X5LV72_CAEEL Loading...

ethanolamine-phosphate cytidylyltransferase

AlphaFold DB , UniProt , Accession X5LV72, Species CAEEL (Caenorhabditis elegans), Gene pcyt-2.1, Length 323 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	93.3	Very high	96.2	Very high	80 Å²	80	78 Å²	78	39%	0.394	41%	0.409	S	S	.	.				0	-72	0	-70.7	-53.6	-78.6	0	0	111	A3 G4 F168 H169 I170 L173 Y219	M1-A3 PolarHBondContact O-N 2.95Å; M1-G4 PolarHBondContact O-N 3.45Å; M1-F168 HydrophobicContact CE-CD1 4.22Å; M1-H169 VanDerWaalsContact SD-C 3.57Å; M1-I170 HydrophobicContact CG-CB 4.13Å; M1-I170 HydrophobicContact CG-CD1 4.13Å; M1-I170 WeakPolarHBondContact SD-CA 3.42Å; M1-I170 HydrophobicContact SD-CB 3.79Å; M1-I170 HydrophobicContact SD-CD1 3.88Å; M1-I170 HydrophobicContact SD-CG1 4.44Å; M1-I170 PolarHBondContact SD-N 3.01Å; M1-L173 HydrophobicContact SD-CB 4.42Å; M1-L173 HydrophobicContact SD-CD2 4.21Å; M1-Y219 HydrophobicContact CE-CE1 4.35Å; M1-Y219 WeakPolarHBondContact CE-OH 3.03Å
2	V	96.3	Very high	96.3	Very high	85 Å²	85	75.6 Å²	75.6	52%	0.515	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-54.6	-47.4	-176.7	-178.2	0	0	0	0	112.6	G4 I5 V8 V11	V2-G4 PolarHBondContact O-N 2.82Å; V2-G4 VanDerWaalsContact O-N 3.08Å; V2-I5 WeakPolarHBondContact O-CB 3.34Å; V2-I5 PolarHBondContact O-N 2.94Å; V2-V8 HydrophobicContact CG1-CG1 4.26Å; V2-V8 HydrophobicContact CG1-CG2 4.18Å; V2-V11 HydrophobicContact CB-CG2 4.14Å; V2-V11 HydrophobicContact CG1-CG2 3.89Å
3	A	96.3	Very high	96.2	Very high	55 Å²	55	81.9 Å²	81.9	46%	0.455	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-60	-21.2	178.6	0	0	0	0	0	114.7	M1 V11 K220	M1-A3 PolarHBondContact O-N 2.95Å; A3-V11 HydrophobicContact CB-CG2 3.69Å; A3-K220 WeakPolarHBondContact O-CE 3.23Å; A3-K220 PolarHBondContact O-NZ 2.83Å
4	G	95.5	Very high	96	Very high	4 Å²	4	87.5 Å²	87.5	4%	0.041	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-82.7	-13.1	179.2	0	0	0	0	0	113.7	M1 V2 Y219 K220	M1-G4 PolarHBondContact O-N 3.45Å; V2-G4 PolarHBondContact O-N 2.82Å; V2-G4 VanDerWaalsContact O-N 3.08Å; G4-Y219 VanDerWaalsContact C-CD1 3.48Å; G4-Y219 CarbonylContact O-C 3.55Å; G4-Y219 VanDerWaalsContact O-CA 3.32Å; G4-Y219 WeakPolarHBondContact O-CA 3.39Å; G4-Y219 VanDerWaalsContact O-CD1 3.31Å; G4-Y219 WeakPolarHBondContact O-CD1 3.12Å; G4-K220 WeakPolarHBondContact O-CG 3.34Å; G4-K220 PolarHBondContact O-N 2.93Å
5	I	97.1	Very high	95.8	Very high	47 Å²	47	85.7 Å²	85.7	24%	0.241	46%	0.46	C	S	.	.	B	Isolated β-bridge	trans	-73.5	133	177.9	-62.8	171.9	0	0	0	108.8	V2 W7 V8 A218 Y219 K220	V2-I5 WeakPolarHBondContact O-CB 3.34Å; V2-I5 PolarHBondContact O-N 2.94Å; I5-W7 VanDerWaalsContact C-N 3.26Å; I5-W7 HydrophobicContact CG2-CE3 3.58Å; I5-W7 HydrophobicContact CG2-CZ3 4.17Å; I5-W7 PolarHBondContact O-N 3.27Å; I5-V8 HydrophobicContact CB-CG2 4.01Å; I5-V8 HydrophobicContact CG2-CG2 4.26Å; I5-V8 PolarHBondContact O-N 3.08Å; I5-A218 CarbonylContact C-O 3.4Å; I5-A218 WeakPolarHBondContact CA-O 3.45Å; I5-Y219 HydrophobicContact CG1-CE1 4.05Å; I5-K220 VanDerWaalsContact O-CE 3.27Å; I5-K220 WeakPolarHBondContact O-CE 3.4Å
