CG2 3.18Å; F396-T558 HydrophobicContact CG-CG2 4.27Å; F396-T558 HydrophobicContact CZ-CG2 3.48Å; F396-T558 VanDerWaalsContact CZ-CG2 3.48Å; F554-T558 WeakPolarHBondContact O-CB 2.91Å; F554-T558 PolarHBondContact O-N 3.08Å; F554-T558 VanDerWaalsContact O-N 3.08Å; F554-T558 PolarHBondContact O-OG1 2.86Å; V556-T558 VanDerWaalsContact C-N 3.31Å; V556-T558 PolarHBondContact O-N 2.56Å; T558-S560 PolarHBondContact O-N 2.97Å; T558-L561 PolarHBondContact O-N 3.22Å; T558-L562 HydrophobicContact CG2-CD1 3.9Å; T558-L562 HydrophobicContact CG2-CG 4.49Å; T558-L562 WeakPolarHBondContact O-CB 3.43Å; T558-L562 WeakPolarHBondContact O-CG 3.24Å; T558-L562 PolarHBondContact O-N 3.23Å
559	T	92.6	Very high	92.9	Very high	55 Å²	55	34 Å²	34	34%	0.337	20%	0.197	S	C	.	.	H	α-helix	trans	-64.8	-40.9	-178.8	-57.5	0	0	0	0	110.9	L555 V556 L561 L562 A563 L630	L555-T559 VanDerWaalsContact O-CB 3.22Å; L555-T559 WeakPolarHBondContact O-CB 3.46Å; L555-T559 PolarHBondContact O-N 2.92Å; L555-T559 PolarHBondContact O-OG1 3.18Å; V556-T559 PolarHBondContact O-N 3.11Å; T559-L561 PolarHBondContact O-N 3.02Å; T559-L562 PolarHBondContact O-N 3.44Å; T559-A563 VanDerWaalsContact O-CB 3.27Å; T559-A563 WeakPolarHBondContact O-CB 3.21Å; T559-A563 PolarHBondContact O-N 3.12Å; T559-L630 HydrophobicContact CG2-CD2 4.32Å
560	S	94.6	Very high	93.1	Very high	74 Å²	74	39.6 Å²	39.6	52%	0.517	23%	0.226	S	C	.	.	H	α-helix	trans	-61.1	-44	174.9	-61.2	0	0	0	0	112.3	V556 T558 L564	V556-S560 PolarHBondContact O-N 3.14Å; V556-S560 PolarHBondContact O-OG 3.37Å; V556-S560 VanDerWaalsContact O-OG 3.09Å; T558-S560 PolarHBondContact O-N 2.97Å; S560-L564 WeakPolarHBondContact O-CB 3.3Å; S560-L564 PolarHBondContact O-N 3.28Å
561	L	95.2	Very high	93	Very high	14 Å²	14	41.2 Å²	41.2	7%	0.073	23%	0.234	C	C	.	.	H	α-helix	trans	-66.7	-39.7	177.7	-69.2	169.1	0	0	0	112.2	F396 S400 L475 P557 T558 T559 L564 N565	F396-L561 HydrophobicContact CB-CB 4Å; F396-L561 HydrophobicContact CB-CD1 3.63Å; F396-L561 HydrophobicContact CB-CG 4.46Å; S400-L561 WeakPolarHBondContact OG-CD2 3.29Å; S400-L561 PolarHBondContact OG-O 3.41Å; L475-L561 HydrophobicContact CD2-CD1 4.12Å; L475-L561 HydrophobicContact CD2-CD2 3.91Å; P557-L561 VanDerWaalsContact O-CG 3.25Å; P557-L561 WeakPolarHBondContact O-CG 3.33Å; P557-L561 PolarHBondContact O-N 3.26Å; T558-L561 PolarHBondContact O-N 3.22Å; T559-L561 PolarHBondContact O-N 3.02Å; L561-L564 PolarHBondContact O-N 3.4Å; L561-N565 WeakPolarHBondContact O-CB 3.1Å; L561-N565 PolarHBondContact O-N 2.91Å; L561-N565 PolarHBondContact O-OD1 3.06Å
562	L	94.1	Very high	92.8	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-68.2	-41.1	176	-77.4	173.4	0	0	0	112.8	F396 T558 T559 L564 N565 S566 W626 I627 L630	F396-L562 HydrophobicContact CD1-CD1 4.4Å; F396-L562 HydrophobicContact CD1-CD2 3.83Å; F396-L562 HydrophobicContact CD1-CG 3.88Å; F396-L562 HydrophobicContact CE1-CD1 3.85Å; F396-L562 HydrophobicContact CE1-CD2 3.68Å; F396-L562 HydrophobicContact CE1-CG 3.79Å; F396-L562 HydrophobicContact CZ-CD1 4.29Å; T558-L562 HydrophobicContact CG2-CD1 3.9Å; T558-L562 HydrophobicContact CG2-CG 4.49Å; T558-L562 WeakPolarHBondContact O-CB 3.43Å; T558-L562 WeakPolarHBondContact O-CG 3.24Å; T558-L562 PolarHBondContact O-N 3.23Å; T559-L562 PolarHBondContact O-N 3.44Å; L562-L564 VanDerWaalsContact C-N 3.34Å; L562-N565 PolarHBondContact O-N 3.11Å; L562-S566 WeakPolarHBondContact O-CB 3.35Å; L562-S566 PolarHBondContact O-N 2.97Å; L562-S566 PolarHBondContact O-OG 3.46Å; L562-W626 HydrophobicContact CD1-CB 4.02Å; L562-W626 HydrophobicContact CD2-CB 3.81Å; L562-I627 HydrophobicContact CD2-CG1 4.43Å; L562-L630 HydrophobicContact CD1-CD2 4.43Å
563	A	94.7	Very high	92.5	Very high	49 Å²	49	35.5 Å²	35.5	41%	0.405	21%	0.209	S	C	.	.	H	α-helix	trans	-61.1	-45.6	174.8	0	0	0	0	0	110.6	T559 S566 I567	T559-A563 VanDerWaalsContact O-CB 3.27Å; T559-A563 WeakPolarHBondContact O-CB 3.21Å; T559-A563 PolarHBondContact O-N 3.12Å; A563-S566 WeakPolarHBondContact O-CB 3.08Å; A563-S566 PolarHBondContact O-N 3.03Å; A563-I567 WeakPolarHBondContact O-CG1 3.41Å; A563-I567 PolarHBondContact O-N 3.07Å; A563-I567 VanDerWaalsContact O-N 3.07Å
564	L	94	Very high	92.1	Very high	66 Å²	66	37 Å²	37	35%	0.346	22%	0.218	S	C	.	.	H	α-helix	trans	-55.7	-54.5	172.5	178.5	63.5	0	0	0	110.3	S560 L561 L562 S566 I567 I568	S560-L564 WeakPolarHBondContact O-CB 3.3Å; S560-L564 PolarHBondContact O-N 3.28Å; L561-L564 PolarHBondContact O-N 3.4Å; L562-L564 VanDerWaalsContact C-N 3.34Å; L564-S566 PolarHBondContact O-N 2.85Å; L564-I567 PolarHBondContact O-N 2.9Å; L564-I567 VanDerWaalsContact O-N 3.08Å; L564-I568 HydrophobicContact CD1-CD1 4.19Å; L564-I568 HydrophobicContact CD1-CG1 4.26Å; L564-I568 HydrophobicContact CG-CD1 4Å; L564-I568 HydrophobicContact CG-CG1 4.36Å; L564-I568 VanDerWaalsContact O-CG1 3.26Å; L564-I568 WeakPolarHBondContact O-CG1 3.42Å; L564-I568 PolarHBondContact O-N 3.48Å
565	N	94.3	Very high	91.6	Very high	3 Å²	3	37 Å²	37	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-57.8	-34.8	-178.8	-68.2	-5	0	0	0	113.1	M399 S400 L561 L562 I568 L569 L622	M399-N565 WeakPolarHBondContact CB-ND2 3.5Å; S400-N565 WeakPolarHBondContact CA-OD1 3.24Å; S400-N565 WeakPolarHBondContact CB-OD1 3.4Å; S400-N565 PolarHBondContact N-OD1 2.96Å; S400-N565 PolarHBondContact OG-ND2 3.24Å; S400-N565 PolarHBondContact OG-OD1 2.68Å; L561-N565 WeakPolarHBondContact O-CB 3.1Å; L561-N565 PolarHBondContact O-N 2.91Å; L561-N565 PolarHBondContact O-OD1 3.06Å; L562-N565 PolarHBondContact O-N 3.11Å; N565-I568 PolarHBondContact O-N 2.89Å; N565-L569 WeakPolarHBondContact O-CB 3.26Å; N565-L569 PolarHBondContact O-N 2.7Å; N565-L622 HydrophobicContact CB-CB 4.4Å; N565-L622 WeakPolarHBondContact CB-O 3.46Å; N565-L622 PolarHBondContact ND2-O 2.88Å
566	S	93.4	Very high	91.1	Very high	33 Å²	33	36.3 Å²	36.3	23%	0.231	21%	0.214	C	C	.	.	H	α-helix	trans	-65.2	-47.8	176.2	-56.8	0	0	0	0	111.5	L562 A563 L564 I568 L569 L570 I627	L562-S566 WeakPolarHBondContact O-CB 3.35Å; L562-S566 PolarHBondContact O-N 2.97Å; L562-S566 PolarHBondContact O-OG 3.46Å; A563-S566 WeakPolarHBondContact O-CB 3.08Å; A563-S566 PolarHBondContact O-N 3.03Å; L564-S566 PolarHBondContact O-N 2.85Å; S566-I568 VanDerWaalsContact C-N 3.28Å; S566-I568 PolarHBondContact O-N 3.14Å; S566-L569 PolarHBondContact O-N 2.77Å; S566-L570 WeakPolarHBondContact O-CG 2.76Å; S566-L570 PolarHBondContact O-N 3.11Å; S566-I627 WeakPolarHBondContact OG-CD1 3.4Å
567	I	92.3	Very high	90.6	Very high	95 Å²	95	38.2 Å²	38.2	49%	0.487	21%	0.214	S	C	.	.	H	α-helix	trans	-60	-43.1	175.5	-64	164.4	0	0	0	109.9	A563 L564 L570 M571	A563-I567 WeakPolarHBondContact O-CG1 3.41Å; A563-I567 PolarHBondContact O-N 3.07Å; A563-I567 VanDerWaalsContact O-N 3.07Å; L564-I567 PolarHBondContact O-N 2.9Å; L564-I567 VanDerWaalsContact O-N 3.08Å; I567-L570 PolarHBondContact O-N 2.9Å; I567-M571 HydrophobicContact CG2-CE 3.94Å; I567-M571 HydrophobicContact CG2-CG 4.5Å; I567-M571 HydrophobicContact CG2-SD 4.28Å; I567-M571 WeakPolarHBondContact O-CG 3.35Å; I567-M571 PolarHBondContact O-N 2.84Å
568	I	91.6	Very high	89.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-49.7	176.7	-62.5	-171.4	0	0	0	111.4	G403 L404 I407 L564 N565 S566 L570 M571 V572 L622	G403-I568 WeakPolarHBondContact O-CG2 3.28Å; L404-I568 HydrophobicContact CD2-CD1 4.09Å; L404-I568 HydrophobicContact CG-CD1 4.24Å; I407-I568 HydrophobicContact CD1-CB 3.87Å; I407-I568 HydrophobicContact CD1-CD1 3.89Å; I407-I568 HydrophobicContact CD1-CG1 3.41Å; I407-I568 VanDerWaalsContact CD1-CG1 3.41Å; I407-I568 HydrophobicContact CD1-CG2 3.72Å; I407-I568 HydrophobicContact CG1-CG1 4.46Å; I407-I568 HydrophobicContact CG1-CG2 3.86Å; L564-I568 HydrophobicContact CD1-CD1 4.19Å; L564-I568 HydrophobicContact CD1-CG1 4.26Å; L564-I568 HydrophobicContact CG-CD1 4Å; L564-I568 HydrophobicContact CG-CG1 4.36Å; L564-I568 VanDerWaalsContact O-CG1 3.26Å; L564-I568 WeakPolarHBondContact O-CG1 3.42Å; L564-I568 PolarHBondContact O-N 3.48Å; N565-I568 PolarHBondContact O-N 2.89Å; S566-I568 VanDerWaalsContact C-N 3.28Å; S566-I568 PolarHBondContact O-N 3.14Å; I568-L570 VanDerWaalsContact C-N 3.32Å; I568-L570 PolarHBondContact O-N 2.91Å; I568-M571 PolarHBondContact O-N 3.25Å; I568-V572 HydrophobicContact CG2-CG2 4.22Å; I568-V572 WeakPolarHBondContact O-CB 3.32Å; I568-V572 WeakPolarHBondContact O-CG2 2.95Å; I568-V572 PolarHBondContact O-N 2.85Å; I568-L622 HydrophobicContact CG2-CD1 4.09Å
569	L	92.4	Very high	89	Confident	38 Å²	38	40.4 Å²	40.4	20%	0.199	22%	0.224	C	C	.	.	H	α-helix	trans	-60.1	-43	-179.7	179.7	64.2	0	0	0	111.1	N565 S566 G573 L618 L622 A624	N565-L569 WeakPolarHBondContact O-CB 3.26Å; N565-L569 PolarHBondContact O-N 2.7Å; S566-L569 PolarHBondContact O-N 2.77Å; L569-G573 WeakPolarHBondContact O-CA 3.32Å; L569-G573 PolarHBondContact O-N 3.46Å; L569-L618 HydrophobicContact CD1-CB 4.04Å; L569-L622 HydrophobicContact CB-CD1 3.91Å; L569-L622 HydrophobicContact CD1-CD1 4.08Å; L569-A624 HydrophobicContact CD2-CB 4.38Å
