A0A068EWW2_MOUSE Loading...

Gag polyprotein

AlphaFold DB , UniProt , Accession A0A068EWW2, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 537 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	38.4	Very low	71.9	Confident	242 Å²	242	85.5 Å²	85.5	100%	1.192	50%	0.502	S	S	*	.				0	140.6	0	-64	-173.4	-74.3	0	0	107.3
2	G	42.9	Very low	73.9	Confident	75 Å²	75	78.3 Å²	78.3	77%	0.773	46%	0.46	S	S	*	.			trans	-72.3	136.5	-175.6	0	0	0	0	0	111.9	T4	G2-T4 PolarHBondContact O-N 2.99Å
3	Q	41.4	Very low	75.6	Confident	190 Å²	190	75.8 Å²	75.8	89%	0.888	44%	0.443	S	S	*	.			trans	-73.5	110.3	165.1	-72.5	173.8	-28.4	0	0	107.8	V5	Q3-V5 PolarHBondContact O-N 2.67Å
4	T	53.1	Low	77	Confident	128 Å²	128	80.5 Å²	80.5	79%	0.785	46%	0.459	S	S	*	.			trans	-66.6	110.8	166.5	43.8	0	0	0	0	108.1	G2 T6	G2-T4 PolarHBondContact O-N 2.99Å; T4-T6 PolarHBondContact O-N 2.84Å; T4-T6 VanDerWaalsContact O-N 3.1Å
5	V	63.7	Low	78.3	Confident	121 Å²	121	79.2 Å²	79.2	73%	0.733	45%	0.447	S	S	*	.			trans	-64.5	112.8	175.9	179	0	0	0	0	108.1	Q3 T7	Q3-V5 PolarHBondContact O-N 2.67Å; V5-T7 HydrophobicContact CG1-CG2 4.31Å; V5-T7 PolarHBondContact O-N 3.26Å
6	T	82.8	Confident	79.5	Confident	71 Å²	71	75.7 Å²	75.7	44%	0.436	43%	0.425	S	S	.	.			trans	-70.4	113.2	177.9	-54.1	0	0	0	0	109.5	T4 L11 F100	T4-T6 PolarHBondContact O-N 2.84Å; T4-T6 VanDerWaalsContact O-N 3.1Å; T6-L11 HydrophobicContact CG2-CD1 3.83Å; T6-L11 HydrophobicContact CG2-CD2 3.61Å; T6-L11 HydrophobicContact CG2-CG 3.5Å; T6-F100 HydrophobicContact CG2-CE1 4.25Å; T6-F100 HydrophobicContact CG2-CZ 3.89Å
7	T	91.5	Very high	80.4	Confident	23 Å²	23	80.7 Å²	80.7	14%	0.141	44%	0.444	C	S	.	.			trans	-109.1	159.5	179.1	67.6	0	0	0	0	111.7	V5 L9 S10 L11 D53	V5-T7 HydrophobicContact CG1-CG2 4.31Å; V5-T7 PolarHBondContact O-N 3.26Å; T7-L9 PolarHBondContact O-N 3.39Å; T7-S10 PolarHBondContact N-OG 3.2Å; T7-S10 PolarHBondContact O-N 3.32Å; T7-S10 PolarHBondContact O-OG 3.41Å; T7-S10 VanDerWaalsContact O-OG 3.11Å; T7-S10 PolarHBondContact OG1-N 2.61Å; T7-L11 WeakPolarHBondContact O-CB 3.15Å; T7-L11 WeakPolarHBondContact O-CG 3.27Å; T7-L11 PolarHBondContact O-N 3Å; T7-D53 HydrophobicContact CG2-CB 3.86Å
8	P	93.9	Very high	81.2	Confident	27 Å²	27	78.3 Å²	78.3	18%	0.175	43%	0.43	C	S	.	.	H	α-helix	trans	-55.2	-37.1	173.9	-30.7	40.4	0	0	0	113.4	T12 G54 F56 W86	P8-T12 WeakPolarHBondContact O-CG2 3.39Å; P8-T12 PolarHBondContact O-N 3.11Å; P8-T12 VanDerWaalsContact O-N 3.13Å; P8-T12 PolarHBondContact O-OG1 3.21Å; P8-G54 WeakPolarHBondContact CG-O 3.42Å; P8-F56 HydrophobicContact CB-CD1 4.46Å; P8-F56 HydrophobicContact CB-CD2 3.93Å; P8-F56 HydrophobicContact CB-CE1 4.13Å; P8-F56 HydrophobicContact CB-CE2 3.57Å; P8-F56 HydrophobicContact CB-CG 4.36Å; P8-F56 HydrophobicContact CB-CZ 3.69Å; P8-F56 HydrophobicContact CG-CD2 3.97Å; P8-F56 HydrophobicContact CG-CE2 3.92Å; P8-W86 HydrophobicContact CB-CZ2 4.2Å
9	L	95.4	Very high	82	Confident	14 Å²	14	74.2 Å²	74.2	7%	0.073	41%	0.408	C	S	.	.	H	α-helix	trans	-68.6	-43.3	171.4	-177.8	59.3	0	0	0	112.3	T7 L11 T12 L13 C39 S40 D53 W86	T7-L9 PolarHBondContact O-N 3.39Å; L9-L11 PolarHBondContact O-N 3.49Å; L9-T12 PolarHBondContact O-N 3.49Å; L9-T12 PolarHBondContact O-OG1 3.15Å; L9-T12 VanDerWaalsContact O-OG1 3.11Å; L9-L13 HydrophobicContact CD1-CD1 3.89Å; L9-L13 HydrophobicContact CD1-CG 4.06Å; L9-L13 HydrophobicContact CG-CD1 3.88Å; L9-L13 HydrophobicContact CG-CG 4.46Å; L9-L13 WeakPolarHBondContact O-CB 3.5Å; L9-L13 WeakPolarHBondContact O-CD1 3.17Å; L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 2.87Å; L9-C39 HydrophobicContact CD1-CB 4.05Å; L9-C39 HydrophobicContact CD2-CB 4.45Å; L9-S40 WeakPolarHBondContact CD2-OG 3.41Å; L9-D53 WeakPolarHBondContact CB-O 3.35Å; L9-D53 PolarHBondContact N-O 3.21Å; L9-W86 HydrophobicContact CB-CH2 4.3Å; L9-W86 HydrophobicContact CD1-CH2 4.04Å; L9-W86 HydrophobicContact CD1-CZ3 4.34Å
10	S	93.8	Very high	82.8	Confident	41 Å²	41	74.5 Å²	74.5	29%	0.287	41%	0.406	S	S	.	.	H	α-helix	trans	-63.5	-43	178.1	82.4	0	0	0	0	111.8	T7 L13 E14	T7-S10 PolarHBondContact N-OG 3.2Å; T7-S10 PolarHBondContact O-N 3.32Å; T7-S10 PolarHBondContact O-OG 3.41Å; T7-S10 VanDerWaalsContact O-OG 3.11Å; T7-S10 PolarHBondContact OG1-N 2.61Å; S10-L13 PolarHBondContact O-N 2.99Å; S10-E14 WeakPolarHBondContact O-CB 3.18Å; S10-E14 PolarHBondContact O-N 2.98Å
11	L	94.1	Very high	83.4	Confident	8 Å²	8	77.2 Å²	77.2	4%	0.042	41%	0.41	C	S	.	.	H	α-helix	trans	-58	-48.2	176.2	-77.5	163.5	0	0	0	112.4	T6 T7 L9 L13 E14 H15 F56 W96 F100	T6-L11 HydrophobicContact CG2-CD1 3.83Å; T6-L11 HydrophobicContact CG2-CD2 3.61Å; T6-L11 HydrophobicContact CG2-CG 3.5Å; T7-L11 WeakPolarHBondContact O-CB 3.15Å; T7-L11 WeakPolarHBondContact O-CG 3.27Å; T7-L11 PolarHBondContact O-N 3Å; L9-L11 PolarHBondContact O-N 3.49Å; L11-L13 VanDerWaalsContact C-N 3.26Å; L11-L13 PolarHBondContact O-N 3.49Å; L11-E14 PolarHBondContact O-N 2.96Å; L11-H15 PolarHBondContact O-N 3.4Å; L11-F56 HydrophobicContact CD1-CE2 3.94Å; L11-F56 HydrophobicContact CD1-CZ 4.47Å; L11-W96 HydrophobicContact CB-CE3 4.08Å; L11-W96 HydrophobicContact CB-CZ3 4.07Å; L11-W96 HydrophobicContact CD2-CE3 4.46Å; L11-F100 HydrophobicContact CD1-CD1 4.22Å; L11-F100 HydrophobicContact CD1-CD2 3.63Å; L11-F100 HydrophobicContact CD1-CE1 4.2Å; L11-F100 HydrophobicContact CD1-CE2 3.61Å; L11-F100 HydrophobicContact CD1-CG 3.95Å; L11-F100 HydrophobicContact CD1-CZ 3.9Å; L11-F100 HydrophobicContact CD2-CE2 4.07Å; L11-F100 HydrophobicContact CD2-CZ 4.45Å; L11-F100 HydrophobicContact CG-CE2 4.49Å
12	T	96.1	Very high	86.1	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-69.8	-23.7	179.4	52.9	0	0	0	0	112.7	P8 L9 W16 V19 W35 F56 I89 W96	P8-T12 WeakPolarHBondContact O-CG2 3.39Å; P8-T12 PolarHBondContact O-N 3.11Å; P8-T12 VanDerWaalsContact O-N 3.13Å; P8-T12 PolarHBondContact O-OG1 3.21Å; L9-T12 PolarHBondContact O-N 3.49Å; L9-T12 PolarHBondContact O-OG1 3.15Å; L9-T12 VanDerWaalsContact O-OG1 3.11Å; T12-W16 WeakPolarHBondContact O-CA 3.29Å; T12-V19 HydrophobicContact CG2-CG2 4.28Å; T12-V19 WeakPolarHBondContact O-CG2 3.37Å; T12-W35 HydrophobicContact CG2-CZ2 3.97Å; T12-W35 PolarHBondContact OG1-NE1 2.78Å; T12-F56 HydrophobicContact CG2-CE1 4.1Å; T12-F56 HydrophobicContact CG2-CZ 4.14Å; T12-I89 HydrophobicContact CG2-CD1 4.43Å; T12-W96 HydrophobicContact CG2-CH2 4.1Å; T12-W96 HydrophobicContact CG2-CZ3 4.04Å
13	L	95.9	Very high	88.6	Confident	45 Å²	45	63.5 Å²	63.5	24%	0.236	32%	0.324	C	S	.	.	H	α-helix	trans	-83.3	-27.8	172.6	-65.7	171	0	0	0	113.5	L9 S10 L11 W16 K32 V36	L9-L13 HydrophobicContact CD1-CD1 3.89Å; L9-L13 HydrophobicContact CD1-CG 4.06Å; L9-L13 HydrophobicContact CG-CD1 3.88Å; L9-L13 HydrophobicContact CG-CG 4.46Å; L9-L13 WeakPolarHBondContact O-CB 3.5Å; L9-L13 WeakPolarHBondContact O-CD1 3.17Å; L9-L13 WeakPolarHBondContact O-CG 3.41Å; L9-L13 PolarHBondContact O-N 2.87Å; S10-L13 PolarHBondContact O-N 2.99Å; L11-L13 VanDerWaalsContact C-N 3.26Å; L11-L13 PolarHBondContact O-N 3.49Å; L13-W16 HydrophobicContact CD2-CE3 4.48Å; L13-K32 HydrophobicContact CD2-CD 4.23Å; L13-K32 HydrophobicContact CD2-CG 3.64Å; L13-K32 VanDerWaalsContact O-CE 3.29Å; L13-K32 WeakPolarHBondContact O-CE 3.27Å; L13-K32 PolarHBondContact O-NZ 3.25Å; L13-V36 HydrophobicContact CD1-CG2 3.85Å; L13-V36 HydrophobicContact CD2-CG2 3.64Å; L13-V36 HydrophobicContact CG-CG2 4.35Å
14	E	95.4	Very high	91.1	Very high	142 Å²	142	58.1 Å²	58.1	66%	0.664	31%	0.307	S	S	*	.	H	α-helix	trans	-70.8	-55.2	172.4	-175.3	167.6	-166.3	0	0	109.8	S10 L11 W16	S10-E14 WeakPolarHBondContact O-CB 3.18Å; S10-E14 PolarHBondContact O-N 2.98Å; L11-E14 PolarHBondContact O-N 2.96Å; E14-W16 PolarHBondContact O-N 2.91Å
15	H	95.9	Very high	92.9	Very high	61 Å²	61	57.9 Å²	57.9	28%	0.282	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	39.7	178.5	-64.2	-80.3	0	0	0	113.5	L11 E17 D18 V19 W96	L11-H15 PolarHBondContact O-N 3.4Å; H15-E17 VanDerWaalsContact C-N 3.3Å; H15-E17 PolarHBondContact O-N 3.14Å; H15-D18 HydrophobicContact CB-CB 4.44Å; H15-D18 WeakPolarHBondContact O-CB 3.41Å; H15-D18 PolarHBondContact O-N 3.43Å; H15-D18 VanDerWaalsContact O-N 3.07Å; H15-V19 PolarHBondContact O-N 2.75Å; H15-W96 HydrophobicContact CB-CD2 3.62Å; H15-W96 HydrophobicContact CB-CE3 3.97Å; H15-W96 HydrophobicContact CB-CG 4.23Å; H15-W96 HydrophobicContact CB-CH2 3.85Å; H15-W96 HydrophobicContact CB-CZ2 3.45Å; H15-W96 VanDerWaalsContact CB-CZ2 3.45Å; H15-W96 HydrophobicContact CB-CZ3 4.08Å; H15-W96 AromaticContact CD2-CD1 3.96Å; H15-W96 AromaticContact CD2-CD2 3.36Å; H15-W96 AromaticContact CD2-CE3 3.55Å; H15-W96 AromaticContact CD2-CG 3.43Å; H15-W96 VanDerWaalsContact CD2-CG 3.43Å; H15-W96 AromaticContact CE1-CD1 3.81Å; H15-W96 AromaticContact CE1-CG 3.79Å; H15-W96 AromaticContact CG-CD1 3.63Å; H15-W96 AromaticContact CG-CD2 3.42Å; H15-W96 VanDerWaalsContact CG-CD2 3.42Å; H15-W96 AromaticContact CG-CE2 3.55Å; H15-W96 AromaticContact CG-CE3 3.91Å; H15-W96 AromaticContact CG-CG 3.55Å; H15-W96 AromaticContact CG-NE1 3.61Å; H15-W96 AromaticContact ND1-CD1 3.53Å; H15-W96 AromaticContact ND1-CG 3.78Å; H15-W96 AromaticContact ND1-NE1 3.77Å; H15-W96 WeakPolarHBondContact NE2-CB 3.39Å; H15-W96 AromaticContact NE2-CG 3.58Å
16	W	97.2	Very high	94.2	Very high	23 Å²	23	57 Å²	57	9%	0.087	29%	0.289	C	S	.	.	H	α-helix	trans	-61.9	-31.3	-169.9	-178.8	-101.3	0	0	0	114.5	T12 L13 E14 V19 Q20 V30 K32 W35	T12-W16 WeakPolarHBondContact O-CA 3.29Å; L13-W16 HydrophobicContact CD2-CE3 4.48Å; E14-W16 PolarHBondContact O-N 2.91Å; W16-V19 HydrophobicContact CE3-CB 4.13Å; W16-V19 HydrophobicContact CE3-CG1 4.08Å; W16-V19 HydrophobicContact CH2-CG1 4.18Å; W16-V19 HydrophobicContact CZ3-CB 4.25Å; W16-V19 HydrophobicContact CZ3-CG1 3.69Å; W16-V19 WeakPolarHBondContact O-CB 3.44Å; W16-V19 PolarHBondContact O-N 3.27Å; W16-Q20 HydrophobicContact CD2-CG 4.46Å; W16-Q20 HydrophobicContact CZ2-CG 3.71Å; W16-Q20 PolarHBondContact O-N 3.3Å; W16-V30 HydrophobicContact CH2-CB 4.34Å; W16-V30 HydrophobicContact CH2-CG2 3.87Å; W16-V30 HydrophobicContact CZ2-CG2 4.21Å; W16-V30 WeakPolarHBondContact CZ2-O 3.3Å; W16-K32 HydrophobicContact CB-CD 4.3Å; W16-K32 HydrophobicContact CD2-CB 3.97Å; W16-K32 HydrophobicContact CD2-CD 3.71Å; W16-K32 HydrophobicContact CD2-CG 3.65Å; W16-K32 HydrophobicContact CE3-CB 4.35Å; W16-K32 HydrophobicContact CE3-CD 4.27Å; W16-K32 HydrophobicContact CE3-CG 3.85Å; W16-K32 HydrophobicContact CG-CD 3.64Å; W16-K32 HydrophobicContact CG-CG 4.16Å; W16-K32 HydrophobicContact CH2-CB 4.14Å; W16-K32 HydrophobicContact CH2-CG 4.46Å; W16-K32 VanDerWaalsContact CZ2-CA 3.49Å; W16-K32 HydrophobicContact CZ2-CB 3.7Å; W16-K32 HydrophobicContact CZ2-CG 4.27Å; W16-K32 HydrophobicContact CZ3-CB 4.42Å; W16-K32 HydrophobicContact CZ3-CG 4.25Å; W16-W35 HydrophobicContact CH2-CB 3.91Å; W16-W35 HydrophobicContact CH2-CD2 4.21Å; W16-W35 HydrophobicContact CH2-CE3 4.35Å; W16-W35 HydrophobicContact CH2-CG 4.05Å; W16-W35 HydrophobicContact CZ3-CB 3.82Å; W16-W35 AromaticContact CZ3-CD1 3.84Å; W16-W35 AromaticContact CZ3-CD2 3.73Å; W16-W35 HydrophobicContact CZ3-CD2 3.73Å; W16-W35 HydrophobicContact CZ3-CE3 4.24Å; W16-W35 AromaticContact CZ3-CG 3.53Å; W16-W35 HydrophobicContact CZ3-CG 3.53Å
17	E	95.3	Very high	94.6	Very high	161 Å²	161	59 Å²	59	75%	0.752	31%	0.306	S	S	*	.	H	α-helix	trans	-67.2	-36.5	175.8	-63.8	-175.8	174.5	0	0	112.4	H15 Q20 R21	H15-E17 VanDerWaalsContact C-N 3.3Å; H15-E17 PolarHBondContact O-N 3.14Å; E17-Q20 PolarHBondContact O-N 3.46Å; E17-R21 WeakPolarHBondContact O-CB 3.45Å; E17-R21 PolarHBondContact O-N 2.89Å
18	D	95.1	Very high	94.7	Very high	37 Å²	37	59.7 Å²	59.7	20%	0.198	31%	0.31	C	S	.	.	H	α-helix	trans	-65.4	-41	172.2	-78.9	-4.9	0	0	0	110.8	H15 R21 I22 W96	H15-D18 HydrophobicContact CB-CB 4.44Å; H15-D18 WeakPolarHBondContact O-CB 3.41Å; H15-D18 PolarHBondContact O-N 3.43Å; H15-D18 VanDerWaalsContact O-N 3.07Å; D18-R21 VanDerWaalsContact CG-NH2 3.33Å; D18-R21 PolarHBondContact O-N 3.11Å; D18-R21 IonicContact OD1-CZ 2.71Å; D18-R21 IonicContact OD1-NH1 2.67Å; D18-R21 PolarHBondContact OD1-NH1 3.01Å; D18-R21 IonicContact OD1-NH2 3.96Å; D18-R21 PolarHBondContact OD1-NH2 3.05Å; D18-R21 IonicContact OD2-NH2 3.69Å; D18-I22 WeakPolarHBondContact O-CD1 3.48Å; D18-I22 VanDerWaalsContact O-CG1 3.24Å; D18-I22 WeakPolarHBondContact O-CG1 3.35Å; D18-I22 PolarHBondContact O-N 3.38Å; D18-W96 HydrophobicContact CB-CZ2 3.89Å; D18-W96 PolarHBondContact OD2-NE1 2.95Å
19	V	96.7	Very high	94.7	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-60.6	-45.2	175.8	176.8	0	0	0	0	111.1	T12 H15 W16 I22 A23 V30 W35 T85 I89 W96	T12-V19 HydrophobicContact CG2-CG2 4.28Å; T12-V19 WeakPolarHBondContact O-CG2 3.37Å; H15-V19 PolarHBondContact O-N 2.75Å; W16-V19 HydrophobicContact CE3-CB 4.13Å; W16-V19 HydrophobicContact CE3-CG1 4.08Å; W16-V19 HydrophobicContact CH2-CG1 4.18Å; W16-V19 HydrophobicContact CZ3-CB 4.25Å; W16-V19 HydrophobicContact CZ3-CG1 3.69Å; W16-V19 WeakPolarHBondContact O-CB 3.44Å; W16-V19 PolarHBondContact O-N 3.27Å; V19-I22 PolarHBondContact O-N 3.03Å; V19-A23 WeakPolarHBondContact O-CB 3.48Å; V19-A23 PolarHBondContact O-N 3.29Å; V19-V30 HydrophobicContact CG1-CG2 4.32Å; V19-W35 HydrophobicContact CG1-CD2 4.43Å; V19-W35 HydrophobicContact CG1-CE3 4.28Å; V19-W35 HydrophobicContact CG1-CH2 3.74Å; V19-W35 HydrophobicContact CG1-CZ2 3.84Å; V19-W35 HydrophobicContact CG1-CZ3 3.96Å; V19-T85 HydrophobicContact CG1-CG2 3.97Å; V19-I89 HydrophobicContact CB-CD1 4.34Å; V19-I89 HydrophobicContact CG1-CD1 4.05Å; V19-I89 HydrophobicContact CG2-CD1 3.86Å; V19-W96 HydrophobicContact CG2-CH2 4Å; V19-W96 HydrophobicContact CG2-CZ2 4.43Å
20	Q	96.8	Very high	94.7	Very high	80 Å²	80	62.1 Å²	62.1	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-66	-37.4	175.7	-69.2	-166.5	-92.6	0	0	112.4	W16 E17 A23 S24 V30	W16-Q20 HydrophobicContact CD2-CG 4.46Å; W16-Q20 HydrophobicContact CZ2-CG 3.71Å; W16-Q20 PolarHBondContact O-N 3.3Å; E17-Q20 PolarHBondContact O-N 3.46Å; Q20-A23 PolarHBondContact O-N 3.5Å; Q20-S24 WeakPolarHBondContact O-CB 3.44Å; Q20-S24 PolarHBondContact O-N 3.24Å; Q20-S24 PolarHBondContact O-OG 2.75Å; Q20-V30 HydrophobicContact CG-CG2 4.5Å
21	R	95.6	Very high	94.8	Very high	132 Å²	132	66 Å²	66	50%	0.498	33%	0.334	S	S	.	.	H	α-helix	trans	-64.3	-41.1	174.6	-170.5	173.9	67.6	-109.7	-3.9	112.1	E17 D18 S24 N25	E17-R21 WeakPolarHBondContact O-CB 3.45Å; E17-R21 PolarHBondContact O-N 2.89Å; D18-R21 VanDerWaalsContact CG-NH2 3.33Å; D18-R21 PolarHBondContact O-N 3.11Å; D18-R21 IonicContact OD1-CZ 2.71Å; D18-R21 IonicContact OD1-NH1 2.67Å; D18-R21 PolarHBondContact OD1-NH1 3.01Å; D18-R21 IonicContact OD1-NH2 3.96Å; D18-R21 PolarHBondContact OD1-NH2 3.05Å; D18-R21 IonicContact OD2-NH2 3.69Å; R21-S24 PolarHBondContact O-N 3.16Å; R21-N25 VanDerWaalsContact O-CG 3.24Å; R21-N25 PolarHBondContact O-N 3.13Å; R21-N25 PolarHBondContact O-OD1 3.33Å
22	I	95.3	Very high	94.9	Very high	28 Å²	28	69.7 Å²	69.7	14%	0.144	35%	0.349	C	S	.	.	H	α-helix	trans	-65.8	-43.7	176.4	-67.5	162.9	0	0	0	110.8	D18 V19 S24 N25 Q26 T85 A88 I89 P94	D18-I22 WeakPolarHBondContact O-CD1 3.48Å; D18-I22 VanDerWaalsContact O-CG1 3.24Å; D18-I22 WeakPolarHBondContact O-CG1 3.35Å; D18-I22 PolarHBondContact O-N 3.38Å; V19-I22 PolarHBondContact O-N 3.03Å; I22-S24 VanDerWaalsContact C-N 3.32Å; I22-S24 PolarHBondContact O-N 3.41Å; I22-N25 PolarHBondContact O-N 3.19Å; I22-Q26 WeakPolarHBondContact O-CG 3.31Å; I22-Q26 PolarHBondContact O-N 3.47Å; I22-Q26 VanDerWaalsContact O-N 3.08Å; I22-T85 HydrophobicContact CG2-CG2 4.36Å; I22-A88 HydrophobicContact CG2-CB 3.76Å; I22-I89 HydrophobicContact CD1-CG1 3.76Å; I22-I89 HydrophobicContact CG2-CG1 4.16Å; I22-P94 HydrophobicContact CD1-CG 3.65Å
23	A	95.1	Very high	94.9	Very high	1 Å²	1	80.1 Å²	80.1	1%	0.008	39%	0.389	C	S	.	.	H	α-helix	trans	-58	-44.5	172.6	0	0	0	0	0	111.9	V19 Q20 N25 Q26 S27 V28 V30 T85	V19-A23 WeakPolarHBondContact O-CB 3.48Å; V19-A23 PolarHBondContact O-N 3.29Å; Q20-A23 PolarHBondContact O-N 3.5Å; A23-N25 PolarHBondContact O-N 2.92Å; A23-Q26 CarbonylContact O-C 3.58Å; A23-Q26 WeakPolarHBondContact O-CA 3.36Å; A23-Q26 PolarHBondContact O-N 3.42Å; A23-S27 PolarHBondContact O-N 3.1Å; A23-S27 VanDerWaalsContact O-N 3.15Å; A23-V28 CarbonylContact C-O 3.58Å; A23-V28 HydrophobicContact CB-CG2 4.14Å; A23-V28 WeakPolarHBondContact CB-O 3.41Å; A23-V28 WeakPolarHBondContact O-CG2 3.38Å; A23-V28 PolarHBondContact O-N 3.25Å; A23-V28 VanDerWaalsContact O-O 3.06Å; A23-V30 HydrophobicContact CB-CB 4.39Å; A23-V30 HydrophobicContact CB-CG1 4.06Å; A23-V30 HydrophobicContact CB-CG2 3.55Å; A23-T85 WeakPolarHBondContact CA-OG1 3.06Å; A23-T85 HydrophobicContact CB-CG2 3.85Å; A23-T85 WeakPolarHBondContact CB-OG1 3.34Å
24	S	94.1	Very high	95	Very high	77 Å²	77	83.1 Å²	83.1	54%	0.538	40%	0.397	S	S	.	.	H	α-helix	trans	-64.6	-39	179.9	-56.6	0	0	0	0	112	Q20 R21 I22 Q26 S27	Q20-S24 WeakPolarHBondContact O-CB 3.44Å; Q20-S24 PolarHBondContact O-N 3.24Å; Q20-S24 PolarHBondContact O-OG 2.75Å; R21-S24 PolarHBondContact O-N 3.16Å; I22-S24 VanDerWaalsContact C-N 3.32Å; I22-S24 PolarHBondContact O-N 3.41Å; S24-Q26 VanDerWaalsContact C-N 3.28Å; S24-Q26 PolarHBondContact O-N 3.27Å; S24-S27 WeakPolarHBondContact O-CA 3.39Å; S24-S27 PolarHBondContact O-N 3Å
25	N	92.6	Very high	95.1	Very high	123 Å²	123	76.4 Å²	76.4	66%	0.658	37%	0.365	S	S	*	.	H	α-helix	trans	-64	-33.6	172.9	-70.3	-3.3	0	0	0	112.1	R21 I22 A23 S27	R21-N25 VanDerWaalsContact O-CG 3.24Å; R21-N25 PolarHBondContact O-N 3.13Å; R21-N25 PolarHBondContact O-OD1 3.33Å; I22-N25 PolarHBondContact O-N 3.19Å; A23-N25 PolarHBondContact O-N 2.92Å; N25-S27 PolarHBondContact O-N 2.96Å
26	Q	89.4	Confident	95.1	Very high	102 Å²	102	76 Å²	76	48%	0.477	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	8.8	171.3	-61.7	-61.2	-26.1	0	0	113.2	I22 A23 S24 V28 A88	I22-Q26 WeakPolarHBondContact O-CG 3.31Å; I22-Q26 PolarHBondContact O-N 3.47Å; I22-Q26 VanDerWaalsContact O-N 3.08Å; A23-Q26 CarbonylContact O-C 3.58Å; A23-Q26 WeakPolarHBondContact O-CA 3.36Å; A23-Q26 PolarHBondContact O-N 3.42Å; S24-Q26 VanDerWaalsContact C-N 3.28Å; S24-Q26 PolarHBondContact O-N 3.27Å; Q26-V28 VanDerWaalsContact C-N 3.31Å; Q26-V28 HydrophobicContact CB-CG2 4.18Å; Q26-V28 PolarHBondContact O-N 3Å; Q26-A88 HydrophobicContact CG-CB 4.34Å
27	S	92.5	Very high	95.1	Very high	113 Å²	113	77.4 Å²	77.4	79%	0.79	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	33.1	-177.9	-57.9	0	0	0	0	115	A23 S24 N25	A23-S27 PolarHBondContact O-N 3.1Å; A23-S27 VanDerWaalsContact O-N 3.15Å; S24-S27 WeakPolarHBondContact O-CA 3.39Å; S24-S27 PolarHBondContact O-N 3Å; N25-S27 PolarHBondContact O-N 2.96Å
28	V	93.1	Very high	95.2	Very high	39 Å²	39	69.7 Å²	69.7	24%	0.236	34%	0.342	C	S	.	.			trans	-129.2	150.7	179.2	-62.9	0	0	0	0	112.8	A23 Q26 P81	A23-V28 CarbonylContact C-O 3.58Å; A23-V28 HydrophobicContact CB-CG2 4.14Å; A23-V28 WeakPolarHBondContact CB-O 3.41Å; A23-V28 WeakPolarHBondContact O-CG2 3.38Å; A23-V28 PolarHBondContact O-N 3.25Å; A23-V28 VanDerWaalsContact O-O 3.06Å; Q26-V28 VanDerWaalsContact C-N 3.31Å; Q26-V28 HydrophobicContact CB-CG2 4.18Å; Q26-V28 PolarHBondContact O-N 3Å; V28-P81 HydrophobicContact CB-CB 3.89Å; V28-P81 HydrophobicContact CB-CG 4.36Å; V28-P81 HydrophobicContact CG1-CB 4.48Å; V28-P81 HydrophobicContact CG2-CB 4.18Å
29	D	92.6	Very high	95.3	Very high	90 Å²	90	68 Å²	68	48%	0.481	33%	0.333	S	S	.	.			trans	-100.8	134.5	175.2	175.1	34.6	0	0	0	111.2	K31 P81	D29-K31 WeakPolarHBondContact OD2-CE 3.29Å; D29-K31 IonicContact OD2-NZ 3.06Å; D29-K31 PolarHBondContact OD2-NZ 3.33Å; D29-P81 WeakPolarHBondContact O-CB 3.48Å
30	V	96.2	Very high	95.3	Very high	1 Å²	1	69.7 Å²	69.7	1%	0.006	35%	0.345	C	S	.	.			trans	-129.2	132.4	177.8	-64.5	0	0	0	0	110.7	W16 V19 Q20 A23 W35 P81 Y82	W16-V30 HydrophobicContact CH2-CB 4.34Å; W16-V30 HydrophobicContact CH2-CG2 3.87Å; W16-V30 HydrophobicContact CZ2-CG2 4.21Å; W16-V30 WeakPolarHBondContact CZ2-O 3.3Å; V19-V30 HydrophobicContact CG1-CG2 4.32Å; Q20-V30 HydrophobicContact CG-CG2 4.5Å; A23-V30 HydrophobicContact CB-CB 4.39Å; A23-V30 HydrophobicContact CB-CG1 4.06Å; A23-V30 HydrophobicContact CB-CG2 3.55Å; V30-W35 HydrophobicContact CB-CE3 4.33Å; V30-W35 HydrophobicContact CG1-CE3 4.49Å; V30-W35 HydrophobicContact CG1-CZ3 4.43Å; V30-P81 HydrophobicContact CG1-CB 3.99Å; V30-P81 WeakPolarHBondContact CG1-O 3.47Å; V30-Y82 HydrophobicContact CB-CD1 4.1Å; V30-Y82 HydrophobicContact CB-CE1 3.9Å; V30-Y82 HydrophobicContact CG1-CD1 4.06Å; V30-Y82 HydrophobicContact CG1-CD2 4.44Å; V30-Y82 HydrophobicContact CG1-CE1 4.22Å; V30-Y82 HydrophobicContact CG1-CG 4.14Å
31	K	96.8	Very high	95.1	Very high	123 Å²	123	68.6 Å²	68.6	54%	0.535	35%	0.35	S	S	.	.			trans	-110.8	124.9	-175.2	-61.5	-178.9	-174	177.7	0	110.6	D29 R33 R34 W35 Y82	D29-K31 WeakPolarHBondContact OD2-CE 3.29Å; D29-K31 IonicContact OD2-NZ 3.06Å; D29-K31 PolarHBondContact OD2-NZ 3.33Å; K31-R33 PolarHBondContact O-N 3.45Å; K31-R34 WeakPolarHBondContact O-CA 3.13Å; K31-R34 PolarHBondContact O-N 3.17Å; K31-W35 PolarHBondContact O-N 3.4Å; K31-Y82 PolarHBondContact N-OH 3.15Å
32	K	96.3	Very high	95.1	Very high	86 Å²	86	65.1 Å²	65.1	37%	0.374	34%	0.339	S	S	.	.	H	α-helix	trans	-48.7	-40.2	-171.7	-158.6	168.1	-166.8	167.2	0	114	L13 W16 W35 V36	L13-K32 HydrophobicContact CD2-CD 4.23Å; L13-K32 HydrophobicContact CD2-CG 3.64Å; L13-K32 VanDerWaalsContact O-CE 3.29Å; L13-K32 WeakPolarHBondContact O-CE 3.27Å; L13-K32 PolarHBondContact O-NZ 3.25Å; W16-K32 HydrophobicContact CB-CD 4.3Å; W16-K32 HydrophobicContact CD2-CB 3.97Å; W16-K32 HydrophobicContact CD2-CD 3.71Å; W16-K32 HydrophobicContact CD2-CG 3.65Å; W16-K32 HydrophobicContact CE3-CB 4.35Å; W16-K32 HydrophobicContact CE3-CD 4.27Å; W16-K32 HydrophobicContact CE3-CG 3.85Å; W16-K32 HydrophobicContact CG-CD 3.64Å; W16-K32 HydrophobicContact CG-CG 4.16Å; W16-K32 HydrophobicContact CH2-CB 4.14Å; W16-K32 HydrophobicContact CH2-CG 4.46Å; W16-K32 VanDerWaalsContact CZ2-CA 3.49Å; W16-K32 HydrophobicContact CZ2-CB 3.7Å; W16-K32 HydrophobicContact CZ2-CG 4.27Å; W16-K32 HydrophobicContact CZ3-CB 4.42Å; W16-K32 HydrophobicContact CZ3-CG 4.25Å; K32-W35 WeakPolarHBondContact O-CB 3.47Å; K32-W35 PolarHBondContact O-N 2.97Å; K32-V36 WeakPolarHBondContact O-CG2 3.43Å; K32-V36 PolarHBondContact O-N 2.81Å
33	R	95.7	Very high	95.2	Very high	218 Å²	218	63.8 Å²	63.8	82%	0.823	33%	0.332	S	S	*	.	H	α-helix	trans	-63.8	-44.3	176.1	-173.4	175.5	178.7	177.7	0.2	113.1	K31 T37	K31-R33 PolarHBondContact O-N 3.45Å; R33-T37 PolarHBondContact O-N 3.14Å; R33-T37 VanDerWaalsContact O-N 3.15Å; R33-T37 PolarHBondContact O-OG1 3.28Å; R33-T37 VanDerWaalsContact O-OG1 3.06Å
34	R	96.8	Very high	95.3	Very high	109 Å²	109	65.4 Å²	65.4	41%	0.411	34%	0.343	S	S	.	.	H	α-helix	trans	-70.8	-35.8	177.5	-80.2	-67	-164.7	127.9	8.5	111.7	K31 V36 T37 F38 D78 Y82	K31-R34 WeakPolarHBondContact O-CA 3.13Å; K31-R34 PolarHBondContact O-N 3.17Å; R34-V36 VanDerWaalsContact C-N 3.34Å; R34-V36 PolarHBondContact O-N 2.94Å; R34-T37 PolarHBondContact O-N 3.5Å; R34-F38 HydrophobicContact CB-CD2 4.24Å; R34-F38 HydrophobicContact CB-CE2 3.95Å; R34-F38 HydrophobicContact CB-CZ 4.41Å; R34-F38 HydrophobicContact CG-CE2 4.46Å; R34-F38 HydrophobicContact CG-CZ 4.48Å; R34-F38 VanDerWaalsContact NH1-CE1 3.27Å; R34-F38 WeakPolarHBondContact O-CB 3.45Å; R34-F38 WeakPolarHBondContact O-CD2 3.44Å; R34-F38 VanDerWaalsContact O-CG 3.23Å; R34-F38 WeakPolarHBondContact O-CG 3.42Å; R34-F38 PolarHBondContact O-N 3.33Å; R34-D78 IonicContact CZ-OD2 3.78Å; R34-D78 IonicContact NH1-OD2 3.71Å; R34-D78 PolarHBondContact NH1-OD2 3.01Å; R34-D78 IonicContact NH2-OD2 3.91Å; R34-Y82 HydrophobicContact CB-CD1 4.4Å; R34-Y82 HydrophobicContact CB-CE1 3.52Å
35	W	97.6	Very high	95.4	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-54	-48.5	172.4	-172.2	-92.6	0	0	0	112	T12 W16 V19 V30 K31 K32 C39 Y82 T85 W86 I89	T12-W35 HydrophobicContact CG2-CZ2 3.97Å; T12-W35 PolarHBondContact OG1-NE1 2.78Å; W16-W35 HydrophobicContact CH2-CB 3.91Å; W16-W35 HydrophobicContact CH2-CD2 4.21Å; W16-W35 HydrophobicContact CH2-CE3 4.35Å; W16-W35 HydrophobicContact CH2-CG 4.05Å; W16-W35 HydrophobicContact CZ3-CB 3.82Å; W16-W35 AromaticContact CZ3-CD1 3.84Å; W16-W35 AromaticContact CZ3-CD2 3.73Å; W16-W35 HydrophobicContact CZ3-CD2 3.73Å; W16-W35 HydrophobicContact CZ3-CE3 4.24Å; W16-W35 AromaticContact CZ3-CG 3.53Å; W16-W35 HydrophobicContact CZ3-CG 3.53Å; V19-W35 HydrophobicContact CG1-CD2 4.43Å; V19-W35 HydrophobicContact CG1-CE3 4.28Å; V19-W35 HydrophobicContact CG1-CH2 3.74Å; V19-W35 HydrophobicContact CG1-CZ2 3.84Å; V19-W35 HydrophobicContact CG1-CZ3 3.96Å; V30-W35 HydrophobicContact CB-CE3 4.33Å; V30-W35 HydrophobicContact CG1-CE3 4.49Å; V30-W35 HydrophobicContact CG1-CZ3 4.43Å; K31-W35 PolarHBondContact O-N 3.4Å; K32-W35 WeakPolarHBondContact O-CB 3.47Å; K32-W35 PolarHBondContact O-N 2.97Å; W35-C39 WeakPolarHBondContact O-CB 3.34Å; W35-C39 PolarHBondContact O-N 3.42Å; W35-C39 VanDerWaalsContact O-N 3.1Å; W35-Y82 HydrophobicContact CB-CD1 4.27Å; W35-Y82 HydrophobicContact CB-CE1 4.48Å; W35-Y82 AromaticContact CE3-CD1 3.89Å; W35-Y82 HydrophobicContact CE3-CD1 3.89Å; W35-Y82 WeakPolarHBondContact CZ3-O 3.31Å; W35-T85 HydrophobicContact CH2-CG2 3.82Å; W35-T85 HydrophobicContact CZ3-CG2 3.77Å; W35-W86 AromaticContact CD1-CZ3 3.94Å; W35-W86 HydrophobicContact CD2-CE3 4.08Å; W35-W86 HydrophobicContact CD2-CZ3 4.08Å; W35-W86 AromaticContact CE2-CE3 3.38Å; W35-W86 AromaticContact CE2-CZ3 3.33Å; W35-W86 HydrophobicContact CE3-CE3 4.48Å; W35-W86 HydrophobicContact CG-CZ3 4.43Å; W35-W86 HydrophobicContact CH2-CB 3.93Å; W35-W86 HydrophobicContact CH2-CD2 4.07Å; W35-W86 AromaticContact CH2-CE3 3.6Å; W35-W86 HydrophobicContact CH2-CE3 3.6Å; W35-W86 HydrophobicContact CH2-CG 4.27Å; W35-W86 HydrophobicContact CH2-CZ3 4.4Å; W35-W86 HydrophobicContact CZ2-CB 4.49Å; W35-W86 AromaticContact CZ2-CD2 3.74Å; W35-W86 HydrophobicContact CZ2-CD2 3.74Å; W35-W86 AromaticContact CZ2-CE3 3.12Å; W35-W86 HydrophobicContact CZ2-CE3 3.12Å; W35-W86 HydrophobicContact CZ2-CG 4.35Å; W35-W86 HydrophobicContact CZ2-CH2 4.4Å; W35-W86 AromaticContact CZ2-CZ3 3.53Å; W35-W86 HydrophobicContact CZ2-CZ3 3.53Å; W35-W86 HydrophobicContact CZ3-CE3 4.26Å; W35-W86 AromaticContact NE1-CE3 3.84Å; W35-W86 AromaticContact NE1-CH2 3.91Å; W35-W86 AromaticContact NE1-CZ3 3.24Å; W35-I89 HydrophobicContact CH2-CD1 3.89Å; W35-I89 HydrophobicContact CZ2-CD1 4.13Å
36	V	97.2	Very high	95.4	Very high	53 Å²	53	62.4 Å²	62.4	32%	0.321	32%	0.324	S	S	.	.	H	α-helix	trans	-62.7	-48.8	174.5	178.1	0	0	0	0	111.8	L13 K32 R34 F38 C39 S40	L13-V36 HydrophobicContact CD1-CG2 3.85Å; L13-V36 HydrophobicContact CD2-CG2 3.64Å; L13-V36 HydrophobicContact CG-CG2 4.35Å; K32-V36 WeakPolarHBondContact O-CG2 3.43Å; K32-V36 PolarHBondContact O-N 2.81Å; R34-V36 VanDerWaalsContact C-N 3.34Å; R34-V36 PolarHBondContact O-N 2.94Å; V36-F38 PolarHBondContact O-N 3.22Å; V36-C39 PolarHBondContact O-N 3.11Å; V36-S40 VanDerWaalsContact O-CB 3.3Å; V36-S40 WeakPolarHBondContact O-CB 3.17Å; V36-S40 PolarHBondContact O-N 3.45Å; V36-S40 PolarHBondContact O-OG 2.87Å
37	T	97.1	Very high	95.5	Very high	52 Å²	52	60.9 Å²	60.9	32%	0.319	34%	0.335	S	S	.	.	H	α-helix	trans	-60.4	-46.3	-178.6	-55.7	0	0	0	0	112	R33 R34 A41 E42	R33-T37 PolarHBondContact O-N 3.14Å; R33-T37 VanDerWaalsContact O-N 3.15Å; R33-T37 PolarHBondContact O-OG1 3.28Å; R33-T37 VanDerWaalsContact O-OG1 3.06Å; R34-T37 PolarHBondContact O-N 3.5Å; T37-A41 WeakPolarHBondContact O-CA 3.3Å; T37-A41 WeakPolarHBondContact O-CB 3.36Å; T37-A41 PolarHBondContact O-N 2.88Å; T37-E42 HydrophobicContact CG2-CG 4.49Å; T37-E42 WeakPolarHBondContact CG2-OE1 3.45Å; T37-E42 PolarHBondContact O-N 2.71Å
38	F	97.7	Very high	95.5	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.304	C	S	.	.	I	π-helix	trans	-65.6	-47	-179.6	-63.4	-30.5	0	0	0	111.9	R34 V36 E42 W43 Q79 Y82	R34-F38 HydrophobicContact CB-CD2 4.24Å; R34-F38 HydrophobicContact CB-CE2 3.95Å; R34-F38 HydrophobicContact CB-CZ 4.41Å; R34-F38 HydrophobicContact CG-CE2 4.46Å; R34-F38 HydrophobicContact CG-CZ 4.48Å; R34-F38 VanDerWaalsContact NH1-CE1 3.27Å; R34-F38 WeakPolarHBondContact O-CB 3.45Å; R34-F38 WeakPolarHBondContact O-CD2 3.44Å; R34-F38 VanDerWaalsContact O-CG 3.23Å; R34-F38 WeakPolarHBondContact O-CG 3.42Å; R34-F38 PolarHBondContact O-N 3.33Å; V36-F38 PolarHBondContact O-N 3.22Å; F38-E42 HydrophobicContact CD1-CB 4.32Å; F38-E42 HydrophobicContact CD1-CG 4.26Å; F38-E42 VanDerWaalsContact CD1-OE1 3.31Å; F38-E42 WeakPolarHBondContact CD1-OE1 3.24Å; F38-E42 WeakPolarHBondContact CD1-OE2 3.38Å; F38-E42 WeakPolarHBondContact CE1-OE1 3.42Å; F38-E42 WeakPolarHBondContact CE1-OE2 3.35Å; F38-E42 PolarHBondContact O-N 3.47Å; F38-W43 HydrophobicContact CB-CD2 4.2Å; F38-W43 HydrophobicContact CB-CH2 4.46Å; F38-W43 HydrophobicContact CB-CZ2 3.95Å; F38-W43 WeakPolarHBondContact O-CB 3.47Å; F38-W43 VanDerWaalsContact O-CG 3.27Å; F38-W43 PolarHBondContact O-N 2.75Å; F38-Q79 HydrophobicContact CD1-CG 3.8Å; F38-Q79 HydrophobicContact CD2-CG 4.11Å; F38-Q79 HydrophobicContact CE1-CG 3.55Å; F38-Q79 HydrophobicContact CE2-CB 4.33Å; F38-Q79 HydrophobicContact CE2-CG 3.87Å; F38-Q79 HydrophobicContact CG-CG 4.07Å; F38-Q79 HydrophobicContact CZ-CB 4.44Å; F38-Q79 HydrophobicContact CZ-CG 3.57Å; F38-Y82 AromaticContact CD2-CD1 3.71Å; F38-Y82 HydrophobicContact CD2-CD1 3.71Å; F38-Y82 AromaticContact CD2-CD2 3.8Å; F38-Y82 HydrophobicContact CD2-CD2 3.8Å; F38-Y82 HydrophobicContact CD2-CE1 4.22Å; F38-Y82 HydrophobicContact CD2-CE2 4.32Å; F38-Y82 AromaticContact CD2-CG 3.5Å; F38-Y82 HydrophobicContact CD2-CG 3.5Å; F38-Y82 HydrophobicContact CE2-CD1 4.04Å; F38-Y82 AromaticContact CE2-CD2 3.47Å; F38-Y82 HydrophobicContact CE2-CD2 3.47Å; F38-Y82 VanDerWaalsContact CE2-CD2 3.47Å; F38-Y82 HydrophobicContact CE2-CE1 4.2Å; F38-Y82 AromaticContact CE2-CE2 3.68Å; F38-Y82 HydrophobicContact CE2-CE2 3.68Å; F38-Y82 AromaticContact CE2-CG 3.71Å; F38-Y82 HydrophobicContact CE2-CG 3.71Å
39	C	96.9	Very high	95.4	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.32	C	S	.	.	I	π-helix	trans	-65	-43.7	178.4	-179.5	0	0	0	0	113.7	L9 W35 V36 W43 P44 W50 G54 W86	L9-C39 HydrophobicContact CD1-CB 4.05Å; L9-C39 HydrophobicContact CD2-CB 4.45Å; W35-C39 WeakPolarHBondContact O-CB 3.34Å; W35-C39 PolarHBondContact O-N 3.42Å; W35-C39 VanDerWaalsContact O-N 3.1Å; V36-C39 PolarHBondContact O-N 3.11Å; C39-W43 HydrophobicContact CB-CE3 4.36Å; C39-W43 HydrophobicContact CB-CZ3 4.47Å; C39-P44 WeakPolarHBondContact O-CD 3.24Å; C39-W50 PolarHBondContact O-NE1 3.2Å; C39-G54 WeakPolarHBondContact SG-CA 3.5Å; C39-G54 PolarHBondContact SG-N 3.27Å; C39-W86 HydrophobicContact CB-CH2 3.92Å; C39-W86 HydrophobicContact CB-CZ3 3.7Å; C39-W86 WeakPolarHBondContact SG-CH2 3.46Å
40	S	95.6	Very high	95.6	Very high	37 Å²	37	53.6 Å²	53.6	26%	0.259	30%	0.299	S	S	.	.	I	π-helix	trans	-92.5	-25.8	-168.4	-36.8	0	0	0	0	113.9	L9 V36 Q52	L9-S40 WeakPolarHBondContact CD2-OG 3.41Å; V36-S40 VanDerWaalsContact O-CB 3.3Å; V36-S40 WeakPolarHBondContact O-CB 3.17Å; V36-S40 PolarHBondContact O-N 3.45Å; V36-S40 PolarHBondContact O-OG 2.87Å; S40-Q52 WeakPolarHBondContact CA-O 3.22Å
41	A	93.8	Very high	95.5	Very high	57 Å²	57	56.1 Å²	56.1	47%	0.471	32%	0.316	S	S	.	.	I	π-helix	trans	-124.8	-39.1	-170.3	0	0	0	0	0	114.3	T37 T45	T37-A41 WeakPolarHBondContact O-CA 3.3Å; T37-A41 WeakPolarHBondContact O-CB 3.36Å; T37-A41 PolarHBondContact O-N 2.88Å; A41-T45 WeakPolarHBondContact O-CG2 3.34Å
42	E	95.9	Very high	95.3	Very high	58 Å²	58	56.6 Å²	56.6	27%	0.271	32%	0.32	S	S	.	.	I	π-helix	trans	-92.7	-54.1	-174.3	-62.2	180	-136.7	0	0	112.7	T37 F38 P44 T45 Q79	T37-E42 HydrophobicContact CG2-CG 4.49Å; T37-E42 WeakPolarHBondContact CG2-OE1 3.45Å; T37-E42 PolarHBondContact O-N 2.71Å; F38-E42 HydrophobicContact CD1-CB 4.32Å; F38-E42 HydrophobicContact CD1-CG 4.26Å; F38-E42 VanDerWaalsContact CD1-OE1 3.31Å; F38-E42 WeakPolarHBondContact CD1-OE1 3.24Å; F38-E42 WeakPolarHBondContact CD1-OE2 3.38Å; F38-E42 WeakPolarHBondContact CE1-OE1 3.42Å; F38-E42 WeakPolarHBondContact CE1-OE2 3.35Å; F38-E42 PolarHBondContact O-N 3.47Å; E42-P44 VanDerWaalsContact C-CD 3.46Å; E42-T45 WeakPolarHBondContact O-CB 3.38Å; E42-T45 PolarHBondContact O-N 2.85Å; E42-T45 PolarHBondContact O-OG1 3.49Å; E42-Q79 PolarHBondContact OE2-NE2 2.76Å
43	W	97.4	Very high	95.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-59.6	-34.2	-179.2	-63.5	-18	0	0	0	115.3	F38 C39 T45 F46 W50 V64 Q79 I83 W86	F38-W43 HydrophobicContact CB-CD2 4.2Å; F38-W43 HydrophobicContact CB-CH2 4.46Å; F38-W43 HydrophobicContact CB-CZ2 3.95Å; F38-W43 WeakPolarHBondContact O-CB 3.47Å; F38-W43 VanDerWaalsContact O-CG 3.27Å; F38-W43 PolarHBondContact O-N 2.75Å; C39-W43 HydrophobicContact CB-CE3 4.36Å; C39-W43 HydrophobicContact CB-CZ3 4.47Å; W43-T45 PolarHBondContact O-N 3.26Å; W43-F46 AromaticContact CD1-CE2 3.5Å; W43-F46 AromaticContact CD1-CZ 4Å; W43-F46 HydrophobicContact CG-CE2 4.43Å; W43-F46 WeakPolarHBondContact O-CB 3.4Å; W43-F46 PolarHBondContact O-N 3.38Å; W43-W50 HydrophobicContact CB-CB 4.45Å; W43-W50 HydrophobicContact CB-CD2 4.16Å; W43-W50 HydrophobicContact CB-CG 3.84Å; W43-W50 HydrophobicContact CE3-CD2 4.23Å; W43-W50 AromaticContact CE3-CE2 3.64Å; W43-W50 AromaticContact CE3-CH2 3.85Å; W43-W50 HydrophobicContact CE3-CH2 3.85Å; W43-W50 AromaticContact CE3-CZ2 3.46Å; W43-W50 HydrophobicContact CE3-CZ2 3.46Å; W43-W50 VanDerWaalsContact CE3-CZ2 3.46Å; W43-W50 HydrophobicContact CE3-CZ3 4.37Å; W43-W50 AromaticContact CZ3-CH2 3.89Å; W43-W50 HydrophobicContact CZ3-CH2 3.89Å; W43-W50 AromaticContact CZ3-CZ2 3.76Å; W43-W50 HydrophobicContact CZ3-CZ2 3.76Å; W43-V64 HydrophobicContact CB-CG1 4.15Å; W43-V64 HydrophobicContact CB-CG2 4.41Å; W43-V64 HydrophobicContact CD2-CG1 3.82Å; W43-V64 HydrophobicContact CG-CG1 3.62Å; W43-Q79 VanDerWaalsContact CD1-OE1 3.25Å; W43-I83 HydrophobicContact CE3-CD1 4.42Å; W43-I83 HydrophobicContact CH2-CB 4.17Å; W43-I83 HydrophobicContact CH2-CD1 3.93Å; W43-I83 HydrophobicContact CZ2-CB 3.81Å; W43-I83 HydrophobicContact CZ2-CD1 4.08Å; W43-I83 HydrophobicContact CZ2-CG1 4.49Å; W43-I83 HydrophobicContact CZ3-CD1 4.11Å; W43-W86 HydrophobicContact CH2-CE3 4.15Å; W43-W86 HydrophobicContact CZ3-CD2 4.11Å; W43-W86 AromaticContact CZ3-CE3 3.63Å; W43-W86 HydrophobicContact CZ3-CE3 3.63Å; W43-W86 HydrophobicContact CZ3-CZ3 4.2Å
44	P	96.9	Very high	95	Very high	35 Å²	35	46.7 Å²	46.7	23%	0.227	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-57.5	-30.4	170.5	-24.9	33.3	0	0	0	114	C39 E42 F46 Q52	C39-P44 WeakPolarHBondContact O-CD 3.24Å; E42-P44 VanDerWaalsContact C-CD 3.46Å; P44-F46 PolarHBondContact O-N 2.88Å; P44-Q52 HydrophobicContact CB-CG 4.43Å; P44-Q52 HydrophobicContact CG-CG 4.01Å
45	T	95.1	Very high	94.9	Very high	109 Å²	109	42.5 Å²	42.5	67%	0.669	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-73.6	-14.6	-178.5	70.4	0	0	0	0	113.7	A41 E42 W43 G47	A41-T45 WeakPolarHBondContact O-CG2 3.34Å; E42-T45 WeakPolarHBondContact O-CB 3.38Å; E42-T45 PolarHBondContact O-N 2.85Å; E42-T45 PolarHBondContact O-OG1 3.49Å; W43-T45 PolarHBondContact O-N 3.26Å; T45-G47 PolarHBondContact O-N 2.98Å
46	F	93.8	Very high	94.8	Very high	29 Å²	29	43.2 Å²	43.2	13%	0.127	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-70.7	-9.5	180	-67.7	-7.5	0	0	0	113.8	W43 P44 V48 V64 K67 V68 H76 Q79	W43-F46 AromaticContact CD1-CE2 3.5Å; W43-F46 AromaticContact CD1-CZ 4Å; W43-F46 HydrophobicContact CG-CE2 4.43Å; W43-F46 WeakPolarHBondContact O-CB 3.4Å; W43-F46 PolarHBondContact O-N 3.38Å; P44-F46 PolarHBondContact O-N 2.88Å; F46-V48 VanDerWaalsContact C-N 3.25Å; F46-V48 HydrophobicContact CB-CG2 4.18Å; F46-V48 PolarHBondContact O-N 3.13Å; F46-V64 HydrophobicContact CD2-CG1 4.01Å; F46-V64 HydrophobicContact CE2-CG1 4.05Å; F46-K67 HydrophobicContact CB-CG 4.23Å; F46-K67 HydrophobicContact CD2-CB 3.72Å; F46-K67 HydrophobicContact CD2-CG 4.21Å; F46-K67 HydrophobicContact CE2-CB 4.01Å; F46-K67 HydrophobicContact CG-CB 4.18Å; F46-K67 HydrophobicContact CG-CG 4.36Å; F46-V68 HydrophobicContact CE2-CG2 3.91Å; F46-V68 HydrophobicContact CZ-CG2 4.5Å; F46-H76 AromaticContact CE1-CD2 3.88Å; F46-H76 AromaticContact CE1-CE1 3.95Å; F46-H76 AromaticContact CE1-NE2 3.51Å; F46-H76 AromaticContact CZ-CD2 3.58Å; F46-H76 AromaticContact CZ-CG 3.96Å; F46-H76 AromaticContact CZ-NE2 3.73Å; F46-Q79 VanDerWaalsContact CZ-OE1 3.28Å
