A0AA82MCS6_SCHMA Loading...

Gap associated protein-related AlphaSync

AlphaFold DB , UniProt , Accession A0AA82MCS6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 283 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.1	Very low	60.6	Low	164 Å²	164	98.5 Å²	98.5	81%	0.808	53%	0.527	S	S	*	.				0	120.7	0	-64	-175.7	-169.4	0	0	106.8	R7 P8	M1-R7 HydrophobicContact SD-CG 4.35Å; M1-P8 HydrophobicContact CE-CG 4.34Å
2	K	43.1	Very low	62.8	Low	158 Å²	158	95.3 Å²	95.3	69%	0.687	52%	0.524	S	S	*	.			trans	-65.7	146	174.9	-71.2	171.3	-179.8	165.8	0	108.8	G4 E5	K2-G4 PolarHBondContact O-N 3.09Å; K2-E5 HydrophobicContact CB-CG 4.22Å; K2-E5 PolarHBondContact N-OE2 3.46Å; K2-E5 PolarHBondContact O-N 3.45Å
3	I	49.1	Very low	64.7	Low	139 Å²	139	93.2 Å²	93.2	71%	0.713	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	109.9	174.7	-66.2	163	0	0	0	107.5	L139	I3-L139 HydrophobicContact CG2-CD2 4.03Å
4	G	52.2	Low	66.3	Low	80 Å²	80	87.6 Å²	87.6	83%	0.825	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.3	-3.7	-177.5	0	0	0	0	0	116.5	K2	K2-G4 PolarHBondContact O-N 3.09Å
5	E	54.7	Low	67.9	Low	107 Å²	107	90.4 Å²	90.4	50%	0.5	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-74.6	132.9	165.8	-85.3	168.4	171.9	0	0	110.2	K2	K2-E5 HydrophobicContact CB-CG 4.22Å; K2-E5 PolarHBondContact N-OE2 3.46Å; K2-E5 PolarHBondContact O-N 3.45Å
6	L	58.9	Low	69.3	Low	62 Å²	62	87.5 Å²	87.5	33%	0.325	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-56.2	137.8	171.6	-66.4	170.7	0	0	0	109.1	L43	L6-L43 WeakPolarHBondContact CD2-O 3.23Å
7	R	66.1	Low	70.6	Confident	78 Å²	78	83.9 Å²	83.9	29%	0.294	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-56.9	141.3	168.7	-74.1	-172.5	-83.5	173.8	-4.2	107.7	M1 E9 Q10 S11 D49	M1-R7 HydrophobicContact SD-CG 4.35Å; R7-E9 PolarHBondContact O-N 2.82Å; R7-E9 VanDerWaalsContact O-N 3.14Å; R7-Q10 HydrophobicContact CB-CB 4.37Å; R7-Q10 HydrophobicContact CB-CG 3.95Å; R7-Q10 WeakPolarHBondContact O-CA 3.33Å; R7-Q10 WeakPolarHBondContact O-CB 3.45Å; R7-Q10 PolarHBondContact O-N 3.4Å; R7-S11 PolarHBondContact O-N 3.31Å; R7-D49 IonicContact CZ-OD1 2.86Å; R7-D49 IonicContact NH2-OD1 2.98Å; R7-D49 PolarHBondContact NH2-OD1 3.4Å
8	P	66.8	Low	71.6	Confident	88 Å²	88	81.5 Å²	81.5	57%	0.571	45%	0.453	S	S	*	.	H	α-helix	trans	-55.8	-36.4	-176.9	21.2	-32.5	0	0	0	112	M1 Q10 S11 A12	M1-P8 HydrophobicContact CE-CG 4.34Å; P8-Q10 VanDerWaalsContact C-N 3.35Å; P8-Q10 PolarHBondContact O-N 2.69Å; P8-S11 WeakPolarHBondContact O-CB 3.43Å; P8-S11 PolarHBondContact O-N 3.23Å; P8-A12 PolarHBondContact O-N 3.49Å
9	E	70.7	Confident	72.6	Confident	148 Å²	148	86.6 Å²	86.6	69%	0.692	46%	0.464	S	S	*	.	H	α-helix	trans	-58.9	-43.4	172.7	-62.6	178.4	174.9	0	0	112.2	R7 S11 A12 T13	R7-E9 PolarHBondContact O-N 2.82Å; R7-E9 VanDerWaalsContact O-N 3.14Å; E9-S11 VanDerWaalsContact C-N 3.32Å; E9-S11 PolarHBondContact O-N 3.37Å; E9-A12 PolarHBondContact O-N 3.49Å; E9-T13 PolarHBondContact O-N 2.77Å; E9-T13 PolarHBondContact O-OG1 2.87Å; E9-T13 VanDerWaalsContact O-OG1 3.08Å
10	Q	77.9	Confident	73.5	Confident	17 Å²	17	88.3 Å²	88.3	8%	0.079	47%	0.469	C	S	.	.	H	α-helix	trans	-66.8	-34	177.8	-64.1	175.9	-28.7	0	0	111.8	R7 P8 T13 V14 L43	R7-Q10 HydrophobicContact CB-CB 4.37Å; R7-Q10 HydrophobicContact CB-CG 3.95Å; R7-Q10 WeakPolarHBondContact O-CA 3.33Å; R7-Q10 WeakPolarHBondContact O-CB 3.45Å; R7-Q10 PolarHBondContact O-N 3.4Å; P8-Q10 VanDerWaalsContact C-N 3.35Å; P8-Q10 PolarHBondContact O-N 2.69Å; Q10-T13 PolarHBondContact O-N 2.73Å; Q10-V14 WeakPolarHBondContact O-CB 3.38Å; Q10-V14 WeakPolarHBondContact O-CG2 3.48Å; Q10-V14 PolarHBondContact O-N 2.74Å; Q10-L43 HydrophobicContact CB-CD2 4.2Å; Q10-L43 HydrophobicContact CG-CD2 3.97Å
11	S	81.2	Confident	74.1	Confident	43 Å²	43	85.2 Å²	85.2	30%	0.301	45%	0.453	S	S	.	.	H	α-helix	trans	-63.8	-45.6	177.9	-163	0	0	0	0	111.7	R7 P8 E9 T13 V14 E15	R7-S11 PolarHBondContact O-N 3.31Å; P8-S11 WeakPolarHBondContact O-CB 3.43Å; P8-S11 PolarHBondContact O-N 3.23Å; E9-S11 VanDerWaalsContact C-N 3.32Å; E9-S11 PolarHBondContact O-N 3.37Å; S11-T13 PolarHBondContact O-N 3.12Å; S11-V14 PolarHBondContact O-N 2.7Å; S11-E15 WeakPolarHBondContact O-CG 3.48Å; S11-E15 PolarHBondContact O-N 3.1Å
12	A	86.5	Confident	76.1	Confident	60 Å²	60	84.7 Å²	84.7	50%	0.496	45%	0.448	S	S	.	.	H	α-helix	trans	-62.9	-42.8	177.7	0	0	0	0	0	111.7	P8 E9 E15 A16	P8-A12 PolarHBondContact O-N 3.49Å; E9-A12 PolarHBondContact O-N 3.49Å; A12-E15 PolarHBondContact O-N 3.23Å; A12-A16 WeakPolarHBondContact O-CB 3.29Å; A12-A16 PolarHBondContact O-N 3.13Å
13	T	87.6	Confident	78.2	Confident	67 Å²	67	83.4 Å²	83.4	41%	0.411	45%	0.449	S	S	.	.	H	α-helix	trans	-63.7	-41.1	175	-51.3	0	0	0	0	111.9	E9 Q10 S11 A16 L17 L43	E9-T13 PolarHBondContact O-N 2.77Å; E9-T13 PolarHBondContact O-OG1 2.87Å; E9-T13 VanDerWaalsContact O-OG1 3.08Å; Q10-T13 PolarHBondContact O-N 2.73Å; S11-T13 PolarHBondContact O-N 3.12Å; T13-A16 PolarHBondContact O-N 3.47Å; T13-L17 HydrophobicContact CG2-CD1 4.05Å; T13-L17 HydrophobicContact CG2-CG 4.37Å; T13-L17 WeakPolarHBondContact O-CB 3.32Å; T13-L17 VanDerWaalsContact O-CG 3.31Å; T13-L17 WeakPolarHBondContact O-CG 3.5Å; T13-L17 PolarHBondContact O-N 3.27Å; T13-L43 HydrophobicContact CG2-CD1 3.73Å
14	V	87.9	Confident	80	Confident	15 Å²	15	79.1 Å²	79.1	9%	0.091	43%	0.427	C	S	.	.	H	α-helix	trans	-60.4	-46.4	176.4	163.4	0	0	0	0	111	Q10 S11 L17 V18 L40 L43 R44	Q10-V14 WeakPolarHBondContact O-CB 3.38Å; Q10-V14 WeakPolarHBondContact O-CG2 3.48Å; Q10-V14 PolarHBondContact O-N 2.74Å; S11-V14 PolarHBondContact O-N 2.7Å; V14-L17 PolarHBondContact O-N 3.2Å; V14-V18 VanDerWaalsContact O-CG2 3.23Å; V14-V18 WeakPolarHBondContact O-CG2 3.42Å; V14-V18 PolarHBondContact O-N 3.1Å; V14-L40 HydrophobicContact CB-CD1 4.35Å; V14-L40 HydrophobicContact CG1-CD1 3.79Å; V14-L40 HydrophobicContact CG2-CD1 4.34Å; V14-L43 HydrophobicContact CG2-CB 3.41Å; V14-L43 VanDerWaalsContact CG2-CB 3.41Å; V14-L43 HydrophobicContact CG2-CD1 3.86Å; V14-L43 HydrophobicContact CG2-CG 4.27Å; V14-R44 HydrophobicContact CG1-CG 4.41Å
15	E	90	Very high	81.5	Confident	130 Å²	130	79.5 Å²	79.5	61%	0.607	41%	0.41	S	S	*	.	H	α-helix	trans	-63.5	-43.1	178.2	-73.2	174.5	-163.3	0	0	112	S11 A12 V18 R19	S11-E15 WeakPolarHBondContact O-CG 3.48Å; S11-E15 PolarHBondContact O-N 3.1Å; A12-E15 PolarHBondContact O-N 3.23Å; E15-V18 PolarHBondContact O-N 3.39Å; E15-R19 PolarHBondContact O-N 3.49Å
16	A	90.8	Very high	82.8	Confident	44 Å²	44	77 Å²	77	36%	0.364	40%	0.404	S	S	.	.	H	α-helix	trans	-60.1	-49.3	175.4	0	0	0	0	0	111.7	A12 T13 V18 R19 E20	A12-A16 WeakPolarHBondContact O-CB 3.29Å; A12-A16 PolarHBondContact O-N 3.13Å; T13-A16 PolarHBondContact O-N 3.47Å; A16-V18 VanDerWaalsContact C-N 3.35Å; A16-V18 PolarHBondContact O-N 3.04Å; A16-R19 WeakPolarHBondContact O-CB 3.35Å; A16-R19 PolarHBondContact O-N 2.99Å; A16-R19 VanDerWaalsContact O-N 3.15Å; A16-E20 WeakPolarHBondContact O-CG 3.24Å; A16-E20 PolarHBondContact O-N 3.14Å
17	L	90.4	Very high	84.2	Confident	26 Å²	26	80.7 Å²	80.7	14%	0.136	43%	0.425	C	S	.	.	H	α-helix	trans	-63	-38.4	179	-73.4	173.3	0	0	0	112.7	T13 V14 R19 E20 L21 E39 L43	T13-L17 HydrophobicContact CG2-CD1 4.05Å; T13-L17 HydrophobicContact CG2-CG 4.37Å; T13-L17 WeakPolarHBondContact O-CB 3.32Å; T13-L17 VanDerWaalsContact O-CG 3.31Å; T13-L17 WeakPolarHBondContact O-CG 3.5Å; T13-L17 PolarHBondContact O-N 3.27Å; V14-L17 PolarHBondContact O-N 3.2Å; L17-R19 VanDerWaalsContact C-N 3.33Å; L17-E20 PolarHBondContact O-N 3.22Å; L17-L21 WeakPolarHBondContact O-CB 3.32Å; L17-L21 WeakPolarHBondContact O-CG 3.43Å; L17-L21 PolarHBondContact O-N 3.27Å; L17-E39 HydrophobicContact CD1-CB 4.11Å; L17-E39 HydrophobicContact CD1-CG 3.56Å; L17-L43 HydrophobicContact CD1-CD1 3.77Å
18	V	89.5	Confident	85.2	Confident	41 Å²	41	79.5 Å²	79.5	25%	0.248	43%	0.432	C	S	.	.	H	α-helix	trans	-63.3	-42.1	175.2	169.9	0	0	0	0	110.8	V14 E15 A16 Q22 L40	V14-V18 VanDerWaalsContact O-CG2 3.23Å; V14-V18 WeakPolarHBondContact O-CG2 3.42Å; V14-V18 PolarHBondContact O-N 3.1Å; E15-V18 PolarHBondContact O-N 3.39Å; A16-V18 VanDerWaalsContact C-N 3.35Å; A16-V18 PolarHBondContact O-N 3.04Å; V18-Q22 WeakPolarHBondContact O-CG 3.39Å; V18-Q22 PolarHBondContact O-N 3.44Å; V18-L40 HydrophobicContact CG2-CD1 3.69Å; V18-L40 HydrophobicContact CG2-CD2 4Å
19	R	90.5	Very high	86.3	Confident	178 Å²	178	80.8 Å²	80.8	67%	0.672	43%	0.429	S	S	*	.	H	α-helix	trans	-65.9	-41.1	177.2	-176.4	-178.9	177.3	-177.7	-1	111.8	E15 A16 L17 Q22 N23	E15-R19 PolarHBondContact O-N 3.49Å; A16-R19 WeakPolarHBondContact O-CB 3.35Å; A16-R19 PolarHBondContact O-N 2.99Å; A16-R19 VanDerWaalsContact O-N 3.15Å; L17-R19 VanDerWaalsContact C-N 3.33Å; R19-Q22 PolarHBondContact O-N 2.86Å; R19-N23 PolarHBondContact O-N 2.77Å; R19-N23 PolarHBondContact O-ND2 2.95Å
20	E	89.5	Confident	87.1	Confident	121 Å²	121	77.8 Å²	77.8	57%	0.565	42%	0.422	S	S	*	.	H	α-helix	trans	-65.5	-45.4	177	-73.4	177.1	-164.8	0	0	111.3	A16 L17 Q22 N23 L24	A16-E20 WeakPolarHBondContact O-CG 3.24Å; A16-E20 PolarHBondContact O-N 3.14Å; L17-E20 PolarHBondContact O-N 3.22Å; E20-Q22 PolarHBondContact O-N 3.13Å; E20-N23 PolarHBondContact O-N 3.37Å; E20-L24 VanDerWaalsContact O-CB 3.32Å; E20-L24 WeakPolarHBondContact O-CB 3.48Å; E20-L24 PolarHBondContact O-N 2.9Å
21	L	87.1	Confident	87.6	Confident	24 Å²	24	80.7 Å²	80.7	13%	0.126	45%	0.449	C	S	.	.	H	α-helix	trans	-59.4	-29.4	176.4	-83	170	0	0	0	113.7	L17 Y33 A36 E37 L40	L17-L21 WeakPolarHBondContact O-CB 3.32Å; L17-L21 WeakPolarHBondContact O-CG 3.43Å; L17-L21 PolarHBondContact O-N 3.27Å; L21-Y33 HydrophobicContact CD2-CD2 3.55Å; L21-Y33 HydrophobicContact CD2-CE2 3.64Å; L21-Y33 HydrophobicContact CD2-CG 4.08Å; L21-A36 HydrophobicContact CD1-CB 4.09Å; L21-A36 HydrophobicContact CD2-CB 3.7Å; L21-A36 HydrophobicContact CG-CB 3.85Å; L21-E37 HydrophobicContact CD2-CG 4.5Å; L21-L40 HydrophobicContact CD1-CD2 4.08Å
22	Q	87.3	Confident	88	Confident	152 Å²	152	83.1 Å²	83.1	71%	0.71	46%	0.458	S	S	*	.	H	α-helix	trans	-72.5	-28.5	175.1	-74.9	174.4	-5.5	0	0	113.2	V18 R19 E20	V18-Q22 WeakPolarHBondContact O-CG 3.39Å; V18-Q22 PolarHBondContact O-N 3.44Å; R19-Q22 PolarHBondContact O-N 2.86Å; E20-Q22 PolarHBondContact O-N 3.13Å
23	N	88.2	Confident	88	Confident	131 Å²	131	83.5 Å²	83.5	70%	0.701	45%	0.447	S	S	*	.	H	α-helix	trans	-95.5	-15.5	-178.9	-65.1	-54	0	0	0	112.8	R19 E20	R19-N23 PolarHBondContact O-N 2.77Å; R19-N23 PolarHBondContact O-ND2 2.95Å; E20-N23 PolarHBondContact O-N 3.37Å
24	L	86.3	Confident	87.9	Confident	49 Å²	49	83 Å²	83	26%	0.257	45%	0.446	S	S	.	.	S	Bend	trans	-85	122.8	-176	-164.2	141.7	0	0	0	110.2	E20 S26 F29 L32 Y33	E20-L24 VanDerWaalsContact O-CB 3.32Å; E20-L24 WeakPolarHBondContact O-CB 3.48Å; E20-L24 PolarHBondContact O-N 2.9Å; L24-S26 PolarHBondContact O-N 3.18Å; L24-F29 HydrophobicContact CD2-CB 4.12Å; L24-L32 HydrophobicContact CD1-CB 4.28Å; L24-Y33 HydrophobicContact CD2-CD2 3.98Å; L24-Y33 HydrophobicContact CD2-CG 4.48Å
25	D	83.6	Confident	87.9	Confident	88 Å²	88	87.7 Å²	87.7	47%	0.471	47%	0.47	S	S	.	.			trans	-71.3	115	174.1	179.9	11.4	0	0	0	110	N27 A28 F29	D25-N27 PolarHBondContact O-N 3.08Å; D25-N27 PolarHBondContact OD1-N 3.06Å; D25-A28 HydrophobicContact CB-CB 3.95Å; D25-A28 PolarHBondContact O-N 3.33Å; D25-F29 PolarHBondContact O-N 3.37Å
26	S	82.8	Confident	87.8	Confident	54 Å²	54	82.2 Å²	82.2	38%	0.378	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-27.1	178	179.6	0	0	0	0	112.8	L24	L24-S26 PolarHBondContact O-N 3.18Å
27	N	86.8	Confident	87.6	Confident	141 Å²	141	83 Å²	83	75%	0.754	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-34.2	-179.3	-62.2	-49.6	0	0	0	112.1	D25	D25-N27 PolarHBondContact O-N 3.08Å; D25-N27 PolarHBondContact OD1-N 3.06Å
28	A	89	Confident	87.4	Confident	53 Å²	53	85 Å²	85	44%	0.438	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-39.5	179.5	0	0	0	0	0	112.1	D25	D25-A28 HydrophobicContact CB-CB 3.95Å; D25-A28 PolarHBondContact O-N 3.33Å
29	F	88.4	Confident	87.3	Confident	115 Å²	115	84.8 Å²	84.8	50%	0.504	45%	0.45	S	S	.	.			trans	-134	68	-175.2	-54.4	-76.5	0	0	0	112.6	L24 D25 A31 L32 Y33	L24-F29 HydrophobicContact CD2-CB 4.12Å; D25-F29 PolarHBondContact O-N 3.37Å; F29-A31 VanDerWaalsContact C-N 3.27Å; F29-A31 PolarHBondContact O-N 3.49Å; F29-L32 HydrophobicContact CB-CB 3.97Å; F29-L32 HydrophobicContact CB-CD1 3.94Å; F29-L32 HydrophobicContact CB-CG 4.21Å; F29-L32 HydrophobicContact CD1-CD1 4.07Å; F29-L32 HydrophobicContact CG-CD1 4.05Å; F29-L32 PolarHBondContact O-N 3.1Å; F29-Y33 WeakPolarHBondContact O-CB 3.48Å; F29-Y33 PolarHBondContact O-N 3.25Å
30	P	88	Confident	87	Confident	84 Å²	84	77.1 Å²	77.1	55%	0.545	42%	0.422	S	S	.	.	H	α-helix	trans	-61.2	-35.5	-177	24.3	-34.4	0	0	0	112.8	S34	P30-S34 WeakPolarHBondContact O-CB 3.05Å; P30-S34 PolarHBondContact O-N 2.91Å
31	A	87.5	Confident	86.8	Confident	78 Å²	78	75 Å²	75	65%	0.645	41%	0.411	S	S	*	.	H	α-helix	trans	-67.5	-45.1	178.6	0	0	0	0	0	112.4	F29 S34 L35	F29-A31 VanDerWaalsContact C-N 3.27Å; F29-A31 PolarHBondContact O-N 3.49Å; A31-S34 PolarHBondContact O-N 3.47Å; A31-L35 WeakPolarHBondContact O-CB 3.4Å; A31-L35 PolarHBondContact O-N 2.82Å
32	L	89.6	Confident	86.7	Confident	94 Å²	94	78.6 Å²	78.6	49%	0.492	42%	0.423	S	S	.	.	H	α-helix	trans	-65.5	-41.5	177.1	-68.5	178.4	0	0	0	111.2	L24 F29 S34 L35 A36	L24-L32 HydrophobicContact CD1-CB 4.28Å; F29-L32 HydrophobicContact CB-CB 3.97Å; F29-L32 HydrophobicContact CB-CD1 3.94Å; F29-L32 HydrophobicContact CB-CG 4.21Å; F29-L32 HydrophobicContact CD1-CD1 4.07Å; F29-L32 HydrophobicContact CG-CD1 4.05Å; F29-L32 PolarHBondContact O-N 3.1Å; L32-S34 PolarHBondContact O-N 3.01Å; L32-L35 PolarHBondContact O-N 3.22Å; L32-A36 WeakPolarHBondContact O-CB 3.35Å; L32-A36 PolarHBondContact O-N 3.45Å
33	Y	86.8	Confident	86.7	Confident	68 Å²	68	72 Å²	72	27%	0.267	39%	0.393	S	S	.	.	H	α-helix	trans	-58.2	-49.3	176	-168.6	-89	0	0	0	111.3	L21 L24 F29 L35 A36 E37	L21-Y33 HydrophobicContact CD2-CD2 3.55Å; L21-Y33 HydrophobicContact CD2-CE2 3.64Å; L21-Y33 HydrophobicContact CD2-CG 4.08Å; L24-Y33 HydrophobicContact CD2-CD2 3.98Å; L24-Y33 HydrophobicContact CD2-CG 4.48Å; F29-Y33 WeakPolarHBondContact O-CB 3.48Å; F29-Y33 PolarHBondContact O-N 3.25Å; Y33-L35 PolarHBondContact O-N 3.06Å; Y33-A36 PolarHBondContact O-N 2.95Å; Y33-E37 HydrophobicContact CD1-CG 4.09Å; Y33-E37 HydrophobicContact CE1-CG 3.81Å; Y33-E37 VanDerWaalsContact CE1-OE1 3.27Å; Y33-E37 WeakPolarHBondContact CE1-OE1 3.23Å; Y33-E37 WeakPolarHBondContact O-CG 3.28Å; Y33-E37 PolarHBondContact O-N 3.4Å
34	S	85.7	Confident	86.5	Confident	57 Å²	57	72.5 Å²	72.5	40%	0.399	39%	0.385	S	S	.	.	H	α-helix	trans	-61.1	-41.6	176.8	-179.8	0	0	0	0	112.7	P30 A31 L32 E37 N38	P30-S34 WeakPolarHBondContact O-CB 3.05Å; P30-S34 PolarHBondContact O-N 2.91Å; A31-S34 PolarHBondContact O-N 3.47Å; L32-S34 PolarHBondContact O-N 3.01Å; S34-E37 PolarHBondContact O-N 3.47Å; S34-N38 WeakPolarHBondContact O-CB 3.48Å; S34-N38 VanDerWaalsContact O-CG 3.26Å; S34-N38 PolarHBondContact O-N 3.47Å; S34-N38 PolarHBondContact O-ND2 3.24Å