570	L	90.4	Very high	88.2	Confident	116 Å²	116	38.6 Å²	38.6	61%	0.607	21%	0.213	S	C	*	.	H	α-helix	trans	-62.8	-48.8	176.5	-71.7	173.8	0	0	0	111.7	S566 I567 I568 G573 M574	S566-L570 WeakPolarHBondContact O-CG 2.76Å; S566-L570 PolarHBondContact O-N 3.11Å; I567-L570 PolarHBondContact O-N 2.9Å; I568-L570 VanDerWaalsContact C-N 3.32Å; I568-L570 PolarHBondContact O-N 2.91Å; L570-G573 PolarHBondContact O-N 2.91Å; L570-M574 WeakPolarHBondContact O-CB 2.87Å; L570-M574 VanDerWaalsContact O-CG 3.27Å; L570-M574 WeakPolarHBondContact O-CG 3.36Å; L570-M574 PolarHBondContact O-N 2.67Å
571	M	88	Confident	87.2	Confident	35 Å²	35	39.3 Å²	39.3	17%	0.172	21%	0.208	C	C	.	.	H	α-helix	trans	-63.1	-47.6	179.5	-70.8	-171	-55.7	0	0	112.1	I407 C416 C419 I567 I568 Y575	I407-M571 HydrophobicContact CD1-CE 3.36Å; I407-M571 HydrophobicContact CG1-CE 4.24Å; C416-M571 HydrophobicContact CB-SD 4.15Å; C419-M571 PolarHBondContact SG-O 3.44Å; I567-M571 HydrophobicContact CG2-CE 3.94Å; I567-M571 HydrophobicContact CG2-CG 4.5Å; I567-M571 HydrophobicContact CG2-SD 4.28Å; I567-M571 WeakPolarHBondContact O-CG 3.35Å; I567-M571 PolarHBondContact O-N 2.84Å; I568-M571 PolarHBondContact O-N 3.25Å; M571-Y575 WeakPolarHBondContact O-CB 3.16Å; M571-Y575 PolarHBondContact O-N 3.04Å
572	V	87.2	Confident	85.9	Confident	1 Å²	1	41 Å²	41	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-67	-41.2	179.7	174.1	0	0	0	0	110.9	L406 I407 F410 I568 Y575 I576 L618	L406-V572 HydrophobicContact CB-CG2 4.32Å; I407-V572 HydrophobicContact CG1-CG2 4.03Å; F410-V572 HydrophobicContact CD2-CG1 3.81Å; F410-V572 HydrophobicContact CD2-CG2 4.3Å; F410-V572 HydrophobicContact CE2-CG1 3.67Å; I568-V572 HydrophobicContact CG2-CG2 4.22Å; I568-V572 WeakPolarHBondContact O-CB 3.32Å; I568-V572 WeakPolarHBondContact O-CG2 2.95Å; I568-V572 PolarHBondContact O-N 2.85Å; V572-Y575 PolarHBondContact O-N 2.9Å; V572-I576 HydrophobicContact CG1-CD1 3.76Å; V572-I576 HydrophobicContact CG1-CG1 4.34Å; V572-I576 VanDerWaalsContact O-CG1 3.27Å; V572-I576 WeakPolarHBondContact O-CG1 3.34Å; V572-I576 PolarHBondContact O-N 3.38Å; V572-L618 HydrophobicContact CG1-CD1 3.92Å
573	G	86.4	Confident	84.5	Confident	18 Å²	18	47.7 Å²	47.7	19%	0.186	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-47.2	176.5	0	0	0	0	0	112.5	L569 L570 Y575 I576 W577	L569-G573 WeakPolarHBondContact O-CA 3.32Å; L569-G573 PolarHBondContact O-N 3.46Å; L570-G573 PolarHBondContact O-N 2.91Å; G573-Y575 VanDerWaalsContact C-N 3.29Å; G573-Y575 PolarHBondContact O-N 3.13Å; G573-I576 PolarHBondContact O-N 3.25Å; G573-W577 WeakPolarHBondContact O-CB 3.46Å; G573-W577 PolarHBondContact O-N 2.86Å
574	M	84.5	Confident	82.5	Confident	64 Å²	64	48.8 Å²	48.8	32%	0.315	25%	0.247	S	C	.	.	H	α-helix	trans	-59.5	-41	173.8	-76.3	-165.7	-62.8	0	0	111.8	C419 V423 L570 W577 L578	C419-M574 HydrophobicContact CB-CE 3.78Å; V423-M574 HydrophobicContact CG2-SD 4.23Å; L570-M574 WeakPolarHBondContact O-CB 2.87Å; L570-M574 VanDerWaalsContact O-CG 3.27Å; L570-M574 WeakPolarHBondContact O-CG 3.36Å; L570-M574 PolarHBondContact O-N 2.67Å; M574-W577 PolarHBondContact O-N 2.83Å; M574-L578 WeakPolarHBondContact O-CB 3.27Å; M574-L578 PolarHBondContact O-N 3.17Å
575	Y	83.5	Confident	80.2	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-65.7	-45.1	179.2	-172.6	-106.6	0	0	0	112.7	F410 T415 T444 M448 M571 V572 G573 W577 L578 L579	F410-Y575 HydrophobicContact CB-CD1 4.02Å; F410-Y575 HydrophobicContact CB-CE1 4.25Å; F410-Y575 AromaticContact CD1-CD1 3.79Å; F410-Y575 HydrophobicContact CD1-CD1 3.79Å; F410-Y575 AromaticContact CD1-CE1 3.86Å; F410-Y575 HydrophobicContact CD1-CE1 3.86Å; F410-Y575 HydrophobicContact CG-CD1 4.12Å; F410-Y575 HydrophobicContact CG-CE1 4.45Å; T415-Y575 HydrophobicContact CG2-CD1 4.16Å; T415-Y575 HydrophobicContact CG2-CD2 3.75Å; T415-Y575 HydrophobicContact CG2-CG 3.59Å; T444-Y575 HydrophobicContact CG2-CE2 4.36Å; M448-Y575 HydrophobicContact CE-CE1 4.03Å; M448-Y575 WeakPolarHBondContact CE-OH 3.29Å; M448-Y575 HydrophobicContact SD-CE1 4.37Å; M571-Y575 WeakPolarHBondContact O-CB 3.16Å; M571-Y575 PolarHBondContact O-N 3.04Å; V572-Y575 PolarHBondContact O-N 2.9Å; G573-Y575 VanDerWaalsContact C-N 3.29Å; G573-Y575 PolarHBondContact O-N 3.13Å; Y575-W577 VanDerWaalsContact C-N 3.31Å; Y575-W577 PolarHBondContact O-N 2.85Å; Y575-L578 PolarHBondContact O-N 3.41Å; Y575-L579 HydrophobicContact CD1-CD1 3.81Å; Y575-L579 HydrophobicContact CD1-CG 4.47Å; Y575-L579 HydrophobicContact CE1-CD1 3.3Å; Y575-L579 HydrophobicContact CE1-CG 3.94Å; Y575-L579 PolarHBondContact O-N 2.86Å
576	I	82.4	Confident	77.7	Confident	15 Å²	15	55.6 Å²	55.6	8%	0.077	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-42.4	175.5	-67.5	167.4	0	0	0	110.4	F410 V572 G573 L579 D580 V611 I614 L618	F410-I576 HydrophobicContact CE1-CG1 4.48Å; F410-I576 HydrophobicContact CZ-CD1 4.3Å; F410-I576 HydrophobicContact CZ-CG1 4.32Å; V572-I576 HydrophobicContact CG1-CD1 3.76Å; V572-I576 HydrophobicContact CG1-CG1 4.34Å; V572-I576 VanDerWaalsContact O-CG1 3.27Å; V572-I576 WeakPolarHBondContact O-CG1 3.34Å; V572-I576 PolarHBondContact O-N 3.38Å; G573-I576 PolarHBondContact O-N 3.25Å; I576-L579 WeakPolarHBondContact O-CB 3Å; I576-L579 PolarHBondContact O-N 3.42Å; I576-D580 PolarHBondContact O-N 3.28Å; I576-V611 HydrophobicContact CG2-CG1 3.85Å; I576-V611 HydrophobicContact CG2-CG2 4.44Å; I576-I614 HydrophobicContact CD1-CG2 4.06Å; I576-L618 HydrophobicContact CD1-CD1 3.61Å
577	W	82.1	Confident	74.9	Confident	114 Å²	114	58.1 Å²	58.1	43%	0.432	30%	0.297	S	S	.	.	H	α-helix	trans	-62	-43.5	177	178.3	83.3	0	0	0	112	Y422 G573 M574 Y575 L579 D580 H581	Y422-W577 HydrophobicContact CE1-CZ3 4.05Å; Y422-W577 HydrophobicContact CE2-CZ3 4.04Å; Y422-W577 AromaticContact CZ-CZ3 3.5Å; Y422-W577 VanDerWaalsContact CZ-CZ3 3.5Å; Y422-W577 WeakPolarHBondContact OH-CH2 3.41Å; Y422-W577 WeakPolarHBondContact OH-CZ3 3.38Å; G573-W577 WeakPolarHBondContact O-CB 3.46Å; G573-W577 PolarHBondContact O-N 2.86Å; M574-W577 PolarHBondContact O-N 2.83Å; Y575-W577 VanDerWaalsContact C-N 3.31Å; Y575-W577 PolarHBondContact O-N 2.85Å; W577-L579 VanDerWaalsContact C-N 3.34Å; W577-L579 PolarHBondContact O-N 2.83Å; W577-D580 PolarHBondContact O-N 2.86Å; W577-H581 WeakPolarHBondContact O-CB 3.26Å; W577-H581 PolarHBondContact O-N 2.85Å
578	L	79.8	Confident	72.2	Confident	14 Å²	14	59.7 Å²	59.7	7%	0.073	31%	0.306	C	S	.	.	H	α-helix	trans	-63.3	-39.3	176.7	-174.1	67.4	0	0	0	112.2	V418 Y422 Y441 M574 Y575 N582	V418-L578 HydrophobicContact CG1-CD2 3.58Å; Y422-L578 HydrophobicContact CD2-CD1 4.16Å; Y422-L578 HydrophobicContact CE2-CD1 4.32Å; Y441-L578 HydrophobicContact CD2-CD2 3.64Å; Y441-L578 HydrophobicContact CD2-CG 4.24Å; Y441-L578 HydrophobicContact CE2-CD2 3.88Å; Y441-L578 HydrophobicContact CE2-CG 4.02Å; M574-L578 WeakPolarHBondContact O-CB 3.27Å; M574-L578 PolarHBondContact O-N 3.17Å; Y575-L578 PolarHBondContact O-N 3.41Å; L578-N582 PolarHBondContact O-N 2.74Å; L578-N582 VanDerWaalsContact O-N 3.09Å
579	L	76.2	Confident	69.6	Low	40 Å²	40	67.4 Å²	67.4	21%	0.209	34%	0.34	C	S	.	.	H	α-helix	trans	-63.6	-40.4	175.3	-81.4	169.8	0	0	0	112.6	Y441 Y575 I576 W577 K583	Y441-L579 HydrophobicContact CE2-CD2 4.39Å; Y441-L579 WeakPolarHBondContact OH-CD2 3.37Å; Y575-L579 HydrophobicContact CD1-CD1 3.81Å; Y575-L579 HydrophobicContact CD1-CG 4.47Å; Y575-L579 HydrophobicContact CE1-CD1 3.3Å; Y575-L579 HydrophobicContact CE1-CG 3.94Å; Y575-L579 PolarHBondContact O-N 2.86Å; I576-L579 WeakPolarHBondContact O-CB 3Å; I576-L579 PolarHBondContact O-N 3.42Å; W577-L579 VanDerWaalsContact C-N 3.34Å; W577-L579 PolarHBondContact O-N 2.83Å; L579-K583 WeakPolarHBondContact O-CG 3.28Å; L579-K583 PolarHBondContact O-N 2.94Å
580	D	76.1	Confident	66.9	Low	18 Å²	18	72.4 Å²	72.4	10%	0.096	37%	0.367	C	S	.	.	H	α-helix	trans	-70	-43.8	177.9	-166.5	55.9	0	0	0	111	I576 W577 N582 K583 T584 S607 V611	I576-D580 PolarHBondContact O-N 3.28Å; W577-D580 PolarHBondContact O-N 2.86Å; D580-N582 VanDerWaalsContact C-N 3.33Å; D580-N582 PolarHBondContact O-N 2.91Å; D580-K583 PolarHBondContact O-N 3.36Å; D580-T584 PolarHBondContact O-N 3.1Å; D580-T584 PolarHBondContact O-OG1 2.83Å; D580-S607 PolarHBondContact OD1-OG 3.22Å; D580-V611 HydrophobicContact CB-CG2 3.76Å; D580-V611 VanDerWaalsContact CG-CG2 3.47Å
581	H	72.6	Confident	64.2	Low	89 Å²	89	75.4 Å²	75.4	41%	0.412	38%	0.378	S	S	.	.	H	α-helix	trans	-58.7	-41.3	177.5	-173	-76.6	0	0	0	112.5	W577 T584 V585	W577-H581 WeakPolarHBondContact O-CB 3.26Å; W577-H581 PolarHBondContact O-N 2.85Å; H581-T584 VanDerWaalsContact C-OG1 3.28Å; H581-T584 WeakPolarHBondContact CA-OG1 3.5Å; H581-T584 PolarHBondContact O-N 3.2Å; H581-T584 PolarHBondContact O-OG1 3.28Å; H581-V585 WeakPolarHBondContact O-CG2 3.42Å; H581-V585 PolarHBondContact O-N 2.88Å