47	G	90.8	Very high	94.6	Very high	69 Å²	69	44 Å²	44	71%	0.711	28%	0.281	S	S	*	.	S	Bend	trans	74.5	8.4	175	0	0	0	0	0	115.2	T45 G49	T45-G47 PolarHBondContact O-N 2.98Å; G47-G49 PolarHBondContact O-N 2.88Å
48	V	91.6	Very high	94.4	Very high	22 Å²	22	44.3 Å²	44.3	13%	0.133	28%	0.28	C	S	.	.	S	Bend	trans	-94.1	19.5	-174.9	-60.6	0	0	0	0	114.1	F46 Q63 V64 K67	F46-V48 VanDerWaalsContact C-N 3.25Å; F46-V48 HydrophobicContact CB-CG2 4.18Å; F46-V48 PolarHBondContact O-N 3.13Å; V48-Q63 HydrophobicContact CB-CB 3.78Å; V48-Q63 HydrophobicContact CG1-CB 3.98Å; V48-Q63 HydrophobicContact CG2-CB 4.16Å; V48-V64 HydrophobicContact CG2-CB 4.48Å; V48-V64 HydrophobicContact CG2-CG2 3.46Å; V48-V64 VanDerWaalsContact CG2-CG2 3.46Å; V48-K67 HydrophobicContact CG1-CG 4.26Å
49	G	91.8	Very high	94.2	Very high	57 Å²	57	49.6 Å²	49.6	59%	0.588	31%	0.308	S	S	*	.			trans	76.6	16.7	179.6	0	0	0	0	0	115.7	G47 P51	G47-G49 PolarHBondContact O-N 2.88Å; G49-P51 WeakPolarHBondContact O-CD 3.33Å
50	W	96.7	Very high	94.1	Very high	10 Å²	10	51.2 Å²	51.2	4%	0.038	32%	0.317	C	S	.	.			trans	-71	121.7	175.4	-175.9	-82.3	0	0	0	111.7	C39 W43 T55 I60 I61 V64 I83 W86	C39-W50 PolarHBondContact O-NE1 3.2Å; W43-W50 HydrophobicContact CB-CB 4.45Å; W43-W50 HydrophobicContact CB-CD2 4.16Å; W43-W50 HydrophobicContact CB-CG 3.84Å; W43-W50 HydrophobicContact CE3-CD2 4.23Å; W43-W50 AromaticContact CE3-CE2 3.64Å; W43-W50 AromaticContact CE3-CH2 3.85Å; W43-W50 HydrophobicContact CE3-CH2 3.85Å; W43-W50 AromaticContact CE3-CZ2 3.46Å; W43-W50 HydrophobicContact CE3-CZ2 3.46Å; W43-W50 VanDerWaalsContact CE3-CZ2 3.46Å; W43-W50 HydrophobicContact CE3-CZ3 4.37Å; W43-W50 AromaticContact CZ3-CH2 3.89Å; W43-W50 HydrophobicContact CZ3-CH2 3.89Å; W43-W50 AromaticContact CZ3-CZ2 3.76Å; W43-W50 HydrophobicContact CZ3-CZ2 3.76Å; W50-T55 HydrophobicContact CD2-CG2 4.36Å; W50-T55 HydrophobicContact CE3-CG2 3.79Å; W50-T55 HydrophobicContact CH2-CG2 4.17Å; W50-T55 HydrophobicContact CZ3-CG2 3.71Å; W50-I60 HydrophobicContact CB-CG2 4.28Å; W50-I60 HydrophobicContact CE3-CG2 4.05Å; W50-I61 HydrophobicContact CH2-CG1 4.32Å; W50-I61 HydrophobicContact CZ3-CG1 3.72Å; W50-V64 HydrophobicContact CB-CG2 4Å; W50-V64 HydrophobicContact CD2-CG2 4.08Å; W50-V64 HydrophobicContact CE3-CB 4.39Å; W50-V64 HydrophobicContact CE3-CG2 3.59Å; W50-V64 HydrophobicContact CG-CG2 4.24Å; W50-V64 HydrophobicContact CZ3-CG2 4.42Å; W50-I83 HydrophobicContact CZ3-CD1 4.43Å; W50-W86 AromaticContact CH2-CD1 3.91Å; W50-W86 AromaticContact CH2-CD2 3.93Å; W50-W86 HydrophobicContact CH2-CD2 3.93Å; W50-W86 AromaticContact CH2-CE2 3.72Å; W50-W86 HydrophobicContact CH2-CG 4.1Å; W50-W86 HydrophobicContact CH2-CZ2 4.24Å; W50-W86 AromaticContact CH2-NE1 3.66Å; W50-W86 HydrophobicContact CZ2-CD2 4.27Å; W50-W86 AromaticContact CZ2-CE2 3.97Å; W50-W86 HydrophobicContact CZ2-CH2 4.36Å; W50-W86 HydrophobicContact CZ2-CZ2 4.04Å
51	P	94.8	Very high	94.2	Very high	55 Å²	55	49.5 Å²	49.5	36%	0.357	30%	0.304	S	S	.	.			trans	-81.4	151.1	178.7	34.4	-35.9	0	0	0	112	G49 D53 G54	G49-P51 WeakPolarHBondContact O-CD 3.33Å; P51-D53 PolarHBondContact O-N 2.81Å; P51-G54 VanDerWaalsContact CG-O 3.32Å; P51-G54 WeakPolarHBondContact CG-O 3.46Å; P51-G54 PolarHBondContact O-N 3.05Å
52	Q	92	Very high	94.3	Very high	133 Å²	133	50.3 Å²	50.3	62%	0.621	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-31.3	-178.6	-66.5	178.9	-22.7	0	0	113.3	S40 P44 G54	S40-Q52 WeakPolarHBondContact CA-O 3.22Å; P44-Q52 HydrophobicContact CB-CG 4.43Å; P44-Q52 HydrophobicContact CG-CG 4.01Å; Q52-G54 VanDerWaalsContact C-N 3.28Å; Q52-G54 PolarHBondContact O-N 2.81Å
53	D	92.6	Very high	94.3	Very high	90 Å²	90	52 Å²	52	48%	0.481	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	3.5	176.5	-70.1	-66	0	0	0	114.6	T7 L9 P51	T7-D53 HydrophobicContact CG2-CB 3.86Å; L9-D53 WeakPolarHBondContact CB-O 3.35Å; L9-D53 PolarHBondContact N-O 3.21Å; P51-D53 PolarHBondContact O-N 2.81Å
54	G	94.1	Very high	94.3	Very high	5 Å²	5	52 Å²	52	5%	0.052	31%	0.309	C	S	.	.			trans	76.4	169.2	-179.2	0	0	0	0	0	114.4	P8 C39 P51 Q52	P8-G54 WeakPolarHBondContact CG-O 3.42Å; C39-G54 WeakPolarHBondContact SG-CA 3.5Å; C39-G54 PolarHBondContact SG-N 3.27Å; P51-G54 VanDerWaalsContact CG-O 3.32Å; P51-G54 WeakPolarHBondContact CG-O 3.46Å; P51-G54 PolarHBondContact O-N 3.05Å; Q52-G54 VanDerWaalsContact C-N 3.28Å; Q52-G54 PolarHBondContact O-N 2.81Å
55	T	94.4	Very high	94.3	Very high	22 Å²	22	52.9 Å²	52.9	14%	0.135	31%	0.309	C	S	.	.			trans	-144.8	154.1	-179.4	-173.7	0	0	0	0	111.6	W50 N57 I60 W86	W50-T55 HydrophobicContact CD2-CG2 4.36Å; W50-T55 HydrophobicContact CE3-CG2 3.79Å; W50-T55 HydrophobicContact CH2-CG2 4.17Å; W50-T55 HydrophobicContact CZ3-CG2 3.71Å; T55-N57 WeakPolarHBondContact OG1-CB 3.35Å; T55-N57 PolarHBondContact OG1-N 2.69Å; T55-I60 HydrophobicContact CG2-CB 4.01Å; T55-I60 HydrophobicContact CG2-CD1 4.44Å; T55-I60 HydrophobicContact CG2-CG2 3.94Å; T55-W86 PolarHBondContact O-NE1 2.89Å
56	F	94.8	Very high	94.3	Very high	14 Å²	14	51.5 Å²	51.5	6%	0.061	30%	0.303	C	S	.	.			trans	-106.4	11.5	166	-56.8	-58.6	0	0	0	112.4	P8 L11 T12 L58 W86 I89 A90 V97 F100 V101	P8-F56 HydrophobicContact CB-CD1 4.46Å; P8-F56 HydrophobicContact CB-CD2 3.93Å; P8-F56 HydrophobicContact CB-CE1 4.13Å; P8-F56 HydrophobicContact CB-CE2 3.57Å; P8-F56 HydrophobicContact CB-CG 4.36Å; P8-F56 HydrophobicContact CB-CZ 3.69Å; P8-F56 HydrophobicContact CG-CD2 3.97Å; P8-F56 HydrophobicContact CG-CE2 3.92Å; L11-F56 HydrophobicContact CD1-CE2 3.94Å; L11-F56 HydrophobicContact CD1-CZ 4.47Å; T12-F56 HydrophobicContact CG2-CE1 4.1Å; T12-F56 HydrophobicContact CG2-CZ 4.14Å; F56-L58 PolarHBondContact O-N 3.44Å; F56-W86 AromaticContact CD1-NE1 3.86Å; F56-W86 AromaticContact CE1-NE1 3.97Å; F56-I89 HydrophobicContact CD1-CG2 4.32Å; F56-I89 HydrophobicContact CE1-CG2 3.78Å; F56-A90 HydrophobicContact CB-CB 4.32Å; F56-V97 HydrophobicContact CD1-CG1 4.06Å; F56-V97 HydrophobicContact CD2-CG1 3.89Å; F56-V97 HydrophobicContact CE1-CG1 4.1Å; F56-V97 HydrophobicContact CE1-CG2 4.48Å; F56-V97 HydrophobicContact CE2-CG1 3.92Å; F56-V97 HydrophobicContact CG-CG1 3.96Å; F56-V97 HydrophobicContact CZ-CG1 4.03Å; F56-V97 HydrophobicContact CZ-CG2 4.13Å; F56-F100 HydrophobicContact CD2-CB 3.88Å; F56-F100 HydrophobicContact CE2-CB 4.18Å; F56-V101 HydrophobicContact CB-CG2 3.66Å; F56-V101 HydrophobicContact CG-CG2 4.33Å
57	N	93.1	Very high	94.4	Very high	71 Å²	71	54.6 Å²	54.6	38%	0.38	32%	0.317	S	S	.	.			trans	-70.4	115.1	170.6	-178.9	-47.3	0	0	0	109.7	T55 D59 I60 I61	T55-N57 WeakPolarHBondContact OG1-CB 3.35Å; T55-N57 PolarHBondContact OG1-N 2.69Å; N57-D59 VanDerWaalsContact C-N 3.34Å; N57-D59 PolarHBondContact O-N 2.91Å; N57-D59 WeakPolarHBondContact OD1-CB 3.43Å; N57-D59 PolarHBondContact OD1-N 3.01Å; N57-I60 HydrophobicContact CB-CB 4.49Å; N57-I60 HydrophobicContact CB-CD1 4.05Å; N57-I60 HydrophobicContact CB-CG1 4.19Å; N57-I60 PolarHBondContact O-N 3.44Å; N57-I60 PolarHBondContact OD1-N 3.2Å; N57-I61 WeakPolarHBondContact O-CG1 3.46Å; N57-I61 PolarHBondContact O-N 3.39Å; N57-I61 VanDerWaalsContact O-N 3.11Å
58	L	92.8	Very high	94.7	Very high	58 Å²	58	51.5 Å²	51.5	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-63.6	-34.5	-174.9	-164.6	68.1	0	0	0	113	F56 I60 I61 L62 E87 A90 Y91	F56-L58 PolarHBondContact O-N 3.44Å; L58-I60 VanDerWaalsContact C-N 3.31Å; L58-I60 PolarHBondContact O-N 3.31Å; L58-I61 PolarHBondContact O-N 3.24Å; L58-L62 HydrophobicContact CG-CD1 4.06Å; L58-L62 HydrophobicContact CG-CG 4.32Å; L58-L62 WeakPolarHBondContact O-CB 3.28Å; L58-L62 VanDerWaalsContact O-CG 3.24Å; L58-L62 WeakPolarHBondContact O-CG 3.43Å; L58-L62 PolarHBondContact O-N 3.41Å; L58-E87 HydrophobicContact CD1-CG 4.33Å; L58-A90 HydrophobicContact CD1-CB 4.36Å; L58-Y91 HydrophobicContact CD2-CD2 4.17Å
59	D	93.8	Very high	94.9	Very high	110 Å²	110	55.4 Å²	55.4	59%	0.588	30%	0.3	S	S	*	.	H	α-helix	trans	-67.1	-33.3	179.9	-56	-47.8	0	0	0	112	N57 Q63	N57-D59 VanDerWaalsContact C-N 3.34Å; N57-D59 PolarHBondContact O-N 2.91Å; N57-D59 WeakPolarHBondContact OD1-CB 3.43Å; N57-D59 PolarHBondContact OD1-N 3.01Å; D59-Q63 VanDerWaalsContact O-CG 3.32Å; D59-Q63 WeakPolarHBondContact O-CG 3.5Å; D59-Q63 PolarHBondContact O-N 2.89Å; D59-Q63 PolarHBondContact O-NE2 2.76Å
60	I	95.3	Very high	94.9	Very high	35 Å²	35	54.6 Å²	54.6	18%	0.179	29%	0.285	C	S	.	.	H	α-helix	trans	-76.3	-41.3	175.6	-55.5	178.5	0	0	0	110	W50 T55 N57 L58 L62 Q63 V64	W50-I60 HydrophobicContact CB-CG2 4.28Å; W50-I60 HydrophobicContact CE3-CG2 4.05Å; T55-I60 HydrophobicContact CG2-CB 4.01Å; T55-I60 HydrophobicContact CG2-CD1 4.44Å; T55-I60 HydrophobicContact CG2-CG2 3.94Å; N57-I60 HydrophobicContact CB-CB 4.49Å; N57-I60 HydrophobicContact CB-CD1 4.05Å; N57-I60 HydrophobicContact CB-CG1 4.19Å; N57-I60 PolarHBondContact O-N 3.44Å; N57-I60 PolarHBondContact OD1-N 3.2Å; L58-I60 VanDerWaalsContact C-N 3.31Å; L58-I60 PolarHBondContact O-N 3.31Å; I60-L62 PolarHBondContact O-N 3.22Å; I60-Q63 PolarHBondContact O-N 2.9Å; I60-V64 PolarHBondContact O-N 2.95Å
61	I	97.2	Very high	94.3	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.5	-45.5	174.5	-67.6	160.3	0	0	0	111	W50 N57 L58 Q63 V64 K65 I83 E87 A90	W50-I61 HydrophobicContact CH2-CG1 4.32Å; W50-I61 HydrophobicContact CZ3-CG1 3.72Å; N57-I61 WeakPolarHBondContact O-CG1 3.46Å; N57-I61 PolarHBondContact O-N 3.39Å; N57-I61 VanDerWaalsContact O-N 3.11Å; L58-I61 PolarHBondContact O-N 3.24Å; I61-Q63 VanDerWaalsContact C-N 3.32Å; I61-Q63 PolarHBondContact O-N 2.97Å; I61-V64 PolarHBondContact O-N 3.34Å; I61-K65 WeakPolarHBondContact O-CB 3.37Å; I61-K65 PolarHBondContact O-N 2.64Å; I61-I83 HydrophobicContact CG2-CD1 3.97Å; I61-I83 HydrophobicContact CG2-CG1 4.45Å; I61-E87 HydrophobicContact CG2-CB 3.71Å; I61-E87 HydrophobicContact CG2-CG 4.28Å; I61-A90 HydrophobicContact CD1-CB 3.35Å
62	L	95.6	Very high	93.5	Very high	75 Å²	75	60.3 Å²	60.3	39%	0.393	33%	0.334	S	S	.	.	H	α-helix	trans	-64.8	-34	178.9	-73.3	171.4	0	0	0	112.5	L58 I60 K65 S66 E87	L58-L62 HydrophobicContact CG-CD1 4.06Å; L58-L62 HydrophobicContact CG-CG 4.32Å; L58-L62 WeakPolarHBondContact O-CB 3.28Å; L58-L62 VanDerWaalsContact O-CG 3.24Å; L58-L62 WeakPolarHBondContact O-CG 3.43Å; L58-L62 PolarHBondContact O-N 3.41Å; I60-L62 PolarHBondContact O-N 3.22Å; L62-K65 HydrophobicContact CD2-CD 4.42Å; L62-K65 PolarHBondContact O-N 2.9Å; L62-S66 WeakPolarHBondContact O-CB 3.13Å; L62-S66 PolarHBondContact O-N 3.48Å; L62-E87 WeakPolarHBondContact CD2-OE1 3.2Å
63	Q	96.4	Very high	92.8	Very high	93 Å²	93	59.8 Å²	59.8	44%	0.435	34%	0.342	S	S	.	.	H	α-helix	trans	-69.1	-42.1	172.9	-74.7	172	82.9	0	0	112.6	V48 D59 I60 I61 K65 S66 K67	V48-Q63 HydrophobicContact CB-CB 3.78Å; V48-Q63 HydrophobicContact CG1-CB 3.98Å; V48-Q63 HydrophobicContact CG2-CB 4.16Å; D59-Q63 VanDerWaalsContact O-CG 3.32Å; D59-Q63 WeakPolarHBondContact O-CG 3.5Å; D59-Q63 PolarHBondContact O-N 2.89Å; D59-Q63 PolarHBondContact O-NE2 2.76Å; I60-Q63 PolarHBondContact O-N 2.9Å; I61-Q63 VanDerWaalsContact C-N 3.32Å; I61-Q63 PolarHBondContact O-N 2.97Å; Q63-K65 VanDerWaalsContact C-N 3.34Å; Q63-S66 WeakPolarHBondContact O-CB 3.49Å; Q63-S66 PolarHBondContact O-N 3.19Å; Q63-K67 PolarHBondContact O-N 3.2Å
64	V	97	Very high	92.2	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-61.3	-44.7	171.5	172.7	0	0	0	0	110.1	W43 F46 V48 W50 I60 I61 S66 K67 V68 I83	W43-V64 HydrophobicContact CB-CG1 4.15Å; W43-V64 HydrophobicContact CB-CG2 4.41Å; W43-V64 HydrophobicContact CD2-CG1 3.82Å; W43-V64 HydrophobicContact CG-CG1 3.62Å; F46-V64 HydrophobicContact CD2-CG1 4.01Å; F46-V64 HydrophobicContact CE2-CG1 4.05Å; V48-V64 HydrophobicContact CG2-CB 4.48Å; V48-V64 HydrophobicContact CG2-CG2 3.46Å; V48-V64 VanDerWaalsContact CG2-CG2 3.46Å; W50-V64 HydrophobicContact CB-CG2 4Å; W50-V64 HydrophobicContact CD2-CG2 4.08Å; W50-V64 HydrophobicContact CE3-CB 4.39Å; W50-V64 HydrophobicContact CE3-CG2 3.59Å; W50-V64 HydrophobicContact CG-CG2 4.24Å; W50-V64 HydrophobicContact CZ3-CG2 4.42Å; I60-V64 PolarHBondContact O-N 2.95Å; I61-V64 PolarHBondContact O-N 3.34Å; V64-S66 VanDerWaalsContact C-N 3.32Å; V64-S66 PolarHBondContact O-N 2.94Å; V64-K67 WeakPolarHBondContact O-CB 3.34Å; V64-K67 PolarHBondContact O-N 3.27Å; V64-K67 VanDerWaalsContact O-N 3.09Å; V64-V68 HydrophobicContact CG1-CG2 4.18Å; V64-V68 WeakPolarHBondContact O-CG2 3.21Å; V64-V68 PolarHBondContact O-N 3.31Å; V64-I83 HydrophobicContact CB-CD1 3.9Å; V64-I83 HydrophobicContact CB-CG1 4.37Å; V64-I83 HydrophobicContact CG1-CD1 3.52Å; V64-I83 HydrophobicContact CG1-CG1 3.92Å
65	K	96.7	Very high	91.9	Very high	54 Å²	54	63 Å²	63	24%	0.235	36%	0.357	C	S	.	.	H	α-helix	trans	-57.5	-42.4	175.7	-175.9	174.6	168.8	177.7	0	111.9	I61 L62 Q63 K67 V68 F69 I83 E87	I61-K65 WeakPolarHBondContact O-CB 3.37Å; I61-K65 PolarHBondContact O-N 2.64Å; L62-K65 HydrophobicContact CD2-CD 4.42Å; L62-K65 PolarHBondContact O-N 2.9Å; Q63-K65 VanDerWaalsContact C-N 3.34Å; K65-K67 VanDerWaalsContact C-N 3.32Å; K65-K67 PolarHBondContact O-N 2.97Å; K65-V68 PolarHBondContact O-N 2.98Å; K65-F69 HydrophobicContact CD-CE2 4.45Å; K65-F69 HydrophobicContact CG-CD2 3.7Å; K65-F69 HydrophobicContact CG-CE2 3.77Å; K65-F69 WeakPolarHBondContact O-CB 3.45Å; K65-F69 VanDerWaalsContact O-CD2 3.3Å; K65-F69 WeakPolarHBondContact O-CD2 3.4Å; K65-F69 PolarHBondContact O-N 2.65Å; K65-I83 HydrophobicContact CB-CG1 3.94Å; K65-I83 HydrophobicContact CB-CG2 4.43Å; K65-I83 HydrophobicContact CG-CG2 4.41Å; K65-E87 VanDerWaalsContact CD-OE1 3.31Å; K65-E87 WeakPolarHBondContact CD-OE1 3.4Å; K65-E87 WeakPolarHBondContact CD-OE2 3.42Å; K65-E87 WeakPolarHBondContact CE-OE2 3.09Å; K65-E87 IonicContact NZ-OE1 3.53Å; K65-E87 PolarHBondContact NZ-OE1 2.87Å; K65-E87 IonicContact NZ-OE2 2.85Å; K65-E87 PolarHBondContact NZ-OE2 2.83Å
66	S	96	Very high	92	Very high	79 Å²	79	64.8 Å²	64.8	55%	0.552	36%	0.364	S	S	*	.	H	α-helix	trans	-59.6	-39.1	175.2	-179.2	0	0	0	0	112.8	L62 Q63 V64 S70	L62-S66 WeakPolarHBondContact O-CB 3.13Å; L62-S66 PolarHBondContact O-N 3.48Å; Q63-S66 WeakPolarHBondContact O-CB 3.49Å; Q63-S66 PolarHBondContact O-N 3.19Å; V64-S66 VanDerWaalsContact C-N 3.32Å; V64-S66 PolarHBondContact O-N 2.94Å; S66-S70 PolarHBondContact O-N 2.67Å; S66-S70 PolarHBondContact O-OG 3.19Å
67	K	95.5	Very high	91.9	Very high	95 Å²	95	69.1 Å²	69.1	41%	0.413	39%	0.393	S	S	.	.	H	α-helix	trans	-67.8	-48.7	173.2	-63.1	-69.4	-173.6	178.1	0	111.7	F46 V48 Q63 V64 K65 F69 S70	F46-K67 HydrophobicContact CB-CG 4.23Å; F46-K67 HydrophobicContact CD2-CB 3.72Å; F46-K67 HydrophobicContact CD2-CG 4.21Å; F46-K67 HydrophobicContact CE2-CB 4.01Å; F46-K67 HydrophobicContact CG-CB 4.18Å; F46-K67 HydrophobicContact CG-CG 4.36Å; V48-K67 HydrophobicContact CG1-CG 4.26Å; Q63-K67 PolarHBondContact O-N 3.2Å; V64-K67 WeakPolarHBondContact O-CB 3.34Å; V64-K67 PolarHBondContact O-N 3.27Å; V64-K67 VanDerWaalsContact O-N 3.09Å; K65-K67 VanDerWaalsContact C-N 3.32Å; K65-K67 PolarHBondContact O-N 2.97Å; K67-F69 VanDerWaalsContact C-N 3.29Å; K67-F69 PolarHBondContact O-N 3.47Å; K67-S70 VanDerWaalsContact O-CB 3.3Å; K67-S70 WeakPolarHBondContact O-CB 3.44Å; K67-S70 PolarHBondContact O-N 3.31Å; K67-S70 VanDerWaalsContact O-N 3.11Å; K67-S70 PolarHBondContact O-OG 3.29Å
68	V	96.7	Very high	91.9	Very high	3 Å²	3	69.5 Å²	69.5	2%	0.018	40%	0.396	C	S	.	.	H	α-helix	trans	-56.1	-42.7	178.5	170.1	0	0	0	0	112.1	F46 V64 K65 H76 Q79 V80 I83	F46-V68 HydrophobicContact CE2-CG2 3.91Å; F46-V68 HydrophobicContact CZ-CG2 4.5Å; V64-V68 HydrophobicContact CG1-CG2 4.18Å; V64-V68 WeakPolarHBondContact O-CG2 3.21Å; V64-V68 PolarHBondContact O-N 3.31Å; K65-V68 PolarHBondContact O-N 2.98Å; V68-H76 WeakPolarHBondContact CG1-O 3.45Å; V68-H76 PolarHBondContact O-N 2.95Å; V68-Q79 HydrophobicContact CG1-CB 4.04Å; V68-Q79 HydrophobicContact CG2-CB 4.05Å; V68-V80 HydrophobicContact CG1-CB 4.33Å; V68-V80 HydrophobicContact CG1-CG2 3.58Å; V68-I83 HydrophobicContact CB-CG2 4.06Å; V68-I83 HydrophobicContact CG1-CG2 3.8Å; V68-I83 HydrophobicContact CG2-CB 4.44Å; V68-I83 HydrophobicContact CG2-CG2 4.09Å
69	F	95.1	Very high	92.1	Very high	105 Å²	105	66.8 Å²	66.8	46%	0.461	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	7	-179.5	-77.6	-108.5	0	0	0	114.3	K65 K67 V80 I83 V84	K65-F69 HydrophobicContact CD-CE2 4.45Å; K65-F69 HydrophobicContact CG-CD2 3.7Å; K65-F69 HydrophobicContact CG-CE2 3.77Å; K65-F69 WeakPolarHBondContact O-CB 3.45Å; K65-F69 VanDerWaalsContact O-CD2 3.3Å; K65-F69 WeakPolarHBondContact O-CD2 3.4Å; K65-F69 PolarHBondContact O-N 2.65Å; K67-F69 VanDerWaalsContact C-N 3.29Å; K67-F69 PolarHBondContact O-N 3.47Å; F69-V80 HydrophobicContact CD2-CG2 4.18Å; F69-V80 HydrophobicContact CE1-CG1 4.29Å; F69-V80 HydrophobicContact CE1-CG2 4.48Å; F69-V80 HydrophobicContact CE2-CB 4.38Å; F69-V80 HydrophobicContact CE2-CG1 4Å; F69-V80 HydrophobicContact CE2-CG2 3.92Å; F69-V80 HydrophobicContact CZ-CB 4.41Å; F69-V80 HydrophobicContact CZ-CG1 3.6Å; F69-V80 HydrophobicContact CZ-CG2 4.1Å; F69-I83 HydrophobicContact CE2-CG2 4.2Å; F69-V84 HydrophobicContact CE2-CG2 3.96Å; F69-V84 HydrophobicContact CZ-CG2 3.81Å
70	S	92.6	Very high	92.3	Very high	40 Å²	40	63.4 Å²	63.4	28%	0.28	36%	0.364	S	S	.	.			trans	-63.8	136.3	179.4	-74.1	0	0	0	0	111.6	S66 K67 G75	S66-S70 PolarHBondContact O-N 2.67Å; S66-S70 PolarHBondContact O-OG 3.19Å; K67-S70 VanDerWaalsContact O-CB 3.3Å; K67-S70 WeakPolarHBondContact O-CB 3.44Å; K67-S70 PolarHBondContact O-N 3.31Å; K67-S70 VanDerWaalsContact O-N 3.11Å; K67-S70 PolarHBondContact O-OG 3.29Å; S70-G75 WeakPolarHBondContact O-CA 3.42Å; S70-G75 PolarHBondContact O-N 3.44Å
71	P	83.2	Confident	92.4	Very high	124 Å²	124	63.1 Å²	63.1	81%	0.805	37%	0.365	S	S	*	.	S	Bend	trans	-74	149.1	-177.4	29.5	-35	0	0	0	112.7
72	G	77.9	Confident	92.4	Very high	60 Å²	60	63.9 Å²	63.9	62%	0.619	37%	0.368	S	S	*	.	S	Bend	trans	83.4	-157.4	176.8	0	0	0	0	0	113.9	H74 G75	G72-H74 PolarHBondContact O-N 3.05Å; G72-G75 PolarHBondContact O-N 3.46Å
73	P	77.4	Confident	92.5	Very high	123 Å²	123	60.3 Å²	60.3	80%	0.799	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	5.9	-170.8	32.6	-37.9	0	0	0	114.6
74	H	80.1	Confident	92.5	Very high	146 Å²	146	57.1 Å²	57.1	68%	0.676	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	2.6	178.1	-55.2	-52.4	0	0	0	113	G72	G72-H74 PolarHBondContact O-N 3.05Å
75	G	89	Confident	92.6	Very high	17 Å²	17	57.1 Å²	57.1	18%	0.175	34%	0.336	C	S	.	.			trans	-87.6	158.3	169.9	0	0	0	0	0	112.5	S70 G72 P77	S70-G75 WeakPolarHBondContact O-CA 3.42Å; S70-G75 PolarHBondContact O-N 3.44Å; G72-G75 PolarHBondContact O-N 3.46Å; G75-P77 VanDerWaalsContact C-CD 3.49Å; G75-P77 WeakPolarHBondContact O-CD 3.34Å
76	H	95.1	Very high	92.6	Very high	59 Å²	59	54.5 Å²	54.5	27%	0.273	33%	0.325	S	S	.	.			trans	-123.2	69.2	-178.3	-65	-94.1	0	0	0	110.8	F46 V68 D78 Q79	F46-H76 AromaticContact CE1-CD2 3.88Å; F46-H76 AromaticContact CE1-CE1 3.95Å; F46-H76 AromaticContact CE1-NE2 3.51Å; F46-H76 AromaticContact CZ-CD2 3.58Å; F46-H76 AromaticContact CZ-CG 3.96Å; F46-H76 AromaticContact CZ-NE2 3.73Å; V68-H76 WeakPolarHBondContact CG1-O 3.45Å; V68-H76 PolarHBondContact O-N 2.95Å; H76-D78 PolarHBondContact O-N 3.2Å; H76-D78 VanDerWaalsContact O-N 3.11Å; H76-Q79 HydrophobicContact CB-CB 4.03Å; H76-Q79 HydrophobicContact CB-CG 3.88Å; H76-Q79 WeakPolarHBondContact O-CB 3.32Å; H76-Q79 PolarHBondContact O-N 2.91Å
77	P	92.7	Very high	92.6	Very high	104 Å²	104	52.2 Å²	52.2	68%	0.675	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-23	-172.2	24.7	-34.6	0	0	0	114.2	G75 Q79	G75-P77 VanDerWaalsContact C-CD 3.49Å; G75-P77 WeakPolarHBondContact O-CD 3.34Å; P77-Q79 VanDerWaalsContact C-N 3.32Å
78	D	94.4	Very high	92.7	Very high	80 Å²	80	48.7 Å²	48.7	43%	0.428	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-17.9	174.2	71.9	-45.8	0	0	0	113.7	R34 H76	R34-D78 IonicContact CZ-OD2 3.78Å; R34-D78 IonicContact NH1-OD2 3.71Å; R34-D78 PolarHBondContact NH1-OD2 3.01Å; R34-D78 IonicContact NH2-OD2 3.91Å; H76-D78 PolarHBondContact O-N 3.2Å; H76-D78 VanDerWaalsContact O-N 3.11Å
79	Q	97.3	Very high	92.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-14.1	174.5	-62.6	-178.8	7.6	0	0	113.3	F38 E42 W43 F46 V68 H76 P77 Y82 I83	F38-Q79 HydrophobicContact CD1-CG 3.8Å; F38-Q79 HydrophobicContact CD2-CG 4.11Å; F38-Q79 HydrophobicContact CE1-CG 3.55Å; F38-Q79 HydrophobicContact CE2-CB 4.33Å; F38-Q79 HydrophobicContact CE2-CG 3.87Å; F38-Q79 HydrophobicContact CG-CG 4.07Å; F38-Q79 HydrophobicContact CZ-CB 4.44Å; F38-Q79 HydrophobicContact CZ-CG 3.57Å; E42-Q79 PolarHBondContact OE2-NE2 2.76Å; W43-Q79 VanDerWaalsContact CD1-OE1 3.25Å; F46-Q79 VanDerWaalsContact CZ-OE1 3.28Å; V68-Q79 HydrophobicContact CG1-CB 4.04Å; V68-Q79 HydrophobicContact CG2-CB 4.05Å; H76-Q79 HydrophobicContact CB-CB 4.03Å; H76-Q79 HydrophobicContact CB-CG 3.88Å; H76-Q79 WeakPolarHBondContact O-CB 3.32Å; H76-Q79 PolarHBondContact O-N 2.91Å; P77-Q79 VanDerWaalsContact C-N 3.32Å; Q79-Y82 WeakPolarHBondContact O-CB 3.42Å; Q79-Y82 PolarHBondContact O-N 2.78Å; Q79-I83 PolarHBondContact O-N 3.48Å; Q79-I83 VanDerWaalsContact O-N 3.15Å
80	V	96.7	Very high	92.6	Very high	39 Å²	39	43.9 Å²	43.9	24%	0.236	27%	0.273	C	S	.	.	H	α-helix	trans	-51.3	-49.8	-177.8	166.3	0	0	0	0	113.3	V68 F69 Y82 V84	V68-V80 HydrophobicContact CG1-CB 4.33Å; V68-V80 HydrophobicContact CG1-CG2 3.58Å; F69-V80 HydrophobicContact CD2-CG2 4.18Å; F69-V80 HydrophobicContact CE1-CG1 4.29Å; F69-V80 HydrophobicContact CE1-CG2 4.48Å; F69-V80 HydrophobicContact CE2-CB 4.38Å; F69-V80 HydrophobicContact CE2-CG1 4Å; F69-V80 HydrophobicContact CE2-CG2 3.92Å; F69-V80 HydrophobicContact CZ-CB 4.41Å; F69-V80 HydrophobicContact CZ-CG1 3.6Å; F69-V80 HydrophobicContact CZ-CG2 4.1Å; V80-Y82 PolarHBondContact O-N 3.21Å; V80-Y82 VanDerWaalsContact O-N 3.14Å; V80-V84 HydrophobicContact CG1-CG2 4.36Å; V80-V84 WeakPolarHBondContact O-CB 3.4Å; V80-V84 WeakPolarHBondContact O-CG2 3.48Å; V80-V84 PolarHBondContact O-N 3.42Å
81	P	97.6	Very high	92.5	Very high	29 Å²	29	48 Å²	48	19%	0.188	28%	0.284	C	S	.	.	H	α-helix	trans	-52.6	-36	175.7	-32.1	39.2	0	0	0	114.5	V28 D29 V30 T85	V28-P81 HydrophobicContact CB-CB 3.89Å; V28-P81 HydrophobicContact CB-CG 4.36Å; V28-P81 HydrophobicContact CG1-CB 4.48Å; V28-P81 HydrophobicContact CG2-CB 4.18Å; D29-P81 WeakPolarHBondContact O-CB 3.48Å; V30-P81 HydrophobicContact CG1-CB 3.99Å; V30-P81 WeakPolarHBondContact CG1-O 3.47Å; P81-T85 VanDerWaalsContact O-CB 3.31Å; P81-T85 WeakPolarHBondContact O-CB 3.37Å; P81-T85 PolarHBondContact O-N 3.21Å; P81-T85 PolarHBondContact O-OG1 3.06Å
82	Y	98.1	Very high	92.9	Very high	16 Å²	16	49.2 Å²	49.2	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-81.8	-46.6	-168.9	-61.4	-103.3	0	0	0	110.4	V30 K31 R34 W35 F38 Q79 V80 T85 W86	V30-Y82 HydrophobicContact CB-CD1 4.1Å; V30-Y82 HydrophobicContact CB-CE1 3.9Å; V30-Y82 HydrophobicContact CG1-CD1 4.06Å; V30-Y82 HydrophobicContact CG1-CD2 4.44Å; V30-Y82 HydrophobicContact CG1-CE1 4.22Å; V30-Y82 HydrophobicContact CG1-CG 4.14Å; K31-Y82 PolarHBondContact N-OH 3.15Å; R34-Y82 HydrophobicContact CB-CD1 4.4Å; R34-Y82 HydrophobicContact CB-CE1 3.52Å; W35-Y82 HydrophobicContact CB-CD1 4.27Å; W35-Y82 HydrophobicContact CB-CE1 4.48Å; W35-Y82 AromaticContact CE3-CD1 3.89Å; W35-Y82 HydrophobicContact CE3-CD1 3.89Å; W35-Y82 WeakPolarHBondContact CZ3-O 3.31Å; F38-Y82 AromaticContact CD2-CD1 3.71Å; F38-Y82 HydrophobicContact CD2-CD1 3.71Å; F38-Y82 AromaticContact CD2-CD2 3.8Å; F38-Y82 HydrophobicContact CD2-CD2 3.8Å; F38-Y82 HydrophobicContact CD2-CE1 4.22Å; F38-Y82 HydrophobicContact CD2-CE2 4.32Å; F38-Y82 AromaticContact CD2-CG 3.5Å; F38-Y82 HydrophobicContact CD2-CG 3.5Å; F38-Y82 HydrophobicContact CE2-CD1 4.04Å; F38-Y82 AromaticContact CE2-CD2 3.47Å; F38-Y82 HydrophobicContact CE2-CD2 3.47Å; F38-Y82 VanDerWaalsContact CE2-CD2 3.47Å; F38-Y82 HydrophobicContact CE2-CE1 4.2Å; F38-Y82 AromaticContact CE2-CE2 3.68Å; F38-Y82 HydrophobicContact CE2-CE2 3.68Å; F38-Y82 AromaticContact CE2-CG 3.71Å; F38-Y82 HydrophobicContact CE2-CG 3.71Å; Q79-Y82 WeakPolarHBondContact O-CB 3.42Å; Q79-Y82 PolarHBondContact O-N 2.78Å; V80-Y82 PolarHBondContact O-N 3.21Å; V80-Y82 VanDerWaalsContact O-N 3.14Å; Y82-T85 PolarHBondContact O-N 3.1Å; Y82-W86 WeakPolarHBondContact O-CB 3.38Å; Y82-W86 PolarHBondContact O-N 3.03Å
83	I	97.4	Very high	93.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-71.2	-34.6	179.1	-164.6	60.2	0	0	0	112.3	W43 W50 I61 V64 K65 V68 F69 Q79 W86 E87	W43-I83 HydrophobicContact CE3-CD1 4.42Å; W43-I83 HydrophobicContact CH2-CB 4.17Å; W43-I83 HydrophobicContact CH2-CD1 3.93Å; W43-I83 HydrophobicContact CZ2-CB 3.81Å; W43-I83 HydrophobicContact CZ2-CD1 4.08Å; W43-I83 HydrophobicContact CZ2-CG1 4.49Å; W43-I83 HydrophobicContact CZ3-CD1 4.11Å; W50-I83 HydrophobicContact CZ3-CD1 4.43Å; I61-I83 HydrophobicContact CG2-CD1 3.97Å; I61-I83 HydrophobicContact CG2-CG1 4.45Å; V64-I83 HydrophobicContact CB-CD1 3.9Å; V64-I83 HydrophobicContact CB-CG1 4.37Å; V64-I83 HydrophobicContact CG1-CD1 3.52Å; V64-I83 HydrophobicContact CG1-CG1 3.92Å; K65-I83 HydrophobicContact CB-CG1 3.94Å; K65-I83 HydrophobicContact CB-CG2 4.43Å; K65-I83 HydrophobicContact CG-CG2 4.41Å; V68-I83 HydrophobicContact CB-CG2 4.06Å; V68-I83 HydrophobicContact CG1-CG2 3.8Å; V68-I83 HydrophobicContact CG2-CB 4.44Å; V68-I83 HydrophobicContact CG2-CG2 4.09Å; F69-I83 HydrophobicContact CE2-CG2 4.2Å; Q79-I83 PolarHBondContact O-N 3.48Å; Q79-I83 VanDerWaalsContact O-N 3.15Å; I83-W86 PolarHBondContact O-N 3.49Å; I83-E87 VanDerWaalsContact O-CB 3.28Å; I83-E87 WeakPolarHBondContact O-CB 3.23Å; I83-E87 PolarHBondContact O-N 3.31Å
84	V	97	Very high	94.2	Very high	26 Å²	26	42.7 Å²	42.7	16%	0.158	23%	0.225	C	C	.	.	H	α-helix	trans	-66.6	-40.5	174.7	172	0	0	0	0	111.2	F69 V80 E87 A88	F69-V84 HydrophobicContact CE2-CG2 3.96Å; F69-V84 HydrophobicContact CZ-CG2 3.81Å; V80-V84 HydrophobicContact CG1-CG2 4.36Å; V80-V84 WeakPolarHBondContact O-CB 3.4Å; V80-V84 WeakPolarHBondContact O-CG2 3.48Å; V80-V84 PolarHBondContact O-N 3.42Å; V84-E87 PolarHBondContact O-N 3.2Å; V84-A88 WeakPolarHBondContact O-CB 3.35Å; V84-A88 PolarHBondContact O-N 2.98Å
85	T	97.4	Very high	94.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-40.7	174.3	-59.8	0	0	0	0	111.2	V19 I22 A23 W35 P81 Y82 A88 I89	V19-T85 HydrophobicContact CG1-CG2 3.97Å; I22-T85 HydrophobicContact CG2-CG2 4.36Å; A23-T85 WeakPolarHBondContact CA-OG1 3.06Å; A23-T85 HydrophobicContact CB-CG2 3.85Å; A23-T85 WeakPolarHBondContact CB-OG1 3.34Å; W35-T85 HydrophobicContact CH2-CG2 3.82Å; W35-T85 HydrophobicContact CZ3-CG2 3.77Å; P81-T85 VanDerWaalsContact O-CB 3.31Å; P81-T85 WeakPolarHBondContact O-CB 3.37Å; P81-T85 PolarHBondContact O-N 3.21Å; P81-T85 PolarHBondContact O-OG1 3.06Å; Y82-T85 PolarHBondContact O-N 3.1Å; T85-A88 PolarHBondContact O-N 2.85Å; T85-I89 HydrophobicContact CG2-CD1 3.99Å; T85-I89 WeakPolarHBondContact O-CD1 3.45Å; T85-I89 VanDerWaalsContact O-CG1 3.24Å; T85-I89 WeakPolarHBondContact O-CG1 3.42Å; T85-I89 PolarHBondContact O-N 2.94Å
86	W	97.4	Very high	94.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67	-38.6	177.8	-154.7	-59.4	0	0	0	112.3	P8 L9 W35 C39 W43 W50 T55 F56 Y82 I83 I89 A90	P8-W86 HydrophobicContact CB-CZ2 4.2Å; L9-W86 HydrophobicContact CB-CH2 4.3Å; L9-W86 HydrophobicContact CD1-CH2 4.04Å; L9-W86 HydrophobicContact CD1-CZ3 4.34Å; W35-W86 AromaticContact CD1-CZ3 3.94Å; W35-W86 HydrophobicContact CD2-CE3 4.08Å; W35-W86 HydrophobicContact CD2-CZ3 4.08Å; W35-W86 AromaticContact CE2-CE3 3.38Å; W35-W86 AromaticContact CE2-CZ3 3.33Å; W35-W86 HydrophobicContact CE3-CE3 4.48Å; W35-W86 HydrophobicContact CG-CZ3 4.43Å; W35-W86 HydrophobicContact CH2-CB 3.93Å; W35-W86 HydrophobicContact CH2-CD2 4.07Å; W35-W86 AromaticContact CH2-CE3 3.6Å; W35-W86 HydrophobicContact CH2-CE3 3.6Å; W35-W86 HydrophobicContact CH2-CG 4.27Å; W35-W86 HydrophobicContact CH2-CZ3 4.4Å; W35-W86 HydrophobicContact CZ2-CB 4.49Å; W35-W86 AromaticContact CZ2-CD2 3.74Å; W35-W86 HydrophobicContact CZ2-CD2 3.74Å; W35-W86 AromaticContact CZ2-CE3 3.12Å; W35-W86 HydrophobicContact CZ2-CE3 3.12Å; W35-W86 HydrophobicContact CZ2-CG 4.35Å; W35-W86 HydrophobicContact CZ2-CH2 4.4Å; W35-W86 AromaticContact CZ2-CZ3 3.53Å; W35-W86 HydrophobicContact CZ2-CZ3 3.53Å; W35-W86 HydrophobicContact CZ3-CE3 4.26Å; W35-W86 AromaticContact NE1-CE3 3.84Å; W35-W86 AromaticContact NE1-CH2 3.91Å; W35-W86 AromaticContact NE1-CZ3 3.24Å; C39-W86 HydrophobicContact CB-CH2 3.92Å; C39-W86 HydrophobicContact CB-CZ3 3.7Å; C39-W86 WeakPolarHBondContact SG-CH2 3.46Å; W43-W86 HydrophobicContact CH2-CE3 4.15Å; W43-W86 HydrophobicContact CZ3-CD2 4.11Å; W43-W86 AromaticContact CZ3-CE3 3.63Å; W43-W86 HydrophobicContact CZ3-CE3 3.63Å; W43-W86 HydrophobicContact CZ3-CZ3 4.2Å; W50-W86 AromaticContact CH2-CD1 3.91Å; W50-W86 AromaticContact CH2-CD2 3.93Å; W50-W86 HydrophobicContact CH2-CD2 3.93Å; W50-W86 AromaticContact CH2-CE2 3.72Å; W50-W86 HydrophobicContact CH2-CG 4.1Å; W50-W86 HydrophobicContact CH2-CZ2 4.24Å; W50-W86 AromaticContact CH2-NE1 3.66Å; W50-W86 HydrophobicContact CZ2-CD2 4.27Å; W50-W86 AromaticContact CZ2-CE2 3.97Å; W50-W86 HydrophobicContact CZ2-CH2 4.36Å; W50-W86 HydrophobicContact CZ2-CZ2 4.04Å; T55-W86 PolarHBondContact O-NE1 2.89Å; F56-W86 AromaticContact CD1-NE1 3.86Å; F56-W86 AromaticContact CE1-NE1 3.97Å; Y82-W86 WeakPolarHBondContact O-CB 3.38Å; Y82-W86 PolarHBondContact O-N 3.03Å; I83-W86 PolarHBondContact O-N 3.49Å; W86-I89 PolarHBondContact O-N 3.47Å; W86-A90 PolarHBondContact O-N 3.5Å; W86-A90 VanDerWaalsContact O-N 3.1Å
87	E	96.9	Very high	94.7	Very high	31 Å²	31	38.3 Å²	38.3	15%	0.145	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-47.4	171.2	179.5	-172.8	-141.1	0	0	112	L58 I61 L62 K65 I83 V84 I89 A90 Y91	L58-E87 HydrophobicContact CD1-CG 4.33Å; I61-E87 HydrophobicContact CG2-CB 3.71Å; I61-E87 HydrophobicContact CG2-CG 4.28Å; L62-E87 WeakPolarHBondContact CD2-OE1 3.2Å; K65-E87 VanDerWaalsContact CD-OE1 3.31Å; K65-E87 WeakPolarHBondContact CD-OE1 3.4Å; K65-E87 WeakPolarHBondContact CD-OE2 3.42Å; K65-E87 WeakPolarHBondContact CE-OE2 3.09Å; K65-E87 IonicContact NZ-OE1 3.53Å; K65-E87 PolarHBondContact NZ-OE1 2.87Å; K65-E87 IonicContact NZ-OE2 2.85Å; K65-E87 PolarHBondContact NZ-OE2 2.83Å; I83-E87 VanDerWaalsContact O-CB 3.28Å; I83-E87 WeakPolarHBondContact O-CB 3.23Å; I83-E87 PolarHBondContact O-N 3.31Å; V84-E87 PolarHBondContact O-N 3.2Å; E87-I89 VanDerWaalsContact C-N 3.29Å; E87-I89 PolarHBondContact O-N 3.06Å; E87-A90 PolarHBondContact O-N 2.81Å; E87-A90 VanDerWaalsContact O-N 3.1Å; E87-Y91 VanDerWaalsContact O-CB 3.29Å; E87-Y91 WeakPolarHBondContact O-CB 3.13Å; E87-Y91 PolarHBondContact O-N 3.25Å
88	A	96.1	Very high	94.4	Very high	20 Å²	20	39.6 Å²	39.6	17%	0.165	20%	0.203	C	C	.	.	H	α-helix	trans	-58.9	-41.4	176.4	0	0	0	0	0	111.9	I22 Q26 V84 T85 A90 Y91 E92	I22-A88 HydrophobicContact CG2-CB 3.76Å; Q26-A88 HydrophobicContact CG-CB 4.34Å; V84-A88 WeakPolarHBondContact O-CB 3.35Å; V84-A88 PolarHBondContact O-N 2.98Å; T85-A88 PolarHBondContact O-N 2.85Å; A88-A90 VanDerWaalsContact C-N 3.3Å; A88-A90 PolarHBondContact O-N 2.9Å; A88-Y91 PolarHBondContact O-N 3.37Å; A88-E92 PolarHBondContact O-N 2.88Å
89	I	96	Very high	94	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-31.4	176.4	-68.5	163.2	0	0	0	112.4	T12 V19 I22 W35 F56 T85 W86 E87 P93 W96 V97	T12-I89 HydrophobicContact CG2-CD1 4.43Å; V19-I89 HydrophobicContact CB-CD1 4.34Å; V19-I89 HydrophobicContact CG1-CD1 4.05Å; V19-I89 HydrophobicContact CG2-CD1 3.86Å; I22-I89 HydrophobicContact CD1-CG1 3.76Å; I22-I89 HydrophobicContact CG2-CG1 4.16Å; W35-I89 HydrophobicContact CH2-CD1 3.89Å; W35-I89 HydrophobicContact CZ2-CD1 4.13Å; F56-I89 HydrophobicContact CD1-CG2 4.32Å; F56-I89 HydrophobicContact CE1-CG2 3.78Å; T85-I89 HydrophobicContact CG2-CD1 3.99Å; T85-I89 WeakPolarHBondContact O-CD1 3.45Å; T85-I89 VanDerWaalsContact O-CG1 3.24Å; T85-I89 WeakPolarHBondContact O-CG1 3.42Å; T85-I89 PolarHBondContact O-N 2.94Å; W86-I89 PolarHBondContact O-N 3.47Å; E87-I89 VanDerWaalsContact C-N 3.29Å; E87-I89 PolarHBondContact O-N 3.06Å; I89-P93 VanDerWaalsContact O-CA 3.3Å; I89-P93 WeakPolarHBondContact O-CA 3.42Å; I89-W96 HydrophobicContact CG2-CH2 4.31Å; I89-V97 HydrophobicContact CG2-CG1 4.36Å; I89-V97 HydrophobicContact CG2-CG2 3.79Å
90	A	94.2	Very high	93.3	Very high	7 Å²	7	45.2 Å²	45.2	6%	0.058	24%	0.235	C	C	.	.	H	α-helix	trans	-85.7	-32.5	176.7	0	0	0	0	0	113.4	F56 L58 I61 W86 E87 A88	F56-A90 HydrophobicContact CB-CB 4.32Å; L58-A90 HydrophobicContact CD1-CB 4.36Å; I61-A90 HydrophobicContact CD1-CB 3.35Å; W86-A90 PolarHBondContact O-N 3.5Å; W86-A90 VanDerWaalsContact O-N 3.1Å; E87-A90 PolarHBondContact O-N 2.81Å; E87-A90 VanDerWaalsContact O-N 3.1Å; A88-A90 VanDerWaalsContact C-N 3.3Å; A88-A90 PolarHBondContact O-N 2.9Å
91	Y	91.1	Very high	92.6	Very high	128 Å²	128	45.1 Å²	45.1	50%	0.502	23%	0.234	S	C	.	.	H	α-helix	trans	-79.5	-42.3	-176.8	-176.9	-97.6	0	0	0	112.8	L58 E87 A88 P93	L58-Y91 HydrophobicContact CD2-CD2 4.17Å; E87-Y91 VanDerWaalsContact O-CB 3.29Å; E87-Y91 WeakPolarHBondContact O-CB 3.13Å; E87-Y91 PolarHBondContact O-N 3.25Å; A88-Y91 PolarHBondContact O-N 3.37Å; Y91-P93 VanDerWaalsContact C-CD 3.46Å; Y91-P93 WeakPolarHBondContact O-CD 3.46Å
92	E	90.4	Very high	91	Very high	149 Å²	149	48.8 Å²	48.8	70%	0.696	26%	0.26	S	S	*	.	S	Bend	trans	-120.3	72.9	174.1	-82	175.5	-153.1	0	0	110.2	A88 P94	A88-E92 PolarHBondContact O-N 2.88Å; E92-P94 WeakPolarHBondContact O-CD 3.4Å
93	P	91.3	Very high	88.8	Confident	28 Å²	28	53.8 Å²	53.8	18%	0.182	30%	0.295	C	S	.	.			trans	-62	125.6	-168.1	21.4	-33.1	0	0	0	113.6	I89 Y91 V97 K98 V101	I89-P93 VanDerWaalsContact O-CA 3.3Å; I89-P93 WeakPolarHBondContact O-CA 3.42Å; Y91-P93 VanDerWaalsContact C-CD 3.46Å; Y91-P93 WeakPolarHBondContact O-CD 3.46Å; P93-V97 HydrophobicContact CB-CB 3.84Å; P93-V97 HydrophobicContact CB-CG1 3.75Å; P93-K98 HydrophobicContact CB-CG 3.97Å; P93-K98 HydrophobicContact CG-CG 3.99Å; P93-K98 WeakPolarHBondContact O-CE 3.17Å; P93-K98 WeakPolarHBondContact O-CG 3.39Å; P93-V101 HydrophobicContact CB-CG2 4.25Å; P93-V101 HydrophobicContact CG-CB 4.46Å
94	P	91.3	Very high	86.2	Confident	17 Å²	17	61.8 Å²	61.8	11%	0.11	33%	0.33	C	S	.	.			trans	-56.5	161.6	166.7	-27.4	36.7	0	0	0	112.5	I22 E92 W96 V97 K98	I22-P94 HydrophobicContact CD1-CG 3.65Å; E92-P94 WeakPolarHBondContact O-CD 3.4Å; P94-W96 HydrophobicContact CB-CD2 4.23Å; P94-W96 HydrophobicContact CB-CG 4.34Å; P94-W96 HydrophobicContact CB-CZ2 4.03Å; P94-W96 HydrophobicContact CG-CZ2 3.95Å; P94-W96 PolarHBondContact O-N 3.02Å; P94-V97 HydrophobicContact CB-CG2 4.41Å; P94-V97 HydrophobicContact CG-CG2 4.36Å; P94-V97 WeakPolarHBondContact O-CA 3.32Å; P94-V97 PolarHBondContact O-N 3.16Å; P94-K98 WeakPolarHBondContact O-CG 3.33Å; P94-K98 PolarHBondContact O-N 3.26Å
95	P	90.8	Very high	83.3	Confident	102 Å²	102	68.9 Å²	68.9	66%	0.662	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-33.7	-177.3	-28.1	36.1	0	0	0	115