35	L	88.2	Confident	86.4	Confident	114 Å²	114	71.1 Å²	71.1	60%	0.597	38%	0.382	S	S	*	.	H	α-helix	trans	-62.6	-47.3	177.5	-171.8	153.5	0	0	0	111.1	A31 L32 Y33 N38 E39	A31-L35 WeakPolarHBondContact O-CB 3.4Å; A31-L35 PolarHBondContact O-N 2.82Å; L32-L35 PolarHBondContact O-N 3.22Å; Y33-L35 PolarHBondContact O-N 3.06Å; L35-N38 PolarHBondContact O-N 3.47Å; L35-E39 WeakPolarHBondContact O-CB 3.48Å; L35-E39 PolarHBondContact O-N 3.07Å
36	A	88.6	Confident	86.5	Confident	14 Å²	14	68.4 Å²	68.4	12%	0.116	38%	0.375	C	S	.	.	H	α-helix	trans	-65.4	-38.9	178.5	0	0	0	0	0	112.5	L21 L32 Y33 E39 L40	L21-A36 HydrophobicContact CD1-CB 4.09Å; L21-A36 HydrophobicContact CD2-CB 3.7Å; L21-A36 HydrophobicContact CG-CB 3.85Å; L32-A36 WeakPolarHBondContact O-CB 3.35Å; L32-A36 PolarHBondContact O-N 3.45Å; Y33-A36 PolarHBondContact O-N 2.95Å; A36-E39 PolarHBondContact O-N 2.94Å; A36-L40 VanDerWaalsContact O-CB 3.26Å; A36-L40 WeakPolarHBondContact O-CB 3.28Å; A36-L40 PolarHBondContact O-N 3.25Å
37	E	85.1	Confident	86.7	Confident	61 Å²	61	66.7 Å²	66.7	29%	0.285	36%	0.362	S	S	.	.	H	α-helix	trans	-62	-43.7	173	-77.2	-166.6	139.4	0	0	112.2	L21 Y33 S34 E39 L40 F41	L21-E37 HydrophobicContact CD2-CG 4.5Å; Y33-E37 HydrophobicContact CD1-CG 4.09Å; Y33-E37 HydrophobicContact CE1-CG 3.81Å; Y33-E37 VanDerWaalsContact CE1-OE1 3.27Å; Y33-E37 WeakPolarHBondContact CE1-OE1 3.23Å; Y33-E37 WeakPolarHBondContact O-CG 3.28Å; Y33-E37 PolarHBondContact O-N 3.4Å; S34-E37 PolarHBondContact O-N 3.47Å; E37-E39 VanDerWaalsContact C-N 3.33Å; E37-E39 PolarHBondContact O-N 3.25Å; E37-L40 PolarHBondContact O-N 3.39Å; E37-F41 WeakPolarHBondContact O-CB 3.49Å; E37-F41 PolarHBondContact O-N 3.39Å
38	N	86.1	Confident	86.6	Confident	67 Å²	67	60.9 Å²	60.9	36%	0.358	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-40.3	177.5	-75.2	-42.9	0	0	0	111.7	S34 L35 F41 R42	S34-N38 WeakPolarHBondContact O-CB 3.48Å; S34-N38 VanDerWaalsContact O-CG 3.26Å; S34-N38 PolarHBondContact O-N 3.47Å; S34-N38 PolarHBondContact O-ND2 3.24Å; L35-N38 PolarHBondContact O-N 3.47Å; N38-F41 PolarHBondContact O-N 3Å; N38-R42 PolarHBondContact O-N 3.36Å
39	E	87.5	Confident	86.3	Confident	38 Å²	38	63.3 Å²	63.3	18%	0.178	34%	0.338	C	S	.	.	H	α-helix	trans	-65.2	-45	176.3	-173.6	55.9	-151.1	0	0	111.4	L17 L35 A36 E37 F41 R42 L43	L17-E39 HydrophobicContact CD1-CB 4.11Å; L17-E39 HydrophobicContact CD1-CG 3.56Å; L35-E39 WeakPolarHBondContact O-CB 3.48Å; L35-E39 PolarHBondContact O-N 3.07Å; A36-E39 PolarHBondContact O-N 2.94Å; E37-E39 VanDerWaalsContact C-N 3.33Å; E37-E39 PolarHBondContact O-N 3.25Å; E39-F41 VanDerWaalsContact C-N 3.27Å; E39-F41 PolarHBondContact O-N 3.46Å; E39-R42 VanDerWaalsContact CD-CZ 3.45Å; E39-R42 WeakPolarHBondContact O-CA 3.29Å; E39-R42 WeakPolarHBondContact O-CB 3.41Å; E39-R42 PolarHBondContact O-N 3.09Å; E39-R42 IonicContact OE1-CZ 3.46Å; E39-R42 VanDerWaalsContact OE1-CZ 3.22Å; E39-R42 IonicContact OE1-NE 3.64Å; E39-R42 PolarHBondContact OE1-NE 2.92Å; E39-R42 VanDerWaalsContact OE1-NE 3.08Å; E39-R42 IonicContact OE1-NH2 3.94Å; E39-R42 PolarHBondContact OE1-NH2 3.46Å; E39-R42 IonicContact OE2-CZ 2.84Å; E39-R42 IonicContact OE2-NE 3.58Å; E39-R42 PolarHBondContact OE2-NE 3.41Å; E39-R42 IonicContact OE2-NH1 3.59Å; E39-R42 IonicContact OE2-NH2 2.85Å; E39-R42 PolarHBondContact OE2-NH2 3.05Å; E39-L43 HydrophobicContact CG-CD1 4.02Å; E39-L43 HydrophobicContact CG-CG 4.37Å; E39-L43 WeakPolarHBondContact O-CG 3.37Å; E39-L43 PolarHBondContact O-N 2.97Å; E39-L43 WeakPolarHBondContact OE1-CG 3.3Å
40	L	85.7	Confident	86.2	Confident	16 Å²	16	60.6 Å²	60.6	8%	0.084	33%	0.334	C	S	.	.	H	α-helix	trans	-59.8	-40.3	176	-170.8	65.9	0	0	0	111.4	V14 V18 L21 A36 E37 R42 R44	V14-L40 HydrophobicContact CB-CD1 4.35Å; V14-L40 HydrophobicContact CG1-CD1 3.79Å; V14-L40 HydrophobicContact CG2-CD1 4.34Å; V18-L40 HydrophobicContact CG2-CD1 3.69Å; V18-L40 HydrophobicContact CG2-CD2 4Å; L21-L40 HydrophobicContact CD1-CD2 4.08Å; A36-L40 VanDerWaalsContact O-CB 3.26Å; A36-L40 WeakPolarHBondContact O-CB 3.28Å; A36-L40 PolarHBondContact O-N 3.25Å; E37-L40 PolarHBondContact O-N 3.39Å; L40-R42 VanDerWaalsContact C-N 3.34Å; L40-R44 HydrophobicContact CD1-CG 4.29Å; L40-R44 HydrophobicContact CG-CG 4.37Å; L40-R44 WeakPolarHBondContact O-CB 3.49Å; L40-R44 WeakPolarHBondContact O-CG 3.25Å; L40-R44 PolarHBondContact O-N 3.43Å
41	F	83.8	Confident	86.2	Confident	77 Å²	77	61.1 Å²	61.1	34%	0.338	33%	0.328	S	S	.	.	H	α-helix	trans	-65.2	-37.4	174.7	-176	-103.4	0	0	0	112.4	E37 N38 E39 G45	E37-F41 WeakPolarHBondContact O-CB 3.49Å; E37-F41 PolarHBondContact O-N 3.39Å; N38-F41 PolarHBondContact O-N 3Å; E39-F41 VanDerWaalsContact C-N 3.27Å; E39-F41 PolarHBondContact O-N 3.46Å; F41-G45 PolarHBondContact O-N 3.44Å
42	R	86.4	Confident	86.2	Confident	100 Å²	100	61.1 Å²	61.1	38%	0.377	32%	0.317	S	S	.	.	H	α-helix	trans	-65.4	-52	175.9	-178	175.4	76.4	174.6	9.5	111.4	N38 E39 L40 G45 G46 I47	N38-R42 PolarHBondContact O-N 3.36Å; E39-R42 VanDerWaalsContact CD-CZ 3.45Å; E39-R42 WeakPolarHBondContact O-CA 3.29Å; E39-R42 WeakPolarHBondContact O-CB 3.41Å; E39-R42 PolarHBondContact O-N 3.09Å; E39-R42 IonicContact OE1-CZ 3.46Å; E39-R42 VanDerWaalsContact OE1-CZ 3.22Å; E39-R42 IonicContact OE1-NE 3.64Å; E39-R42 PolarHBondContact OE1-NE 2.92Å; E39-R42 VanDerWaalsContact OE1-NE 3.08Å; E39-R42 IonicContact OE1-NH2 3.94Å; E39-R42 PolarHBondContact OE1-NH2 3.46Å; E39-R42 IonicContact OE2-CZ 2.84Å; E39-R42 IonicContact OE2-NE 3.58Å; E39-R42 PolarHBondContact OE2-NE 3.41Å; E39-R42 IonicContact OE2-NH1 3.59Å; E39-R42 IonicContact OE2-NH2 2.85Å; E39-R42 PolarHBondContact OE2-NH2 3.05Å; L40-R42 VanDerWaalsContact C-N 3.34Å; R42-G45 PolarHBondContact O-N 3.42Å; R42-G46 PolarHBondContact O-N 2.88Å; R42-I47 HydrophobicContact CB-CD1 4.34Å; R42-I47 HydrophobicContact CG-CB 3.87Å; R42-I47 HydrophobicContact CG-CD1 4.06Å; R42-I47 HydrophobicContact CG-CG1 4.45Å; R42-I47 HydrophobicContact CG-CG2 4.34Å; R42-I47 PolarHBondContact O-N 3.03Å
43	L	86.3	Confident	86	Confident	12 Å²	12	62.6 Å²	62.6	6%	0.063	33%	0.325	C	S	.	.	H	α-helix	trans	-64.9	-52	-178.6	-65.9	173.7	0	0	0	111.2	L6 Q10 T13 V14 L17 E39 G45 G46	L6-L43 WeakPolarHBondContact CD2-O 3.23Å; Q10-L43 HydrophobicContact CB-CD2 4.2Å; Q10-L43 HydrophobicContact CG-CD2 3.97Å; T13-L43 HydrophobicContact CG2-CD1 3.73Å; V14-L43 HydrophobicContact CG2-CB 3.41Å; V14-L43 VanDerWaalsContact CG2-CB 3.41Å; V14-L43 HydrophobicContact CG2-CD1 3.86Å; V14-L43 HydrophobicContact CG2-CG 4.27Å; L17-L43 HydrophobicContact CD1-CD1 3.77Å; E39-L43 HydrophobicContact CG-CD1 4.02Å; E39-L43 HydrophobicContact CG-CG 4.37Å; E39-L43 WeakPolarHBondContact O-CG 3.37Å; E39-L43 PolarHBondContact O-N 2.97Å; E39-L43 WeakPolarHBondContact OE1-CG 3.3Å; L43-G45 PolarHBondContact O-N 3.07Å; L43-G45 VanDerWaalsContact O-N 3.16Å; L43-G46 PolarHBondContact O-N 3.01Å
44	R	85	Confident	86.2	Confident	143 Å²	143	66 Å²	66	54%	0.54	35%	0.352	S	S	.	.	H	α-helix	trans	-58.6	-30.1	175.2	-70.9	177.6	175.7	180	-1.5	112.5	V14 L40 G46	V14-R44 HydrophobicContact CG1-CG 4.41Å; L40-R44 HydrophobicContact CD1-CG 4.29Å; L40-R44 HydrophobicContact CG-CG 4.37Å; L40-R44 WeakPolarHBondContact O-CB 3.49Å; L40-R44 WeakPolarHBondContact O-CG 3.25Å; L40-R44 PolarHBondContact O-N 3.43Å; R44-G46 PolarHBondContact O-N 2.97Å
45	G	82.8	Confident	86.1	Confident	19 Å²	19	65.5 Å²	65.5	20%	0.196	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-10.5	176.2	0	0	0	0	0	114.6	F41 R42 L43 I47 K60	F41-G45 PolarHBondContact O-N 3.44Å; R42-G45 PolarHBondContact O-N 3.42Å; L43-G45 PolarHBondContact O-N 3.07Å; L43-G45 VanDerWaalsContact O-N 3.16Å; G45-I47 VanDerWaalsContact C-N 3.27Å; G45-I47 PolarHBondContact O-N 3.17Å; G45-K60 WeakPolarHBondContact O-CD 3.23Å; G45-K60 PolarHBondContact O-NZ 2.91Å
46	G	85.5	Confident	85.9	Confident	31 Å²	31	64.3 Å²	64.3	32%	0.32	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	26	-175.7	0	0	0	0	0	113.2	R42 L43 R44 K60	R42-G46 PolarHBondContact O-N 2.88Å; L43-G46 PolarHBondContact O-N 3.01Å; R44-G46 PolarHBondContact O-N 2.97Å; G46-K60 WeakPolarHBondContact O-CB 3.49Å
47	I	87.9	Confident	85.8	Confident	19 Å²	19	69.5 Å²	69.5	10%	0.097	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-76.2	132.8	-176.6	-52.3	173.4	0	0	0	108.9	R42 G45 K60 R62	R42-I47 HydrophobicContact CB-CD1 4.34Å; R42-I47 HydrophobicContact CG-CB 3.87Å; R42-I47 HydrophobicContact CG-CD1 4.06Å; R42-I47 HydrophobicContact CG-CG1 4.45Å; R42-I47 HydrophobicContact CG-CG2 4.34Å; R42-I47 PolarHBondContact O-N 3.03Å; G45-I47 VanDerWaalsContact C-N 3.27Å; G45-I47 PolarHBondContact O-N 3.17Å; I47-K60 WeakPolarHBondContact CA-O 3.31Å; I47-R62 HydrophobicContact CD1-CB 3.79Å; I47-R62 VanDerWaalsContact CD1-CD 3.48Å; I47-R62 HydrophobicContact CD1-CG 4.2Å; I47-R62 HydrophobicContact CG1-CB 4.21Å; I47-R62 HydrophobicContact CG2-CB 4.12Å
48	A	84	Confident	86.1	Confident	18 Å²	18	70.1 Å²	70.1	15%	0.149	37%	0.372	C	S	.	.			trans	-74.8	132.3	177.3	0	0	0	0	0	111.2	F51 V59 K60	A48-F51 HydrophobicContact CB-CE1 4.36Å; A48-V59 HydrophobicContact CB-CB 3.87Å; A48-V59 HydrophobicContact CB-CG1 4.08Å; A48-K60 PolarHBondContact N-O 3.46Å
49	D	84.2	Confident	86.3	Confident	104 Å²	104	68 Å²	68	56%	0.556	36%	0.361	S	S	*	.	S	Bend	trans	-91	-30.7	169.4	60	-22.6	0	0	0	112	R7	R7-D49 IonicContact CZ-OD1 2.86Å; R7-D49 IonicContact NH2-OD1 2.98Å; R7-D49 PolarHBondContact NH2-OD1 3.4Å
50	S	85.3	Confident	86.6	Confident	59 Å²	59	68.7 Å²	68.7	41%	0.413	36%	0.364	S	S	.	.	S	Bend	trans	-136.5	150.1	-174.1	52.3	0	0	0	0	110.7
51	F	87.9	Confident	86.9	Confident	94 Å²	94	68.8 Å²	68.8	41%	0.412	37%	0.365	S	S	.	.			trans	-112	121.8	179.5	-57.7	-62.8	0	0	0	110.3	A48 L53 V59 V61 P142	A48-F51 HydrophobicContact CB-CE1 4.36Å; F51-L53 HydrophobicContact CB-CD2 4.34Å; F51-V59 HydrophobicContact CD1-CB 4.48Å; F51-V59 HydrophobicContact CD1-CG1 4.38Å; F51-V59 HydrophobicContact CD1-CG2 3.93Å; F51-V59 HydrophobicContact CE1-CG2 3.89Å; F51-V61 HydrophobicContact CE1-CG2 3.78Å; F51-V61 HydrophobicContact CZ-CG2 4.02Å; F51-P142 HydrophobicContact CB-CB 4.11Å; F51-P142 HydrophobicContact CB-CG 4.39Å; F51-P142 HydrophobicContact CD1-CB 3.83Å; F51-P142 HydrophobicContact CD1-CG 4.26Å; F51-P142 HydrophobicContact CG-CB 4.13Å
52	D	86.9	Confident	87.4	Confident	78 Å²	78	67.1 Å²	67.1	42%	0.417	36%	0.356	S	S	.	.			trans	-93.3	101.7	169.3	176.5	4	0	0	0	109.3	V54 S55 N56	D52-V54 VanDerWaalsContact C-N 3.29Å; D52-V54 WeakPolarHBondContact OD1-CB 3.28Å; D52-V54 PolarHBondContact OD1-N 2.82Å; D52-S55 PolarHBondContact OD1-N 3.48Å; D52-S55 VanDerWaalsContact OD1-N 3.13Å; D52-S55 WeakPolarHBondContact OD2-CB 3.35Å; D52-S55 PolarHBondContact OD2-OG 3.49Å; D52-N56 PolarHBondContact O-N 3.05Å
53	L	87.2	Confident	87.8	Confident	126 Å²	126	63.2 Å²	63.2	66%	0.66	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-19	-178.8	-57.4	-177.4	0	0	0	112.9	F51 P142	F51-L53 HydrophobicContact CB-CD2 4.34Å; L53-P142 HydrophobicContact CD2-CB 4.14Å
54	V	89.1	Confident	88.2	Confident	140 Å²	140	67.2 Å²	67.2	85%	0.848	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-47.4	-179.7	-178.8	0	0	0	0	109.9	D52 N56	D52-V54 VanDerWaalsContact C-N 3.29Å; D52-V54 WeakPolarHBondContact OD1-CB 3.28Å; D52-V54 PolarHBondContact OD1-N 2.82Å; V54-N56 VanDerWaalsContact C-N 3.33Å
55	S	84.1	Confident	88.7	Confident	45 Å²	45	62 Å²	62	32%	0.315	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-17.9	179.8	71.6	0	0	0	0	113.9	D52 K57	D52-S55 PolarHBondContact OD1-N 3.48Å; D52-S55 VanDerWaalsContact OD1-N 3.13Å; D52-S55 WeakPolarHBondContact OD2-CB 3.35Å; D52-S55 PolarHBondContact OD2-OG 3.49Å; S55-K57 PolarHBondContact O-N 3.43Å; S55-K57 WeakPolarHBondContact OG-CD 3.29Å; S55-K57 WeakPolarHBondContact OG-CG 3.33Å
56	N	84	Confident	89.2	Confident	89 Å²	89	68 Å²	68	48%	0.476	37%	0.368	S	S	.	.			trans	48.5	30.8	179.4	-157.1	15.6	0	0	0	113.5	D52 V54 P142	D52-N56 PolarHBondContact O-N 3.05Å; V54-N56 VanDerWaalsContact C-N 3.33Å; N56-P142 WeakPolarHBondContact OD1-CD 3.45Å
57	K	87.2	Confident	89.6	Confident	123 Å²	123	67 Å²	67	54%	0.535	36%	0.355	S	S	.	.			trans	-65.6	146.3	-178.3	-73.9	169.3	-175.1	161.5	0	110	S55 V59	S55-K57 PolarHBondContact O-N 3.43Å; S55-K57 WeakPolarHBondContact OG-CD 3.29Å; S55-K57 WeakPolarHBondContact OG-CG 3.33Å; K57-V59 PolarHBondContact O-N 3.09Å
58	P	90.3	Very high	89.7	Confident	75 Å²	75	67.4 Å²	67.4	49%	0.487	36%	0.359	S	S	.	.			trans	-62.4	127.4	175.9	26.4	-33.4	0	0	0	109.8	G140	P58-G140 CarbonylContact C-O 3.56Å; P58-G140 WeakPolarHBondContact CA-O 3.48Å
59	V	91.6	Very high	90	Very high	21 Å²	21	70.2 Å²	70.2	13%	0.127	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	150.1	178.5	-68.6	0	0	0	0	109.6	A48 F51 K57 V61 G140 P142 S145	A48-V59 HydrophobicContact CB-CB 3.87Å; A48-V59 HydrophobicContact CB-CG1 4.08Å; F51-V59 HydrophobicContact CD1-CB 4.48Å; F51-V59 HydrophobicContact CD1-CG1 4.38Å; F51-V59 HydrophobicContact CD1-CG2 3.93Å; F51-V59 HydrophobicContact CE1-CG2 3.89Å; K57-V59 PolarHBondContact O-N 3.09Å; V59-V61 HydrophobicContact CG2-CG2 4.23Å; V59-G140 PolarHBondContact N-O 3.31Å; V59-G140 PolarHBondContact O-N 3.46Å; V59-G140 VanDerWaalsContact O-O 3.13Å; V59-P142 HydrophobicContact CG1-CG 4.34Å; V59-P142 HydrophobicContact CG2-CB 4.17Å; V59-P142 HydrophobicContact CG2-CG 3.92Å; V59-S145 PolarHBondContact O-OG 3.26Å
60	K	93.2	Very high	90.2	Very high	54 Å²	54	71.3 Å²	71.3	24%	0.235	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	120.3	171.5	-173	179.7	173.5	-174.5	0	109.4	G45 G46 I47 A48 D137 S138 L139	G45-K60 WeakPolarHBondContact O-CD 3.23Å; G45-K60 PolarHBondContact O-NZ 2.91Å; G46-K60 WeakPolarHBondContact O-CB 3.49Å; I47-K60 WeakPolarHBondContact CA-O 3.31Å; A48-K60 PolarHBondContact N-O 3.46Å; K60-D137 VanDerWaalsContact CE-OD2 3.31Å; K60-D137 WeakPolarHBondContact CE-OD2 3.38Å; K60-D137 IonicContact NZ-OD2 2.87Å; K60-S138 CarbonylContact C-O 3.56Å; K60-S138 WeakPolarHBondContact CA-O 3.34Å; K60-L139 HydrophobicContact CB-CD1 3.9Å
61	V	93.2	Very high	90.4	Very high	18 Å²	18	74.5 Å²	74.5	11%	0.109	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	139.1	176.4	-168.6	0	0	0	0	108.5	F51 V59 D137 S138 L149	F51-V61 HydrophobicContact CE1-CG2 3.78Å; F51-V61 HydrophobicContact CZ-CG2 4.02Å; V59-V61 HydrophobicContact CG2-CG2 4.23Å; V61-D137 WeakPolarHBondContact O-CA 3.29Å; V61-S138 PolarHBondContact N-O 3.44Å; V61-S138 PolarHBondContact O-N 3.48Å; V61-L149 HydrophobicContact CB-CD2 4.46Å; V61-L149 HydrophobicContact CG1-CD2 3.61Å