582	N	68	Low	61.5	Low	50 Å²	50	78.5 Å²	78.5	27%	0.267	40%	0.402	S	S	.	.	H	α-helix	trans	-72.1	-32.7	179.5	-76.5	-12.8	0	0	0	113.1	Y441 L578 D580 T584 V585 E586	Y441-N582 VanDerWaalsContact CZ-ND2 3.31Å; Y441-N582 PolarHBondContact OH-ND2 2.91Å; L578-N582 PolarHBondContact O-N 2.74Å; L578-N582 VanDerWaalsContact O-N 3.09Å; D580-N582 VanDerWaalsContact C-N 3.33Å; D580-N582 PolarHBondContact O-N 2.91Å; N582-T584 PolarHBondContact O-N 3.03Å; N582-V585 PolarHBondContact O-N 3.47Å; N582-E586 PolarHBondContact O-N 2.93Å; N582-E586 VanDerWaalsContact O-N 3.08Å
583	K	64.4	Low	58.9	Low	144 Å²	144	84.6 Å²	84.6	63%	0.626	44%	0.44	S	S	*	.	H	α-helix	trans	-63.1	-30.6	172.9	-74.7	176.8	-178.8	-179.4	0	112.7	L579 D580 V585 P587	L579-K583 WeakPolarHBondContact O-CG 3.28Å; L579-K583 PolarHBondContact O-N 2.94Å; D580-K583 PolarHBondContact O-N 3.36Å; K583-V585 VanDerWaalsContact C-N 3.3Å; K583-P587 VanDerWaalsContact O-CD 3.24Å; K583-P587 WeakPolarHBondContact O-CD 3.41Å
584	T	52.1	Low	56.4	Low	71 Å²	71	89.6 Å²	89.6	44%	0.436	47%	0.466	S	S	.	.	H	α-helix	trans	-75.4	-16	173.3	32.5	0	0	0	0	113.8	D580 H581 N582	D580-T584 PolarHBondContact O-N 3.1Å; D580-T584 PolarHBondContact O-OG1 2.83Å; H581-T584 VanDerWaalsContact C-OG1 3.28Å; H581-T584 WeakPolarHBondContact CA-OG1 3.5Å; H581-T584 PolarHBondContact O-N 3.2Å; H581-T584 PolarHBondContact O-OG1 3.28Å; N582-T584 PolarHBondContact O-N 3.03Å
585	V	46.3	Very low	53.9	Low	66 Å²	66	91.6 Å²	91.6	40%	0.4	49%	0.487	S	S	.	.	H	α-helix	trans	-98.7	-28.7	-178.1	177.1	0	0	0	0	112.6	H581 N582 K583 P587 L588	H581-V585 WeakPolarHBondContact O-CG2 3.42Å; H581-V585 PolarHBondContact O-N 2.88Å; N582-V585 PolarHBondContact O-N 3.47Å; K583-V585 VanDerWaalsContact C-N 3.3Å; V585-P587 VanDerWaalsContact C-CD 3.43Å; V585-L588 PolarHBondContact O-N 2.87Å
586	E	41.4	Very low	51.4	Low	146 Å²	146	97.9 Å²	97.9	68%	0.682	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-59	-31.9	176.4	-81.4	179.8	161.5	0	0	116.1	N582 L588	N582-E586 PolarHBondContact O-N 2.93Å; N582-E586 VanDerWaalsContact O-N 3.08Å; E586-L588 PolarHBondContact O-N 3.29Å
587	P	34.9	Very low	49	Very low	86 Å²	86	104.3 Å²	104.3	56%	0.558	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-75.7	-4.1	177.3	27.8	-33.1	0	0	0	114.9	K583 V585	K583-P587 VanDerWaalsContact O-CD 3.24Å; K583-P587 WeakPolarHBondContact O-CD 3.41Å; V585-P587 VanDerWaalsContact C-CD 3.43Å
588	L	35.5	Very low	46.4	Very low	128 Å²	128	104.4 Å²	104.4	67%	0.67	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-95.5	6.3	-177.7	-80	160.6	0	0	0	114.4	V585 E586	V585-L588 PolarHBondContact O-N 2.87Å; E586-L588 PolarHBondContact O-N 3.29Å
589	K	37.5	Very low	44	Very low	163 Å²	163	113.4 Å²	113.4	71%	0.709	62%	0.616	S	S	*	*	S	Bend	trans	-113.7	-4.3	-179.9	-81.6	-173.7	173.5	-175.4	0	115.8
590	D	34.6	Very low	41.8	Very low	143 Å²	143	116.2 Å²	116.2	77%	0.765	64%	0.639	S	S	*	*			trans	-110.7	10	179.1	-70.9	-20.7	0	0	0	113.7	S592	D590-S592 VanDerWaalsContact C-N 3.26Å; D590-S592 PolarHBondContact O-N 2.86Å
591	E	34.8	Very low	39.6	Very low	179 Å²	179	122 Å²	122	84%	0.836	68%	0.675	S	S	*	*			trans	-83.8	69.4	170.2	-85.2	-171.7	139.3	0	0	111.6
592	S	30.3	Very low	37.7	Very low	99 Å²	99	126.1 Å²	126.1	69%	0.692	70%	0.695	S	S	*	*			trans	-123.4	128.5	145.2	64.4	0	0	0	0	106.7	D590	D590-S592 VanDerWaalsContact C-N 3.26Å; D590-S592 PolarHBondContact O-N 2.86Å
593	V	34.5	Very low	36.3	Very low	130 Å²	130	130.6 Å²	130.6	79%	0.788	72%	0.718	S	S	*	*	S	Bend	trans	101.3	83.3	176.3	-167.8	0	0	0	0	115.2
594	T	32.4	Very low	35	Very low	122 Å²	122	128.4 Å²	128.4	75%	0.748	72%	0.718	S	S	*	*			trans	67.6	125.4	135.6	56.6	0	0	0	0	121.8
595	S	31.9	Very low	34.6	Very low	107 Å²	107	129.8 Å²	129.8	75%	0.748	72%	0.723	S	S	*	*			trans	91.9	104.6	140.7	71.1	0	0	0	0	119.5
596	V	31.2	Very low	34.9	Very low	132 Å²	132	134.1 Å²	134.1	80%	0.8	74%	0.737	S	S	*	*				46.8	97.8	127.3	-168.9	0	0	0	0	116.3
597	D	31.7	Very low	35.7	Very low	150 Å²	150	129.3 Å²	129.3	80%	0.802	72%	0.719	S	S	*	*				-163.9	120.9	118.5	-108	-20.7	0	0	0	112.6	K599	D597-K599 PolarHBondContact O-N 3.36Å
598	S	28.6	Very low	37.2	Very low	116 Å²	116	129.9 Å²	129.9	81%	0.811	72%	0.717	S	S	*	*			trans	-77	79	-178.6	44.3	0	0	0	0	111.3
599	K	29.3	Very low	38.8	Very low	203 Å²	203	132.1 Å²	132.1	88%	0.883	72%	0.717	S	S	*	*			trans	-151.7	57	167.8	-102.9	177.3	-169.5	170.8	0	112.7	D597	D597-K599 PolarHBondContact O-N 3.36Å
600	S	29.6	Very low	40.7	Very low	98 Å²	98	128.7 Å²	128.7	69%	0.685	71%	0.706	S	S	*	*			trans	-137.3	78.5	173.8	72.3	0	0	0	0	113.3
601	T	30.4	Very low	42.8	Very low	141 Å²	141	122.9 Å²	122.9	87%	0.865	68%	0.676	S	S	*	*	S	Bend	trans	-129.8	24.3	170.9	-18.5	0	0	0	0	113
602	Q	32.8	Very low	44.9	Very low	174 Å²	174	117.3 Å²	117.3	81%	0.813	66%	0.66	S	S	*	*	S	Bend	trans	-132.9	3.3	178.4	-72.3	-145.6	13.5	0	0	116.5
603	L	38.5	Very low	47.5	Very low	145 Å²	145	116.3 Å²	116.3	76%	0.759	64%	0.643	S	S	*	*	S	Bend	trans	-84	-24.7	-175	-98.7	78.7	0	0	0	118.5	N605	L603-N605 PolarHBondContact O-N 3.41Å
604	P	36.5	Very low	49.8	Very low	97 Å²	97	114.1 Å²	114.1	63%	0.63	63%	0.626	S	S	*	*	H	α-helix	trans	-76.8	-26.2	-174.5	26.2	-30.8	0	0	0	114	K606	P604-K606 VanDerWaalsContact C-N 3.34Å; P604-K606 PolarHBondContact O-N 3.41Å
605	N	44.2	Very low	52.4	Low	101 Å²	101	110.1 Å²	110.1	54%	0.54	60%	0.603	S	S	.	*	H	α-helix	trans	-77.2	-18.8	-172.3	-150.7	-4	0	0	0	113.6	L603 R609	L603-N605 PolarHBondContact O-N 3.41Å; N605-R609 WeakPolarHBondContact O-CG 3.42Å
606	K	52.7	Low	55.1	Low	157 Å²	157	109.7 Å²	109.7	68%	0.683	59%	0.592	S	S	*	*	H	α-helix	trans	-81.6	-32.1	-176.1	-165.2	173.8	179.6	179.1	0	113	P604 N610	P604-K606 VanDerWaalsContact C-N 3.34Å; P604-K606 PolarHBondContact O-N 3.41Å; K606-N610 PolarHBondContact O-ND2 3.1Å
607	S	58.6	Low	57.9	Low	44 Å²	44	105.2 Å²	105.2	31%	0.308	56%	0.562	S	S	.	*	H	α-helix	trans	-70.5	-50.1	-179.8	-150.6	0	0	0	0	111.7	D580 R609 N610 V611	D580-S607 PolarHBondContact OD1-OG 3.22Å; S607-R609 PolarHBondContact O-N 3.19Å; S607-N610 WeakPolarHBondContact O-CB 3.43Å; S607-N610 PolarHBondContact O-N 2.99Å; S607-V611 PolarHBondContact O-N 3.31Å; S607-V611 VanDerWaalsContact O-N 3.15Å
608	N	64.8	Low	60.8	Low	98 Å²	98	98.7 Å²	98.7	52%	0.524	53%	0.527	S	S	.	.	H	α-helix	trans	-55.8	-38.8	179.7	-68.6	-3	0	0	0	112.5	N610 V611 A612	N608-N610 VanDerWaalsContact C-N 3.34Å; N608-N610 PolarHBondContact O-N 3.3Å; N608-V611 PolarHBondContact O-N 3.18Å; N608-A612 WeakPolarHBondContact O-CB 3.18Å; N608-A612 PolarHBondContact O-N 2.73Å
609	R	70.7	Confident	63.8	Low	176 Å²	176	94.7 Å²	94.7	66%	0.664	50%	0.499	S	S	*	.	H	α-helix	trans	-64.4	-36.1	176.8	-74.9	-179.7	174.7	-167.6	-3	112.9	N605 S607 K613	N605-R609 WeakPolarHBondContact O-CG 3.42Å; S607-R609 PolarHBondContact O-N 3.19Å; R609-K613 WeakPolarHBondContact O-CB 3.33Å; R609-K613 PolarHBondContact O-N 2.83Å; R609-K613 VanDerWaalsContact O-N 3.1Å
610	N	76.1	Confident	66.9	Low	91 Å²	91	85.9 Å²	85.9	49%	0.487	46%	0.462	S	S	.	.	H	α-helix	trans	-70.5	-42.2	177.6	-67.8	-26.7	0	0	0	111.1	K606 S607 N608 K613 I614	K606-N610 PolarHBondContact O-ND2 3.1Å; S607-N610 WeakPolarHBondContact O-CB 3.43Å; S607-N610 PolarHBondContact O-N 2.99Å; N608-N610 VanDerWaalsContact C-N 3.34Å; N608-N610 PolarHBondContact O-N 3.3Å; N610-K613 PolarHBondContact O-N 3.1Å; N610-I614 WeakPolarHBondContact O-CD1 3.41Å; N610-I614 VanDerWaalsContact O-CG1 3.27Å; N610-I614 WeakPolarHBondContact O-CG1 3.38Å; N610-I614 PolarHBondContact O-N 3.07Å
611	V	78.6	Confident	69.9	Low	21 Å²	21	81.2 Å²	81.2	13%	0.127	43%	0.429	C	S	.	.	H	α-helix	trans	-62.8	-47.8	176.3	175	0	0	0	0	111.1	I576 D580 S607 N608 K613 I614 C615	I576-V611 HydrophobicContact CG2-CG1 3.85Å; I576-V611 HydrophobicContact CG2-CG2 4.44Å; D580-V611 HydrophobicContact CB-CG2 3.76Å; D580-V611 VanDerWaalsContact CG-CG2 3.47Å; S607-V611 PolarHBondContact O-N 3.31Å; S607-V611 VanDerWaalsContact O-N 3.15Å; N608-V611 PolarHBondContact O-N 3.18Å; V611-K613 VanDerWaalsContact C-N 3.28Å; V611-K613 PolarHBondContact O-N 2.88Å; V611-I614 PolarHBondContact O-N 3.26Å; V611-I614 VanDerWaalsContact O-N 3.09Å; V611-C615 PolarHBondContact O-N 2.81Å; V611-C615 PolarHBondContact O-SG 3.02Å
612	A	79.6	Confident	72.9	Confident	61 Å²	61	74.7 Å²	74.7	50%	0.504	39%	0.388	S	S	.	.	H	α-helix	trans	-57.7	-41.6	176.8	0	0	0	0	0	111.9	N608 I614 C615 L616	N608-A612 WeakPolarHBondContact O-CB 3.18Å; N608-A612 PolarHBondContact O-N 2.73Å; A612-I614 PolarHBondContact O-N 2.92Å; A612-C615 PolarHBondContact O-N 3.43Å; A612-L616 VanDerWaalsContact O-CB 3.29Å; A612-L616 WeakPolarHBondContact O-CB 3.49Å; A612-L616 PolarHBondContact O-N 3.07Å