96	W	92.4	Very high	80	Confident	28 Å²	28	73.6 Å²	73.6	11%	0.106	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-15.6	176.6	49.5	-92.1	0	0	0	114.3	L11 T12 H15 D18 V19 I89 P94 F100	L11-W96 HydrophobicContact CB-CE3 4.08Å; L11-W96 HydrophobicContact CB-CZ3 4.07Å; L11-W96 HydrophobicContact CD2-CE3 4.46Å; T12-W96 HydrophobicContact CG2-CH2 4.1Å; T12-W96 HydrophobicContact CG2-CZ3 4.04Å; H15-W96 HydrophobicContact CB-CD2 3.62Å; H15-W96 HydrophobicContact CB-CE3 3.97Å; H15-W96 HydrophobicContact CB-CG 4.23Å; H15-W96 HydrophobicContact CB-CH2 3.85Å; H15-W96 HydrophobicContact CB-CZ2 3.45Å; H15-W96 VanDerWaalsContact CB-CZ2 3.45Å; H15-W96 HydrophobicContact CB-CZ3 4.08Å; H15-W96 AromaticContact CD2-CD1 3.96Å; H15-W96 AromaticContact CD2-CD2 3.36Å; H15-W96 AromaticContact CD2-CE3 3.55Å; H15-W96 AromaticContact CD2-CG 3.43Å; H15-W96 VanDerWaalsContact CD2-CG 3.43Å; H15-W96 AromaticContact CE1-CD1 3.81Å; H15-W96 AromaticContact CE1-CG 3.79Å; H15-W96 AromaticContact CG-CD1 3.63Å; H15-W96 AromaticContact CG-CD2 3.42Å; H15-W96 VanDerWaalsContact CG-CD2 3.42Å; H15-W96 AromaticContact CG-CE2 3.55Å; H15-W96 AromaticContact CG-CE3 3.91Å; H15-W96 AromaticContact CG-CG 3.55Å; H15-W96 AromaticContact CG-NE1 3.61Å; H15-W96 AromaticContact ND1-CD1 3.53Å; H15-W96 AromaticContact ND1-CG 3.78Å; H15-W96 AromaticContact ND1-NE1 3.77Å; H15-W96 WeakPolarHBondContact NE2-CB 3.39Å; H15-W96 AromaticContact NE2-CG 3.58Å; D18-W96 HydrophobicContact CB-CZ2 3.89Å; D18-W96 PolarHBondContact OD2-NE1 2.95Å; V19-W96 HydrophobicContact CG2-CH2 4Å; V19-W96 HydrophobicContact CG2-CZ2 4.43Å; I89-W96 HydrophobicContact CG2-CH2 4.31Å; P94-W96 HydrophobicContact CB-CD2 4.23Å; P94-W96 HydrophobicContact CB-CG 4.34Å; P94-W96 HydrophobicContact CB-CZ2 4.03Å; P94-W96 HydrophobicContact CG-CZ2 3.95Å; P94-W96 PolarHBondContact O-N 3.02Å; W96-F100 WeakPolarHBondContact O-CD2 3.29Å; W96-F100 WeakPolarHBondContact O-CE2 3.5Å
97	V	92.2	Very high	77.1	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-29.6	175.9	-177.2	0	0	0	0	112.3	F56 I89 P93 P94 P99 F100 V101	F56-V97 HydrophobicContact CD1-CG1 4.06Å; F56-V97 HydrophobicContact CD2-CG1 3.89Å; F56-V97 HydrophobicContact CE1-CG1 4.1Å; F56-V97 HydrophobicContact CE1-CG2 4.48Å; F56-V97 HydrophobicContact CE2-CG1 3.92Å; F56-V97 HydrophobicContact CG-CG1 3.96Å; F56-V97 HydrophobicContact CZ-CG1 4.03Å; F56-V97 HydrophobicContact CZ-CG2 4.13Å; I89-V97 HydrophobicContact CG2-CG1 4.36Å; I89-V97 HydrophobicContact CG2-CG2 3.79Å; P93-V97 HydrophobicContact CB-CB 3.84Å; P93-V97 HydrophobicContact CB-CG1 3.75Å; P94-V97 HydrophobicContact CB-CG2 4.41Å; P94-V97 HydrophobicContact CG-CG2 4.36Å; P94-V97 WeakPolarHBondContact O-CA 3.32Å; P94-V97 PolarHBondContact O-N 3.16Å; V97-P99 VanDerWaalsContact C-N 3.29Å; V97-P99 VanDerWaalsContact O-N 3.11Å; V97-F100 WeakPolarHBondContact O-CA 3.46Å; V97-F100 PolarHBondContact O-N 2.91Å; V97-V101 HydrophobicContact CG1-CG2 3.75Å; V97-V101 PolarHBondContact O-N 3.44Å
98	K	86.8	Confident	73.9	Confident	131 Å²	131	83.1 Å²	83.1	57%	0.57	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-48.7	-36.9	-178.4	-73.8	180	-173.1	-173.3	0	115.4	P93 P94 F100	P93-K98 HydrophobicContact CB-CG 3.97Å; P93-K98 HydrophobicContact CG-CG 3.99Å; P93-K98 WeakPolarHBondContact O-CE 3.17Å; P93-K98 WeakPolarHBondContact O-CG 3.39Å; P94-K98 WeakPolarHBondContact O-CG 3.33Å; P94-K98 PolarHBondContact O-N 3.26Å; K98-F100 PolarHBondContact O-N 3.2Å
99	P	86.3	Confident	71.2	Confident	102 Å²	102	87.9 Å²	87.9	66%	0.662	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-69	-18.3	175.8	-21	34.4	0	0	0	114.9	V97	V97-P99 VanDerWaalsContact C-N 3.29Å; V97-P99 VanDerWaalsContact O-N 3.11Å
100	F	82.4	Confident	68.2	Low	97 Å²	97	94.2 Å²	94.2	43%	0.425	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-106.9	-5.1	-172.8	-56.2	-86.1	0	0	0	113.5	T6 L11 F56 W96 V97 K98	T6-F100 HydrophobicContact CG2-CE1 4.25Å; T6-F100 HydrophobicContact CG2-CZ 3.89Å; L11-F100 HydrophobicContact CD1-CD1 4.22Å; L11-F100 HydrophobicContact CD1-CD2 3.63Å; L11-F100 HydrophobicContact CD1-CE1 4.2Å; L11-F100 HydrophobicContact CD1-CE2 3.61Å; L11-F100 HydrophobicContact CD1-CG 3.95Å; L11-F100 HydrophobicContact CD1-CZ 3.9Å; L11-F100 HydrophobicContact CD2-CE2 4.07Å; L11-F100 HydrophobicContact CD2-CZ 4.45Å; L11-F100 HydrophobicContact CG-CE2 4.49Å; F56-F100 HydrophobicContact CD2-CB 3.88Å; F56-F100 HydrophobicContact CE2-CB 4.18Å; W96-F100 WeakPolarHBondContact O-CD2 3.29Å; W96-F100 WeakPolarHBondContact O-CE2 3.5Å; V97-F100 WeakPolarHBondContact O-CA 3.46Å; V97-F100 PolarHBondContact O-N 2.91Å; K98-F100 PolarHBondContact O-N 3.2Å
101	V	81.8	Confident	65.4	Low	37 Å²	37	97.4 Å²	97.4	22%	0.224	56%	0.56	C	S	.	*	S	Bend	trans	-103.3	118.1	171.9	171.1	0	0	0	0	108.4	F56 P93 V97	F56-V101 HydrophobicContact CB-CG2 3.66Å; F56-V101 HydrophobicContact CG-CG2 4.33Å; P93-V101 HydrophobicContact CB-CG2 4.25Å; P93-V101 HydrophobicContact CG-CB 4.46Å; V97-V101 HydrophobicContact CG1-CG2 3.75Å; V97-V101 PolarHBondContact O-N 3.44Å
102	S	63.4	Low	63	Low	106 Å²	106	97.1 Å²	97.1	74%	0.741	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-53.7	133.1	175.1	-61.3	0	0	0	0	110.6	K104	S102-K104 PolarHBondContact O-N 2.85Å
103	P	52.7	Low	60.3	Low	120 Å²	120	97.6 Å²	97.6	78%	0.779	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-53.1	135.6	176.9	-27	34.8	0	0	0	111.5	L105	P103-L105 PolarHBondContact O-N 3.45Å
104	K	43	Very low	57.4	Low	169 Å²	169	103.3 Å²	103.3	74%	0.735	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-49.9	119.5	168.8	-95.1	176.8	173.9	167.8	0	108.2	S102 S106	S102-K104 PolarHBondContact O-N 2.85Å; K104-S106 PolarHBondContact O-N 3.14Å
105	L	35.4	Very low	55	Low	175 Å²	175	108.4 Å²	108.4	92%	0.916	64%	0.641	S	S	*	*			trans	-58.9	104.3	171.3	-81.9	164.4	0	0	0	108.3	P103	P103-L105 PolarHBondContact O-N 3.45Å
106	S	29	Very low	52.1	Low	99 Å²	99	109.4 Å²	109.4	69%	0.692	65%	0.65	S	S	*	*			trans	-64.6	140.2	168	40	0	0	0	0	108.8	K104 S108	K104-S106 PolarHBondContact O-N 3.14Å; S106-S108 PolarHBondContact O-N 3.46Å
107	P	36.6	Very low	49.1	Very low	128 Å²	128	111.5 Å²	111.5	83%	0.831	68%	0.681	S	S	*	*			trans	-67.9	99	178.8	27.1	-33.4	0	0	0	109.6
108	S	29.7	Very low	46.9	Very low	102 Å²	102	118 Å²	118	71%	0.713	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-61.3	136.4	170.5	-169.3	0	0	0	0	109.3	S106 T110	S106-S108 PolarHBondContact O-N 3.46Å; S108-T110 PolarHBondContact O-N 2.65Å
109	P	38.5	Very low	44	Very low	121 Å²	121	117.2 Å²	117.2	79%	0.786	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-64.4	123	-173.4	25	-34.3	0	0	0	111.8	A111	P109-A111 PolarHBondContact O-N 3.45Å
110	T	33.9	Very low	41.3	Very low	132 Å²	132	118 Å²	118	81%	0.81	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-62.8	117.6	-178.7	-50.6	0	0	0	0	111.7	S108	S108-T110 PolarHBondContact O-N 2.65Å
111	A	34.2	Very low	39	Very low	75 Å²	75	121.8 Å²	121.8	62%	0.62	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-68.1	144.9	168.1	0	0	0	0	0	110.7	P109	P109-A111 PolarHBondContact O-N 3.45Å
112	P	40.1	Very low	36.7	Very low	122 Å²	122	125.8 Å²	125.8	79%	0.792	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-70.8	132.9	-173.1	28.1	-34.9	0	0	0	112.6
113	I	34.4	Very low	35.7	Very low	158 Å²	158	126 Å²	126	81%	0.81	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-95.8	126.4	176.2	-63.4	173.6	0	0	0	109.1
114	L	31.2	Very low	35.8	Very low	148 Å²	148	125.2 Å²	125.2	78%	0.775	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-81.2	149.1	167.7	-91.1	84	0	0	0	111.1
115	P	40.4	Very low	35.1	Very low	125 Å²	125	128.7 Å²	128.7	81%	0.812	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-76	145.3	-173.7	31	-35.9	0	0	0	113.3
116	S	30.2	Very low	34.9	Very low	122 Å²	122	125.9 Å²	125.9	85%	0.853	78%	0.78	S	S	*	*			trans	-109	148	168.2	-66.5	0	0	0	0	110.8
117	G	29.1	Very low	34.9	Very low	73 Å²	73	125.8 Å²	125.8	75%	0.753	79%	0.786	S	S	*	*			trans	-77.8	174.9	-169.2	0	0	0	0	0	116.7
118	P	45.3	Very low	34.6	Very low	136 Å²	136	126.2 Å²	126.2	88%	0.883	78%	0.78	S	S	*	*			trans	-94	151.4	-165.6	36.4	-36.4	0	0	0	115.4
119	S	27.2	Very low	34.5	Very low	115 Å²	115	130.9 Å²	130.9	80%	0.804	78%	0.783	S	S	*	*			trans	-170.8	143.7	168.5	178.5	0	0	0	0	109
120	T	29	Very low	34.4	Very low	119 Å²	119	131 Å²	131	73%	0.73	78%	0.784	S	S	*	*			cis	-159.4	144.2	-18.3	-78.6	0	0	0	0	107.3
121	Q	34	Very low	34.2	Very low	176 Å²	176	128.9 Å²	128.9	82%	0.822	78%	0.78	S	S	*	*			trans	-88.7	151.4	171.7	-85.1	-168.4	-16.1	0	0	112.8
122	P	32.4	Very low	34	Very low	120 Å²	120	133.8 Å²	133.8	78%	0.779	80%	0.795	S	S	*	*			trans	-126.7	160.3	134.7	3.3	18.8	0	0	0	114.4
123	P	43	Very low	33.7	Very low	111 Å²	111	134 Å²	134	72%	0.721	79%	0.794	S	S	*	*			trans	-126.4	-141.2	-171.3	46	-28.7	0	0	0	110.6
124	P	54.7	Low	33.5	Very low	104 Å²	104	132 Å²	132	68%	0.675	79%	0.792	S	S	*	*			cis	-130.9	177.1	-31.2	39.5	-24.8	0	0	0	113.9
125	R	28.9	Very low	33.4	Very low	241 Å²	241	130 Å²	130	91%	0.909	79%	0.79	S	S	*	*			trans	172.5	121.2	138.5	-94.1	157	-169.1	-145	2.5	108.4
126	S	30.3	Very low	33	Very low	117 Å²	117	131.1 Å²	131.1	82%	0.818	79%	0.788	S	S	*	*			cis	96.4	106.3	34.7	-169.2	0	0	0	0	113.7
127	A	30.5	Very low	33.5	Very low	97 Å²	97	134.3 Å²	134.3	80%	0.802	79%	0.786	S	S	*	*			trans	-163.4	159.6	166.6	0	0	0	0	0	111.4
128	L	30.1	Very low	33.6	Very low	137 Å²	137	136.5 Å²	136.5	72%	0.717	79%	0.788	S	S	*	*			trans	-147.9	168	-168.9	-75.1	174.5	0	0	0	110.8
129	Y	27.3	Very low	32.9	Very low	199 Å²	199	140.8 Å²	140.8	78%	0.78	79%	0.786	S	S	*	*			cis	-133.2	-69.9	14.8	-123.9	-52.8	0	0	0	116.7
130	P	35.8	Very low	33.1	Very low	124 Å²	124	141.4 Å²	141.4	81%	0.805	79%	0.787	S	S	*	*			trans	-124.3	165.1	-141.8	38.9	-23.9	0	0	0	117.5
131	A	30.8	Very low	33.2	Very low	88 Å²	88	141.1 Å²	141.1	73%	0.727	79%	0.79	S	S	*	*			trans	-85.5	154.8	-177	0	0	0	0	0	114.4
132	L	29.6	Very low	33.4	Very low	177 Å²	177	142 Å²	142	93%	0.927	79%	0.791	S	S	*	*			trans	-133.2	124.8	150.8	-80.3	176.6	0	0	0	109
133	T	33.9	Very low	33.4	Very low	126 Å²	126	142.3 Å²	142.3	77%	0.773	79%	0.793	S	S	*	*			trans	-114.4	143.8	170.7	52.3	0	0	0	0	110
134	P	29.2	Very low	32.9	Very low	117 Å²	117	146 Å²	146	76%	0.76	80%	0.801	S	S	*	*			trans	-102.1	112.5	151.2	-7.3	26.8	0	0	0	109.1	I136	P134-I136 PolarHBondContact O-N 3.12Å
135	S	29.7	Very low	31.9	Very low	107 Å²	107	147.8 Å²	147.8	75%	0.748	81%	0.81	S	S	*	*			trans	-77.2	105.5	172.8	-174.2	0	0	0	0	110
136	I	32.8	Very low	32.1	Very low	148 Å²	148	144.2 Å²	144.2	76%	0.759	81%	0.808	S	S	*	*			trans	-108.9	116.8	170.5	-59.5	179.6	0	0	0	108.2	P134 P138	P134-I136 PolarHBondContact O-N 3.12Å; I136-P138 WeakPolarHBondContact O-CD 3.42Å
137	K	39.2	Very low	32	Very low	188 Å²	188	144.4 Å²	144.4	82%	0.817	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-95.7	120.5	173.6	-64.6	179.9	-178.6	178.3	0	110.3
138	P	31.8	Very low	32.2	Very low	120 Å²	120	146.6 Å²	146.6	78%	0.779	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-78	142.6	156.9	-13.7	30.8	0	0	0	110.5	I136	I136-P138 WeakPolarHBondContact O-CD 3.42Å
139	R	31.7	Very low	32.3	Very low	226 Å²	226	148.1 Å²	148.1	85%	0.853	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-88.1	148.5	168.2	-164.6	177.6	-166.2	-154.1	5.1	108.2	S141	R139-S141 PolarHBondContact O-N 2.95Å; R139-S141 VanDerWaalsContact O-N 3.13Å
140	P	30.6	Very low	32.8	Very low	128 Å²	128	141.9 Å²	141.9	83%	0.831	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-61.5	118	177	23.4	-34.6	0	0	0	111.6
141	S	31.9	Very low	32.7	Very low	113 Å²	113	138.9 Å²	138.9	79%	0.79	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-91.8	142.4	168.2	-65.3	0	0	0	0	109.7	R139	R139-S141 PolarHBondContact O-N 2.95Å; R139-S141 VanDerWaalsContact O-N 3.13Å
142	K	37	Very low	33.1	Very low	193 Å²	193	141.1 Å²	141.1	84%	0.839	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-66.4	142.4	170.9	-60.7	178.9	-179.6	-178.1	0	109.4	Q144	K142-Q144 PolarHBondContact O-N 2.86Å
143	P	32.3	Very low	33.4	Very low	127 Å²	127	140.7 Å²	140.7	83%	0.825	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-62.5	136.3	167	27.9	-33.4	0	0	0	109.5
144	Q	33.5	Very low	33.7	Very low	190 Å²	190	141.9 Å²	141.9	89%	0.888	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-90.4	151.5	166.4	-75.1	-176.7	-61.7	0	0	109.8	K142	K142-Q144 PolarHBondContact O-N 2.86Å
145	V	32.6	Very low	34.2	Very low	141 Å²	141	140.8 Å²	140.8	86%	0.855	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-70.2	138.8	-177.4	176.7	0	0	0	0	110.3
146	L	33.1	Very low	34.8	Very low	165 Å²	165	141.1 Å²	141.1	86%	0.864	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-71.4	134.6	169.1	-72.7	170.6	0	0	0	110
147	S	29.1	Very low	35.2	Very low	122 Å²	122	141.1 Å²	141.1	85%	0.853	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-75.2	148.8	169	-63.6	0	0	0	0	111.6
148	D	33.3	Very low	35.2	Very low	143 Å²	143	136.4 Å²	136.4	77%	0.765	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-62.6	147.3	-176.6	179.3	20.8	0	0	0	113.6	G150	D148-G150 PolarHBondContact OD1-N 3.36Å
149	N	32.7	Very low	35.5	Very low	169 Å²	169	138.5 Å²	138.5	90%	0.904	78%	0.78	S	S	*	*			trans	-156.2	67.6	149.8	-140.9	8.8	0	0	0	113.4
150	G	39	Very low	35.7	Very low	67 Å²	67	134.8 Å²	134.8	69%	0.691	78%	0.777	S	S	*	*			trans	73.7	82.5	140.9	0	0	0	0	0	118.9	D148	D148-G150 PolarHBondContact OD1-N 3.36Å
151	G	33.5	Very low	36	Very low	61 Å²	61	133.9 Å²	133.9	63%	0.629	77%	0.771	S	S	*	*			trans	-172	138.9	161.4	0	0	0	0	0	111.1	L153	G151-L153 VanDerWaalsContact C-N 3.28Å; G151-L153 PolarHBondContact O-N 3.28Å
152	P	38	Very low	36.3	Very low	136 Å²	136	134 Å²	134	88%	0.883	77%	0.77	S	S	*	*			trans	-79.3	71.2	-171.8	33.2	-36.5	0	0	0	112.3	I154	P152-I154 PolarHBondContact O-N 3.1Å
153	L	35.5	Very low	36.4	Very low	168 Å²	168	130.7 Å²	130.7	88%	0.88	77%	0.768	S	S	*	*			trans	-73.2	116.3	162.8	-157.6	87.2	0	0	0	108	G151 D155	G151-L153 VanDerWaalsContact C-N 3.28Å; G151-L153 PolarHBondContact O-N 3.28Å; L153-D155 PolarHBondContact O-N 3.04Å
154	I	41.3	Very low	36.6	Very low	150 Å²	150	136.1 Å²	136.1	77%	0.769	77%	0.774	S	S	*	*			trans	-67.4	131	177.5	-60.6	176.2	0	0	0	108.7	P152 L156	P152-I154 PolarHBondContact O-N 3.1Å; I154-L156 PolarHBondContact O-N 2.87Å
155	D	40.2	Very low	36.4	Very low	94 Å²	94	130.6 Å²	130.6	50%	0.503	77%	0.768	S	S	.	*			trans	-69.2	101.2	-174.1	178	34.5	0	0	0	112.4	L153 L157 S158	L153-D155 PolarHBondContact O-N 3.04Å; D155-L157 PolarHBondContact O-N 3.11Å; D155-L157 VanDerWaalsContact OD1-CB 3.32Å; D155-L157 WeakPolarHBondContact OD1-CB 3.41Å; D155-L157 PolarHBondContact OD1-N 2.94Å; D155-L157 VanDerWaalsContact OD1-N 3.09Å; D155-S158 PolarHBondContact OD2-OG 3.2Å
156	L	42.7	Very low	36.3	Very low	114 Å²	114	127.4 Å²	127.4	60%	0.597	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	9.5	176.9	-91.7	161.9	0	0	0	114	I154 T260	I154-L156 PolarHBondContact O-N 2.87Å; L156-T260 HydrophobicContact CD2-CG2 4.21Å
157	L	39.8	Very low	36.1	Very low	148 Å²	148	128.9 Å²	128.9	78%	0.775	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	-4.3	-177.2	-57.4	177.6	0	0	0	114.7	D155 E159	D155-L157 PolarHBondContact O-N 3.11Å; D155-L157 VanDerWaalsContact OD1-CB 3.32Å; D155-L157 WeakPolarHBondContact OD1-CB 3.41Å; D155-L157 PolarHBondContact OD1-N 2.94Å; D155-L157 VanDerWaalsContact OD1-N 3.09Å; L157-E159 PolarHBondContact O-N 3.47Å
158	S	38.8	Very low	36	Very low	90 Å²	90	126.6 Å²	126.6	63%	0.629	76%	0.761	S	S	*	*			trans	-90	97.5	-179.3	-70.5	0	0	0	0	112.6	D155 D160	D155-S158 PolarHBondContact OD2-OG 3.2Å; S158-D160 VanDerWaalsContact C-N 3.34Å; S158-D160 PolarHBondContact O-N 2.86Å; S158-D160 VanDerWaalsContact O-N 3.08Å
159	E	39.7	Very low	35.9	Very low	164 Å²	164	127.8 Å²	127.8	77%	0.766	77%	0.767	S	S	*	*			trans	-75.6	74.1	168.9	-73.2	-173.1	126	0	0	111.6	L157 R326	L157-E159 PolarHBondContact O-N 3.47Å; E159-R326 IonicContact OE1-NH1 2.64Å
160	D	36	Very low	35.7	Very low	147 Å²	147	125.6 Å²	125.6	79%	0.786	77%	0.765	S	S	*	*			trans	-160.4	131.2	161	-113.2	-29.6	0	0	0	112.7	S158	S158-D160 VanDerWaalsContact C-N 3.34Å; S158-D160 PolarHBondContact O-N 2.86Å; S158-D160 VanDerWaalsContact O-N 3.08Å
161	P	36.6	Very low	35.2	Very low	109 Å²	109	128.1 Å²	128.1	71%	0.708	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-82.2	142	173.5	32.9	-32.7	0	0	0	111.6
162	P	38.6	Very low	34.9	Very low	117 Å²	117	130.1 Å²	130.1	76%	0.76	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-66	138.3	177.5	27.7	-34.4	0	0	0	111.3
163	P	38.2	Very low	34.5	Very low	123 Å²	123	130.9 Å²	130.9	80%	0.799	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-68	141.9	178	28.1	-34.4	0	0	0	111.2	G165	P163-G165 PolarHBondContact O-N 2.89Å
164	Y	36	Very low	34.1	Very low	241 Å²	241	126.5 Å²	126.5	95%	0.945	77%	0.768	S	S	*	*			trans	-66.1	93.6	173.3	-96.3	-98.3	0	0	0	110.8	G166	Y164-G166 PolarHBondContact O-N 3.28Å
165	G	30.7	Very low	33.5	Very low	74 Å²	74	127.7 Å²	127.7	76%	0.763	78%	0.776	S	S	*	*			trans	-69.2	104.1	166.9	0	0	0	0	0	110.2	P163	P163-G165 PolarHBondContact O-N 2.89Å
166	G	29.6	Very low	33	Very low	73 Å²	73	126.4 Å²	126.4	75%	0.753	79%	0.785	S	S	*	*			trans	-60.8	142.9	174.1	0	0	0	0	0	111.6	Y164 G168	Y164-G166 PolarHBondContact O-N 3.28Å; G166-G168 PolarHBondContact O-N 2.92Å; G166-G168 VanDerWaalsContact O-N 3.07Å
167	Q	29	Very low	32.4	Very low	196 Å²	196	127.4 Å²	127.4	92%	0.916	79%	0.791	S	S	*	*			trans	-65.2	109.8	177.7	-73.7	177.3	-38.2	0	0	110.3	L169	Q167-L169 PolarHBondContact O-N 3.13Å
168	G	27.9	Very low	32	Very low	74 Å²	74	129.8 Å²	129.8	76%	0.763	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-67	120.3	170	0	0	0	0	0	110.4	G166	G166-G168 PolarHBondContact O-N 2.92Å; G166-G168 VanDerWaalsContact O-N 3.07Å
169	L	29.4	Very low	31.6	Very low	169 Å²	169	132.3 Å²	132.3	89%	0.885	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-65.9	132.8	170.5	-71.8	156.8	0	0	0	109.7	Q167	Q167-L169 PolarHBondContact O-N 3.13Å
170	S	28.6	Very low	31.1	Very low	123 Å²	123	133.2 Å²	133.2	86%	0.86	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-96	125.6	159.9	-67.6	0	0	0	0	109.1
171	S	28.3	Very low	30.7	Very low	119 Å²	119	129.6 Å²	129.6	83%	0.832	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-79.6	153.6	-173.9	-45	0	0	0	0	113.4
172	S	28	Very low	30.1	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	79%	0.79	S	S	*	*			trans	-150.5	121.1	140.6	-130.2	0	0	0	0	108.9
173	D	29.3	Very low	29.6	Very low	152 Å²	152	129.4 Å²	129.4	81%	0.813	79%	0.785	S	S	*	*			trans	45.5	133.4	144.4	-40.8	-57.4	0	0	0	120.9
174	G	28.3	Very low	29	Very low	76 Å²	76	130 Å²	130	78%	0.784	79%	0.786	S	S	*	*			trans	-169	-27.3	178.6	0	0	0	0	0	120.3
175	D	28.8	Very low	28.5	Very low	175 Å²	175	122.9 Å²	122.9	94%	0.936	77%	0.772	S	S	*	*			trans	65.4	163.4	173.4	-148.1	-3.3	0	0	0	117.6
176	G	28.7	Very low	28.2	Very low	68 Å²	68	127.5 Å²	127.5	70%	0.701	77%	0.774	S	S	*	*			trans	118.6	83.5	167.2	0	0	0	0	0	119.5
177	D	30.6	Very low	28.5	Very low	134 Å²	134	130.9 Å²	130.9	72%	0.717	77%	0.773	S	S	*	*			trans	-11.5	135.3	166.4	-74.6	-57.5	0	0	0	124.7
178	R	32	Very low	28.6	Very low	198 Å²	198	127.8 Å²	127.8	75%	0.747	77%	0.77	S	S	*	*				37.5	147.8	110	-50.7	174	88	146.3	3.2	119.7
179	E	30.2	Very low	28.8	Very low	144 Å²	144	128.3 Å²	128.3	67%	0.673	77%	0.767	S	S	*	*			cis	-159.6	-169.6	8.9	-135.1	158.7	-145.5	0	0	113.7
180	E	28.6	Very low	29.2	Very low	182 Å²	182	126.4 Å²	126.4	85%	0.85	77%	0.765	S	S	*	*			trans	-63.4	171.6	177.4	-76.6	-178.7	103.4	0	0	116.4
181	A	27.1	Very low	29.3	Very low	71 Å²	71	125.8 Å²	125.8	59%	0.587	76%	0.76	S	S	*	*			cis	-175	-171.9	-21.1	0	0	0	0	0	111.3
182	T	25.3	Very low	30.3	Very low	128 Å²	128	125.2 Å²	125.2	79%	0.785	75%	0.754	S	S	*	*			trans	75.1	99.8	150.6	33.8	0	0	0	0	124
183	S	26.3	Very low	30.2	Very low	95 Å²	95	127.7 Å²	127.7	66%	0.664	76%	0.758	S	S	*	*				71.4	139	116.5	65.5	0	0	0	0	125.7
184	T	25.8	Very low	30.2	Very low	134 Å²	134	126 Å²	126	82%	0.822	75%	0.752	S	S	*	*			trans	66.2	143.3	156	48.6	0	0	0	0	118.3
185	S	25.8	Very low	30.1	Very low	92 Å²	92	127.2 Å²	127.2	64%	0.643	75%	0.749	S	S	*	*			cis	-152.1	-171.6	2.4	-141.5	0	0	0	0	109.3
186	E	25.3	Very low	30.3	Very low	172 Å²	172	130.4 Å²	130.4	80%	0.804	75%	0.748	S	S	*	*			cis	-151.1	-144.2	8.8	-161.6	120.5	-70	0	0	111
187	I	34.3	Very low	30.4	Very low	144 Å²	144	134.9 Å²	134.9	74%	0.738	76%	0.755	S	S	*	*			trans	-140.3	153.3	-178.8	-36.1	176.2	0	0	0	109.8
188	P	31.8	Very low	30.5	Very low	131 Å²	131	140.4 Å²	140.4	85%	0.851	77%	0.766	S	S	*	*				-141.7	157.9	115	37.9	-25.9	0	0	0	115
189	A	33.2	Very low	30.3	Very low	85 Å²	85	134.7 Å²	134.7	70%	0.702	77%	0.769	S	S	*	*			trans	-119.4	166.2	171.2	0	0	0	0	0	110.6
190	P	36.8	Very low	30.3	Very low	129 Å²	129	136.1 Å²	136.1	84%	0.838	77%	0.773	S	S	*	*				-147.6	168.8	101.8	37.4	-20.7	0	0	0	116.3
191	S	31.4	Very low	30.4	Very low	109 Å²	109	138.9 Å²	138.9	76%	0.762	78%	0.775	S	S	*	*			trans	-96.1	-152.6	172.8	-36.3	0	0	0	0	110.4
192	P	48.6	Very low	30.5	Very low	108 Å²	108	140.8 Å²	140.8	70%	0.701	78%	0.776	S	S	*	*			cis	-147.4	-155.4	19.3	36.6	-9	0	0	0	116.5
193	I	26.6	Very low	30.9	Very low	154 Å²	154	140.3 Å²	140.3	79%	0.79	78%	0.775	S	S	*	*			trans	83.9	131.7	159.3	-67.2	161.3	0	0	0	117.1
194	V	27.8	Very low	31.3	Very low	116 Å²	116	141.8 Å²	141.8	70%	0.703	78%	0.782	S	S	*	*			cis	-158.2	128.3	-11	131.2	0	0	0	0	106
195	S	26.4	Very low	31.5	Very low	102 Å²	102	139.2 Å²	139.2	71%	0.713	78%	0.775	S	S	*	*				78.6	100.5	62.7	-71.4	0	0	0	0	117.5
196	R	32.8	Very low	32.1	Very low	243 Å²	243	139.6 Å²	139.6	92%	0.917	78%	0.783	S	S	*	*			trans	167.8	149.5	147.3	-95.1	161.1	-167.5	-158.7	5.3	111.1
197	L	32.2	Very low	32.3	Very low	161 Å²	161	138.6 Å²	138.6	84%	0.843	78%	0.783	S	S	*	*				-168.4	149.9	-54.9	-115.5	173.6	0	0	0	109.5
198	R	32.7	Very low	32.6	Very low	250 Å²	250	136.6 Å²	136.6	94%	0.943	78%	0.782	S	S	*	*			trans	80.7	132.4	-174.8	-53.5	-176.6	-178.9	-141.6	-0.1	115
199	G	27.3	Very low	32.9	Very low	79 Å²	79	136 Å²	136	81%	0.814	78%	0.776	S	S	*	*			cis	-157.6	149.7	-4	0	0	0	0	0	112
200	K	31.1	Very low	33.2	Very low	174 Å²	174	137.9 Å²	137.9	76%	0.757	78%	0.779	S	S	*	*			trans	-102.9	131.6	-164.2	179.7	-179.4	178	178	0	113	D202	K200-D202 VanDerWaalsContact CE-CG 3.41Å; K200-D202 WeakPolarHBondContact CE-OD1 3.41Å; K200-D202 WeakPolarHBondContact CE-OD2 3.44Å; K200-D202 IonicContact NZ-OD2 3.31Å; K200-D202 PolarHBondContact NZ-OD2 3.07Å
201	R	29.7	Very low	33.3	Very low	240 Å²	240	136.4 Å²	136.4	91%	0.906	77%	0.772	S	S	*	*			trans	-155.5	110.4	145.8	-160.8	172.3	-163.3	161.9	5.7	110
202	D	29.1	Very low	34.2	Very low	111 Å²	111	142.4 Å²	142.4	59%	0.594	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-79	137.9	-179.5	-30.8	-71.1	0	0	0	110	K200	K200-D202 VanDerWaalsContact CE-CG 3.41Å; K200-D202 WeakPolarHBondContact CE-OD1 3.41Å; K200-D202 WeakPolarHBondContact CE-OD2 3.44Å; K200-D202 IonicContact NZ-OD2 3.31Å; K200-D202 PolarHBondContact NZ-OD2 3.07Å
203	P	34.1	Very low	34.3	Very low	118 Å²	118	139 Å²	139	77%	0.766	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-78.8	140.3	163.1	32.5	-31.4	0	0	0	109.9
204	P	34.5	Very low	35.8	Very low	126 Å²	126	136.1 Å²	136.1	82%	0.818	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-71.7	163.2	175	31.1	-35	0	0	0	112.4
205	A	30.6	Very low	37.7	Very low	80 Å²	80	130.8 Å²	130.8	66%	0.661	71%	0.708	S	S	*	*			trans	-21.6	131	-179	0	0	0	0	0	117.9	D207	A205-D207 PolarHBondContact O-N 3.39Å; A205-D207 VanDerWaalsContact O-N 3.13Å
206	A	37.7	Very low	40	Very low	99 Å²	99	126.6 Å²	126.6	82%	0.818	68%	0.678	S	S	*	*			trans	-84.5	74.3	172.7	0	0	0	0	0	111.5	S208	A206-S208 VanDerWaalsContact C-N 3.32Å; A206-S208 PolarHBondContact O-N 3.11Å
207	D	30.6	Very low	41.9	Very low	152 Å²	152	118.2 Å²	118.2	81%	0.813	65%	0.646	S	S	*	*			trans	-73.8	83	175.9	-70.7	-6.6	0	0	0	111.3	A205	A205-D207 PolarHBondContact O-N 3.39Å; A205-D207 VanDerWaalsContact O-N 3.13Å
208	S	40.3	Very low	43.8	Very low	102 Å²	102	116.4 Å²	116.4	71%	0.713	64%	0.637	S	S	*	*			trans	-84.1	137.5	150	-60.3	0	0	0	0	107.2	A206	A206-S208 VanDerWaalsContact C-N 3.32Å; A206-S208 PolarHBondContact O-N 3.11Å
209	T	38.2	Very low	45.5	Very low	118 Å²	118	105.1 Å²	105.1	72%	0.724	60%	0.599	S	S	*	*				-173.2	160.1	74.2	-63.2	0	0	0	0	110.6
210	T	39.2	Very low	47.4	Very low	124 Å²	124	106.1 Å²	106.1	76%	0.761	61%	0.609	S	S	*	*	S	Bend	trans	53.2	88.6	162.1	45.6	0	0	0	0	119.6
211	S	37.9	Very low	49.4	Very low	98 Å²	98	102.3 Å²	102.3	69%	0.685	60%	0.597	S	S	*	*				169	60.8	127.6	-77.4	0	0	0	0	113.3	R217	S211-R217 PolarHBondContact O-NH1 2.72Å; S211-R217 PolarHBondContact O-NH2 3.06Å
212	R	51.8	Low	51.5	Low	235 Å²	235	93.4 Å²	93.4	89%	0.887	58%	0.579	S	S	*	*			trans	-95.9	94	169.7	-76.9	179.7	168.8	164.7	-3.1	109.1
213	A	50.5	Low	53.7	Low	38 Å²	38	94.2 Å²	94.2	31%	0.314	58%	0.58	S	S	.	*			trans	-161.3	25	-168.1	0	0	0	0	0	114.8	H262	A213-H262 PolarHBondContact O-CD2 3.43Å; A213-H262 PolarHBondContact O-CE1 2.89Å; A213-H262 PolarHBondContact O-ND1 3.18Å; A213-H262 PolarHBondContact O-NE2 3.18Å
214	F	58.1	Low	55.8	Low	93 Å²	93	90.6 Å²	90.6	41%	0.408	55%	0.554	S	S	.	*			trans	-143.2	118.8	171.3	-41	-62.5	0	0	0	110.7	R217 T261	F214-R217 HydrophobicContact CB-CG 3.77Å; F214-R217 HydrophobicContact CD2-CG 4.17Å; F214-R217 HydrophobicContact CG-CG 4.48Å; F214-R217 WeakPolarHBondContact O-CG 3.42Å; F214-R217 PolarHBondContact O-NE 3Å; F214-R217 VanDerWaalsContact O-NE 3.12Å; F214-T261 WeakPolarHBondContact CD1-O 3.44Å
215	P	65.9	Low	58.1	Low	3 Å²	3	88.4 Å²	88.4	2%	0.019	53%	0.533	C	S	.	.	S	Bend	trans	-60	-36.5	171.5	-33.8	33.3	0	0	0	118.4	Y226 W227 F229 H262	P215-Y226 HydrophobicContact CB-CE2 4.49Å; P215-Y226 CarbonylContact O-C 3.51Å; P215-Y226 VanDerWaalsContact O-CA 3.25Å; P215-Y226 WeakPolarHBondContact O-CA 2.81Å; P215-Y226 WeakPolarHBondContact O-CD2 3.3Å; P215-W227 WeakPolarHBondContact CA-O 3.48Å; P215-W227 VanDerWaalsContact CB-O 3.24Å; P215-W227 WeakPolarHBondContact CB-O 3.46Å; P215-W227 PolarHBondContact O-N 3.09Å; P215-F229 HydrophobicContact CG-CD1 3.82Å; P215-F229 HydrophobicContact CG-CE1 3.74Å; P215-F229 HydrophobicContact CG-CG 4.36Å; P215-F229 HydrophobicContact CG-CZ 4.21Å; P215-H262 WeakPolarHBondContact CD-O 3.4Å; P215-H262 HydrophobicContact CG-CB 4.26Å
216	L	76.1	Confident	60.7	Low	15 Å²	15	89 Å²	89	8%	0.079	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	122.5	168.2	-69	179.7	0	0	0	109.5	Y226 Q263 T265 Y320 L329	L216-Y226 HydrophobicContact CD2-CD2 4.24Å; L216-Q263 HydrophobicContact CB-CB 4.35Å; L216-Q263 WeakPolarHBondContact CD1-O 3.37Å; L216-T265 HydrophobicContact CD1-CG2 4.31Å; L216-T265 HydrophobicContact CD2-CG2 4.33Å; L216-T265 HydrophobicContact CG-CG2 4.37Å; L216-Y320 HydrophobicContact CD1-CG 4.33Å; L216-Y320 HydrophobicContact CD2-CD1 4.23Å; L216-Y320 HydrophobicContact CD2-CD2 3.73Å; L216-Y320 HydrophobicContact CD2-CE1 4.44Å; L216-Y320 HydrophobicContact CD2-CE2 3.99Å; L216-Y320 HydrophobicContact CD2-CG 3.88Å; L216-L329 HydrophobicContact CD1-CD1 4.5Å
217	R	73.1	Confident	62.9	Low	67 Å²	67	91 Å²	91	25%	0.253	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.5	-177.4	-71.6	-179	171.7	-138.8	-19.8	110.8	S211 F214 G219 L224 Q225	S211-R217 PolarHBondContact O-NH1 2.72Å; S211-R217 PolarHBondContact O-NH2 3.06Å; F214-R217 HydrophobicContact CB-CG 3.77Å; F214-R217 HydrophobicContact CD2-CG 4.17Å; F214-R217 HydrophobicContact CG-CG 4.48Å; F214-R217 WeakPolarHBondContact O-CG 3.42Å; F214-R217 PolarHBondContact O-NE 3Å; F214-R217 VanDerWaalsContact O-NE 3.12Å; R217-G219 PolarHBondContact O-N 3.43Å; R217-L224 CarbonylContact O-C 3.55Å; R217-L224 WeakPolarHBondContact O-CA 3.49Å; R217-Q225 PolarHBondContact N-O 2.9Å; R217-Q225 PolarHBondContact O-N 3.46Å
218	L	71.4	Confident	65.5	Low	122 Å²	122	87.7 Å²	87.7	64%	0.639	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	111.6	161.9	-156.1	73.6	0	0	0	107.9	G222 L224	L218-G222 WeakPolarHBondContact CD1-O 3.35Å; L218-L224 HydrophobicContact CD1-CD2 4.34Å; L218-L224 HydrophobicContact CD1-CG 4.41Å
219	G	67.9	Low	67.8	Low	14 Å²	14	83.5 Å²	83.5	14%	0.144	46%	0.46	C	S	.	.			trans	-72.1	165.9	176	0	0	0	0	0	111.7	R217 N221 G222 Q223	R217-G219 PolarHBondContact O-N 3.43Å; G219-N221 PolarHBondContact O-N 2.94Å; G219-G222 PolarHBondContact O-N 3.48Å; G219-Q223 PolarHBondContact N-O 3.15Å
220	G	67.4	Low	70.3	Confident	100 Å²	100	80.2 Å²	80.2	100%	1.031	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	0.8	177.7	0	0	0	0	0	115.6
221	N	73.7	Confident	72.7	Confident	94 Å²	94	78.1 Å²	78.1	50%	0.503	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	9.4	172	69.6	-27.5	0	0	0	113.5	G219 Q223	G219-N221 PolarHBondContact O-N 2.94Å; N221-Q223 VanDerWaalsContact C-N 3.29Å; N221-Q223 PolarHBondContact ND2-OE1 3.06Å; N221-Q223 PolarHBondContact O-N 3.03Å; N221-Q223 PolarHBondContact OD1-N 3.29Å
222	G	72.3	Confident	75.3	Confident	52 Å²	52	76.7 Å²	76.7	54%	0.536	42%	0.423	S	S	.	.	S	Bend	trans	73.7	12.1	-178.7	0	0	0	0	0	115.1	L218 G219	L218-G222 WeakPolarHBondContact CD1-O 3.35Å; G219-G222 PolarHBondContact O-N 3.48Å
223	Q	76.4	Confident	77.2	Confident	128 Å²	128	67.8 Å²	67.8	60%	0.598	39%	0.393	S	S	*	.			trans	-107.1	146.2	178.6	-65.1	-176.2	-32.2	0	0	111.8	G219 N221 Q225	G219-Q223 PolarHBondContact N-O 3.15Å; N221-Q223 VanDerWaalsContact C-N 3.29Å; N221-Q223 PolarHBondContact ND2-OE1 3.06Å; N221-Q223 PolarHBondContact O-N 3.03Å; N221-Q223 PolarHBondContact OD1-N 3.29Å; Q223-Q225 PolarHBondContact O-N 3.37Å
224	L	78.6	Confident	79.3	Confident	42 Å²	42	66.3 Å²	66.3	22%	0.22	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	120.4	174.5	-73.2	167.5	0	0	0	111.2	R217 L218 Y320	R217-L224 CarbonylContact O-C 3.55Å; R217-L224 WeakPolarHBondContact O-CA 3.49Å; L218-L224 HydrophobicContact CD1-CD2 4.34Å; L218-L224 HydrophobicContact CD1-CG 4.41Å; L224-Y320 HydrophobicContact CB-CD2 4.04Å; L224-Y320 HydrophobicContact CB-CE2 4.13Å; L224-Y320 WeakPolarHBondContact CD1-O 3.32Å
225	Q	82.1	Confident	80.9	Confident	81 Å²	81	68.5 Å²	68.5	38%	0.379	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	139.5	175.9	-60	-176.5	8.5	0	0	110	R217 Q223	R217-Q225 PolarHBondContact N-O 2.9Å; R217-Q225 PolarHBondContact O-N 3.46Å; Q223-Q225 PolarHBondContact O-N 3.37Å
226	Y	85.5	Confident	82.3	Confident	93 Å²	93	72.5 Å²	72.5	37%	0.365	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	138.7	-179.6	171.9	-110.3	0	0	0	112.6	P215 L216 T265 D268	P215-Y226 HydrophobicContact CB-CE2 4.49Å; P215-Y226 CarbonylContact O-C 3.51Å; P215-Y226 VanDerWaalsContact O-CA 3.25Å; P215-Y226 WeakPolarHBondContact O-CA 2.81Å; P215-Y226 WeakPolarHBondContact O-CD2 3.3Å; L216-Y226 HydrophobicContact CD2-CD2 4.24Å; Y226-T265 HydrophobicContact CD2-CG2 4.2Å; Y226-T265 HydrophobicContact CE2-CG2 4.21Å; Y226-D268 WeakPolarHBondContact CE2-OD2 3.42Å; Y226-D268 PolarHBondContact OH-OD1 3.45Å
227	W	82.9	Confident	83.2	Confident	139 Å²	139	73.9 Å²	73.9	53%	0.527	41%	0.412	S	S	.	.			trans	-140	127.6	174.2	-64.9	89.6	0	0	0	109.8	P215	P215-W227 WeakPolarHBondContact CA-O 3.48Å; P215-W227 VanDerWaalsContact CB-O 3.24Å; P215-W227 WeakPolarHBondContact CB-O 3.46Å; P215-W227 PolarHBondContact O-N 3.09Å
228	P	85.4	Confident	84.2	Confident	83 Å²	83	75.1 Å²	75.1	54%	0.539	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-68.2	156.9	176.3	29	-35.1	0	0	0	111.7
229	F	89.3	Confident	85.3	Confident	14 Å²	14	75 Å²	75	6%	0.061	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-55.8	145	166.2	-67.9	-61.7	0	0	0	111.3	P215 L234 W237 V258 H262 P264 D268 L272	P215-F229 HydrophobicContact CG-CD1 3.82Å; P215-F229 HydrophobicContact CG-CE1 3.74Å; P215-F229 HydrophobicContact CG-CG 4.36Å; P215-F229 HydrophobicContact CG-CZ 4.21Å; F229-L234 HydrophobicContact CB-CD1 4.01Å; F229-L234 HydrophobicContact CB-CD2 4.21Å; F229-L234 HydrophobicContact CB-CG 4Å; F229-L234 HydrophobicContact CD2-CD2 4.09Å; F229-L234 HydrophobicContact CG-CD2 4.22Å; F229-W237 AromaticContact CD1-CH2 3.74Å; F229-W237 HydrophobicContact CD1-CH2 3.74Å; F229-W237 AromaticContact CD1-CZ3 3.82Å; F229-W237 HydrophobicContact CD1-CZ3 3.82Å; F229-W237 AromaticContact CE1-CH2 3.7Å; F229-W237 HydrophobicContact CE1-CH2 3.7Å; F229-W237 AromaticContact CE1-CZ3 3.8Å; F229-W237 HydrophobicContact CE1-CZ3 3.8Å; F229-W237 HydrophobicContact CG-CZ3 4.43Å; F229-W237 HydrophobicContact CZ-CZ3 4.38Å; F229-V258 HydrophobicContact CE1-CG1 3.77Å; F229-V258 HydrophobicContact CZ-CG1 3.67Å; F229-H262 AromaticContact CD1-CD2 3.91Å; F229-H262 HydrophobicContact CE1-CB 3.93Å; F229-H262 AromaticContact CE1-CD2 3.52Å; F229-H262 AromaticContact CE1-CG 3.96Å; F229-H262 HydrophobicContact CZ-CB 4.48Å; F229-P264 HydrophobicContact CE2-CB 4.34Å; F229-P264 HydrophobicContact CZ-CB 4.06Å; F229-D268 HydrophobicContact CD2-CB 4.14Å; F229-D268 HydrophobicContact CE2-CB 3.67Å; F229-D268 HydrophobicContact CZ-CB 4.42Å; F229-L272 HydrophobicContact CE2-CB 4.11Å; F229-L272 HydrophobicContact CZ-CD2 4.49Å
230	S	90.5	Very high	86.6	Confident	50 Å²	50	80 Å²	80	35%	0.35	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-71.4	141	168.1	-167.5	0	0	0	0	110.1	S232 D233 L234	S230-S232 PolarHBondContact O-N 3.43Å; S230-S232 PolarHBondContact OG-N 3.37Å; S230-D233 WeakPolarHBondContact CB-OD2 3.47Å; S230-D233 PolarHBondContact O-N 3.31Å; S230-D233 VanDerWaalsContact O-N 3.12Å; S230-L234 PolarHBondContact O-N 3.2Å
231	S	90.3	Very high	87.9	Confident	79 Å²	79	77 Å²	77	55%	0.552	40%	0.402	S	S	*	.	H	α-helix	trans	-58.5	-36.3	170.1	51.8	0	0	0	0	111.5	D233 L234 Y235	S231-D233 VanDerWaalsContact C-N 3.34Å; S231-D233 PolarHBondContact O-N 2.98Å; S231-L234 PolarHBondContact O-N 3.14Å; S231-Y235 VanDerWaalsContact O-CD2 3.24Å; S231-Y235 WeakPolarHBondContact O-CD2 3.39Å; S231-Y235 PolarHBondContact O-N 2.92Å
232	S	92.1	Very high	88.9	Confident	68 Å²	68	74.1 Å²	74.1	48%	0.476	39%	0.389	S	S	.	.	H	α-helix	trans	-58.9	-43.4	174.4	-55.4	0	0	0	0	112.2	S230 Y235 N236	S230-S232 PolarHBondContact O-N 3.43Å; S230-S232 PolarHBondContact OG-N 3.37Å; S232-Y235 PolarHBondContact O-N 3.31Å; S232-N236 VanDerWaalsContact O-CB 3.23Å; S232-N236 WeakPolarHBondContact O-CB 3.5Å; S232-N236 PolarHBondContact O-N 2.78Å; S232-N236 PolarHBondContact O-ND2 3.11Å; S232-N236 VanDerWaalsContact O-ND2 3.12Å
233	D	91.6	Very high	89.9	Confident	48 Å²	48	74 Å²	74	26%	0.257	38%	0.38	S	S	.	.	H	α-helix	trans	-68.1	-44.7	-177	-56.3	-28.5	0	0	0	110.3	S230 S231 Y235 N236 W237	S230-D233 WeakPolarHBondContact CB-OD2 3.47Å; S230-D233 PolarHBondContact O-N 3.31Å; S230-D233 VanDerWaalsContact O-N 3.12Å; S231-D233 VanDerWaalsContact C-N 3.34Å; S231-D233 PolarHBondContact O-N 2.98Å; D233-Y235 PolarHBondContact O-N 3.39Å; D233-N236 PolarHBondContact O-N 3.21Å; D233-W237 HydrophobicContact CB-CH2 4.19Å; D233-W237 HydrophobicContact CB-CZ2 4.08Å; D233-W237 HydrophobicContact CB-CZ3 4.49Å; D233-W237 WeakPolarHBondContact O-CB 3.4Å; D233-W237 VanDerWaalsContact O-CD2 3.31Å; D233-W237 PolarHBondContact O-N 2.87Å
234	L	93.6	Very high	90.6	Very high	8 Å²	8	68 Å²	68	4%	0.042	35%	0.352	C	S	.	.	H	α-helix	trans	-60.2	-43.6	176.5	-66.4	168.5	0	0	0	112.6	F229 S230 S231 W237 K238 Q271 L272 T275	F229-L234 HydrophobicContact CB-CD1 4.01Å; F229-L234 HydrophobicContact CB-CD2 4.21Å; F229-L234 HydrophobicContact CB-CG 4Å; F229-L234 HydrophobicContact CD2-CD2 4.09Å; F229-L234 HydrophobicContact CG-CD2 4.22Å; S230-L234 PolarHBondContact O-N 3.2Å; S231-L234 PolarHBondContact O-N 3.14Å; L234-W237 HydrophobicContact CD2-CE3 4.05Å; L234-W237 HydrophobicContact CD2-CZ3 3.98Å; L234-K238 WeakPolarHBondContact O-CB 3.45Å; L234-K238 PolarHBondContact O-N 3.27Å; L234-Q271 HydrophobicContact CD1-CG 3.82Å; L234-L272 HydrophobicContact CD2-CD1 3.92Å; L234-T275 HydrophobicContact CB-CG2 4.07Å
235	Y	92.6	Very high	91.1	Very high	139 Å²	139	69.5 Å²	69.5	55%	0.545	37%	0.366	S	S	.	.	H	α-helix	trans	-72.9	-33.9	175.5	-79.8	-67.6	0	0	0	112.7	S231 S232 D233 K238 N239	S231-Y235 VanDerWaalsContact O-CD2 3.24Å; S231-Y235 WeakPolarHBondContact O-CD2 3.39Å; S231-Y235 PolarHBondContact O-N 2.92Å; S232-Y235 PolarHBondContact O-N 3.31Å; D233-Y235 PolarHBondContact O-N 3.39Å; Y235-K238 PolarHBondContact O-N 3.25Å; Y235-N239 VanDerWaalsContact O-CB 3.27Å; Y235-N239 WeakPolarHBondContact O-CB 3.41Å; Y235-N239 PolarHBondContact O-N 2.87Å; Y235-N239 PolarHBondContact O-ND2 2.91Å; Y235-N239 PolarHBondContact O-OD1 3.47Å
236	N	95.1	Very high	91.3	Very high	87 Å²	87	71.4 Å²	71.4	47%	0.465	38%	0.375	S	S	.	.	H	α-helix	trans	-63.5	-46	173.1	-74.9	-25.2	0	0	0	111	S232 D233 N239 N240	S232-N236 VanDerWaalsContact O-CB 3.23Å; S232-N236 WeakPolarHBondContact O-CB 3.5Å; S232-N236 PolarHBondContact O-N 2.78Å; S232-N236 PolarHBondContact O-ND2 3.11Å; S232-N236 VanDerWaalsContact O-ND2 3.12Å; D233-N236 PolarHBondContact O-N 3.21Å; N236-N239 PolarHBondContact O-N 3.43Å; N236-N240 WeakPolarHBondContact O-CB 3.36Å; N236-N240 PolarHBondContact O-N 2.9Å; N236-N240 PolarHBondContact O-ND2 3.11Å