62	R	94.4	Very high	90.5	Very high	41 Å²	41	75 Å²	75	16%	0.155	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.7	-179.3	176.4	172.4	-62	175.8	-8.1	110.3	I47 Q135 V136 D137	I47-R62 HydrophobicContact CD1-CB 3.79Å; I47-R62 VanDerWaalsContact CD1-CD 3.48Å; I47-R62 HydrophobicContact CD1-CG 4.2Å; I47-R62 HydrophobicContact CG1-CB 4.21Å; I47-R62 HydrophobicContact CG2-CB 4.12Å; R62-Q135 VanDerWaalsContact CD-CD 3.5Å; R62-Q135 HydrophobicContact CG-CG 3.81Å; R62-Q135 VanDerWaalsContact NE-CD 3.32Å; R62-Q135 VanDerWaalsContact NH2-NE2 3.15Å; R62-V136 CarbonylContact C-O 3.51Å; R62-V136 VanDerWaalsContact CA-O 3.3Å; R62-V136 WeakPolarHBondContact CA-O 3.04Å; R62-D137 WeakPolarHBondContact CB-OD1 3.48Å; R62-D137 WeakPolarHBondContact CD-OD1 3.49Å; R62-D137 WeakPolarHBondContact CG-OD1 3.37Å; R62-D137 IonicContact CZ-OD1 3.63Å; R62-D137 IonicContact CZ-OD2 2.67Å; R62-D137 IonicContact NE-OD1 3.08Å; R62-D137 PolarHBondContact NE-OD1 2.95Å; R62-D137 IonicContact NE-OD2 2.81Å; R62-D137 IonicContact NH2-OD1 3.94Å; R62-D137 IonicContact NH2-OD2 3.22Å; R62-D137 PolarHBondContact NH2-OD2 3.3Å
63	A	94.4	Very high	90.6	Very high	19 Å²	19	76.6 Å²	76.6	16%	0.157	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	143.2	162.9	0	0	0	0	0	110.3	Q135 V136 L149 L153	A63-Q135 WeakPolarHBondContact O-CA 3.25Å; A63-V136 PolarHBondContact N-O 3.37Å; A63-V136 PolarHBondContact O-N 3.31Å; A63-L149 HydrophobicContact CB-CD1 3.76Å; A63-L149 HydrophobicContact CB-CD2 4.14Å; A63-L149 HydrophobicContact CB-CG 4.21Å; A63-L153 HydrophobicContact CB-CD2 4.44Å
64	K	94.1	Very high	90.7	Very high	96 Å²	96	75.5 Å²	75.5	42%	0.417	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.9	166.7	-66.3	-173.3	180	-172.7	0	107.8
65	I	95	Very high	90.7	Very high	32 Å²	32	71 Å²	71	16%	0.164	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	114.2	179.4	-50.8	169.7	0	0	0	107.3	H133 L134 V136 L153 V156 M160	I65-H133 CarbonylContact O-C 3.58Å; I65-H133 WeakPolarHBondContact O-CA 3.36Å; I65-H133 VanDerWaalsContact O-CB 3.26Å; I65-H133 WeakPolarHBondContact O-CB 3.21Å; I65-L134 HydrophobicContact CB-CB 4.31Å; I65-L134 HydrophobicContact CD1-CD2 4.21Å; I65-L134 PolarHBondContact N-O 2.84Å; I65-L134 PolarHBondContact O-N 3.17Å; I65-V136 HydrophobicContact CD1-CG2 3.81Å; I65-L153 HydrophobicContact CD1-CD2 3.4Å; I65-L153 VanDerWaalsContact CD1-CD2 3.4Å; I65-L153 HydrophobicContact CG1-CD2 3.65Å; I65-V156 HydrophobicContact CD1-CB 4.36Å; I65-V156 HydrophobicContact CD1-CG1 3.93Å; I65-M160 HydrophobicContact CG2-SD 4.2Å
66	E	94	Very high	91.1	Very high	146 Å²	146	74 Å²	74	68%	0.682	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	135	175.3	-62.4	-169.6	164.6	0	0	110.5
67	I	93.5	Very high	91.5	Very high	9 Å²	9	70 Å²	70	5%	0.046	37%	0.365	C	S	.	.			trans	-92.5	120.4	177.6	-67.5	170.8	0	0	0	108.2	Q69 F77 L81 L132 L134 M160	I67-Q69 PolarHBondContact O-N 3.12Å; I67-F77 HydrophobicContact CG2-CB 3.45Å; I67-F77 VanDerWaalsContact CG2-CB 3.45Å; I67-F77 HydrophobicContact CG2-CD1 4.41Å; I67-F77 HydrophobicContact CG2-CD2 3.57Å; I67-F77 HydrophobicContact CG2-CE2 4.42Å; I67-F77 HydrophobicContact CG2-CG 3.57Å; I67-L81 HydrophobicContact CD1-CD1 3.96Å; I67-L132 HydrophobicContact CB-CB 4.47Å; I67-L132 HydrophobicContact CB-CD2 4.08Å; I67-L132 HydrophobicContact CB-CG 4.02Å; I67-L132 HydrophobicContact CD1-CD1 4.44Å; I67-L132 HydrophobicContact CD1-CD2 4.24Å; I67-L132 HydrophobicContact CD1-CG 3.86Å; I67-L132 HydrophobicContact CG1-CG 4.46Å; I67-L132 HydrophobicContact CG2-CD2 3.81Å; I67-L132 HydrophobicContact CG2-CG 4.31Å; I67-L132 PolarHBondContact N-O 2.84Å; I67-L134 HydrophobicContact CD1-CB 4.5Å; I67-M160 HydrophobicContact CB-CE 4.2Å; I67-M160 HydrophobicContact CG1-CE 3.83Å; I67-M160 HydrophobicContact CG2-CE 4.3Å
68	P	90.5	Very high	91.9	Very high	28 Å²	28	65.2 Å²	65.2	18%	0.182	35%	0.346	C	S	.	.			trans	-79.2	58.4	-171.3	33.7	-36.5	0	0	0	112.3	E70 Q71 Y72 F77 M160	P68-E70 VanDerWaalsContact C-N 3.26Å; P68-E70 PolarHBondContact O-N 2.65Å; P68-Q71 VanDerWaalsContact C-OE1 3.3Å; P68-Q71 HydrophobicContact CB-CB 4.35Å; P68-Q71 PolarHBondContact O-N 2.75Å; P68-Q71 PolarHBondContact O-OE1 3.41Å; P68-Y72 HydrophobicContact CB-CD2 4.22Å; P68-Y72 HydrophobicContact CG-CD2 4.13Å; P68-Y72 HydrophobicContact CG-CE2 4.49Å; P68-Y72 PolarHBondContact O-N 2.94Å; P68-F77 HydrophobicContact CG-CE1 4.26Å; P68-F77 HydrophobicContact CG-CE2 4.29Å; P68-F77 HydrophobicContact CG-CZ 3.85Å; P68-F77 WeakPolarHBondContact O-CE2 3.25Å; P68-M160 HydrophobicContact CG-CE 4.36Å
69	Q	89.5	Confident	92	Very high	77 Å²	77	63.4 Å²	63.4	36%	0.36	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-27.7	178.5	65.2	-179.3	2.7	0	0	112.5	I67 Y72 P73	I67-Q69 PolarHBondContact O-N 3.12Å; Q69-Y72 CarbonylContact O-C 3.58Å; Q69-P73 VanDerWaalsContact O-CA 3.29Å; Q69-P73 WeakPolarHBondContact O-CA 3.29Å
70	E	89	Confident	92.1	Very high	128 Å²	128	67.2 Å²	67.2	60%	0.598	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-38.7	177.6	-64.8	175.3	-159.4	0	0	111	P68 K131	P68-E70 VanDerWaalsContact C-N 3.26Å; P68-E70 PolarHBondContact O-N 2.65Å; E70-K131 IonicContact OE1-NZ 3.32Å; E70-K131 PolarHBondContact OE1-NZ 3.24Å; E70-K131 IonicContact OE2-NZ 3.89Å
71	Q	90	Very high	92.2	Very high	125 Å²	125	64.7 Å²	64.7	58%	0.584	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-32.1	178.5	-60.9	82.9	2.1	0	0	112.6	P68	P68-Q71 VanDerWaalsContact C-OE1 3.3Å; P68-Q71 HydrophobicContact CB-CB 4.35Å; P68-Q71 PolarHBondContact O-N 2.75Å; P68-Q71 PolarHBondContact O-OE1 3.41Å
72	Y	89.1	Confident	92.3	Very high	105 Å²	105	67 Å²	67	41%	0.412	36%	0.356	S	S	.	.			trans	-129.9	66.3	-177.9	-55.5	-81	0	0	0	112.2	P68 Q69 A74 I75 F77	P68-Y72 HydrophobicContact CB-CD2 4.22Å; P68-Y72 HydrophobicContact CG-CD2 4.13Å; P68-Y72 HydrophobicContact CG-CE2 4.49Å; P68-Y72 PolarHBondContact O-N 2.94Å; Q69-Y72 CarbonylContact O-C 3.58Å; Y72-A74 PolarHBondContact O-N 2.94Å; Y72-A74 VanDerWaalsContact O-N 3.14Å; Y72-I75 HydrophobicContact CD1-CD1 4.19Å; Y72-I75 HydrophobicContact CG-CD1 4.21Å; Y72-I75 PolarHBondContact O-N 2.96Å; Y72-F77 AromaticContact CD2-CZ 3.95Å; Y72-F77 HydrophobicContact CD2-CZ 3.95Å; Y72-F77 HydrophobicContact CG-CZ 4.16Å
73	P	89.8	Confident	92.3	Very high	112 Å²	112	66.1 Å²	66.1	73%	0.727	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.8	-175.6	25.8	-35.4	0	0	0	113.7	Q69 I75	Q69-P73 VanDerWaalsContact O-CA 3.29Å; Q69-P73 WeakPolarHBondContact O-CA 3.29Å; P73-I75 VanDerWaalsContact C-N 3.28Å; P73-I75 PolarHBondContact O-N 2.86Å
74	A	89	Confident	92.4	Very high	103 Å²	103	70.4 Å²	70.4	85%	0.851	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-12.6	176.9	0	0	0	0	0	113.6	Y72	Y72-A74 PolarHBondContact O-N 2.94Å; Y72-A74 VanDerWaalsContact O-N 3.14Å
75	I	89.6	Confident	92.4	Very high	45 Å²	45	69.2 Å²	69.2	23%	0.231	40%	0.401	C	S	.	.			trans	-101.5	119.9	-175.3	-58.7	-177.6	0	0	0	110	Y72 P73 F77 K80	Y72-I75 HydrophobicContact CD1-CD1 4.19Å; Y72-I75 HydrophobicContact CG-CD1 4.21Å; Y72-I75 PolarHBondContact O-N 2.96Å; P73-I75 VanDerWaalsContact C-N 3.28Å; P73-I75 PolarHBondContact O-N 2.86Å; I75-F77 HydrophobicContact CB-CD2 4.4Å; I75-F77 HydrophobicContact CB-CE1 4.49Å; I75-F77 HydrophobicContact CB-CE2 3.98Å; I75-F77 HydrophobicContact CB-CZ 4.03Å; I75-F77 HydrophobicContact CD1-CZ 4.43Å; I75-F77 HydrophobicContact CG2-CD1 4.02Å; I75-F77 HydrophobicContact CG2-CD2 4.23Å; I75-F77 HydrophobicContact CG2-CE1 3.9Å; I75-F77 HydrophobicContact CG2-CE2 4.12Å; I75-F77 HydrophobicContact CG2-CG 4.19Å; I75-F77 HydrophobicContact CG2-CZ 3.95Å; I75-F77 WeakPolarHBondContact O-CD2 3.45Å; I75-F77 PolarHBondContact O-N 2.92Å; I75-F77 VanDerWaalsContact O-N 3.09Å; I75-K80 HydrophobicContact CG2-CD 3.86Å
76	N	91.8	Very high	92.4	Very high	108 Å²	108	68.4 Å²	68.4	58%	0.578	40%	0.4	S	S	*	.			trans	-80.3	88	168.2	-176.1	-2.7	0	0	0	110.8	V78 G79 K80	N76-V78 VanDerWaalsContact C-N 3.34Å; N76-V78 PolarHBondContact O-N 3.25Å; N76-V78 PolarHBondContact OD1-N 3.47Å; N76-G79 PolarHBondContact O-N 2.89Å; N76-G79 PolarHBondContact OD1-N 3.21Å; N76-K80 WeakPolarHBondContact O-CG 3.43Å; N76-K80 PolarHBondContact O-N 3.47Å
77	F	93.3	Very high	92.6	Very high	5 Å²	5	66.9 Å²	66.9	2%	0.022	39%	0.393	C	S	.	.	H	α-helix	trans	-61.9	-38.4	177.5	-67.1	-78.9	0	0	0	113	I67 P68 Y72 I75 G79 K80 L81 M160	I67-F77 HydrophobicContact CG2-CB 3.45Å; I67-F77 VanDerWaalsContact CG2-CB 3.45Å; I67-F77 HydrophobicContact CG2-CD1 4.41Å; I67-F77 HydrophobicContact CG2-CD2 3.57Å; I67-F77 HydrophobicContact CG2-CE2 4.42Å; I67-F77 HydrophobicContact CG2-CG 3.57Å; P68-F77 HydrophobicContact CG-CE1 4.26Å; P68-F77 HydrophobicContact CG-CE2 4.29Å; P68-F77 HydrophobicContact CG-CZ 3.85Å; P68-F77 WeakPolarHBondContact O-CE2 3.25Å; Y72-F77 AromaticContact CD2-CZ 3.95Å; Y72-F77 HydrophobicContact CD2-CZ 3.95Å; Y72-F77 HydrophobicContact CG-CZ 4.16Å; I75-F77 HydrophobicContact CB-CD2 4.4Å; I75-F77 HydrophobicContact CB-CE1 4.49Å; I75-F77 HydrophobicContact CB-CE2 3.98Å; I75-F77 HydrophobicContact CB-CZ 4.03Å; I75-F77 HydrophobicContact CD1-CZ 4.43Å; I75-F77 HydrophobicContact CG2-CD1 4.02Å; I75-F77 HydrophobicContact CG2-CD2 4.23Å; I75-F77 HydrophobicContact CG2-CE1 3.9Å; I75-F77 HydrophobicContact CG2-CE2 4.12Å; I75-F77 HydrophobicContact CG2-CG 4.19Å; I75-F77 HydrophobicContact CG2-CZ 3.95Å; I75-F77 WeakPolarHBondContact O-CD2 3.45Å; I75-F77 PolarHBondContact O-N 2.92Å; I75-F77 VanDerWaalsContact O-N 3.09Å; F77-G79 VanDerWaalsContact C-N 3.34Å; F77-G79 PolarHBondContact O-N 3.5Å; F77-K80 PolarHBondContact O-N 3.27Å; F77-L81 WeakPolarHBondContact O-CB 3.32Å; F77-L81 VanDerWaalsContact O-CG 3.28Å; F77-L81 WeakPolarHBondContact O-CG 3.34Å; F77-L81 PolarHBondContact O-N 2.95Å; F77-M160 HydrophobicContact CD1-CB 4.42Å; F77-M160 HydrophobicContact CD1-CG 4.47Å; F77-M160 HydrophobicContact CE1-CB 4.48Å; F77-M160 WeakPolarHBondContact CE1-O 3.46Å
78	V	93.8	Very high	92.7	Very high	23 Å²	23	68.8 Å²	68.8	14%	0.139	41%	0.405	C	S	.	.	H	α-helix	trans	-60.8	-46.2	179.1	179.4	0	0	0	0	110.3	N76 L81 L82 I102 L132	N76-V78 VanDerWaalsContact C-N 3.34Å; N76-V78 PolarHBondContact O-N 3.25Å; N76-V78 PolarHBondContact OD1-N 3.47Å; V78-L81 PolarHBondContact O-N 2.94Å; V78-L82 HydrophobicContact CG1-CD1 3.83Å; V78-L82 WeakPolarHBondContact O-CB 3.25Å; V78-L82 WeakPolarHBondContact O-CG 3.41Å; V78-L82 PolarHBondContact O-N 2.79Å; V78-I102 HydrophobicContact CG1-CD1 3.98Å; V78-I102 HydrophobicContact CG1-CG2 4.39Å; V78-I102 HydrophobicContact CG2-CG2 4.08Å; V78-L132 HydrophobicContact CG2-CD1 4.07Å; V78-L132 HydrophobicContact CG2-CD2 3.98Å
79	G	93.9	Very high	93	Very high	36 Å²	36	68 Å²	68	37%	0.371	40%	0.4	S	S	.	.	H	α-helix	trans	-62.3	-41.8	175.3	0	0	0	0	0	113	N76 F77 G83	N76-G79 PolarHBondContact O-N 2.89Å; N76-G79 PolarHBondContact OD1-N 3.21Å; F77-G79 VanDerWaalsContact C-N 3.34Å; F77-G79 PolarHBondContact O-N 3.5Å; G79-G83 PolarHBondContact O-N 3.42Å
80	K	93.6	Very high	93.3	Very high	102 Å²	102	70.8 Å²	70.8	44%	0.443	41%	0.407	S	S	.	.	H	α-helix	trans	-65	-45	176.4	-76.3	-170.1	170.9	-158.9	0	112.9	I75 N76 F77 I159	I75-K80 HydrophobicContact CG2-CD 3.86Å; N76-K80 WeakPolarHBondContact O-CG 3.43Å; N76-K80 PolarHBondContact O-N 3.47Å; F77-K80 PolarHBondContact O-N 3.27Å; K80-I159 HydrophobicContact CB-CG2 4.44Å
81	L	95.4	Very high	93.7	Very high	1 Å²	1	67 Å²	67	1%	0.005	40%	0.397	C	S	.	.	H	α-helix	trans	-65.1	-45.5	179.9	-74.5	168.1	0	0	0	111.3	I67 F77 V78 T88 L89 I102 L134 V156 I159 M160	I67-L81 HydrophobicContact CD1-CD1 3.96Å; F77-L81 WeakPolarHBondContact O-CB 3.32Å; F77-L81 VanDerWaalsContact O-CG 3.28Å; F77-L81 WeakPolarHBondContact O-CG 3.34Å; F77-L81 PolarHBondContact O-N 2.95Å; V78-L81 PolarHBondContact O-N 2.94Å; L81-T88 WeakPolarHBondContact O-CB 3.41Å; L81-L89 WeakPolarHBondContact O-CB 3.4Å; L81-L89 PolarHBondContact O-N 3.34Å; L81-I102 HydrophobicContact CB-CD1 4.06Å; L81-I102 HydrophobicContact CD1-CD1 4.34Å; L81-L134 HydrophobicContact CD2-CD2 4.49Å; L81-V156 HydrophobicContact CD2-CG1 4.24Å; L81-I159 HydrophobicContact CD2-CB 4.34Å; L81-I159 HydrophobicContact CD2-CG2 3.97Å; L81-M160 HydrophobicContact CD2-CG 4.05Å
82	L	95.6	Very high	94	Very high	66 Å²	66	61.7 Å²	61.7	35%	0.346	37%	0.373	S	S	.	.	H	α-helix	trans	-70.5	-45.6	179.3	-70.1	171.8	0	0	0	112	V78 G86 Q87 T88 L89 I102	V78-L82 HydrophobicContact CG1-CD1 3.83Å; V78-L82 WeakPolarHBondContact O-CB 3.25Å; V78-L82 WeakPolarHBondContact O-CG 3.41Å; V78-L82 PolarHBondContact O-N 2.79Å; L82-G86 CarbonylContact O-C 3.5Å; L82-G86 WeakPolarHBondContact O-CA 3.48Å; L82-Q87 PolarHBondContact O-N 3.03Å; L82-T88 WeakPolarHBondContact O-CB 3.41Å; L82-T88 PolarHBondContact O-N 3.03Å; L82-T88 VanDerWaalsContact O-N 3.1Å; L82-L89 HydrophobicContact CD2-CB 4.38Å; L82-L89 HydrophobicContact CD2-CD2 3.88Å; L82-I102 HydrophobicContact CD1-CD1 4.33Å; L82-I102 HydrophobicContact CD2-CD1 4.05Å; L82-I102 HydrophobicContact CG-CD1 3.82Å
83	G	94	Very high	94.4	Very high	23 Å²	23	58.7 Å²	58.7	24%	0.237	36%	0.363	C	S	.	.			trans	63	-171.8	-170	0	0	0	0	0	113.2	G79 G85 G86	G79-G83 PolarHBondContact O-N 3.42Å; G83-G85 PolarHBondContact O-N 2.7Å; G83-G86 PolarHBondContact O-N 3.35Å
84	P	96.4	Very high	94.7	Very high	109 Å²	109	60.5 Å²	60.5	71%	0.708	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-62.4	122.9	-178.6	26.1	-33.5	0	0	0	110.8	G86 Q87	P84-G86 PolarHBondContact O-N 2.97Å; P84-G86 VanDerWaalsContact O-N 3.12Å; P84-Q87 WeakPolarHBondContact O-CB 3.33Å; P84-Q87 VanDerWaalsContact O-CG 3.29Å; P84-Q87 WeakPolarHBondContact O-CG 3.47Å; P84-Q87 PolarHBondContact O-N 3.48Å; P84-Q87 VanDerWaalsContact O-N 3.13Å
85	G	94.5	Very high	95	Very high	71 Å²	71	60.1 Å²	60.1	73%	0.732	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	63.7	13.5	-179.8	0	0	0	0	0	115.2	G83 Q87	G83-G85 PolarHBondContact O-N 2.7Å; G85-Q87 VanDerWaalsContact C-N 3.29Å
86	G	94.9	Very high	95.3	Very high	15 Å²	15	58 Å²	58	16%	0.155	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	77.9	11.2	-174.6	0	0	0	0	0	114.2	L82 G83 P84 T88 R90	L82-G86 CarbonylContact O-C 3.5Å; L82-G86 WeakPolarHBondContact O-CA 3.48Å; G83-G86 PolarHBondContact O-N 3.35Å; P84-G86 PolarHBondContact O-N 2.97Å; P84-G86 VanDerWaalsContact O-N 3.12Å; G86-T88 PolarHBondContact O-N 3.19Å; G86-R90 VanDerWaalsContact O-CG 3.3Å; G86-R90 WeakPolarHBondContact O-CG 3.48Å; G86-R90 PolarHBondContact O-N 2.96Å
87	Q	97	Very high	95.5	Very high	113 Å²	113	59.2 Å²	59.2	53%	0.528	34%	0.338	S	S	.	.	H	α-helix	trans	-69.1	-32.9	-173	-65.9	-66.1	14.2	0	0	113.4	L82 P84 G85 R90 A91	L82-Q87 PolarHBondContact O-N 3.03Å; P84-Q87 WeakPolarHBondContact O-CB 3.33Å; P84-Q87 VanDerWaalsContact O-CG 3.29Å; P84-Q87 WeakPolarHBondContact O-CG 3.47Å; P84-Q87 PolarHBondContact O-N 3.48Å; P84-Q87 VanDerWaalsContact O-N 3.13Å; G85-Q87 VanDerWaalsContact C-N 3.29Å; Q87-R90 PolarHBondContact O-N 3.38Å; Q87-A91 VanDerWaalsContact O-CB 3.32Å; Q87-A91 WeakPolarHBondContact O-CB 3.25Å; Q87-A91 PolarHBondContact O-N 2.81Å