613	K	83.9	Confident	75.7	Confident	79 Å²	79	66.4 Å²	66.4	34%	0.343	35%	0.35	S	S	.	.	H	α-helix	trans	-63	-41	176	-168.4	-176.6	-173.7	-169	0	112.3	R609 N610 V611 H617 N663	R609-K613 WeakPolarHBondContact O-CB 3.33Å; R609-K613 PolarHBondContact O-N 2.83Å; R609-K613 VanDerWaalsContact O-N 3.1Å; N610-K613 PolarHBondContact O-N 3.1Å; V611-K613 VanDerWaalsContact C-N 3.28Å; V611-K613 PolarHBondContact O-N 2.88Å; K613-H617 PolarHBondContact O-N 3.12Å; K613-N663 WeakPolarHBondContact CE-OD1 3.23Å; K613-N663 PolarHBondContact NZ-OD1 2.71Å
614	I	84.3	Confident	78.3	Confident	84 Å²	84	60.7 Å²	60.7	43%	0.431	32%	0.324	S	S	.	.	H	α-helix	trans	-66.4	-49.5	177.4	-66.6	162.3	0	0	0	109.9	I576 N610 V611 A612 L616 H617 L618	I576-I614 HydrophobicContact CD1-CG2 4.06Å; N610-I614 WeakPolarHBondContact O-CD1 3.41Å; N610-I614 VanDerWaalsContact O-CG1 3.27Å; N610-I614 WeakPolarHBondContact O-CG1 3.38Å; N610-I614 PolarHBondContact O-N 3.07Å; V611-I614 PolarHBondContact O-N 3.26Å; V611-I614 VanDerWaalsContact O-N 3.09Å; A612-I614 PolarHBondContact O-N 2.92Å; I614-L616 VanDerWaalsContact C-N 3.29Å; I614-L616 PolarHBondContact O-N 2.71Å; I614-H617 PolarHBondContact O-N 3.47Å; I614-H617 VanDerWaalsContact O-N 3.16Å; I614-L618 HydrophobicContact CG2-CD1 4.01Å; I614-L618 HydrophobicContact CG2-CG 4.33Å; I614-L618 WeakPolarHBondContact O-CG 3.47Å; I614-L618 PolarHBondContact O-N 3.27Å
615	C	86.5	Confident	81.1	Confident	37 Å²	37	57.4 Å²	57.4	25%	0.25	30%	0.302	C	S	.	.	H	α-helix	trans	-60.3	-38.7	178.3	-69.6	0	0	0	0	112.1	V611 A612 L618 S619	V611-C615 PolarHBondContact O-N 2.81Å; V611-C615 PolarHBondContact O-SG 3.02Å; A612-C615 PolarHBondContact O-N 3.43Å; C615-L618 PolarHBondContact O-N 2.03Å; C615-S619 VanDerWaalsContact O-CB 3.23Å; C615-S619 WeakPolarHBondContact O-CB 3.42Å; C615-S619 PolarHBondContact O-N 3.03Å
616	L	88.3	Confident	83.4	Confident	98 Å²	98	52.8 Å²	52.8	51%	0.513	28%	0.277	S	S	.	.	H	α-helix	trans	-63	-45.9	174.4	-178.9	63.1	0	0	0	111.7	A612 I614 L618 S619 I620	A612-L616 VanDerWaalsContact O-CB 3.29Å; A612-L616 WeakPolarHBondContact O-CB 3.49Å; A612-L616 PolarHBondContact O-N 3.07Å; I614-L616 VanDerWaalsContact C-N 3.29Å; I614-L616 PolarHBondContact O-N 2.71Å; L616-L618 VanDerWaalsContact C-N 3.34Å; L616-L618 PolarHBondContact O-N 3.11Å; L616-S619 PolarHBondContact O-N 2.75Å; L616-I620 HydrophobicContact CD1-CD1 3.97Å; L616-I620 HydrophobicContact CD1-CG1 4.42Å; L616-I620 HydrophobicContact CG-CD1 3.96Å; L616-I620 WeakPolarHBondContact O-CD1 3.41Å; L616-I620 VanDerWaalsContact O-CG1 3.32Å; L616-I620 WeakPolarHBondContact O-CG1 3.12Å; L616-I620 PolarHBondContact O-N 2.64Å
617	H	90.4	Very high	85.3	Confident	38 Å²	38	47.8 Å²	47.8	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-42.7	176.3	-178.3	-119	0	0	0	111.9	K613 I614 T621 I659 S660	K613-H617 PolarHBondContact O-N 3.12Å; I614-H617 PolarHBondContact O-N 3.47Å; I614-H617 VanDerWaalsContact O-N 3.16Å; H617-T621 WeakPolarHBondContact O-CB 3.26Å; H617-T621 PolarHBondContact O-N 3.05Å; H617-T621 PolarHBondContact O-OG1 3.31Å; H617-I659 HydrophobicContact CB-CG2 3.91Å; H617-I659 WeakPolarHBondContact CD2-CG2 3.45Å; H617-S660 PolarHBondContact NE2-OG 3.38Å
618	L	91.5	Very high	86.9	Confident	13 Å²	13	49.8 Å²	49.8	7%	0.068	26%	0.26	C	S	.	.	H	α-helix	trans	-64.8	-43.6	176.1	-68.1	178.4	0	0	0	112	L406 L569 V572 I576 I614 C615 L616 I620 T621 L622	L406-L618 HydrophobicContact CD1-CD2 3.58Å; L406-L618 HydrophobicContact CD2-CD2 3.98Å; L406-L618 HydrophobicContact CG-CD2 4.45Å; L569-L618 HydrophobicContact CD1-CB 4.04Å; V572-L618 HydrophobicContact CG1-CD1 3.92Å; I576-L618 HydrophobicContact CD1-CD1 3.61Å; I614-L618 HydrophobicContact CG2-CD1 4.01Å; I614-L618 HydrophobicContact CG2-CG 4.33Å; I614-L618 WeakPolarHBondContact O-CG 3.47Å; I614-L618 PolarHBondContact O-N 3.27Å; C615-L618 PolarHBondContact O-N 2.03Å; L616-L618 VanDerWaalsContact C-N 3.34Å; L616-L618 PolarHBondContact O-N 3.11Å; L618-I620 PolarHBondContact O-N 3.45Å; L618-T621 PolarHBondContact O-N 3.48Å; L618-L622 WeakPolarHBondContact O-CB 3.24Å; L618-L622 VanDerWaalsContact O-CG 3.32Å; L618-L622 WeakPolarHBondContact O-CG 3.1Å; L618-L622 PolarHBondContact O-N 2.87Å
619	S	93.5	Very high	88.1	Confident	32 Å²	32	45.2 Å²	45.2	22%	0.224	24%	0.236	C	C	.	.	H	α-helix	trans	-59	-45.2	178.2	-179.1	0	0	0	0	111.9	C615 L616 G623 A624	C615-S619 VanDerWaalsContact O-CB 3.23Å; C615-S619 WeakPolarHBondContact O-CB 3.42Å; C615-S619 PolarHBondContact O-N 3.03Å; L616-S619 PolarHBondContact O-N 2.75Å; S619-G623 PolarHBondContact O-N 2.76Å; S619-G623 VanDerWaalsContact O-N 3.17Å; S619-A624 WeakPolarHBondContact O-CB 3.33Å; S619-A624 PolarHBondContact O-N 2.92Å; S619-A624 WeakPolarHBondContact OG-CB 3.45Å
620	I	92.9	Very high	89.1	Confident	19 Å²	19	38 Å²	38	10%	0.097	21%	0.21	C	C	.	.	H	α-helix	trans	-67.4	-41.4	176.8	-64.4	163.1	0	0	0	110.8	L616 L618 L622 G623 Q652 A655 L656 I659	L616-I620 HydrophobicContact CD1-CD1 3.97Å; L616-I620 HydrophobicContact CD1-CG1 4.42Å; L616-I620 HydrophobicContact CG-CD1 3.96Å; L616-I620 WeakPolarHBondContact O-CD1 3.41Å; L616-I620 VanDerWaalsContact O-CG1 3.32Å; L616-I620 WeakPolarHBondContact O-CG1 3.12Å; L616-I620 PolarHBondContact O-N 2.64Å; L618-I620 PolarHBondContact O-N 3.45Å; I620-L622 PolarHBondContact O-N 2.79Å; I620-G623 PolarHBondContact O-N 2.04Å; I620-Q652 HydrophobicContact CG2-CG 4.14Å; I620-Q652 PolarHBondContact O-NE2 3.24Å; I620-A655 HydrophobicContact CD1-CB 4.17Å; I620-A655 HydrophobicContact CG2-CB 3.96Å; I620-L656 HydrophobicContact CG2-CD2 3.72Å; I620-L656 HydrophobicContact CG2-CG 3.78Å; I620-I659 HydrophobicContact CD1-CD1 3.31Å
621	T	92.5	Very high	89.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-68.3	-32.6	179.9	-52.1	0	0	0	0	113.1	L349 L352 M399 H402 H617 L618 L656	L349-T621 HydrophobicContact CD1-CG2 4.42Å; L352-T621 HydrophobicContact CD2-CG2 4.11Å; M399-T621 WeakPolarHBondContact CG-O 3.34Å; H402-T621 WeakPolarHBondContact ND1-CG2 3.34Å; H617-T621 WeakPolarHBondContact O-CB 3.26Å; H617-T621 PolarHBondContact O-N 3.05Å; H617-T621 PolarHBondContact O-OG1 3.31Å; L618-T621 PolarHBondContact O-N 3.48Å; T621-L656 HydrophobicContact CG2-CD2 4.48Å; T621-L656 WeakPolarHBondContact OG1-CD2 3.32Å
622	L	93.8	Very high	90.2	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-89.5	-1.8	178.7	-63.6	-179	0	0	0	113.5	M399 L406 N565 I568 L569 L618 I620	M399-L622 WeakPolarHBondContact O-CD2 3.39Å; L406-L622 HydrophobicContact CD1-CD1 4.23Å; L406-L622 HydrophobicContact CD1-CD2 4.26Å; L406-L622 HydrophobicContact CD1-CG 4.49Å; N565-L622 HydrophobicContact CB-CB 4.4Å; N565-L622 WeakPolarHBondContact CB-O 3.46Å; N565-L622 PolarHBondContact ND2-O 2.88Å; I568-L622 HydrophobicContact CG2-CD1 4.09Å; L569-L622 HydrophobicContact CB-CD1 3.91Å; L569-L622 HydrophobicContact CD1-CD1 4.08Å; L618-L622 WeakPolarHBondContact O-CB 3.24Å; L618-L622 VanDerWaalsContact O-CG 3.32Å; L618-L622 WeakPolarHBondContact O-CG 3.1Å; L618-L622 PolarHBondContact O-N 2.87Å; I620-L622 PolarHBondContact O-N 2.79Å
623	G	92.6	Very high	90.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	84	32.1	170.3	0	0	0	0	0	115.1	M399 S619 I620 V625 W626	M399-G623 WeakPolarHBondContact SD-CA 3.36Å; S619-G623 PolarHBondContact O-N 2.76Å; S619-G623 VanDerWaalsContact O-N 3.17Å; I620-G623 PolarHBondContact O-N 2.04Å; G623-V625 PolarHBondContact O-N 3.1Å; G623-V625 VanDerWaalsContact O-N 3.13Å; G623-W626 WeakPolarHBondContact O-CB 3.21Å; G623-W626 PolarHBondContact O-N 3.01Å
624	A	92.6	Very high	90.4	Very high	26 Å²	26	36.5 Å²	36.5	22%	0.215	20%	0.197	C	C	.	.	H	α-helix	trans	-56.6	-29.9	176.9	0	0	0	0	0	113.2	L569 S619 W626 I627 F628	L569-A624 HydrophobicContact CD2-CB 4.38Å; S619-A624 WeakPolarHBondContact O-CB 3.33Å; S619-A624 PolarHBondContact O-N 2.92Å; S619-A624 WeakPolarHBondContact OG-CB 3.45Å; A624-W626 PolarHBondContact O-N 3.31Å; A624-I627 WeakPolarHBondContact O-CB 3.04Å; A624-I627 PolarHBondContact O-N 3.12Å; A624-I627 VanDerWaalsContact O-N 3.1Å; A624-F628 PolarHBondContact O-N 3.13Å
625	V	94.1	Very high	90.4	Very high	28 Å²	28	37.1 Å²	37.1	17%	0.17	20%	0.2	C	C	.	.	H	α-helix	trans	-59.7	-29.3	174.9	-62.9	0	0	0	0	113.4	G623 I627 F628 Q629 V648 Q652	G623-V625 PolarHBondContact O-N 3.1Å; G623-V625 VanDerWaalsContact O-N 3.13Å; V625-I627 VanDerWaalsContact C-N 3.34Å; V625-F628 WeakPolarHBondContact O-CB 3.06Å; V625-F628 PolarHBondContact O-N 3.37Å; V625-Q629 PolarHBondContact O-N 3.19Å; V625-Q629 VanDerWaalsContact O-N 3.11Å; V625-V648 HydrophobicContact CB-CG1 4.15Å; V625-V648 HydrophobicContact CG1-CG1 3.88Å; V625-Q652 HydrophobicContact CG2-CB 4.05Å; V625-Q652 HydrophobicContact CG2-CG 3.95Å