237	W	95.4	Very high	91.4	Very high	43 Å²	43	70 Å²	70	16%	0.163	37%	0.374	C	S	.	.	H	α-helix	trans	-60.9	-43.1	174.6	-66.7	-22.7	0	0	0	111.8	F229 D233 L234 N241 L254 V258 H262 L272 L276	F229-W237 AromaticContact CD1-CH2 3.74Å; F229-W237 HydrophobicContact CD1-CH2 3.74Å; F229-W237 AromaticContact CD1-CZ3 3.82Å; F229-W237 HydrophobicContact CD1-CZ3 3.82Å; F229-W237 AromaticContact CE1-CH2 3.7Å; F229-W237 HydrophobicContact CE1-CH2 3.7Å; F229-W237 AromaticContact CE1-CZ3 3.8Å; F229-W237 HydrophobicContact CE1-CZ3 3.8Å; F229-W237 HydrophobicContact CG-CZ3 4.43Å; F229-W237 HydrophobicContact CZ-CZ3 4.38Å; D233-W237 HydrophobicContact CB-CH2 4.19Å; D233-W237 HydrophobicContact CB-CZ2 4.08Å; D233-W237 HydrophobicContact CB-CZ3 4.49Å; D233-W237 WeakPolarHBondContact O-CB 3.4Å; D233-W237 VanDerWaalsContact O-CD2 3.31Å; D233-W237 PolarHBondContact O-N 2.87Å; L234-W237 HydrophobicContact CD2-CE3 4.05Å; L234-W237 HydrophobicContact CD2-CZ3 3.98Å; W237-N241 PolarHBondContact O-ND2 2.7Å; W237-L254 HydrophobicContact CB-CD2 3.98Å; W237-L254 HydrophobicContact CG-CD2 4.42Å; W237-V258 HydrophobicContact CD2-CG2 4.38Å; W237-V258 HydrophobicContact CE3-CG2 4.34Å; W237-V258 HydrophobicContact CH2-CG1 4.14Å; W237-V258 HydrophobicContact CH2-CG2 3.96Å; W237-V258 HydrophobicContact CZ2-CG2 3.98Å; W237-V258 HydrophobicContact CZ3-CG1 4.19Å; W237-V258 HydrophobicContact CZ3-CG2 4.14Å; W237-H262 AromaticContact CH2-CD2 3.92Å; W237-H262 AromaticContact CH2-NE2 3.6Å; W237-H262 AromaticContact CZ2-CE1 3.96Å; W237-H262 AromaticContact CZ2-NE2 3.64Å; W237-L272 HydrophobicContact CE3-CD1 3.84Å; W237-L272 HydrophobicContact CZ3-CD1 3.89Å; W237-L276 HydrophobicContact CB-CD2 3.98Å
238	K	94.4	Very high	91.8	Very high	94 Å²	94	65 Å²	65	41%	0.409	36%	0.359	S	S	.	.	H	α-helix	trans	-62.4	-46.4	176.1	-171.1	174.3	-171.5	141.3	0	112.9	L234 Y235 T275 L276	L234-K238 WeakPolarHBondContact O-CB 3.45Å; L234-K238 PolarHBondContact O-N 3.27Å; Y235-K238 PolarHBondContact O-N 3.25Å; K238-T275 HydrophobicContact CD-CG2 4.31Å; K238-T275 WeakPolarHBondContact CD-O 3.41Å; K238-T275 WeakPolarHBondContact CE-O 3.43Å; K238-T275 PolarHBondContact NZ-O 3.39Å; K238-L276 HydrophobicContact CB-CD2 3.93Å
239	N	94.6	Very high	92	Very high	119 Å²	119	63.3 Å²	63.3	64%	0.636	36%	0.356	S	S	*	.	H	α-helix	trans	-81.5	-18.8	-169.4	-65	-10.8	0	0	0	113.9	Y235 N236	Y235-N239 VanDerWaalsContact O-CB 3.27Å; Y235-N239 WeakPolarHBondContact O-CB 3.41Å; Y235-N239 PolarHBondContact O-N 2.87Å; Y235-N239 PolarHBondContact O-ND2 2.91Å; Y235-N239 PolarHBondContact O-OD1 3.47Å; N236-N239 PolarHBondContact O-N 3.43Å
240	N	95.2	Very high	92.2	Very high	119 Å²	119	67.3 Å²	67.3	64%	0.636	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	3	-179.8	-70.6	-83.1	0	0	0	113.8	N236	N236-N240 WeakPolarHBondContact O-CB 3.36Å; N236-N240 PolarHBondContact O-N 2.9Å; N236-N240 PolarHBondContact O-ND2 3.11Å
241	N	94.6	Very high	92.4	Very high	36 Å²	36	65.1 Å²	65.1	19%	0.193	36%	0.358	C	S	.	.	S	Bend	trans	-129.3	149.4	-176.9	-67.5	-79.5	0	0	0	111.3	W237 K250 L251 L254	W237-N241 PolarHBondContact O-ND2 2.7Å; N241-K250 WeakPolarHBondContact OD1-CE 3.45Å; N241-L251 HydrophobicContact CB-CD1 4.05Å; N241-L254 HydrophobicContact CB-CD2 4.4Å; N241-L254 VanDerWaalsContact ND2-CD2 3.32Å; N241-L254 WeakPolarHBondContact ND2-CD2 3.31Å
242	P	93.9	Very high	92.7	Very high	35 Å²	35	61.9 Å²	61.9	23%	0.227	34%	0.335	C	S	.	.			trans	-66.2	163.7	172.9	30.2	-35.4	0	0	0	111	E246 D247 K250	P242-E246 HydrophobicContact CB-CB 4.13Å; P242-D247 HydrophobicContact CB-CB 4.28Å; P242-D247 HydrophobicContact CG-CB 3.7Å; P242-K250 HydrophobicContact CG-CB 4.42Å; P242-K250 HydrophobicContact CG-CD 4.03Å; P242-K250 HydrophobicContact CG-CG 4.47Å
243	S	93.4	Very high	92.9	Very high	49 Å²	49	61.3 Å²	61.3	34%	0.343	33%	0.334	S	S	.	.			trans	-67.2	156.4	170.8	67.1	0	0	0	0	111.5	S245 E246 D247	S243-S245 PolarHBondContact O-N 3.38Å; S243-E246 VanDerWaalsContact CB-OE2 3.31Å; S243-E246 WeakPolarHBondContact CB-OE2 3.39Å; S243-E246 PolarHBondContact N-OE2 2.95Å; S243-E246 PolarHBondContact O-N 2.91Å; S243-E246 VanDerWaalsContact OG-CD 3.24Å; S243-E246 VanDerWaalsContact OG-CG 3.28Å; S243-E246 WeakPolarHBondContact OG-CG 3.37Å; S243-E246 PolarHBondContact OG-OE2 3.26Å; S243-D247 PolarHBondContact O-N 2.94Å
244	F	92.4	Very high	93.1	Very high	1 Å²	1	60.5 Å²	60.5	0%	0.004	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-29.4	-178.1	-170.1	-101	0	0	0	112.8	P248 L251 L277 E281 V285 L340 A343	F244-P248 HydrophobicContact CD2-CB 4.24Å; F244-P248 HydrophobicContact CE1-CB 4.35Å; F244-P248 HydrophobicContact CE2-CB 4.03Å; F244-P248 HydrophobicContact CZ-CB 4.09Å; F244-P248 VanDerWaalsContact O-CA 3.3Å; F244-P248 WeakPolarHBondContact O-CA 3.4Å; F244-P248 WeakPolarHBondContact O-CB 3.46Å; F244-P248 VanDerWaalsContact O-CD 3.3Å; F244-P248 WeakPolarHBondContact O-CD 3.32Å; F244-P248 WeakPolarHBondContact O-CG 3.48Å; F244-L251 HydrophobicContact CB-CD2 3.9Å; F244-L251 HydrophobicContact CD2-CB 4.46Å; F244-L251 HydrophobicContact CD2-CD2 4.27Å; F244-L277 HydrophobicContact CB-CD2 3.63Å; F244-L277 HydrophobicContact CD2-CD2 3.9Å; F244-L277 HydrophobicContact CG-CD2 3.83Å; F244-E281 HydrophobicContact CB-CB 4.47Å; F244-E281 HydrophobicContact CB-CG 4.23Å; F244-E281 WeakPolarHBondContact CB-OE1 3.48Å; F244-E281 HydrophobicContact CD1-CB 4.17Å; F244-E281 HydrophobicContact CD1-CG 4.11Å; F244-V285 HydrophobicContact CE1-CG2 4.19Å; F244-V285 HydrophobicContact CZ-CG2 4.03Å; F244-L340 HydrophobicContact CD2-CD2 4.36Å; F244-L340 HydrophobicContact CE2-CD2 3.68Å; F244-L340 HydrophobicContact CZ-CD2 4.21Å; F244-A343 HydrophobicContact CE1-CB 4.19Å; F244-A343 HydrophobicContact CZ-CB 4.28Å
245	S	88.6	Confident	93.3	Very high	74 Å²	74	60.2 Å²	60.2	52%	0.517	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-13.1	176.2	-60.6	0	0	0	0	114.5	S243 E281	S243-S245 PolarHBondContact O-N 3.38Å; S245-E281 VanDerWaalsContact CB-OE1 3.29Å; S245-E281 WeakPolarHBondContact CB-OE1 3.24Å; S245-E281 PolarHBondContact N-OE1 3.24Å; S245-E281 PolarHBondContact OG-OE1 2.94Å
246	E	86.8	Confident	93.5	Very high	121 Å²	121	57.2 Å²	57.2	57%	0.565	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-49.9	173.9	-74	165.8	127.1	0	0	111.4	P242 S243	P242-E246 HydrophobicContact CB-CB 4.13Å; S243-E246 VanDerWaalsContact CB-OE2 3.31Å; S243-E246 WeakPolarHBondContact CB-OE2 3.39Å; S243-E246 PolarHBondContact N-OE2 2.95Å; S243-E246 PolarHBondContact O-N 2.91Å; S243-E246 VanDerWaalsContact OG-CD 3.24Å; S243-E246 VanDerWaalsContact OG-CG 3.28Å; S243-E246 WeakPolarHBondContact OG-CG 3.37Å; S243-E246 PolarHBondContact OG-OE2 3.26Å
247	D	86.9	Confident	93.5	Very high	65 Å²	65	56.3 Å²	56.3	35%	0.348	32%	0.32	S	S	.	.			trans	-144.8	92	176.6	177.2	-3.2	0	0	0	109.6	P242 S243 G249 K250	P242-D247 HydrophobicContact CB-CB 4.28Å; P242-D247 HydrophobicContact CG-CB 3.7Å; S243-D247 PolarHBondContact O-N 2.94Å; D247-G249 PolarHBondContact O-N 3.07Å; D247-G249 WeakPolarHBondContact OD1-CA 3.37Å; D247-G249 PolarHBondContact OD1-N 3.18Å; D247-K250 PolarHBondContact OD1-N 3.21Å; D247-K250 WeakPolarHBondContact OD2-CB 3.24Å
248	P	90.6	Very high	93.4	Very high	34 Å²	34	54.5 Å²	54.5	22%	0.221	31%	0.314	C	S	.	.	H	α-helix	trans	-64.3	-27.6	177	-10.2	18.3	0	0	0	112.6	F244 T252 G344	F244-P248 HydrophobicContact CD2-CB 4.24Å; F244-P248 HydrophobicContact CE1-CB 4.35Å; F244-P248 HydrophobicContact CE2-CB 4.03Å; F244-P248 HydrophobicContact CZ-CB 4.09Å; F244-P248 VanDerWaalsContact O-CA 3.3Å; F244-P248 WeakPolarHBondContact O-CA 3.4Å; F244-P248 WeakPolarHBondContact O-CB 3.46Å; F244-P248 VanDerWaalsContact O-CD 3.3Å; F244-P248 WeakPolarHBondContact O-CD 3.32Å; F244-P248 WeakPolarHBondContact O-CG 3.48Å; P248-T252 WeakPolarHBondContact O-CB 3.28Å; P248-T252 PolarHBondContact O-N 3.07Å; P248-T252 PolarHBondContact O-OG1 3.11Å; P248-G344 VanDerWaalsContact CB-CA 3.43Å; P248-G344 WeakPolarHBondContact CG-O 3.39Å
249	G	90.4	Very high	93.4	Very high	46 Å²	46	50.4 Å²	50.4	47%	0.474	30%	0.296	S	S	.	.	H	α-helix	trans	-69.5	-53.3	-174.7	0	0	0	0	0	111.6	D247 L251 T252 A253	D247-G249 PolarHBondContact O-N 3.07Å; D247-G249 WeakPolarHBondContact OD1-CA 3.37Å; D247-G249 PolarHBondContact OD1-N 3.18Å; G249-L251 VanDerWaalsContact C-N 3.35Å; G249-L251 PolarHBondContact O-N 3.33Å; G249-T252 PolarHBondContact O-N 2.93Å; G249-A253 PolarHBondContact O-N 3.28Å
250	K	93.1	Very high	93.2	Very high	98 Å²	98	48 Å²	48	43%	0.426	29%	0.286	S	S	.	.	H	α-helix	trans	-60.3	-42	178.9	178.5	172	168	-174.4	0	112.4	N241 P242 D247 L254	N241-K250 WeakPolarHBondContact OD1-CE 3.45Å; P242-K250 HydrophobicContact CG-CB 4.42Å; P242-K250 HydrophobicContact CG-CD 4.03Å; P242-K250 HydrophobicContact CG-CG 4.47Å; D247-K250 PolarHBondContact OD1-N 3.21Å; D247-K250 WeakPolarHBondContact OD2-CB 3.24Å; K250-L254 PolarHBondContact O-N 2.79Å; K250-L254 VanDerWaalsContact O-N 3.13Å
251	L	95.1	Very high	92.8	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-74.1	-31.9	178.6	-166.5	64.1	0	0	0	112.6	N241 F244 G249 L254 I255 L276 L277	N241-L251 HydrophobicContact CB-CD1 4.05Å; F244-L251 HydrophobicContact CB-CD2 3.9Å; F244-L251 HydrophobicContact CD2-CB 4.46Å; F244-L251 HydrophobicContact CD2-CD2 4.27Å; G249-L251 VanDerWaalsContact C-N 3.35Å; G249-L251 PolarHBondContact O-N 3.33Å; L251-L254 HydrophobicContact CD1-CD2 3.81Å; L251-L254 PolarHBondContact O-N 3.1Å; L251-I255 HydrophobicContact CG-CD1 4.22Å; L251-I255 WeakPolarHBondContact O-CG1 3.46Å; L251-I255 PolarHBondContact O-N 2.96Å; L251-L276 HydrophobicContact CD1-CD1 4.38Å; L251-L277 HydrophobicContact CD2-CD2 3.89Å
252	T	95.9	Very high	92.5	Very high	11 Å²	11	44.5 Å²	44.5	7%	0.067	27%	0.269	C	S	.	.	H	α-helix	trans	-63.5	-46.8	171.4	-61.5	0	0	0	0	111	P248 G249 L254 I255 E256 L337 L340 Q341	P248-T252 WeakPolarHBondContact O-CB 3.28Å; P248-T252 PolarHBondContact O-N 3.07Å; P248-T252 PolarHBondContact O-OG1 3.11Å; G249-T252 PolarHBondContact O-N 2.93Å; T252-L254 VanDerWaalsContact C-N 3.31Å; T252-L254 PolarHBondContact O-N 3.28Å; T252-I255 PolarHBondContact O-N 3.44Å; T252-I255 VanDerWaalsContact O-N 3.12Å; T252-E256 WeakPolarHBondContact O-CB 3.49Å; T252-E256 PolarHBondContact O-N 2.96Å; T252-L337 HydrophobicContact CG2-CD1 3.97Å; T252-L340 HydrophobicContact CG2-CB 3.88Å; T252-Q341 HydrophobicContact CG2-CG 3.93Å
253	A	95.9	Very high	92.3	Very high	56 Å²	56	47.2 Å²	47.2	46%	0.463	28%	0.279	S	S	.	.	H	α-helix	trans	-62	-36.1	178.5	0	0	0	0	0	112.9	G249 S257	G249-A253 PolarHBondContact O-N 3.28Å; A253-S257 WeakPolarHBondContact O-CB 3.46Å; A253-S257 PolarHBondContact O-N 3.39Å
254	L	96.7	Very high	92.3	Very high	32 Å²	32	44.9 Å²	44.9	17%	0.168	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-50.2	170.9	179	70.3	0	0	0	111.5	W237 N241 K250 L251 T252 E256 S257 V258 L276	W237-L254 HydrophobicContact CB-CD2 3.98Å; W237-L254 HydrophobicContact CG-CD2 4.42Å; N241-L254 HydrophobicContact CB-CD2 4.4Å; N241-L254 VanDerWaalsContact ND2-CD2 3.32Å; N241-L254 WeakPolarHBondContact ND2-CD2 3.31Å; K250-L254 PolarHBondContact O-N 2.79Å; K250-L254 VanDerWaalsContact O-N 3.13Å; L251-L254 HydrophobicContact CD1-CD2 3.81Å; L251-L254 PolarHBondContact O-N 3.1Å; T252-L254 VanDerWaalsContact C-N 3.31Å; T252-L254 PolarHBondContact O-N 3.28Å; L254-E256 VanDerWaalsContact C-N 3.35Å; L254-E256 PolarHBondContact O-N 3.28Å; L254-S257 WeakPolarHBondContact O-CB 3.36Å; L254-S257 PolarHBondContact O-N 3.37Å; L254-V258 WeakPolarHBondContact O-CG2 3.32Å; L254-V258 PolarHBondContact O-N 3.26Å; L254-L276 HydrophobicContact CD2-CD1 4.46Å
255	I	96.7	Very high	92.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-40.6	-178.8	-66.4	165.4	0	0	0	110.3	L251 T252 S257 V258 L259 L272 L276 L340	L251-I255 HydrophobicContact CG-CD1 4.22Å; L251-I255 WeakPolarHBondContact O-CG1 3.46Å; L251-I255 PolarHBondContact O-N 2.96Å; T252-I255 PolarHBondContact O-N 3.44Å; T252-I255 VanDerWaalsContact O-N 3.12Å; I255-S257 PolarHBondContact O-N 3.38Å; I255-V258 CarbonylContact O-C 3.54Å; I255-V258 PolarHBondContact O-N 2.84Å; I255-V258 VanDerWaalsContact O-N 3.12Å; I255-L259 HydrophobicContact CG2-CD1 4.07Å; I255-L259 HydrophobicContact CG2-CD2 4.49Å; I255-L259 HydrophobicContact CG2-CG 3.96Å; I255-L259 VanDerWaalsContact O-CG 3.3Å; I255-L259 WeakPolarHBondContact O-CG 3.46Å; I255-L259 PolarHBondContact O-N 2.87Å; I255-L272 HydrophobicContact CG2-CD2 4.06Å; I255-L276 HydrophobicContact CD1-CD1 4.12Å; I255-L276 HydrophobicContact CG1-CD1 3.77Å; I255-L340 HydrophobicContact CB-CD1 4.01Å; I255-L340 HydrophobicContact CD1-CD1 4.13Å; I255-L340 HydrophobicContact CD1-CD2 3.94Å; I255-L340 HydrophobicContact CG2-CD1 3.51Å
256	E	96.9	Very high	92.8	Very high	76 Å²	76	43.3 Å²	43.3	36%	0.355	25%	0.247	S	C	.	.	H	α-helix	trans	-56.9	-45.4	174.4	-176.2	165.8	-170.6	0	0	112.6	T252 L254 V258 L259 T260 L337	T252-E256 WeakPolarHBondContact O-CB 3.49Å; T252-E256 PolarHBondContact O-N 2.96Å; L254-E256 VanDerWaalsContact C-N 3.35Å; L254-E256 PolarHBondContact O-N 3.28Å; E256-V258 VanDerWaalsContact C-N 3.34Å; E256-V258 PolarHBondContact O-N 2.83Å; E256-L259 PolarHBondContact O-N 3.48Å; E256-T260 WeakPolarHBondContact O-CB 3.3Å; E256-T260 PolarHBondContact O-N 3.35Å; E256-T260 PolarHBondContact O-OG1 2.97Å; E256-L337 HydrophobicContact CB-CD1 3.71Å; E256-L337 HydrophobicContact CG-CD1 3.86Å; E256-L337 HydrophobicContact CG-CD2 3.83Å
257	S	95.8	Very high	93.2	Very high	68 Å²	68	40.4 Å²	40.4	48%	0.476	24%	0.235	S	C	.	.	H	α-helix	trans	-60.2	-42.7	173.7	-177.6	0	0	0	0	111.7	A253 L254 I255 T261	A253-S257 WeakPolarHBondContact O-CB 3.46Å; A253-S257 PolarHBondContact O-N 3.39Å; L254-S257 WeakPolarHBondContact O-CB 3.36Å; L254-S257 PolarHBondContact O-N 3.37Å; I255-S257 PolarHBondContact O-N 3.38Å; S257-T261 WeakPolarHBondContact O-CB 3.37Å; S257-T261 WeakPolarHBondContact O-CG2 3.48Å; S257-T261 PolarHBondContact O-N 3.41Å; S257-T261 PolarHBondContact O-OG1 2.71Å
258	V	94.1	Very high	93.6	Very high	5 Å²	5	37.3 Å²	37.3	3%	0.03	22%	0.218	C	C	.	.	H	α-helix	trans	-66.5	-50.1	174.8	175.6	0	0	0	0	111.4	F229 W237 L254 I255 E256 T260 T261 H262 L272	F229-V258 HydrophobicContact CE1-CG1 3.77Å; F229-V258 HydrophobicContact CZ-CG1 3.67Å; W237-V258 HydrophobicContact CD2-CG2 4.38Å; W237-V258 HydrophobicContact CE3-CG2 4.34Å; W237-V258 HydrophobicContact CH2-CG1 4.14Å; W237-V258 HydrophobicContact CH2-CG2 3.96Å; W237-V258 HydrophobicContact CZ2-CG2 3.98Å; W237-V258 HydrophobicContact CZ3-CG1 4.19Å; W237-V258 HydrophobicContact CZ3-CG2 4.14Å; L254-V258 WeakPolarHBondContact O-CG2 3.32Å; L254-V258 PolarHBondContact O-N 3.26Å; I255-V258 CarbonylContact O-C 3.54Å; I255-V258 PolarHBondContact O-N 2.84Å; I255-V258 VanDerWaalsContact O-N 3.12Å; E256-V258 VanDerWaalsContact C-N 3.34Å; E256-V258 PolarHBondContact O-N 2.83Å; V258-T260 PolarHBondContact O-N 3.26Å; V258-T261 PolarHBondContact O-N 3.42Å; V258-H262 HydrophobicContact CG1-CB 3.95Å; V258-H262 WeakPolarHBondContact O-CA 3.44Å; V258-H262 WeakPolarHBondContact O-CB 3.31Å; V258-H262 PolarHBondContact O-N 3.3Å; V258-L272 HydrophobicContact CB-CD2 4.38Å; V258-L272 HydrophobicContact CG1-CD1 4.39Å; V258-L272 HydrophobicContact CG1-CD2 3.84Å
259	L	94.1	Very high	93.9	Very high	9 Å²	9	35.8 Å²	35.8	5%	0.047	21%	0.208	C	C	.	.	H	α-helix	trans	-55.3	-38.3	179.5	-67.9	-178.3	0	0	0	112.1	I255 E256 P264 R333 L336 L337	I255-L259 HydrophobicContact CG2-CD1 4.07Å; I255-L259 HydrophobicContact CG2-CD2 4.49Å; I255-L259 HydrophobicContact CG2-CG 3.96Å; I255-L259 VanDerWaalsContact O-CG 3.3Å; I255-L259 WeakPolarHBondContact O-CG 3.46Å; I255-L259 PolarHBondContact O-N 2.87Å; E256-L259 PolarHBondContact O-N 3.48Å; L259-P264 HydrophobicContact CD2-CG 3.66Å; L259-R333 HydrophobicContact CD2-CG 4.28Å; L259-L336 HydrophobicContact CD1-CD2 4.39Å; L259-L336 HydrophobicContact CD1-CG 4.45Å; L259-L336 HydrophobicContact CD2-CD2 4.16Å; L259-L337 HydrophobicContact CD1-CB 4.23Å
260	T	89.4	Confident	94.2	Very high	68 Å²	68	35.1 Å²	35.1	42%	0.417	19%	0.193	S	C	.	.	H	α-helix	trans	-72.6	-57	177.7	-57.5	0	0	0	0	112.1	L156 E256 V258	L156-T260 HydrophobicContact CD2-CG2 4.21Å; E256-T260 WeakPolarHBondContact O-CB 3.3Å; E256-T260 PolarHBondContact O-N 3.35Å; E256-T260 PolarHBondContact O-OG1 2.97Å; V258-T260 PolarHBondContact O-N 3.26Å
261	T	88.3	Confident	94.3	Very high	63 Å²	63	34.5 Å²	34.5	39%	0.387	19%	0.191	S	C	.	.	H	α-helix	trans	-75.2	-46.8	-172.9	54.6	0	0	0	0	112.9	F214 S257 V258	F214-T261 WeakPolarHBondContact CD1-O 3.44Å; S257-T261 WeakPolarHBondContact O-CB 3.37Å; S257-T261 WeakPolarHBondContact O-CG2 3.48Å; S257-T261 PolarHBondContact O-N 3.41Å; S257-T261 PolarHBondContact O-OG1 2.71Å; V258-T261 PolarHBondContact O-N 3.42Å
262	H	86.9	Confident	94.3	Very high	18 Å²	18	34.3 Å²	34.3	8%	0.083	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-18.5	-170.7	-75.9	63.5	0	0	0	112.7	A213 P215 F229 W237 V258	A213-H262 PolarHBondContact O-CD2 3.43Å; A213-H262 PolarHBondContact O-CE1 2.89Å; A213-H262 PolarHBondContact O-ND1 3.18Å; A213-H262 PolarHBondContact O-NE2 3.18Å; P215-H262 WeakPolarHBondContact CD-O 3.4Å; P215-H262 HydrophobicContact CG-CB 4.26Å; F229-H262 AromaticContact CD1-CD2 3.91Å; F229-H262 HydrophobicContact CE1-CB 3.93Å; F229-H262 AromaticContact CE1-CD2 3.52Å; F229-H262 AromaticContact CE1-CG 3.96Å; F229-H262 HydrophobicContact CZ-CB 4.48Å; W237-H262 AromaticContact CH2-CD2 3.92Å; W237-H262 AromaticContact CH2-NE2 3.6Å; W237-H262 AromaticContact CZ2-CE1 3.96Å; W237-H262 AromaticContact CZ2-NE2 3.64Å; V258-H262 HydrophobicContact CG1-CB 3.95Å; V258-H262 WeakPolarHBondContact O-CA 3.44Å; V258-H262 WeakPolarHBondContact O-CB 3.31Å; V258-H262 PolarHBondContact O-N 3.3Å
263	Q	89.6	Confident	94.4	Very high	93 Å²	93	33.8 Å²	33.8	44%	0.435	19%	0.187	S	C	.	.			trans	46.1	55.7	-176.9	-63.3	-155.4	44.7	0	0	114	L216 R333	L216-Q263 HydrophobicContact CB-CB 4.35Å; L216-Q263 WeakPolarHBondContact CD1-O 3.37Å; Q263-R333 VanDerWaalsContact C-CZ 3.46Å; Q263-R333 PolarHBondContact O-NH2 3.42Å
264	P	93.9	Very high	94.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.188	C	C	.	.			trans	-60.7	148.7	-176	22.8	-32.1	0	0	0	113.8	F229 L259 D268 R333	F229-P264 HydrophobicContact CE2-CB 4.34Å; F229-P264 HydrophobicContact CZ-CB 4.06Å; L259-P264 HydrophobicContact CD2-CG 3.66Å; P264-D268 HydrophobicContact CB-CB 3.37Å; P264-R333 VanDerWaalsContact O-CZ 3.28Å; P264-R333 PolarHBondContact O-NE 2.85Å; P264-R333 PolarHBondContact O-NH2 3.02Å
265	T	94.8	Very high	94.4	Very high	13 Å²	13	33 Å²	33	8%	0.08	19%	0.188	C	C	.	.			trans	-72	-179.4	165.9	68.1	0	0	0	0	111.3	L216 Y226 D267 D268 C269	L216-T265 HydrophobicContact CD1-CG2 4.31Å; L216-T265 HydrophobicContact CD2-CG2 4.33Å; L216-T265 HydrophobicContact CG-CG2 4.37Å; Y226-T265 HydrophobicContact CD2-CG2 4.2Å; Y226-T265 HydrophobicContact CE2-CG2 4.21Å; T265-D267 PolarHBondContact OG1-N 2.97Å; T265-D268 VanDerWaalsContact CB-OD2 3.28Å; T265-D268 WeakPolarHBondContact CB-OD2 3.35Å; T265-D268 WeakPolarHBondContact CG2-OD2 3.35Å; T265-D268 PolarHBondContact N-OD2 3.35Å; T265-D268 VanDerWaalsContact OG1-CG 3.29Å; T265-D268 PolarHBondContact OG1-N 3.43Å; T265-D268 PolarHBondContact OG1-OD2 3.49Å; T265-C269 PolarHBondContact O-N 2.9Å; T265-C269 PolarHBondContact O-SG 2.72Å
266	W	96.1	Very high	94.4	Very high	29 Å²	29	33.6 Å²	33.6	11%	0.11	19%	0.191	C	C	.	.	H	α-helix	trans	-61.9	-42.7	172	-179.3	97.8	0	0	0	111.6	C269 Q270 P312 E314 R315 P316 Y332	W266-C269 WeakPolarHBondContact O-CB 3.28Å; W266-C269 PolarHBondContact O-N 3.41Å; W266-Q270 HydrophobicContact CD2-CG 3.94Å; W266-Q270 HydrophobicContact CE3-CG 3.83Å; W266-Q270 HydrophobicContact CH2-CG 3.6Å; W266-Q270 HydrophobicContact CZ2-CG 3.69Å; W266-Q270 HydrophobicContact CZ3-CG 3.66Å; W266-Q270 WeakPolarHBondContact O-CG 3.36Å; W266-Q270 PolarHBondContact O-N 3.13Å; W266-P312 PolarHBondContact NE1-O 3.28Å; W266-E314 VanDerWaalsContact CZ2-O 3.3Å; W266-E314 WeakPolarHBondContact CZ2-O 3.3Å; W266-R315 HydrophobicContact CE3-CB 4.02Å; W266-R315 HydrophobicContact CE3-CG 3.8Å; W266-R315 HydrophobicContact CH2-CB 3.89Å; W266-R315 HydrophobicContact CZ3-CB 3.56Å; W266-R315 HydrophobicContact CZ3-CG 3.73Å; W266-P316 HydrophobicContact CB-CG 4.13Å; W266-P316 VanDerWaalsContact CG-CD 3.49Å; W266-P316 HydrophobicContact CG-CG 3.97Å; W266-Y332 AromaticContact CD1-CE2 3.59Å; W266-Y332 AromaticContact CD1-CZ 3.49Å; W266-Y332 VanDerWaalsContact CD1-CZ 3.49Å; W266-Y332 AromaticContact NE1-CE2 3.88Å; W266-Y332 AromaticContact NE1-CZ 3.85Å
267	D	95.6	Very high	94.4	Very high	59 Å²	59	30.5 Å²	30.5	32%	0.316	18%	0.176	S	C	.	.	H	α-helix	trans	-64.5	-44.5	-179.9	-64.1	-63.1	0	0	0	111.7	T265 C269 Q270 Q271 R315	T265-D267 PolarHBondContact OG1-N 2.97Å; D267-C269 VanDerWaalsContact C-N 3.32Å; D267-C269 PolarHBondContact O-N 2.9Å; D267-Q270 PolarHBondContact O-N 2.68Å; D267-Q270 VanDerWaalsContact O-N 3.1Å; D267-Q271 PolarHBondContact O-N 3.07Å; D267-R315 VanDerWaalsContact CG-NE 3.27Å; D267-R315 WeakPolarHBondContact OD1-CD 3.31Å; D267-R315 IonicContact OD1-CZ 2.7Å; D267-R315 IonicContact OD1-NE 2.67Å; D267-R315 PolarHBondContact OD1-NE 3.37Å; D267-R315 IonicContact OD1-NH2 3.97Å; D267-R315 IonicContact OD2-CZ 2.64Å; D267-R315 VanDerWaalsContact OD2-CZ 3.23Å; D267-R315 IonicContact OD2-NE 3.31Å; D267-R315 PolarHBondContact OD2-NE 3.4Å; D267-R315 IonicContact OD2-NH2 2.73Å; D267-R315 PolarHBondContact OD2-NH2 3.38Å
268	D	95.6	Very high	94.4	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-58.1	-44	174	-64.5	-56.3	0	0	0	111.2	Y226 F229 P264 T265 Q270 Q271 L272	Y226-D268 WeakPolarHBondContact CE2-OD2 3.42Å; Y226-D268 PolarHBondContact OH-OD1 3.45Å; F229-D268 HydrophobicContact CD2-CB 4.14Å; F229-D268 HydrophobicContact CE2-CB 3.67Å; F229-D268 HydrophobicContact CZ-CB 4.42Å; P264-D268 HydrophobicContact CB-CB 3.37Å; T265-D268 VanDerWaalsContact CB-OD2 3.28Å; T265-D268 WeakPolarHBondContact CB-OD2 3.35Å; T265-D268 WeakPolarHBondContact CG2-OD2 3.35Å; T265-D268 PolarHBondContact N-OD2 3.35Å; T265-D268 VanDerWaalsContact OG1-CG 3.29Å; T265-D268 PolarHBondContact OG1-N 3.43Å; T265-D268 PolarHBondContact OG1-OD2 3.49Å; D268-Q270 VanDerWaalsContact C-N 3.33Å; D268-Q270 PolarHBondContact O-N 2.72Å; D268-Q271 PolarHBondContact O-N 3.41Å; D268-L272 WeakPolarHBondContact O-CB 3.29Å; D268-L272 PolarHBondContact O-N 2.83Å
269	C	96.4	Very high	94.4	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.007	21%	0.205	C	C	.	.	H	α-helix	trans	-60.6	-41.2	174.7	-67.7	0	0	0	0	111.6	T265 W266 D267 Q271 L272 L273 Y332 L336	T265-C269 PolarHBondContact O-N 2.9Å; T265-C269 PolarHBondContact O-SG 2.72Å; W266-C269 WeakPolarHBondContact O-CB 3.28Å; W266-C269 PolarHBondContact O-N 3.41Å; D267-C269 VanDerWaalsContact C-N 3.32Å; D267-C269 PolarHBondContact O-N 2.9Å; C269-Q271 VanDerWaalsContact C-N 3.34Å; C269-Q271 PolarHBondContact O-N 3.36Å; C269-L272 PolarHBondContact O-N 3.02Å; C269-L273 WeakPolarHBondContact O-CB 3.35Å; C269-L273 WeakPolarHBondContact O-CD1 3.48Å; C269-L273 WeakPolarHBondContact O-CG 3.31Å; C269-L273 PolarHBondContact O-N 2.84Å; C269-Y332 HydrophobicContact CB-CE1 3.79Å; C269-L336 HydrophobicContact CB-CD2 4.14Å
270	Q	96.4	Very high	94.3	Very high	32 Å²	32	40.2 Å²	40.2	15%	0.15	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-37.1	177.4	-66.5	-55.1	-24.7	0	0	112.7	W266 D267 D268 G274 K282 Y332	W266-Q270 HydrophobicContact CD2-CG 3.94Å; W266-Q270 HydrophobicContact CE3-CG 3.83Å; W266-Q270 HydrophobicContact CH2-CG 3.6Å; W266-Q270 HydrophobicContact CZ2-CG 3.69Å; W266-Q270 HydrophobicContact CZ3-CG 3.66Å; W266-Q270 WeakPolarHBondContact O-CG 3.36Å; W266-Q270 PolarHBondContact O-N 3.13Å; D267-Q270 PolarHBondContact O-N 2.68Å; D267-Q270 VanDerWaalsContact O-N 3.1Å; D268-Q270 VanDerWaalsContact C-N 3.33Å; D268-Q270 PolarHBondContact O-N 2.72Å; Q270-G274 PolarHBondContact O-N 3.3Å; Q270-K282 PolarHBondContact O-NZ 3.08Å; Q270-Y332 PolarHBondContact NE2-OH 3.14Å; Q270-Y332 VanDerWaalsContact NE2-OH 3.1Å
271	Q	95.5	Very high	94.6	Very high	85 Å²	85	37.2 Å²	37.2	40%	0.397	22%	0.217	S	C	.	.	H	α-helix	trans	-68.8	-44.9	175.3	-175.8	-178.5	65	0	0	111.9	L234 D267 D268 C269 G274 T275	L234-Q271 HydrophobicContact CD1-CG 3.82Å; D267-Q271 PolarHBondContact O-N 3.07Å; D268-Q271 PolarHBondContact O-N 3.41Å; C269-Q271 VanDerWaalsContact C-N 3.34Å; C269-Q271 PolarHBondContact O-N 3.36Å; Q271-G274 PolarHBondContact O-N 2.71Å; Q271-T275 WeakPolarHBondContact O-CB 3.49Å; Q271-T275 PolarHBondContact O-N 3.41Å; Q271-T275 PolarHBondContact O-OG1 3.41Å
272	L	96.1	Very high	95	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.9	-53.1	177.9	-174.9	66.4	0	0	0	110.7	F229 L234 W237 I255 V258 D268 C269 G274 T275 L276	F229-L272 HydrophobicContact CE2-CB 4.11Å; F229-L272 HydrophobicContact CZ-CD2 4.49Å; L234-L272 HydrophobicContact CD2-CD1 3.92Å; W237-L272 HydrophobicContact CE3-CD1 3.84Å; W237-L272 HydrophobicContact CZ3-CD1 3.89Å; I255-L272 HydrophobicContact CG2-CD2 4.06Å; V258-L272 HydrophobicContact CB-CD2 4.38Å; V258-L272 HydrophobicContact CG1-CD1 4.39Å; V258-L272 HydrophobicContact CG1-CD2 3.84Å; D268-L272 WeakPolarHBondContact O-CB 3.29Å; D268-L272 PolarHBondContact O-N 2.83Å; C269-L272 PolarHBondContact O-N 3.02Å; L272-G274 PolarHBondContact O-N 2.71Å; L272-T275 PolarHBondContact O-N 2.83Å; L272-L276 HydrophobicContact CD1-CD1 3.57Å; L272-L276 HydrophobicContact CD1-CG 4.22Å; L272-L276 HydrophobicContact CG-CD1 4.03Å; L272-L276 WeakPolarHBondContact O-CB 3.45Å; L272-L276 WeakPolarHBondContact O-CG 3.43Å; L272-L276 PolarHBondContact O-N 3.31Å
273	L	96.9	Very high	95.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-40.2	177.1	-63.4	168.2	0	0	0	112.1	C269 T275 L277 K282 V285 L286 L336	C269-L273 WeakPolarHBondContact O-CB 3.35Å; C269-L273 WeakPolarHBondContact O-CD1 3.48Å; C269-L273 WeakPolarHBondContact O-CG 3.31Å; C269-L273 PolarHBondContact O-N 2.84Å; L273-T275 PolarHBondContact O-N 3.06Å; L273-L277 HydrophobicContact CB-CD1 4.34Å; L273-L277 HydrophobicContact CD2-CD1 3.62Å; L273-L277 HydrophobicContact CD2-CG 4.44Å; L273-L277 VanDerWaalsContact O-CB 3.29Å; L273-L277 WeakPolarHBondContact O-CB 3.15Å; L273-L277 PolarHBondContact O-N 2.77Å; L273-K282 HydrophobicContact CB-CD 4.02Å; L273-K282 HydrophobicContact CB-CG 4.27Å; L273-V285 HydrophobicContact CD2-CG1 4.45Å; L273-L286 HydrophobicContact CD1-CD2 4.37Å; L273-L336 HydrophobicContact CD1-CD1 3.64Å; L273-L336 HydrophobicContact CD1-CD2 3.94Å; L273-L336 HydrophobicContact CD1-CG 4.46Å; L273-L336 HydrophobicContact CD2-CD1 3.95Å; L273-L336 HydrophobicContact CD2-CD2 4.4Å; L273-L336 HydrophobicContact CG-CD1 4.36Å; L273-L336 HydrophobicContact CG-CD2 4.37Å
274	G	96.6	Very high	95.6	Very high	47 Å²	47	42 Å²	42	49%	0.485	23%	0.23	S	C	.	.	H	α-helix	trans	-69.4	-17.8	177.9	0	0	0	0	0	114.2	Q270 Q271 L272	Q270-G274 PolarHBondContact O-N 3.3Å; Q271-G274 PolarHBondContact O-N 2.71Å; L272-G274 PolarHBondContact O-N 2.71Å
275	T	96.8	Very high	95.8	Very high	26 Å²	26	42 Å²	42	16%	0.16	23%	0.23	C	C	.	.	H	α-helix	trans	-95.8	-43.7	176.2	-50.6	0	0	0	0	111.8	L234 K238 Q271 L272 L273	L234-T275 HydrophobicContact CB-CG2 4.07Å; K238-T275 HydrophobicContact CD-CG2 4.31Å; K238-T275 WeakPolarHBondContact CD-O 3.41Å; K238-T275 WeakPolarHBondContact CE-O 3.43Å; K238-T275 PolarHBondContact NZ-O 3.39Å; Q271-T275 WeakPolarHBondContact O-CB 3.49Å; Q271-T275 PolarHBondContact O-N 3.41Å; Q271-T275 PolarHBondContact O-OG1 3.41Å; L272-T275 PolarHBondContact O-N 2.83Å; L273-T275 PolarHBondContact O-N 3.06Å
276	L	96.8	Very high	95.9	Very high	13 Å²	13	42.6 Å²	42.6	7%	0.068	23%	0.233	C	C	.	.	H	α-helix	trans	-84.8	-26.3	-174	-62.3	-178.2	0	0	0	114.3	W237 K238 L251 L254 I255 L272	W237-L276 HydrophobicContact CB-CD2 3.98Å; K238-L276 HydrophobicContact CB-CD2 3.93Å; L251-L276 HydrophobicContact CD1-CD1 4.38Å; L254-L276 HydrophobicContact CD2-CD1 4.46Å; I255-L276 HydrophobicContact CD1-CD1 4.12Å; I255-L276 HydrophobicContact CG1-CD1 3.77Å; L272-L276 HydrophobicContact CD1-CD1 3.57Å; L272-L276 HydrophobicContact CD1-CG 4.22Å; L272-L276 HydrophobicContact CG-CD1 4.03Å; L272-L276 WeakPolarHBondContact O-CB 3.45Å; L272-L276 WeakPolarHBondContact O-CG 3.43Å; L272-L276 PolarHBondContact O-N 3.31Å
277	L	96.6	Very high	95.8	Very high	10 Å²	10	45.8 Å²	45.8	5%	0.052	25%	0.252	C	S	.	.	S	Bend	trans	-110	154.5	-177.7	-51.8	179.6	0	0	0	111.8	F244 L251 L273 E281 K282 V285 L340	F244-L277 HydrophobicContact CB-CD2 3.63Å; F244-L277 HydrophobicContact CD2-CD2 3.9Å; F244-L277 HydrophobicContact CG-CD2 3.83Å; L251-L277 HydrophobicContact CD2-CD2 3.89Å; L273-L277 HydrophobicContact CB-CD1 4.34Å; L273-L277 HydrophobicContact CD2-CD1 3.62Å; L273-L277 HydrophobicContact CD2-CG 4.44Å; L273-L277 VanDerWaalsContact O-CB 3.29Å; L273-L277 WeakPolarHBondContact O-CB 3.15Å; L273-L277 PolarHBondContact O-N 2.77Å; L277-E281 HydrophobicContact CB-CB 4.05Å; L277-E281 HydrophobicContact CD2-CB 4.48Å; L277-K282 HydrophobicContact CB-CB 4.21Å; L277-K282 HydrophobicContact CD1-CB 4.24Å; L277-V285 HydrophobicContact CD1-CB 4.39Å; L277-V285 HydrophobicContact CD1-CG2 3.98Å; L277-L340 HydrophobicContact CD1-CD2 4.43Å
278	T	96.4	Very high	95.9	Very high	77 Å²	77	44.9 Å²	44.9	47%	0.472	25%	0.246	S	C	.	.			trans	-71.3	166.9	160.6	63.3	0	0	0	0	111.1	E280 E281 K282	T278-E280 VanDerWaalsContact C-N 3.32Å; T278-E280 PolarHBondContact O-N 3.07Å; T278-E281 VanDerWaalsContact CB-OE2 3.29Å; T278-E281 WeakPolarHBondContact CB-OE2 3.45Å; T278-E281 WeakPolarHBondContact CG2-OE2 3.29Å; T278-E281 PolarHBondContact N-OE2 3.37Å; T278-E281 PolarHBondContact O-N 3.37Å; T278-E281 VanDerWaalsContact OG1-CG 3.25Å; T278-E281 WeakPolarHBondContact OG1-CG 3.24Å; T278-E281 PolarHBondContact OG1-N 2.88Å; T278-E281 PolarHBondContact OG1-OE2 2.97Å; T278-K282 WeakPolarHBondContact O-CB 3.49Å; T278-K282 PolarHBondContact O-N 3.1Å
279	G	93.8	Very high	95.9	Very high	61 Å²	61	44.9 Å²	44.9	63%	0.629	25%	0.245	S	C	*	.	H	α-helix	trans	-58.5	-40.2	177.8	0	0	0	0	0	113.6	Q283	G279-Q283 WeakPolarHBondContact O-CB 3.45Å; G279-Q283 PolarHBondContact O-N 2.98Å
280	E	92.4	Very high	96	Very high	148 Å²	148	47.3 Å²	47.3	69%	0.692	25%	0.254	S	S	*	.	H	α-helix	trans	-69.4	-43.4	178.8	-64.4	-174.9	-164.8	0	0	112.5	T278 Q283 R284	T278-E280 VanDerWaalsContact C-N 3.32Å; T278-E280 PolarHBondContact O-N 3.07Å; E280-Q283 PolarHBondContact O-N 3.45Å; E280-R284 WeakPolarHBondContact O-CB 3.39Å; E280-R284 PolarHBondContact O-N 2.94Å
281	E	94.8	Very high	95.9	Very high	6 Å²	6	51.2 Å²	51.2	3%	0.028	27%	0.271	C	S	.	.	H	α-helix	trans	-64.1	-45.3	176.3	-68.3	161.7	147.2	0	0	110.6	F244 S245 L277 T278 Q283 R284 V285	F244-E281 HydrophobicContact CB-CB 4.47Å; F244-E281 HydrophobicContact CB-CG 4.23Å; F244-E281 WeakPolarHBondContact CB-OE1 3.48Å; F244-E281 HydrophobicContact CD1-CB 4.17Å; F244-E281 HydrophobicContact CD1-CG 4.11Å; S245-E281 VanDerWaalsContact CB-OE1 3.29Å; S245-E281 WeakPolarHBondContact CB-OE1 3.24Å; S245-E281 PolarHBondContact N-OE1 3.24Å; S245-E281 PolarHBondContact OG-OE1 2.94Å; L277-E281 HydrophobicContact CB-CB 4.05Å; L277-E281 HydrophobicContact CD2-CB 4.48Å; T278-E281 VanDerWaalsContact CB-OE2 3.29Å; T278-E281 WeakPolarHBondContact CB-OE2 3.45Å; T278-E281 WeakPolarHBondContact CG2-OE2 3.29Å; T278-E281 PolarHBondContact N-OE2 3.37Å; T278-E281 PolarHBondContact O-N 3.37Å; T278-E281 VanDerWaalsContact OG1-CG 3.25Å; T278-E281 WeakPolarHBondContact OG1-CG 3.24Å; T278-E281 PolarHBondContact OG1-N 2.88Å; T278-E281 PolarHBondContact OG1-OE2 2.97Å; E281-Q283 PolarHBondContact O-N 3.45Å; E281-R284 WeakPolarHBondContact O-CB 3.35Å; E281-R284 PolarHBondContact O-N 3.44Å; E281-V285 VanDerWaalsContact O-CG2 3.29Å; E281-V285 WeakPolarHBondContact O-CG2 3.36Å; E281-V285 PolarHBondContact O-N 2.9Å
282	K	96.9	Very high	95.9	Very high	42 Å²	42	47.9 Å²	47.9	18%	0.183	26%	0.258	C	S	.	.	H	α-helix	trans	-58.1	-47.1	173.7	-178.1	170.9	179.5	173.6	0	111.3	Q270 L273 L277 T278 R284 V285 L286	Q270-K282 PolarHBondContact O-NZ 3.08Å; L273-K282 HydrophobicContact CB-CD 4.02Å; L273-K282 HydrophobicContact CB-CG 4.27Å; L277-K282 HydrophobicContact CB-CB 4.21Å; L277-K282 HydrophobicContact CD1-CB 4.24Å; T278-K282 WeakPolarHBondContact O-CB 3.49Å; T278-K282 PolarHBondContact O-N 3.1Å; K282-R284 VanDerWaalsContact C-N 3.32Å; K282-R284 PolarHBondContact O-N 3.31Å; K282-V285 PolarHBondContact O-N 2.94Å; K282-L286 HydrophobicContact CG-CD1 3.93Å; K282-L286 HydrophobicContact CG-CG 4.33Å; K282-L286 VanDerWaalsContact O-CG 3.24Å; K282-L286 WeakPolarHBondContact O-CG 3.33Å; K282-L286 PolarHBondContact O-N 3.07Å
283	Q	96.1	Very high	96	Very high	147 Å²	147	48 Å²	48	69%	0.687	26%	0.259	S	S	*	.	H	α-helix	trans	-61.4	-39.6	177.9	-177.1	174.2	-30.5	0	0	112.1	G279 E280 E281 L287	G279-Q283 WeakPolarHBondContact O-CB 3.45Å; G279-Q283 PolarHBondContact O-N 2.98Å; E280-Q283 PolarHBondContact O-N 3.45Å; E281-Q283 PolarHBondContact O-N 3.45Å; Q283-L287 WeakPolarHBondContact O-CB 3.41Å; Q283-L287 PolarHBondContact O-N 3.32Å
284	R	93.8	Very high	95.8	Very high	85 Å²	85	54.9 Å²	54.9	32%	0.321	29%	0.285	S	S	.	.	H	α-helix	trans	-63.5	-47.6	175.6	-162.4	-176.1	-55.9	130.2	9.4	111.7	E280 E281 K282 L286 L287 E288 A343	E280-R284 WeakPolarHBondContact O-CB 3.39Å; E280-R284 PolarHBondContact O-N 2.94Å; E281-R284 WeakPolarHBondContact O-CB 3.35Å; E281-R284 PolarHBondContact O-N 3.44Å; K282-R284 VanDerWaalsContact C-N 3.32Å; K282-R284 PolarHBondContact O-N 3.31Å; R284-L286 PolarHBondContact O-N 3.15Å; R284-L287 WeakPolarHBondContact O-CB 3.47Å; R284-L287 PolarHBondContact O-N 3.31Å; R284-E288 WeakPolarHBondContact O-CG 3.39Å; R284-E288 PolarHBondContact O-N 3.37Å; R284-A343 HydrophobicContact CB-CB 4.25Å; R284-A343 HydrophobicContact CG-CB 3.85Å
285	V	96.8	Very high	95.6	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.3	-46.4	176.9	168.6	0	0	0	0	111.7	F244 L273 L277 E281 K282 L287 E288 A289 L336 L340 A343	F244-V285 HydrophobicContact CE1-CG2 4.19Å; F244-V285 HydrophobicContact CZ-CG2 4.03Å; L273-V285 HydrophobicContact CD2-CG1 4.45Å; L277-V285 HydrophobicContact CD1-CB 4.39Å; L277-V285 HydrophobicContact CD1-CG2 3.98Å; E281-V285 VanDerWaalsContact O-CG2 3.29Å; E281-V285 WeakPolarHBondContact O-CG2 3.36Å; E281-V285 PolarHBondContact O-N 2.9Å; K282-V285 PolarHBondContact O-N 2.94Å; V285-L287 VanDerWaalsContact C-N 3.32Å; V285-L287 PolarHBondContact O-N 2.69Å; V285-E288 PolarHBondContact O-N 3.38Å; V285-A289 WeakPolarHBondContact O-CB 3.3Å; V285-A289 PolarHBondContact O-N 2.97Å; V285-L336 HydrophobicContact CG1-CD1 3.61Å; V285-L340 HydrophobicContact CG1-CD2 3.94Å; V285-L340 HydrophobicContact CG1-CG 3.84Å; V285-L340 HydrophobicContact CG2-CD2 3.72Å; V285-L340 HydrophobicContact CG2-CG 4.33Å; V285-A343 HydrophobicContact CB-CB 4.36Å; V285-A343 HydrophobicContact CG2-CB 3.72Å
286	L	97.1	Very high	95.2	Very high	25 Å²	25	59.8 Å²	59.8	13%	0.131	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-33.9	178.1	-64.3	172	0	0	0	112.2	L273 K282 R284 R290 F311 L313	L273-L286 HydrophobicContact CD1-CD2 4.37Å; K282-L286 HydrophobicContact CG-CD1 3.93Å; K282-L286 HydrophobicContact CG-CG 4.33Å; K282-L286 VanDerWaalsContact O-CG 3.24Å; K282-L286 WeakPolarHBondContact O-CG 3.33Å; K282-L286 PolarHBondContact O-N 3.07Å; R284-L286 PolarHBondContact O-N 3.15Å; L286-R290 WeakPolarHBondContact O-CG 3.46Å; L286-R290 PolarHBondContact O-N 3.45Å; L286-F311 HydrophobicContact CB-CE1 4.39Å; L286-F311 HydrophobicContact CD2-CE1 3.56Å; L286-F311 HydrophobicContact CD2-CZ 3.84Å; L286-L313 HydrophobicContact CB-CD2 4.16Å; L286-L313 HydrophobicContact CD1-CD2 4.31Å
287	L	95.4	Very high	94.9	Very high	97 Å²	97	64.3 Å²	64.3	51%	0.508	33%	0.326	S	S	.	.	H	α-helix	trans	-67.7	-48	174.9	-171.9	80.4	0	0	0	111.8	Q283 R284 V285 R290 K291	Q283-L287 WeakPolarHBondContact O-CB 3.41Å; Q283-L287 PolarHBondContact O-N 3.32Å; R284-L287 WeakPolarHBondContact O-CB 3.47Å; R284-L287 PolarHBondContact O-N 3.31Å; V285-L287 VanDerWaalsContact C-N 3.32Å; V285-L287 PolarHBondContact O-N 2.69Å; L287-R290 PolarHBondContact O-N 2.63Å; L287-K291 WeakPolarHBondContact O-CG 3.43Å; L287-K291 PolarHBondContact O-N 2.68Å; L287-K291 VanDerWaalsContact O-N 3.1Å