88	T	96.2	Very high	95.7	Very high	50 Å²	50	59.5 Å²	59.5	31%	0.307	34%	0.34	S	S	.	.	H	α-helix	trans	-63	-52.6	178.8	-55.9	0	0	0	0	110.4	L81 L82 G86 R90 A91 V92 I159	L81-T88 WeakPolarHBondContact O-CB 3.41Å; L82-T88 WeakPolarHBondContact O-CB 3.41Å; L82-T88 PolarHBondContact O-N 3.03Å; L82-T88 VanDerWaalsContact O-N 3.1Å; G86-T88 PolarHBondContact O-N 3.19Å; T88-R90 VanDerWaalsContact C-N 3.27Å; T88-R90 PolarHBondContact O-N 3.32Å; T88-A91 PolarHBondContact O-N 2.78Å; T88-V92 WeakPolarHBondContact O-CG2 3.3Å; T88-V92 PolarHBondContact O-N 3.07Å; T88-V92 VanDerWaalsContact O-N 3.08Å; T88-I159 HydrophobicContact CG2-CD1 4.05Å
89	L	96.3	Very high	95.8	Very high	11 Å²	11	65.4 Å²	65.4	6%	0.058	36%	0.364	C	S	.	.	H	α-helix	trans	-64.3	-33.2	179.1	-166.4	65.8	0	0	0	112.2	L81 L82 Q93 M100 I102 L134	L81-L89 WeakPolarHBondContact O-CB 3.4Å; L81-L89 PolarHBondContact O-N 3.34Å; L82-L89 HydrophobicContact CD2-CB 4.38Å; L82-L89 HydrophobicContact CD2-CD2 3.88Å; L89-Q93 WeakPolarHBondContact O-CB 3.39Å; L89-Q93 VanDerWaalsContact O-CG 3.28Å; L89-Q93 WeakPolarHBondContact O-CG 3.27Å; L89-Q93 PolarHBondContact O-N 2.72Å; L89-Q93 VanDerWaalsContact O-N 3.09Å; L89-Q93 PolarHBondContact O-NE2 3.33Å; L89-M100 HydrophobicContact CD1-CB 4.01Å; L89-M100 HydrophobicContact CD1-SD 3.75Å; L89-M100 HydrophobicContact CD2-CB 4.47Å; L89-M100 HydrophobicContact CG-CB 4.27Å; L89-I102 HydrophobicContact CD2-CD1 4.35Å; L89-I102 HydrophobicContact CD2-CG1 4.34Å; L89-L134 HydrophobicContact CD1-CD1 4.22Å
90	R	96.7	Very high	95.9	Very high	136 Å²	136	64.2 Å²	64.2	51%	0.513	35%	0.349	S	S	.	.	H	α-helix	trans	-68	-45.6	175.4	-75.2	177.1	-177.8	-174.2	1.3	111.9	G86 Q87 T88 V92 Q93 E94	G86-R90 VanDerWaalsContact O-CG 3.3Å; G86-R90 WeakPolarHBondContact O-CG 3.48Å; G86-R90 PolarHBondContact O-N 2.96Å; Q87-R90 PolarHBondContact O-N 3.38Å; T88-R90 VanDerWaalsContact C-N 3.27Å; T88-R90 PolarHBondContact O-N 3.32Å; R90-V92 VanDerWaalsContact C-N 3.3Å; R90-V92 PolarHBondContact O-N 2.63Å; R90-Q93 WeakPolarHBondContact O-CB 3.24Å; R90-Q93 PolarHBondContact O-N 3.01Å; R90-Q93 VanDerWaalsContact O-N 3.13Å; R90-E94 WeakPolarHBondContact O-CG 3.48Å; R90-E94 PolarHBondContact O-N 3.09Å
91	A	96.5	Very high	96	Very high	47 Å²	47	61 Å²	61	39%	0.388	34%	0.341	S	S	.	.	H	α-helix	trans	-59.5	-41.2	177.1	0	0	0	0	0	111.8	Q87 T88 E94 T95	Q87-A91 VanDerWaalsContact O-CB 3.32Å; Q87-A91 WeakPolarHBondContact O-CB 3.25Å; Q87-A91 PolarHBondContact O-N 2.81Å; T88-A91 PolarHBondContact O-N 2.78Å; A91-E94 PolarHBondContact O-N 2.92Å; A91-T95 VanDerWaalsContact O-CB 3.32Å; A91-T95 WeakPolarHBondContact O-CB 3.3Å; A91-T95 PolarHBondContact O-N 2.82Å; A91-T95 PolarHBondContact O-OG1 2.88Å
92	V	96.3	Very high	96	Very high	14 Å²	14	62.2 Å²	62.2	9%	0.085	35%	0.348	C	S	.	.	H	α-helix	trans	-64.2	-44	175	178.7	0	0	0	0	111.1	T88 R90 E94 T95 T96 M100 E155 V156 I159	T88-V92 WeakPolarHBondContact O-CG2 3.3Å; T88-V92 PolarHBondContact O-N 3.07Å; T88-V92 VanDerWaalsContact O-N 3.08Å; R90-V92 VanDerWaalsContact C-N 3.3Å; R90-V92 PolarHBondContact O-N 2.63Å; V92-E94 PolarHBondContact O-N 2.99Å; V92-T95 PolarHBondContact O-N 3.49Å; V92-T96 HydrophobicContact CG1-CG2 4.11Å; V92-T96 VanDerWaalsContact O-CB 3.31Å; V92-T96 WeakPolarHBondContact O-CB 3.3Å; V92-T96 VanDerWaalsContact O-CG2 3.23Å; V92-T96 WeakPolarHBondContact O-CG2 3.44Å; V92-T96 PolarHBondContact O-N 2.86Å; V92-T96 PolarHBondContact O-OG1 3.5Å; V92-M100 HydrophobicContact CB-SD 4.48Å; V92-M100 HydrophobicContact CG1-CE 3.51Å; V92-M100 HydrophobicContact CG1-SD 3.89Å; V92-E155 HydrophobicContact CG1-CB 3.97Å; V92-V156 HydrophobicContact CG1-CG2 4.46Å; V92-I159 HydrophobicContact CG2-CD1 3.69Å
93	Q	97.1	Very high	96	Very high	43 Å²	43	60.3 Å²	60.3	20%	0.201	34%	0.338	C	S	.	.	H	α-helix	trans	-60.1	-44.7	176.3	-78.9	174.5	101.1	0	0	112.6	L89 R90 K97 T98 M100	L89-Q93 WeakPolarHBondContact O-CB 3.39Å; L89-Q93 VanDerWaalsContact O-CG 3.28Å; L89-Q93 WeakPolarHBondContact O-CG 3.27Å; L89-Q93 PolarHBondContact O-N 2.72Å; L89-Q93 VanDerWaalsContact O-N 3.09Å; L89-Q93 PolarHBondContact O-NE2 3.33Å; R90-Q93 WeakPolarHBondContact O-CB 3.24Å; R90-Q93 PolarHBondContact O-N 3.01Å; R90-Q93 VanDerWaalsContact O-N 3.13Å; Q93-K97 VanDerWaalsContact O-CA 3.29Å; Q93-K97 WeakPolarHBondContact O-CA 3.19Å; Q93-K97 PolarHBondContact O-N 3.45Å; Q93-T98 WeakPolarHBondContact CA-O 3.5Å; Q93-T98 VanDerWaalsContact CB-O 3.25Å; Q93-T98 WeakPolarHBondContact CB-O 3.49Å; Q93-T98 WeakPolarHBondContact CG-O 3.41Å; Q93-T98 PolarHBondContact O-N 2.69Å; Q93-T98 VanDerWaalsContact O-N 3.12Å; Q93-M100 HydrophobicContact CG-CB 3.67Å; Q93-M100 HydrophobicContact CG-CG 3.62Å; Q93-M100 HydrophobicContact CG-SD 4.08Å; Q93-M100 PolarHBondContact OE1-O 2.98Å
94	E	96.6	Very high	95.9	Very high	150 Å²	150	59.2 Å²	59.2	70%	0.701	33%	0.326	S	S	*	.	H	α-helix	trans	-65.3	-46.3	178.8	-72.6	173	-170.8	0	0	111.6	R90 A91 V92 K97	R90-E94 WeakPolarHBondContact O-CG 3.48Å; R90-E94 PolarHBondContact O-N 3.09Å; A91-E94 PolarHBondContact O-N 2.92Å; V92-E94 PolarHBondContact O-N 2.99Å; E94-K97 PolarHBondContact O-N 3.14Å
95	T	95.9	Very high	95.7	Very high	94 Å²	94	55.8 Å²	55.8	58%	0.577	31%	0.307	S	S	*	.	H	α-helix	trans	-65.5	-41.9	-179	-56.7	0	0	0	0	111.9	A91 V92	A91-T95 VanDerWaalsContact O-CB 3.32Å; A91-T95 WeakPolarHBondContact O-CB 3.3Å; A91-T95 PolarHBondContact O-N 2.82Å; A91-T95 PolarHBondContact O-OG1 2.88Å; V92-T95 PolarHBondContact O-N 3.49Å
96	T	95.5	Very high	95.6	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.012	29%	0.288	C	S	.	.	H	α-helix	trans	-87.4	-10.5	-177	63.1	0	0	0	0	112.9	V92 T98 R148 A152 E155	V92-T96 HydrophobicContact CG1-CG2 4.11Å; V92-T96 VanDerWaalsContact O-CB 3.31Å; V92-T96 WeakPolarHBondContact O-CB 3.3Å; V92-T96 VanDerWaalsContact O-CG2 3.23Å; V92-T96 WeakPolarHBondContact O-CG2 3.44Å; V92-T96 PolarHBondContact O-N 2.86Å; V92-T96 PolarHBondContact O-OG1 3.5Å; T96-T98 PolarHBondContact O-N 2.82Å; T96-T98 PolarHBondContact OG1-OG1 3.26Å; T96-R148 WeakPolarHBondContact O-CB 3.48Å; T96-R148 WeakPolarHBondContact O-CG 3.26Å; T96-A152 HydrophobicContact CG2-CB 3.99Å; T96-E155 HydrophobicContact CG2-CB 4.45Å; T96-E155 HydrophobicContact CG2-CG 4.12Å
97	K	96	Very high	95.5	Very high	133 Å²	133	54.3 Å²	54.3	58%	0.578	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	41.5	-172.1	-55.8	177.9	-176.9	174.2	0	112.2	Q93 E94	Q93-K97 VanDerWaalsContact O-CA 3.29Å; Q93-K97 WeakPolarHBondContact O-CA 3.19Å; Q93-K97 PolarHBondContact O-N 3.45Å; E94-K97 PolarHBondContact O-N 3.14Å
98	T	97	Very high	95.2	Very high	10 Å²	10	52 Å²	52	6%	0.061	28%	0.279	C	S	.	.			trans	-120	161.1	177.5	65.6	0	0	0	0	111	Q93 T96 M100 V136 R148 A152	Q93-T98 WeakPolarHBondContact CA-O 3.5Å; Q93-T98 VanDerWaalsContact CB-O 3.25Å; Q93-T98 WeakPolarHBondContact CB-O 3.49Å; Q93-T98 WeakPolarHBondContact CG-O 3.41Å; Q93-T98 PolarHBondContact O-N 2.69Å; Q93-T98 VanDerWaalsContact O-N 3.12Å; T96-T98 PolarHBondContact O-N 2.82Å; T96-T98 PolarHBondContact OG1-OG1 3.26Å; T98-M100 VanDerWaalsContact OG1-CE 3.29Å; T98-M100 WeakPolarHBondContact OG1-CE 3.46Å; T98-V136 HydrophobicContact CG2-CG1 4.16Å; T98-R148 HydrophobicContact CG2-CB 4.06Å; T98-A152 HydrophobicContact CG2-CB 3.92Å
99	K	96.5	Very high	94.9	Very high	147 Å²	147	61 Å²	61	64%	0.639	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	126.1	171.6	-179.3	176	-177	175.6	0	108.8	D137	K99-D137 HydrophobicContact CB-CB 4.29Å; K99-D137 PolarHBondContact N-O 2.92Å; K99-D137 PolarHBondContact O-N 3.31Å
100	M	96.8	Very high	94.7	Very high	12 Å²	12	63.7 Å²	63.7	6%	0.059	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	139.8	-177.5	-62	-175.7	178	0	0	110.9	L89 V92 Q93 T98 L134 Q135 V136 A152 V156	L89-M100 HydrophobicContact CD1-CB 4.01Å; L89-M100 HydrophobicContact CD1-SD 3.75Å; L89-M100 HydrophobicContact CD2-CB 4.47Å; L89-M100 HydrophobicContact CG-CB 4.27Å; V92-M100 HydrophobicContact CB-SD 4.48Å; V92-M100 HydrophobicContact CG1-CE 3.51Å; V92-M100 HydrophobicContact CG1-SD 3.89Å; Q93-M100 HydrophobicContact CG-CB 3.67Å; Q93-M100 HydrophobicContact CG-CG 3.62Å; Q93-M100 HydrophobicContact CG-SD 4.08Å; Q93-M100 PolarHBondContact OE1-O 2.98Å; T98-M100 VanDerWaalsContact OG1-CE 3.29Å; T98-M100 WeakPolarHBondContact OG1-CE 3.46Å; M100-L134 HydrophobicContact CB-CD1 4.3Å; M100-L134 HydrophobicContact SD-CD2 4.29Å; M100-Q135 CarbonylContact C-O 3Å; M100-Q135 VanDerWaalsContact CA-O 3.27Å; M100-Q135 WeakPolarHBondContact CA-O 3.45Å; M100-V136 HydrophobicContact CE-CG1 4.04Å; M100-V136 HydrophobicContact CE-CG2 4.24Å; M100-V136 HydrophobicContact CG-CG1 4.23Å; M100-V136 HydrophobicContact CG-CG2 4.13Å; M100-A152 HydrophobicContact CE-CB 3.54Å; M100-V156 HydrophobicContact CE-CG2 3.88Å; M100-V156 HydrophobicContact SD-CG2 4.07Å
101	A	95.4	Very high	94.3	Very high	34 Å²	34	62.4 Å²	62.4	28%	0.281	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	130.9	175	0	0	0	0	0	110.4	L103 Q135	A101-L103 HydrophobicContact CB-CD2 4.27Å; A101-L103 HydrophobicContact CB-CG 4.18Å; A101-Q135 PolarHBondContact N-O 2.98Å; A101-Q135 PolarHBondContact O-N 3.03Å
102	I	95.8	Very high	94.1	Very high	27 Å²	27	64 Å²	64	14%	0.138	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	122	171.2	-58.2	173.2	0	0	0	107.1	V78 L81 L82 L89 L132 L134	V78-I102 HydrophobicContact CG1-CD1 3.98Å; V78-I102 HydrophobicContact CG1-CG2 4.39Å; V78-I102 HydrophobicContact CG2-CG2 4.08Å; L81-I102 HydrophobicContact CB-CD1 4.06Å; L81-I102 HydrophobicContact CD1-CD1 4.34Å; L82-I102 HydrophobicContact CD1-CD1 4.33Å; L82-I102 HydrophobicContact CD2-CD1 4.05Å; L82-I102 HydrophobicContact CG-CD1 3.82Å; L89-I102 HydrophobicContact CD2-CD1 4.35Å; L89-I102 HydrophobicContact CD2-CG1 4.34Å; I102-L132 HydrophobicContact CG2-CD1 4.04Å; I102-L134 HydrophobicContact CG1-CD1 3.59Å
103	L	94.1	Very high	93.9	Very high	25 Å²	25	69 Å²	69	13%	0.131	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	175	-174.7	-58.6	177.5	0	0	0	109.6	A101 H127 H133 Q135	A101-L103 HydrophobicContact CB-CD2 4.27Å; A101-L103 HydrophobicContact CB-CG 4.18Å; L103-H127 HydrophobicContact CB-CB 4.18Å; L103-H133 PolarHBondContact N-O 3.33Å; L103-H133 PolarHBondContact O-N 2.89Å; L103-H133 VanDerWaalsContact O-O 3.06Å; L103-Q135 HydrophobicContact CD1-CB 3.94Å
104	G	93.3	Very high	93.6	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.354	C	S	.	.	S	Bend	trans	94.3	177.5	-176	0	0	0	0	0	114.8	S107 H127 L128 Q130 K131	G104-S107 VanDerWaalsContact O-CB 3.24Å; G104-S107 WeakPolarHBondContact O-CB 3.45Å; G104-S107 PolarHBondContact O-N 3.11Å; G104-S107 PolarHBondContact O-OG 2.87Å; G104-H127 WeakPolarHBondContact CA-O 3.39Å; G104-H127 PolarHBondContact N-ND1 3.04Å; G104-H127 PolarHBondContact N-O 3.35Å; G104-L128 WeakPolarHBondContact O-CD2 3.48Å; G104-Q130 CarbonylContact C-O 3.55Å; G104-Q130 WeakPolarHBondContact CA-O 3.4Å; G104-K131 WeakPolarHBondContact CA-O 3.45Å
105	A	91.8	Very high	93.3	Very high	37 Å²	37	68.3 Å²	68.3	31%	0.306	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	134.2	175.1	0	0	0	0	0	111	S107 E114 Q130 L132	A105-S107 VanDerWaalsContact C-N 3.31Å; A105-E114 VanDerWaalsContact CA-OE1 3.25Å; A105-E114 WeakPolarHBondContact CA-OE1 3.28Å; A105-Q130 PolarHBondContact N-O 2.84Å; A105-L132 WeakPolarHBondContact O-CB 3.21Å
106	G	91.2	Very high	93.1	Very high	32 Å²	32	69.4 Å²	69.4	33%	0.33	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	11.6	-175.6	0	0	0	0	0	114.5	L108 E114	G106-L108 VanDerWaalsContact C-N 3.32Å; G106-E114 WeakPolarHBondContact CA-OE2 3.31Å; G106-E114 PolarHBondContact N-OE1 3.19Å; G106-E114 PolarHBondContact N-OE2 3.3Å
107	S	92.5	Very high	92.9	Very high	23 Å²	23	71.2 Å²	71.2	16%	0.161	36%	0.361	C	S	.	.			trans	-76.1	-22.8	173.4	60.6	0	0	0	0	112.5	G104 A105	G104-S107 VanDerWaalsContact O-CB 3.24Å; G104-S107 WeakPolarHBondContact O-CB 3.45Å; G104-S107 PolarHBondContact O-N 3.11Å; G104-S107 PolarHBondContact O-OG 2.87Å; A105-S107 VanDerWaalsContact C-N 3.31Å
108	L	91.7	Very high	92.5	Very high	64 Å²	64	68.1 Å²	68.1	34%	0.335	35%	0.351	S	S	.	.	S	Bend	trans	-91.2	151.3	174.7	-69.4	168.2	0	0	0	110.6	G106 D110 E114 L117 L128	G106-L108 VanDerWaalsContact C-N 3.32Å; L108-D110 VanDerWaalsContact C-N 3.3Å; L108-D110 PolarHBondContact O-N 2.88Å; L108-E114 HydrophobicContact CB-CB 4.36Å; L108-E114 HydrophobicContact CD1-CB 3.92Å; L108-E114 HydrophobicContact CD1-CG 4.06Å; L108-L117 HydrophobicContact CD1-CD1 3.85Å; L108-L128 HydrophobicContact CD1-CD1 4.25Å; L108-L128 HydrophobicContact CD1-CD2 4.17Å
109	R	88.9	Confident	92.1	Very high	240 Å²	240	72 Å²	72	91%	0.906	38%	0.378	S	S	*	.	S	Bend	trans	-68.7	-30.3	177.6	-177.6	175.7	177.1	175.2	0.2	113.1
110	D	92.4	Very high	91.6	Very high	68 Å²	68	69.3 Å²	69.3	36%	0.364	37%	0.371	S	S	.	.			trans	-115	102.2	-172.6	-60.3	-38.2	0	0	0	110.2	L108 A112 K113 E114	L108-D110 VanDerWaalsContact C-N 3.3Å; L108-D110 PolarHBondContact O-N 2.88Å; D110-A112 PolarHBondContact O-N 2.84Å; D110-K113 HydrophobicContact CB-CB 4.07Å; D110-K113 HydrophobicContact CB-CD 3.89Å; D110-K113 HydrophobicContact CB-CG 3.93Å; D110-K113 PolarHBondContact O-N 2.84Å; D110-K113 WeakPolarHBondContact OD2-CD 3.46Å; D110-K113 VanDerWaalsContact OD2-CE 3.3Å; D110-K113 WeakPolarHBondContact OD2-CE 3.21Å; D110-K113 IonicContact OD2-NZ 2.7Å; D110-K113 PolarHBondContact OD2-NZ 2.86Å; D110-E114 PolarHBondContact O-N 3.22Å
111	D	89.6	Confident	90.9	Very high	108 Å²	108	71.2 Å²	71.2	58%	0.578	39%	0.394	S	S	*	.	H	α-helix	trans	-58.1	-32.6	-178.9	-60.6	-23.9	0	0	0	113.2	E114 K115	D111-E114 WeakPolarHBondContact O-CB 3.27Å; D111-E114 PolarHBondContact O-N 2.91Å; D111-K115 PolarHBondContact O-N 3.06Å
112	A	91.4	Very high	90.5	Very high	81 Å²	81	73.2 Å²	73.2	67%	0.669	40%	0.4	S	S	*	.	H	α-helix	trans	-65.2	-40.7	177.1	0	0	0	0	0	111.9	D110 Q116	D110-A112 PolarHBondContact O-N 2.84Å; A112-Q116 PolarHBondContact O-N 2.72Å
113	K	91.6	Very high	89.8	Confident	118 Å²	118	76.2 Å²	76.2	51%	0.513	42%	0.421	S	S	.	.	H	α-helix	trans	-70.4	-36.9	175.7	-66.2	-177.9	-174.3	155.8	0	110.7	D110 K115 Q116 L117	D110-K113 HydrophobicContact CB-CB 4.07Å; D110-K113 HydrophobicContact CB-CD 3.89Å; D110-K113 HydrophobicContact CB-CG 3.93Å; D110-K113 PolarHBondContact O-N 2.84Å; D110-K113 WeakPolarHBondContact OD2-CD 3.46Å; D110-K113 VanDerWaalsContact OD2-CE 3.3Å; D110-K113 WeakPolarHBondContact OD2-CE 3.21Å; D110-K113 IonicContact OD2-NZ 2.7Å; D110-K113 PolarHBondContact OD2-NZ 2.86Å; K113-K115 PolarHBondContact O-N 2.75Å; K113-Q116 PolarHBondContact O-N 3.12Å; K113-L117 WeakPolarHBondContact O-CB 3.44Å; K113-L117 VanDerWaalsContact O-CG 3.27Å; K113-L117 WeakPolarHBondContact O-CG 3.28Å; K113-L117 PolarHBondContact O-N 3.15Å