626	W	93.5	Very high	89.5	Confident	3 Å²	3	38 Å²	38	1%	0.011	21%	0.206	C	C	.	.	H	α-helix	trans	-75.6	-24.3	177.7	-67.9	100.4	0	0	0	112.6	W277 L281 M356 F392 F396 L562 G623 A624 F628 Q629 L630	W277-W626 HydrophobicContact CZ2-CH2 4.24Å; L281-W626 HydrophobicContact CD1-CE3 3.88Å; L281-W626 HydrophobicContact CD1-CZ3 4.16Å; M356-W626 HydrophobicContact CE-CZ2 4.14Å; F392-W626 HydrophobicContact CE1-CE3 4.34Å; F392-W626 HydrophobicContact CE1-CH2 4.09Å; F392-W626 AromaticContact CE1-CZ3 3.82Å; F392-W626 HydrophobicContact CE1-CZ3 3.82Å; F392-W626 HydrophobicContact CE2-CH2 4.03Å; F392-W626 HydrophobicContact CE2-CZ3 4.15Å; F392-W626 HydrophobicContact CZ-CE3 4.2Å; F392-W626 AromaticContact CZ-CH2 3.56Å; F392-W626 HydrophobicContact CZ-CH2 3.56Å; F392-W626 AromaticContact CZ-CZ3 3.3Å; F392-W626 HydrophobicContact CZ-CZ3 3.3Å; F396-W626 HydrophobicContact CE1-CB 3.81Å; F396-W626 AromaticContact CE1-CD1 3.95Å; F396-W626 AromaticContact CE1-CD2 3.91Å; F396-W626 HydrophobicContact CE1-CD2 3.91Å; F396-W626 HydrophobicContact CE1-CE3 4.48Å; F396-W626 AromaticContact CE1-CG 3.61Å; F396-W626 HydrophobicContact CE1-CG 3.61Å; F396-W626 HydrophobicContact CZ-CB 4.27Å; F396-W626 AromaticContact CZ-CD2 3.81Å; F396-W626 HydrophobicContact CZ-CD2 3.81Å; F396-W626 AromaticContact CZ-CE3 3.95Å; F396-W626 HydrophobicContact CZ-CE3 3.95Å; F396-W626 AromaticContact CZ-CG 3.98Å; F396-W626 HydrophobicContact CZ-CG 3.98Å; L562-W626 HydrophobicContact CD1-CB 4.02Å; L562-W626 HydrophobicContact CD2-CB 3.81Å; G623-W626 WeakPolarHBondContact O-CB 3.21Å; G623-W626 PolarHBondContact O-N 3.01Å; A624-W626 PolarHBondContact O-N 3.31Å; W626-F628 VanDerWaalsContact C-N 3.34Å; W626-Q629 HydrophobicContact CE3-CB 4.5Å; W626-Q629 PolarHBondContact O-N 2.85Å; W626-L630 WeakPolarHBondContact O-CB 3.44Å; W626-L630 PolarHBondContact O-N 3.44Å
627	I	92.6	Very high	88.6	Confident	53 Å²	53	42.1 Å²	42.1	27%	0.272	22%	0.223	S	C	.	.	H	α-helix	trans	-66.5	-43.4	171.5	-54.9	169	0	0	0	108.9	L562 S566 A624 V625 Q629 L630 L631	L562-I627 HydrophobicContact CD2-CG1 4.43Å; S566-I627 WeakPolarHBondContact OG-CD1 3.4Å; A624-I627 WeakPolarHBondContact O-CB 3.04Å; A624-I627 PolarHBondContact O-N 3.12Å; A624-I627 VanDerWaalsContact O-N 3.1Å; V625-I627 VanDerWaalsContact C-N 3.34Å; I627-Q629 VanDerWaalsContact C-N 3.33Å; I627-Q629 PolarHBondContact O-N 3.25Å; I627-L630 PolarHBondContact O-N 3.47Å; I627-L631 HydrophobicContact CG2-CD1 4.03Å; I627-L631 HydrophobicContact CG2-CG 4.34Å; I627-L631 WeakPolarHBondContact O-CB 3.49Å; I627-L631 VanDerWaalsContact O-CG 3.28Å; I627-L631 WeakPolarHBondContact O-CG 3.43Å; I627-L631 PolarHBondContact O-N 3.37Å
628	F	91.5	Very high	87.9	Confident	85 Å²	85	45.7 Å²	45.7	37%	0.373	24%	0.239	S	C	.	.	H	α-helix	trans	-60.6	-43.4	174.6	-179	-119.1	0	0	0	111.5	A624 V625 W626 L631 A632 L641 A645 V648	A624-F628 PolarHBondContact O-N 3.13Å; V625-F628 WeakPolarHBondContact O-CB 3.06Å; V625-F628 PolarHBondContact O-N 3.37Å; W626-F628 VanDerWaalsContact C-N 3.34Å; F628-L631 PolarHBondContact O-N 3.34Å; F628-A632 VanDerWaalsContact O-CB 3.28Å; F628-A632 WeakPolarHBondContact O-CB 3.06Å; F628-A632 PolarHBondContact O-N 3.43Å; F628-L641 HydrophobicContact CE2-CD1 4.25Å; F628-L641 HydrophobicContact CZ-CD1 3.89Å; F628-A645 HydrophobicContact CD1-CB 3.56Å; F628-A645 HydrophobicContact CE1-CB 3.49Å; F628-A645 VanDerWaalsContact CE1-CB 3.49Å; F628-A645 HydrophobicContact CG-CB 4.38Å; F628-A645 HydrophobicContact CZ-CB 4.25Å; F628-V648 HydrophobicContact CE1-CG2 4.45Å
629	Q	91.4	Very high	87	Confident	3 Å²	3	47.3 Å²	47.3	1%	0.014	25%	0.25	C	C	.	.	H	α-helix	trans	-60.1	-46.7	173.2	-177.1	61.4	32.8	0	0	112.9	L281 V625 W626 I627 A632 S633 A645	L281-Q629 HydrophobicContact CB-CG 4.34Å; L281-Q629 HydrophobicContact CD1-CB 4.09Å; L281-Q629 HydrophobicContact CD1-CG 3.4Å; L281-Q629 VanDerWaalsContact CD1-CG 3.4Å; L281-Q629 HydrophobicContact CG-CG 4.45Å; V625-Q629 PolarHBondContact O-N 3.19Å; V625-Q629 VanDerWaalsContact O-N 3.11Å; W626-Q629 HydrophobicContact CE3-CB 4.5Å; W626-Q629 PolarHBondContact O-N 2.85Å; I627-Q629 VanDerWaalsContact C-N 3.33Å; I627-Q629 PolarHBondContact O-N 3.25Å; Q629-A632 PolarHBondContact O-N 3.34Å; Q629-S633 PolarHBondContact NE2-OG 3.25Å; Q629-S633 WeakPolarHBondContact O-CB 3.36Å; Q629-S633 PolarHBondContact O-N 3.25Å; Q629-S633 PolarHBondContact O-OG 3.45Å; Q629-A645 HydrophobicContact CB-CB 4.45Å; Q629-A645 PolarHBondContact OE1-O 3.16Å; Q629-A645 VanDerWaalsContact OE1-O 3.1Å
630	L	90.6	Very high	86.4	Confident	24 Å²	24	49.3 Å²	49.3	13%	0.126	26%	0.257	C	S	.	.	H	α-helix	trans	-61.9	-47.4	-179.5	-178.1	65.2	0	0	0	110.8	L281 L555 T559 L562 W626 I627 A632 S633 L634	L281-L630 HydrophobicContact CD2-CD1 4.3Å; L555-L630 HydrophobicContact CD1-CD1 3.75Å; T559-L630 HydrophobicContact CG2-CD2 4.32Å; L562-L630 HydrophobicContact CD1-CD2 4.43Å; W626-L630 WeakPolarHBondContact O-CB 3.44Å; W626-L630 PolarHBondContact O-N 3.44Å; I627-L630 PolarHBondContact O-N 3.47Å; L630-A632 PolarHBondContact O-N 3.27Å; L630-S633 PolarHBondContact O-N 3.06Å; L630-S633 VanDerWaalsContact O-N 3.15Å; L630-L634 WeakPolarHBondContact O-CG 3.48Å; L630-L634 PolarHBondContact O-N 3.32Å; L630-L634 VanDerWaalsContact O-N 3.12Å
631	L	90.6	Very high	86.1	Confident	100 Å²	100	51.2 Å²	51.2	52%	0.524	27%	0.267	S	S	.	.	H	α-helix	trans	-62.7	-41.4	177	-69.1	174.5	0	0	0	112.2	I627 F628 S633 L634	I627-L631 HydrophobicContact CG2-CD1 4.03Å; I627-L631 HydrophobicContact CG2-CG 4.34Å; I627-L631 WeakPolarHBondContact O-CB 3.49Å; I627-L631 VanDerWaalsContact O-CG 3.28Å; I627-L631 WeakPolarHBondContact O-CG 3.43Å; I627-L631 PolarHBondContact O-N 3.37Å; F628-L631 PolarHBondContact O-N 3.34Å; L631-S633 VanDerWaalsContact C-N 3.27Å; L631-S633 PolarHBondContact O-N 3.43Å; L631-L634 HydrophobicContact CD2-CD1 4.48Å; L631-L634 PolarHBondContact O-N 3Å
632	A	88.6	Confident	85.6	Confident	2 Å²	2	51.7 Å²	51.7	2%	0.017	27%	0.27	C	S	.	.	H	α-helix	trans	-63.5	-34.8	174.9	0	0	0	0	0	112.1	F628 Q629 L630 L634 L635 L641 A645	F628-A632 VanDerWaalsContact O-CB 3.28Å; F628-A632 WeakPolarHBondContact O-CB 3.06Å; F628-A632 PolarHBondContact O-N 3.43Å; Q629-A632 PolarHBondContact O-N 3.34Å; L630-A632 PolarHBondContact O-N 3.27Å; A632-L634 VanDerWaalsContact C-N 3.33Å; A632-L635 PolarHBondContact O-N 3.14Å; A632-L641 HydrophobicContact CB-CD2 4.3Å; A632-L641 HydrophobicContact CB-CG 3.9Å; A632-A645 HydrophobicContact CB-CB 3.63Å
633	S	83.4	Confident	85.2	Confident	10 Å²	10	52.4 Å²	52.4	7%	0.07	27%	0.273	C	S	.	.	H	α-helix	trans	-74.3	-22.2	179.4	-53	0	0	0	0	113.1	L281 Q629 L630 L631 L635	L281-S633 VanDerWaalsContact O-CB 3.3Å; L281-S633 WeakPolarHBondContact O-CB 3.32Å; Q629-S633 PolarHBondContact NE2-OG 3.25Å; Q629-S633 WeakPolarHBondContact O-CB 3.36Å; Q629-S633 PolarHBondContact O-N 3.25Å; Q629-S633 PolarHBondContact O-OG 3.45Å; L630-S633 PolarHBondContact O-N 3.06Å; L630-S633 VanDerWaalsContact O-N 3.15Å; L631-S633 VanDerWaalsContact C-N 3.27Å; L631-S633 PolarHBondContact O-N 3.43Å; S633-L635 PolarHBondContact O-N 2.95Å
634	L	84.1	Confident	85	Confident	109 Å²	109	55.1 Å²	55.1	57%	0.571	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-8.6	173.7	-68.3	172.2	0	0	0	113.3	L630 L631 A632 P636	L630-L634 WeakPolarHBondContact O-CG 3.48Å; L630-L634 PolarHBondContact O-N 3.32Å; L630-L634 VanDerWaalsContact O-N 3.12Å; L631-L634 HydrophobicContact CD2-CD1 4.48Å; L631-L634 PolarHBondContact O-N 3Å; A632-L634 VanDerWaalsContact C-N 3.33Å; L634-P636 VanDerWaalsContact C-CD 3.44Å; L634-P636 WeakPolarHBondContact O-CD 3.45Å
635	L	82.5	Confident	85	Confident	96 Å²	96	53.9 Å²	53.9	50%	0.503	28%	0.279	S	S	.	.			trans	-111.6	74.2	179.8	-62.8	174.5	0	0	0	110.2	A632 S633 Q637 Q638 L641	A632-L635 PolarHBondContact O-N 3.14Å; S633-L635 PolarHBondContact O-N 2.95Å; L635-Q637 PolarHBondContact O-N 3.38Å; L635-Q637 VanDerWaalsContact O-N 3.07Å; L635-Q638 PolarHBondContact O-N 3.16Å; L635-Q638 VanDerWaalsContact O-N 3.1Å; L635-L641 HydrophobicContact CD1-CD2 4.14Å
636	P	67.8	Low	84.7	Confident	56 Å²	56	52.7 Å²	52.7	36%	0.364	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.3	-173.6	24.8	-34.5	0	0	0	113.4	F290 L634 Q638	F290-P636 WeakPolarHBondContact CZ-O 3.39Å; L634-P636 VanDerWaalsContact C-CD 3.44Å; L634-P636 WeakPolarHBondContact O-CD 3.45Å; P636-Q638 PolarHBondContact O-N 3Å; P636-Q638 VanDerWaalsContact O-N 3.16Å
637	Q	69.6	Low	84.6	Confident	185 Å²	185	54.2 Å²	54.2	86%	0.864	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-14.5	177.9	-66.3	178.8	-7	0	0	114	L635	L635-Q637 PolarHBondContact O-N 3.38Å; L635-Q637 VanDerWaalsContact O-N 3.07Å
638	Q	75.8	Confident	84.6	Confident	112 Å²	112	54.7 Å²	54.7	52%	0.523	29%	0.286	S	S	.	.			trans	-119.6	75.3	-174.6	-64.2	-71	-12.4	0	0	111.4	L635 P636 I640 L641 S642	L635-Q638 PolarHBondContact O-N 3.16Å; L635-Q638 VanDerWaalsContact O-N 3.1Å; P636-Q638 PolarHBondContact O-N 3Å; P636-Q638 VanDerWaalsContact O-N 3.16Å; Q638-I640 VanDerWaalsContact C-N 3.28Å; Q638-I640 PolarHBondContact O-N 3.31Å; Q638-L641 HydrophobicContact CB-CB 3.87Å; Q638-L641 HydrophobicContact CB-CD2 4.49Å; Q638-L641 WeakPolarHBondContact O-CB 3.36Å; Q638-L641 PolarHBondContact O-N 3.43Å; Q638-L641 VanDerWaalsContact O-N 3.09Å; Q638-S642 PolarHBondContact O-N 2.95Å