288	E	95.7	Very high	94.5	Very high	40 Å²	40	66.2 Å²	66.2	19%	0.187	35%	0.348	C	S	.	.	H	α-helix	trans	-69.2	-33.6	179.8	-61.3	-45.5	127.9	0	0	112.5	R284 V285 R290 K291 A292 N342 A343	R284-E288 WeakPolarHBondContact O-CG 3.39Å; R284-E288 PolarHBondContact O-N 3.37Å; V285-E288 PolarHBondContact O-N 3.38Å; E288-R290 VanDerWaalsContact C-N 3.33Å; E288-R290 PolarHBondContact O-N 2.89Å; E288-K291 VanDerWaalsContact CD-NZ 3.3Å; E288-K291 PolarHBondContact O-N 3.3Å; E288-K291 IonicContact OE1-NZ 3.13Å; E288-K291 PolarHBondContact OE1-NZ 3Å; E288-K291 WeakPolarHBondContact OE2-CD 3.46Å; E288-K291 IonicContact OE2-NZ 2.71Å; E288-K291 PolarHBondContact OE2-NZ 3.44Å; E288-A292 PolarHBondContact O-N 2.9Å; E288-N342 HydrophobicContact CB-CB 3.78Å; E288-N342 HydrophobicContact CG-CB 4.11Å; E288-A343 HydrophobicContact CB-CB 4.38Å; E288-A343 HydrophobicContact CG-CB 3.96Å
289	A	97.3	Very high	94.3	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-59.6	-43.2	171.1	0	0	0	0	0	111.7	V285 K291 A292 F311 L335	V285-A289 WeakPolarHBondContact O-CB 3.3Å; V285-A289 PolarHBondContact O-N 2.97Å; A289-K291 VanDerWaalsContact C-N 3.35Å; A289-K291 PolarHBondContact O-N 3.22Å; A289-A292 WeakPolarHBondContact O-CB 3.42Å; A289-A292 PolarHBondContact O-N 3.39Å; A289-A292 VanDerWaalsContact O-N 3.13Å; A289-F311 HydrophobicContact CB-CD1 4.01Å; A289-F311 HydrophobicContact CB-CD2 4.06Å; A289-F311 HydrophobicContact CB-CE1 3.59Å; A289-F311 HydrophobicContact CB-CE2 3.66Å; A289-F311 HydrophobicContact CB-CG 4.21Å; A289-F311 HydrophobicContact CB-CZ 3.4Å; A289-L335 WeakPolarHBondContact CA-O 3.45Å; A289-L335 VanDerWaalsContact CB-O 3.22Å; A289-L335 WeakPolarHBondContact CB-O 3.42Å
290	R	97.1	Very high	94.2	Very high	52 Å²	52	72.3 Å²	72.3	20%	0.196	36%	0.356	C	S	.	.	H	α-helix	trans	-68.1	-30.8	177.2	-73.4	174.8	67.4	94.4	-7.5	113.1	L286 L287 E288 A292 V293 V307 D308 F311	L286-R290 WeakPolarHBondContact O-CG 3.46Å; L286-R290 PolarHBondContact O-N 3.45Å; L287-R290 PolarHBondContact O-N 2.63Å; E288-R290 VanDerWaalsContact C-N 3.33Å; E288-R290 PolarHBondContact O-N 2.89Å; R290-A292 VanDerWaalsContact C-N 3.33Å; R290-V293 WeakPolarHBondContact O-CG2 3.49Å; R290-V307 HydrophobicContact CB-CG1 3.67Å; R290-V307 HydrophobicContact CG-CG1 3.78Å; R290-D308 IonicContact CZ-OD1 3.82Å; R290-D308 IonicContact NH1-OD1 3.23Å; R290-D308 PolarHBondContact NH1-OD1 3.32Å; R290-D308 IonicContact NH2-OD1 3.49Å; R290-D308 PolarHBondContact NH2-OD1 3.42Å; R290-D308 IonicContact NH2-OD2 2.84Å; R290-F311 HydrophobicContact CG-CB 4.13Å; R290-F311 HydrophobicContact CG-CD1 3.58Å; R290-F311 HydrophobicContact CG-CE1 4.44Å; R290-F311 HydrophobicContact CG-CG 4.21Å; R290-F311 PolarHBondContact NH1-O 3.07Å
291	K	94.9	Very high	94.3	Very high	115 Å²	115	66 Å²	66	50%	0.5	33%	0.327	S	S	.	.	H	α-helix	trans	-72.5	-23.2	170.6	-69.6	165.6	174.7	176.6	0	113.5	L287 E288 A289 V293	L287-K291 WeakPolarHBondContact O-CG 3.43Å; L287-K291 PolarHBondContact O-N 2.68Å; L287-K291 VanDerWaalsContact O-N 3.1Å; E288-K291 VanDerWaalsContact CD-NZ 3.3Å; E288-K291 PolarHBondContact O-N 3.3Å; E288-K291 IonicContact OE1-NZ 3.13Å; E288-K291 PolarHBondContact OE1-NZ 3Å; E288-K291 WeakPolarHBondContact OE2-CD 3.46Å; E288-K291 IonicContact OE2-NZ 2.71Å; E288-K291 PolarHBondContact OE2-NZ 3.44Å; A289-K291 VanDerWaalsContact C-N 3.35Å; A289-K291 PolarHBondContact O-N 3.22Å; K291-V293 VanDerWaalsContact C-N 3.32Å
292	A	95.9	Very high	94.2	Very high	14 Å²	14	74.5 Å²	74.5	12%	0.116	37%	0.367	C	S	.	.	H	α-helix	trans	-75.2	-21.3	179	0	0	0	0	0	113.1	E288 A289 R290 R294 L335 A338	E288-A292 PolarHBondContact O-N 2.9Å; A289-A292 WeakPolarHBondContact O-CB 3.42Å; A289-A292 PolarHBondContact O-N 3.39Å; A289-A292 VanDerWaalsContact O-N 3.13Å; R290-A292 VanDerWaalsContact C-N 3.33Å; A292-R294 PolarHBondContact O-N 3.44Å; A292-R294 PolarHBondContact O-NH1 2.72Å; A292-L335 HydrophobicContact CB-CD2 3.93Å; A292-A338 HydrophobicContact CB-CB 3.95Å
293	V	97.1	Very high	94	Very high	4 Å²	4	76.9 Å²	76.9	2%	0.024	38%	0.381	C	S	.	.			trans	-52.1	135.2	-176.9	-175.4	0	0	0	0	111.8	R290 K291 P300 T301 V307 A310 F311 L335	R290-V293 WeakPolarHBondContact O-CG2 3.49Å; K291-V293 VanDerWaalsContact C-N 3.32Å; V293-P300 WeakPolarHBondContact O-CA 3.34Å; V293-T301 HydrophobicContact CB-CG2 4.22Å; V293-T301 HydrophobicContact CG1-CG2 3.71Å; V293-T301 PolarHBondContact O-N 2.72Å; V293-T301 VanDerWaalsContact O-N 3.16Å; V293-V307 HydrophobicContact CB-CG2 4.37Å; V293-V307 HydrophobicContact CG2-CG1 4.26Å; V293-A310 HydrophobicContact CG1-CB 3.73Å; V293-A310 HydrophobicContact CG2-CB 4.17Å; V293-F311 HydrophobicContact CG2-CB 4.36Å; V293-L335 HydrophobicContact CG2-CD1 3.96Å; V293-L335 HydrophobicContact CG2-CD2 4.07Å
294	R	94.4	Very high	94	Very high	143 Å²	143	73.9 Å²	73.9	54%	0.54	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-109.2	140.9	176.3	-59.5	-54.3	-164.1	-121.5	7.5	110.7	A292 G298 R299	A292-R294 PolarHBondContact O-N 3.44Å; A292-R294 PolarHBondContact O-NH1 2.72Å; R294-G298 WeakPolarHBondContact CD-O 3.47Å; R294-R299 CarbonylContact C-O 3.58Å; R294-R299 VanDerWaalsContact CA-O 3.24Å; R294-R299 WeakPolarHBondContact CA-O 3.32Å; R294-R299 VanDerWaalsContact CD-C 3.5Å
295	G	91.4	Very high	94	Very high	12 Å²	12	75.2 Å²	75.2	12%	0.124	39%	0.388	C	S	.	.			trans	-74.9	177.4	168.2	0	0	0	0	0	111.9	D297 G298 R299	G295-D297 PolarHBondContact O-N 2.9Å; G295-G298 PolarHBondContact O-N 2.95Å; G295-R299 PolarHBondContact N-O 3.29Å
296	N	88.6	Confident	93.9	Very high	165 Å²	165	77.5 Å²	77.5	88%	0.882	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-11.6	-179.4	-64.7	-67.1	0	0	0	114.4
297	D	90.3	Very high	93.9	Very high	107 Å²	107	76.8 Å²	76.8	57%	0.572	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	3.9	173.8	71.9	-19.4	0	0	0	113.4	G295 R299	G295-D297 PolarHBondContact O-N 2.9Å; D297-R299 VanDerWaalsContact C-N 3.27Å; D297-R299 PolarHBondContact O-N 3.01Å; D297-R299 WeakPolarHBondContact OD1-CB 3.39Å; D297-R299 PolarHBondContact OD1-N 2.87Å; D297-R299 WeakPolarHBondContact OD2-CD 3.47Å; D297-R299 VanDerWaalsContact OD2-CG 3.28Å; D297-R299 WeakPolarHBondContact OD2-CG 3.32Å; D297-R299 IonicContact OD2-NE 3.73Å
298	G	88.8	Confident	93.9	Very high	51 Å²	51	75.5 Å²	75.5	53%	0.526	39%	0.389	S	S	.	.	S	Bend	trans	78.2	0.8	-177.4	0	0	0	0	0	115	R294 G295	R294-G298 WeakPolarHBondContact CD-O 3.47Å; G295-G298 PolarHBondContact O-N 2.95Å
299	R	91.3	Very high	93.8	Very high	175 Å²	175	76.1 Å²	76.1	66%	0.66	40%	0.4	S	S	*	.	S	Bend	trans	-91.2	152.5	-177.6	-60	-171.6	-178.4	-177.5	-3.3	111.8	R294 G295 D297 T301	R294-R299 CarbonylContact C-O 3.58Å; R294-R299 VanDerWaalsContact CA-O 3.24Å; R294-R299 WeakPolarHBondContact CA-O 3.32Å; R294-R299 VanDerWaalsContact CD-C 3.5Å; G295-R299 PolarHBondContact N-O 3.29Å; D297-R299 VanDerWaalsContact C-N 3.27Å; D297-R299 PolarHBondContact O-N 3.01Å; D297-R299 WeakPolarHBondContact OD1-CB 3.39Å; D297-R299 PolarHBondContact OD1-N 2.87Å; D297-R299 WeakPolarHBondContact OD2-CD 3.47Å; D297-R299 VanDerWaalsContact OD2-CG 3.28Å; D297-R299 WeakPolarHBondContact OD2-CG 3.32Å; D297-R299 IonicContact OD2-NE 3.73Å; R299-T301 PolarHBondContact O-N 2.85Å
300	P	93.1	Very high	93.8	Very high	91 Å²	91	76.6 Å²	76.6	59%	0.591	40%	0.404	S	S	*	.	B	Isolated β-bridge	trans	-56.3	126.5	173	22	-32.7	0	0	0	110.9	V293	V293-P300 WeakPolarHBondContact O-CA 3.34Å
301	T	93.6	Very high	93.8	Very high	16 Å²	16	74.1 Å²	74.1	10%	0.098	40%	0.395	C	S	.	.			trans	-106.1	152.5	178.3	-174.8	0	0	0	0	111	V293 R299 L303 E306 V307	V293-T301 HydrophobicContact CB-CG2 4.22Å; V293-T301 HydrophobicContact CG1-CG2 3.71Å; V293-T301 PolarHBondContact O-N 2.72Å; V293-T301 VanDerWaalsContact O-N 3.16Å; R299-T301 PolarHBondContact O-N 2.85Å; T301-L303 PolarHBondContact OG1-N 3.46Å; T301-E306 VanDerWaalsContact CB-OE2 3.23Å; T301-E306 WeakPolarHBondContact CB-OE2 3.35Å; T301-E306 HydrophobicContact CG2-CB 4Å; T301-E306 WeakPolarHBondContact CG2-OE2 3.47Å; T301-E306 PolarHBondContact OG1-OE2 2.96Å; T301-V307 HydrophobicContact CG2-CG2 4.28Å
302	Q	92.1	Very high	93.9	Very high	183 Å²	183	69.4 Å²	69.4	86%	0.855	38%	0.376	S	S	*	.			trans	-123.8	9.6	170.6	-62.2	-174.8	5.1	0	0	111.6	P304	Q302-P304 WeakPolarHBondContact O-CD 3.26Å
303	L	94.2	Very high	93.9	Very high	93 Å²	93	73.2 Å²	73.2	49%	0.487	39%	0.394	S	S	.	.			trans	-70.6	117	178.5	-65.6	178.4	0	0	0	109.3	T301 N305 E306 V307	T301-L303 PolarHBondContact OG1-N 3.46Å; L303-N305 VanDerWaalsContact C-N 3.28Å; L303-N305 PolarHBondContact O-N 2.91Å; L303-E306 HydrophobicContact CB-CB 4.33Å; L303-E306 HydrophobicContact CB-CG 4.02Å; L303-E306 HydrophobicContact CD1-CG 4.41Å; L303-E306 PolarHBondContact O-N 3.35Å; L303-V307 WeakPolarHBondContact O-CG2 3.42Å; L303-V307 PolarHBondContact O-N 3.07Å; L303-V307 VanDerWaalsContact O-N 3.08Å
304	P	94.8	Very high	93.9	Very high	84 Å²	84	80.9 Å²	80.9	55%	0.545	43%	0.43	S	S	.	.	H	α-helix	trans	-54.9	-43	-171.8	-28.9	36.2	0	0	0	113	Q302 E306 V307 D308	Q302-P304 WeakPolarHBondContact O-CD 3.26Å; P304-E306 VanDerWaalsContact C-N 3.26Å; P304-E306 PolarHBondContact O-N 3.34Å; P304-V307 PolarHBondContact O-N 3.11Å; P304-D308 VanDerWaalsContact O-CB 3.3Å; P304-D308 WeakPolarHBondContact O-CB 3.4Å; P304-D308 VanDerWaalsContact O-CG 3.28Å; P304-D308 PolarHBondContact O-N 2.9Å
305	N	94	Very high	94	Very high	112 Å²	112	82.7 Å²	82.7	60%	0.599	44%	0.437	S	S	*	.	H	α-helix	trans	-61.6	-26.8	178.1	62.8	-80.6	0	0	0	114.6	L303 A309	L303-N305 VanDerWaalsContact C-N 3.28Å; L303-N305 PolarHBondContact O-N 2.91Å; N305-A309 VanDerWaalsContact O-CB 3.23Å; N305-A309 WeakPolarHBondContact O-CB 3.37Å; N305-A309 PolarHBondContact O-N 2.96Å
306	E	94.2	Very high	94.2	Very high	49 Å²	49	83.7 Å²	83.7	23%	0.229	44%	0.441	C	S	.	.	H	α-helix	trans	-83.5	-42.6	174.9	-60.5	-170.4	144.6	0	0	110.4	T301 L303 P304 A309 A310	T301-E306 VanDerWaalsContact CB-OE2 3.23Å; T301-E306 WeakPolarHBondContact CB-OE2 3.35Å; T301-E306 HydrophobicContact CG2-CB 4Å; T301-E306 WeakPolarHBondContact CG2-OE2 3.47Å; T301-E306 PolarHBondContact OG1-OE2 2.96Å; L303-E306 HydrophobicContact CB-CB 4.33Å; L303-E306 HydrophobicContact CB-CG 4.02Å; L303-E306 HydrophobicContact CD1-CG 4.41Å; L303-E306 PolarHBondContact O-N 3.35Å; P304-E306 VanDerWaalsContact C-N 3.26Å; P304-E306 PolarHBondContact O-N 3.34Å; E306-A309 PolarHBondContact O-N 3.17Å; E306-A310 WeakPolarHBondContact O-CB 3.4Å; E306-A310 PolarHBondContact O-N 3.23Å
307	V	96.7	Very high	94.6	Very high	10 Å²	10	83 Å²	83	6%	0.061	44%	0.437	C	S	.	.	H	α-helix	trans	-65.2	-40.8	178.7	-179.4	0	0	0	0	111.6	R290 V293 T301 L303 P304 F311	R290-V307 HydrophobicContact CB-CG1 3.67Å; R290-V307 HydrophobicContact CG-CG1 3.78Å; V293-V307 HydrophobicContact CB-CG2 4.37Å; V293-V307 HydrophobicContact CG2-CG1 4.26Å; T301-V307 HydrophobicContact CG2-CG2 4.28Å; L303-V307 WeakPolarHBondContact O-CG2 3.42Å; L303-V307 PolarHBondContact O-N 3.07Å; L303-V307 VanDerWaalsContact O-N 3.08Å; P304-V307 PolarHBondContact O-N 3.11Å; V307-F311 CarbonylContact O-C 3.52Å; V307-F311 WeakPolarHBondContact O-CA 3.4Å; V307-F311 PolarHBondContact O-N 3.46Å
308	D	96.3	Very high	94.8	Very high	70 Å²	70	79.7 Å²	79.7	37%	0.374	42%	0.417	S	S	.	.	H	α-helix	trans	-73.1	-33.4	177.6	-68.1	-41.1	0	0	0	112.5	R290 P304 A310 P312	R290-D308 IonicContact CZ-OD1 3.82Å; R290-D308 IonicContact NH1-OD1 3.23Å; R290-D308 PolarHBondContact NH1-OD1 3.32Å; R290-D308 IonicContact NH2-OD1 3.49Å; R290-D308 PolarHBondContact NH2-OD1 3.42Å; R290-D308 IonicContact NH2-OD2 2.84Å; P304-D308 VanDerWaalsContact O-CB 3.3Å; P304-D308 WeakPolarHBondContact O-CB 3.4Å; P304-D308 VanDerWaalsContact O-CG 3.28Å; P304-D308 PolarHBondContact O-N 2.9Å; D308-A310 VanDerWaalsContact C-N 3.35Å; D308-P312 WeakPolarHBondContact O-CB 3.5Å; D308-P312 WeakPolarHBondContact O-CD 2.93Å
309	A	94.6	Very high	94.9	Very high	52 Å²	52	80.7 Å²	80.7	43%	0.43	41%	0.41	S	S	.	.	H	α-helix	trans	-74	-24.2	175.5	0	0	0	0	0	113.6	N305 E306 H328	N305-A309 VanDerWaalsContact O-CB 3.23Å; N305-A309 WeakPolarHBondContact O-CB 3.37Å; N305-A309 PolarHBondContact O-N 2.96Å; E306-A309 PolarHBondContact O-N 3.17Å; A309-H328 PolarHBondContact O-ND1 3.17Å
310	A	96	Very high	94.8	Very high	10 Å²	10	75.5 Å²	75.5	8%	0.083	39%	0.391	C	S	.	.	H	α-helix	trans	-94.3	-38.3	177.1	0	0	0	0	0	113.1	V293 E306 D308 L331 L335	V293-A310 HydrophobicContact CG1-CB 3.73Å; V293-A310 HydrophobicContact CG2-CB 4.17Å; E306-A310 WeakPolarHBondContact O-CB 3.4Å; E306-A310 PolarHBondContact O-N 3.23Å; D308-A310 VanDerWaalsContact C-N 3.35Å; A310-L331 HydrophobicContact CB-CD2 3.97Å; A310-L335 HydrophobicContact CB-CD1 3.87Å
311	F	97.7	Very high	94.7	Very high	0 Å²	0	75.3 Å²	75.3	0%	0	39%	0.389	C	S	.	.	S	Bend	trans	-140.8	73	-175.4	-156.3	-91.5	0	0	0	112.5	L286 A289 R290 V293 V307 Y332 L335 L336	L286-F311 HydrophobicContact CB-CE1 4.39Å; L286-F311 HydrophobicContact CD2-CE1 3.56Å; L286-F311 HydrophobicContact CD2-CZ 3.84Å; A289-F311 HydrophobicContact CB-CD1 4.01Å; A289-F311 HydrophobicContact CB-CD2 4.06Å; A289-F311 HydrophobicContact CB-CE1 3.59Å; A289-F311 HydrophobicContact CB-CE2 3.66Å; A289-F311 HydrophobicContact CB-CG 4.21Å; A289-F311 HydrophobicContact CB-CZ 3.4Å; R290-F311 HydrophobicContact CG-CB 4.13Å; R290-F311 HydrophobicContact CG-CD1 3.58Å; R290-F311 HydrophobicContact CG-CE1 4.44Å; R290-F311 HydrophobicContact CG-CG 4.21Å; R290-F311 PolarHBondContact NH1-O 3.07Å; V293-F311 HydrophobicContact CG2-CB 4.36Å; V307-F311 CarbonylContact O-C 3.52Å; V307-F311 WeakPolarHBondContact O-CA 3.4Å; V307-F311 PolarHBondContact O-N 3.46Å; F311-Y332 HydrophobicContact CD1-CE2 4.27Å; F311-Y332 AromaticContact CD2-CD2 3.46Å; F311-Y332 HydrophobicContact CD2-CD2 3.46Å; F311-Y332 VanDerWaalsContact CD2-CD2 3.46Å; F311-Y332 AromaticContact CD2-CE2 3.53Å; F311-Y332 HydrophobicContact CD2-CE2 3.53Å; F311-Y332 HydrophobicContact CD2-CG 4.26Å; F311-Y332 HydrophobicContact CE1-CE2 4.19Å; F311-Y332 AromaticContact CE2-CD2 3.66Å; F311-Y332 HydrophobicContact CE2-CD2 3.66Å; F311-Y332 HydrophobicContact CE2-CE1 4.37Å; F311-Y332 AromaticContact CE2-CE2 3.41Å; F311-Y332 HydrophobicContact CE2-CE2 3.41Å; F311-Y332 VanDerWaalsContact CE2-CE2 3.41Å; F311-Y332 HydrophobicContact CE2-CG 4.24Å; F311-Y332 AromaticContact CE2-CZ 3.79Å; F311-Y332 HydrophobicContact CG-CD2 4.13Å; F311-Y332 AromaticContact CG-CE2 3.99Å; F311-Y332 HydrophobicContact CG-CE2 3.99Å; F311-Y332 HydrophobicContact CZ-CD2 4.46Å; F311-Y332 AromaticContact CZ-CE2 3.77Å; F311-Y332 HydrophobicContact CZ-CE2 3.77Å; F311-Y332 AromaticContact CZ-CZ 3.92Å; F311-L335 HydrophobicContact CB-CD1 4.25Å; F311-L335 HydrophobicContact CD2-CB 3.64Å; F311-L335 HydrophobicContact CD2-CD1 4.3Å; F311-L335 HydrophobicContact CE2-CB 4.11Å; F311-L336 HydrophobicContact CE2-CB 4Å; F311-L336 HydrophobicContact CZ-CB 4.38Å; F311-L336 HydrophobicContact CZ-CD1 4.25Å
312	P	97.6	Very high	94.6	Very high	17 Å²	17	77.3 Å²	77.3	11%	0.11	40%	0.4	C	S	.	.			trans	-71.1	136.9	-178.4	29.2	-34.7	0	0	0	112	W266 D308 P316 W318	W266-P312 PolarHBondContact NE1-O 3.28Å; D308-P312 WeakPolarHBondContact O-CB 3.5Å; D308-P312 WeakPolarHBondContact O-CD 2.93Å; P312-P316 HydrophobicContact CG-CB 3.95Å; P312-P316 HydrophobicContact CG-CG 3.93Å; P312-W318 VanDerWaalsContact CD-CH2 3.49Å; P312-W318 HydrophobicContact CG-CH2 3.76Å; P312-W318 HydrophobicContact CG-CZ2 3.74Å
313	L	96.4	Very high	94.6	Very high	93 Å²	93	73.5 Å²	73.5	49%	0.487	38%	0.383	S	S	.	.	S	Bend	trans	-84.1	-20.5	174.6	-64.2	176.3	0	0	0	112.9	L286	L286-L313 HydrophobicContact CB-CD2 4.16Å; L286-L313 HydrophobicContact CD1-CD2 4.31Å
314	E	95.6	Very high	94.6	Very high	166 Å²	166	77.9 Å²	77.9	78%	0.776	39%	0.393	S	S	*	.	S	Bend	trans	-103.6	167.5	171.9	-63.6	-173.9	-179.1	0	0	110.5	W266 P316	W266-E314 VanDerWaalsContact CZ2-O 3.3Å; W266-E314 WeakPolarHBondContact CZ2-O 3.3Å; E314-P316 VanDerWaalsContact O-CD 3.31Å; E314-P316 WeakPolarHBondContact O-CD 3.22Å
315	R	96.9	Very high	94.5	Very high	180 Å²	180	74 Å²	74	68%	0.679	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-70.1	116.6	-173.5	-169.7	178.7	-165.1	-131.9	-1.5	111.2	W266 D267	W266-R315 HydrophobicContact CE3-CB 4.02Å; W266-R315 HydrophobicContact CE3-CG 3.8Å; W266-R315 HydrophobicContact CH2-CB 3.89Å; W266-R315 HydrophobicContact CZ3-CB 3.56Å; W266-R315 HydrophobicContact CZ3-CG 3.73Å; D267-R315 VanDerWaalsContact CG-NE 3.27Å; D267-R315 WeakPolarHBondContact OD1-CD 3.31Å; D267-R315 IonicContact OD1-CZ 2.7Å; D267-R315 IonicContact OD1-NE 2.67Å; D267-R315 PolarHBondContact OD1-NE 3.37Å; D267-R315 IonicContact OD1-NH2 3.97Å; D267-R315 IonicContact OD2-CZ 2.64Å; D267-R315 VanDerWaalsContact OD2-CZ 3.23Å; D267-R315 IonicContact OD2-NE 3.31Å; D267-R315 PolarHBondContact OD2-NE 3.4Å; D267-R315 IonicContact OD2-NH2 2.73Å; D267-R315 PolarHBondContact OD2-NH2 3.38Å
316	P	96.6	Very high	94.5	Very high	33 Å²	33	72.5 Å²	72.5	21%	0.214	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-81.5	166.3	-178.8	33.8	-35.1	0	0	0	113	W266 P312 E314 W318	W266-P316 HydrophobicContact CB-CG 4.13Å; W266-P316 VanDerWaalsContact CG-CD 3.49Å; W266-P316 HydrophobicContact CG-CG 3.97Å; P312-P316 HydrophobicContact CG-CB 3.95Å; P312-P316 HydrophobicContact CG-CG 3.93Å; E314-P316 VanDerWaalsContact O-CD 3.31Å; E314-P316 WeakPolarHBondContact O-CD 3.22Å; P316-W318 HydrophobicContact CB-CD2 3.69Å; P316-W318 HydrophobicContact CB-CE3 4.34Å; P316-W318 HydrophobicContact CB-CG 3.78Å; P316-W318 HydrophobicContact CB-CZ2 4.24Å; P316-W318 HydrophobicContact CG-CB 4.43Å; P316-W318 HydrophobicContact CG-CD2 3.53Å; P316-W318 HydrophobicContact CG-CE3 3.68Å; P316-W318 HydrophobicContact CG-CG 3.89Å; P316-W318 HydrophobicContact CG-CH2 4.48Å; P316-W318 HydrophobicContact CG-CZ2 4.35Å; P316-W318 HydrophobicContact CG-CZ3 4.15Å; P316-W318 PolarHBondContact O-N 3Å
317	D	95.6	Very high	94.5	Very high	150 Å²	150	74.5 Å²	74.5	80%	0.802	37%	0.366	S	S	*	.			trans	-83.8	23.8	177.7	66.9	-23.8	0	0	0	113.9	D319	D317-D319 PolarHBondContact O-N 3.13Å
318	W	94.7	Very high	94.5	Very high	38 Å²	38	75.9 Å²	75.9	14%	0.144	37%	0.372	C	S	.	.			trans	-77.4	95.8	-168.7	-62	-11.8	0	0	0	113.6	P312 P316 Y320 H328 L329 Y332	P312-W318 VanDerWaalsContact CD-CH2 3.49Å; P312-W318 HydrophobicContact CG-CH2 3.76Å; P312-W318 HydrophobicContact CG-CZ2 3.74Å; P316-W318 HydrophobicContact CB-CD2 3.69Å; P316-W318 HydrophobicContact CB-CE3 4.34Å; P316-W318 HydrophobicContact CB-CG 3.78Å; P316-W318 HydrophobicContact CB-CZ2 4.24Å; P316-W318 HydrophobicContact CG-CB 4.43Å; P316-W318 HydrophobicContact CG-CD2 3.53Å; P316-W318 HydrophobicContact CG-CE3 3.68Å; P316-W318 HydrophobicContact CG-CG 3.89Å; P316-W318 HydrophobicContact CG-CH2 4.48Å; P316-W318 HydrophobicContact CG-CZ2 4.35Å; P316-W318 HydrophobicContact CG-CZ3 4.15Å; P316-W318 PolarHBondContact O-N 3Å; W318-Y320 PolarHBondContact O-N 3.21Å; W318-H328 HydrophobicContact CD2-CB 3.48Å; W318-H328 VanDerWaalsContact CD2-CB 3.48Å; W318-H328 VanDerWaalsContact CE2-CB 3.47Å; W318-H328 AromaticContact CE2-CG 3.69Å; W318-H328 AromaticContact CE2-ND1 3.82Å; W318-H328 HydrophobicContact CE3-CB 3.79Å; W318-H328 HydrophobicContact CG-CB 3.95Å; W318-H328 HydrophobicContact CH2-CB 4.05Å; W318-H328 HydrophobicContact CZ2-CB 3.78Å; W318-H328 AromaticContact CZ2-ND1 3.78Å; W318-H328 HydrophobicContact CZ3-CB 4.07Å; W318-H328 AromaticContact NE1-CD2 3.97Å; W318-H328 AromaticContact NE1-CG 3.7Å; W318-H328 AromaticContact NE1-ND1 3.84Å; W318-L329 HydrophobicContact CE3-CD2 4Å; W318-L329 HydrophobicContact CE3-CG 4.27Å; W318-L329 HydrophobicContact CZ3-CD2 4.49Å; W318-Y332 AromaticContact CH2-CD2 3.95Å; W318-Y332 HydrophobicContact CH2-CD2 3.95Å; W318-Y332 HydrophobicContact CH2-CG 4.22Å; W318-Y332 AromaticContact CZ3-CD2 3.99Å; W318-Y332 HydrophobicContact CZ3-CD2 3.99Å; W318-Y332 AromaticContact CZ3-CG 3.88Å; W318-Y332 HydrophobicContact CZ3-CG 3.88Å
319	D	92.1	Very high	94.4	Very high	73 Å²	73	72.8 Å²	72.8	39%	0.39	36%	0.356	S	S	.	.			trans	-70.4	108.9	172.8	-177.8	-8.1	0	0	0	112.2	D317 T321 T322 G325	D317-D319 PolarHBondContact O-N 3.13Å; D319-T321 PolarHBondContact O-N 3.35Å; D319-T321 VanDerWaalsContact OD1-CB 3.31Å; D319-T321 WeakPolarHBondContact OD1-CB 3.45Å; D319-T321 WeakPolarHBondContact OD1-CG2 3.4Å; D319-T321 PolarHBondContact OD1-N 2.92Å; D319-T321 PolarHBondContact OD1-OG1 3.27Å; D319-T321 PolarHBondContact OD2-OG1 3.06Å; D319-T321 VanDerWaalsContact OD2-OG1 3.11Å; D319-T322 HydrophobicContact CB-CG2 3.96Å; D319-T322 PolarHBondContact O-N 3.14Å; D319-T322 PolarHBondContact O-OG1 3.19Å; D319-G325 WeakPolarHBondContact O-CA 3.41Å
320	Y	89.2	Confident	94.5	Very high	65 Å²	65	73.1 Å²	73.1	26%	0.255	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-13.5	179	65.5	-101.5	0	0	0	114.5	L216 L224 W318 T322 R326	L216-Y320 HydrophobicContact CD1-CG 4.33Å; L216-Y320 HydrophobicContact CD2-CD1 4.23Å; L216-Y320 HydrophobicContact CD2-CD2 3.73Å; L216-Y320 HydrophobicContact CD2-CE1 4.44Å; L216-Y320 HydrophobicContact CD2-CE2 3.99Å; L216-Y320 HydrophobicContact CD2-CG 3.88Å; L224-Y320 HydrophobicContact CB-CD2 4.04Å; L224-Y320 HydrophobicContact CB-CE2 4.13Å; L224-Y320 WeakPolarHBondContact CD1-O 3.32Å; W318-Y320 PolarHBondContact O-N 3.21Å; Y320-T322 VanDerWaalsContact C-N 3.32Å; Y320-R326 WeakPolarHBondContact O-CG 3.35Å
321	T	89.6	Confident	94.5	Very high	88 Å²	88	75.9 Å²	75.9	54%	0.54	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-21	172.5	73.9	0	0	0	0	111.9	D319	D319-T321 PolarHBondContact O-N 3.35Å; D319-T321 VanDerWaalsContact OD1-CB 3.31Å; D319-T321 WeakPolarHBondContact OD1-CB 3.45Å; D319-T321 WeakPolarHBondContact OD1-CG2 3.4Å; D319-T321 PolarHBondContact OD1-N 2.92Å; D319-T321 PolarHBondContact OD1-OG1 3.27Å; D319-T321 PolarHBondContact OD2-OG1 3.06Å; D319-T321 VanDerWaalsContact OD2-OG1 3.11Å
322	T	91.8	Very high	94.5	Very high	57 Å²	57	75.9 Å²	75.9	35%	0.35	37%	0.365	S	S	.	.	S	Bend	trans	-90.1	148	178.5	72.9	0	0	0	0	112	D319 Y320 R324 G325 R326	D319-T322 HydrophobicContact CB-CG2 3.96Å; D319-T322 PolarHBondContact O-N 3.14Å; D319-T322 PolarHBondContact O-OG1 3.19Å; Y320-T322 VanDerWaalsContact C-N 3.32Å; T322-R324 PolarHBondContact O-N 2.97Å; T322-G325 PolarHBondContact O-N 2.85Å; T322-G325 PolarHBondContact OG1-N 3.3Å; T322-R326 WeakPolarHBondContact O-CG 3.14Å; T322-R326 PolarHBondContact O-N 2.76Å
323	Q	91.9	Very high	94.5	Very high	104 Å²	104	76.1 Å²	76.1	49%	0.486	36%	0.364	S	S	.	.	H	α-helix	trans	-58.5	-35	172.4	-168	61.5	37.8	0	0	112.3	R326 N327	Q323-R326 PolarHBondContact O-N 2.59Å; Q323-N327 PolarHBondContact NE2-OD1 3.34Å; Q323-N327 WeakPolarHBondContact O-CB 3.08Å; Q323-N327 PolarHBondContact O-N 3.16Å; Q323-N327 PolarHBondContact O-OD1 3.39Å; Q323-N327 VanDerWaalsContact O-OD1 3.1Å
324	R	94.1	Very high	94.5	Very high	185 Å²	185	76.3 Å²	76.3	70%	0.698	36%	0.362	S	S	*	.	H	α-helix	trans	-65	-50.2	179.5	-178.5	173	175.7	-172	-4.8	111.5	T322 N327 H328	T322-R324 PolarHBondContact O-N 2.97Å; R324-N327 PolarHBondContact O-N 2.92Å; R324-H328 PolarHBondContact NE-NE2 3.36Å; R324-H328 PolarHBondContact O-CD2 3.06Å; R324-H328 PolarHBondContact O-N 3.32Å
325	G	93.4	Very high	94.6	Very high	2 Å²	2	69 Å²	69	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-63.5	-39.5	177	0	0	0	0	0	112.4	D319 T322 N327 H328 L329	D319-G325 WeakPolarHBondContact O-CA 3.41Å; T322-G325 PolarHBondContact O-N 2.85Å; T322-G325 PolarHBondContact OG1-N 3.3Å; G325-N327 PolarHBondContact O-N 3.28Å; G325-H328 PolarHBondContact O-N 2.79Å; G325-L329 WeakPolarHBondContact O-CB 3.39Å; G325-L329 WeakPolarHBondContact O-CG 3.35Å; G325-L329 PolarHBondContact O-N 3.07Å
326	R	92.7	Very high	94.7	Very high	80 Å²	80	60.5 Å²	60.5	30%	0.302	30%	0.296	S	S	.	.	H	α-helix	trans	-58.2	-47	171.8	-68.1	-163.2	-65.9	169.3	-2.9	112.4	E159 Y320 T322 Q323 H328 L329 V330	E159-R326 IonicContact OE1-NH1 2.64Å; Y320-R326 WeakPolarHBondContact O-CG 3.35Å; T322-R326 WeakPolarHBondContact O-CG 3.14Å; T322-R326 PolarHBondContact O-N 2.76Å; Q323-R326 PolarHBondContact O-N 2.59Å; R326-H328 PolarHBondContact O-N 2.89Å; R326-L329 PolarHBondContact O-N 2.96Å; R326-V330 WeakPolarHBondContact O-CG2 3.19Å; R326-V330 PolarHBondContact O-N 3.36Å
327	N	94.8	Very high	94.7	Very high	92 Å²	92	60.3 Å²	60.3	49%	0.492	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-43.5	177.7	-70.6	8.3	0	0	0	112.2	Q323 R324 G325 V330 L331	Q323-N327 PolarHBondContact NE2-OD1 3.34Å; Q323-N327 WeakPolarHBondContact O-CB 3.08Å; Q323-N327 PolarHBondContact O-N 3.16Å; Q323-N327 PolarHBondContact O-OD1 3.39Å; Q323-N327 VanDerWaalsContact O-OD1 3.1Å; R324-N327 PolarHBondContact O-N 2.92Å; G325-N327 PolarHBondContact O-N 3.28Å; N327-V330 PolarHBondContact O-N 3.3Å; N327-L331 PolarHBondContact O-N 3.21Å; N327-L331 VanDerWaalsContact O-N 3.09Å
328	H	96.2	Very high	94.7	Very high	38 Å²	38	54.3 Å²	54.3	18%	0.176	27%	0.265	C	S	.	.	H	α-helix	trans	-63.5	-41.1	175.2	-77.8	-78.1	0	0	0	112.1	A309 W318 R324 G325 R326 L331 Y332	A309-H328 PolarHBondContact O-ND1 3.17Å; W318-H328 HydrophobicContact CD2-CB 3.48Å; W318-H328 VanDerWaalsContact CD2-CB 3.48Å; W318-H328 VanDerWaalsContact CE2-CB 3.47Å; W318-H328 AromaticContact CE2-CG 3.69Å; W318-H328 AromaticContact CE2-ND1 3.82Å; W318-H328 HydrophobicContact CE3-CB 3.79Å; W318-H328 HydrophobicContact CG-CB 3.95Å; W318-H328 HydrophobicContact CH2-CB 4.05Å; W318-H328 HydrophobicContact CZ2-CB 3.78Å; W318-H328 AromaticContact CZ2-ND1 3.78Å; W318-H328 HydrophobicContact CZ3-CB 4.07Å; W318-H328 AromaticContact NE1-CD2 3.97Å; W318-H328 AromaticContact NE1-CG 3.7Å; W318-H328 AromaticContact NE1-ND1 3.84Å; R324-H328 PolarHBondContact NE-NE2 3.36Å; R324-H328 PolarHBondContact O-CD2 3.06Å; R324-H328 PolarHBondContact O-N 3.32Å; G325-H328 PolarHBondContact O-N 2.79Å; R326-H328 PolarHBondContact O-N 2.89Å; H328-L331 PolarHBondContact O-N 3.35Å; H328-Y332 VanDerWaalsContact O-CB 3.31Å; H328-Y332 WeakPolarHBondContact O-CB 3.46Å; H328-Y332 PolarHBondContact O-N 2.83Å
329	L	95.7	Very high	94.8	Very high	6 Å²	6	52.5 Å²	52.5	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-63.5	-41.1	176.5	-75.1	170.8	0	0	0	112.6	L216 W318 G325 R326 Y332 R333	L216-L329 HydrophobicContact CD1-CD1 4.5Å; W318-L329 HydrophobicContact CE3-CD2 4Å; W318-L329 HydrophobicContact CE3-CG 4.27Å; W318-L329 HydrophobicContact CZ3-CD2 4.49Å; G325-L329 WeakPolarHBondContact O-CB 3.39Å; G325-L329 WeakPolarHBondContact O-CG 3.35Å; G325-L329 PolarHBondContact O-N 3.07Å; R326-L329 PolarHBondContact O-N 2.96Å; L329-Y332 PolarHBondContact O-N 3.08Å; L329-R333 VanDerWaalsContact O-CG 3.24Å; L329-R333 WeakPolarHBondContact O-CG 3.18Å; L329-R333 PolarHBondContact O-N 3.33Å
330	V	95.7	Very high	95	Very high	58 Å²	58	49 Å²	49	35%	0.352	24%	0.239	S	C	.	.	H	α-helix	trans	-61.2	-49.7	174.6	171	0	0	0	0	110.7	R326 N327 Y332 R333 Q334	R326-V330 WeakPolarHBondContact O-CG2 3.19Å; R326-V330 PolarHBondContact O-N 3.36Å; N327-V330 PolarHBondContact O-N 3.3Å; V330-Y332 VanDerWaalsContact C-N 3.33Å; V330-Y332 PolarHBondContact O-N 2.81Å; V330-R333 PolarHBondContact O-N 3.44Å; V330-Q334 WeakPolarHBondContact O-CG 3.37Å; V330-Q334 PolarHBondContact O-N 3.28Å
331	L	96.5	Very high	95.1	Very high	69 Å²	69	50.1 Å²	50.1	36%	0.361	25%	0.247	S	C	.	.	H	α-helix	trans	-59.2	-43	177.5	177.7	60	0	0	0	111.9	A310 N327 H328 Q334 L335	A310-L331 HydrophobicContact CB-CD2 3.97Å; N327-L331 PolarHBondContact O-N 3.21Å; N327-L331 VanDerWaalsContact O-N 3.09Å; H328-L331 PolarHBondContact O-N 3.35Å; L331-Q334 PolarHBondContact O-N 3.44Å; L331-L335 HydrophobicContact CD1-CD1 3.85Å; L331-L335 HydrophobicContact CD1-CG 4.1Å; L331-L335 HydrophobicContact CG-CD1 3.83Å; L331-L335 HydrophobicContact CG-CG 4.48Å; L331-L335 WeakPolarHBondContact O-CB 3.48Å; L331-L335 VanDerWaalsContact O-CG 3.29Å; L331-L335 WeakPolarHBondContact O-CG 3.2Å; L331-L335 PolarHBondContact O-N 3.48Å
332	Y	97.8	Very high	95.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-42.7	178.1	-177.1	-92.6	0	0	0	112.6	W266 C269 Q270 F311 W318 H328 L329 V330 L335 L336	W266-Y332 AromaticContact CD1-CE2 3.59Å; W266-Y332 AromaticContact CD1-CZ 3.49Å; W266-Y332 VanDerWaalsContact CD1-CZ 3.49Å; W266-Y332 AromaticContact NE1-CE2 3.88Å; W266-Y332 AromaticContact NE1-CZ 3.85Å; C269-Y332 HydrophobicContact CB-CE1 3.79Å; Q270-Y332 PolarHBondContact NE2-OH 3.14Å; Q270-Y332 VanDerWaalsContact NE2-OH 3.1Å; F311-Y332 HydrophobicContact CD1-CE2 4.27Å; F311-Y332 AromaticContact CD2-CD2 3.46Å; F311-Y332 HydrophobicContact CD2-CD2 3.46Å; F311-Y332 VanDerWaalsContact CD2-CD2 3.46Å; F311-Y332 AromaticContact CD2-CE2 3.53Å; F311-Y332 HydrophobicContact CD2-CE2 3.53Å; F311-Y332 HydrophobicContact CD2-CG 4.26Å; F311-Y332 HydrophobicContact CE1-CE2 4.19Å; F311-Y332 AromaticContact CE2-CD2 3.66Å; F311-Y332 HydrophobicContact CE2-CD2 3.66Å; F311-Y332 HydrophobicContact CE2-CE1 4.37Å; F311-Y332 AromaticContact CE2-CE2 3.41Å; F311-Y332 HydrophobicContact CE2-CE2 3.41Å; F311-Y332 VanDerWaalsContact CE2-CE2 3.41Å; F311-Y332 HydrophobicContact CE2-CG 4.24Å; F311-Y332 AromaticContact CE2-CZ 3.79Å; F311-Y332 HydrophobicContact CG-CD2 4.13Å; F311-Y332 AromaticContact CG-CE2 3.99Å; F311-Y332 HydrophobicContact CG-CE2 3.99Å; F311-Y332 HydrophobicContact CZ-CD2 4.46Å; F311-Y332 AromaticContact CZ-CE2 3.77Å; F311-Y332 HydrophobicContact CZ-CE2 3.77Å; F311-Y332 AromaticContact CZ-CZ 3.92Å; W318-Y332 AromaticContact CH2-CD2 3.95Å; W318-Y332 HydrophobicContact CH2-CD2 3.95Å; W318-Y332 HydrophobicContact CH2-CG 4.22Å; W318-Y332 AromaticContact CZ3-CD2 3.99Å; W318-Y332 HydrophobicContact CZ3-CD2 3.99Å; W318-Y332 AromaticContact CZ3-CG 3.88Å; W318-Y332 HydrophobicContact CZ3-CG 3.88Å; H328-Y332 VanDerWaalsContact O-CB 3.31Å; H328-Y332 WeakPolarHBondContact O-CB 3.46Å; H328-Y332 PolarHBondContact O-N 2.83Å; L329-Y332 PolarHBondContact O-N 3.08Å; V330-Y332 VanDerWaalsContact C-N 3.33Å; V330-Y332 PolarHBondContact O-N 2.81Å; Y332-L335 PolarHBondContact O-N 2.97Å; Y332-L336 VanDerWaalsContact O-CB 3.3Å; Y332-L336 WeakPolarHBondContact O-CB 3.4Å; Y332-L336 PolarHBondContact O-N 2.84Å
333	R	97.1	Very high	95.2	Very high	22 Å²	22	46.2 Å²	46.2	8%	0.083	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-42.5	175.5	-67.1	169.8	-162.2	156	6.6	111.5	L259 Q263 P264 L329 V330 L336 L337	L259-R333 HydrophobicContact CD2-CG 4.28Å; Q263-R333 VanDerWaalsContact C-CZ 3.46Å; Q263-R333 PolarHBondContact O-NH2 3.42Å; P264-R333 VanDerWaalsContact O-CZ 3.28Å; P264-R333 PolarHBondContact O-NE 2.85Å; P264-R333 PolarHBondContact O-NH2 3.02Å; L329-R333 VanDerWaalsContact O-CG 3.24Å; L329-R333 WeakPolarHBondContact O-CG 3.18Å; L329-R333 PolarHBondContact O-N 3.33Å; V330-R333 PolarHBondContact O-N 3.44Å; R333-L336 PolarHBondContact O-N 3.11Å; R333-L337 WeakPolarHBondContact O-CB 3.48Å; R333-L337 PolarHBondContact O-N 3Å
334	Q	97.2	Very high	94.9	Very high	97 Å²	97	42.1 Å²	42.1	45%	0.453	21%	0.207	S	C	.	.	H	α-helix	trans	-62.4	-45.3	176.1	-71.7	171.5	-12.4	0	0	112	V330 L331 L337 A338	V330-Q334 WeakPolarHBondContact O-CG 3.37Å; V330-Q334 PolarHBondContact O-N 3.28Å; L331-Q334 PolarHBondContact O-N 3.44Å; Q334-L337 PolarHBondContact O-N 3.38Å; Q334-A338 PolarHBondContact O-N 3.06Å
335	L	98	Very high	94.2	Very high	13 Å²	13	39.7 Å²	39.7	7%	0.068	20%	0.198	C	C	.	.	H	α-helix	trans	-66.9	-35.6	176.4	-71.2	168.1	0	0	0	112.4	A289 A292 V293 A310 F311 L331 Y332 A338 G339	A289-L335 WeakPolarHBondContact CA-O 3.45Å; A289-L335 VanDerWaalsContact CB-O 3.22Å; A289-L335 WeakPolarHBondContact CB-O 3.42Å; A292-L335 HydrophobicContact CB-CD2 3.93Å; V293-L335 HydrophobicContact CG2-CD1 3.96Å; V293-L335 HydrophobicContact CG2-CD2 4.07Å; A310-L335 HydrophobicContact CB-CD1 3.87Å; F311-L335 HydrophobicContact CB-CD1 4.25Å; F311-L335 HydrophobicContact CD2-CB 3.64Å; F311-L335 HydrophobicContact CD2-CD1 4.3Å; F311-L335 HydrophobicContact CE2-CB 4.11Å; L331-L335 HydrophobicContact CD1-CD1 3.85Å; L331-L335 HydrophobicContact CD1-CG 4.1Å; L331-L335 HydrophobicContact CG-CD1 3.83Å; L331-L335 HydrophobicContact CG-CG 4.48Å; L331-L335 WeakPolarHBondContact O-CB 3.48Å; L331-L335 VanDerWaalsContact O-CG 3.29Å; L331-L335 WeakPolarHBondContact O-CG 3.2Å; L331-L335 PolarHBondContact O-N 3.48Å; Y332-L335 PolarHBondContact O-N 2.97Å; L335-A338 PolarHBondContact O-N 3.39Å; L335-G339 PolarHBondContact O-N 3.03Å
336	L	98.1	Very high	93.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-43.6	174.1	179.2	56	0	0	0	111.6	L259 C269 L273 V285 F311 Y332 R333 G339 L340	L259-L336 HydrophobicContact CD1-CD2 4.39Å; L259-L336 HydrophobicContact CD1-CG 4.45Å; L259-L336 HydrophobicContact CD2-CD2 4.16Å; C269-L336 HydrophobicContact CB-CD2 4.14Å; L273-L336 HydrophobicContact CD1-CD1 3.64Å; L273-L336 HydrophobicContact CD1-CD2 3.94Å; L273-L336 HydrophobicContact CD1-CG 4.46Å; L273-L336 HydrophobicContact CD2-CD1 3.95Å; L273-L336 HydrophobicContact CD2-CD2 4.4Å; L273-L336 HydrophobicContact CG-CD1 4.36Å; L273-L336 HydrophobicContact CG-CD2 4.37Å; V285-L336 HydrophobicContact CG1-CD1 3.61Å; F311-L336 HydrophobicContact CE2-CB 4Å; F311-L336 HydrophobicContact CZ-CB 4.38Å; F311-L336 HydrophobicContact CZ-CD1 4.25Å; Y332-L336 VanDerWaalsContact O-CB 3.3Å; Y332-L336 WeakPolarHBondContact O-CB 3.4Å; Y332-L336 PolarHBondContact O-N 2.84Å; R333-L336 PolarHBondContact O-N 3.11Å; L336-G339 CarbonylContact O-C 3.59Å; L336-G339 WeakPolarHBondContact O-CA 3.45Å; L336-G339 PolarHBondContact O-N 2.81Å; L336-G339 VanDerWaalsContact O-N 3.16Å; L336-L340 HydrophobicContact CG-CD1 4.32Å; L336-L340 WeakPolarHBondContact O-CG 3.31Å; L336-L340 PolarHBondContact O-N 3.36Å
337	L	97.3	Very high	92.1	Very high	30 Å²	30	43.2 Å²	43.2	16%	0.157	23%	0.232	C	C	.	.	H	α-helix	trans	-62	-46.2	175.1	179.4	59	0	0	0	111.5	T252 E256 L259 R333 Q334 G339 L340 Q341	T252-L337 HydrophobicContact CG2-CD1 3.97Å; E256-L337 HydrophobicContact CB-CD1 3.71Å; E256-L337 HydrophobicContact CG-CD1 3.86Å; E256-L337 HydrophobicContact CG-CD2 3.83Å; L259-L337 HydrophobicContact CD1-CB 4.23Å; R333-L337 WeakPolarHBondContact O-CB 3.48Å; R333-L337 PolarHBondContact O-N 3Å; Q334-L337 PolarHBondContact O-N 3.38Å; L337-G339 VanDerWaalsContact C-N 3.26Å; L337-G339 PolarHBondContact O-N 2.95Å; L337-L340 PolarHBondContact O-N 2.89Å; L337-Q341 HydrophobicContact CD1-CG 4.33Å; L337-Q341 WeakPolarHBondContact O-CB 3.4Å; L337-Q341 WeakPolarHBondContact O-CG 3.43Å; L337-Q341 PolarHBondContact O-N 2.85Å
338	A	95.8	Very high	91.5	Very high	24 Å²	24	42.1 Å²	42.1	20%	0.198	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-36.3	172.6	0	0	0	0	0	112	A292 Q334 L335 N342	A292-A338 HydrophobicContact CB-CB 3.95Å; Q334-A338 PolarHBondContact O-N 3.06Å; L335-A338 PolarHBondContact O-N 3.39Å; A338-N342 VanDerWaalsContact O-CB 3.25Å; A338-N342 WeakPolarHBondContact O-CB 3.41Å; A338-N342 VanDerWaalsContact O-CG 3.23Å; A338-N342 PolarHBondContact O-N 2.92Å; A338-N342 PolarHBondContact O-ND2 2.68Å
339	G	96.4	Very high	91	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-42.8	173.7	0	0	0	0	0	113.2	L335 L336 L337 A343	L335-G339 PolarHBondContact O-N 3.03Å; L336-G339 CarbonylContact O-C 3.59Å; L336-G339 WeakPolarHBondContact O-CA 3.45Å; L336-G339 PolarHBondContact O-N 2.81Å; L336-G339 VanDerWaalsContact O-N 3.16Å; L337-G339 VanDerWaalsContact C-N 3.26Å; L337-G339 PolarHBondContact O-N 2.95Å; G339-A343 WeakPolarHBondContact O-CB 3.14Å; G339-A343 PolarHBondContact O-N 3.49Å
340	L	95.5	Very high	90.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-52	173.5	-72.1	157.1	0	0	0	111.1	F244 T252 I255 L277 V285 L336 L337 N342 A343 G344	F244-L340 HydrophobicContact CD2-CD2 4.36Å; F244-L340 HydrophobicContact CE2-CD2 3.68Å; F244-L340 HydrophobicContact CZ-CD2 4.21Å; T252-L340 HydrophobicContact CG2-CB 3.88Å; I255-L340 HydrophobicContact CB-CD1 4.01Å; I255-L340 HydrophobicContact CD1-CD1 4.13Å; I255-L340 HydrophobicContact CD1-CD2 3.94Å; I255-L340 HydrophobicContact CG2-CD1 3.51Å; L277-L340 HydrophobicContact CD1-CD2 4.43Å; V285-L340 HydrophobicContact CG1-CD2 3.94Å; V285-L340 HydrophobicContact CG1-CG 3.84Å; V285-L340 HydrophobicContact CG2-CD2 3.72Å; V285-L340 HydrophobicContact CG2-CG 4.33Å; L336-L340 HydrophobicContact CG-CD1 4.32Å; L336-L340 WeakPolarHBondContact O-CG 3.31Å; L336-L340 PolarHBondContact O-N 3.36Å; L337-L340 PolarHBondContact O-N 2.89Å; L340-N342 PolarHBondContact O-N 2.85Å; L340-A343 PolarHBondContact O-N 3.28Å; L340-G344 PolarHBondContact O-N 2.96Å