114	E	91.1	Very high	89.4	Confident	20 Å²	20	82 Å²	82	9%	0.093	45%	0.445	C	S	.	.	H	α-helix	trans	-56	-51	175.4	-170.6	171.5	119.5	0	0	111.5	A105 G106 L108 D110 D111 Q116 L117 L118 L128	A105-E114 VanDerWaalsContact CA-OE1 3.25Å; A105-E114 WeakPolarHBondContact CA-OE1 3.28Å; G106-E114 WeakPolarHBondContact CA-OE2 3.31Å; G106-E114 PolarHBondContact N-OE1 3.19Å; G106-E114 PolarHBondContact N-OE2 3.3Å; L108-E114 HydrophobicContact CB-CB 4.36Å; L108-E114 HydrophobicContact CD1-CB 3.92Å; L108-E114 HydrophobicContact CD1-CG 4.06Å; D110-E114 PolarHBondContact O-N 3.22Å; D111-E114 WeakPolarHBondContact O-CB 3.27Å; D111-E114 PolarHBondContact O-N 2.91Å; E114-Q116 VanDerWaalsContact C-N 3.33Å; E114-Q116 PolarHBondContact O-N 3.39Å; E114-L117 PolarHBondContact O-N 3.01Å; E114-L118 WeakPolarHBondContact O-CB 3.44Å; E114-L118 PolarHBondContact O-N 2.89Å; E114-L128 HydrophobicContact CG-CB 4.28Å; E114-L128 HydrophobicContact CG-CD1 3.7Å; E114-L128 HydrophobicContact CG-CD2 3.72Å; E114-L128 HydrophobicContact CG-CG 4.09Å
115	K	90.3	Very high	89.2	Confident	159 Å²	159	84.6 Å²	84.6	69%	0.691	46%	0.455	S	S	*	.	H	α-helix	trans	-61.9	-39.4	177.2	-70.3	179.7	-178.8	179.6	0	112.6	D111 K113 L118 S119	D111-K115 PolarHBondContact O-N 3.06Å; K113-K115 PolarHBondContact O-N 2.75Å; K115-L118 PolarHBondContact O-N 3.46Å; K115-S119 PolarHBondContact O-N 3.46Å; K115-S119 PolarHBondContact O-OG 2.98Å
116	Q	92.2	Very high	89	Confident	118 Å²	118	87 Å²	87	55%	0.551	46%	0.461	S	S	*	.	H	α-helix	trans	-63.9	-47	176.4	-172.2	-178.1	3.2	0	0	111.7	A112 K113 E114 L118 S119 N120	A112-Q116 PolarHBondContact O-N 2.72Å; K113-Q116 PolarHBondContact O-N 3.12Å; E114-Q116 VanDerWaalsContact C-N 3.33Å; E114-Q116 PolarHBondContact O-N 3.39Å; Q116-L118 VanDerWaalsContact C-N 3.28Å; Q116-L118 PolarHBondContact O-N 2.84Å; Q116-S119 WeakPolarHBondContact CA-OG 3.31Å; Q116-S119 PolarHBondContact O-N 2.72Å; Q116-S119 VanDerWaalsContact O-N 3.12Å; Q116-S119 PolarHBondContact O-OG 3.29Å; Q116-N120 PolarHBondContact O-N 3.11Å; Q116-N120 PolarHBondContact O-OD1 3.41Å
117	L	90.4	Very high	88.9	Confident	39 Å²	39	87.2 Å²	87.2	20%	0.204	45%	0.453	C	S	.	.	H	α-helix	trans	-65	-34	179.5	-69.8	174.3	0	0	0	112.3	L108 K113 E114 Y125 L128	L108-L117 HydrophobicContact CD1-CD1 3.85Å; K113-L117 WeakPolarHBondContact O-CB 3.44Å; K113-L117 VanDerWaalsContact O-CG 3.27Å; K113-L117 WeakPolarHBondContact O-CG 3.28Å; K113-L117 PolarHBondContact O-N 3.15Å; E114-L117 PolarHBondContact O-N 3.01Å; L117-Y125 HydrophobicContact CB-CD1 4.36Å; L117-Y125 HydrophobicContact CB-CD2 3.93Å; L117-Y125 HydrophobicContact CB-CE2 4.4Å; L117-Y125 HydrophobicContact CB-CG 3.94Å; L117-Y125 HydrophobicContact CD1-CD1 4.16Å; L117-Y125 HydrophobicContact CD1-CE1 3.93Å; L117-Y125 HydrophobicContact CD1-CE2 4.43Å; L117-Y125 HydrophobicContact CD2-CD2 4.06Å; L117-Y125 HydrophobicContact CD2-CE2 3.69Å; L117-Y125 HydrophobicContact CG-CD2 4.41Å; L117-Y125 HydrophobicContact CG-CE2 4.39Å; L117-L128 HydrophobicContact CB-CD1 4.26Å
118	L	87.6	Confident	88.8	Confident	69 Å²	69	86.3 Å²	86.3	36%	0.361	45%	0.446	S	S	.	.	H	α-helix	trans	-66.6	-41.9	172.3	-167.4	157.7	0	0	0	111.1	E114 K115 Q116 N120 G121 L128 K129	E114-L118 WeakPolarHBondContact O-CB 3.44Å; E114-L118 PolarHBondContact O-N 2.89Å; K115-L118 PolarHBondContact O-N 3.46Å; Q116-L118 VanDerWaalsContact C-N 3.28Å; Q116-L118 PolarHBondContact O-N 2.84Å; L118-N120 VanDerWaalsContact C-N 3.3Å; L118-N120 PolarHBondContact O-N 3.01Å; L118-G121 PolarHBondContact O-N 2.85Å; L118-L128 HydrophobicContact CB-CD1 4.43Å; L118-L128 HydrophobicContact CD1-CB 4.03Å; L118-K129 HydrophobicContact CD1-CG 3.89Å; L118-K129 HydrophobicContact CG-CG 4.3Å
119	S	88.5	Confident	88.7	Confident	91 Å²	91	89.8 Å²	89.8	64%	0.636	46%	0.458	S	S	*	.	H	α-helix	trans	-67.6	-26.5	178.9	70.8	0	0	0	0	114.1	K115 Q116 G121	K115-S119 PolarHBondContact O-N 3.46Å; K115-S119 PolarHBondContact O-OG 2.98Å; Q116-S119 WeakPolarHBondContact CA-OG 3.31Å; Q116-S119 PolarHBondContact O-N 2.72Å; Q116-S119 VanDerWaalsContact O-N 3.12Å; Q116-S119 PolarHBondContact O-OG 3.29Å; S119-G121 PolarHBondContact O-N 2.88Å
120	N	87.8	Confident	88.7	Confident	91 Å²	91	81 Å²	81	49%	0.487	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.8	176.1	-69.9	-10.5	0	0	0	112.9	Q116 L118 D122	Q116-N120 PolarHBondContact O-N 3.11Å; Q116-N120 PolarHBondContact O-OD1 3.41Å; L118-N120 VanDerWaalsContact C-N 3.3Å; L118-N120 PolarHBondContact O-N 3.01Å; N120-D122 VanDerWaalsContact C-N 3.27Å; N120-D122 PolarHBondContact O-N 3.25Å
121	G	81.6	Confident	88.7	Confident	52 Å²	52	83.5 Å²	83.5	54%	0.536	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	7.7	177.2	0	0	0	0	0	115	L118 S119	L118-G121 PolarHBondContact O-N 2.85Å; S119-G121 PolarHBondContact O-N 2.88Å
122	D	86	Confident	88.9	Confident	75 Å²	75	78.8 Å²	78.8	40%	0.401	41%	0.41	S	S	.	.			trans	-63.4	130.3	179.6	-79.6	-30	0	0	0	111.3	N120 K124 Y125	N120-D122 VanDerWaalsContact C-N 3.27Å; N120-D122 PolarHBondContact O-N 3.25Å; D122-K124 PolarHBondContact O-N 3.49Å; D122-Y125 HydrophobicContact CB-CD2 3.84Å; D122-Y125 HydrophobicContact CB-CE2 4.39Å; D122-Y125 PolarHBondContact O-N 3.21Å
123	P	82.1	Confident	89.1	Confident	91 Å²	91	75.4 Å²	75.4	59%	0.591	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-61.3	-22.7	179.6	24.3	-33.6	0	0	0	112.9	Y125	P123-Y125 VanDerWaalsContact C-N 3.27Å; P123-Y125 PolarHBondContact O-N 2.85Å
124	K	85.3	Confident	89.3	Confident	147 Å²	147	69.8 Å²	69.8	64%	0.639	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-62.2	-32.7	175.8	-173.5	-177.5	175.6	-166.1	0	112.9	D122 H127	D122-K124 PolarHBondContact O-N 3.49Å; K124-H127 PolarHBondContact O-CD2 3.17Å; K124-H127 PolarHBondContact O-NE2 2.96Å
125	Y	88.9	Confident	89.5	Confident	53 Å²	53	69.6 Å²	69.6	21%	0.208	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-107	7.9	-174.8	-58.1	-63.9	0	0	0	113.1	L117 D122 P123 H127 L128	L117-Y125 HydrophobicContact CB-CD1 4.36Å; L117-Y125 HydrophobicContact CB-CD2 3.93Å; L117-Y125 HydrophobicContact CB-CE2 4.4Å; L117-Y125 HydrophobicContact CB-CG 3.94Å; L117-Y125 HydrophobicContact CD1-CD1 4.16Å; L117-Y125 HydrophobicContact CD1-CE1 3.93Å; L117-Y125 HydrophobicContact CD1-CE2 4.43Å; L117-Y125 HydrophobicContact CD2-CD2 4.06Å; L117-Y125 HydrophobicContact CD2-CE2 3.69Å; L117-Y125 HydrophobicContact CG-CD2 4.41Å; L117-Y125 HydrophobicContact CG-CE2 4.39Å; D122-Y125 HydrophobicContact CB-CD2 3.84Å; D122-Y125 HydrophobicContact CB-CE2 4.39Å; D122-Y125 PolarHBondContact O-N 3.21Å; P123-Y125 VanDerWaalsContact C-N 3.27Å; P123-Y125 PolarHBondContact O-N 2.85Å; Y125-H127 PolarHBondContact O-N 3.36Å; Y125-H127 VanDerWaalsContact O-N 3.15Å; Y125-L128 HydrophobicContact CD1-CD1 4.5Å; Y125-L128 HydrophobicContact CG-CD1 4.5Å; Y125-L128 VanDerWaalsContact O-CB 3.31Å; Y125-L128 WeakPolarHBondContact O-CB 3.37Å; Y125-L128 VanDerWaalsContact O-CG 3.28Å; Y125-L128 WeakPolarHBondContact O-CG 3.32Å; Y125-L128 PolarHBondContact O-N 3.42Å
126	Q	87.1	Confident	89.8	Confident	89 Å²	89	62 Å²	62	42%	0.416	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-58.7	-27.6	176.3	-77.9	176.4	-6.5	0	0	113	L128 K129	Q126-L128 PolarHBondContact O-N 3.47Å; Q126-L128 VanDerWaalsContact O-N 3.13Å; Q126-K129 PolarHBondContact O-N 3.21Å; Q126-K129 VanDerWaalsContact O-N 3.16Å
127	H	89.5	Confident	90	Very high	35 Å²	35	57.1 Å²	57.1	16%	0.162	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-59.5	-22.7	176	67.9	77	0	0	0	113.3	L103 G104 K124 Y125 K129 Q130	L103-H127 HydrophobicContact CB-CB 4.18Å; G104-H127 WeakPolarHBondContact CA-O 3.39Å; G104-H127 PolarHBondContact N-ND1 3.04Å; G104-H127 PolarHBondContact N-O 3.35Å; K124-H127 PolarHBondContact O-CD2 3.17Å; K124-H127 PolarHBondContact O-NE2 2.96Å; Y125-H127 PolarHBondContact O-N 3.36Å; Y125-H127 VanDerWaalsContact O-N 3.15Å; H127-K129 PolarHBondContact O-N 3.13Å; H127-Q130 WeakPolarHBondContact O-CB 3.18Å; H127-Q130 PolarHBondContact O-N 3.19Å
128	L	91.3	Very high	90.2	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.021	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-64.8	-18.3	179.1	-61.9	174.6	0	0	0	112.9	G104 L108 E114 L117 L118 Y125 Q126 Q130	G104-L128 WeakPolarHBondContact O-CD2 3.48Å; L108-L128 HydrophobicContact CD1-CD1 4.25Å; L108-L128 HydrophobicContact CD1-CD2 4.17Å; E114-L128 HydrophobicContact CG-CB 4.28Å; E114-L128 HydrophobicContact CG-CD1 3.7Å; E114-L128 HydrophobicContact CG-CD2 3.72Å; E114-L128 HydrophobicContact CG-CG 4.09Å; L117-L128 HydrophobicContact CB-CD1 4.26Å; L118-L128 HydrophobicContact CB-CD1 4.43Å; L118-L128 HydrophobicContact CD1-CB 4.03Å; Y125-L128 HydrophobicContact CD1-CD1 4.5Å; Y125-L128 HydrophobicContact CG-CD1 4.5Å; Y125-L128 VanDerWaalsContact O-CB 3.31Å; Y125-L128 WeakPolarHBondContact O-CB 3.37Å; Y125-L128 VanDerWaalsContact O-CG 3.28Å; Y125-L128 WeakPolarHBondContact O-CG 3.32Å; Y125-L128 PolarHBondContact O-N 3.42Å; Q126-L128 PolarHBondContact O-N 3.47Å; Q126-L128 VanDerWaalsContact O-N 3.13Å; L128-Q130 VanDerWaalsContact C-N 3.27Å
129	K	88.2	Confident	90.5	Very high	138 Å²	138	56.3 Å²	56.3	60%	0.6	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-73	-19.9	171.8	-63.9	179.4	-179.4	-179.7	0	113	L118 Q126 H127	L118-K129 HydrophobicContact CD1-CG 3.89Å; L118-K129 HydrophobicContact CG-CG 4.3Å; Q126-K129 PolarHBondContact O-N 3.21Å; Q126-K129 VanDerWaalsContact O-N 3.16Å; H127-K129 PolarHBondContact O-N 3.13Å
130	Q	89	Confident	90.7	Very high	54 Å²	54	52.4 Å²	52.4	25%	0.252	27%	0.269	S	S	.	.	S	Bend	trans	-86.2	158.8	-176.6	-60.5	178.3	-12.7	0	0	110.7	G104 A105 H127 L128 H133	G104-Q130 CarbonylContact C-O 3.55Å; G104-Q130 WeakPolarHBondContact CA-O 3.4Å; A105-Q130 PolarHBondContact N-O 2.84Å; H127-Q130 WeakPolarHBondContact O-CB 3.18Å; H127-Q130 PolarHBondContact O-N 3.19Å; L128-Q130 VanDerWaalsContact C-N 3.27Å; Q130-H133 PolarHBondContact OE1-CE1 2.7Å
131	K	92.3	Very high	90.9	Very high	121 Å²	121	50.2 Å²	50.2	53%	0.526	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-59	153	171.4	-67.9	-165.3	175.6	-157.8	0	110.9	E70 G104 H133	E70-K131 IonicContact OE1-NZ 3.32Å; E70-K131 PolarHBondContact OE1-NZ 3.24Å; E70-K131 IonicContact OE2-NZ 3.89Å; G104-K131 WeakPolarHBondContact CA-O 3.45Å; K131-H133 PolarHBondContact O-N 2.86Å; K131-H133 PolarHBondContact O-ND1 3.38Å
132	L	95	Very high	91.4	Very high	10 Å²	10	47.9 Å²	47.9	5%	0.052	24%	0.236	C	C	.	.	S	Bend	trans	-56	121.7	176.6	-174.6	65.1	0	0	0	110.4	I67 V78 I102 A105	I67-L132 HydrophobicContact CB-CB 4.47Å; I67-L132 HydrophobicContact CB-CD2 4.08Å; I67-L132 HydrophobicContact CB-CG 4.02Å; I67-L132 HydrophobicContact CD1-CD1 4.44Å; I67-L132 HydrophobicContact CD1-CD2 4.24Å; I67-L132 HydrophobicContact CD1-CG 3.86Å; I67-L132 HydrophobicContact CG1-CG 4.46Å; I67-L132 HydrophobicContact CG2-CD2 3.81Å; I67-L132 HydrophobicContact CG2-CG 4.31Å; I67-L132 PolarHBondContact N-O 2.84Å; V78-L132 HydrophobicContact CG2-CD1 4.07Å; V78-L132 HydrophobicContact CG2-CD2 3.98Å; I102-L132 HydrophobicContact CG2-CD1 4.04Å; A105-L132 WeakPolarHBondContact O-CB 3.21Å
133	H	95.2	Very high	91.7	Very high	10 Å²	10	47.8 Å²	47.8	5%	0.046	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	153.7	-177.3	64.8	-83.7	0	0	0	112.3	I65 L103 Q130 K131	I65-H133 CarbonylContact O-C 3.58Å; I65-H133 WeakPolarHBondContact O-CA 3.36Å; I65-H133 VanDerWaalsContact O-CB 3.26Å; I65-H133 WeakPolarHBondContact O-CB 3.21Å; L103-H133 PolarHBondContact N-O 3.33Å; L103-H133 PolarHBondContact O-N 2.89Å; L103-H133 VanDerWaalsContact O-O 3.06Å; Q130-H133 PolarHBondContact OE1-CE1 2.7Å; K131-H133 PolarHBondContact O-N 2.86Å; K131-H133 PolarHBondContact O-ND1 3.38Å
134	L	96.3	Very high	92.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.2	168.2	-173.5	71.9	0	0	0	109	I65 I67 L81 L89 M100 I102 V136 V156	I65-L134 HydrophobicContact CB-CB 4.31Å; I65-L134 HydrophobicContact CD1-CD2 4.21Å; I65-L134 PolarHBondContact N-O 2.84Å; I65-L134 PolarHBondContact O-N 3.17Å; I67-L134 HydrophobicContact CD1-CB 4.5Å; L81-L134 HydrophobicContact CD2-CD2 4.49Å; L89-L134 HydrophobicContact CD1-CD1 4.22Å; M100-L134 HydrophobicContact CB-CD1 4.3Å; M100-L134 HydrophobicContact SD-CD2 4.29Å; I102-L134 HydrophobicContact CG1-CD1 3.59Å; L134-V136 HydrophobicContact CD2-CG2 4.2Å; L134-V136 HydrophobicContact CG-CG2 4.29Å; L134-V156 HydrophobicContact CD2-CB 4.41Å; L134-V156 HydrophobicContact CD2-CG1 3.75Å; L134-V156 HydrophobicContact CD2-CG2 3.71Å
135	Q	95.5	Very high	92.7	Very high	15 Å²	15	38.5 Å²	38.5	7%	0.07	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.4	171.1	-171	-176.3	-76.1	0	0	109.5	R62 A63 M100 A101 L103 D137	R62-Q135 VanDerWaalsContact CD-CD 3.5Å; R62-Q135 HydrophobicContact CG-CG 3.81Å; R62-Q135 VanDerWaalsContact NE-CD 3.32Å; R62-Q135 VanDerWaalsContact NH2-NE2 3.15Å; A63-Q135 WeakPolarHBondContact O-CA 3.25Å; M100-Q135 CarbonylContact C-O 3Å; M100-Q135 VanDerWaalsContact CA-O 3.27Å; M100-Q135 WeakPolarHBondContact CA-O 3.45Å; A101-Q135 PolarHBondContact N-O 2.98Å; A101-Q135 PolarHBondContact O-N 3.03Å; L103-Q135 HydrophobicContact CD1-CB 3.94Å; Q135-D137 PolarHBondContact NE2-OD1 3.2Å; Q135-D137 PolarHBondContact NE2-OD2 3.25Å
136	V	96.9	Very high	92.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	116.8	176.2	-173.7	0	0	0	0	109	R62 A63 I65 T98 M100 L134 L149 A152	R62-V136 CarbonylContact C-O 3.51Å; R62-V136 VanDerWaalsContact CA-O 3.3Å; R62-V136 WeakPolarHBondContact CA-O 3.04Å; A63-V136 PolarHBondContact N-O 3.37Å; A63-V136 PolarHBondContact O-N 3.31Å; I65-V136 HydrophobicContact CD1-CG2 3.81Å; T98-V136 HydrophobicContact CG2-CG1 4.16Å; M100-V136 HydrophobicContact CE-CG1 4.04Å; M100-V136 HydrophobicContact CE-CG2 4.24Å; M100-V136 HydrophobicContact CG-CG1 4.23Å; M100-V136 HydrophobicContact CG-CG2 4.13Å; L134-V136 HydrophobicContact CD2-CG2 4.2Å; L134-V136 HydrophobicContact CG-CG2 4.29Å; V136-L149 HydrophobicContact CB-CD1 4.02Å; V136-L149 HydrophobicContact CG1-CD1 3.75Å; V136-A152 HydrophobicContact CG1-CB 3.86Å
137	D	95.4	Very high	93.3	Very high	15 Å²	15	38.2 Å²	38.2	8%	0.08	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	128.8	178.3	-72.7	-7.7	0	0	0	109.7	K60 V61 R62 K99 Q135	K60-D137 VanDerWaalsContact CE-OD2 3.31Å; K60-D137 WeakPolarHBondContact CE-OD2 3.38Å; K60-D137 IonicContact NZ-OD2 2.87Å; V61-D137 WeakPolarHBondContact O-CA 3.29Å; R62-D137 WeakPolarHBondContact CB-OD1 3.48Å; R62-D137 WeakPolarHBondContact CD-OD1 3.49Å; R62-D137 WeakPolarHBondContact CG-OD1 3.37Å; R62-D137 IonicContact CZ-OD1 3.63Å; R62-D137 IonicContact CZ-OD2 2.67Å; R62-D137 IonicContact NE-OD1 3.08Å; R62-D137 PolarHBondContact NE-OD1 2.95Å; R62-D137 IonicContact NE-OD2 2.81Å; R62-D137 IonicContact NH2-OD1 3.94Å; R62-D137 IonicContact NH2-OD2 3.22Å; R62-D137 PolarHBondContact NH2-OD2 3.3Å; K99-D137 HydrophobicContact CB-CB 4.29Å; K99-D137 PolarHBondContact N-O 2.92Å; K99-D137 PolarHBondContact O-N 3.31Å; Q135-D137 PolarHBondContact NE2-OD1 3.2Å; Q135-D137 PolarHBondContact NE2-OD2 3.25Å