639	T	72.4	Confident	84.7	Confident	48 Å²	48	50.8 Å²	50.8	29%	0.294	27%	0.269	S	S	.	.	H	α-helix	trans	-57.8	-38.5	-178.5	57.3	0	0	0	0	113.1	F290 L641 S642 R643	F290-T639 HydrophobicContact CD1-CG2 4.38Å; F290-T639 HydrophobicContact CE1-CG2 3.42Å; F290-T639 VanDerWaalsContact CE1-CG2 3.42Å; F290-T639 HydrophobicContact CE2-CG2 4.32Å; F290-T639 HydrophobicContact CZ-CG2 3.41Å; F290-T639 VanDerWaalsContact CZ-CG2 3.41Å; T639-L641 VanDerWaalsContact C-N 3.32Å; T639-L641 PolarHBondContact O-N 3.49Å; T639-S642 PolarHBondContact O-N 3.12Å; T639-R643 WeakPolarHBondContact O-CG 3.32Å; T639-R643 PolarHBondContact O-N 3Å; T639-R643 VanDerWaalsContact O-N 3.13Å
640	I	81.5	Confident	84.7	Confident	74 Å²	74	50.8 Å²	50.8	38%	0.379	27%	0.269	S	S	.	.	H	α-helix	trans	-62.6	-40.7	178	-60.1	174.1	0	0	0	110.7	Q638 S642 R643 V644	Q638-I640 VanDerWaalsContact C-N 3.28Å; Q638-I640 PolarHBondContact O-N 3.31Å; I640-S642 PolarHBondContact O-N 2.92Å; I640-R643 PolarHBondContact O-N 2.96Å; I640-V644 HydrophobicContact CG2-CG2 4.16Å; I640-V644 VanDerWaalsContact O-CG2 3.3Å; I640-V644 WeakPolarHBondContact O-CG2 3.4Å; I640-V644 PolarHBondContact O-N 3.19Å
641	L	85.9	Confident	84.9	Confident	58 Å²	58	50.5 Å²	50.5	30%	0.304	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-43.6	-179.2	-176.8	64.2	0	0	0	111.2	F628 A632 L635 Q638 T639 R643 V644 A645	F628-L641 HydrophobicContact CE2-CD1 4.25Å; F628-L641 HydrophobicContact CZ-CD1 3.89Å; A632-L641 HydrophobicContact CB-CD2 4.3Å; A632-L641 HydrophobicContact CB-CG 3.9Å; L635-L641 HydrophobicContact CD1-CD2 4.14Å; Q638-L641 HydrophobicContact CB-CB 3.87Å; Q638-L641 HydrophobicContact CB-CD2 4.49Å; Q638-L641 WeakPolarHBondContact O-CB 3.36Å; Q638-L641 PolarHBondContact O-N 3.43Å; Q638-L641 VanDerWaalsContact O-N 3.09Å; T639-L641 VanDerWaalsContact C-N 3.32Å; T639-L641 PolarHBondContact O-N 3.49Å; L641-R643 VanDerWaalsContact C-N 3.32Å; L641-R643 PolarHBondContact O-N 3.09Å; L641-V644 PolarHBondContact O-N 3.17Å; L641-A645 WeakPolarHBondContact O-CB 3.48Å; L641-A645 PolarHBondContact O-N 2.61Å
642	S	83.1	Confident	85.1	Confident	10 Å²	10	45.9 Å²	45.9	7%	0.07	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-39.7	176.2	-175.5	0	0	0	0	112.1	Q638 T639 I640 A645 A646	Q638-S642 PolarHBondContact O-N 2.95Å; T639-S642 PolarHBondContact O-N 3.12Å; I640-S642 PolarHBondContact O-N 2.92Å; S642-A645 PolarHBondContact O-N 3.05Å; S642-A646 WeakPolarHBondContact O-CB 3.35Å; S642-A646 PolarHBondContact O-N 3.46Å
643	R	84.9	Confident	85.4	Confident	19 Å²	19	45.9 Å²	45.9	7%	0.072	25%	0.248	C	C	.	.	H	α-helix	trans	-68.3	-41.3	175.3	-69.7	178.3	178.7	-109.6	17.2	113	E309 L312 D313 T639 I640 L641 A646 L647	E309-R643 IonicContact OE1-CZ 3.65Å; E309-R643 IonicContact OE1-NE 2.73Å; E309-R643 PolarHBondContact OE1-NE 3.44Å; E309-R643 IonicContact OE1-NH2 2.78Å; E309-R643 PolarHBondContact OE1-NH2 3.37Å; E309-R643 IonicContact OE2-NH2 2.81Å; E309-R643 PolarHBondContact OE2-NH2 2.73Å; L312-R643 HydrophobicContact CD1-CB 3.98Å; D313-R643 IonicContact OD1-NH1 3.19Å; D313-R643 PolarHBondContact OD1-NH1 3.03Å; D313-R643 IonicContact OD2-NH1 3.55Å; D313-R643 PolarHBondContact OD2-NH1 3.44Å; T639-R643 WeakPolarHBondContact O-CG 3.32Å; T639-R643 PolarHBondContact O-N 3Å; T639-R643 VanDerWaalsContact O-N 3.13Å; I640-R643 PolarHBondContact O-N 2.96Å; L641-R643 VanDerWaalsContact C-N 3.32Å; L641-R643 PolarHBondContact O-N 3.09Å; R643-A646 WeakPolarHBondContact O-CB 3.34Å; R643-A646 PolarHBondContact O-N 3.37Å; R643-L647 PolarHBondContact O-N 3.31Å
644	V	89.3	Confident	86	Confident	56 Å²	56	45.8 Å²	45.8	34%	0.339	25%	0.248	S	C	.	.	H	α-helix	trans	-64.9	-41.9	175.5	169.9	0	0	0	0	110.6	I640 L641 A646 L647 V648	I640-V644 HydrophobicContact CG2-CG2 4.16Å; I640-V644 VanDerWaalsContact O-CG2 3.3Å; I640-V644 WeakPolarHBondContact O-CG2 3.4Å; I640-V644 PolarHBondContact O-N 3.19Å; L641-V644 PolarHBondContact O-N 3.17Å; V644-A646 VanDerWaalsContact C-N 3.26Å; V644-A646 PolarHBondContact O-N 3.44Å; V644-L647 WeakPolarHBondContact O-CB 3.24Å; V644-L647 PolarHBondContact O-N 2.94Å; V644-V648 WeakPolarHBondContact O-CG2 3.42Å; V644-V648 PolarHBondContact O-N 3.36Å
645	A	90.9	Very high	86.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.5	-35.6	174.4	0	0	0	0	0	111.6	F628 Q629 A632 L641 S642 L647 V648 S649	F628-A645 HydrophobicContact CD1-CB 3.56Å; F628-A645 HydrophobicContact CE1-CB 3.49Å; F628-A645 VanDerWaalsContact CE1-CB 3.49Å; F628-A645 HydrophobicContact CG-CB 4.38Å; F628-A645 HydrophobicContact CZ-CB 4.25Å; Q629-A645 HydrophobicContact CB-CB 4.45Å; Q629-A645 PolarHBondContact OE1-O 3.16Å; Q629-A645 VanDerWaalsContact OE1-O 3.1Å; A632-A645 HydrophobicContact CB-CB 3.63Å; L641-A645 WeakPolarHBondContact O-CB 3.48Å; L641-A645 PolarHBondContact O-N 2.61Å; S642-A645 PolarHBondContact O-N 3.05Å; A645-L647 PolarHBondContact O-N 3.03Å; A645-V648 PolarHBondContact O-N 3.04Å; A645-V648 VanDerWaalsContact O-N 3.16Å; A645-S649 PolarHBondContact O-N 2.04Å; A645-S649 PolarHBondContact O-OG 3.03Å; A645-S649 VanDerWaalsContact O-OG 3.14Å
646	A	87.9	Confident	87	Confident	3 Å²	3	37.6 Å²	37.6	3%	0.025	21%	0.209	C	C	.	.	H	α-helix	trans	-67	-33	178.9	0	0	0	0	0	111.1	H278 Q316 S642 R643 V644 S649 S650	H278-A646 HydrophobicContact CB-CB 3.58Å; Q316-A646 PolarHBondContact NE2-O 3.43Å; Q316-A646 PolarHBondContact OE1-O 2.95Å; S642-A646 WeakPolarHBondContact O-CB 3.35Å; S642-A646 PolarHBondContact O-N 3.46Å; R643-A646 WeakPolarHBondContact O-CB 3.34Å; R643-A646 PolarHBondContact O-N 3.37Å; V644-A646 VanDerWaalsContact C-N 3.26Å; V644-A646 PolarHBondContact O-N 3.44Å; A646-S649 WeakPolarHBondContact CA-OG 3.3Å; A646-S649 PolarHBondContact O-OG 2.79Å; A646-S650 WeakPolarHBondContact O-CB 3.47Å; A646-S650 PolarHBondContact O-N 2.91Å; A646-S650 PolarHBondContact O-OG 3.38Å
647	L	91.6	Very high	88.2	Confident	35 Å²	35	34.9 Å²	34.9	18%	0.183	19%	0.192	C	C	.	.	H	α-helix	trans	-66.9	-41.9	171	-171	69.3	0	0	0	113.5	L315 Q316 V319 R643 V644 A645 S650 G651	L315-L647 HydrophobicContact CB-CD1 4.36Å; L315-L647 HydrophobicContact CD2-CD1 4.3Å; L315-L647 HydrophobicContact CD2-CD2 3.55Å; L315-L647 HydrophobicContact CG-CD1 3.89Å; L315-L647 HydrophobicContact CG-CD2 4.09Å; Q316-L647 HydrophobicContact CB-CD1 4.3Å; V319-L647 HydrophobicContact CB-CD1 4.21Å; V319-L647 HydrophobicContact CG2-CD1 3.86Å; R643-L647 PolarHBondContact O-N 3.31Å; V644-L647 WeakPolarHBondContact O-CB 3.24Å; V644-L647 PolarHBondContact O-N 2.94Å; A645-L647 PolarHBondContact O-N 3.03Å; L647-S650 PolarHBondContact O-OG 3.43Å; L647-G651 PolarHBondContact O-N 3.13Å
648	V	93.1	Very high	89.3	Confident	64 Å²	64	31.4 Å²	31.4	39%	0.388	17%	0.174	S	C	.	.	H	α-helix	trans	-67.5	-41.6	176.8	175.5	0	0	0	0	111	V625 F628 V644 A645 G651	V625-V648 HydrophobicContact CB-CG1 4.15Å; V625-V648 HydrophobicContact CG1-CG1 3.88Å; F628-V648 HydrophobicContact CE1-CG2 4.45Å; V644-V648 WeakPolarHBondContact O-CG2 3.42Å; V644-V648 PolarHBondContact O-N 3.36Å; A645-V648 PolarHBondContact O-N 3.04Å; A645-V648 VanDerWaalsContact O-N 3.16Å; V648-G651 PolarHBondContact O-N 3.05Å
649	S	93.5	Very high	90	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-69.8	-38.5	-179.8	58.1	0	0	0	0	112.7	A645 A646 G651 Q652	A645-S649 PolarHBondContact O-N 2.04Å; A645-S649 PolarHBondContact O-OG 3.03Å; A645-S649 VanDerWaalsContact O-OG 3.14Å; A646-S649 WeakPolarHBondContact CA-OG 3.3Å; A646-S649 PolarHBondContact O-OG 2.79Å; S649-G651 PolarHBondContact O-N 3.22Å; S649-Q652 VanDerWaalsContact O-CB 3.24Å; S649-Q652 WeakPolarHBondContact O-CB 2.89Å; S649-Q652 PolarHBondContact O-N 2.73Å; S649-Q652 VanDerWaalsContact O-N 3.11Å
650	S	92.7	Very high	90.8	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.021	14%	0.143	C	C	.	.	H	α-helix	trans	-64.9	-28	174.3	63.1	0	0	0	0	113.4	Q316 V319 S323 A646 L647 Q652	Q316-S650 VanDerWaalsContact CD-OG 3.29Å; Q316-S650 PolarHBondContact NE2-OG 3.2Å; Q316-S650 PolarHBondContact OE1-OG 3.27Å; V319-S650 WeakPolarHBondContact CG1-OG 3.34Å; S323-S650 WeakPolarHBondContact CB-O 3.31Å; S323-S650 PolarHBondContact OG-O 2.84Å; A646-S650 WeakPolarHBondContact O-CB 3.47Å; A646-S650 PolarHBondContact O-N 2.91Å; A646-S650 PolarHBondContact O-OG 3.38Å; L647-S650 PolarHBondContact O-OG 3.43Å; S650-Q652 VanDerWaalsContact C-N 3.27Å; S650-Q652 PolarHBondContact O-N 3.44Å
651	G	94.2	Very high	91.2	Very high	17 Å²	17	23.1 Å²	23.1	18%	0.175	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.4	173.7	0	0	0	0	0	115.2	V319 L647 V648 S649 G653 A654 A655	V319-G651 VanDerWaalsContact CG1-CA 3.42Å; L647-G651 PolarHBondContact O-N 3.13Å; V648-G651 PolarHBondContact O-N 3.05Å; S649-G651 PolarHBondContact O-N 3.22Å; G651-G653 VanDerWaalsContact C-N 3.3Å; G651-G653 PolarHBondContact O-N 3.24Å; G651-A654 PolarHBondContact O-N 3.49Å; G651-A655 PolarHBondContact O-N 2.61Å