341	Q	92.1	Very high	90.3	Very high	88 Å²	88	47.7 Å²	47.7	41%	0.411	27%	0.268	S	S	.	.	H	α-helix	trans	-60.4	-27.5	179	-69.9	174.7	-3.4	0	0	113.6	T252 L337 R345	T252-Q341 HydrophobicContact CG2-CG 3.93Å; L337-Q341 HydrophobicContact CD1-CG 4.33Å; L337-Q341 WeakPolarHBondContact O-CB 3.4Å; L337-Q341 WeakPolarHBondContact O-CG 3.43Å; L337-Q341 PolarHBondContact O-N 2.85Å; Q341-R345 WeakPolarHBondContact O-CG 3.34Å; Q341-R345 PolarHBondContact O-NE 3.45Å
342	N	90.9	Very high	90	Very high	55 Å²	55	49.3 Å²	49.3	29%	0.294	27%	0.272	S	S	.	.	H	α-helix	trans	-90.3	-40.2	176.5	-72.4	-33.8	0	0	0	112.6	E288 A338 L340 G344 R345	E288-N342 HydrophobicContact CB-CB 3.78Å; E288-N342 HydrophobicContact CG-CB 4.11Å; A338-N342 VanDerWaalsContact O-CB 3.25Å; A338-N342 WeakPolarHBondContact O-CB 3.41Å; A338-N342 VanDerWaalsContact O-CG 3.23Å; A338-N342 PolarHBondContact O-N 2.92Å; A338-N342 PolarHBondContact O-ND2 2.68Å; L340-N342 PolarHBondContact O-N 2.85Å; N342-G344 VanDerWaalsContact C-N 3.26Å; N342-G344 PolarHBondContact O-N 3.31Å; N342-R345 WeakPolarHBondContact O-CB 3.25Å; N342-R345 PolarHBondContact O-N 3.31Å; N342-R345 VanDerWaalsContact O-N 3.17Å; N342-R345 PolarHBondContact OD1-NE 3.47Å
343	A	91.1	Very high	89.8	Confident	7 Å²	7	49.4 Å²	49.4	6%	0.058	27%	0.273	C	S	.	.	H	α-helix	trans	-71.3	-20.7	177.7	0	0	0	0	0	113.4	F244 R284 V285 E288 G339 L340	F244-A343 HydrophobicContact CE1-CB 4.19Å; F244-A343 HydrophobicContact CZ-CB 4.28Å; R284-A343 HydrophobicContact CB-CB 4.25Å; R284-A343 HydrophobicContact CG-CB 3.85Å; V285-A343 HydrophobicContact CB-CB 4.36Å; V285-A343 HydrophobicContact CG2-CB 3.72Å; E288-A343 HydrophobicContact CB-CB 4.38Å; E288-A343 HydrophobicContact CG-CB 3.96Å; G339-A343 WeakPolarHBondContact O-CB 3.14Å; G339-A343 PolarHBondContact O-N 3.49Å; L340-A343 PolarHBondContact O-N 3.28Å
344	G	86.2	Confident	89.6	Confident	19 Å²	19	55.3 Å²	55.3	20%	0.196	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-10.8	171.1	0	0	0	0	0	114.5	P248 L340 N342 S346	P248-G344 VanDerWaalsContact CB-CA 3.43Å; P248-G344 WeakPolarHBondContact CG-O 3.39Å; L340-G344 PolarHBondContact O-N 2.96Å; N342-G344 VanDerWaalsContact C-N 3.26Å; N342-G344 PolarHBondContact O-N 3.31Å; G344-S346 PolarHBondContact O-N 3.46Å
345	R	80.8	Confident	89.4	Confident	134 Å²	134	53.2 Å²	53.2	51%	0.506	30%	0.303	S	S	.	.	S	Bend	trans	-75.4	122.2	172.6	-65.3	171	-167.9	-130.2	2.7	108.9	Q341 N342 P347 P380	Q341-R345 WeakPolarHBondContact O-CG 3.34Å; Q341-R345 PolarHBondContact O-NE 3.45Å; N342-R345 WeakPolarHBondContact O-CB 3.25Å; N342-R345 PolarHBondContact O-N 3.31Å; N342-R345 VanDerWaalsContact O-N 3.17Å; N342-R345 PolarHBondContact OD1-NE 3.47Å; R345-P347 WeakPolarHBondContact O-CD 3.35Å; R345-P380 HydrophobicContact CB-CB 4.28Å
346	S	68.8	Low	89.4	Confident	44 Å²	44	54.1 Å²	54.1	31%	0.308	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-56.7	126.4	175	-77.6	0	0	0	0	111.3	G344 T348 R377	G344-S346 PolarHBondContact O-N 3.46Å; S346-T348 PolarHBondContact O-N 2.67Å; S346-R377 VanDerWaalsContact CB-O 3.28Å; S346-R377 WeakPolarHBondContact CB-O 3.43Å; S346-R377 PolarHBondContact OG-O 2.79Å
347	P	72.6	Confident	89.3	Confident	112 Å²	112	58.3 Å²	58.3	73%	0.727	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-55.5	130.1	173	-26.1	35	0	0	0	110.9	R345 N349	R345-P347 WeakPolarHBondContact O-CD 3.35Å; P347-N349 PolarHBondContact O-N 3.43Å
348	T	81.6	Confident	89.3	Confident	69 Å²	69	57.4 Å²	57.4	42%	0.423	33%	0.328	S	S	.	.			trans	-58.4	93.5	-166.3	-43	0	0	0	0	113.5	S346 L350 T379 P380 Y381	S346-T348 PolarHBondContact O-N 2.67Å; T348-L350 HydrophobicContact CG2-CD2 3.85Å; T348-L350 HydrophobicContact CG2-CG 4Å; T348-L350 PolarHBondContact O-N 2.94Å; T348-T379 HydrophobicContact CG2-CG2 4.25Å; T348-P380 WeakPolarHBondContact OG1-CD 3.4Å; T348-Y381 HydrophobicContact CG2-CE2 3.91Å
349	N	85.6	Confident	89.2	Confident	64 Å²	64	57.3 Å²	57.3	34%	0.342	33%	0.33	S	S	.	.			trans	-101.6	73.4	-177.6	-168.1	-28.7	0	0	0	110.5	P347 A351 K352 V353 Y378	P347-N349 PolarHBondContact O-N 3.43Å; N349-A351 PolarHBondContact O-N 2.73Å; N349-A351 VanDerWaalsContact O-N 3.13Å; N349-A351 PolarHBondContact OD1-N 2.89Å; N349-K352 PolarHBondContact O-N 3.32Å; N349-K352 VanDerWaalsContact O-N 3.14Å; N349-K352 PolarHBondContact OD1-N 2.64Å; N349-V353 PolarHBondContact O-N 2.88Å; N349-Y378 PolarHBondContact N-O 2.64Å
350	L	88.3	Confident	88.9	Confident	80 Å²	80	62.2 Å²	62.2	42%	0.419	36%	0.361	S	S	.	.	H	α-helix	trans	-62.2	-17	176.3	-58.4	-176.8	0	0	0	113.2	T348 K354 T379	T348-L350 HydrophobicContact CG2-CD2 3.85Å; T348-L350 HydrophobicContact CG2-CG 4Å; T348-L350 PolarHBondContact O-N 2.94Å; L350-K354 VanDerWaalsContact O-CB 3.3Å; L350-K354 WeakPolarHBondContact O-CB 3.45Å; L350-K354 VanDerWaalsContact O-CG 3.22Å; L350-K354 WeakPolarHBondContact O-CG 3.24Å; L350-K354 PolarHBondContact O-N 3.33Å; L350-T379 HydrophobicContact CD2-CG2 4.01Å
351	A	89.1	Confident	88.6	Confident	75 Å²	75	69.3 Å²	69.3	62%	0.62	40%	0.4	S	S	*	.	H	α-helix	trans	-69.8	-42.1	174.2	0	0	0	0	0	111.3	N349 G355	N349-A351 PolarHBondContact O-N 2.73Å; N349-A351 VanDerWaalsContact O-N 3.13Å; N349-A351 PolarHBondContact OD1-N 2.89Å; A351-G355 PolarHBondContact O-N 2.92Å
352	K	89.7	Confident	88.7	Confident	103 Å²	103	66.9 Å²	66.9	45%	0.448	39%	0.388	S	S	.	.	H	α-helix	trans	-64.3	-41.8	172.4	-76.7	-171.1	174	-170.4	0	112.2	N349 G355 Y378	N349-K352 PolarHBondContact O-N 3.32Å; N349-K352 VanDerWaalsContact O-N 3.14Å; N349-K352 PolarHBondContact OD1-N 2.64Å; K352-G355 PolarHBondContact O-N 2.64Å; K352-Y378 HydrophobicContact CB-CD1 4.5Å; K352-Y378 HydrophobicContact CB-CD2 3.7Å; K352-Y378 HydrophobicContact CB-CE2 4.11Å; K352-Y378 HydrophobicContact CB-CG 3.91Å; K352-Y378 HydrophobicContact CD-CD1 3.57Å; K352-Y378 HydrophobicContact CD-CD2 4.03Å; K352-Y378 HydrophobicContact CD-CE1 3.47Å; K352-Y378 VanDerWaalsContact CD-CE1 3.47Å; K352-Y378 HydrophobicContact CD-CE2 3.93Å; K352-Y378 HydrophobicContact CD-CG 3.85Å
353	V	92.9	Very high	89	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.012	39%	0.387	C	S	.	.	H	α-helix	trans	-61.9	-49.9	175.7	-177.8	0	0	0	0	110.9	N349 G355 I356 L371 Y375 T379 Q399	N349-V353 PolarHBondContact O-N 2.88Å; V353-G355 PolarHBondContact O-N 2.83Å; V353-G355 VanDerWaalsContact O-N 3.16Å; V353-I356 VanDerWaalsContact O-CB 3.32Å; V353-I356 WeakPolarHBondContact O-CB 3.28Å; V353-I356 PolarHBondContact O-N 2.96Å; V353-L371 HydrophobicContact CG1-CD1 3.95Å; V353-Y375 HydrophobicContact CG1-CD2 3.89Å; V353-Y375 HydrophobicContact CG1-CE1 4.39Å; V353-Y375 HydrophobicContact CG1-CE2 3.58Å; V353-Y375 HydrophobicContact CG1-CG 4.41Å; V353-T379 HydrophobicContact CG2-CG2 3.69Å; V353-Q399 PolarHBondContact O-OE1 3.18Å
354	K	93.4	Very high	89.3	Confident	145 Å²	145	65.8 Å²	65.8	63%	0.63	38%	0.384	S	S	*	.	H	α-helix	trans	-64.3	-18.1	177.6	-72.9	175.3	178.9	-174.7	0	114.3	L350 I356	L350-K354 VanDerWaalsContact O-CB 3.3Å; L350-K354 WeakPolarHBondContact O-CB 3.45Å; L350-K354 VanDerWaalsContact O-CG 3.22Å; L350-K354 WeakPolarHBondContact O-CG 3.24Å; L350-K354 PolarHBondContact O-N 3.33Å; K354-I356 VanDerWaalsContact C-N 3.28Å
355	G	94.3	Very high	89.8	Confident	53 Å²	53	67.4 Å²	67.4	55%	0.546	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-9.2	172	0	0	0	0	0	114.2	A351 K352 V353 T357	A351-G355 PolarHBondContact O-N 2.92Å; K352-G355 PolarHBondContact O-N 2.64Å; V353-G355 PolarHBondContact O-N 2.83Å; V353-G355 VanDerWaalsContact O-N 3.16Å; G355-T357 PolarHBondContact O-N 2.81Å
356	I	96.3	Very high	90.6	Very high	33 Å²	33	63.2 Å²	63.2	17%	0.169	39%	0.387	C	S	.	.			trans	-83	89.2	176.1	-58.2	-57.9	0	0	0	109.4	V353 K354 F367 R370 L371 A374 Q399	V353-I356 VanDerWaalsContact O-CB 3.32Å; V353-I356 WeakPolarHBondContact O-CB 3.28Å; V353-I356 PolarHBondContact O-N 2.96Å; K354-I356 VanDerWaalsContact C-N 3.28Å; I356-F367 HydrophobicContact CG2-CD2 4.46Å; I356-F367 HydrophobicContact CG2-CE2 4.1Å; I356-F367 WeakPolarHBondContact O-CE2 3.44Å; I356-R370 HydrophobicContact CG2-CB 4.38Å; I356-L371 HydrophobicContact CB-CD1 4.37Å; I356-L371 HydrophobicContact CG2-CB 4.2Å; I356-L371 HydrophobicContact CG2-CD1 4.36Å; I356-A374 HydrophobicContact CD1-CB 4.17Å; I356-A374 HydrophobicContact CG1-CB 3.56Å; I356-Q399 VanDerWaalsContact O-CB 3.31Å; I356-Q399 WeakPolarHBondContact O-CB 3.49Å; I356-Q399 PolarHBondContact O-OE1 2.99Å
357	T	97.1	Very high	92	Very high	87 Å²	87	61.1 Å²	61.1	53%	0.534	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-95.2	156.7	169.3	55.7	0	0	0	0	111.9	G355 R370 Q399	G355-T357 PolarHBondContact O-N 2.81Å; T357-R370 PolarHBondContact O-NH2 2.71Å; T357-Q399 WeakPolarHBondContact CA-O 3.46Å
358	Q	97.6	Very high	93.2	Very high	12 Å²	12	56.4 Å²	56.4	6%	0.056	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-70.4	132.9	170.3	-174.5	-177.1	5.4	0	0	111.1	E362 F367 Q399 S400 A401	Q358-E362 WeakPolarHBondContact CA-OE2 3.34Å; Q358-E362 HydrophobicContact CG-CB 4.34Å; Q358-E362 PolarHBondContact NE2-O 2.69Å; Q358-F367 HydrophobicContact CB-CB 4.15Å; Q358-F367 HydrophobicContact CB-CD1 3.84Å; Q358-F367 HydrophobicContact CB-CD2 3.79Å; Q358-F367 HydrophobicContact CB-CE1 4.2Å; Q358-F367 HydrophobicContact CB-CE2 4.16Å; Q358-F367 HydrophobicContact CB-CG 3.63Å; Q358-F367 HydrophobicContact CB-CZ 4.36Å; Q358-F367 HydrophobicContact CG-CB 3.89Å; Q358-F367 HydrophobicContact CG-CD1 4.17Å; Q358-F367 HydrophobicContact CG-CD2 4.47Å; Q358-F367 HydrophobicContact CG-CG 3.91Å; Q358-Q399 PolarHBondContact N-O 3Å; Q358-S400 PolarHBondContact OE1-OG 3.48Å; Q358-A401 HydrophobicContact CB-CB 4.34Å; Q358-A401 HydrophobicContact CG-CB 4.32Å
359	G	92.8	Very high	93.9	Very high	22 Å²	22	57.5 Å²	57.5	23%	0.227	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-70.9	158.6	173.3	0	0	0	0	0	113.2	N361 E362	G359-N361 VanDerWaalsContact C-N 3.28Å; G359-N361 PolarHBondContact O-N 2.72Å; G359-E362 PolarHBondContact N-OE2 3.23Å; G359-E362 PolarHBondContact O-N 2.93Å
360	P	90.3	Very high	94.4	Very high	102 Å²	102	59 Å²	59	66%	0.662	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-37.4	-178.3	24.3	-33.8	0	0	0	112.6	R433	P360-R433 PolarHBondContact O-NH1 3.05Å
361	N	89.7	Confident	94.8	Very high	150 Å²	150	55.2 Å²	55.2	80%	0.802	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	14.3	-176.5	-57.8	-1.2	0	0	0	112.6	G359	G359-N361 VanDerWaalsContact C-N 3.28Å; G359-N361 PolarHBondContact O-N 2.72Å
362	E	94.7	Very high	95.1	Very high	36 Å²	36	52.6 Å²	52.6	17%	0.168	30%	0.297	C	S	.	.			trans	-96.2	129.7	-175.5	-178.9	-178.7	-149.8	0	0	111.3	Q358 G359 A366 F367 R370 F430	Q358-E362 WeakPolarHBondContact CA-OE2 3.34Å; Q358-E362 HydrophobicContact CG-CB 4.34Å; Q358-E362 PolarHBondContact NE2-O 2.69Å; G359-E362 PolarHBondContact N-OE2 3.23Å; G359-E362 PolarHBondContact O-N 2.93Å; E362-A366 HydrophobicContact CG-CB 4.22Å; E362-F367 HydrophobicContact CG-CB 4.2Å; E362-F367 WeakPolarHBondContact OE1-CA 3.15Å; E362-R370 VanDerWaalsContact CD-NH2 3.26Å; E362-R370 IonicContact OE1-CZ 2.68Å; E362-R370 VanDerWaalsContact OE1-CZ 3.26Å; E362-R370 IonicContact OE1-NE 2.72Å; E362-R370 PolarHBondContact OE1-NE 2.76Å; E362-R370 IonicContact OE1-NH2 2.72Å; E362-R370 PolarHBondContact OE1-NH2 2.88Å; E362-R370 IonicContact OE2-CZ 2.63Å; E362-R370 IonicContact OE2-NE 3.29Å; E362-R370 IonicContact OE2-NH2 3.79Å; E362-R370 PolarHBondContact OE2-NH2 2.77Å; E362-F430 VanDerWaalsContact C-CE2 3.49Å; E362-F430 WeakPolarHBondContact O-CE2 3.1Å
363	S	96.3	Very high	95.2	Very high	39 Å²	39	51.8 Å²	51.8	27%	0.273	29%	0.294	S	S	.	.			trans	-64.8	140.4	175.5	63.5	0	0	0	0	111	S365 A366 F367	S363-S365 PolarHBondContact O-N 2.97Å; S363-S365 VanDerWaalsContact O-N 3.12Å; S363-A366 PolarHBondContact O-N 3.46Å; S363-A366 WeakPolarHBondContact OG-CB 3.43Å; S363-A366 PolarHBondContact OG-N 3.12Å; S363-F367 PolarHBondContact O-N 2.95Å
364	P	97.5	Very high	95.1	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-51.2	-35	175.9	-30.8	37.5	0	0	0	113.7	F367 L368 F396 I404 A426 F430	P364-F367 PolarHBondContact O-N 3.44Å; P364-L368 PolarHBondContact O-N 3.44Å; P364-F396 HydrophobicContact CB-CE2 4.35Å; P364-F396 HydrophobicContact CB-CZ 3.99Å; P364-I404 HydrophobicContact CG-CD1 4.08Å; P364-A426 HydrophobicContact CB-CB 3.59Å; P364-A426 HydrophobicContact CG-CB 3.65Å; P364-F430 HydrophobicContact CG-CB 3.98Å; P364-F430 HydrophobicContact CG-CG 4.44Å
365	S	96.9	Very high	94.9	Very high	53 Å²	53	45.8 Å²	45.8	37%	0.371	27%	0.269	S	S	.	.	H	α-helix	trans	-62.6	-45.3	175.8	-53.8	0	0	0	0	112.9	S363 L368 E369 E427	S363-S365 PolarHBondContact O-N 2.97Å; S363-S365 VanDerWaalsContact O-N 3.12Å; S365-L368 PolarHBondContact O-N 3.47Å; S365-E369 PolarHBondContact O-N 3.04Å; S365-E427 PolarHBondContact N-OE2 3.49Å; S365-E427 PolarHBondContact OG-OE2 3.4Å
366	A	97.3	Very high	94.6	Very high	46 Å²	46	47.9 Å²	47.9	38%	0.38	26%	0.26	S	S	.	.	H	α-helix	trans	-70.3	-36.7	177.6	0	0	0	0	0	112.3	E362 S363 E369 R370	E362-A366 HydrophobicContact CG-CB 4.22Å; S363-A366 PolarHBondContact O-N 3.46Å; S363-A366 WeakPolarHBondContact OG-CB 3.43Å; S363-A366 PolarHBondContact OG-N 3.12Å; A366-E369 PolarHBondContact O-N 3.02Å; A366-R370 PolarHBondContact O-N 3.12Å
367	F	98	Very high	93.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-43.6	173.3	162.1	-119.9	0	0	0	112.1	I356 Q358 E362 S363 P364 E369 R370 L371 F396 Q399	I356-F367 HydrophobicContact CG2-CD2 4.46Å; I356-F367 HydrophobicContact CG2-CE2 4.1Å; I356-F367 WeakPolarHBondContact O-CE2 3.44Å; Q358-F367 HydrophobicContact CB-CB 4.15Å; Q358-F367 HydrophobicContact CB-CD1 3.84Å; Q358-F367 HydrophobicContact CB-CD2 3.79Å; Q358-F367 HydrophobicContact CB-CE1 4.2Å; Q358-F367 HydrophobicContact CB-CE2 4.16Å; Q358-F367 HydrophobicContact CB-CG 3.63Å; Q358-F367 HydrophobicContact CB-CZ 4.36Å; Q358-F367 HydrophobicContact CG-CB 3.89Å; Q358-F367 HydrophobicContact CG-CD1 4.17Å; Q358-F367 HydrophobicContact CG-CD2 4.47Å; Q358-F367 HydrophobicContact CG-CG 3.91Å; E362-F367 HydrophobicContact CG-CB 4.2Å; E362-F367 WeakPolarHBondContact OE1-CA 3.15Å; S363-F367 PolarHBondContact O-N 2.95Å; P364-F367 PolarHBondContact O-N 3.44Å; F367-E369 PolarHBondContact O-N 2.97Å; F367-R370 PolarHBondContact O-N 3.28Å; F367-L371 HydrophobicContact CE2-CB 4.49Å; F367-L371 HydrophobicContact CZ-CD2 4.25Å; F367-L371 PolarHBondContact O-N 2.8Å; F367-F396 AromaticContact CD1-CD2 3.69Å; F367-F396 HydrophobicContact CD1-CD2 3.69Å; F367-F396 AromaticContact CD1-CE2 3.63Å; F367-F396 HydrophobicContact CD1-CE2 3.63Å; F367-F396 AromaticContact CE1-CD2 3.45Å; F367-F396 HydrophobicContact CE1-CD2 3.45Å; F367-F396 VanDerWaalsContact CE1-CD2 3.45Å; F367-F396 AromaticContact CE1-CE2 3.85Å; F367-F396 HydrophobicContact CE1-CE2 3.85Å; F367-F396 HydrophobicContact CE1-CG 4.16Å; F367-F396 HydrophobicContact CZ-CD2 4.48Å; F367-Q399 HydrophobicContact CE2-CB 4.32Å; F367-Q399 HydrophobicContact CZ-CB 3.79Å
368	L	97.6	Very high	93.4	Very high	13 Å²	13	51.1 Å²	51.1	7%	0.068	26%	0.261	C	S	.	.	H	α-helix	trans	-60.8	-43	177.8	179.4	58.7	0	0	0	111.8	P364 S365 R370 L371 K372 V392 F396 L419 V423	P364-L368 PolarHBondContact O-N 3.44Å; S365-L368 PolarHBondContact O-N 3.47Å; L368-R370 PolarHBondContact O-N 2.96Å; L368-L371 HydrophobicContact CD1-CD2 4.46Å; L368-L371 WeakPolarHBondContact O-CB 3.37Å; L368-L371 PolarHBondContact O-N 3.01Å; L368-L371 VanDerWaalsContact O-N 3.12Å; L368-K372 HydrophobicContact CD1-CD 4.39Å; L368-K372 HydrophobicContact CD1-CG 4.04Å; L368-K372 HydrophobicContact CG-CD 4.09Å; L368-K372 HydrophobicContact CG-CG 4.23Å; L368-K372 WeakPolarHBondContact O-CB 3.34Å; L368-K372 WeakPolarHBondContact O-CG 3.48Å; L368-K372 PolarHBondContact O-N 3.36Å; L368-V392 HydrophobicContact CD1-CG1 3.86Å; L368-F396 HydrophobicContact CB-CD2 4.08Å; L368-F396 HydrophobicContact CB-CE2 3.99Å; L368-F396 HydrophobicContact CD1-CD2 4.02Å; L368-L419 HydrophobicContact CD1-CD1 3.98Å; L368-L419 HydrophobicContact CD1-CD2 4.24Å; L368-L419 HydrophobicContact CD1-CG 4.47Å; L368-L419 HydrophobicContact CD2-CD1 4.07Å; L368-L419 HydrophobicContact CD2-CD2 4.06Å; L368-L419 HydrophobicContact CD2-CG 3.93Å; L368-V423 HydrophobicContact CB-CG2 4.48Å; L368-V423 HydrophobicContact CD2-CG2 3.52Å
369	E	96.6	Very high	92.8	Very high	92 Å²	92	50.8 Å²	50.8	43%	0.43	26%	0.26	S	S	.	.	H	α-helix	trans	-65.9	-36.1	178.7	-72.6	-53.5	134.1	0	0	112.8	S365 A366 F367 L371 K372 E373 R376	S365-E369 PolarHBondContact O-N 3.04Å; A366-E369 PolarHBondContact O-N 3.02Å; F367-E369 PolarHBondContact O-N 2.97Å; E369-L371 VanDerWaalsContact C-N 3.34Å; E369-L371 PolarHBondContact O-N 3.1Å; E369-K372 WeakPolarHBondContact OE1-CD 3.46Å; E369-K372 IonicContact OE1-NZ 3.73Å; E369-E373 VanDerWaalsContact O-CB 3.29Å; E369-E373 WeakPolarHBondContact O-CB 3.46Å; E369-E373 PolarHBondContact O-N 3.46Å; E369-R376 IonicContact OE2-NH2 2.68Å
370	R	97.1	Very high	92.2	Very high	97 Å²	97	52.3 Å²	52.3	37%	0.366	27%	0.266	S	S	.	.	H	α-helix	trans	-64.8	-36.9	169.9	-68.5	-163.2	-57.1	104.5	2.7	113	I356 T357 E362 A366 F367 L368 A374	I356-R370 HydrophobicContact CG2-CB 4.38Å; T357-R370 PolarHBondContact O-NH2 2.71Å; E362-R370 VanDerWaalsContact CD-NH2 3.26Å; E362-R370 IonicContact OE1-CZ 2.68Å; E362-R370 VanDerWaalsContact OE1-CZ 3.26Å; E362-R370 IonicContact OE1-NE 2.72Å; E362-R370 PolarHBondContact OE1-NE 2.76Å; E362-R370 IonicContact OE1-NH2 2.72Å; E362-R370 PolarHBondContact OE1-NH2 2.88Å; E362-R370 IonicContact OE2-CZ 2.63Å; E362-R370 IonicContact OE2-NE 3.29Å; E362-R370 IonicContact OE2-NH2 3.79Å; E362-R370 PolarHBondContact OE2-NH2 2.77Å; A366-R370 PolarHBondContact O-N 3.12Å; F367-R370 PolarHBondContact O-N 3.28Å; L368-R370 PolarHBondContact O-N 2.96Å; R370-A374 WeakPolarHBondContact O-CB 3.2Å; R370-A374 PolarHBondContact O-N 3.4Å
371	L	96.4	Very high	92	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-66.8	-48.5	177.1	177.5	58.9	0	0	0	110.8	V353 I356 F367 L368 E369 E373 A374 Y375 F396 Q399	V353-L371 HydrophobicContact CG1-CD1 3.95Å; I356-L371 HydrophobicContact CB-CD1 4.37Å; I356-L371 HydrophobicContact CG2-CB 4.2Å; I356-L371 HydrophobicContact CG2-CD1 4.36Å; F367-L371 HydrophobicContact CE2-CB 4.49Å; F367-L371 HydrophobicContact CZ-CD2 4.25Å; F367-L371 PolarHBondContact O-N 2.8Å; L368-L371 HydrophobicContact CD1-CD2 4.46Å; L368-L371 WeakPolarHBondContact O-CB 3.37Å; L368-L371 PolarHBondContact O-N 3.01Å; L368-L371 VanDerWaalsContact O-N 3.12Å; E369-L371 VanDerWaalsContact C-N 3.34Å; E369-L371 PolarHBondContact O-N 3.1Å; L371-E373 VanDerWaalsContact C-N 3.34Å; L371-E373 PolarHBondContact O-N 3.32Å; L371-A374 WeakPolarHBondContact O-CB 3.44Å; L371-A374 PolarHBondContact O-N 3.44Å; L371-Y375 HydrophobicContact CD1-CD2 4.11Å; L371-Y375 HydrophobicContact CD1-CE2 3.87Å; L371-Y375 HydrophobicContact CG-CD2 4.24Å; L371-Y375 HydrophobicContact CG-CE2 4.13Å; L371-Y375 WeakPolarHBondContact O-CD2 3.31Å; L371-Y375 PolarHBondContact O-N 3.35Å; L371-F396 HydrophobicContact CD2-CB 4.03Å; L371-Q399 VanDerWaalsContact CD1-OE1 3.27Å
372	K	93.9	Very high	91.8	Very high	20 Å²	20	49.6 Å²	49.6	9%	0.087	24%	0.239	C	C	.	.	H	α-helix	trans	-56.9	-46.3	173.7	-71.6	176.4	152.4	-157.4	0	111.6	L368 E369 A374 Y375 R376 P383 E384	L368-K372 HydrophobicContact CD1-CD 4.39Å; L368-K372 HydrophobicContact CD1-CG 4.04Å; L368-K372 HydrophobicContact CG-CD 4.09Å; L368-K372 HydrophobicContact CG-CG 4.23Å; L368-K372 WeakPolarHBondContact O-CB 3.34Å; L368-K372 WeakPolarHBondContact O-CG 3.48Å; L368-K372 PolarHBondContact O-N 3.36Å; E369-K372 WeakPolarHBondContact OE1-CD 3.46Å; E369-K372 IonicContact OE1-NZ 3.73Å; K372-A374 VanDerWaalsContact C-N 3.3Å; K372-A374 PolarHBondContact O-N 3.21Å; K372-Y375 WeakPolarHBondContact O-CA 3.44Å; K372-Y375 WeakPolarHBondContact O-CB 3.36Å; K372-Y375 PolarHBondContact O-N 3.22Å; K372-R376 WeakPolarHBondContact O-CG 3.38Å; K372-R376 PolarHBondContact O-N 3.4Å; K372-P383 HydrophobicContact CB-CB 4.16Å; K372-P383 HydrophobicContact CB-CG 3.93Å; K372-P383 HydrophobicContact CG-CB 4.01Å; K372-P383 HydrophobicContact CG-CG 4.24Å; K372-E384 WeakPolarHBondContact CD-OE1 3.44Å; K372-E384 VanDerWaalsContact CE-OE1 3.29Å; K372-E384 WeakPolarHBondContact CE-OE1 3.43Å; K372-E384 IonicContact NZ-OE1 3.6Å; K372-E384 PolarHBondContact NZ-OE1 2.8Å; K372-E384 IonicContact NZ-OE2 2.85Å; K372-E384 PolarHBondContact NZ-OE2 3.3Å
373	E	91.8	Very high	91.6	Very high	86 Å²	86	48.1 Å²	48.1	40%	0.402	23%	0.232	S	C	.	.	H	α-helix	trans	-63.3	-36	177.6	-174.4	52.3	-151.1	0	0	112.5	E369 L371 R376 R377	E369-E373 VanDerWaalsContact O-CB 3.29Å; E369-E373 WeakPolarHBondContact O-CB 3.46Å; E369-E373 PolarHBondContact O-N 3.46Å; L371-E373 VanDerWaalsContact C-N 3.34Å; L371-E373 PolarHBondContact O-N 3.32Å; E373-R376 PolarHBondContact O-N 2.72Å; E373-R376 IonicContact OE2-NH1 3.49Å; E373-R376 PolarHBondContact OE2-NH1 3.49Å; E373-R377 VanDerWaalsContact O-CB 3.22Å; E373-R377 WeakPolarHBondContact O-CB 3.34Å; E373-R377 PolarHBondContact O-N 2.86Å
374	A	91.2	Very high	91.4	Very high	6 Å²	6	50.9 Å²	50.9	5%	0.05	24%	0.24	C	C	.	.	H	α-helix	trans	-67.4	-33	171.6	0	0	0	0	0	113.3	I356 R370 L371 K372 Y378	I356-A374 HydrophobicContact CD1-CB 4.17Å; I356-A374 HydrophobicContact CG1-CB 3.56Å; R370-A374 WeakPolarHBondContact O-CB 3.2Å; R370-A374 PolarHBondContact O-N 3.4Å; L371-A374 WeakPolarHBondContact O-CB 3.44Å; L371-A374 PolarHBondContact O-N 3.44Å; K372-A374 VanDerWaalsContact C-N 3.3Å; K372-A374 PolarHBondContact O-N 3.21Å; A374-Y378 HydrophobicContact CB-CD2 4.1Å; A374-Y378 HydrophobicContact CB-CE2 4.49Å; A374-Y378 VanDerWaalsContact O-CB 3.28Å; A374-Y378 WeakPolarHBondContact O-CB 3.44Å; A374-Y378 WeakPolarHBondContact O-CD2 3.34Å; A374-Y378 PolarHBondContact O-N 3.06Å
375	Y	90.7	Very high	91	Very high	14 Å²	14	54 Å²	54	6%	0.055	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-51.6	169.2	-89.7	-85	0	0	0	111.2	V353 L371 K372 R377 T379 P383 N391 V392 S395	V353-Y375 HydrophobicContact CG1-CD2 3.89Å; V353-Y375 HydrophobicContact CG1-CE1 4.39Å; V353-Y375 HydrophobicContact CG1-CE2 3.58Å; V353-Y375 HydrophobicContact CG1-CG 4.41Å; L371-Y375 HydrophobicContact CD1-CD2 4.11Å; L371-Y375 HydrophobicContact CD1-CE2 3.87Å; L371-Y375 HydrophobicContact CG-CD2 4.24Å; L371-Y375 HydrophobicContact CG-CE2 4.13Å; L371-Y375 WeakPolarHBondContact O-CD2 3.31Å; L371-Y375 PolarHBondContact O-N 3.35Å; K372-Y375 WeakPolarHBondContact O-CA 3.44Å; K372-Y375 WeakPolarHBondContact O-CB 3.36Å; K372-Y375 PolarHBondContact O-N 3.22Å; Y375-R377 VanDerWaalsContact C-N 3.33Å; Y375-R377 PolarHBondContact O-N 3.14Å; Y375-T379 HydrophobicContact CD1-CG2 4.16Å; Y375-T379 WeakPolarHBondContact O-CA 3.42Å; Y375-T379 WeakPolarHBondContact O-CB 3.47Å; Y375-T379 PolarHBondContact O-N 3.1Å; Y375-T379 PolarHBondContact O-OG1 2.94Å; Y375-P383 HydrophobicContact CG-CB 4.48Å; Y375-N391 PolarHBondContact OH-O 3.18Å; Y375-V392 HydrophobicContact CD2-CG2 4.39Å; Y375-V392 HydrophobicContact CE2-CG2 4.25Å; Y375-S395 PolarHBondContact OH-OG 3.05Å
376	R	87.1	Confident	90.7	Very high	97 Å²	97	56.8 Å²	56.8	37%	0.366	27%	0.274	S	S	.	.	H	α-helix	trans	-58.4	-42.5	178	-61.8	176.6	-157	123.1	-0.5	112.1	E369 K372 E373 P383 E384	E369-R376 IonicContact OE2-NH2 2.68Å; K372-R376 WeakPolarHBondContact O-CG 3.38Å; K372-R376 PolarHBondContact O-N 3.4Å; E373-R376 PolarHBondContact O-N 2.72Å; E373-R376 IonicContact OE2-NH1 3.49Å; E373-R376 PolarHBondContact OE2-NH1 3.49Å; R376-P383 HydrophobicContact CG-CG 3.78Å; R376-E384 IonicContact CZ-OE1 3.44Å; R376-E384 IonicContact NH2-OE1 3.49Å; R376-E384 PolarHBondContact NH2-OE1 3.09Å
377	R	82.3	Confident	90.4	Very high	123 Å²	123	57 Å²	57	46%	0.464	28%	0.28	S	S	.	.	H	α-helix	trans	-83.5	-24.4	-174.5	-165.1	165.9	-169.7	76.6	8.3	114.6	S346 E373 Y375	S346-R377 VanDerWaalsContact CB-O 3.28Å; S346-R377 WeakPolarHBondContact CB-O 3.43Å; S346-R377 PolarHBondContact OG-O 2.79Å; E373-R377 VanDerWaalsContact O-CB 3.22Å; E373-R377 WeakPolarHBondContact O-CB 3.34Å; E373-R377 PolarHBondContact O-N 2.86Å; Y375-R377 VanDerWaalsContact C-N 3.33Å; Y375-R377 PolarHBondContact O-N 3.14Å
378	Y	85.3	Confident	90.1	Very high	66 Å²	66	58.3 Å²	58.3	26%	0.259	29%	0.287	S	S	.	.	H	α-helix	trans	-125.5	5.9	-173.2	-55.8	-53.2	0	0	0	115.1	N349 K352 A374	N349-Y378 PolarHBondContact N-O 2.64Å; K352-Y378 HydrophobicContact CB-CD1 4.5Å; K352-Y378 HydrophobicContact CB-CD2 3.7Å; K352-Y378 HydrophobicContact CB-CE2 4.11Å; K352-Y378 HydrophobicContact CB-CG 3.91Å; K352-Y378 HydrophobicContact CD-CD1 3.57Å; K352-Y378 HydrophobicContact CD-CD2 4.03Å; K352-Y378 HydrophobicContact CD-CE1 3.47Å; K352-Y378 VanDerWaalsContact CD-CE1 3.47Å; K352-Y378 HydrophobicContact CD-CE2 3.93Å; K352-Y378 HydrophobicContact CD-CG 3.85Å; A374-Y378 HydrophobicContact CB-CD2 4.1Å; A374-Y378 HydrophobicContact CB-CE2 4.49Å; A374-Y378 VanDerWaalsContact O-CB 3.28Å; A374-Y378 WeakPolarHBondContact O-CB 3.44Å; A374-Y378 WeakPolarHBondContact O-CD2 3.34Å; A374-Y378 PolarHBondContact O-N 3.06Å
379	T	85.9	Confident	89.8	Confident	5 Å²	5	61 Å²	61	3%	0.031	30%	0.299	C	S	.	.	S	Bend	trans	-141.7	160.6	175.5	79.5	0	0	0	0	111.6	T348 L350 V353 Y375 Y381	T348-T379 HydrophobicContact CG2-CG2 4.25Å; L350-T379 HydrophobicContact CD2-CG2 4.01Å; V353-T379 HydrophobicContact CG2-CG2 3.69Å; Y375-T379 HydrophobicContact CD1-CG2 4.16Å; Y375-T379 WeakPolarHBondContact O-CA 3.42Å; Y375-T379 WeakPolarHBondContact O-CB 3.47Å; Y375-T379 PolarHBondContact O-N 3.1Å; Y375-T379 PolarHBondContact O-OG1 2.94Å; T379-Y381 HydrophobicContact CG2-CD2 4.37Å; T379-Y381 PolarHBondContact O-N 2.97Å; T379-Y381 PolarHBondContact OG1-N 2.68Å; T379-Y381 PolarHBondContact OG1-O 3.25Å
380	P	80.8	Confident	89.6	Confident	53 Å²	53	61.6 Å²	61.6	34%	0.344	31%	0.309	S	S	.	.	S	Bend	trans	-83.5	14.2	170.6	36.7	-37.9	0	0	0	113.1	R345 T348	R345-P380 HydrophobicContact CB-CB 4.28Å; T348-P380 WeakPolarHBondContact OG1-CD 3.4Å
381	Y	84.9	Confident	89.4	Confident	105 Å²	105	60.7 Å²	60.7	41%	0.412	31%	0.311	S	S	.	.			trans	-102.1	128.1	-178.2	-55.2	-64.8	0	0	0	110.2	T348 T379 P383	T348-Y381 HydrophobicContact CG2-CE2 3.91Å; T379-Y381 HydrophobicContact CG2-CD2 4.37Å; T379-Y381 PolarHBondContact O-N 2.97Å; T379-Y381 PolarHBondContact OG1-N 2.68Å; T379-Y381 PolarHBondContact OG1-O 3.25Å; Y381-P383 WeakPolarHBondContact O-CD 3.5Å
382	D	85.5	Confident	89.3	Confident	91 Å²	91	60.7 Å²	60.7	49%	0.487	31%	0.311	S	S	.	.			trans	-75.5	120.8	169.8	-172.8	-12.3	0	0	0	109.3	E384 D385 Q388	D382-E384 PolarHBondContact O-N 3.25Å; D382-E384 PolarHBondContact OD1-N 3.03Å; D382-D385 HydrophobicContact CB-CB 4.23Å; D382-D385 PolarHBondContact O-N 3.25Å; D382-Q388 WeakPolarHBondContact O-CB 3.5Å; D382-Q388 WeakPolarHBondContact O-CG 3.48Å
383	P	91.3	Very high	89.4	Confident	4 Å²	4	60.3 Å²	60.3	3%	0.026	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-6.7	177.5	34.1	-39.4	0	0	0	114.2	K372 Y375 R376 Y381 V392	K372-P383 HydrophobicContact CB-CB 4.16Å; K372-P383 HydrophobicContact CB-CG 3.93Å; K372-P383 HydrophobicContact CG-CB 4.01Å; K372-P383 HydrophobicContact CG-CG 4.24Å; Y375-P383 HydrophobicContact CG-CB 4.48Å; R376-P383 HydrophobicContact CG-CG 3.78Å; Y381-P383 WeakPolarHBondContact O-CD 3.5Å; P383-V392 HydrophobicContact CB-CG2 3.82Å
384	E	90.6	Very high	89.5	Confident	97 Å²	97	60.2 Å²	60.2	45%	0.453	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-8.4	173.6	-44.2	-55.6	150.7	0	0	113	K372 R376 D382 P386	K372-E384 WeakPolarHBondContact CD-OE1 3.44Å; K372-E384 VanDerWaalsContact CE-OE1 3.29Å; K372-E384 WeakPolarHBondContact CE-OE1 3.43Å; K372-E384 IonicContact NZ-OE1 3.6Å; K372-E384 PolarHBondContact NZ-OE1 2.8Å; K372-E384 IonicContact NZ-OE2 2.85Å; K372-E384 PolarHBondContact NZ-OE2 3.3Å; R376-E384 IonicContact CZ-OE1 3.44Å; R376-E384 IonicContact NH2-OE1 3.49Å; R376-E384 PolarHBondContact NH2-OE1 3.09Å; D382-E384 PolarHBondContact O-N 3.25Å; D382-E384 PolarHBondContact OD1-N 3.03Å; E384-P386 WeakPolarHBondContact O-CD 3.46Å
385	D	90.7	Very high	89.7	Confident	66 Å²	66	60.8 Å²	60.8	35%	0.353	32%	0.315	S	S	.	.	S	Bend	trans	-65.1	126.2	172.2	162.6	36.8	0	0	0	110.1	D382 G387 Q388 E389	D382-D385 HydrophobicContact CB-CB 4.23Å; D382-D385 PolarHBondContact O-N 3.25Å; D385-G387 VanDerWaalsContact CG-N 3.27Å; D385-G387 PolarHBondContact O-N 2.71Å; D385-G387 VanDerWaalsContact O-N 3.12Å; D385-G387 PolarHBondContact OD1-N 3.28Å; D385-G387 WeakPolarHBondContact OD2-CA 3.28Å; D385-Q388 HydrophobicContact CB-CG 4.06Å; D385-Q388 WeakPolarHBondContact O-CA 3.22Å; D385-Q388 PolarHBondContact O-N 3.1Å; D385-Q388 WeakPolarHBondContact OD2-CG 3.29Å; D385-Q388 PolarHBondContact OD2-N 3.41Å; D385-Q388 PolarHBondContact OD2-NE2 3.44Å; D385-E389 PolarHBondContact O-N 2.74Å
386	P	90.6	Very high	90	Very high	111 Å²	111	60.1 Å²	60.1	72%	0.721	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-28.9	172.6	-27.3	36.1	0	0	0	113.6	E384 Q388 E389	E384-P386 WeakPolarHBondContact O-CD 3.46Å; P386-Q388 PolarHBondContact O-N 2.98Å; P386-E389 PolarHBondContact O-N 2.86Å
387	G	90.6	Very high	90.4	Very high	50 Å²	50	55.8 Å²	55.8	52%	0.515	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-19.3	171.4	0	0	0	0	0	114.6	D385	D385-G387 VanDerWaalsContact CG-N 3.27Å; D385-G387 PolarHBondContact O-N 2.71Å; D385-G387 VanDerWaalsContact O-N 3.12Å; D385-G387 PolarHBondContact OD1-N 3.28Å; D385-G387 WeakPolarHBondContact OD2-CA 3.28Å
388	Q	90.6	Very high	91.1	Very high	29 Å²	29	57.7 Å²	57.7	14%	0.136	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-9.2	176	-54.2	-41.1	-54.2	0	0	114.5	D382 D385 P386 T390 N391 V392	D382-Q388 WeakPolarHBondContact O-CB 3.5Å; D382-Q388 WeakPolarHBondContact O-CG 3.48Å; D385-Q388 HydrophobicContact CB-CG 4.06Å; D385-Q388 WeakPolarHBondContact O-CA 3.22Å; D385-Q388 PolarHBondContact O-N 3.1Å; D385-Q388 WeakPolarHBondContact OD2-CG 3.29Å; D385-Q388 PolarHBondContact OD2-N 3.41Å; D385-Q388 PolarHBondContact OD2-NE2 3.44Å; P386-Q388 PolarHBondContact O-N 2.98Å; Q388-T390 PolarHBondContact O-N 3.37Å; Q388-T390 VanDerWaalsContact O-N 3.1Å; Q388-N391 WeakPolarHBondContact O-CA 3.13Å; Q388-N391 WeakPolarHBondContact O-CB 3.43Å; Q388-N391 PolarHBondContact O-N 3.37Å; Q388-N391 PolarHBondContact OE1-ND2 3.22Å; Q388-V392 HydrophobicContact CB-CG2 4.47Å; Q388-V392 PolarHBondContact O-N 3.19Å
389	E	91.8	Very high	91.6	Very high	70 Å²	70	55.4 Å²	55.4	33%	0.327	30%	0.296	S	S	.	.	H	α-helix	trans	-53.6	-40	-174.3	-171.3	-175	-178.1	0	0	112.1	D385 P386 S393 T418 L419	D385-E389 PolarHBondContact O-N 2.74Å; P386-E389 PolarHBondContact O-N 2.86Å; E389-S393 WeakPolarHBondContact O-CB 3.45Å; E389-S393 PolarHBondContact O-N 3.08Å; E389-S393 PolarHBondContact O-OG 3.48Å; E389-T418 WeakPolarHBondContact OE1-CA 3.48Å; E389-T418 WeakPolarHBondContact OE1-CB 3.41Å; E389-L419 HydrophobicContact CG-CB 3.88Å; E389-L419 PolarHBondContact OE1-N 3.39Å
390	T	92.6	Very high	92.2	Very high	103 Å²	103	55.7 Å²	55.7	63%	0.632	30%	0.298	S	S	*	.	H	α-helix	trans	-66.3	-38	176.5	-62.9	0	0	0	0	112.3	Q388 M394	Q388-T390 PolarHBondContact O-N 3.37Å; Q388-T390 VanDerWaalsContact O-N 3.1Å; T390-M394 WeakPolarHBondContact O-CB 3.34Å; T390-M394 VanDerWaalsContact O-CG 3.26Å; T390-M394 WeakPolarHBondContact O-CG 3.49Å; T390-M394 PolarHBondContact O-N 3.27Å
391	N	92.1	Very high	92.9	Very high	79 Å²	79	53.5 Å²	53.5	42%	0.422	28%	0.284	S	S	.	.	H	α-helix	trans	-69	-43.3	178.8	-67.8	-33.6	0	0	0	111.3	Y375 Q388 S395	Y375-N391 PolarHBondContact OH-O 3.18Å; Q388-N391 WeakPolarHBondContact O-CA 3.13Å; Q388-N391 WeakPolarHBondContact O-CB 3.43Å; Q388-N391 PolarHBondContact O-N 3.37Å; Q388-N391 PolarHBondContact OE1-ND2 3.22Å; N391-S395 PolarHBondContact O-N 3.18Å; N391-S395 VanDerWaalsContact O-N 3.08Å; N391-S395 PolarHBondContact O-OG 2.77Å
392	V	95.2	Very high	93.4	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-66.9	-44.4	175.9	-179.1	0	0	0	0	110.5	L368 Y375 P383 Q388 M394 S395 F396 L419	L368-V392 HydrophobicContact CD1-CG1 3.86Å; Y375-V392 HydrophobicContact CD2-CG2 4.39Å; Y375-V392 HydrophobicContact CE2-CG2 4.25Å; P383-V392 HydrophobicContact CB-CG2 3.82Å; Q388-V392 HydrophobicContact CB-CG2 4.47Å; Q388-V392 PolarHBondContact O-N 3.19Å; V392-M394 PolarHBondContact O-N 2.95Å; V392-S395 PolarHBondContact O-N 2.83Å; V392-F396 WeakPolarHBondContact O-CB 3.42Å; V392-F396 PolarHBondContact O-N 3.21Å; V392-L419 HydrophobicContact CB-CD2 4.34Å; V392-L419 HydrophobicContact CG1-CD1 4.21Å; V392-L419 HydrophobicContact CG1-CD2 3.78Å
393	S	95.3	Very high	93.7	Very high	11 Å²	11	51 Å²	51	8%	0.077	28%	0.283	C	S	.	.	H	α-helix	trans	-58.9	-45.6	176.5	-66	0	0	0	0	112.8	E389 F396 I397	E389-S393 WeakPolarHBondContact O-CB 3.45Å; E389-S393 PolarHBondContact O-N 3.08Å; E389-S393 PolarHBondContact O-OG 3.48Å; S393-F396 WeakPolarHBondContact O-CB 3.43Å; S393-F396 PolarHBondContact O-N 3.39Å; S393-I397 WeakPolarHBondContact O-CD1 3.5Å; S393-I397 VanDerWaalsContact O-CG1 3.25Å; S393-I397 WeakPolarHBondContact O-CG1 3.5Å; S393-I397 PolarHBondContact O-N 3.43Å
394	M	94.3	Very high	93.9	Very high	84 Å²	84	50.8 Å²	50.8	41%	0.414	28%	0.282	S	S	.	.	H	α-helix	trans	-65.8	-42.9	176.7	-71.3	-65.7	-81.5	0	0	111.5	T390 V392 F396 I397 W398	T390-M394 WeakPolarHBondContact O-CB 3.34Å; T390-M394 VanDerWaalsContact O-CG 3.26Å; T390-M394 WeakPolarHBondContact O-CG 3.49Å; T390-M394 PolarHBondContact O-N 3.27Å; V392-M394 PolarHBondContact O-N 2.95Å; M394-F396 VanDerWaalsContact C-N 3.34Å; M394-F396 PolarHBondContact O-N 3.39Å; M394-I397 PolarHBondContact O-N 2.94Å; M394-I397 HydrophobicContact SD-CD1 4.28Å; M394-W398 PolarHBondContact O-N 2.9Å
395	S	95.7	Very high	94	Very high	18 Å²	18	46.6 Å²	46.6	13%	0.126	26%	0.264	C	S	.	.	H	α-helix	trans	-58.2	-45.9	172.8	-78.1	0	0	0	0	111.9	Y375 N391 V392 I397 W398 Q399	Y375-S395 PolarHBondContact OH-OG 3.05Å; N391-S395 PolarHBondContact O-N 3.18Å; N391-S395 VanDerWaalsContact O-N 3.08Å; N391-S395 PolarHBondContact O-OG 2.77Å; V392-S395 PolarHBondContact O-N 2.83Å; S395-I397 PolarHBondContact O-N 3.45Å; S395-W398 PolarHBondContact O-N 2.61Å; S395-Q399 WeakPolarHBondContact O-CB 3.45Å; S395-Q399 WeakPolarHBondContact O-CG 3.29Å; S395-Q399 PolarHBondContact O-N 3.2Å; S395-Q399 PolarHBondContact OG-NE2 3.16Å
396	F	97.3	Very high	94.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.1	-47.2	177.1	178.1	-96.7	0	0	0	111.9	P364 F367 L368 L371 V392 S393 M394 S400 L408 L419 L422 V423 A426	P364-F396 HydrophobicContact CB-CE2 4.35Å; P364-F396 HydrophobicContact CB-CZ 3.99Å; F367-F396 AromaticContact CD1-CD2 3.69Å; F367-F396 HydrophobicContact CD1-CD2 3.69Å; F367-F396 AromaticContact CD1-CE2 3.63Å; F367-F396 HydrophobicContact CD1-CE2 3.63Å; F367-F396 AromaticContact CE1-CD2 3.45Å; F367-F396 HydrophobicContact CE1-CD2 3.45Å; F367-F396 VanDerWaalsContact CE1-CD2 3.45Å; F367-F396 AromaticContact CE1-CE2 3.85Å; F367-F396 HydrophobicContact CE1-CE2 3.85Å; F367-F396 HydrophobicContact CE1-CG 4.16Å; F367-F396 HydrophobicContact CZ-CD2 4.48Å; L368-F396 HydrophobicContact CB-CD2 4.08Å; L368-F396 HydrophobicContact CB-CE2 3.99Å; L368-F396 HydrophobicContact CD1-CD2 4.02Å; L371-F396 HydrophobicContact CD2-CB 4.03Å; V392-F396 WeakPolarHBondContact O-CB 3.42Å; V392-F396 PolarHBondContact O-N 3.21Å; S393-F396 WeakPolarHBondContact O-CB 3.43Å; S393-F396 PolarHBondContact O-N 3.39Å; M394-F396 VanDerWaalsContact C-N 3.34Å; M394-F396 PolarHBondContact O-N 3.39Å; F396-S400 WeakPolarHBondContact O-CB 3.23Å; F396-S400 PolarHBondContact O-N 3.27Å; F396-S400 PolarHBondContact O-OG 3.38Å; F396-S400 VanDerWaalsContact O-OG 3.11Å; F396-L408 HydrophobicContact CD1-CD1 4.07Å; F396-L408 HydrophobicContact CE1-CD1 3.78Å; F396-L419 HydrophobicContact CB-CD1 4.41Å; F396-L422 HydrophobicContact CD1-CB 4.06Å; F396-L422 HydrophobicContact CE1-CB 3.93Å; F396-V423 HydrophobicContact CE1-CG2 4.39Å; F396-V423 HydrophobicContact CE2-CG2 4.06Å; F396-V423 HydrophobicContact CZ-CB 4.46Å; F396-V423 HydrophobicContact CZ-CG2 3.8Å; F396-A426 HydrophobicContact CE1-CB 4.11Å; F396-A426 HydrophobicContact CZ-CB 3.94Å