138	S	95.4	Very high	93.6	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	138.5	173	-173.9	0	0	0	0	109.5	K60 V61 S145 R148	K60-S138 CarbonylContact C-O 3.56Å; K60-S138 WeakPolarHBondContact CA-O 3.34Å; V61-S138 PolarHBondContact N-O 3.44Å; V61-S138 PolarHBondContact O-N 3.48Å; S138-S145 WeakPolarHBondContact CB-O 3.14Å; S138-S145 WeakPolarHBondContact OG-CA 3.48Å; S138-S145 PolarHBondContact OG-O 3.38Å; S138-S145 VanDerWaalsContact OG-O 3.11Å; S138-R148 WeakPolarHBondContact OG-CB 3.47Å
139	L	93.4	Very high	93.9	Very high	91 Å²	91	39.4 Å²	39.4	48%	0.476	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	127.1	177.7	-176.8	75.5	0	0	0	109.7	I3 K60 R148	I3-L139 HydrophobicContact CG2-CD2 4.03Å; K60-L139 HydrophobicContact CB-CD1 3.9Å; L139-R148 PolarHBondContact O-NH1 2.87Å; L139-R148 VanDerWaalsContact O-NH1 3.09Å
140	G	92.4	Very high	94.2	Very high	8 Å²	8	35.6 Å²	35.6	8%	0.082	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.1	-174.7	-177.2	0	0	0	0	0	112	P58 V59 S145	P58-G140 CarbonylContact C-O 3.56Å; P58-G140 WeakPolarHBondContact CA-O 3.48Å; V59-G140 PolarHBondContact N-O 3.31Å; V59-G140 PolarHBondContact O-N 3.46Å; V59-G140 VanDerWaalsContact O-O 3.13Å; G140-S145 VanDerWaalsContact CA-OG 3.28Å; G140-S145 WeakPolarHBondContact CA-OG 3.47Å; G140-S145 PolarHBondContact N-OG 3.04Å; G140-S145 PolarHBondContact O-OG 3.4Å
141	P	92.3	Very high	94.6	Very high	45 Å²	45	35.8 Å²	35.8	29%	0.292	19%	0.194	S	C	.	.	S	Bend	trans	-52.6	149.6	172.4	-24.4	34.4	0	0	0	111.7	S143 E144 S145	P141-S143 PolarHBondContact O-N 3.12Å; P141-E144 HydrophobicContact CB-CB 4.45Å; P141-E144 PolarHBondContact O-N 3.07Å; P141-E144 VanDerWaalsContact O-N 3.14Å; P141-S145 WeakPolarHBondContact O-CB 3.18Å; P141-S145 PolarHBondContact O-N 3.05Å; P141-S145 PolarHBondContact O-OG 3.39Å
142	P	91.9	Very high	94.7	Very high	4 Å²	4	30 Å²	30	3%	0.026	17%	0.169	C	C	.	.	H	α-helix	trans	-51.2	-48.1	-175.1	-29.5	36.3	0	0	0	114.3	F51 L53 N56 V59 E144 S145 C146	F51-P142 HydrophobicContact CB-CB 4.11Å; F51-P142 HydrophobicContact CB-CG 4.39Å; F51-P142 HydrophobicContact CD1-CB 3.83Å; F51-P142 HydrophobicContact CD1-CG 4.26Å; F51-P142 HydrophobicContact CG-CB 4.13Å; L53-P142 HydrophobicContact CD2-CB 4.14Å; N56-P142 WeakPolarHBondContact OD1-CD 3.45Å; V59-P142 HydrophobicContact CG1-CG 4.34Å; V59-P142 HydrophobicContact CG2-CB 4.17Å; V59-P142 HydrophobicContact CG2-CG 3.92Å; P142-E144 PolarHBondContact O-N 3.09Å; P142-S145 PolarHBondContact O-N 3.01Å; P142-C146 PolarHBondContact O-N 3.46Å; P142-C146 VanDerWaalsContact O-N 3.15Å; P142-C146 PolarHBondContact O-SG 2.68Å
143	S	92.4	Very high	94.8	Very high	73 Å²	73	33 Å²	33	51%	0.51	18%	0.184	S	C	.	.	H	α-helix	trans	-62.8	-44.9	179.8	-50.6	0	0	0	0	112.5	P141 Y147	P141-S143 PolarHBondContact O-N 3.12Å; S143-Y147 WeakPolarHBondContact O-CB 3.39Å; S143-Y147 PolarHBondContact O-N 3.5Å; S143-Y147 VanDerWaalsContact O-N 3.12Å
144	E	93.6	Very high	94.7	Very high	42 Å²	42	34.8 Å²	34.8	20%	0.196	20%	0.201	C	C	.	.	H	α-helix	trans	-71.7	-40.4	-178.5	-164.8	-173.2	-179.5	0	0	111.5	P141 P142 C146 Y147 R148	P141-E144 HydrophobicContact CB-CB 4.45Å; P141-E144 PolarHBondContact O-N 3.07Å; P141-E144 VanDerWaalsContact O-N 3.14Å; P142-E144 PolarHBondContact O-N 3.09Å; E144-C146 VanDerWaalsContact C-N 3.35Å; E144-C146 PolarHBondContact O-N 3.35Å; E144-Y147 PolarHBondContact O-N 2.95Å; E144-R148 HydrophobicContact CG-CG 4.35Å; E144-R148 WeakPolarHBondContact O-CB 3.39Å; E144-R148 VanDerWaalsContact O-CG 3.3Å; E144-R148 WeakPolarHBondContact O-CG 3.5Å; E144-R148 PolarHBondContact O-N 3.05Å; E144-R148 IonicContact OE1-CZ 3.52Å; E144-R148 IonicContact OE1-NE 2.78Å; E144-R148 PolarHBondContact OE1-NE 3.3Å; E144-R148 IonicContact OE1-NH2 3.85Å; E144-R148 PolarHBondContact OE1-NH2 3.1Å; E144-R148 IonicContact OE2-CZ 3.53Å; E144-R148 IonicContact OE2-NH2 2.7Å; E144-R148 PolarHBondContact OE2-NH2 3.43Å
145	S	93.8	Very high	94.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.2	-45	179.2	-73.4	0	0	0	0	111.8	V59 S138 G140 P141 P142 L149	V59-S145 PolarHBondContact O-OG 3.26Å; S138-S145 WeakPolarHBondContact CB-O 3.14Å; S138-S145 WeakPolarHBondContact OG-CA 3.48Å; S138-S145 PolarHBondContact OG-O 3.38Å; S138-S145 VanDerWaalsContact OG-O 3.11Å; G140-S145 VanDerWaalsContact CA-OG 3.28Å; G140-S145 WeakPolarHBondContact CA-OG 3.47Å; G140-S145 PolarHBondContact N-OG 3.04Å; G140-S145 PolarHBondContact O-OG 3.4Å; P141-S145 WeakPolarHBondContact O-CB 3.18Å; P141-S145 PolarHBondContact O-N 3.05Å; P141-S145 PolarHBondContact O-OG 3.39Å; P142-S145 PolarHBondContact O-N 3.01Å; S145-L149 WeakPolarHBondContact O-CB 3.36Å; S145-L149 PolarHBondContact O-N 3.49Å
146	C	93.7	Very high	94.5	Very high	51 Å²	51	36.5 Å²	36.5	35%	0.345	21%	0.209	S	C	.	.	H	α-helix	trans	-66.2	-41.7	176.4	-68.4	0	0	0	0	111.9	P142 E144 L149 A150	P142-C146 PolarHBondContact O-N 3.46Å; P142-C146 VanDerWaalsContact O-N 3.15Å; P142-C146 PolarHBondContact O-SG 2.68Å; E144-C146 VanDerWaalsContact C-N 3.35Å; E144-C146 PolarHBondContact O-N 3.35Å; C146-L149 PolarHBondContact O-N 3.15Å; C146-A150 PolarHBondContact O-N 2.98Å
147	Y	95.6	Very high	94.3	Very high	85 Å²	85	45.1 Å²	45.1	33%	0.333	24%	0.242	S	C	.	.	H	α-helix	trans	-60.9	-49	175.1	172.9	-99.7	0	0	0	112.2	S143 E144 L149 A150 H151 Y254 P255	S143-Y147 WeakPolarHBondContact O-CB 3.39Å; S143-Y147 PolarHBondContact O-N 3.5Å; S143-Y147 VanDerWaalsContact O-N 3.12Å; E144-Y147 PolarHBondContact O-N 2.95Å; Y147-L149 VanDerWaalsContact C-N 3.26Å; Y147-L149 PolarHBondContact O-N 3.16Å; Y147-A150 PolarHBondContact O-N 3.12Å; Y147-H151 WeakPolarHBondContact O-CB 3.45Å; Y147-H151 PolarHBondContact O-N 2.98Å; Y147-Y254 HydrophobicContact CD1-CD1 4.12Å; Y147-Y254 AromaticContact CD1-CE1 3.99Å; Y147-Y254 HydrophobicContact CD1-CE1 3.99Å; Y147-Y254 AromaticContact CD2-CD1 3.56Å; Y147-Y254 HydrophobicContact CD2-CD1 3.56Å; Y147-Y254 AromaticContact CD2-CE1 3.94Å; Y147-Y254 HydrophobicContact CD2-CE1 3.94Å; Y147-Y254 HydrophobicContact CE1-CD1 4.37Å; Y147-Y254 AromaticContact CE2-CD1 3.85Å; Y147-Y254 HydrophobicContact CE2-CD1 3.85Å; Y147-Y254 AromaticContact CG-CD1 3.72Å; Y147-Y254 HydrophobicContact CG-CD1 3.72Å; Y147-Y254 AromaticContact CG-CE1 3.62Å; Y147-Y254 HydrophobicContact CG-CE1 3.62Å; Y147-P255 HydrophobicContact CE2-CG 4.37Å; Y147-P255 VanDerWaalsContact OH-CD 3.23Å; Y147-P255 WeakPolarHBondContact OH-CD 3.5Å; Y147-P255 WeakPolarHBondContact OH-CG 3.37Å
148	R	96.8	Very high	94.1	Very high	43 Å²	43	50.9 Å²	50.9	16%	0.162	27%	0.266	C	S	.	.	H	α-helix	trans	-58.9	-39.6	177	-72.4	175.8	-177	-176.9	5.6	111.7	T96 T98 S138 L139 E144 A152	T96-R148 WeakPolarHBondContact O-CB 3.48Å; T96-R148 WeakPolarHBondContact O-CG 3.26Å; T98-R148 HydrophobicContact CG2-CB 4.06Å; S138-R148 WeakPolarHBondContact OG-CB 3.47Å; L139-R148 PolarHBondContact O-NH1 2.87Å; L139-R148 VanDerWaalsContact O-NH1 3.09Å; E144-R148 HydrophobicContact CG-CG 4.35Å; E144-R148 WeakPolarHBondContact O-CB 3.39Å; E144-R148 VanDerWaalsContact O-CG 3.3Å; E144-R148 WeakPolarHBondContact O-CG 3.5Å; E144-R148 PolarHBondContact O-N 3.05Å; E144-R148 IonicContact OE1-CZ 3.52Å; E144-R148 IonicContact OE1-NE 2.78Å; E144-R148 PolarHBondContact OE1-NE 3.3Å; E144-R148 IonicContact OE1-NH2 3.85Å; E144-R148 PolarHBondContact OE1-NH2 3.1Å; E144-R148 IonicContact OE2-CZ 3.53Å; E144-R148 IonicContact OE2-NH2 2.7Å; E144-R148 PolarHBondContact OE2-NH2 3.43Å; R148-A152 WeakPolarHBondContact O-CB 3.27Å; R148-A152 PolarHBondContact O-N 3.3Å
149	L	95.8	Very high	93.9	Very high	22 Å²	22	52.8 Å²	52.8	12%	0.115	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-47.7	176.1	-169.4	67.4	0	0	0	111.6	V61 A63 V136 S145 C146 Y147 H151 A152 L153	V61-L149 HydrophobicContact CB-CD2 4.46Å; V61-L149 HydrophobicContact CG1-CD2 3.61Å; A63-L149 HydrophobicContact CB-CD1 3.76Å; A63-L149 HydrophobicContact CB-CD2 4.14Å; A63-L149 HydrophobicContact CB-CG 4.21Å; V136-L149 HydrophobicContact CB-CD1 4.02Å; V136-L149 HydrophobicContact CG1-CD1 3.75Å; S145-L149 WeakPolarHBondContact O-CB 3.36Å; S145-L149 PolarHBondContact O-N 3.49Å; C146-L149 PolarHBondContact O-N 3.15Å; Y147-L149 VanDerWaalsContact C-N 3.26Å; Y147-L149 PolarHBondContact O-N 3.16Å; L149-H151 VanDerWaalsContact C-N 3.35Å; L149-H151 PolarHBondContact O-N 2.9Å; L149-A152 WeakPolarHBondContact O-CB 3.42Å; L149-A152 PolarHBondContact O-N 3.18Å; L149-L153 WeakPolarHBondContact O-CG 3.48Å; L149-L153 PolarHBondContact O-N 3.26Å
150	A	95.8	Very high	93.7	Very high	58 Å²	58	49 Å²	49	48%	0.479	26%	0.256	S	S	.	.	H	α-helix	trans	-61.2	-42.8	177	0	0	0	0	0	112.1	C146 Y147 A152 L153 A154	C146-A150 PolarHBondContact O-N 2.98Å; Y147-A150 PolarHBondContact O-N 3.12Å; A150-A152 PolarHBondContact O-N 2.98Å; A150-L153 PolarHBondContact O-N 3.26Å; A150-A154 PolarHBondContact O-N 3.35Å
151	H	96.1	Very high	93.2	Very high	58 Å²	58	52 Å²	52	27%	0.269	27%	0.27	S	S	.	.	H	α-helix	trans	-61	-44.2	175.1	-176.5	-137	0	0	0	111.7	Y147 L149 L153 A154 E155	Y147-H151 WeakPolarHBondContact O-CB 3.45Å; Y147-H151 PolarHBondContact O-N 2.98Å; L149-H151 VanDerWaalsContact C-N 3.35Å; L149-H151 PolarHBondContact O-N 2.9Å; H151-L153 PolarHBondContact O-N 3.21Å; H151-A154 PolarHBondContact O-N 2.96Å; H151-E155 PolarHBondContact O-N 2.94Å; H151-E155 VanDerWaalsContact O-N 3.07Å
152	A	96.4	Very high	92.2	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.1	-41.3	174.4	0	0	0	0	0	113.2	T96 T98 M100 V136 R148 L149 A150 A154 E155 V156	T96-A152 HydrophobicContact CG2-CB 3.99Å; T98-A152 HydrophobicContact CG2-CB 3.92Å; M100-A152 HydrophobicContact CE-CB 3.54Å; V136-A152 HydrophobicContact CG1-CB 3.86Å; R148-A152 WeakPolarHBondContact O-CB 3.27Å; R148-A152 PolarHBondContact O-N 3.3Å; L149-A152 WeakPolarHBondContact O-CB 3.42Å; L149-A152 PolarHBondContact O-N 3.18Å; A150-A152 PolarHBondContact O-N 2.98Å; A152-A154 VanDerWaalsContact C-N 3.32Å; A152-A154 PolarHBondContact O-N 2.97Å; A152-E155 PolarHBondContact O-N 2.91Å; A152-V156 WeakPolarHBondContact O-CB 3.41Å; A152-V156 VanDerWaalsContact O-CG2 3.25Å; A152-V156 WeakPolarHBondContact O-CG2 3.44Å; A152-V156 PolarHBondContact O-N 3.24Å
153	L	95.4	Very high	90.7	Very high	71 Å²	71	62 Å²	62	37%	0.372	32%	0.319	S	S	.	.	H	α-helix	trans	-61.8	-40.5	175.5	-68.5	174.5	0	0	0	111.8	A63 I65 L149 A150 H151 R157	A63-L153 HydrophobicContact CB-CD2 4.44Å; I65-L153 HydrophobicContact CD1-CD2 3.4Å; I65-L153 VanDerWaalsContact CD1-CD2 3.4Å; I65-L153 HydrophobicContact CG1-CD2 3.65Å; L149-L153 WeakPolarHBondContact O-CG 3.48Å; L149-L153 PolarHBondContact O-N 3.26Å; A150-L153 PolarHBondContact O-N 3.26Å; H151-L153 PolarHBondContact O-N 3.21Å; L153-R157 VanDerWaalsContact O-CB 3.28Å; L153-R157 WeakPolarHBondContact O-CB 2.93Å; L153-R157 PolarHBondContact O-N 2.89Å
154	A	94.5	Very high	88.4	Confident	49 Å²	49	67.1 Å²	67.1	41%	0.405	34%	0.335	S	S	.	.	H	α-helix	trans	-64.2	-44.4	177.2	0	0	0	0	0	112.2	A150 H151 A152 R157 K158	A150-A154 PolarHBondContact O-N 3.35Å; H151-A154 PolarHBondContact O-N 2.96Å; A152-A154 VanDerWaalsContact C-N 3.32Å; A152-A154 PolarHBondContact O-N 2.97Å; A154-R157 PolarHBondContact O-N 3.21Å; A154-K158 WeakPolarHBondContact O-CG 3.4Å; A154-K158 PolarHBondContact O-N 3.38Å
155	E	93.8	Very high	85.8	Confident	49 Å²	49	70.6 Å²	70.6	23%	0.229	36%	0.359	C	S	.	.	H	α-helix	trans	-66.2	-44.5	177.2	-70.6	-56.1	126.9	0	0	112.4	V92 T96 H151 A152 R157 K158 I159	V92-E155 HydrophobicContact CG1-CB 3.97Å; T96-E155 HydrophobicContact CG2-CB 4.45Å; T96-E155 HydrophobicContact CG2-CG 4.12Å; H151-E155 PolarHBondContact O-N 2.94Å; H151-E155 VanDerWaalsContact O-N 3.07Å; A152-E155 PolarHBondContact O-N 2.91Å; E155-R157 VanDerWaalsContact C-N 3.3Å; E155-R157 PolarHBondContact O-N 3.35Å; E155-K158 WeakPolarHBondContact O-CB 3.32Å; E155-K158 PolarHBondContact O-N 3.16Å; E155-K158 IonicContact OE1-NZ 2.7Å; E155-K158 PolarHBondContact OE1-NZ 2.56Å; E155-K158 IonicContact OE2-NZ 3.79Å; E155-I159 PolarHBondContact O-N 2.89Å
156	V	94.2	Very high	83	Confident	2 Å²	2	78.5 Å²	78.5	1%	0.012	40%	0.396	C	S	.	.	H	α-helix	trans	-63.3	-37.9	177.8	170.9	0	0	0	0	111.2	I65 L81 V92 M100 L134 A152 K158 I159 M160	I65-V156 HydrophobicContact CD1-CB 4.36Å; I65-V156 HydrophobicContact CD1-CG1 3.93Å; L81-V156 HydrophobicContact CD2-CG1 4.24Å; V92-V156 HydrophobicContact CG1-CG2 4.46Å; M100-V156 HydrophobicContact CE-CG2 3.88Å; M100-V156 HydrophobicContact SD-CG2 4.07Å; L134-V156 HydrophobicContact CD2-CB 4.41Å; L134-V156 HydrophobicContact CD2-CG1 3.75Å; L134-V156 HydrophobicContact CD2-CG2 3.71Å; A152-V156 WeakPolarHBondContact O-CB 3.41Å; A152-V156 VanDerWaalsContact O-CG2 3.25Å; A152-V156 WeakPolarHBondContact O-CG2 3.44Å; A152-V156 PolarHBondContact O-N 3.24Å; V156-K158 VanDerWaalsContact C-N 3.3Å; V156-K158 PolarHBondContact O-N 3.02Å; V156-I159 PolarHBondContact O-N 2.85Å; V156-I159 VanDerWaalsContact O-N 3.1Å; V156-M160 HydrophobicContact CG1-CG 4.05Å; V156-M160 HydrophobicContact CG1-SD 3.54Å; V156-M160 VanDerWaalsContact CG1-SD 3.54Å; V156-M160 WeakPolarHBondContact O-CG 3.19Å; V156-M160 PolarHBondContact O-N 2.98Å
157	R	92.9	Very high	80.5	Confident	181 Å²	181	79.4 Å²	79.4	68%	0.683	40%	0.402	S	S	*	.	H	α-helix	trans	-57.6	-41.2	176.9	-174.5	-179.2	177.9	-176.8	-1	112.1	L153 A154 E155 I159 M160 L161	L153-R157 VanDerWaalsContact O-CB 3.28Å; L153-R157 WeakPolarHBondContact O-CB 2.93Å; L153-R157 PolarHBondContact O-N 2.89Å; A154-R157 PolarHBondContact O-N 3.21Å; E155-R157 VanDerWaalsContact C-N 3.3Å; E155-R157 PolarHBondContact O-N 3.35Å; R157-I159 VanDerWaalsContact C-N 3.27Å; R157-I159 PolarHBondContact O-N 3.06Å; R157-M160 PolarHBondContact O-N 3.34Å; R157-L161 HydrophobicContact CG-CD1 3.87Å; R157-L161 PolarHBondContact O-N 3.35Å
158	K	91.2	Very high	78	Confident	136 Å²	136	78.1 Å²	78.1	59%	0.591	40%	0.402	S	S	*	.	H	α-helix	trans	-63.2	-31.5	177.4	-63.5	169.8	-174.7	172.4	0	112.9	A154 E155 V156	A154-K158 WeakPolarHBondContact O-CG 3.4Å; A154-K158 PolarHBondContact O-N 3.38Å; E155-K158 WeakPolarHBondContact O-CB 3.32Å; E155-K158 PolarHBondContact O-N 3.16Å; E155-K158 IonicContact OE1-NZ 2.7Å; E155-K158 PolarHBondContact OE1-NZ 2.56Å; E155-K158 IonicContact OE2-NZ 3.79Å; V156-K158 VanDerWaalsContact C-N 3.3Å; V156-K158 PolarHBondContact O-N 3.02Å
159	I	90.7	Very high	75.7	Confident	40 Å²	40	80 Å²	80	21%	0.205	43%	0.428	C	S	.	.	H	α-helix	trans	-82.4	-39.6	-179	-58.9	166.9	0	0	0	111	K80 L81 T88 V92 E155 V156 R157	K80-I159 HydrophobicContact CB-CG2 4.44Å; L81-I159 HydrophobicContact CD2-CB 4.34Å; L81-I159 HydrophobicContact CD2-CG2 3.97Å; T88-I159 HydrophobicContact CG2-CD1 4.05Å; V92-I159 HydrophobicContact CG2-CD1 3.69Å; E155-I159 PolarHBondContact O-N 2.89Å; V156-I159 PolarHBondContact O-N 2.85Å; V156-I159 VanDerWaalsContact O-N 3.1Å; R157-I159 VanDerWaalsContact C-N 3.27Å; R157-I159 PolarHBondContact O-N 3.06Å