652	Q	94.9	Very high	91.1	Very high	3 Å²	3	23.5 Å²	23.5	1%	0.014	14%	0.137	C	C	.	.	H	α-helix	trans	-58.5	-42.3	-178.7	-168.8	-168.5	11.2	0	0	111.9	M399 I620 V625 S649 S650 A655 L656	M399-Q652 PolarHBondContact SD-NE2 2.88Å; M399-Q652 VanDerWaalsContact SD-NE2 3.41Å; I620-Q652 HydrophobicContact CG2-CG 4.14Å; I620-Q652 PolarHBondContact O-NE2 3.24Å; V625-Q652 HydrophobicContact CG2-CB 4.05Å; V625-Q652 HydrophobicContact CG2-CG 3.95Å; S649-Q652 VanDerWaalsContact O-CB 3.24Å; S649-Q652 WeakPolarHBondContact O-CB 2.89Å; S649-Q652 PolarHBondContact O-N 2.73Å; S649-Q652 VanDerWaalsContact O-N 3.11Å; S650-Q652 VanDerWaalsContact C-N 3.27Å; S650-Q652 PolarHBondContact O-N 3.44Å; Q652-A655 PolarHBondContact O-N 3.31Å; Q652-L656 HydrophobicContact CG-CD1 4.08Å; Q652-L656 HydrophobicContact CG-CG 4.38Å; Q652-L656 WeakPolarHBondContact O-CB 3.33Å; Q652-L656 VanDerWaalsContact O-CG 3.3Å; Q652-L656 WeakPolarHBondContact O-CG 3.27Å; Q652-L656 PolarHBondContact O-N 3.11Å
653	G	94.9	Very high	90.7	Very high	2 Å²	2	25.9 Å²	25.9	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-59.7	-48.8	179.1	0	0	0	0	0	112.3	S326 G651 L656 G657	S326-G653 PolarHBondContact OG-O 2.62Å; G651-G653 VanDerWaalsContact C-N 3.3Å; G651-G653 PolarHBondContact O-N 3.24Å; G653-L656 PolarHBondContact O-N 2.94Å; G653-G657 PolarHBondContact O-N 3.32Å
654	A	95.4	Very high	90	Very high	9 Å²	9	25.2 Å²	25.2	7%	0.074	15%	0.147	C	C	.	.	H	α-helix	trans	-54.5	-52.8	172.8	0	0	0	0	0	111.6	L322 S323 S326 G651 L656 G657 F658	L322-A654 HydrophobicContact CG-CB 4.34Å; S323-A654 WeakPolarHBondContact OG-CB 3.13Å; S323-A654 PolarHBondContact OG-N 3.35Å; S326-A654 WeakPolarHBondContact OG-CA 3.44Å; S326-A654 PolarHBondContact OG-N 3.43Å; G651-A654 PolarHBondContact O-N 3.49Å; A654-L656 VanDerWaalsContact C-N 3.34Å; A654-L656 PolarHBondContact O-N 2.8Å; A654-G657 PolarHBondContact O-N 3.16Å; A654-F658 HydrophobicContact CB-CD2 4.25Å; A654-F658 HydrophobicContact CB-CE2 4.15Å; A654-F658 WeakPolarHBondContact O-CD2 3.21Å; A654-F658 PolarHBondContact O-N 2.99Å
655	A	94.8	Very high	88.4	Confident	31 Å²	31	25.8 Å²	25.8	26%	0.256	15%	0.151	S	C	.	.	H	α-helix	trans	-60.2	-42.5	-179.3	0	0	0	0	0	112.2	I620 G651 Q652 I659	I620-A655 HydrophobicContact CD1-CB 4.17Å; I620-A655 HydrophobicContact CG2-CB 3.96Å; G651-A655 PolarHBondContact O-N 2.61Å; Q652-A655 PolarHBondContact O-N 3.31Å; A655-I659 WeakPolarHBondContact O-CB 3.4Å; A655-I659 WeakPolarHBondContact O-CD1 3.27Å; A655-I659 WeakPolarHBondContact O-CG1 3.04Å; A655-I659 PolarHBondContact O-N 3.18Å
656	L	93.8	Very high	86.7	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-61.3	-47.8	175.1	-75.3	172.6	0	0	0	112.1	L352 I620 T621 Q652 G653 A654 S660	L352-L656 HydrophobicContact CD2-CD1 4.2Å; I620-L656 HydrophobicContact CG2-CD2 3.72Å; I620-L656 HydrophobicContact CG2-CG 3.78Å; T621-L656 HydrophobicContact CG2-CD2 4.48Å; T621-L656 WeakPolarHBondContact OG1-CD2 3.32Å; Q652-L656 HydrophobicContact CG-CD1 4.08Å; Q652-L656 HydrophobicContact CG-CG 4.38Å; Q652-L656 WeakPolarHBondContact O-CB 3.33Å; Q652-L656 VanDerWaalsContact O-CG 3.3Å; Q652-L656 WeakPolarHBondContact O-CG 3.27Å; Q652-L656 PolarHBondContact O-N 3.11Å; G653-L656 PolarHBondContact O-N 2.94Å; A654-L656 VanDerWaalsContact C-N 3.34Å; A654-L656 PolarHBondContact O-N 2.8Å; L656-S660 WeakPolarHBondContact O-CB 3.15Å; L656-S660 PolarHBondContact O-N 2.79Å; L656-S660 VanDerWaalsContact O-N 3.1Å; L656-S660 PolarHBondContact O-OG 3.02Å
657	G	92.7	Very high	84.8	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-54.7	178.2	0	0	0	0	0	111.7	G653 A654 S660 L661	G653-G657 PolarHBondContact O-N 3.32Å; A654-G657 PolarHBondContact O-N 3.16Å; G657-S660 PolarHBondContact O-N 3.36Å; G657-L661 VanDerWaalsContact O-CB 3.31Å; G657-L661 WeakPolarHBondContact O-CB 2.81Å; G657-L661 WeakPolarHBondContact O-CD1 3.41Å; G657-L661 WeakPolarHBondContact O-CG 3.26Å; G657-L661 PolarHBondContact O-N 3.04Å
658	F	92.2	Very high	82.4	Confident	112 Å²	112	47 Å²	47	49%	0.491	24%	0.24	S	C	.	.	H	α-helix	trans	-62.4	-47.6	-177.5	-73.7	-60.9	0	0	0	112.9	L322 A654 S660 T662	L322-F658 HydrophobicContact CD1-CE2 4.44Å; L322-F658 HydrophobicContact CD1-CZ 4.25Å; L322-F658 HydrophobicContact CD2-CE2 4.43Å; L322-F658 HydrophobicContact CG-CE2 4.44Å; A654-F658 HydrophobicContact CB-CD2 4.25Å; A654-F658 HydrophobicContact CB-CE2 4.15Å; A654-F658 WeakPolarHBondContact O-CD2 3.21Å; A654-F658 PolarHBondContact O-N 2.99Å; F658-S660 VanDerWaalsContact C-N 3.35Å; F658-S660 PolarHBondContact O-N 3Å; F658-T662 WeakPolarHBondContact O-CB 3.35Å; F658-T662 WeakPolarHBondContact O-CG2 2.98Å; F658-T662 PolarHBondContact O-N 3.17Å; F658-T662 PolarHBondContact O-OG1 2.91Å
659	I	90.5	Very high	80.2	Confident	29 Å²	29	46.7 Å²	46.7	15%	0.149	24%	0.236	C	C	.	.	H	α-helix	trans	-66.9	-39.7	-177.7	-63.5	169.5	0	0	0	110.8	H617 I620 A655 T662 N663	H617-I659 HydrophobicContact CB-CG2 3.91Å; H617-I659 WeakPolarHBondContact CD2-CG2 3.45Å; I620-I659 HydrophobicContact CD1-CD1 3.31Å; A655-I659 WeakPolarHBondContact O-CB 3.4Å; A655-I659 WeakPolarHBondContact O-CD1 3.27Å; A655-I659 WeakPolarHBondContact O-CG1 3.04Å; A655-I659 PolarHBondContact O-N 3.18Å; I659-T662 PolarHBondContact O-OG1 3.12Å; I659-T662 VanDerWaalsContact O-OG1 3.08Å; I659-N663 WeakPolarHBondContact O-CB 3.24Å; I659-N663 VanDerWaalsContact O-CG 3.32Å; I659-N663 PolarHBondContact O-N 3.41Å; I659-N663 VanDerWaalsContact O-N 3.14Å; I659-N663 PolarHBondContact O-ND2 3.21Å
660	S	89.2	Confident	77.7	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.014	26%	0.257	C	S	.	.	H	α-helix	trans	-68.8	-44.5	-179.5	-57.4	0	0	0	0	111.6	Y334 H617 L656 G657 F658 N663 S664	Y334-S660 PolarHBondContact OH-O 2.88Å; H617-S660 PolarHBondContact NE2-OG 3.38Å; L656-S660 WeakPolarHBondContact O-CB 3.15Å; L656-S660 PolarHBondContact O-N 2.79Å; L656-S660 VanDerWaalsContact O-N 3.1Å; L656-S660 PolarHBondContact O-OG 3.02Å; G657-S660 PolarHBondContact O-N 3.36Å; F658-S660 VanDerWaalsContact C-N 3.35Å; F658-S660 PolarHBondContact O-N 3Å; S660-N663 PolarHBondContact O-N 2.85Å; S660-S664 PolarHBondContact O-N 3.29Å; S660-S664 VanDerWaalsContact O-N 3.11Å
661	L	89	Confident	75	Confident	28 Å²	28	56.1 Å²	56.1	15%	0.147	29%	0.286	C	S	.	.	H	α-helix	trans	-66.5	-42.3	178	-69.6	168.6	0	0	0	112.2	V329 L330 V333 Y334 G657 N663 S664 T665	V329-L661 HydrophobicContact CB-CD1 4.49Å; V329-L661 HydrophobicContact CG1-CD1 3.85Å; L330-L661 HydrophobicContact CD1-CD2 4.28Å; L330-L661 HydrophobicContact CD1-CG 4.12Å; V333-L661 HydrophobicContact CB-CD2 3.89Å; V333-L661 HydrophobicContact CG1-CD2 3.93Å; V333-L661 HydrophobicContact CG2-CD2 3.96Å; Y334-L661 HydrophobicContact CE2-CD2 4.43Å; G657-L661 VanDerWaalsContact O-CB 3.31Å; G657-L661 WeakPolarHBondContact O-CB 2.81Å; G657-L661 WeakPolarHBondContact O-CD1 3.41Å; G657-L661 WeakPolarHBondContact O-CG 3.26Å; G657-L661 PolarHBondContact O-N 3.04Å; L661-N663 VanDerWaalsContact C-N 3.32Å; L661-N663 PolarHBondContact O-N 3.09Å; L661-S664 WeakPolarHBondContact O-CB 3.35Å; L661-S664 PolarHBondContact O-N 3.4Å; L661-S664 VanDerWaalsContact O-N 3.14Å; L661-T665 WeakPolarHBondContact O-CG2 3.19Å; L661-T665 PolarHBondContact O-N 2.96Å
662	T	84.7	Confident	72.4	Confident	67 Å²	67	61.2 Å²	61.2	41%	0.411	31%	0.31	S	S	.	.	H	α-helix	trans	-67.9	-29	178.6	55.6	0	0	0	0	113.5	F658 I659 T665	F658-T662 WeakPolarHBondContact O-CB 3.35Å; F658-T662 WeakPolarHBondContact O-CG2 2.98Å; F658-T662 PolarHBondContact O-N 3.17Å; F658-T662 PolarHBondContact O-OG1 2.91Å; I659-T662 PolarHBondContact O-OG1 3.12Å; I659-T662 VanDerWaalsContact O-OG1 3.08Å; T662-T665 PolarHBondContact O-OG1 3.16Å
663	N	74.8	Confident	69.6	Low	59 Å²	59	67.8 Å²	67.8	32%	0.316	33%	0.334	S	S	.	.	H	α-helix	trans	-73.2	-34.6	171.7	-75.9	-22.8	0	0	0	111.5	K613 I659 S660 L661	K613-N663 WeakPolarHBondContact CE-OD1 3.23Å; K613-N663 PolarHBondContact NZ-OD1 2.71Å; I659-N663 WeakPolarHBondContact O-CB 3.24Å; I659-N663 VanDerWaalsContact O-CG 3.32Å; I659-N663 PolarHBondContact O-N 3.41Å; I659-N663 VanDerWaalsContact O-N 3.14Å; I659-N663 PolarHBondContact O-ND2 3.21Å; S660-N663 PolarHBondContact O-N 2.85Å; L661-N663 VanDerWaalsContact C-N 3.32Å; L661-N663 PolarHBondContact O-N 3.09Å
664	S	69.2	Low	66.8	Low	5 Å²	5	71.9 Å²	71.9	4%	0.035	36%	0.362	C	S	.	.	H	α-helix	trans	-68	-34.5	175.8	153.5	0	0	0	0	113.3	F340 S660 L661 K666 T667	F340-S664 WeakPolarHBondContact CE2-OG 3.41Å; F340-S664 VanDerWaalsContact CZ-CB 3.47Å; F340-S664 WeakPolarHBondContact CZ-OG 3.28Å; S660-S664 PolarHBondContact O-N 3.29Å; S660-S664 VanDerWaalsContact O-N 3.11Å; L661-S664 WeakPolarHBondContact O-CB 3.35Å; L661-S664 PolarHBondContact O-N 3.4Å; L661-S664 VanDerWaalsContact O-N 3.14Å; S664-K666 VanDerWaalsContact C-N 3.29Å; S664-K666 PolarHBondContact O-N 3.26Å; S664-T667 CarbonylContact O-C 3.31Å; S664-T667 VanDerWaalsContact O-C 3.31Å; S664-T667 WeakPolarHBondContact O-CA 3.41Å; S664-T667 PolarHBondContact O-N 3.17Å; S664-T667 VanDerWaalsContact O-O 3.05Å; S664-T667 PolarHBondContact O-OG1 3.5Å