397	I	96.1	Very high	94.3	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.036	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-48.3	177.9	-65.6	158.9	0	0	0	112	S393 M394 S395 G405 L408 E409 L414 L422	S393-I397 WeakPolarHBondContact O-CD1 3.5Å; S393-I397 VanDerWaalsContact O-CG1 3.25Å; S393-I397 WeakPolarHBondContact O-CG1 3.5Å; S393-I397 PolarHBondContact O-N 3.43Å; M394-I397 PolarHBondContact O-N 2.94Å; M394-I397 HydrophobicContact SD-CD1 4.28Å; S395-I397 PolarHBondContact O-N 3.45Å; I397-G405 WeakPolarHBondContact O-CA 3.45Å; I397-L408 HydrophobicContact CG1-CB 4.08Å; I397-L408 HydrophobicContact CG1-CD1 4.16Å; I397-L408 HydrophobicContact CG2-CB 4.11Å; I397-E409 HydrophobicContact CG2-CB 4.5Å; I397-L414 HydrophobicContact CD1-CD1 3.83Å; I397-L414 HydrophobicContact CD1-CD2 4.44Å; I397-L422 HydrophobicContact CD1-CD1 3.88Å; I397-L422 HydrophobicContact CD1-CD2 4.29Å; I397-L422 HydrophobicContact CG1-CD1 4.14Å; I397-L422 HydrophobicContact CG1-CD2 4.43Å
398	W	95.2	Very high	94.5	Very high	163 Å²	163	47.5 Å²	47.5	62%	0.617	24%	0.236	S	C	*	.	H	α-helix	trans	-76.6	-24.5	-175	-66.9	120.4	0	0	0	114.2	M394 S395 E409	M394-W398 PolarHBondContact O-N 2.9Å; S395-W398 PolarHBondContact O-N 2.61Å; W398-E409 HydrophobicContact CH2-CG 4.42Å; W398-E409 WeakPolarHBondContact CH2-OE1 3.14Å
399	Q	97.6	Very high	94.6	Very high	18 Å²	18	50.3 Å²	50.3	8%	0.084	25%	0.249	C	C	.	.	H	α-helix	trans	-105.1	-8.9	-177	-64.9	152.1	37.7	0	0	113	V353 I356 T357 Q358 F367 L371 S395	V353-Q399 PolarHBondContact O-OE1 3.18Å; I356-Q399 VanDerWaalsContact O-CB 3.31Å; I356-Q399 WeakPolarHBondContact O-CB 3.49Å; I356-Q399 PolarHBondContact O-OE1 2.99Å; T357-Q399 WeakPolarHBondContact CA-O 3.46Å; Q358-Q399 PolarHBondContact N-O 3Å; F367-Q399 HydrophobicContact CE2-CB 4.32Å; F367-Q399 HydrophobicContact CZ-CB 3.79Å; L371-Q399 VanDerWaalsContact CD1-OE1 3.27Å; S395-Q399 WeakPolarHBondContact O-CB 3.45Å; S395-Q399 WeakPolarHBondContact O-CG 3.29Å; S395-Q399 PolarHBondContact O-N 3.2Å; S395-Q399 PolarHBondContact OG-NE2 3.16Å
400	S	97.6	Very high	94.6	Very high	10 Å²	10	56.1 Å²	56.1	7%	0.07	27%	0.268	C	S	.	.	S	Bend	trans	-55	157	163.8	-98	0	0	0	0	112.1	Q358 F396	Q358-S400 PolarHBondContact OE1-OG 3.48Å; F396-S400 WeakPolarHBondContact O-CB 3.23Å; F396-S400 PolarHBondContact O-N 3.27Å; F396-S400 PolarHBondContact O-OG 3.38Å; F396-S400 VanDerWaalsContact O-OG 3.11Å
401	A	95.5	Very high	94.6	Very high	7 Å²	7	52.7 Å²	52.7	6%	0.058	25%	0.246	C	C	.	.			trans	-59	146.3	179.5	0	0	0	0	0	111	Q358 D403 I404 G405	Q358-A401 HydrophobicContact CB-CB 4.34Å; Q358-A401 HydrophobicContact CG-CB 4.32Å; A401-D403 VanDerWaalsContact C-N 3.26Å; A401-D403 PolarHBondContact O-N 3.01Å; A401-I404 HydrophobicContact CB-CD1 4.49Å; A401-I404 WeakPolarHBondContact O-CA 3.39Å; A401-I404 WeakPolarHBondContact O-CB 3.33Å; A401-I404 PolarHBondContact O-N 3.33Å; A401-G405 PolarHBondContact O-N 2.89Å
402	P	94.8	Very high	94.2	Very high	94 Å²	94	58.8 Å²	58.8	61%	0.61	27%	0.272	S	S	*	.	H	α-helix	trans	-61.4	-25.6	-162	-28.7	36.5	0	0	0	116	R406	P402-R406 WeakPolarHBondContact O-CB 3.37Å; P402-R406 PolarHBondContact O-NE 2.84Å; P402-R406 PolarHBondContact O-NH2 3.35Å; P402-R406 VanDerWaalsContact O-NH2 3.13Å
403	D	92.3	Very high	93.8	Very high	49 Å²	49	62 Å²	62	26%	0.262	29%	0.289	S	S	.	.	H	α-helix	trans	-80.1	-23.5	175.4	64.3	-55.2	0	0	0	113.8	A401 K407 R433	A401-D403 VanDerWaalsContact C-N 3.26Å; A401-D403 PolarHBondContact O-N 3.01Å; D403-K407 WeakPolarHBondContact O-CD 3.5Å; D403-K407 WeakPolarHBondContact O-CG 3.4Å; D403-R433 IonicContact OD1-CZ 2.7Å; D403-R433 IonicContact OD1-NE 3.85Å; D403-R433 IonicContact OD1-NH2 3.93Å; D403-R433 PolarHBondContact OD1-NH2 3.34Å; D403-R433 IonicContact OD2-CZ 3.77Å; D403-R433 IonicContact OD2-NE 3.17Å; D403-R433 PolarHBondContact OD2-NE 2.67Å; D403-R433 IonicContact OD2-NH2 3.68Å; D403-R433 PolarHBondContact OD2-NH2 3.17Å
404	I	94.7	Very high	93.4	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-83.5	-54.4	173.9	-68.7	172.6	0	0	0	109.2	P364 A401 R406 K407 L408 A426 I429 F430	P364-I404 HydrophobicContact CG-CD1 4.08Å; A401-I404 HydrophobicContact CB-CD1 4.49Å; A401-I404 WeakPolarHBondContact O-CA 3.39Å; A401-I404 WeakPolarHBondContact O-CB 3.33Å; A401-I404 PolarHBondContact O-N 3.33Å; I404-R406 PolarHBondContact O-N 3.41Å; I404-K407 WeakPolarHBondContact O-CA 3.48Å; I404-K407 WeakPolarHBondContact O-CB 3.17Å; I404-K407 PolarHBondContact O-N 3.12Å; I404-L408 HydrophobicContact CG2-CD1 3.8Å; I404-L408 HydrophobicContact CG2-CG 4.06Å; I404-L408 PolarHBondContact O-N 2.85Å; I404-A426 HydrophobicContact CG2-CB 3.61Å; I404-I429 HydrophobicContact CG1-CB 4.16Å; I404-I429 HydrophobicContact CG1-CG2 3.64Å; I404-F430 HydrophobicContact CD1-CB 4.13Å; I404-F430 HydrophobicContact CD1-CD2 4.39Å
405	G	94.1	Very high	92.9	Very high	9 Å²	9	70.1 Å²	70.1	9%	0.093	32%	0.323	C	S	.	.	H	α-helix	trans	-54.4	-47.3	-178.3	0	0	0	0	0	113	I397 A401 K407 L408 E409	I397-G405 WeakPolarHBondContact O-CA 3.45Å; A401-G405 PolarHBondContact O-N 2.89Å; G405-K407 PolarHBondContact O-N 2.92Å; G405-K407 VanDerWaalsContact O-N 3.11Å; G405-L408 PolarHBondContact O-N 2.97Å; G405-E409 VanDerWaalsContact O-CB 3.32Å; G405-E409 WeakPolarHBondContact O-CB 3.28Å; G405-E409 PolarHBondContact O-N 2.86Å
406	R	94.1	Very high	92.5	Very high	141 Å²	141	73.3 Å²	73.3	53%	0.532	35%	0.345	S	S	.	.	H	α-helix	trans	-64.6	-10.8	175.7	-80.5	179.5	-70.4	160.5	0.7	115.2	P402 I404 R410	P402-R406 WeakPolarHBondContact O-CB 3.37Å; P402-R406 PolarHBondContact O-NE 2.84Å; P402-R406 PolarHBondContact O-NH2 3.35Å; P402-R406 VanDerWaalsContact O-NH2 3.13Å; I404-R406 PolarHBondContact O-N 3.41Å; R406-R410 WeakPolarHBondContact O-CD 3.29Å; R406-R410 VanDerWaalsContact O-CG 3.31Å; R406-R410 WeakPolarHBondContact O-CG 3.33Å; R406-R410 PolarHBondContact O-NE 2.9Å
407	K	93.5	Very high	92.2	Very high	106 Å²	106	76 Å²	76	46%	0.461	36%	0.356	S	S	.	.	H	α-helix	trans	-97.9	-42.5	171.9	-72.1	174	-174.7	165.4	0	111	D403 I404 G405 E409 R410 I429	D403-K407 WeakPolarHBondContact O-CD 3.5Å; D403-K407 WeakPolarHBondContact O-CG 3.4Å; I404-K407 WeakPolarHBondContact O-CA 3.48Å; I404-K407 WeakPolarHBondContact O-CB 3.17Å; I404-K407 PolarHBondContact O-N 3.12Å; G405-K407 PolarHBondContact O-N 2.92Å; G405-K407 VanDerWaalsContact O-N 3.11Å; K407-E409 VanDerWaalsContact C-N 3.33Å; K407-E409 PolarHBondContact O-N 2.81Å; K407-R410 PolarHBondContact O-N 3.42Å; K407-I429 HydrophobicContact CB-CD1 3.62Å; K407-I429 HydrophobicContact CD-CD1 3.7Å; K407-I429 HydrophobicContact CD-CG1 3.83Å; K407-I429 HydrophobicContact CD-CG2 3.84Å; K407-I429 HydrophobicContact CG-CD1 4.32Å
408	L	94.5	Very high	92.1	Very high	0 Å²	0	78.6 Å²	78.6	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-59	-42.7	173.9	-62.7	179.2	0	0	0	112	F396 I397 I404 G405 R410 L411 L422 E425 A426	F396-L408 HydrophobicContact CD1-CD1 4.07Å; F396-L408 HydrophobicContact CE1-CD1 3.78Å; I397-L408 HydrophobicContact CG1-CB 4.08Å; I397-L408 HydrophobicContact CG1-CD1 4.16Å; I397-L408 HydrophobicContact CG2-CB 4.11Å; I404-L408 HydrophobicContact CG2-CD1 3.8Å; I404-L408 HydrophobicContact CG2-CG 4.06Å; I404-L408 PolarHBondContact O-N 2.85Å; G405-L408 PolarHBondContact O-N 2.97Å; L408-R410 PolarHBondContact O-N 3.38Å; L408-R410 VanDerWaalsContact O-N 3.14Å; L408-L411 HydrophobicContact CD2-CD1 4.41Å; L408-L411 WeakPolarHBondContact O-CG 3.34Å; L408-L411 PolarHBondContact O-N 2.63Å; L408-L422 HydrophobicContact CD2-CD2 4.32Å; L408-E425 HydrophobicContact CD2-CB 3.77Å; L408-E425 HydrophobicContact CD2-CG 3.51Å; L408-A426 HydrophobicContact CD1-CB 4.3Å; L408-A426 HydrophobicContact CD2-CB 4.3Å
409	E	93	Very high	92.1	Very high	88 Å²	88	71.7 Å²	71.7	41%	0.411	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-26.1	174.8	-176.8	-173.9	-152.4	0	0	113.1	I397 W398 G405 K407	I397-E409 HydrophobicContact CG2-CB 4.5Å; W398-E409 HydrophobicContact CH2-CG 4.42Å; W398-E409 WeakPolarHBondContact CH2-OE1 3.14Å; G405-E409 VanDerWaalsContact O-CB 3.32Å; G405-E409 WeakPolarHBondContact O-CB 3.28Å; G405-E409 PolarHBondContact O-N 2.86Å; K407-E409 VanDerWaalsContact C-N 3.33Å; K407-E409 PolarHBondContact O-N 2.81Å
410	R	92.3	Very high	91.9	Very high	191 Å²	191	72.6 Å²	72.6	72%	0.721	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	11.9	-173	-62.5	-179.1	-175.3	-169.3	-3.5	114	R406 K407 L408 E412	R406-R410 WeakPolarHBondContact O-CD 3.29Å; R406-R410 VanDerWaalsContact O-CG 3.31Å; R406-R410 WeakPolarHBondContact O-CG 3.33Å; R406-R410 PolarHBondContact O-NE 2.9Å; K407-R410 PolarHBondContact O-N 3.42Å; L408-R410 PolarHBondContact O-N 3.38Å; L408-R410 VanDerWaalsContact O-N 3.14Å; R410-E412 PolarHBondContact O-N 3.37Å
411	L	91.1	Very high	91.8	Very high	31 Å²	31	74.1 Å²	74.1	16%	0.162	37%	0.369	C	S	.	.			trans	-69.3	123.4	173.6	-63.8	173	0	0	0	110	L408 D413 L414 K417 L422 E425	L408-L411 HydrophobicContact CD2-CD1 4.41Å; L408-L411 WeakPolarHBondContact O-CG 3.34Å; L408-L411 PolarHBondContact O-N 2.63Å; L411-D413 PolarHBondContact O-N 2.58Å; L411-D413 VanDerWaalsContact O-N 3.17Å; L411-L414 HydrophobicContact CB-CB 4.2Å; L411-L414 HydrophobicContact CB-CD1 4.48Å; L411-L414 HydrophobicContact CD1-CD1 4.24Å; L411-L414 WeakPolarHBondContact O-CB 3.25Å; L411-L414 PolarHBondContact O-N 2.86Å; L411-K417 HydrophobicContact CD1-CD 4.31Å; L411-K417 HydrophobicContact CD1-CG 4.19Å; L411-L422 HydrophobicContact CD1-CD2 3.91Å; L411-E425 HydrophobicContact CD1-CG 4.13Å; L411-E425 HydrophobicContact CD2-CG 4.05Å
412	E	83.6	Confident	91.8	Very high	207 Å²	207	73.9 Å²	73.9	97%	0.967	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-31.9	-177.3	-61	-178.9	165.1	0	0	112.6	R410	R410-E412 PolarHBondContact O-N 3.37Å
413	D	87.7	Confident	91.9	Very high	67 Å²	67	70.4 Å²	70.4	36%	0.358	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	29.6	-178.3	81.5	-53.3	0	0	0	113.1	L411 K415 S416 K417	L411-D413 PolarHBondContact O-N 2.58Å; L411-D413 VanDerWaalsContact O-N 3.17Å; D413-K415 PolarHBondContact O-N 2.9Å; D413-S416 PolarHBondContact O-N 3.41Å; D413-S416 PolarHBondContact O-OG 3.22Å; D413-S416 PolarHBondContact OD2-OG 2.93Å; D413-K417 PolarHBondContact O-N 3.46Å; D413-K417 VanDerWaalsContact OD1-CE 3.24Å; D413-K417 WeakPolarHBondContact OD1-CE 3.29Å; D413-K417 IonicContact OD1-NZ 2.71Å; D413-K417 PolarHBondContact OD1-NZ 2.95Å; D413-K417 IonicContact OD2-NZ 3.88Å; D413-K417 PolarHBondContact OD2-NZ 3.2Å
414	L	86.4	Confident	92.1	Very high	49 Å²	49	76 Å²	76	26%	0.257	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-49.2	-32.2	-175.7	-177.4	59.1	0	0	0	114.7	I397 L411 S416 K417 L422	I397-L414 HydrophobicContact CD1-CD1 3.83Å; I397-L414 HydrophobicContact CD1-CD2 4.44Å; L411-L414 HydrophobicContact CB-CB 4.2Å; L411-L414 HydrophobicContact CB-CD1 4.48Å; L411-L414 HydrophobicContact CD1-CD1 4.24Å; L411-L414 WeakPolarHBondContact O-CB 3.25Å; L411-L414 PolarHBondContact O-N 2.86Å; L414-S416 VanDerWaalsContact C-N 3.3Å; L414-S416 PolarHBondContact O-N 3.32Å; L414-K417 PolarHBondContact O-N 3.37Å; L414-L422 HydrophobicContact CD1-CD2 3.7Å
415	K	83.6	Confident	92.1	Very high	218 Å²	218	77.7 Å²	77.7	95%	0.948	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-74.1	-14	179.1	-65.4	-175	-179.3	179.2	0	114.8	D413	D413-K415 PolarHBondContact O-N 2.9Å
416	S	86.8	Confident	92.1	Very high	85 Å²	85	77.2 Å²	77.2	59%	0.594	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-110.8	6.8	176.5	42.3	0	0	0	0	113	D413 L414	D413-S416 PolarHBondContact O-N 3.41Å; D413-S416 PolarHBondContact O-OG 3.22Å; D413-S416 PolarHBondContact OD2-OG 2.93Å; L414-S416 VanDerWaalsContact C-N 3.3Å; L414-S416 PolarHBondContact O-N 3.32Å
417	K	91.4	Very high	92.2	Very high	56 Å²	56	72.5 Å²	72.5	24%	0.243	35%	0.349	C	S	.	.			trans	-83.9	126.4	172.2	-70.3	-82.4	176.5	-84.7	0	109.6	L411 D413 L414 D421 L422	L411-K417 HydrophobicContact CD1-CD 4.31Å; L411-K417 HydrophobicContact CD1-CG 4.19Å; D413-K417 PolarHBondContact O-N 3.46Å; D413-K417 VanDerWaalsContact OD1-CE 3.24Å; D413-K417 WeakPolarHBondContact OD1-CE 3.29Å; D413-K417 IonicContact OD1-NZ 2.71Å; D413-K417 PolarHBondContact OD1-NZ 2.95Å; D413-K417 IonicContact OD2-NZ 3.88Å; D413-K417 PolarHBondContact OD2-NZ 3.2Å; L414-K417 PolarHBondContact O-N 3.37Å; K417-D421 HydrophobicContact CB-CB 4.13Å; K417-D421 HydrophobicContact CD-CB 3.46Å; K417-D421 VanDerWaalsContact CD-CB 3.46Å; K417-D421 HydrophobicContact CG-CB 4.43Å; K417-L422 HydrophobicContact CB-CD2 4.05Å; K417-L422 HydrophobicContact CB-CG 4.25Å
418	T	94.4	Very high	92.2	Very high	61 Å²	61	72.9 Å²	72.9	37%	0.374	35%	0.348	S	S	.	.			trans	-71.4	163.7	167.2	63.9	0	0	0	0	110.5	E389 G420 D421 L422	E389-T418 WeakPolarHBondContact OE1-CA 3.48Å; E389-T418 WeakPolarHBondContact OE1-CB 3.41Å; T418-G420 PolarHBondContact O-N 3.24Å; T418-G420 PolarHBondContact OG1-N 3.49Å; T418-D421 WeakPolarHBondContact CB-OD2 3.47Å; T418-D421 PolarHBondContact N-OD2 3.01Å; T418-D421 WeakPolarHBondContact O-CB 3.28Å; T418-D421 PolarHBondContact O-N 2.7Å; T418-D421 VanDerWaalsContact OG1-CG 3.3Å; T418-D421 PolarHBondContact OG1-N 2.83Å; T418-D421 VanDerWaalsContact OG1-N 3.1Å; T418-D421 PolarHBondContact OG1-OD2 3.23Å; T418-L422 PolarHBondContact O-N 3.19Å; T418-L422 VanDerWaalsContact O-N 3.09Å
419	L	94.5	Very high	92.1	Very high	18 Å²	18	73.2 Å²	73.2	9%	0.094	35%	0.349	C	S	.	.	H	α-helix	trans	-53.7	-37.3	170	-179.4	59.5	0	0	0	111.4	L368 E389 V392 F396 L422 V423	L368-L419 HydrophobicContact CD1-CD1 3.98Å; L368-L419 HydrophobicContact CD1-CD2 4.24Å; L368-L419 HydrophobicContact CD1-CG 4.47Å; L368-L419 HydrophobicContact CD2-CD1 4.07Å; L368-L419 HydrophobicContact CD2-CD2 4.06Å; L368-L419 HydrophobicContact CD2-CG 3.93Å; E389-L419 HydrophobicContact CG-CB 3.88Å; E389-L419 PolarHBondContact OE1-N 3.39Å; V392-L419 HydrophobicContact CB-CD2 4.34Å; V392-L419 HydrophobicContact CG1-CD1 4.21Å; V392-L419 HydrophobicContact CG1-CD2 3.78Å; F396-L419 HydrophobicContact CB-CD1 4.41Å; L419-L422 PolarHBondContact O-N 2.93Å; L419-V423 WeakPolarHBondContact O-CG2 3.29Å; L419-V423 PolarHBondContact O-N 3.44Å
420	G	94.4	Very high	92.1	Very high	38 Å²	38	70.9 Å²	70.9	39%	0.392	34%	0.338	S	S	.	.	H	α-helix	trans	-66.2	-34.3	174.8	0	0	0	0	0	114	T418 R424	T418-G420 PolarHBondContact O-N 3.24Å; T418-G420 PolarHBondContact OG1-N 3.49Å; G420-R424 WeakPolarHBondContact O-CG 3.24Å; G420-R424 PolarHBondContact O-N 3.45Å
421	D	94.9	Very high	92	Very high	41 Å²	41	67.1 Å²	67.1	22%	0.219	33%	0.332	C	S	.	.	H	α-helix	trans	-68.2	-40.7	173	-65.1	-60.2	0	0	0	112.2	K417 T418 V423 R424 E425	K417-D421 HydrophobicContact CB-CB 4.13Å; K417-D421 HydrophobicContact CD-CB 3.46Å; K417-D421 VanDerWaalsContact CD-CB 3.46Å; K417-D421 HydrophobicContact CG-CB 4.43Å; T418-D421 WeakPolarHBondContact CB-OD2 3.47Å; T418-D421 PolarHBondContact N-OD2 3.01Å; T418-D421 WeakPolarHBondContact O-CB 3.28Å; T418-D421 PolarHBondContact O-N 2.7Å; T418-D421 VanDerWaalsContact OG1-CG 3.3Å; T418-D421 PolarHBondContact OG1-N 2.83Å; T418-D421 VanDerWaalsContact OG1-N 3.1Å; T418-D421 PolarHBondContact OG1-OD2 3.23Å; D421-V423 VanDerWaalsContact C-N 3.33Å; D421-V423 PolarHBondContact O-N 3.17Å; D421-R424 PolarHBondContact O-N 3.41Å; D421-R424 IonicContact OD1-CZ 3.64Å; D421-R424 IonicContact OD1-NE 2.92Å; D421-R424 IonicContact OD1-NH2 3.01Å; D421-R424 PolarHBondContact OD1-NH2 2.84Å; D421-E425 WeakPolarHBondContact O-CB 3.15Å; D421-E425 PolarHBondContact O-N 3.31Å
422	L	96.1	Very high	91.8	Very high	3 Å²	3	73.2 Å²	73.2	2%	0.016	36%	0.357	C	S	.	.	H	α-helix	trans	-63.3	-40	177.2	-63.3	173.1	0	0	0	111.5	F396 I397 L408 L411 L414 K417 T418 L419 A426	F396-L422 HydrophobicContact CD1-CB 4.06Å; F396-L422 HydrophobicContact CE1-CB 3.93Å; I397-L422 HydrophobicContact CD1-CD1 3.88Å; I397-L422 HydrophobicContact CD1-CD2 4.29Å; I397-L422 HydrophobicContact CG1-CD1 4.14Å; I397-L422 HydrophobicContact CG1-CD2 4.43Å; L408-L422 HydrophobicContact CD2-CD2 4.32Å; L411-L422 HydrophobicContact CD1-CD2 3.91Å; L414-L422 HydrophobicContact CD1-CD2 3.7Å; K417-L422 HydrophobicContact CB-CD2 4.05Å; K417-L422 HydrophobicContact CB-CG 4.25Å; T418-L422 PolarHBondContact O-N 3.19Å; T418-L422 VanDerWaalsContact O-N 3.09Å; L419-L422 PolarHBondContact O-N 2.93Å; L422-A426 WeakPolarHBondContact O-CB 3.42Å; L422-A426 PolarHBondContact O-N 2.91Å
423	V	96.8	Very high	91.7	Very high	21 Å²	21	66.5 Å²	66.5	13%	0.127	32%	0.323	C	S	.	.	H	α-helix	trans	-62.7	-47.4	171.7	175.2	0	0	0	0	110.9	L368 F396 L419 D421 E425 A426 E427	L368-V423 HydrophobicContact CB-CG2 4.48Å; L368-V423 HydrophobicContact CD2-CG2 3.52Å; F396-V423 HydrophobicContact CE1-CG2 4.39Å; F396-V423 HydrophobicContact CE2-CG2 4.06Å; F396-V423 HydrophobicContact CZ-CB 4.46Å; F396-V423 HydrophobicContact CZ-CG2 3.8Å; L419-V423 WeakPolarHBondContact O-CG2 3.29Å; L419-V423 PolarHBondContact O-N 3.44Å; D421-V423 VanDerWaalsContact C-N 3.33Å; D421-V423 PolarHBondContact O-N 3.17Å; V423-E425 VanDerWaalsContact C-N 3.34Å; V423-E425 PolarHBondContact O-N 3.4Å; V423-A426 PolarHBondContact O-N 3.13Å; V423-E427 WeakPolarHBondContact O-CB 3.3Å; V423-E427 PolarHBondContact O-N 3.47Å
424	R	95.6	Very high	91	Very high	165 Å²	165	66.9 Å²	66.9	62%	0.623	32%	0.323	S	S	*	.	H	α-helix	trans	-60.1	-41.4	178	-74.3	-173	-70.9	-135.8	5.2	112.9	G420 D421 R428	G420-R424 WeakPolarHBondContact O-CG 3.24Å; G420-R424 PolarHBondContact O-N 3.45Å; D421-R424 PolarHBondContact O-N 3.41Å; D421-R424 IonicContact OD1-CZ 3.64Å; D421-R424 IonicContact OD1-NE 2.92Å; D421-R424 IonicContact OD1-NH2 3.01Å; D421-R424 PolarHBondContact OD1-NH2 2.84Å; R424-R428 VanDerWaalsContact O-CB 3.31Å; R424-R428 WeakPolarHBondContact O-CB 3.3Å; R424-R428 PolarHBondContact O-N 3.03Å; R424-R428 VanDerWaalsContact O-N 3.14Å
425	E	94.6	Very high	90.4	Very high	36 Å²	36	67.1 Å²	67.1	17%	0.168	33%	0.326	C	S	.	.	H	α-helix	trans	-62.8	-50.9	175.3	-178.2	64.6	-136.3	0	0	111	L408 L411 D421 V423 R428 I429	L408-E425 HydrophobicContact CD2-CB 3.77Å; L408-E425 HydrophobicContact CD2-CG 3.51Å; L411-E425 HydrophobicContact CD1-CG 4.13Å; L411-E425 HydrophobicContact CD2-CG 4.05Å; D421-E425 WeakPolarHBondContact O-CB 3.15Å; D421-E425 PolarHBondContact O-N 3.31Å; V423-E425 VanDerWaalsContact C-N 3.34Å; V423-E425 PolarHBondContact O-N 3.4Å; E425-R428 VanDerWaalsContact CD-NH1 3.27Å; E425-R428 VanDerWaalsContact CD-NH2 3.3Å; E425-R428 CarbonylContact O-C 3.15Å; E425-R428 PolarHBondContact O-N 2.81Å; E425-R428 PolarHBondContact O-NH1 2.95Å; E425-R428 IonicContact OE1-CZ 2.87Å; E425-R428 IonicContact OE1-NH1 3.12Å; E425-R428 PolarHBondContact OE1-NH1 3.25Å; E425-R428 IonicContact OE1-NH2 2.79Å; E425-R428 PolarHBondContact OE1-NH2 3.07Å; E425-R428 IonicContact OE2-CZ 3.64Å; E425-R428 IonicContact OE2-NH1 2.68Å; E425-R428 PolarHBondContact OE2-NH1 2.79Å; E425-R428 IonicContact OE2-NH2 2.72Å; E425-R428 PolarHBondContact OE2-NH2 3.01Å; E425-I429 HydrophobicContact CG-CD1 4.13Å; E425-I429 WeakPolarHBondContact O-CD1 3.22Å; E425-I429 WeakPolarHBondContact O-CG1 3.35Å; E425-I429 PolarHBondContact O-N 3.47Å
426	A	95.9	Very high	89.8	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-45.9	179.4	0	0	0	0	0	112.3	P364 F396 I404 L408 L422 V423 R428 I429 F430	P364-A426 HydrophobicContact CB-CB 3.59Å; P364-A426 HydrophobicContact CG-CB 3.65Å; F396-A426 HydrophobicContact CE1-CB 4.11Å; F396-A426 HydrophobicContact CZ-CB 3.94Å; I404-A426 HydrophobicContact CG2-CB 3.61Å; L408-A426 HydrophobicContact CD1-CB 4.3Å; L408-A426 HydrophobicContact CD2-CB 4.3Å; L422-A426 WeakPolarHBondContact O-CB 3.42Å; L422-A426 PolarHBondContact O-N 2.91Å; V423-A426 PolarHBondContact O-N 3.13Å; A426-R428 VanDerWaalsContact C-N 3.27Å; A426-R428 PolarHBondContact O-N 3.04Å; A426-I429 CarbonylContact O-C 3.34Å; A426-I429 WeakPolarHBondContact O-CA 3.4Å; A426-I429 WeakPolarHBondContact O-CB 3.3Å; A426-I429 PolarHBondContact O-N 2.94Å; A426-F430 WeakPolarHBondContact O-CB 3.34Å; A426-F430 PolarHBondContact O-N 3.18Å
427	E	95.6	Very high	89.1	Confident	42 Å²	42	62.9 Å²	62.9	20%	0.196	31%	0.308	C	S	.	.	H	α-helix	trans	-62.2	-38.8	179.8	-163.2	63.9	-107.9	0	0	110	S365 V423 I429 F430 N431	S365-E427 PolarHBondContact N-OE2 3.49Å; S365-E427 PolarHBondContact OG-OE2 3.4Å; V423-E427 WeakPolarHBondContact O-CB 3.3Å; V423-E427 PolarHBondContact O-N 3.47Å; E427-I429 VanDerWaalsContact C-N 3.27Å; E427-I429 PolarHBondContact O-N 3.07Å; E427-F430 PolarHBondContact O-N 3.36Å; E427-N431 WeakPolarHBondContact O-CB 3.45Å; E427-N431 PolarHBondContact O-N 2.61Å; E427-N431 PolarHBondContact O-ND2 2.83Å; E427-N431 PolarHBondContact OE1-ND2 3.36Å
428	R	93.4	Very high	88.5	Confident	114 Å²	114	65.3 Å²	65.3	43%	0.43	32%	0.32	S	S	.	.	H	α-helix	trans	-77.7	-6.9	175.1	-164.2	-104	-63.3	110.5	-4.3	114	R424 E425 A426 K432	R424-R428 VanDerWaalsContact O-CB 3.31Å; R424-R428 WeakPolarHBondContact O-CB 3.3Å; R424-R428 PolarHBondContact O-N 3.03Å; R424-R428 VanDerWaalsContact O-N 3.14Å; E425-R428 VanDerWaalsContact CD-NH1 3.27Å; E425-R428 VanDerWaalsContact CD-NH2 3.3Å; E425-R428 CarbonylContact O-C 3.15Å; E425-R428 PolarHBondContact O-N 2.81Å; E425-R428 PolarHBondContact O-NH1 2.95Å; E425-R428 IonicContact OE1-CZ 2.87Å; E425-R428 IonicContact OE1-NH1 3.12Å; E425-R428 PolarHBondContact OE1-NH1 3.25Å; E425-R428 IonicContact OE1-NH2 2.79Å; E425-R428 PolarHBondContact OE1-NH2 3.07Å; E425-R428 IonicContact OE2-CZ 3.64Å; E425-R428 IonicContact OE2-NH1 2.68Å; E425-R428 PolarHBondContact OE2-NH1 2.79Å; E425-R428 IonicContact OE2-NH2 2.72Å; E425-R428 PolarHBondContact OE2-NH2 3.01Å; A426-R428 VanDerWaalsContact C-N 3.27Å; A426-R428 PolarHBondContact O-N 3.04Å; R428-K432 WeakPolarHBondContact O-CD 3.45Å; R428-K432 VanDerWaalsContact O-CG 3.31Å; R428-K432 WeakPolarHBondContact O-CG 3.23Å
429	I	92.6	Very high	87.8	Confident	6 Å²	6	70.2 Å²	70.2	3%	0.031	33%	0.332	C	S	.	.	H	α-helix	trans	-90.3	-45.1	165.1	-67.2	157	0	0	0	110.1	I404 K407 E425 A426 E427 K432 R433	I404-I429 HydrophobicContact CG1-CB 4.16Å; I404-I429 HydrophobicContact CG1-CG2 3.64Å; K407-I429 HydrophobicContact CB-CD1 3.62Å; K407-I429 HydrophobicContact CD-CD1 3.7Å; K407-I429 HydrophobicContact CD-CG1 3.83Å; K407-I429 HydrophobicContact CD-CG2 3.84Å; K407-I429 HydrophobicContact CG-CD1 4.32Å; E425-I429 HydrophobicContact CG-CD1 4.13Å; E425-I429 WeakPolarHBondContact O-CD1 3.22Å; E425-I429 WeakPolarHBondContact O-CG1 3.35Å; E425-I429 PolarHBondContact O-N 3.47Å; A426-I429 CarbonylContact O-C 3.34Å; A426-I429 WeakPolarHBondContact O-CA 3.4Å; A426-I429 WeakPolarHBondContact O-CB 3.3Å; A426-I429 PolarHBondContact O-N 2.94Å; E427-I429 VanDerWaalsContact C-N 3.27Å; E427-I429 PolarHBondContact O-N 3.07Å; I429-K432 CarbonylContact O-C 3.52Å; I429-K432 WeakPolarHBondContact O-CA 3.42Å; I429-K432 PolarHBondContact O-N 2.87Å; I429-R433 PolarHBondContact O-N 3.07Å
430	F	92.7	Very high	87.3	Confident	39 Å²	39	76 Å²	76	17%	0.171	36%	0.359	C	S	.	.	H	α-helix	trans	-56.6	-51.7	178.3	-178.6	-95.7	0	0	0	111.2	E362 P364 I404 A426 E427 K432 R433	E362-F430 VanDerWaalsContact C-CE2 3.49Å; E362-F430 WeakPolarHBondContact O-CE2 3.1Å; P364-F430 HydrophobicContact CG-CB 3.98Å; P364-F430 HydrophobicContact CG-CG 4.44Å; I404-F430 HydrophobicContact CD1-CB 4.13Å; I404-F430 HydrophobicContact CD1-CD2 4.39Å; A426-F430 WeakPolarHBondContact O-CB 3.34Å; A426-F430 PolarHBondContact O-N 3.18Å; E427-F430 PolarHBondContact O-N 3.36Å; F430-K432 PolarHBondContact O-N 3.03Å; F430-K432 VanDerWaalsContact O-N 3.07Å; F430-R433 VanDerWaalsContact CE2-NH1 3.32Å; F430-R433 WeakPolarHBondContact O-CB 3.36Å; F430-R433 WeakPolarHBondContact O-CG 3.4Å; F430-R433 PolarHBondContact O-N 3.1Å
431	N	89.6	Confident	87	Confident	113 Å²	113	78.1 Å²	78.1	60%	0.604	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	9.2	176.6	-62.5	-70	0	0	0	114	E427	E427-N431 WeakPolarHBondContact O-CB 3.45Å; E427-N431 PolarHBondContact O-N 2.61Å; E427-N431 PolarHBondContact O-ND2 2.83Å; E427-N431 PolarHBondContact OE1-ND2 3.36Å
432	K	86.6	Confident	86.6	Confident	159 Å²	159	83 Å²	83	69%	0.691	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	11.9	168.8	-74.4	-172.1	179	-172.5	0	112.5	R428 I429 F430	R428-K432 WeakPolarHBondContact O-CD 3.45Å; R428-K432 VanDerWaalsContact O-CG 3.31Å; R428-K432 WeakPolarHBondContact O-CG 3.23Å; I429-K432 CarbonylContact O-C 3.52Å; I429-K432 WeakPolarHBondContact O-CA 3.42Å; I429-K432 PolarHBondContact O-N 2.87Å; F430-K432 PolarHBondContact O-N 3.03Å; F430-K432 VanDerWaalsContact O-N 3.07Å
433	R	83.3	Confident	86.3	Confident	66 Å²	66	86.6 Å²	86.6	25%	0.249	40%	0.395	C	S	.	.	S	Bend	trans	-74.7	131	169.4	-70.8	172	169.4	176.5	-6.4	108.8	P360 D403 I429 F430 T435	P360-R433 PolarHBondContact O-NH1 3.05Å; D403-R433 IonicContact OD1-CZ 2.7Å; D403-R433 IonicContact OD1-NE 3.85Å; D403-R433 IonicContact OD1-NH2 3.93Å; D403-R433 PolarHBondContact OD1-NH2 3.34Å; D403-R433 IonicContact OD2-CZ 3.77Å; D403-R433 IonicContact OD2-NE 3.17Å; D403-R433 PolarHBondContact OD2-NE 2.67Å; D403-R433 IonicContact OD2-NH2 3.68Å; D403-R433 PolarHBondContact OD2-NH2 3.17Å; I429-R433 PolarHBondContact O-N 3.07Å; F430-R433 VanDerWaalsContact CE2-NH1 3.32Å; F430-R433 WeakPolarHBondContact O-CB 3.36Å; F430-R433 WeakPolarHBondContact O-CG 3.4Å; F430-R433 PolarHBondContact O-N 3.1Å; R433-T435 PolarHBondContact O-N 3.16Å
434	E	72.8	Confident	86	Confident	74 Å²	74	91 Å²	91	35%	0.346	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-55.9	127.1	168	-178.7	178.9	-117.2	0	0	109.1	E438 R439 R442	E434-E438 VanDerWaalsContact CA-OE2 3.32Å; E434-E438 WeakPolarHBondContact CA-OE2 3.44Å; E434-E438 HydrophobicContact CG-CB 3.75Å; E434-R439 HydrophobicContact CG-CB 3.93Å; E434-R439 WeakPolarHBondContact OE2-CB 3.33Å; E434-R439 WeakPolarHBondContact OE2-CG 3.31Å; E434-R442 IonicContact OE1-CZ 2.81Å; E434-R442 IonicContact OE1-NE 2.9Å; E434-R442 PolarHBondContact OE1-NE 3.13Å; E434-R442 IonicContact OE1-NH2 3.26Å; E434-R442 PolarHBondContact OE1-NH2 2.88Å
435	T	73.9	Confident	85.8	Confident	55 Å²	55	90.2 Å²	90.2	34%	0.337	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-72.4	160.7	179.6	86.7	0	0	0	0	110.7	R433 E437 E438 R439	R433-T435 PolarHBondContact O-N 3.16Å; T435-E437 WeakPolarHBondContact CB-OE2 3.24Å; T435-E437 PolarHBondContact O-N 2.89Å; T435-E437 PolarHBondContact OG1-N 2.94Å; T435-E437 PolarHBondContact OG1-OE2 3.45Å; T435-E438 HydrophobicContact CG2-CG 4.36Å; T435-E438 PolarHBondContact N-OE2 2.91Å; T435-E438 PolarHBondContact O-N 3.2Å; T435-E438 PolarHBondContact OG1-N 2.91Å; T435-R439 WeakPolarHBondContact O-CB 3.29Å; T435-R439 PolarHBondContact O-N 2.65Å
436	P	70.4	Confident	85.7	Confident	86 Å²	86	92.4 Å²	92.4	56%	0.558	42%	0.417	S	S	*	.	H	α-helix	trans	-52	-40	173.5	-26.5	35.8	0	0	0	112.6	R439 E440	P436-R439 PolarHBondContact O-N 2.99Å; P436-E440 WeakPolarHBondContact O-CB 3.31Å; P436-E440 WeakPolarHBondContact O-CG 3.47Å; P436-E440 PolarHBondContact O-N 3.31Å
437	E	72.3	Confident	85.5	Confident	127 Å²	127	96 Å²	96	59%	0.593	44%	0.439	S	S	*	.	H	α-helix	trans	-70.4	-44.2	-178.3	-53	74	-160.5	0	0	112.1	T435 R439 E440 E441	T435-E437 WeakPolarHBondContact CB-OE2 3.24Å; T435-E437 PolarHBondContact O-N 2.89Å; T435-E437 PolarHBondContact OG1-N 2.94Å; T435-E437 PolarHBondContact OG1-OE2 3.45Å; E437-R439 VanDerWaalsContact C-N 3.28Å; E437-R439 PolarHBondContact O-N 2.86Å; E437-E440 PolarHBondContact O-N 3.34Å; E437-E441 WeakPolarHBondContact O-CB 3.25Å; E437-E441 PolarHBondContact O-N 3.38Å
438	E	79.1	Confident	85.5	Confident	108 Å²	108	99 Å²	99	51%	0.505	45%	0.453	S	S	.	.	H	α-helix	trans	-60.7	-40.2	173.7	-69.9	-178.3	138.7	0	0	111.4	E434 T435 E441 R442	E434-E438 VanDerWaalsContact CA-OE2 3.32Å; E434-E438 WeakPolarHBondContact CA-OE2 3.44Å; E434-E438 HydrophobicContact CG-CB 3.75Å; T435-E438 HydrophobicContact CG2-CG 4.36Å; T435-E438 PolarHBondContact N-OE2 2.91Å; T435-E438 PolarHBondContact O-N 3.2Å; T435-E438 PolarHBondContact OG1-N 2.91Å; E438-E441 PolarHBondContact O-N 2.95Å; E438-R442 PolarHBondContact O-N 3.35Å
439	R	79.3	Confident	85.6	Confident	163 Å²	163	99 Å²	99	62%	0.615	46%	0.458	S	S	*	.	H	α-helix	trans	-69.1	-41.9	178.4	-170.2	171.6	177.2	-157.3	-2.4	112.3	E434 T435 P436 E437 R442 V443	E434-R439 HydrophobicContact CG-CB 3.93Å; E434-R439 WeakPolarHBondContact OE2-CB 3.33Å; E434-R439 WeakPolarHBondContact OE2-CG 3.31Å; T435-R439 WeakPolarHBondContact O-CB 3.29Å; T435-R439 PolarHBondContact O-N 2.65Å; P436-R439 PolarHBondContact O-N 2.99Å; E437-R439 VanDerWaalsContact C-N 3.28Å; E437-R439 PolarHBondContact O-N 2.86Å; R439-R442 PolarHBondContact O-N 2.91Å; R439-V443 WeakPolarHBondContact O-CG2 3.2Å; R439-V443 PolarHBondContact O-N 2.75Å
440	E	84.6	Confident	85.7	Confident	141 Å²	141	103.3 Å²	103.3	66%	0.659	48%	0.476	S	S	*	.	H	α-helix	trans	-64.5	-39.2	173.7	-78.3	-177.1	-170.6	0	0	111.6	P436 E437 V443 R444	P436-E440 WeakPolarHBondContact O-CB 3.31Å; P436-E440 WeakPolarHBondContact O-CG 3.47Å; P436-E440 PolarHBondContact O-N 3.31Å; E437-E440 PolarHBondContact O-N 3.34Å; E440-V443 PolarHBondContact O-N 3.48Å; E440-R444 VanDerWaalsContact O-CB 3.28Å; E440-R444 WeakPolarHBondContact O-CB 3.3Å; E440-R444 PolarHBondContact O-N 2.96Å
441	E	86.4	Confident	85.7	Confident	82 Å²	82	104.5 Å²	104.5	38%	0.383	48%	0.483	S	S	.	.	H	α-helix	trans	-63.2	-44.2	171.8	173.2	156.1	-101.5	0	0	112.3	E437 E438 V443 R444 R445	E437-E441 WeakPolarHBondContact O-CB 3.25Å; E437-E441 PolarHBondContact O-N 3.38Å; E438-E441 PolarHBondContact O-N 2.95Å; E441-V443 VanDerWaalsContact C-N 3.35Å; E441-V443 PolarHBondContact O-N 3.27Å; E441-R444 PolarHBondContact O-N 2.96Å; E441-R444 IonicContact OE1-CZ 2.65Å; E441-R444 IonicContact OE1-NH2 3.43Å; E441-R444 PolarHBondContact OE1-NH2 3.21Å; E441-R445 HydrophobicContact CG-CG 4.18Å; E441-R445 WeakPolarHBondContact O-CB 3.47Å; E441-R445 VanDerWaalsContact O-CG 3.29Å; E441-R445 WeakPolarHBondContact O-CG 3.3Å; E441-R445 PolarHBondContact O-N 2.94Å
442	R	87.8	Confident	86	Confident	142 Å²	142	105.7 Å²	105.7	54%	0.536	49%	0.485	S	S	.	.	H	α-helix	trans	-56.8	-49.2	174.9	-174.5	-166.7	-59.9	-87	-4.6	111	E434 E438 R439 R444 R445 E446	E434-R442 IonicContact OE1-CZ 2.81Å; E434-R442 IonicContact OE1-NE 2.9Å; E434-R442 PolarHBondContact OE1-NE 3.13Å; E434-R442 IonicContact OE1-NH2 3.26Å; E434-R442 PolarHBondContact OE1-NH2 2.88Å; E438-R442 PolarHBondContact O-N 3.35Å; R439-R442 PolarHBondContact O-N 2.91Å; R442-R444 PolarHBondContact O-N 3.48Å; R442-R445 PolarHBondContact O-N 3.47Å; R442-E446 WeakPolarHBondContact O-CB 3.19Å; R442-E446 PolarHBondContact O-N 3.37Å
443	V	88.1	Confident	86.4	Confident	79 Å²	79	104.7 Å²	104.7	48%	0.479	48%	0.476	S	S	.	.	H	α-helix	trans	-62.3	-43.2	178.7	170.9	0	0	0	0	111	R439 E440 E441 E446 T447	R439-V443 WeakPolarHBondContact O-CG2 3.2Å; R439-V443 PolarHBondContact O-N 2.75Å; E440-V443 PolarHBondContact O-N 3.48Å; E441-V443 VanDerWaalsContact C-N 3.35Å; E441-V443 PolarHBondContact O-N 3.27Å; V443-E446 PolarHBondContact O-N 2.92Å; V443-T447 WeakPolarHBondContact O-CG2 3.09Å; V443-T447 PolarHBondContact O-N 2.92Å; V443-T447 PolarHBondContact O-OG1 3.1Å
444	R	91.3	Very high	87	Confident	114 Å²	114	107.5 Å²	107.5	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-59	-51.3	177	-170.4	-178.4	72	-117.8	-1.4	111.2	E440 E441 R442 E446 T447 E448	E440-R444 VanDerWaalsContact O-CB 3.28Å; E440-R444 WeakPolarHBondContact O-CB 3.3Å; E440-R444 PolarHBondContact O-N 2.96Å; E441-R444 PolarHBondContact O-N 2.96Å; E441-R444 IonicContact OE1-CZ 2.65Å; E441-R444 IonicContact OE1-NH2 3.43Å; E441-R444 PolarHBondContact OE1-NH2 3.21Å; R442-R444 PolarHBondContact O-N 3.48Å; R444-E446 VanDerWaalsContact C-N 3.35Å; R444-E446 PolarHBondContact O-N 2.92Å; R444-T447 WeakPolarHBondContact CA-OG1 3.29Å; R444-T447 WeakPolarHBondContact O-CA 3.46Å; R444-T447 PolarHBondContact O-N 2.76Å; R444-T447 PolarHBondContact O-OG1 2.97Å; R444-E448 WeakPolarHBondContact CG-OE1 3.46Å; R444-E448 IonicContact NE-OE1 2.68Å; R444-E448 WeakPolarHBondContact O-CG 3.41Å; R444-E448 PolarHBondContact O-N 3.44Å
445	R	91.7	Very high	88	Confident	149 Å²	149	110.7 Å²	110.7	56%	0.562	50%	0.496	S	S	*	.	H	α-helix	trans	-63.5	-39.1	179.4	-66.9	171.9	76.7	167.8	5.4	112.1	E441 R442 T447 E448 E449	E441-R445 HydrophobicContact CG-CG 4.18Å; E441-R445 WeakPolarHBondContact O-CB 3.47Å; E441-R445 VanDerWaalsContact O-CG 3.29Å; E441-R445 WeakPolarHBondContact O-CG 3.3Å; E441-R445 PolarHBondContact O-N 2.94Å; R442-R445 PolarHBondContact O-N 3.47Å; R445-T447 VanDerWaalsContact C-N 3.34Å; R445-T447 PolarHBondContact O-N 2.84Å; R445-E448 PolarHBondContact O-N 3.43Å; R445-E449 WeakPolarHBondContact O-CB 3.42Å; R445-E449 PolarHBondContact O-N 3.25Å
446	E	92.6	Very high	89	Confident	81 Å²	81	110.1 Å²	110.1	38%	0.379	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-37	170.7	-87.8	-167.6	-131.8	0	0	113	R442 V443 R444 K450	R442-E446 WeakPolarHBondContact O-CB 3.19Å; R442-E446 PolarHBondContact O-N 3.37Å; V443-E446 PolarHBondContact O-N 2.92Å; R444-E446 VanDerWaalsContact C-N 3.35Å; R444-E446 PolarHBondContact O-N 2.92Å; E446-K450 WeakPolarHBondContact O-CB 3.33Å; E446-K450 WeakPolarHBondContact O-CD 3.37Å; E446-K450 WeakPolarHBondContact O-CE 3.33Å; E446-K450 WeakPolarHBondContact O-CG 3.48Å; E446-K450 PolarHBondContact O-N 3Å; E446-K450 VanDerWaalsContact O-N 3.12Å; E446-K450 IonicContact OE2-NZ 2.88Å; E446-K450 PolarHBondContact OE2-NZ 3.25Å
447	T	92.6	Very high	90.2	Very high	77 Å²	77	110.3 Å²	110.3	47%	0.472	49%	0.49	S	S	.	.	H	α-helix	trans	-73.1	-37.6	175.7	52.2	0	0	0	0	112.6	V443 R444 R445 K450 E451	V443-T447 WeakPolarHBondContact O-CG2 3.09Å; V443-T447 PolarHBondContact O-N 2.92Å; V443-T447 PolarHBondContact O-OG1 3.1Å; R444-T447 WeakPolarHBondContact CA-OG1 3.29Å; R444-T447 WeakPolarHBondContact O-CA 3.46Å; R444-T447 PolarHBondContact O-N 2.76Å; R444-T447 PolarHBondContact O-OG1 2.97Å; R445-T447 VanDerWaalsContact C-N 3.34Å; R445-T447 PolarHBondContact O-N 2.84Å; T447-K450 PolarHBondContact O-N 3.42Å; T447-E451 PolarHBondContact O-N 3.1Å
448	E	94.3	Very high	91.2	Very high	103 Å²	103	108.9 Å²	108.9	48%	0.481	48%	0.483	S	S	.	.	H	α-helix	trans	-60.6	-49.8	173.8	-70.7	163	173.7	0	0	110.6	R444 R445 K450 E451 E452	R444-E448 WeakPolarHBondContact CG-OE1 3.46Å; R444-E448 IonicContact NE-OE1 2.68Å; R444-E448 WeakPolarHBondContact O-CG 3.41Å; R444-E448 PolarHBondContact O-N 3.44Å; R445-E448 PolarHBondContact O-N 3.43Å; E448-K450 PolarHBondContact O-N 3.45Å; E448-E451 PolarHBondContact O-N 2.8Å; E448-E451 VanDerWaalsContact O-N 3.16Å; E448-E452 PolarHBondContact O-N 2.94Å
449	E	94.9	Very high	92	Very high	114 Å²	114	108.5 Å²	108.5	53%	0.533	48%	0.482	S	S	.	.	H	α-helix	trans	-62	-41.7	177.3	-167.7	-156.1	134.2	0	0	112.3	R445 E451 E452 R453	R445-E449 WeakPolarHBondContact O-CB 3.42Å; R445-E449 PolarHBondContact O-N 3.25Å; E449-E451 VanDerWaalsContact C-N 3.3Å; E449-E451 PolarHBondContact O-N 3.5Å; E449-E452 PolarHBondContact O-N 3.24Å; E449-R453 WeakPolarHBondContact O-CB 3.4Å; E449-R453 PolarHBondContact O-N 3.05Å
450	K	94.9	Very high	92.6	Very high	97 Å²	97	107.2 Å²	107.2	42%	0.422	48%	0.483	S	S	.	.	H	α-helix	trans	-65.3	-33.5	176.1	-72.5	162.1	-159.2	165.3	0	111.8	E446 T447 E448 R454	E446-K450 WeakPolarHBondContact O-CB 3.33Å; E446-K450 WeakPolarHBondContact O-CD 3.37Å; E446-K450 WeakPolarHBondContact O-CE 3.33Å; E446-K450 WeakPolarHBondContact O-CG 3.48Å; E446-K450 PolarHBondContact O-N 3Å; E446-K450 VanDerWaalsContact O-N 3.12Å; E446-K450 IonicContact OE2-NZ 2.88Å; E446-K450 PolarHBondContact OE2-NZ 3.25Å; T447-K450 PolarHBondContact O-N 3.42Å; E448-K450 PolarHBondContact O-N 3.45Å; K450-R454 PolarHBondContact O-N 2.85Å