160	M	88.1	Confident	73.7	Confident	13 Å²	13	86.6 Å²	86.6	6%	0.064	46%	0.458	C	S	.	.	H	α-helix	trans	-76.7	-44.4	-176.5	-69.8	-177.4	66.7	0	0	112.2	I65 I67 P68 F77 L81 V156 R157	I65-M160 HydrophobicContact CG2-SD 4.2Å; I67-M160 HydrophobicContact CB-CE 4.2Å; I67-M160 HydrophobicContact CG1-CE 3.83Å; I67-M160 HydrophobicContact CG2-CE 4.3Å; P68-M160 HydrophobicContact CG-CE 4.36Å; F77-M160 HydrophobicContact CD1-CB 4.42Å; F77-M160 HydrophobicContact CD1-CG 4.47Å; F77-M160 HydrophobicContact CE1-CB 4.48Å; F77-M160 WeakPolarHBondContact CE1-O 3.46Å; L81-M160 HydrophobicContact CD2-CG 4.05Å; V156-M160 HydrophobicContact CG1-CG 4.05Å; V156-M160 HydrophobicContact CG1-SD 3.54Å; V156-M160 VanDerWaalsContact CG1-SD 3.54Å; V156-M160 WeakPolarHBondContact O-CG 3.19Å; V156-M160 PolarHBondContact O-N 2.98Å; R157-M160 PolarHBondContact O-N 3.34Å
161	L	82.8	Confident	71.5	Confident	71 Å²	71	89.4 Å²	89.4	37%	0.372	46%	0.461	S	S	.	.	S	Bend	trans	-96.5	126	179.7	-63.3	169.1	0	0	0	108.3	R157 E163	R157-L161 HydrophobicContact CG-CD1 3.87Å; R157-L161 PolarHBondContact O-N 3.35Å; L161-E163 PolarHBondContact O-N 2.88Å; L161-E163 VanDerWaalsContact O-N 3.1Å
162	P	70.8	Confident	69.3	Low	85 Å²	85	95.2 Å²	95.2	55%	0.552	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-58.3	121.8	164.7	25.9	-29.8	0	0	0	107.1	Q164	P162-Q164 PolarHBondContact O-N 2.94Å
163	E	60.2	Low	67.6	Low	172 Å²	172	99.3 Å²	99.3	80%	0.804	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-52.3	128.1	161.9	-157.6	167.8	-157.2	0	0	105.4	L161 T165	L161-E163 PolarHBondContact O-N 2.88Å; L161-E163 VanDerWaalsContact O-N 3.1Å; E163-T165 VanDerWaalsContact C-N 3.28Å; E163-T165 PolarHBondContact O-N 3.38Å
164	Q	45.1	Very low	65.9	Low	182 Å²	182	103.5 Å²	103.5	85%	0.85	52%	0.523	S	S	*	.			trans	-50.5	106.9	171.2	-76.9	-78.3	14.4	0	0	105	P162 E166	P162-Q164 PolarHBondContact O-N 2.94Å; Q164-E166 PolarHBondContact O-N 3.5Å
165	T	38	Very low	64.2	Low	114 Å²	114	108 Å²	108	70%	0.699	54%	0.536	S	S	*	.			trans	-59.3	99.2	-178.2	-30.2	0	0	0	0	104.9	E163 P167	E163-T165 VanDerWaalsContact C-N 3.28Å; E163-T165 PolarHBondContact O-N 3.38Å; T165-P167 WeakPolarHBondContact O-CD 3.14Å; T165-P167 VanDerWaalsContact O-N 3.09Å
166	E	36.3	Very low	62.6	Low	166 Å²	166	109.5 Å²	109.5	78%	0.776	55%	0.552	S	S	*	*			trans	-48	120	152.8	-85.5	-69.1	128.6	0	0	104.1	Q164 T168	Q164-E166 PolarHBondContact O-N 3.5Å; E166-T168 VanDerWaalsContact C-N 3.26Å; E166-T168 PolarHBondContact O-N 3.13Å
167	P	40.9	Very low	61	Low	71 Å²	71	116.9 Å²	116.9	46%	0.461	59%	0.586	S	S	.	*			trans	-60.9	98.6	-178.8	22.8	-30.6	0	0	0	107.5	T165 A169	T165-P167 WeakPolarHBondContact O-CD 3.14Å; T165-P167 VanDerWaalsContact O-N 3.09Å; P167-A169 PolarHBondContact O-N 2.78Å
168	T	42.2	Very low	59.2	Low	57 Å²	57	112.4 Å²	112.4	35%	0.35	58%	0.583	S	S	.	*			trans	18.4	104.6	152.7	-58.9	0	0	0	0	112.3	E166 Q170 Q171	E166-T168 VanDerWaalsContact C-N 3.26Å; E166-T168 PolarHBondContact O-N 3.13Å; T168-Q170 HydrophobicContact CG2-CB 3.43Å; T168-Q170 VanDerWaalsContact CG2-CB 3.43Å; T168-Q170 HydrophobicContact CG2-CG 3.86Å; T168-Q170 PolarHBondContact O-N 2.67Å; T168-Q171 HydrophobicContact CG2-CG 4.21Å; T168-Q171 WeakPolarHBondContact O-CB 3.34Å; T168-Q171 PolarHBondContact O-N 2.81Å
169	A	49.6	Very low	57.5	Low	84 Å²	84	113.1 Å²	113.1	69%	0.694	59%	0.592	S	S	*	*	H	α-helix	trans	-51.4	-19.4	169.1	0	0	0	0	0	112.7	P167	P167-A169 PolarHBondContact O-N 2.78Å
170	Q	52	Low	55.9	Low	159 Å²	159	116.5 Å²	116.5	74%	0.743	62%	0.617	S	S	*	*	H	α-helix	trans	-74.2	-21	173.5	-42.8	174.7	-18.4	0	0	113.9	T168 Q174	T168-Q170 HydrophobicContact CG2-CB 3.43Å; T168-Q170 VanDerWaalsContact CG2-CB 3.43Å; T168-Q170 HydrophobicContact CG2-CG 3.86Å; T168-Q170 PolarHBondContact O-N 2.67Å; Q170-Q174 PolarHBondContact O-N 3.08Å
171	Q	50.5	Low	54.5	Low	117 Å²	117	122.5 Å²	122.5	55%	0.547	65%	0.654	S	S	.	*	H	α-helix	trans	-74.6	-35.2	173.6	-77.4	179.4	-14	0	0	112	T168 Q174 Q175	T168-Q171 HydrophobicContact CG2-CG 4.21Å; T168-Q171 WeakPolarHBondContact O-CB 3.34Å; T168-Q171 PolarHBondContact O-N 2.81Å; Q171-Q174 PolarHBondContact O-N 2.98Å; Q171-Q175 PolarHBondContact O-N 2.93Å
172	W	48.9	Very low	53.2	Low	180 Å²	180	124.7 Å²	124.7	68%	0.682	67%	0.672	S	S	*	*	H	α-helix	trans	-69.5	-31.5	174.8	-80.4	92.7	0	0	0	113.4	Q174 S176	W172-Q174 VanDerWaalsContact C-N 3.31Å; W172-Q174 PolarHBondContact O-N 3.38Å; W172-S176 PolarHBondContact O-N 3.31Å; W172-S176 PolarHBondContact O-OG 2.99Å
173	V	60.8	Low	52.1	Low	86 Å²	86	124.4 Å²	124.4	52%	0.521	69%	0.685	S	S	.	*	H	α-helix	trans	-71.5	-27.3	176.5	173.6	0	0	0	0	112.1	S176 Q177	V173-S176 PolarHBondContact O-OG 3.44Å; V173-Q177 PolarHBondContact O-NE2 3.28Å; V173-Q177 VanDerWaalsContact O-NE2 3.09Å
174	Q	60.3	Low	51.7	Low	160 Å²	160	127.5 Å²	127.5	75%	0.748	69%	0.689	S	S	*	*	H	α-helix	trans	-86.3	-27.3	179.8	-150.9	151.7	46.2	0	0	112.7	Q170 Q171 W172	Q170-Q174 PolarHBondContact O-N 3.08Å; Q171-Q174 PolarHBondContact O-N 2.98Å; W172-Q174 VanDerWaalsContact C-N 3.31Å; W172-Q174 PolarHBondContact O-N 3.38Å
175	Q	59.8	Low	51.9	Low	143 Å²	143	126.8 Å²	126.8	67%	0.668	69%	0.691	S	S	*	*	H	α-helix	trans	-85	-20.6	179.5	-158.6	165.2	43.5	0	0	113.9	Q171	Q171-Q175 PolarHBondContact O-N 2.93Å
176	S	60.1	Low	52.9	Low	81 Å²	81	126.8 Å²	126.8	57%	0.566	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-11.1	178.2	46.5	0	0	0	0	114.5	W172 V173	W172-S176 PolarHBondContact O-N 3.31Å; W172-S176 PolarHBondContact O-OG 2.99Å; V173-S176 PolarHBondContact O-OG 3.44Å
177	Q	59.8	Low	53.8	Low	157 Å²	157	125 Å²	125	73%	0.734	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-1.9	-178.1	-70.8	-178.5	57.7	0	0	114.7	V173	V173-Q177 PolarHBondContact O-NE2 3.28Å; V173-Q177 VanDerWaalsContact O-NE2 3.09Å
178	S	55.7	Low	54.4	Low	87 Å²	87	128.2 Å²	128.2	61%	0.608	71%	0.712	S	S	*	*			trans	-111.8	28.8	-174.9	65.4	0	0	0	0	114.7	P180	S178-P180 WeakPolarHBondContact O-CD 3.37Å
179	L	54.6	Low	54.6	Low	150 Å²	150	137.1 Å²	137.1	79%	0.785	74%	0.739	S	S	*	*			trans	-84.7	115	170.9	-72.3	175.8	0	0	0	110.7
180	P	57.2	Low	54.4	Low	112 Å²	112	138.4 Å²	138.4	73%	0.727	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-77.7	123.1	169.6	3.5	14.9	0	0	0	108.5	S178 P182	S178-P180 WeakPolarHBondContact O-CD 3.37Å; P180-P182 VanDerWaalsContact O-CD 3.23Å; P180-P182 WeakPolarHBondContact O-CD 3.26Å
181	V	60.2	Low	54.4	Low	139 Å²	139	139 Å²	139	84%	0.842	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-70.6	118.4	173	-178	0	0	0	0	108.9
182	P	54.9	Low	54.4	Low	116 Å²	116	144.5 Å²	144.5	75%	0.753	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-82.5	138.5	171	-2	21.9	0	0	0	109.9	P180	P180-P182 VanDerWaalsContact O-CD 3.23Å; P180-P182 WeakPolarHBondContact O-CD 3.26Å
183	G	47.9	Very low	54.8	Low	80 Å²	80	141.5 Å²	141.5	83%	0.825	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-53.7	149.1	-167	0	0	0	0	0	117.3
184	R	50.9	Low	54.7	Low	236 Å²	236	142.2 Å²	142.2	89%	0.891	78%	0.775	S	S	*	*			trans	-125.4	101.6	157.7	-144.1	171.4	-172.1	173.1	1.8	108.4	V186	R184-V186 PolarHBondContact O-N 2.96Å
185	N	48.7	Very low	54.3	Low	168 Å²	168	141.5 Å²	141.5	90%	0.898	78%	0.776	S	S	*	*			trans	-70.6	116.5	171.1	-122.7	-2.8	0	0	0	108.3
186	V	60.3	Low	54	Low	113 Å²	113	146.2 Å²	146.2	69%	0.685	79%	0.788	S	S	*	*			trans	-142.3	116.6	164.2	-120.3	0	0	0	0	107.6	R184	R184-V186 PolarHBondContact O-N 2.96Å
187	P	54.3	Low	53.9	Low	130 Å²	130	146 Å²	146	84%	0.844	80%	0.797	S	S	*	*			trans	-88.1	111.8	173.4	32.2	-26.8	0	0	0	108.8
188	V	53.4	Low	54.5	Low	137 Å²	137	144.4 Å²	144.4	83%	0.83	80%	0.801	S	S	*	*			trans	-116.8	127.8	165	176.1	0	0	0	0	108.7
189	R	47.2	Very low	55.2	Low	244 Å²	244	145.8 Å²	145.8	92%	0.921	81%	0.808	S	S	*	*			trans	-63.9	149	-173.7	-76.5	173.4	167.2	179.6	-4.7	112.9
190	S	45.1	Very low	56.3	Low	112 Å²	112	144.4 Å²	144.4	78%	0.783	81%	0.808	S	S	*	*			trans	-23.2	134.6	165.2	-65.1	0	0	0	0	116.7
191	I	51.8	Low	56.7	Low	172 Å²	172	144.4 Å²	144.4	88%	0.882	81%	0.808	S	S	*	*				-154.3	114.5	124.2	-83.7	134.5	0	0	0	106.9
192	R	51.1	Low	56.3	Low	231 Å²	231	145.8 Å²	145.8	87%	0.872	81%	0.81	S	S	*	*			trans	-85.8	162.9	159.5	-92.3	-175.1	-178.7	-144	1.3	106.8
193	P	57.8	Low	56.2	Low	117 Å²	117	150.1 Å²	150.1	76%	0.76	82%	0.82	S	S	*	*				-158	-159.1	56	50.8	-27.5	0	0	0	113.6
194	P	57.1	Low	56.8	Low	101 Å²	101	150.5 Å²	150.5	66%	0.656	82%	0.815	S	S	*	*				-121.7	178.1	-122.4	23.3	3.8	0	0	0	112.8
195	L	53.5	Low	57.1	Low	146 Å²	146	145.2 Å²	145.2	76%	0.764	81%	0.811	S	S	*	*			trans	160.9	141.5	131.3	-105.3	89.6	0	0	0	112.8
196	R	52.8	Low	58	Low	242 Å²	242	147.1 Å²	147.1	91%	0.913	81%	0.812	S	S	*	*			trans	79.9	114.1	144	-96.1	175.9	169.2	177	-3.8	121.3
197	G	58.1	Low	58.2	Low	75 Å²	75	147.5 Å²	147.5	77%	0.773	82%	0.817	S	S	*	*			trans	152	112.5	144.2	0	0	0	0	0	114.1
198	P	73.1	Confident	58.3	Low	124 Å²	124	145.8 Å²	145.8	81%	0.805	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-86.4	161.9	178	36	-32	0	0	0	112.3
199	P	70	Confident	59.3	Low	117 Å²	117	145 Å²	145	76%	0.76	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-90.2	157	178.2	36.3	-32.1	0	0	0	112.5
200	P	77.5	Confident	60.1	Low	121 Å²	121	139.4 Å²	139.4	79%	0.786	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-85	151.2	167.7	33.8	-30.8	0	0	0	111.8
201	P	65.2	Low	60.4	Low	111 Å²	111	140.3 Å²	140.3	72%	0.721	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-99.4	149.8	-179.9	36.6	-30.4	0	0	0	114.3
202	L	50.9	Low	60.6	Low	169 Å²	169	141.5 Å²	141.5	89%	0.885	81%	0.809	S	S	*	*			trans	53.5	117.1	139.2	-59.9	169.5	0	0	0	120.6
203	Q	54.3	Low	60.4	Low	206 Å²	206	138 Å²	138	96%	0.963	81%	0.807	S	S	*	*			trans	-140.7	148.6	141.8	-111	174.6	39.6	0	0	111.8
204	A	59.8	Low	60.2	Low	88 Å²	88	137.1 Å²	137.1	73%	0.727	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-80.8	167.8	-147.3	0	0	0	0	0	117.4
205	P	57.3	Low	59.6	Low	125 Å²	125	142 Å²	142	81%	0.812	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-92.7	149.3	176	35.4	-29.7	0	0	0	113.2
206	F	67.9	Low	59.1	Low	209 Å²	209	146.5 Å²	146.5	92%	0.917	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-96	145.3	170.5	-74.9	-80.3	0	0	0	112.2
207	P	64.8	Low	58.6	Low	120 Å²	120	138.5 Å²	138.5	78%	0.779	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-94.1	154.9	-174.2	36.9	-32.9	0	0	0	113.9
208	A	56.3	Low	57.9	Low	94 Å²	94	145.5 Å²	145.5	78%	0.777	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-82.6	154.2	171.6	0	0	0	0	0	112.8
209	P	73.1	Confident	56.5	Low	121 Å²	121	142.7 Å²	142.7	79%	0.786	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-90.3	154.1	168.4	34.7	-30.8	0	0	0	112.6
210	P	64.9	Low	55.6	Low	127 Å²	127	145.4 Å²	145.4	83%	0.825	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-93.4	161.7	-174.1	36.7	-33.2	0	0	0	114.9
211	V	50.3	Low	54.3	Low	130 Å²	130	145.3 Å²	145.3	79%	0.788	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-49.6	139	174.6	179.9	0	0	0	0	115.3
212	Q	55.8	Low	53.3	Low	197 Å²	197	151.3 Å²	151.3	92%	0.921	82%	0.816	S	S	*	*			trans	-147.2	126.4	144.4	-66.6	-166.9	1.7	0	0	112.4
213	L	48.3	Very low	53.1	Low	159 Å²	159	149.5 Å²	149.5	83%	0.832	81%	0.807	S	S	*	*			trans	-122.4	173.4	161.2	-92.2	167.3	0	0	0	105
214	P	52.6	Low	52.5	Low	97 Å²	97	143.4 Å²	143.4	63%	0.63	80%	0.798	S	S	*	*			cis	-138.3	-165.3	-6.8	33.3	-10.1	0	0	0	113.2
215	F	45.3	Very low	51.6	Low	205 Å²	205	151 Å²	151	90%	0.899	81%	0.808	S	S	*	*			trans	68.7	121	148	-104.1	-93.5	0	0	0	119.1
216	R	42.3	Very low	50.8	Low	239 Å²	239	148.6 Å²	148.6	90%	0.902	81%	0.806	S	S	*	*				160.6	120.4	114.1	-160.3	175.6	-156.2	-178.2	5.9	110.1
217	G	42.5	Very low	49.6	Very low	74 Å²	74	145.8 Å²	145.8	76%	0.763	81%	0.806	S	S	*	*			trans	-69.5	155.4	174.4	0	0	0	0	0	113.5
218	R	43.1	Very low	48.7	Very low	222 Å²	222	144 Å²	144	84%	0.838	80%	0.802	S	S	*	*			trans	-162.3	116	155.1	-153.5	178	-163.1	-176.2	6.4	109.6
219	G	44	Very low	48.2	Very low	66 Å²	66	148.7 Å²	148.7	68%	0.68	80%	0.804	S	S	*	*			trans	-74	162.6	166.3	0	0	0	0	0	112.2
220	K	52.4	Low	47	Very low	173 Å²	173	150.5 Å²	150.5	75%	0.752	81%	0.807	S	S	*	*			trans	-174.9	135.3	148.7	-100	157.4	-177	-161.8	0	110
221	P	49.1	Very low	45.8	Very low	119 Å²	119	147.9 Å²	147.9	77%	0.773	80%	0.803	S	S	*	*			trans	-95.3	153.6	174.3	36.6	-30.2	0	0	0	111.4
222	W	43.6	Very low	45.5	Very low	237 Å²	237	148 Å²	148	90%	0.898	80%	0.804	S	S	*	*			trans	-123.8	111.4	168	-88.1	6.7	0	0	0	109.1
223	I	47.7	Very low	44.6	Very low	132 Å²	132	143.5 Å²	143.5	68%	0.677	80%	0.8	S	S	*	*				84.5	107.5	91.8	-69	164	0	0	0	111.9
224	G	41.3	Very low	44.4	Very low	77 Å²	77	142 Å²	142	79%	0.794	80%	0.797	S	S	*	*			trans	-82.9	138.4	155.3	0	0	0	0	0	111.3
225	R	41	Very low	44.1	Very low	248 Å²	248	145.1 Å²	145.1	94%	0.936	80%	0.804	S	S	*	*			trans	-148.3	141.6	156.5	-97.6	-171	-173.1	-155.4	2.7	103.7
226	G	39.7	Very low	44.4	Very low	74 Å²	74	140.5 Å²	140.5	76%	0.763	80%	0.795	S	S	*	*			cis	157.6	129.9	15.9	0	0	0	0	0	104.8
227	V	43.7	Very low	44.5	Very low	151 Å²	151	135 Å²	135	92%	0.915	79%	0.79	S	S	*	*			trans	-75.3	132.1	177.9	167.2	0	0	0	0	110.1
228	A	45.1	Very low	44.7	Very low	83 Å²	83	137.2 Å²	137.2	69%	0.686	79%	0.788	S	S	*	*			trans	-172.3	111.2	150.6	0	0	0	0	0	108.1
229	K	47.3	Very low	44.7	Very low	192 Å²	192	132.6 Å²	132.6	84%	0.835	79%	0.787	S	S	*	*				76.7	119.7	95.3	-73.5	-178.8	178.3	-178.4	0	114
230	N	46.6	Very low	44.4	Very low	159 Å²	159	132.8 Å²	132.8	85%	0.85	79%	0.789	S	S	*	*			trans	86.7	108	156.4	-58.2	-6.3	0	0	0	118.4
231	G	40.7	Very low	43.8	Very low	72 Å²	72	129.2 Å²	129.2	74%	0.742	79%	0.791	S	S	*	*				91.2	125.1	129.5	0	0	0	0	0	116.7
232	V	43.7	Very low	43.1	Very low	131 Å²	131	128.5 Å²	128.5	79%	0.794	79%	0.79	S	S	*	*			trans	92.1	104.4	171.3	-169.4	0	0	0	0	114.5	V234	V232-V234 HydrophobicContact CG1-CG2 4.43Å; V232-V234 PolarHBondContact O-N 3.45Å
233	A	36.4	Very low	42.7	Very low	103 Å²	103	125.3 Å²	125.3	85%	0.851	78%	0.784	S	S	*	*			trans	-66.8	105.3	168.1	0	0	0	0	0	109.4
234	V	44.5	Very low	42.3	Very low	127 Å²	127	125.4 Å²	125.4	77%	0.77	79%	0.791	S	S	*	*			trans	-92.7	106.8	166.7	179.2	0	0	0	0	106.7	V232	V232-V234 HydrophobicContact CG1-CG2 4.43Å; V232-V234 PolarHBondContact O-N 3.45Å
235	Q	46.2	Very low	42.3	Very low	163 Å²	163	130.7 Å²	130.7	76%	0.762	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-62.5	135.2	167.4	-75.8	-176.1	2.6	0	0	108.9
236	P	50.8	Low	42.2	Very low	109 Å²	109	121.8 Å²	121.8	71%	0.708	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-65.1	145.5	166.1	29	-31.4	0	0	0	108.9	V238	P236-V238 PolarHBondContact O-N 3.49Å
237	P	44.2	Very low	42.3	Very low	124 Å²	124	126 Å²	126	81%	0.805	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-63.5	130.8	-175	26.2	-33	0	0	0	110.5
238	V	46.5	Very low	42.2	Very low	120 Å²	120	126.4 Å²	126.4	73%	0.727	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-64.6	127.4	165.1	-170.5	0	0	0	0	107.2	P236 G240	P236-V238 PolarHBondContact O-N 3.49Å; V238-G240 PolarHBondContact O-N 3.41Å
239	P	43.9	Very low	42.3	Very low	125 Å²	125	128.8 Å²	128.8	81%	0.812	78%	0.775	S	S	*	*			trans	-66.8	102.7	165.8	-10.3	25.2	0	0	0	107.5
240	G	38.5	Very low	42.3	Very low	69 Å²	69	126 Å²	126	71%	0.711	77%	0.769	S	S	*	*			trans	-61.4	141.3	170.1	0	0	0	0	0	110.6	V238	V238-G240 PolarHBondContact O-N 3.41Å