665	T	57.2	Low	64	Low	69 Å²	69	75.5 Å²	75.5	42%	0.423	39%	0.388	S	S	.	.	H	α-helix	trans	-69.5	-26.7	-177.4	54.9	0	0	0	0	113.1	L661 T662 T667 F670	L661-T665 WeakPolarHBondContact O-CG2 3.19Å; L661-T665 PolarHBondContact O-N 2.96Å; T662-T665 PolarHBondContact O-OG1 3.16Å; T665-T667 PolarHBondContact O-N 3.31Å; T665-F670 HydrophobicContact CG2-CD2 3.7Å; T665-F670 HydrophobicContact CG2-CE2 4.06Å
666	K	53.7	Low	61.5	Low	174 Å²	174	79.3 Å²	79.3	76%	0.757	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.2	169.6	-68.5	-169.2	178.3	-171.2	0	112.9	S664	S664-K666 VanDerWaalsContact C-N 3.29Å; S664-K666 PolarHBondContact O-N 3.26Å
667	T	49.2	Very low	58.8	Low	66 Å²	66	87.2 Å²	87.2	41%	0.405	44%	0.437	S	S	.	.	S	Bend	trans	-110.7	76.1	172	48.1	0	0	0	0	110.6	S664 T665 L669	S664-T667 CarbonylContact O-C 3.31Å; S664-T667 VanDerWaalsContact O-C 3.31Å; S664-T667 WeakPolarHBondContact O-CA 3.41Å; S664-T667 PolarHBondContact O-N 3.17Å; S664-T667 VanDerWaalsContact O-O 3.05Å; S664-T667 PolarHBondContact O-OG1 3.5Å; T665-T667 PolarHBondContact O-N 3.31Å; T667-L669 PolarHBondContact O-N 3.29Å; T667-L669 VanDerWaalsContact O-N 3.16Å
668	R	41.7	Very low	56	Low	244 Å²	244	93.5 Å²	93.5	92%	0.921	47%	0.469	S	S	*	.	S	Bend	trans	61.1	20.3	153.4	-67.2	-174	175.7	179.6	-1.4	120.9
669	L	45.3	Very low	53	Low	56 Å²	56	93.2 Å²	93.2	29%	0.293	48%	0.481	S	S	.	.			trans	-105.2	-5.6	-170.6	-90	147	0	0	0	119.6	T337 F340 T667	T337-L669 HydrophobicContact CG2-CD1 4.05Å; T337-L669 HydrophobicContact CG2-CD2 3.87Å; F340-L669 HydrophobicContact CD2-CD1 4.22Å; F340-L669 HydrophobicContact CE1-CD1 4.09Å; F340-L669 HydrophobicContact CE2-CD1 3.18Å; F340-L669 HydrophobicContact CZ-CD1 3.08Å; T667-L669 PolarHBondContact O-N 3.29Å; T667-L669 VanDerWaalsContact O-N 3.16Å
670	F	41.9	Very low	50	Low	105 Å²	105	103 Å²	103	46%	0.461	52%	0.516	S	S	.	.			trans	-131.7	53.5	-177	-78	-84.1	0	0	0	117.5	T665 W673	T665-F670 HydrophobicContact CG2-CD2 3.7Å; T665-F670 HydrophobicContact CG2-CE2 4.06Å; F670-W673 HydrophobicContact CD1-CB 3.88Å; F670-W673 HydrophobicContact CD1-CG 4.4Å; F670-W673 HydrophobicContact CE1-CB 4.06Å; F670-W673 HydrophobicContact CE1-CD2 4.19Å; F670-W673 HydrophobicContact CE1-CE3 4.22Å; F670-W673 HydrophobicContact CE1-CG 4.14Å
671	P	36.2	Very low	47.2	Very low	99 Å²	99	114.6 Å²	114.6	64%	0.643	56%	0.56	S	S	*	*	S	Bend	trans	-82.4	-25.3	159.3	-11.8	28.3	0	0	0	113.7
672	N	39	Very low	44.4	Very low	125 Å²	125	118.3 Å²	118.3	67%	0.668	59%	0.588	S	S	*	*	S	Bend	trans	-111	-0.4	-160.1	-79.1	4.4	0	0	0	117.1	S675	N672-S675 PolarHBondContact O-OG 2.77Å
673	W	37	Very low	42	Very low	141 Å²	141	122.6 Å²	122.6	53%	0.534	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-86.6	-7.1	-174.4	-115.8	49.9	0	0	0	115.4	F670 S675 F677	F670-W673 HydrophobicContact CD1-CB 3.88Å; F670-W673 HydrophobicContact CD1-CG 4.4Å; F670-W673 HydrophobicContact CE1-CB 4.06Å; F670-W673 HydrophobicContact CE1-CD2 4.19Å; F670-W673 HydrophobicContact CE1-CE3 4.22Å; F670-W673 HydrophobicContact CE1-CG 4.14Å; W673-S675 PolarHBondContact O-N 3.49Å; W673-F677 HydrophobicContact CE3-CE2 4.42Å; W673-F677 HydrophobicContact CZ3-CE2 4.12Å
674	S	34.6	Very low	40	Very low	87 Å²	87	124.2 Å²	124.2	61%	0.608	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-71.2	-14.2	168.1	50.1	0	0	0	0	113.2
675	S	36.5	Very low	38.2	Very low	86 Å²	86	134.7 Å²	134.7	60%	0.601	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-83.3	-13.2	179.2	66.9	0	0	0	0	114.5	N672 W673	N672-S675 PolarHBondContact O-OG 2.77Å; W673-S675 PolarHBondContact O-N 3.49Å
676	I	42.7	Very low	37	Very low	111 Å²	111	137.4 Å²	137.4	57%	0.569	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-20.1	-175	-65	175	0	0	0	112.2
677	F	37.5	Very low	36.1	Very low	166 Å²	166	137 Å²	137	73%	0.728	69%	0.686	S	S	*	*	S	Bend	trans	-105.5	6.3	177.5	-79.3	-79	0	0	0	114.6	W673	W673-F677 HydrophobicContact CE3-CE2 4.42Å; W673-F677 HydrophobicContact CZ3-CE2 4.12Å
678	I	33.6	Very low	35.3	Very low	133 Å²	133	141.8 Å²	141.8	68%	0.682	70%	0.703	S	S	*	*			trans	-114	78.7	169.5	-54.9	177.2	0	0	0	108	R680	I678-R680 PolarHBondContact O-N 3.43Å
679	S	30.4	Very low	34.9	Very low	106 Å²	106	136.1 Å²	136.1	74%	0.741	70%	0.701	S	S	*	*			trans	-70.7	121	164	-175.3	0	0	0	0	108.9
680	R	27.2	Very low	34.3	Very low	235 Å²	235	142.3 Å²	142.3	89%	0.887	73%	0.726	S	S	*	*			trans	38.3	102.1	153	-78.1	177.3	168.8	175.4	-3.6	117.2	I678	I678-R680 PolarHBondContact O-N 3.43Å
681	R	30.1	Very low	34	Very low	244 Å²	244	142.5 Å²	142.5	92%	0.921	74%	0.74	S	S	*	*			trans	-139.1	95.6	133.4	-141.4	172.8	-171.1	175.5	2.2	109.7
682	S	30.7	Very low	34.1	Very low	107 Å²	107	144.5 Å²	144.5	75%	0.748	75%	0.75	S	S	*	*			trans	-64.5	122.6	161	49.6	0	0	0	0	108.6
683	N	32.7	Very low	34	Very low	157 Å²	157	143.2 Å²	143.2	84%	0.84	75%	0.751	S	S	*	*			trans	-143.7	121.3	150.3	-111	-2.2	0	0	0	109.9
684	S	33.1	Very low	34	Very low	92 Å²	92	142 Å²	142	64%	0.643	76%	0.764	S	S	*	*			trans	-72	166.7	176.2	58.7	0	0	0	0	113.5
685	R	32.2	Very low	34.2	Very low	225 Å²	225	143.2 Å²	143.2	85%	0.849	77%	0.772	S	S	*	*			trans	101.5	100.6	159.6	-60.2	175.8	-162.3	-172.6	3.4	113.7
686	V	32.8	Very low	34.3	Very low	127 Å²	127	143.7 Å²	143.7	77%	0.77	78%	0.775	S	S	*	*				70.7	108.2	84.3	173.7	0	0	0	0	110.9
687	N	33.9	Very low	34.1	Very low	166 Å²	166	149.4 Å²	149.4	89%	0.888	79%	0.79	S	S	*	*				-169.2	145.6	128.7	-94	-13.9	0	0	0	111.9
688	E	32.4	Very low	34.2	Very low	166 Å²	166	147.3 Å²	147.3	78%	0.776	79%	0.791	S	S	*	*			trans	-110.5	143.6	-163.2	-179.3	-176.3	-171	0	0	108.9
689	S	33.6	Very low	34.5	Very low	125 Å²	125	147.8 Å²	147.8	87%	0.874	79%	0.794	S	S	*	*			trans	-170.9	127.7	151.8	46.7	0	0	0	0	113.2
690	K	32.8	Very low	34.8	Very low	186 Å²	186	148.4 Å²	148.4	81%	0.809	79%	0.794	S	S	*	*			trans	-80.5	157.1	179.4	-64.3	164.4	172.9	166.8	0	113.3
691	S	35.1	Very low	35.3	Very low	108 Å²	108	146.5 Å²	146.5	76%	0.755	79%	0.792	S	S	*	*				172.6	116.1	127.7	56.1	0	0	0	0	112.4
692	V	38.5	Very low	35.8	Very low	141 Å²	141	141.2 Å²	141.2	86%	0.855	79%	0.787	S	S	*	*				78.3	121.9	102.9	176.7	0	0	0	0	113.1
693	S	36.5	Very low	36.1	Very low	98 Å²	98	138.9 Å²	138.9	69%	0.685	78%	0.779	S	S	*	*				-174.9	139.3	68.9	51.4	0	0	0	0	116.4
694	S	38.1	Very low	36.4	Very low	117 Å²	117	136.6 Å²	136.6	82%	0.818	78%	0.776	S	S	*	*			trans	49.8	142	138.6	62.9	0	0	0	0	122.6
695	S	38.4	Very low	36.7	Very low	112 Å²	112	138.1 Å²	138.1	78%	0.783	78%	0.781	S	S	*	*			cis	-168	154.1	32.7	179.1	0	0	0	0	113.6
696	S	39.1	Very low	37	Very low	95 Å²	95	132 Å²	132	66%	0.664	77%	0.773	S	S	*	*			trans	-47.9	158.2	174.3	49	0	0	0	0	120
697	R	37.5	Very low	37.3	Very low	232 Å²	232	134.5 Å²	134.5	88%	0.875	78%	0.776	S	S	*	*				-167.2	130.7	66.6	-85.4	177.7	-175.2	167	1.8	111
698	V	39.8	Very low	37.6	Very low	122 Å²	122	131.1 Å²	131.1	74%	0.739	77%	0.766	S	S	*	*				85	108.3	80.4	177.6	0	0	0	0	117.3
699	N	38.8	Very low	37.8	Very low	142 Å²	142	129.7 Å²	129.7	76%	0.759	77%	0.768	S	S	*	*			trans	46.6	146.8	139.7	-59.7	-17.1	0	0	0	121.7
700	T	37.9	Very low	38.5	Very low	120 Å²	120	132 Å²	132	74%	0.736	77%	0.769	S	S	*	*			cis	-174.6	145.7	45.9	-21.7	0	0	0	0	113
701	K	38.6	Very low	39.2	Very low	195 Å²	195	131.4 Å²	131.4	85%	0.848	80%	0.799	S	S	*	*			trans	31.4	153.6	140.2	-75.9	-168.9	162	175.3	0	122.1
702	V	39.1	Very low	39.4	Very low	133 Å²	133	132.6 Å²	132.6	81%	0.806	80%	0.801	S	S	*	*			cis	-177.9	154.4	2.4	140.2	0	0	0	0	108.5
703	G	37.6	Very low	39.4	Very low	57 Å²	57	132.1 Å²	132.1	59%	0.588	80%	0.798	S	S	*	*			trans	137.7	93.4	156	0	0	0	0	0	113.9
704	S	39.3	Very low	39.6	Very low	110 Å²	110	134 Å²	134	77%	0.769	80%	0.804	S	S	*	*				67.2	125.6	93	69.5	0	0	0	0	112.9
705	T	38.3	Very low	39.7	Very low	124 Å²	124	135 Å²	135	76%	0.761	80%	0.804	S	S	*	*			cis	-176.4	130.3	46.5	8.5	0	0	0	0	107.4
706	S	39.8	Very low	39.8	Very low	97 Å²	97	136.4 Å²	136.4	68%	0.678	81%	0.805	S	S	*	*				48.2	131.9	110	63	0	0	0	0	116.2
707	E	38.5	Very low	39.8	Very low	178 Å²	178	139.2 Å²	139.2	83%	0.832	81%	0.814	S	S	*	*				-179.1	155.3	64.8	-132.2	166.6	-171.4	0	0	114.1
708	S	39.5	Very low	40	Very low	96 Å²	96	132.6 Å²	132.6	67%	0.671	81%	0.81	S	S	*	*			trans	47.5	118.7	150.7	59.1	0	0	0	0	122.5
709	T	38.1	Very low	40	Very low	135 Å²	135	133.4 Å²	133.4	83%	0.828	82%	0.815	S	S	*	*				63.8	106.7	68.9	-44.6	0	0	0	0	115.3
710	I	47.6	Very low	40.1	Very low	174 Å²	174	132.7 Å²	132.7	89%	0.892	82%	0.82	S	S	*	*			trans	-156.1	136.3	138.4	-60.2	-167.3	0	0	0	109.4
711	A	47.2	Very low	40.3	Very low	173 Å²	173	133.8 Å²	133.8	100%	1.43	83%	0.828	S	S	*	*			trans	96.3	0	173.8	0	0	0	0	0	117.4

Retrieved 711 of 711 residues in 132.9 ms (Link to these results)

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