451	E	94.1	Very high	93	Very high	65 Å²	65	105.1 Å²	105.1	30%	0.304	47%	0.472	S	S	.	.	H	α-helix	trans	-76.9	-41.2	175.8	-143	-148.9	141.9	0	0	112.4	T447 E448 E449 R453 R454 R455	T447-E451 PolarHBondContact O-N 3.1Å; E448-E451 PolarHBondContact O-N 2.8Å; E448-E451 VanDerWaalsContact O-N 3.16Å; E449-E451 VanDerWaalsContact C-N 3.3Å; E449-E451 PolarHBondContact O-N 3.5Å; E451-R453 VanDerWaalsContact C-N 3.33Å; E451-R453 PolarHBondContact O-N 3.12Å; E451-R454 VanDerWaalsContact CG-NH2 3.35Å; E451-R454 WeakPolarHBondContact O-CB 3.44Å; E451-R454 PolarHBondContact O-N 3.05Å; E451-R454 VanDerWaalsContact O-N 3.14Å; E451-R454 IonicContact OE1-NH2 2.67Å; E451-R454 PolarHBondContact OE1-NH2 2.97Å; E451-R455 WeakPolarHBondContact O-CG 3.46Å; E451-R455 PolarHBondContact O-N 3.44Å; E451-R455 IonicContact OE1-CZ 2.71Å; E451-R455 VanDerWaalsContact OE1-CZ 3.26Å; E451-R455 IonicContact OE1-NE 3Å; E451-R455 PolarHBondContact OE1-NE 3.37Å; E451-R455 IonicContact OE1-NH2 3.26Å; E451-R455 PolarHBondContact OE1-NH2 3.48Å; E451-R455 IonicContact OE2-CZ 3.9Å; E451-R455 IonicContact OE2-NE 2.69Å; E451-R455 IonicContact OE2-NH2 3.59Å; E451-R455 PolarHBondContact OE2-NH2 3.13Å
452	E	95.2	Very high	93.3	Very high	137 Å²	137	106.2 Å²	106.2	64%	0.64	48%	0.477	S	S	*	.	H	α-helix	trans	-57.9	-46.4	173.8	-175.4	176.7	-171.9	0	0	110.8	E448 E449 R454 R455 A456	E448-E452 PolarHBondContact O-N 2.94Å; E449-E452 PolarHBondContact O-N 3.24Å; E452-R454 VanDerWaalsContact C-N 3.3Å; E452-R454 PolarHBondContact O-N 3.45Å; E452-R455 PolarHBondContact O-N 2.91Å; E452-A456 WeakPolarHBondContact O-CB 3.43Å; E452-A456 PolarHBondContact O-N 3.25Å
453	R	95.4	Very high	93.5	Very high	138 Å²	138	104.6 Å²	104.6	52%	0.521	47%	0.473	S	S	.	.	H	α-helix	trans	-60.2	-39.1	175.5	-168.4	173.5	70.7	-123.7	4.1	112.3	E449 E451 A456 E457	E449-R453 WeakPolarHBondContact O-CB 3.4Å; E449-R453 PolarHBondContact O-N 3.05Å; E451-R453 VanDerWaalsContact C-N 3.33Å; E451-R453 PolarHBondContact O-N 3.12Å; R453-A456 PolarHBondContact O-N 3.41Å; R453-E457 WeakPolarHBondContact O-CB 3.41Å; R453-E457 PolarHBondContact O-N 3.38Å
454	R	94.6	Very high	93.7	Very high	125 Å²	125	107.2 Å²	107.2	47%	0.472	48%	0.481	S	S	.	.	H	α-helix	trans	-64.5	-45.2	175.5	-167.3	-174.8	72.7	-130.1	-7.6	111.5	K450 E451 E452 E457 E458	K450-R454 PolarHBondContact O-N 2.85Å; E451-R454 VanDerWaalsContact CG-NH2 3.35Å; E451-R454 WeakPolarHBondContact O-CB 3.44Å; E451-R454 PolarHBondContact O-N 3.05Å; E451-R454 VanDerWaalsContact O-N 3.14Å; E451-R454 IonicContact OE1-NH2 2.67Å; E451-R454 PolarHBondContact OE1-NH2 2.97Å; E452-R454 VanDerWaalsContact C-N 3.3Å; E452-R454 PolarHBondContact O-N 3.45Å; R454-E457 WeakPolarHBondContact O-CB 3.46Å; R454-E457 PolarHBondContact O-N 3.18Å; R454-E458 WeakPolarHBondContact CG-OE1 3.07Å; R454-E458 IonicContact NE-OE1 3.18Å; R454-E458 WeakPolarHBondContact O-CG 3.34Å; R454-E458 PolarHBondContact O-N 3.02Å
455	R	94.4	Very high	93.7	Very high	142 Å²	142	109.6 Å²	109.6	54%	0.536	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-42.6	176.6	-67.3	170.9	-173.9	-176.1	4.7	111.5	E451 E452 E458 E459	E451-R455 WeakPolarHBondContact O-CG 3.46Å; E451-R455 PolarHBondContact O-N 3.44Å; E451-R455 IonicContact OE1-CZ 2.71Å; E451-R455 VanDerWaalsContact OE1-CZ 3.26Å; E451-R455 IonicContact OE1-NE 3Å; E451-R455 PolarHBondContact OE1-NE 3.37Å; E451-R455 IonicContact OE1-NH2 3.26Å; E451-R455 PolarHBondContact OE1-NH2 3.48Å; E451-R455 IonicContact OE2-CZ 3.9Å; E451-R455 IonicContact OE2-NE 2.69Å; E451-R455 IonicContact OE2-NH2 3.59Å; E451-R455 PolarHBondContact OE2-NH2 3.13Å; E452-R455 PolarHBondContact O-N 2.91Å; R455-E458 PolarHBondContact O-N 3Å; R455-E459 WeakPolarHBondContact O-CB 3.3Å; R455-E459 PolarHBondContact O-N 3.42Å
456	A	95.1	Very high	93.7	Very high	43 Å²	43	106.1 Å²	106.1	36%	0.355	48%	0.482	S	S	.	.	H	α-helix	trans	-64.6	-39.8	176.2	0	0	0	0	0	112.5	E452 R453 Q460	E452-A456 WeakPolarHBondContact O-CB 3.43Å; E452-A456 PolarHBondContact O-N 3.25Å; R453-A456 PolarHBondContact O-N 3.41Å; A456-Q460 WeakPolarHBondContact O-CG 3.31Å; A456-Q460 PolarHBondContact O-N 3.4Å
457	E	94.9	Very high	93.7	Very high	89 Å²	89	110.7 Å²	110.7	42%	0.416	50%	0.496	S	S	.	.	H	α-helix	trans	-62.8	-42.2	171.6	-87.6	-169.4	-132.2	0	0	112.8	R453 R454 Q460 K461	R453-E457 WeakPolarHBondContact O-CB 3.41Å; R453-E457 PolarHBondContact O-N 3.38Å; R454-E457 WeakPolarHBondContact O-CB 3.46Å; R454-E457 PolarHBondContact O-N 3.18Å; E457-Q460 PolarHBondContact O-N 2.87Å; E457-K461 VanDerWaalsContact O-CD 3.22Å; E457-K461 WeakPolarHBondContact O-CD 3.48Å; E457-K461 WeakPolarHBondContact O-CE 3.45Å; E457-K461 WeakPolarHBondContact O-CG 3.24Å; E457-K461 PolarHBondContact O-N 3.03Å; E457-K461 IonicContact OE2-NZ 2.69Å; E457-K461 PolarHBondContact OE2-NZ 2.85Å
458	E	94.4	Very high	93.5	Very high	97 Å²	97	114.7 Å²	114.7	45%	0.453	50%	0.502	S	S	.	.	H	α-helix	trans	-64.6	-44	177.5	-74.9	165.1	-173.1	0	0	111.2	R454 R455 Q460 K461 E462	R454-E458 WeakPolarHBondContact CG-OE1 3.07Å; R454-E458 IonicContact NE-OE1 3.18Å; R454-E458 WeakPolarHBondContact O-CG 3.34Å; R454-E458 PolarHBondContact O-N 3.02Å; R455-E458 PolarHBondContact O-N 3Å; E458-Q460 PolarHBondContact O-N 3.28Å; E458-K461 PolarHBondContact O-N 3.09Å; E458-E462 PolarHBondContact O-N 3.41Å
459	E	94.6	Very high	93.3	Very high	101 Å²	101	115.5 Å²	115.5	47%	0.472	50%	0.501	S	S	.	.	H	α-helix	trans	-64.4	-37.6	175.6	-159.9	-146.7	-169.9	0	0	112.2	R455 E462 K463	R455-E459 WeakPolarHBondContact O-CB 3.3Å; R455-E459 PolarHBondContact O-N 3.42Å; E459-E462 PolarHBondContact O-N 3.49Å; E459-K463 HydrophobicContact CG-CD 4.42Å; E459-K463 WeakPolarHBondContact O-CB 3.35Å; E459-K463 VanDerWaalsContact O-CG 3.28Å; E459-K463 WeakPolarHBondContact O-CG 3.34Å; E459-K463 PolarHBondContact O-N 3.45Å; E459-K463 WeakPolarHBondContact OE1-CE 3.36Å; E459-K463 IonicContact OE1-NZ 2.65Å; E459-K463 PolarHBondContact OE1-NZ 3Å; E459-K463 IonicContact OE2-NZ 3.55Å; E459-K463 PolarHBondContact OE2-NZ 3.42Å
460	Q	91.9	Very high	93	Very high	136 Å²	136	116.4 Å²	116.4	64%	0.636	51%	0.505	S	S	*	.	H	α-helix	trans	-64	-42.8	171.6	-76.7	-174	21.1	0	0	112.2	A456 E457 E458 E462 K463 E464	A456-Q460 WeakPolarHBondContact O-CG 3.31Å; A456-Q460 PolarHBondContact O-N 3.4Å; E457-Q460 PolarHBondContact O-N 2.87Å; E458-Q460 PolarHBondContact O-N 3.28Å; Q460-E462 VanDerWaalsContact C-N 3.29Å; Q460-E462 PolarHBondContact O-N 3.45Å; Q460-K463 PolarHBondContact O-N 3.46Å; Q460-E464 PolarHBondContact O-N 3.47Å
461	K	93.9	Very high	92.7	Very high	97 Å²	97	119.3 Å²	119.3	42%	0.422	51%	0.513	S	S	.	.	H	α-helix	trans	-64.6	-33.7	176.9	-68.6	157.1	-162.9	167.4	0	111.4	E457 E458 R465	E457-K461 VanDerWaalsContact O-CD 3.22Å; E457-K461 WeakPolarHBondContact O-CD 3.48Å; E457-K461 WeakPolarHBondContact O-CE 3.45Å; E457-K461 WeakPolarHBondContact O-CG 3.24Å; E457-K461 PolarHBondContact O-N 3.03Å; E457-K461 IonicContact OE2-NZ 2.69Å; E457-K461 PolarHBondContact OE2-NZ 2.85Å; E458-K461 PolarHBondContact O-N 3.09Å; K461-R465 WeakPolarHBondContact O-CD 3.46Å; K461-R465 VanDerWaalsContact O-CG 3.24Å; K461-R465 WeakPolarHBondContact O-CG 3.38Å; K461-R465 PolarHBondContact O-N 2.83Å; K461-R465 VanDerWaalsContact O-N 3.13Å
462	E	91.8	Very high	92.4	Very high	105 Å²	105	120.2 Å²	120.2	49%	0.491	52%	0.518	S	S	.	.	H	α-helix	trans	-70	-48.1	171.2	-179.4	147.3	-120.1	0	0	112.5	E458 E459 Q460 E464 R465 D466	E458-E462 PolarHBondContact O-N 3.41Å; E459-E462 PolarHBondContact O-N 3.49Å; Q460-E462 VanDerWaalsContact C-N 3.29Å; Q460-E462 PolarHBondContact O-N 3.45Å; E462-E464 PolarHBondContact O-N 3.34Å; E462-R465 CarbonylContact O-C 3.5Å; E462-R465 WeakPolarHBondContact O-CA 3.24Å; E462-R465 WeakPolarHBondContact O-CB 3.27Å; E462-R465 PolarHBondContact O-N 2.83Å; E462-D466 PolarHBondContact O-N 2.7Å
463	K	93.8	Very high	91.8	Very high	107 Å²	107	119 Å²	119	47%	0.465	51%	0.513	S	S	.	.	H	α-helix	trans	-56.8	-34.8	174.6	-73.7	166.5	179.4	172.1	0	112.2	E459 Q460 R467	E459-K463 HydrophobicContact CG-CD 4.42Å; E459-K463 WeakPolarHBondContact O-CB 3.35Å; E459-K463 VanDerWaalsContact O-CG 3.28Å; E459-K463 WeakPolarHBondContact O-CG 3.34Å; E459-K463 PolarHBondContact O-N 3.45Å; E459-K463 WeakPolarHBondContact OE1-CE 3.36Å; E459-K463 IonicContact OE1-NZ 2.65Å; E459-K463 PolarHBondContact OE1-NZ 3Å; E459-K463 IonicContact OE2-NZ 3.55Å; E459-K463 PolarHBondContact OE2-NZ 3.42Å; Q460-K463 PolarHBondContact O-N 3.46Å; K463-R467 WeakPolarHBondContact O-CB 3.39Å; K463-R467 VanDerWaalsContact O-CG 3.24Å; K463-R467 WeakPolarHBondContact O-CG 3.28Å; K463-R467 PolarHBondContact O-N 3.3Å
464	E	91.3	Very high	91.2	Very high	135 Å²	135	114.9 Å²	114.9	63%	0.631	51%	0.505	S	S	*	.	H	α-helix	trans	-67.5	-46.1	171.7	-171.2	-179.5	-165.5	0	0	112.2	Q460 E462 D466 R467 R468	Q460-E464 PolarHBondContact O-N 3.47Å; E462-E464 PolarHBondContact O-N 3.34Å; E464-D466 VanDerWaalsContact C-N 3.3Å; E464-D466 PolarHBondContact O-N 2.61Å; E464-R467 PolarHBondContact O-N 2.88Å; E464-R468 PolarHBondContact O-N 3.38Å
465	R	91.9	Very high	90.5	Very high	163 Å²	163	115.8 Å²	115.8	62%	0.615	51%	0.513	S	S	*	.	H	α-helix	trans	-57.1	-41.9	175.5	-72.1	164.1	179.5	-175.1	-0.1	111.5	K461 E462 R468 R469	K461-R465 WeakPolarHBondContact O-CD 3.46Å; K461-R465 VanDerWaalsContact O-CG 3.24Å; K461-R465 WeakPolarHBondContact O-CG 3.38Å; K461-R465 PolarHBondContact O-N 2.83Å; K461-R465 VanDerWaalsContact O-N 3.13Å; E462-R465 CarbonylContact O-C 3.5Å; E462-R465 WeakPolarHBondContact O-CA 3.24Å; E462-R465 WeakPolarHBondContact O-CB 3.27Å; E462-R465 PolarHBondContact O-N 2.83Å; R465-R468 WeakPolarHBondContact O-CB 3.32Å; R465-R468 PolarHBondContact O-N 2.81Å; R465-R469 WeakPolarHBondContact O-CG 3.45Å; R465-R469 PolarHBondContact O-N 3.18Å
466	D	90.9	Very high	89.8	Confident	77 Å²	77	114 Å²	114	41%	0.412	51%	0.513	S	S	.	.	H	α-helix	trans	-68.9	-40.4	175.4	-91.3	-47.1	0	0	0	113.6	E462 E464 R468 R469 H470	E462-D466 PolarHBondContact O-N 2.7Å; E464-D466 VanDerWaalsContact C-N 3.3Å; E464-D466 PolarHBondContact O-N 2.61Å; D466-R468 PolarHBondContact O-N 2.82Å; D466-R469 PolarHBondContact O-N 2.83Å; D466-R469 IonicContact OD1-CZ 3.22Å; D466-R469 IonicContact OD1-NE 2.75Å; D466-R469 PolarHBondContact OD1-NE 2.91Å; D466-R469 IonicContact OD1-NH2 2.89Å; D466-R469 PolarHBondContact OD1-NH2 3.39Å; D466-R469 IonicContact OD2-CZ 3.84Å; D466-R469 IonicContact OD2-NH2 2.81Å; D466-R469 PolarHBondContact OD2-NH2 2.75Å; D466-H470 WeakPolarHBondContact O-CB 3.45Å; D466-H470 PolarHBondContact O-N 2.83Å
467	R	91.9	Very high	88.7	Confident	177 Å²	177	117.2 Å²	117.2	67%	0.668	52%	0.524	S	S	*	.	H	α-helix	trans	-63.1	-29	173.2	-69.1	176	92.9	171.2	9	111.5	K463 E464 R471	K463-R467 WeakPolarHBondContact O-CB 3.39Å; K463-R467 VanDerWaalsContact O-CG 3.24Å; K463-R467 WeakPolarHBondContact O-CG 3.28Å; K463-R467 PolarHBondContact O-N 3.3Å; E464-R467 PolarHBondContact O-N 2.88Å; R467-R471 WeakPolarHBondContact O-CB 3.43Å; R467-R471 VanDerWaalsContact O-CD 3.27Å; R467-R471 WeakPolarHBondContact O-CD 3.38Å; R467-R471 WeakPolarHBondContact O-CG 3.37Å; R467-R471 PolarHBondContact O-N 3.18Å; R467-R471 VanDerWaalsContact O-N 3.14Å
468	R	90.4	Very high	87.4	Confident	161 Å²	161	115.6 Å²	115.6	61%	0.608	53%	0.526	S	S	*	.	H	α-helix	trans	-70.5	-51.6	169.5	-178.2	174.4	177.4	169.9	-1.6	112.2	E464 R465 D466 H470 R471 E472	E464-R468 PolarHBondContact O-N 3.38Å; R465-R468 WeakPolarHBondContact O-CB 3.32Å; R465-R468 PolarHBondContact O-N 2.81Å; D466-R468 PolarHBondContact O-N 2.82Å; R468-H470 VanDerWaalsContact C-N 3.3Å; R468-H470 PolarHBondContact O-N 3.32Å; R468-R471 WeakPolarHBondContact O-CB 3.22Å; R468-R471 PolarHBondContact O-N 3.12Å; R468-R471 VanDerWaalsContact O-N 3.11Å; R468-E472 VanDerWaalsContact CG-OE1 3.31Å; R468-E472 WeakPolarHBondContact CG-OE1 3.47Å; R468-E472 IonicContact CZ-OE1 3.61Å; R468-E472 IonicContact NE-OE1 2.81Å; R468-E472 PolarHBondContact NE-OE1 3.06Å; R468-E472 IonicContact NH2-OE1 3.5Å; R468-E472 PolarHBondContact NH2-OE1 3.24Å; R468-E472 WeakPolarHBondContact O-CG 3.35Å; R468-E472 PolarHBondContact O-N 3.47Å
469	R	89.3	Confident	85.9	Confident	120 Å²	120	115.4 Å²	115.4	45%	0.453	53%	0.531	S	S	.	.	H	α-helix	trans	-52.3	-47.5	174.9	-72.2	-172.4	-78.8	-122.6	8.9	111.4	R465 D466 R471 E472 M473	R465-R469 WeakPolarHBondContact O-CG 3.45Å; R465-R469 PolarHBondContact O-N 3.18Å; D466-R469 PolarHBondContact O-N 2.83Å; D466-R469 IonicContact OD1-CZ 3.22Å; D466-R469 IonicContact OD1-NE 2.75Å; D466-R469 PolarHBondContact OD1-NE 2.91Å; D466-R469 IonicContact OD1-NH2 2.89Å; D466-R469 PolarHBondContact OD1-NH2 3.39Å; D466-R469 IonicContact OD2-CZ 3.84Å; D466-R469 IonicContact OD2-NH2 2.81Å; D466-R469 PolarHBondContact OD2-NH2 2.75Å; R469-R471 PolarHBondContact O-N 3.04Å; R469-E472 PolarHBondContact O-N 3.45Å; R469-M473 WeakPolarHBondContact O-CG 3.48Å; R469-M473 PolarHBondContact O-N 3.33Å
470	H	88.2	Confident	84.2	Confident	132 Å²	132	115.9 Å²	115.9	61%	0.611	54%	0.541	S	S	*	.	H	α-helix	trans	-64	-40.4	178.1	-172.3	-84.8	0	0	0	113	D466 R468 E472 S474	D466-H470 WeakPolarHBondContact O-CB 3.45Å; D466-H470 PolarHBondContact O-N 2.83Å; R468-H470 VanDerWaalsContact C-N 3.3Å; R468-H470 PolarHBondContact O-N 3.32Å; H470-E472 VanDerWaalsContact C-N 3.34Å; H470-S474 PolarHBondContact CE1-OG 2.99Å; H470-S474 PolarHBondContact ND1-OG 3.49Å; H470-S474 VanDerWaalsContact O-CB 3.29Å; H470-S474 WeakPolarHBondContact O-CB 3.48Å; H470-S474 PolarHBondContact O-N 3.06Å; H470-S474 PolarHBondContact O-OG 3.35Å
471	R	88.5	Confident	82.5	Confident	158 Å²	158	114.5 Å²	114.5	60%	0.596	54%	0.542	S	S	*	.	H	α-helix	trans	-63.3	-38.4	173.3	-76.8	164.1	176.6	169.3	-2.6	112.1	R467 R468 R469 K475	R467-R471 WeakPolarHBondContact O-CB 3.43Å; R467-R471 VanDerWaalsContact O-CD 3.27Å; R467-R471 WeakPolarHBondContact O-CD 3.38Å; R467-R471 WeakPolarHBondContact O-CG 3.37Å; R467-R471 PolarHBondContact O-N 3.18Å; R467-R471 VanDerWaalsContact O-N 3.14Å; R468-R471 WeakPolarHBondContact O-CB 3.22Å; R468-R471 PolarHBondContact O-N 3.12Å; R468-R471 VanDerWaalsContact O-N 3.11Å; R469-R471 PolarHBondContact O-N 3.04Å; R471-K475 WeakPolarHBondContact O-CG 3.39Å; R471-K475 PolarHBondContact O-N 3.35Å; R471-K475 VanDerWaalsContact O-N 3.16Å
472	E	87.1	Confident	80.2	Confident	85 Å²	85	114.4 Å²	114.4	40%	0.397	55%	0.553	S	S	.	*	H	α-helix	trans	-71.2	-44.8	179.1	-71.5	166.1	-179	0	0	110.6	R468 R469 H470 S474 K475 L476	R468-E472 VanDerWaalsContact CG-OE1 3.31Å; R468-E472 WeakPolarHBondContact CG-OE1 3.47Å; R468-E472 IonicContact CZ-OE1 3.61Å; R468-E472 IonicContact NE-OE1 2.81Å; R468-E472 PolarHBondContact NE-OE1 3.06Å; R468-E472 IonicContact NH2-OE1 3.5Å; R468-E472 PolarHBondContact NH2-OE1 3.24Å; R468-E472 WeakPolarHBondContact O-CG 3.35Å; R468-E472 PolarHBondContact O-N 3.47Å; R469-E472 PolarHBondContact O-N 3.45Å; H470-E472 VanDerWaalsContact C-N 3.34Å; E472-S474 PolarHBondContact O-N 3.01Å; E472-K475 WeakPolarHBondContact O-CB 3.41Å; E472-K475 PolarHBondContact O-N 2.77Å; E472-L476 PolarHBondContact O-N 3.05Å; E472-L476 VanDerWaalsContact O-N 3.1Å
473	M	83.5	Confident	77.9	Confident	110 Å²	110	112.7 Å²	112.7	54%	0.542	56%	0.564	S	S	.	*	H	α-helix	trans	-60.7	-40.8	171.2	-72.1	-60.7	-65.8	0	0	113.3	R469 K475 L476 L477	R469-M473 WeakPolarHBondContact O-CG 3.48Å; R469-M473 PolarHBondContact O-N 3.33Å; M473-K475 VanDerWaalsContact C-N 3.3Å; M473-K475 PolarHBondContact O-N 3.24Å; M473-L476 PolarHBondContact O-N 3.21Å; M473-L476 HydrophobicContact SD-CD1 4.23Å; M473-L477 WeakPolarHBondContact O-CG 3.44Å; M473-L477 PolarHBondContact O-N 3.34Å
474	S	82.8	Confident	75.4	Confident	52 Å²	52	116 Å²	116	36%	0.364	58%	0.581	S	S	.	*	H	α-helix	trans	-62.1	-37.7	176.7	-60.6	0	0	0	0	112	H470 E472 A478	H470-S474 PolarHBondContact CE1-OG 2.99Å; H470-S474 PolarHBondContact ND1-OG 3.49Å; H470-S474 VanDerWaalsContact O-CB 3.29Å; H470-S474 WeakPolarHBondContact O-CB 3.48Å; H470-S474 PolarHBondContact O-N 3.06Å; H470-S474 PolarHBondContact O-OG 3.35Å; E472-S474 PolarHBondContact O-N 3.01Å; S474-A478 WeakPolarHBondContact O-CB 3.35Å; S474-A478 PolarHBondContact O-N 3.01Å
475	K	80.6	Confident	72.9	Confident	144 Å²	144	120.7 Å²	120.7	63%	0.626	59%	0.593	S	S	*	*	H	α-helix	trans	-66.1	-44.6	174.5	-73.6	171.1	179.7	-178.1	0	111.6	R471 E472 M473 A478 T479	R471-K475 WeakPolarHBondContact O-CG 3.39Å; R471-K475 PolarHBondContact O-N 3.35Å; R471-K475 VanDerWaalsContact O-N 3.16Å; E472-K475 WeakPolarHBondContact O-CB 3.41Å; E472-K475 PolarHBondContact O-N 2.77Å; M473-K475 VanDerWaalsContact C-N 3.3Å; M473-K475 PolarHBondContact O-N 3.24Å; K475-A478 PolarHBondContact O-N 2.84Å; K475-T479 PolarHBondContact O-N 3.1Å; K475-T479 PolarHBondContact O-OG1 3.25Å; K475-T479 VanDerWaalsContact O-OG1 3.13Å
476	L	78.4	Confident	70.4	Confident	105 Å²	105	122.4 Å²	122.4	55%	0.55	61%	0.608	S	S	.	*	H	α-helix	trans	-60.3	-48.7	178	-69.5	171.1	0	0	0	111.1	E472 M473 A478 T479 V480	E472-L476 PolarHBondContact O-N 3.05Å; E472-L476 VanDerWaalsContact O-N 3.1Å; M473-L476 PolarHBondContact O-N 3.21Å; M473-L476 HydrophobicContact SD-CD1 4.23Å; L476-A478 VanDerWaalsContact C-N 3.34Å; L476-A478 PolarHBondContact O-N 2.93Å; L476-T479 WeakPolarHBondContact CA-OG1 3.32Å; L476-T479 PolarHBondContact O-N 2.93Å; L476-T479 PolarHBondContact O-OG1 3.09Å; L476-V480 WeakPolarHBondContact O-CG2 3.4Å; L476-V480 PolarHBondContact O-N 3.49Å
477	L	73	Confident	67.9	Low	110 Å²	110	125.1 Å²	125.1	58%	0.576	62%	0.622	S	S	*	*	H	α-helix	trans	-58.6	-43.7	175.1	-73.1	167.7	0	0	0	112	M473 T479 V480 V481	M473-L477 WeakPolarHBondContact O-CG 3.44Å; M473-L477 PolarHBondContact O-N 3.34Å; L477-T479 PolarHBondContact O-N 2.85Å; L477-V480 PolarHBondContact O-N 3.01Å; L477-V481 WeakPolarHBondContact O-CG2 3.23Å; L477-V481 PolarHBondContact O-N 3.46Å
478	A	68.4	Low	65.3	Low	55 Å²	55	126.8 Å²	126.8	46%	0.455	63%	0.628	S	S	.	*	H	α-helix	trans	-60.1	-44.3	175.4	0	0	0	0	0	112.1	S474 K475 L476 V480 V481 S482	S474-A478 WeakPolarHBondContact O-CB 3.35Å; S474-A478 PolarHBondContact O-N 3.01Å; K475-A478 PolarHBondContact O-N 2.84Å; L476-A478 VanDerWaalsContact C-N 3.34Å; L476-A478 PolarHBondContact O-N 2.93Å; A478-V480 PolarHBondContact O-N 3.45Å; A478-V481 PolarHBondContact O-N 3.32Å; A478-S482 WeakPolarHBondContact O-CB 3.46Å; A478-S482 PolarHBondContact O-N 3.46Å; A478-S482 PolarHBondContact O-OG 3.28Å
479	T	62	Low	62.9	Low	93 Å²	93	128.7 Å²	128.7	57%	0.571	64%	0.644	S	S	*	*	H	α-helix	trans	-64.8	-35.1	176.7	44.4	0	0	0	0	113.5	K475 L476 L477 G483	K475-T479 PolarHBondContact O-N 3.1Å; K475-T479 PolarHBondContact O-OG1 3.25Å; K475-T479 VanDerWaalsContact O-OG1 3.13Å; L476-T479 WeakPolarHBondContact CA-OG1 3.32Å; L476-T479 PolarHBondContact O-N 2.93Å; L476-T479 PolarHBondContact O-OG1 3.09Å; L477-T479 PolarHBondContact O-N 2.85Å; T479-G483 PolarHBondContact O-N 3.12Å
480	V	59.8	Low	60.3	Low	111 Å²	111	126.6 Å²	126.6	67%	0.673	66%	0.66	S	S	*	*	H	α-helix	trans	-68.1	-43.9	174.3	176.3	0	0	0	0	111.1	L476 L477 A478 S482 G483	L476-V480 WeakPolarHBondContact O-CG2 3.4Å; L476-V480 PolarHBondContact O-N 3.49Å; L477-V480 PolarHBondContact O-N 3.01Å; A478-V480 PolarHBondContact O-N 3.45Å; V480-S482 VanDerWaalsContact C-N 3.35Å; V480-S482 PolarHBondContact O-N 3.04Å; V480-G483 PolarHBondContact O-N 3.23Å
481	V	54.7	Low	58.1	Low	108 Å²	108	124.2 Å²	124.2	66%	0.655	67%	0.672	S	S	*	*	H	α-helix	trans	-65.3	-36.8	177.2	172.9	0	0	0	0	111.9	L477 A478 G483 Q484	L477-V481 WeakPolarHBondContact O-CG2 3.23Å; L477-V481 PolarHBondContact O-N 3.46Å; A478-V481 PolarHBondContact O-N 3.32Å; V481-G483 PolarHBondContact O-N 3.12Å; V481-Q484 PolarHBondContact O-N 3.48Å
482	S	45.3	Very low	55.7	Low	95 Å²	95	125.6 Å²	125.6	66%	0.664	69%	0.685	S	S	*	*	H	α-helix	trans	-64.2	-19.9	171.8	-68.4	0	0	0	0	113.7	A478 V480 Q484	A478-S482 WeakPolarHBondContact O-CB 3.46Å; A478-S482 PolarHBondContact O-N 3.46Å; A478-S482 PolarHBondContact O-OG 3.28Å; V480-S482 VanDerWaalsContact C-N 3.35Å; V480-S482 PolarHBondContact O-N 3.04Å; S482-Q484 PolarHBondContact O-N 3.19Å
483	G	44.4	Very low	53.6	Low	69 Å²	69	133.1 Å²	133.1	71%	0.711	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-13.9	176.6	0	0	0	0	0	114.9	T479 V480 V481	T479-G483 PolarHBondContact O-N 3.12Å; V480-G483 PolarHBondContact O-N 3.23Å; V481-G483 PolarHBondContact O-N 3.12Å
484	Q	42.1	Very low	51.6	Low	176 Å²	176	139.3 Å²	139.3	82%	0.822	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.3	15.6	-169.5	-147.5	172.3	6	0	0	115.1	V481 S482	V481-Q484 PolarHBondContact O-N 3.48Å; S482-Q484 PolarHBondContact O-N 3.19Å
485	R	36.9	Very low	50.1	Low	233 Å²	233	147.8 Å²	147.8	88%	0.879	75%	0.751	S	S	*	*			trans	-141.2	77.2	170.1	-73.8	-167.1	175.5	178.1	-0.4	113.3
486	Q	39.6	Very low	48.9	Very low	200 Å²	200	146.4 Å²	146.4	94%	0.935	76%	0.757	S	S	*	*			trans	-86.5	99	150.5	-74	-171	0.8	0	0	109.2
487	D	39	Very low	48.1	Very low	133 Å²	133	150.6 Å²	150.6	71%	0.711	77%	0.773	S	S	*	*				-167.5	163.3	127.3	-156.2	0.9	0	0	0	111
488	R	37.5	Very low	47.7	Very low	212 Å²	212	149.3 Å²	149.3	80%	0.8	77%	0.766	S	S	*	*			trans	71.1	78.4	165.1	-58.6	-176.5	-175.8	-174.3	-2.3	118.1
489	Q	40.5	Very low	47.6	Very low	201 Å²	201	150.9 Å²	150.9	94%	0.939	77%	0.768	S	S	*	*				40	105.7	124.2	-59.4	-178.2	10.4	0	0	118.7
490	G	33.6	Very low	47.9	Very low	77 Å²	77	155 Å²	155	79%	0.794	78%	0.778	S	S	*	*			trans	-145.6	105.8	157.9	0	0	0	0	0	109.2
491	G	41.8	Very low	48.4	Very low	82 Å²	82	154.5 Å²	154.5	85%	0.845	77%	0.771	S	S	*	*			trans	-86.1	122.1	-157.9	0	0	0	0	0	116.6
492	E	38.4	Very low	49.6	Very low	187 Å²	187	151.7 Å²	151.7	87%	0.874	75%	0.751	S	S	*	*			trans	-78.4	123.1	162.8	-71.7	-161.5	126.2	0	0	111.8	R494	E492-R494 PolarHBondContact O-N 2.83Å
493	R	42.6	Very low	51.2	Low	243 Å²	243	147.1 Å²	147.1	92%	0.917	72%	0.719	S	S	*	*			trans	-76.4	86.7	178.9	-71	177.4	170.6	172.6	-3.9	111.9	R495	R493-R495 PolarHBondContact O-N 3.02Å
494	R	43.1	Very low	52.7	Low	239 Å²	239	147 Å²	147	90%	0.902	71%	0.711	S	S	*	*			trans	-60.3	109	163.8	-71.2	-170.1	178	-163.2	0.2	109.8	E492	E492-R494 PolarHBondContact O-N 2.83Å
495	R	50.6	Low	54.2	Low	231 Å²	231	144.5 Å²	144.5	87%	0.872	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-66.8	137.4	167.1	-72	-179.1	174.2	174.2	-1.2	108.7	R493 Q497	R493-R495 PolarHBondContact O-N 3.02Å; R495-Q497 PolarHBondContact O-N 3.11Å
496	P	55.8	Low	56.1	Low	115 Å²	115	135 Å²	135	75%	0.747	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-56.9	135.8	170.4	-23.9	34.1	0	0	0	110.7
497	Q	60.5	Low	58.1	Low	193 Å²	193	132 Å²	132	90%	0.902	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-66.4	150.5	168.2	-75	-179	-42.3	0	0	109.9	R495	R495-Q497 PolarHBondContact O-N 3.11Å
498	L	64.3	Low	59.9	Low	82 Å²	82	129.5 Å²	129.5	43%	0.429	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-90.2	142.2	170.6	-69	158.4	0	0	0	108.5	Q502 A504 K507	L498-Q502 HydrophobicContact CB-CB 4.39Å; L498-Q502 HydrophobicContact CD2-CB 4.21Å; L498-A504 HydrophobicContact CD1-CB 3.44Å; L498-A504 VanDerWaalsContact CD1-CB 3.44Å; L498-K507 HydrophobicContact CD2-CG 4.22Å
499	D	66.1	Low	62	Low	89 Å²	89	125 Å²	125	48%	0.476	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-61	154.3	167.7	-98.4	-21.5	0	0	0	110.8	D501 Q502 K509	D499-D501 PolarHBondContact O-N 2.81Å; D499-Q502 HydrophobicContact CB-CB 4.3Å; D499-Q502 HydrophobicContact CB-CG 3.85Å; D499-Q502 VanDerWaalsContact N-OE1 3.17Å; D499-Q502 PolarHBondContact O-N 2.88Å; D499-K509 WeakPolarHBondContact OD2-CE 3.24Å; D499-K509 IonicContact OD2-NZ 2.67Å; D499-K509 PolarHBondContact OD2-NZ 2.8Å
500	K	70	Confident	63.7	Low	180 Å²	180	119 Å²	119	78%	0.783	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.4	-34	-176	-73.1	-176.1	175.9	179.2	0	114.3	W512	K500-W512 WeakPolarHBondContact O-CH2 3.34Å
501	D	70.6	Confident	65.9	Low	99 Å²	99	117.4 Å²	117.4	53%	0.529	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.8	9.7	-175.3	-45.2	-66	0	0	0	113.9	D499 K509 G510	D499-D501 PolarHBondContact O-N 2.81Å; D501-K509 CarbonylContact O-C 3.57Å; D501-K509 VanDerWaalsContact O-CA 3.27Å; D501-K509 WeakPolarHBondContact O-CA 3.05Å; D501-G510 PolarHBondContact O-N 2.69Å
502	Q	79.5	Confident	67.7	Low	49 Å²	49	121.5 Å²	121.5	23%	0.229	57%	0.572	C	S	.	*	B	Isolated β-bridge	trans	-85.8	130.8	-179.6	-84.6	-176.2	-25.2	0	0	113.3	L498 D499 A504 K507 K509	L498-Q502 HydrophobicContact CB-CB 4.39Å; L498-Q502 HydrophobicContact CD2-CB 4.21Å; D499-Q502 HydrophobicContact CB-CB 4.3Å; D499-Q502 HydrophobicContact CB-CG 3.85Å; D499-Q502 VanDerWaalsContact N-OE1 3.17Å; D499-Q502 PolarHBondContact O-N 2.88Å; Q502-A504 PolarHBondContact O-N 3.21Å; Q502-A504 VanDerWaalsContact O-N 3.15Å; Q502-K507 WeakPolarHBondContact CG-O 3.46Å; Q502-K507 PolarHBondContact NE2-O 3.1Å; Q502-K509 HydrophobicContact CG-CD 4.4Å; Q502-K509 HydrophobicContact CG-CG 3.6Å
503	C	77.8	Confident	69.5	Low	0 Å²	0	113.7 Å²	113.7	0%	0	54%	0.539	C	S	.	.			trans	-61.6	114.2	169.9	177.5	0	0	0	0	111.2	Y505 K507 E508 H511 C516	C503-Y505 PolarHBondContact O-N 3.43Å; C503-Y505 PolarHBondContact SG-N 2.66Å; C503-K507 WeakPolarHBondContact O-CA 3.49Å; C503-K507 PolarHBondContact O-N 3.44Å; C503-E508 WeakPolarHBondContact CB-O 3.18Å; C503-E508 PolarHBondContact N-O 2.89Å; C503-H511 WeakPolarHBondContact CA-O 3.15Å; C503-H511 WeakPolarHBondContact CB-NE2 3.31Å; C503-H511 VanDerWaalsContact CB-O 3.29Å; C503-H511 WeakPolarHBondContact CB-O 3.44Å; C503-H511 PolarHBondContact N-O 3.4Å; C503-H511 PolarHBondContact SG-NE2 3.18Å; C503-C516 VanDerWaalsContact SG-CB 3.6Å; C503-C516 VanDerWaalsContact SG-SG 3.67Å
504	A	76.1	Confident	70.9	Confident	67 Å²	67	110.6 Å²	110.6	55%	0.554	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-1.8	177.2	0	0	0	0	0	116	L498 Q502 A513	L498-A504 HydrophobicContact CD1-CB 3.44Å; L498-A504 VanDerWaalsContact CD1-CB 3.44Å; Q502-A504 PolarHBondContact O-N 3.21Å; Q502-A504 VanDerWaalsContact O-N 3.15Å; A504-A513 HydrophobicContact CB-CB 3.79Å
505	Y	73.7	Confident	72.2	Confident	123 Å²	123	104.2 Å²	104.2	48%	0.482	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-58.8	174.5	-170.4	-101.9	0	0	0	112.5	C503 K518 K519 P520	C503-Y505 PolarHBondContact O-N 3.43Å; C503-Y505 PolarHBondContact SG-N 2.66Å; Y505-K518 WeakPolarHBondContact CE1-O 3.08Å; Y505-K519 HydrophobicContact CD1-CB 3.84Å; Y505-K519 HydrophobicContact CD1-CG 4.08Å; Y505-K519 HydrophobicContact CD2-CD 4.29Å; Y505-K519 HydrophobicContact CD2-CG 4.12Å; Y505-K519 HydrophobicContact CE1-CB 3.94Å; Y505-K519 HydrophobicContact CE1-CG 4.11Å; Y505-K519 HydrophobicContact CE2-CG 4.15Å; Y505-K519 HydrophobicContact CG-CB 4.27Å; Y505-K519 HydrophobicContact CG-CD 4.22Å; Y505-K519 HydrophobicContact CG-CG 4.09Å; Y505-P520 WeakPolarHBondContact OH-CD 2.71Å
506	C	77.8	Confident	73.5	Confident	34 Å²	34	93.6 Å²	93.6	23%	0.23	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-6.2	-178.3	63.5	0	0	0	0	115.2	E508 H511 K518	C506-E508 HydrophobicContact CB-CG 4.45Å; C506-E508 PolarHBondContact O-N 2.85Å; C506-E508 PolarHBondContact SG-OE2 3Å; C506-H511 VanDerWaalsContact SG-CE1 3.59Å; C506-H511 PolarHBondContact SG-NE2 3.12Å; C506-H511 VanDerWaalsContact SG-NE2 3.41Å; C506-K518 HydrophobicContact CB-CD 4.22Å
507	K	80	Confident	74.3	Confident	135 Å²	135	93.6 Å²	93.6	59%	0.587	48%	0.477	S	S	*	.			trans	63.6	6.5	-175.9	-54.1	-178	-179.3	178.8	0	116.4	L498 Q502 C503	L498-K507 HydrophobicContact CD2-CG 4.22Å; Q502-K507 WeakPolarHBondContact CG-O 3.46Å; Q502-K507 PolarHBondContact NE2-O 3.1Å; C503-K507 WeakPolarHBondContact O-CA 3.49Å; C503-K507 PolarHBondContact O-N 3.44Å
508	E	78.1	Confident	74.9	Confident	81 Å²	81	90.3 Å²	90.3	38%	0.379	46%	0.46	S	S	.	.			trans	-73.6	148.8	172.3	-62.9	168	137.2	0	0	110.2	C503 C506 K518	C503-E508 WeakPolarHBondContact CB-O 3.18Å; C503-E508 PolarHBondContact N-O 2.89Å; C506-E508 HydrophobicContact CB-CG 4.45Å; C506-E508 PolarHBondContact O-N 2.85Å; C506-E508 PolarHBondContact SG-OE2 3Å; E508-K518 IonicContact OE1-NZ 2.61Å; E508-K518 PolarHBondContact OE1-NZ 2.82Å; E508-K518 IonicContact OE2-NZ 3Å; E508-K518 PolarHBondContact OE2-NZ 2.87Å
509	K	80.4	Confident	75.1	Confident	119 Å²	119	90.7 Å²	90.7	52%	0.517	46%	0.458	S	S	.	.	B	Isolated β-bridge	trans	-86.2	156.7	-179.6	-72.5	-173.2	177	-174.6	0	112.2	D499 D501 Q502	D499-K509 WeakPolarHBondContact OD2-CE 3.24Å; D499-K509 IonicContact OD2-NZ 2.67Å; D499-K509 PolarHBondContact OD2-NZ 2.8Å; D501-K509 CarbonylContact O-C 3.57Å; D501-K509 VanDerWaalsContact O-CA 3.27Å; D501-K509 WeakPolarHBondContact O-CA 3.05Å; Q502-K509 HydrophobicContact CG-CD 4.4Å; Q502-K509 HydrophobicContact CG-CG 3.6Å
510	G	77.6	Confident	75	Confident	73 Å²	73	91.1 Å²	91.1	75%	0.753	47%	0.465	S	S	*	.	S	Bend	trans	92.6	6	170.3	0	0	0	0	0	116.1	D501	D501-G510 PolarHBondContact O-N 2.69Å
511	H	79.1	Confident	74.4	Confident	44 Å²	44	93.6 Å²	93.6	20%	0.204	47%	0.47	C	S	.	.	S	Bend	trans	-151.3	152.8	170.7	68.4	-93.1	0	0	0	112.1	C503 C506 C516	C503-H511 WeakPolarHBondContact CA-O 3.15Å; C503-H511 WeakPolarHBondContact CB-NE2 3.31Å; C503-H511 VanDerWaalsContact CB-O 3.29Å; C503-H511 WeakPolarHBondContact CB-O 3.44Å; C503-H511 PolarHBondContact N-O 3.4Å; C503-H511 PolarHBondContact SG-NE2 3.18Å; C506-H511 VanDerWaalsContact SG-CE1 3.59Å; C506-H511 PolarHBondContact SG-NE2 3.12Å; C506-H511 VanDerWaalsContact SG-NE2 3.41Å; H511-C516 VanDerWaalsContact CD2-CA 3.41Å; H511-C516 WeakPolarHBondContact CD2-CA 3.06Å; H511-C516 WeakPolarHBondContact NE2-CA 3.25Å; H511-C516 PolarHBondContact NE2-SG 3.08Å; H511-C516 VanDerWaalsContact NE2-SG 3.39Å
512	W	78.9	Confident	73.5	Confident	169 Å²	169	91.5 Å²	91.5	64%	0.64	47%	0.472	S	S	*	.			trans	-87.8	157.4	179.3	-65.1	102.7	0	0	0	112.5	K500 K514 D515 C516	K500-W512 WeakPolarHBondContact O-CH2 3.34Å; W512-K514 PolarHBondContact O-N 2.88Å; W512-D515 PolarHBondContact O-N 2.86Å; W512-C516 PolarHBondContact O-N 3.02Å
513	A	76.6	Confident	72	Confident	22 Å²	22	95.7 Å²	95.7	18%	0.182	50%	0.503	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	8.9	-177.4	0	0	0	0	0	115.7	A504 K519	A504-A513 HydrophobicContact CB-CB 3.79Å; A513-K519 VanDerWaalsContact O-CD 3.3Å; A513-K519 WeakPolarHBondContact O-CD 3.39Å; A513-K519 PolarHBondContact O-NZ 3.17Å
514	K	71.4	Confident	70.5	Confident	178 Å²	178	107.4 Å²	107.4	77%	0.774	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-29.2	167.5	-67.6	177.5	-178	171.7	0	111.8	W512	W512-K514 PolarHBondContact O-N 2.88Å
515	D	71.5	Confident	68.9	Low	106 Å²	106	107.1 Å²	107.1	57%	0.567	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	3.9	-168.2	-44.1	-67.8	0	0	0	111.8	W512	W512-D515 PolarHBondContact O-N 2.86Å
516	C	77.9	Confident	67.7	Low	8 Å²	8	107.6 Å²	107.6	5%	0.054	57%	0.569	C	S	.	*			trans	-57.7	118.4	177.2	-177.4	0	0	0	0	112.3	C503 H511 W512 K518 K519	C503-C516 VanDerWaalsContact SG-CB 3.6Å; C503-C516 VanDerWaalsContact SG-SG 3.67Å; H511-C516 VanDerWaalsContact CD2-CA 3.41Å; H511-C516 WeakPolarHBondContact CD2-CA 3.06Å; H511-C516 WeakPolarHBondContact NE2-CA 3.25Å; H511-C516 PolarHBondContact NE2-SG 3.08Å; H511-C516 VanDerWaalsContact NE2-SG 3.39Å; W512-C516 PolarHBondContact O-N 3.02Å; C516-K518 PolarHBondContact O-N 3.39Å; C516-K519 HydrophobicContact CB-CB 3.99Å; C516-K519 WeakPolarHBondContact O-CB 3.42Å; C516-K519 PolarHBondContact O-N 2.86Å; C516-K519 VanDerWaalsContact O-N 3.14Å
517	P	72.8	Confident	66.1	Low	114 Å²	114	117 Å²	117	74%	0.74	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-21.3	-177.8	27.1	-34.8	0	0	0	112.8	K519	P517-K519 VanDerWaalsContact C-N 3.3Å; P517-K519 PolarHBondContact O-N 3.33Å
518	K	72.3	Confident	64.2	Low	125 Å²	125	116.5 Å²	116.5	54%	0.543	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.4	-0.4	178.1	-64.5	176	178.8	171.1	0	113.6	Y505 C506 E508 C516	Y505-K518 WeakPolarHBondContact CE1-O 3.08Å; C506-K518 HydrophobicContact CB-CD 4.22Å; E508-K518 IonicContact OE1-NZ 2.61Å; E508-K518 PolarHBondContact OE1-NZ 2.82Å; E508-K518 IonicContact OE2-NZ 3Å; E508-K518 PolarHBondContact OE2-NZ 2.87Å; C516-K518 PolarHBondContact O-N 3.39Å
519	K	69.6	Low	62.4	Low	89 Å²	89	121.8 Å²	121.8	39%	0.387	64%	0.635	S	S	.	*	S	Bend	trans	-98.6	119.2	-172.8	-168.9	-179.5	-173.5	-172.9	0	111.8	Y505 A513 C516 P517 R521	Y505-K519 HydrophobicContact CD1-CB 3.84Å; Y505-K519 HydrophobicContact CD1-CG 4.08Å; Y505-K519 HydrophobicContact CD2-CD 4.29Å; Y505-K519 HydrophobicContact CD2-CG 4.12Å; Y505-K519 HydrophobicContact CE1-CB 3.94Å; Y505-K519 HydrophobicContact CE1-CG 4.11Å; Y505-K519 HydrophobicContact CE2-CG 4.15Å; Y505-K519 HydrophobicContact CG-CB 4.27Å; Y505-K519 HydrophobicContact CG-CD 4.22Å; Y505-K519 HydrophobicContact CG-CG 4.09Å; A513-K519 VanDerWaalsContact O-CD 3.3Å; A513-K519 WeakPolarHBondContact O-CD 3.39Å; A513-K519 PolarHBondContact O-NZ 3.17Å; C516-K519 HydrophobicContact CB-CB 3.99Å; C516-K519 WeakPolarHBondContact O-CB 3.42Å; C516-K519 PolarHBondContact O-N 2.86Å; C516-K519 VanDerWaalsContact O-N 3.14Å; P517-K519 VanDerWaalsContact C-N 3.3Å; P517-K519 PolarHBondContact O-N 3.33Å; K519-R521 PolarHBondContact O-N 2.89Å
520	P	62.9	Low	60.4	Low	98 Å²	98	122.6 Å²	122.6	64%	0.636	65%	0.65	S	S	*	*			trans	-66.2	130	-178.9	26.4	-33.7	0	0	0	111.5	Y505 G522	Y505-P520 WeakPolarHBondContact OH-CD 2.71Å; P520-G522 PolarHBondContact O-N 3.13Å; P520-G522 VanDerWaalsContact O-N 3.11Å
521	R	58	Low	58.5	Low	233 Å²	233	124.5 Å²	124.5	88%	0.879	65%	0.652	S	S	*	*			trans	-85.1	74.7	178.2	-70.8	-173.3	172.5	-166	-1.7	111.3	K519	K519-R521 PolarHBondContact O-N 2.89Å
522	G	51.5	Low	56.6	Low	55 Å²	55	130.1 Å²	130.1	57%	0.567	68%	0.682	S	S	*	*			trans	-65.3	162.6	168.3	0	0	0	0	0	113.1	P520	P520-G522 PolarHBondContact O-N 3.13Å; P520-G522 VanDerWaalsContact O-N 3.11Å
523	P	47.1	Very low	54.7	Low	137 Å²	137	130 Å²	130	89%	0.89	69%	0.694	S	S	*	*			trans	-65.8	144.5	-170.4	26.1	-34.7	0	0	0	113.5
524	R	46.8	Very low	52.9	Low	245 Å²	245	134 Å²	134	93%	0.925	72%	0.716	S	S	*	*			trans	-83.4	113.4	175.2	-67.4	178.5	177.6	174.8	-0.6	109.9
525	G	42.9	Very low	51.5	Low	62 Å²	62	134.1 Å²	134.1	64%	0.639	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-66.7	157.8	165.4	0	0	0	0	0	112.2
526	P	47.6	Very low	50.2	Low	132 Å²	132	135.1 Å²	135.1	86%	0.857	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-62.9	151.4	-179	-22.1	34.1	0	0	0	113.4
527	R	44.2	Very low	48.5	Very low	232 Å²	232	146.2 Å²	146.2	88%	0.875	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-84.1	137.7	166.9	-75.5	179.4	169	178.4	-5.6	109.7
528	P	40.9	Very low	47.3	Very low	124 Å²	124	147.9 Å²	147.9	81%	0.805	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-61.8	136.1	162.2	-17.2	30.8	0	0	0	110
529	Q	40.5	Very low	46	Very low	193 Å²	193	149.1 Å²	149.1	90%	0.902	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-83.8	134.4	165.6	-74.9	-179.2	-50.1	0	0	109.4	S531	Q529-S531 PolarHBondContact O-N 3.07Å
530	T	38.1	Very low	44.6	Very low	135 Å²	135	152.4 Å²	152.4	83%	0.828	83%	0.827	S	S	*	*			trans	-79.6	108.4	167.7	46.6	0	0	0	0	108.6	L532	T530-L532 PolarHBondContact O-N 2.9Å
531	S	38.5	Very low	43.6	Very low	113 Å²	113	155.6 Å²	155.6	79%	0.79	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-71.9	120.6	173.5	-160.6	0	0	0	0	109.8	Q529	Q529-S531 PolarHBondContact O-N 3.07Å
532	L	38.7	Very low	42.7	Very low	162 Å²	162	150.8 Å²	150.8	85%	0.848	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-87.7	121.7	162.7	-82.3	164.9	0	0	0	107	T530 T534	T530-L532 PolarHBondContact O-N 2.9Å; L532-T534 PolarHBondContact O-N 3.36Å
533	L	39	Very low	42.1	Very low	167 Å²	167	157.1 Å²	157.1	87%	0.874	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-74.3	118	169.2	-71	169.3	0	0	0	108.4
534	T	37.6	Very low	41.7	Very low	105 Å²	105	158.6 Å²	158.6	64%	0.644	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-70.2	151.2	160.9	45.5	0	0	0	0	109.9	L532 D536	L532-T534 PolarHBondContact O-N 3.36Å; T534-D536 WeakPolarHBondContact CB-OD2 3.32Å; T534-D536 PolarHBondContact OG1-OD2 3.31Å
535	L	42.5	Very low	41.3	Very low	181 Å²	181	151.9 Å²	151.9	95%	0.948	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-92.9	125.2	155.3	-74.5	161.6	0	0	0	105.5
536	D	44.1	Very low	41.2	Very low	127 Å²	127	159.4 Å²	159.4	68%	0.679	86%	0.862	S	S	*	*			trans	-120.2	135.8	174.2	-68.5	-71.3	0	0	0	108.2	T534	T534-D536 WeakPolarHBondContact CB-OD2 3.32Å; T534-D536 PolarHBondContact OG1-OD2 3.31Å
537	D	42.6	Very low	40.6	Very low	242 Å²	242	161.9 Å²	161.9	100%	1.294	86%	0.863	S	S	*	*			trans	37.9	0	171.4	-59.7	-39.7	0	0	0	119.6

Retrieved 537 of 537 residues in 886.1 ms (Link to these results)

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