6	K	95.6	Very high	95.6	Very high	45 Å²	45	85.3 Å²	85.3	20%	0.196	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-22.5	-169.4	71	-175.9	-170.9	168.6	0	116	F146 A218 K220	K6-F146 VanDerWaalsContact NZ-C 3.34Å; K6-F146 PolarHBondContact NZ-O 3.02Å; K6-A218 PolarHBondContact N-O 3.23Å; K6-K220 HydrophobicContact CB-CG 4.03Å
7	W	96.6	Very high	95.2	Very high	135 Å²	135	93.9 Å²	93.9	51%	0.511	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-3.5	176.6	-54.7	-74.9	0	0	0	113.8	I5 F146 A218	I5-W7 VanDerWaalsContact C-N 3.26Å; I5-W7 HydrophobicContact CG2-CE3 3.58Å; I5-W7 HydrophobicContact CG2-CZ3 4.17Å; I5-W7 PolarHBondContact O-N 3.27Å; W7-F146 AromaticContact CH2-CD1 3.65Å; W7-F146 HydrophobicContact CH2-CD1 3.65Å; W7-F146 HydrophobicContact CH2-CD2 4.27Å; W7-F146 AromaticContact CH2-CE1 3.7Å; W7-F146 HydrophobicContact CH2-CE1 3.7Å; W7-F146 HydrophobicContact CH2-CE2 4.33Å; W7-F146 AromaticContact CH2-CG 3.95Å; W7-F146 HydrophobicContact CH2-CG 3.95Å; W7-F146 HydrophobicContact CH2-CZ 4.05Å; W7-F146 HydrophobicContact CZ3-CD1 4.39Å; W7-F146 HydrophobicContact CZ3-CE1 4.11Å; W7-A218 HydrophobicContact CZ3-CB 4.05Å
8	V	97.4	Very high	94.9	Very high	33 Å²	33	90.5 Å²	90.5	20%	0.2	48%	0.477	C	S	.	.			trans	-98.2	117.5	180	177.5	0	0	0	0	109.3	V2 I5 E10 V11 K220	V2-V8 HydrophobicContact CG1-CG1 4.26Å; V2-V8 HydrophobicContact CG1-CG2 4.18Å; I5-V8 HydrophobicContact CB-CG2 4.01Å; I5-V8 HydrophobicContact CG2-CG2 4.26Å; I5-V8 PolarHBondContact O-N 3.08Å; V8-E10 WeakPolarHBondContact CG1-O 3.28Å; V8-V11 HydrophobicContact CG1-CG2 3.83Å; V8-K220 VanDerWaalsContact O-CE 3.29Å; V8-K220 WeakPolarHBondContact O-CE 3.42Å; V8-K220 PolarHBondContact O-NZ 2.64Å
9	D	97.2	Very high	94.9	Very high	159 Å²	159	87.4 Å²	87.4	85%	0.85	46%	0.462	S	S	*	.			trans	-82	-51.4	176.1	-60.9	-61.3	0	0	0	111.9
10	E	96.5	Very high	94.9	Very high	150 Å²	150	85 Å²	85	70%	0.701	45%	0.451	S	S	*	.			trans	-131.8	152	-178.4	179.4	174.6	-171.6	0	0	111.3	V8	V8-E10 WeakPolarHBondContact CG1-O 3.28Å
11	V	96.9	Very high	94.9	Very high	65 Å²	65	81.5 Å²	81.5	39%	0.394	43%	0.433	S	S	.	.			trans	-118.5	118.9	171	178.1	0	0	0	0	109.7	V2 A3 V8	V2-V11 HydrophobicContact CB-CG2 4.14Å; V2-V11 HydrophobicContact CG1-CG2 3.89Å; A3-V11 HydrophobicContact CB-CG2 3.69Å; V8-V11 HydrophobicContact CG1-CG2 3.83Å
12	V	96.4	Very high	95.1	Very high	49 Å²	49	84.9 Å²	84.9	30%	0.297	45%	0.448	S	S	.	.			trans	-85.4	116.5	171.6	176.7	0	0	0	0	109.6	Y27	V12-Y27 HydrophobicContact CG1-CE1 4.1Å; V12-Y27 HydrophobicContact CG1-CE2 3.76Å; V12-Y27 VanDerWaalsContact CG1-CZ 3.43Å; V12-Y27 WeakPolarHBondContact CG1-OH 3.03Å; V12-Y27 HydrophobicContact CG2-CD1 4.05Å; V12-Y27 HydrophobicContact CG2-CD2 4.41Å; V12-Y27 HydrophobicContact CG2-CE1 3.84Å; V12-Y27 HydrophobicContact CG2-CE2 4.2Å; V12-Y27 HydrophobicContact CG2-CG 4.35Å