241	A	39.2	Very low	42.5	Very low	98 Å²	98	124.2 Å²	124.2	81%	0.81	76%	0.764	S	S	*	*			trans	-48.1	134.8	177.9	0	0	0	0	0	113.6
242	S	34.5	Very low	43.1	Very low	105 Å²	105	124.3 Å²	124.3	73%	0.734	75%	0.75	S	S	*	*				167	88	122.5	57.1	0	0	0	0	110.3
243	E	34.7	Very low	43.9	Very low	169 Å²	169	122.7 Å²	122.7	79%	0.79	75%	0.75	S	S	*	*			trans	-137.1	91.3	141.2	-73.9	-163	168.4	0	0	107	F245	E243-F245 VanDerWaalsContact C-N 3.32Å; E243-F245 PolarHBondContact O-N 3.26Å
244	V	40.8	Very low	45	Very low	135 Å²	135	122.3 Å²	122.3	82%	0.818	73%	0.727	S	S	*	*			trans	-57.3	100.4	160.6	175.8	0	0	0	0	105.5	A246	V244-A246 PolarHBondContact O-N 3.02Å
245	F	40.5	Very low	45.8	Very low	187 Å²	187	119.6 Å²	119.6	82%	0.82	71%	0.713	S	S	*	*			trans	-68.5	87.8	158.5	-91.5	-86.3	0	0	0	106.1	E243 N247	E243-F245 VanDerWaalsContact C-N 3.32Å; E243-F245 PolarHBondContact O-N 3.26Å; F245-N247 PolarHBondContact O-N 3.46Å
246	A	39.8	Very low	45.9	Very low	61 Å²	61	117.8 Å²	117.8	50%	0.504	72%	0.715	S	S	.	*			trans	-52.4	135.3	160.6	0	0	0	0	0	107.1	V244 E248	V244-A246 PolarHBondContact O-N 3.02Å; A246-E248 PolarHBondContact O-N 2.84Å
247	N	40.2	Very low	46.1	Very low	163 Å²	163	119.4 Å²	119.4	87%	0.872	72%	0.716	S	S	*	*			trans	-62.3	77.7	167.8	-74.5	-27.4	0	0	0	108.7	F245 V249	F245-N247 PolarHBondContact O-N 3.46Å; N247-V249 PolarHBondContact O-N 3.14Å
248	E	41.4	Very low	46.2	Very low	160 Å²	160	119.5 Å²	119.5	75%	0.748	72%	0.715	S	S	*	*			trans	-76.3	112.6	159.2	-67.7	-166.5	165	0	0	106	A246 N250	A246-E248 PolarHBondContact O-N 2.84Å; E248-N250 PolarHBondContact O-N 2.87Å
249	V	47	Very low	46.1	Very low	133 Å²	133	121.8 Å²	121.8	81%	0.806	72%	0.722	S	S	*	*			trans	-61.4	81.2	165.2	-178.5	0	0	0	0	106.2	N247 T251	N247-V249 PolarHBondContact O-N 3.14Å; V249-T251 PolarHBondContact O-N 3.07Å
250	N	47.7	Very low	45.9	Very low	134 Å²	134	124.7 Å²	124.7	72%	0.717	72%	0.718	S	S	*	*			trans	-68.9	102	174.5	-134.5	-7.4	0	0	0	105	E248 V252	E248-N250 PolarHBondContact O-N 2.87Å; N250-V252 VanDerWaalsContact C-N 3.34Å; N250-V252 PolarHBondContact O-N 3.45Å
251	T	51.4	Low	46	Very low	121 Å²	121	128.3 Å²	128.3	74%	0.742	72%	0.716	S	S	*	*			trans	-58.9	101.1	173.3	45.3	0	0	0	0	107.2	V249 A253	V249-T251 PolarHBondContact O-N 3.07Å; T251-A253 PolarHBondContact O-N 3.34Å
252	V	53.4	Low	46.3	Very low	73 Å²	73	132.1 Å²	132.1	44%	0.442	72%	0.717	S	S	.	*			trans	-66.9	102.7	174.3	-178.6	0	0	0	0	106.5	N250 Y254	N250-V252 VanDerWaalsContact C-N 3.34Å; N250-V252 PolarHBondContact O-N 3.45Å; V252-Y254 VanDerWaalsContact C-N 3.25Å; V252-Y254 HydrophobicContact CB-CD2 4.26Å; V252-Y254 HydrophobicContact CB-CE1 4.46Å; V252-Y254 HydrophobicContact CB-CE2 3.71Å; V252-Y254 HydrophobicContact CG1-CD1 3.91Å; V252-Y254 HydrophobicContact CG1-CD2 3.98Å; V252-Y254 HydrophobicContact CG1-CE1 3.57Å; V252-Y254 HydrophobicContact CG1-CE2 3.65Å; V252-Y254 HydrophobicContact CG1-CG 4.1Å; V252-Y254 VanDerWaalsContact CG1-CZ 3.43Å; V252-Y254 VanDerWaalsContact O-CD2 3.25Å; V252-Y254 WeakPolarHBondContact O-CD2 3.44Å; V252-Y254 PolarHBondContact O-N 2.93Å
253	A	61	Low	47	Very low	97 Å²	97	131.9 Å²	131.9	80%	0.802	71%	0.712	S	S	*	*			trans	-71.4	88.9	167.8	0	0	0	0	0	107.4	T251	T251-A253 PolarHBondContact O-N 3.34Å
254	Y	59.3	Low	47.8	Very low	95 Å²	95	130 Å²	130	37%	0.373	71%	0.707	S	S	.	*			trans	-63.9	136.2	166.5	-61	-81.1	0	0	0	107.7	Y147 V252	Y147-Y254 HydrophobicContact CD1-CD1 4.12Å; Y147-Y254 AromaticContact CD1-CE1 3.99Å; Y147-Y254 HydrophobicContact CD1-CE1 3.99Å; Y147-Y254 AromaticContact CD2-CD1 3.56Å; Y147-Y254 HydrophobicContact CD2-CD1 3.56Å; Y147-Y254 AromaticContact CD2-CE1 3.94Å; Y147-Y254 HydrophobicContact CD2-CE1 3.94Å; Y147-Y254 HydrophobicContact CE1-CD1 4.37Å; Y147-Y254 AromaticContact CE2-CD1 3.85Å; Y147-Y254 HydrophobicContact CE2-CD1 3.85Å; Y147-Y254 AromaticContact CG-CD1 3.72Å; Y147-Y254 HydrophobicContact CG-CD1 3.72Å; Y147-Y254 AromaticContact CG-CE1 3.62Å; Y147-Y254 HydrophobicContact CG-CE1 3.62Å; V252-Y254 VanDerWaalsContact C-N 3.25Å; V252-Y254 HydrophobicContact CB-CD2 4.26Å; V252-Y254 HydrophobicContact CB-CE1 4.46Å; V252-Y254 HydrophobicContact CB-CE2 3.71Å; V252-Y254 HydrophobicContact CG1-CD1 3.91Å; V252-Y254 HydrophobicContact CG1-CD2 3.98Å; V252-Y254 HydrophobicContact CG1-CE1 3.57Å; V252-Y254 HydrophobicContact CG1-CE2 3.65Å; V252-Y254 HydrophobicContact CG1-CG 4.1Å; V252-Y254 VanDerWaalsContact CG1-CZ 3.43Å; V252-Y254 VanDerWaalsContact O-CD2 3.25Å; V252-Y254 WeakPolarHBondContact O-CD2 3.44Å; V252-Y254 PolarHBondContact O-N 2.93Å
255	P	60.1	Low	48.2	Very low	71 Å²	71	132.1 Å²	132.1	46%	0.461	71%	0.706	S	S	.	*			trans	-53.9	142.5	168.9	25.1	-32.8	0	0	0	108.2	Y147 I257	Y147-P255 HydrophobicContact CE2-CG 4.37Å; Y147-P255 VanDerWaalsContact OH-CD 3.23Å; Y147-P255 WeakPolarHBondContact OH-CD 3.5Å; Y147-P255 WeakPolarHBondContact OH-CG 3.37Å; P255-I257 PolarHBondContact O-N 2.93Å
256	P	49	Very low	49	Very low	125 Å²	125	127.6 Å²	127.6	81%	0.812	69%	0.69	S	S	*	*			trans	-54.3	115	178.1	22.3	-31.6	0	0	0	107.8	T258	P256-T258 PolarHBondContact O-N 2.97Å
257	I	55.9	Low	50.1	Low	143 Å²	143	128.5 Å²	128.5	73%	0.733	69%	0.692	S	S	*	*			trans	-61.3	120.9	166.9	-58	172	0	0	0	103.6	P255 L259	P255-I257 PolarHBondContact O-N 2.93Å; I257-L259 PolarHBondContact O-N 2.99Å
258	T	46.3	Very low	51.2	Low	126 Å²	126	125 Å²	125	77%	0.773	67%	0.671	S	S	*	*			trans	-50	112.3	167.5	41.8	0	0	0	0	106.1	P256 Y260	P256-T258 PolarHBondContact O-N 2.97Å; T258-Y260 PolarHBondContact O-N 3.26Å
259	L	42.8	Very low	52.3	Low	167 Å²	167	121.7 Å²	121.7	87%	0.874	66%	0.661	S	S	*	*			trans	-44.6	117.6	176.6	-109.5	151.7	0	0	0	106.4	I257 E261	I257-L259 PolarHBondContact O-N 2.99Å; L259-E261 PolarHBondContact O-N 3.17Å
260	Y	41.4	Very low	52.8	Low	186 Å²	186	124 Å²	124	73%	0.729	66%	0.66	S	S	*	*			trans	-51.7	117.8	162	-102.5	-93.9	0	0	0	105	T258 Q262	T258-Y260 PolarHBondContact O-N 3.26Å; Y260-Q262 PolarHBondContact O-N 3.08Å
261	E	40.1	Very low	53.6	Low	145 Å²	145	122.9 Å²	122.9	68%	0.678	65%	0.651	S	S	*	*			trans	-57.1	117.7	164	-150.8	-177.8	140.8	0	0	104.7	L259 T263 D264	L259-E261 PolarHBondContact O-N 3.17Å; E261-T263 WeakPolarHBondContact CB-OG1 3.47Å; E261-T263 HydrophobicContact CG-CG2 4.43Å; E261-T263 VanDerWaalsContact CG-OG1 3.24Å; E261-T263 WeakPolarHBondContact CG-OG1 3.48Å; E261-T263 PolarHBondContact O-N 3.21Å; E261-T263 PolarHBondContact OE1-OG1 3.44Å; E261-D264 PolarHBondContact O-N 3.44Å
262	Q	46.1	Very low	54.1	Low	179 Å²	179	121.2 Å²	121.2	84%	0.836	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-60.9	-2.4	-174.2	-168.9	171.9	-7.4	0	0	112.4	Y260 D264	Y260-Q262 PolarHBondContact O-N 3.08Å; Q262-D264 VanDerWaalsContact C-N 3.34Å; Q262-D264 PolarHBondContact O-N 3.29Å
263	T	49.1	Very low	54.2	Low	100 Å²	100	124 Å²	124	61%	0.613	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-72.1	-17.2	-179.8	41.9	0	0	0	0	114.5	E261	E261-T263 WeakPolarHBondContact CB-OG1 3.47Å; E261-T263 HydrophobicContact CG-CG2 4.43Å; E261-T263 VanDerWaalsContact CG-OG1 3.24Å; E261-T263 WeakPolarHBondContact CG-OG1 3.48Å; E261-T263 PolarHBondContact O-N 3.21Å; E261-T263 PolarHBondContact OE1-OG1 3.44Å
264	D	50.3	Low	53.9	Low	130 Å²	130	121.2 Å²	121.2	70%	0.695	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-103.1	2.3	177.2	-74.4	-30.2	0	0	0	114.6	E261 Q262 N266	E261-D264 PolarHBondContact O-N 3.44Å; Q262-D264 VanDerWaalsContact C-N 3.34Å; Q262-D264 PolarHBondContact O-N 3.29Å; D264-N266 PolarHBondContact O-N 3.26Å
265	F	49.3	Very low	53.7	Low	179 Å²	179	120.4 Å²	120.4	79%	0.785	63%	0.63	S	S	*	*			trans	-83	70.7	175.2	-139.4	-84.9	0	0	0	110.4	S267	F265-S267 PolarHBondContact O-N 3.21Å
266	N	56.8	Low	53.5	Low	92 Å²	92	123.2 Å²	123.2	49%	0.492	64%	0.641	S	S	.	*			trans	-76.7	118.2	171.7	-172.4	3.8	0	0	0	108.3	D264 H268 V269	D264-N266 PolarHBondContact O-N 3.26Å; N266-H268 PolarHBondContact O-N 3.49Å; N266-H268 PolarHBondContact OD1-CD2 3.39Å; N266-V269 HydrophobicContact CB-CG2 4.01Å; N266-V269 WeakPolarHBondContact O-CB 3.46Å; N266-V269 WeakPolarHBondContact O-CG2 3.23Å; N266-V269 PolarHBondContact O-N 2.99Å
267	S	64.5	Low	53.6	Low	79 Å²	79	126 Å²	126	55%	0.552	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-28.5	-178.6	51.5	0	0	0	0	112.6	F265 V269	F265-S267 PolarHBondContact O-N 3.21Å; S267-V269 VanDerWaalsContact C-N 3.3Å; S267-V269 PolarHBondContact O-N 2.98Å
268	H	62.8	Low	53.2	Low	91 Å²	91	123 Å²	123	42%	0.421	63%	0.634	S	S	.	*	H	α-helix	trans	-68.8	-20.8	177.2	-66.4	-57.1	0	0	0	114.3	N266 F270 E271 D272	N266-H268 PolarHBondContact O-N 3.49Å; N266-H268 PolarHBondContact OD1-CD2 3.39Å; H268-F270 PolarHBondContact O-N 3.37Å; H268-E271 IonicContact CE1-OE2 3.17Å; H268-E271 PolarHBondContact CE1-OE2 3.15Å; H268-E271 IonicContact CG-OE2 3.01Å; H268-E271 IonicContact ND1-OE2 2.63Å; H268-E271 PolarHBondContact ND1-OE2 2.9Å; H268-E271 PolarHBondContact O-N 3.45Å; H268-E271 VanDerWaalsContact O-N 3.11Å; H268-D272 WeakPolarHBondContact O-CB 3.45Å; H268-D272 PolarHBondContact O-N 2.91Å
269	V	64	Low	53.5	Low	89 Å²	89	120.9 Å²	120.9	54%	0.539	63%	0.629	S	S	.	*	H	α-helix	trans	-60.7	-35.1	-179.2	176.9	0	0	0	0	111.6	N266 S267 F273	N266-V269 HydrophobicContact CB-CG2 4.01Å; N266-V269 WeakPolarHBondContact O-CB 3.46Å; N266-V269 WeakPolarHBondContact O-CG2 3.23Å; N266-V269 PolarHBondContact O-N 2.99Å; S267-V269 VanDerWaalsContact C-N 3.3Å; S267-V269 PolarHBondContact O-N 2.98Å; V269-F273 PolarHBondContact O-N 3.4Å
270	F	58	Low	53.7	Low	181 Å²	181	115.8 Å²	115.8	79%	0.794	62%	0.617	S	S	*	*	H	α-helix	trans	-79.9	-37	176.4	-164.7	-94	0	0	0	112.2	H268 F273 G274	H268-F270 PolarHBondContact O-N 3.37Å; F270-F273 VanDerWaalsContact O-CB 3.25Å; F270-F273 WeakPolarHBondContact O-CB 3.45Å; F270-F273 PolarHBondContact O-N 3.19Å; F270-G274 PolarHBondContact O-N 3.04Å
271	E	63.4	Low	53.9	Low	111 Å²	111	115.7 Å²	115.7	52%	0.519	62%	0.623	S	S	.	*	H	α-helix	trans	-66.9	-42.2	176.8	-63.8	-178.2	152.9	0	0	111.6	H268 F273 G274 T275	H268-E271 IonicContact CE1-OE2 3.17Å; H268-E271 PolarHBondContact CE1-OE2 3.15Å; H268-E271 IonicContact CG-OE2 3.01Å; H268-E271 IonicContact ND1-OE2 2.63Å; H268-E271 PolarHBondContact ND1-OE2 2.9Å; H268-E271 PolarHBondContact O-N 3.45Å; H268-E271 VanDerWaalsContact O-N 3.11Å; E271-F273 PolarHBondContact O-N 3.4Å; E271-G274 CarbonylContact O-C 3.5Å; E271-G274 WeakPolarHBondContact O-CA 3.36Å; E271-G274 PolarHBondContact O-N 3.41Å; E271-T275 WeakPolarHBondContact O-CG2 3.45Å; E271-T275 PolarHBondContact O-N 2.97Å
272	D	62	Low	53.8	Low	86 Å²	86	113.2 Å²	113.2	46%	0.46	63%	0.627	S	S	.	*	H	α-helix	trans	-63.1	-31.9	174.3	-71.5	-28.5	0	0	0	111.8	H268 G274 T275 N276	H268-D272 WeakPolarHBondContact O-CB 3.45Å; H268-D272 PolarHBondContact O-N 2.91Å; D272-G274 VanDerWaalsContact C-N 3.27Å; D272-G274 PolarHBondContact O-N 3.21Å; D272-T275 VanDerWaalsContact CA-OG1 3.29Å; D272-T275 WeakPolarHBondContact CA-OG1 3.43Å; D272-T275 PolarHBondContact O-N 2.95Å; D272-T275 PolarHBondContact O-OG1 2.9Å; D272-T275 VanDerWaalsContact O-OG1 3.04Å; D272-N276 PolarHBondContact O-N 3.2Å
273	F	55.9	Low	53.3	Low	131 Å²	131	116.2 Å²	116.2	58%	0.575	65%	0.647	S	S	*	*	H	α-helix	trans	-60.3	-41.9	170.4	-129.3	-90.4	0	0	0	110.6	V269 F270 E271 Y277	V269-F273 PolarHBondContact O-N 3.4Å; F270-F273 VanDerWaalsContact O-CB 3.25Å; F270-F273 WeakPolarHBondContact O-CB 3.45Å; F270-F273 PolarHBondContact O-N 3.19Å; E271-F273 PolarHBondContact O-N 3.4Å; F273-Y277 HydrophobicContact CD1-CE2 4.09Å; F273-Y277 HydrophobicContact CE1-CE2 4.48Å; F273-Y277 WeakPolarHBondContact O-CD2 3.32Å; F273-Y277 WeakPolarHBondContact O-CE2 3.32Å
274	G	55.6	Low	53.5	Low	40 Å²	40	117.1 Å²	117.1	41%	0.412	65%	0.649	S	S	.	*	H	α-helix	trans	-72.7	-35.9	176.8	0	0	0	0	0	114.5	F270 E271 D272 N276 Y277 A278	F270-G274 PolarHBondContact O-N 3.04Å; E271-G274 CarbonylContact O-C 3.5Å; E271-G274 WeakPolarHBondContact O-CA 3.36Å; E271-G274 PolarHBondContact O-N 3.41Å; D272-G274 VanDerWaalsContact C-N 3.27Å; D272-G274 PolarHBondContact O-N 3.21Å; G274-N276 VanDerWaalsContact C-N 3.35Å; G274-N276 PolarHBondContact O-N 2.87Å; G274-Y277 WeakPolarHBondContact O-CB 3.31Å; G274-Y277 PolarHBondContact O-N 3.48Å; G274-Y277 VanDerWaalsContact O-N 3.12Å; G274-A278 PolarHBondContact O-N 3.42Å
275	T	55.6	Low	53.7	Low	77 Å²	77	116.4 Å²	116.4	47%	0.472	65%	0.647	S	S	.	*	H	α-helix	trans	-68.6	-33.2	-179.6	58.9	0	0	0	0	112.4	E271 D272 Y277 A278 A279	E271-T275 WeakPolarHBondContact O-CG2 3.45Å; E271-T275 PolarHBondContact O-N 2.97Å; D272-T275 VanDerWaalsContact CA-OG1 3.29Å; D272-T275 WeakPolarHBondContact CA-OG1 3.43Å; D272-T275 PolarHBondContact O-N 2.95Å; D272-T275 PolarHBondContact O-OG1 2.9Å; D272-T275 VanDerWaalsContact O-OG1 3.04Å; T275-Y277 PolarHBondContact O-N 2.99Å; T275-A278 PolarHBondContact O-N 3.25Å; T275-A278 VanDerWaalsContact O-N 3.09Å; T275-A279 PolarHBondContact O-N 3.18Å; T275-A279 VanDerWaalsContact O-N 3.07Å
276	N	53.8	Low	54	Low	131 Å²	131	112.9 Å²	112.9	70%	0.701	64%	0.639	S	S	*	*	H	α-helix	trans	-63	-26.7	171.7	-83	-28.2	0	0	0	113.1	D272 G274	D272-N276 PolarHBondContact O-N 3.2Å; G274-N276 VanDerWaalsContact C-N 3.35Å; G274-N276 PolarHBondContact O-N 2.87Å
277	Y	51.3	Low	53.8	Low	182 Å²	182	114.1 Å²	114.1	71%	0.714	65%	0.648	S	S	*	*	H	α-helix	trans	-77.3	-30.1	172.2	-73.2	-79.2	0	0	0	112.9	F273 G274 T275	F273-Y277 HydrophobicContact CD1-CE2 4.09Å; F273-Y277 HydrophobicContact CE1-CE2 4.48Å; F273-Y277 WeakPolarHBondContact O-CD2 3.32Å; F273-Y277 WeakPolarHBondContact O-CE2 3.32Å; G274-Y277 WeakPolarHBondContact O-CB 3.31Å; G274-Y277 PolarHBondContact O-N 3.48Å; G274-Y277 VanDerWaalsContact O-N 3.12Å; T275-Y277 PolarHBondContact O-N 2.99Å
278	A	48.8	Very low	53.1	Low	81 Å²	81	116.3 Å²	116.3	67%	0.669	65%	0.654	S	S	*	*	H	α-helix	trans	-79.9	-25.8	179.7	0	0	0	0	0	113.4	G274 T275	G274-A278 PolarHBondContact O-N 3.42Å; T275-A278 PolarHBondContact O-N 3.25Å; T275-A278 VanDerWaalsContact O-N 3.09Å
279	A	51.1	Low	52.5	Low	82 Å²	82	118 Å²	118	68%	0.678	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-10.4	-175.5	0	0	0	0	0	114.9	T275	T275-A279 PolarHBondContact O-N 3.18Å; T275-A279 VanDerWaalsContact O-N 3.07Å
280	G	48.2	Very low	51.7	Low	60 Å²	60	120.1 Å²	120.1	62%	0.619	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	2.3	-171.6	0	0	0	0	0	117.3
281	H	45.1	Very low	51.2	Low	184 Å²	184	115.4 Å²	115.4	85%	0.852	67%	0.669	S	S	*	*			trans	-137.8	29.3	-170.4	-109.8	-79.3	0	0	0	115.3
282	A	38.2	Very low	50.2	Low	92 Å²	92	115.8 Å²	115.8	76%	0.76	68%	0.682	S	S	*	*			trans	-97.3	75.9	169.3	0	0	0	0	0	110.9
283	L	36.4	Very low	49.1	Very low	243 Å²	243	118.5 Å²	118.5	100%	1.272	70%	0.702	S	S	*	*			trans	-149.5	0	158.2	-86.2	-178.7	0	0	0	109.8

Retrieved 283 of 283 residues in 78.4 ms (Link to these results)

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