13	E	95	Very high	95.1	Very high	158 Å²	158	82.1 Å²	82.1	74%	0.738	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	151.3	174.2	-61.9	-169.8	166.8	0	0	112	A15	E13-A15 PolarHBondContact O-N 3.47Å
14	N	93.9	Very high	95.1	Very high	160 Å²	160	80 Å²	80	86%	0.856	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	34.4	178.2	-53.3	-62.1	0	0	0	113.8
15	A	93.4	Very high	95.2	Very high	61 Å²	61	84.3 Å²	84.3	50%	0.504	43%	0.434	S	S	.	.			trans	-58.3	141.3	172.7	0	0	0	0	0	110.8	E13	E13-A15 PolarHBondContact O-N 3.47Å
16	P	92.4	Very high	95.2	Very high	78 Å²	78	89.3 Å²	89.3	51%	0.506	45%	0.454	S	S	.	.			trans	-55.5	147.9	174.4	-24.8	34.7	0	0	0	112	A18	P16-A18 VanDerWaalsContact C-N 3.35Å; P16-A18 PolarHBondContact O-N 3.35Å
17	Y	88.8	Confident	95.2	Very high	232 Å²	232	91.4 Å²	91.4	91%	0.91	46%	0.461	S	S	*	.	S	Bend	trans	-61.9	-41.7	-178.1	-177.4	-100.3	0	0	0	112.8
18	A	89.9	Confident	95.3	Very high	33 Å²	33	92.1 Å²	92.1	27%	0.273	48%	0.475	S	S	.	.	S	Bend	trans	-101.9	135.7	173.5	0	0	0	0	0	109.7	P16 T20 T47	P16-A18 VanDerWaalsContact C-N 3.35Å; P16-A18 PolarHBondContact O-N 3.35Å; A18-T20 PolarHBondContact O-N 2.86Å; A18-T47 HydrophobicContact CB-CG2 4.1Å
19	T	93.8	Very high	95.3	Very high	31 Å²	31	93.1 Å²	93.1	19%	0.19	48%	0.483	C	S	.	.			trans	-69.9	128.8	174.9	-47.6	0	0	0	0	110.1	L24 C32 H34 V51	T19-L24 HydrophobicContact CG2-CD2 4.08Å; T19-L24 HydrophobicContact CG2-CG 4.3Å; T19-C32 HydrophobicContact CG2-CB 3.92Å; T19-H34 PolarHBondContact OG1-NE2 3.3Å; T19-V51 WeakPolarHBondContact O-CG2 3.33Å
20	T	95.3	Very high	95.3	Very high	39 Å²	39	91.8 Å²	91.8	24%	0.239	48%	0.476	C	S	.	.			trans	-118.9	159.1	176.7	63	0	0	0	0	110.8	A18 E22 T23 L24	A18-T20 PolarHBondContact O-N 2.86Å; T20-E22 VanDerWaalsContact C-N 3.26Å; T20-E22 PolarHBondContact O-N 3.41Å; T20-T23 WeakPolarHBondContact O-CB 3.41Å; T20-T23 PolarHBondContact O-N 2.82Å; T20-T23 VanDerWaalsContact O-N 3.15Å; T20-T23 PolarHBondContact OG1-N 3.43Å; T20-T23 PolarHBondContact OG1-OG1 3.14Å; T20-L24 PolarHBondContact O-N 3.21Å
21	V	96	Very high	95.4	Very high	12 Å²	12	89 Å²	89	7%	0.073	46%	0.462	C	S	.	.	H	α-helix	trans	-60.8	-40	175	-179.7	0	0	0	0	110.5	T23 L24 D25 E50 V51 H54	V21-T23 VanDerWaalsContact C-N 3.29Å; V21-T23 PolarHBondContact O-N 3.49Å; V21-L24 WeakPolarHBondContact O-CB 3.31Å; V21-L24 PolarHBondContact O-N 3.15Å; V21-D25 PolarHBondContact O-N 2.98Å; V21-E50 HydrophobicContact CG2-CG 3.95Å; V21-V51 HydrophobicContact CG2-CG2 4.19Å; V21-H54 HydrophobicContact CG2-CB 4.29Å
22	E	96.3	Very high	95.4	Very high	152 Å²	152	86.6 Å²	86.6	71%	0.71	45%	0.447	S	S	*	.	H	α-helix	trans	-56.1	-41.5	174	-176.6	-174.3	-178.3	0	0	112.5	T20 L24 D25 K26	T20-E22 VanDerWaalsContact C-N 3.26Å; T20-E22 PolarHBondContact O-N 3.41Å; E22-L24 VanDerWaalsContact C-N 3.33Å; E22-L24 PolarHBondContact O-N 2.84Å; E22-D25 PolarHBondContact O-N 3.31Å; E22-K26 WeakPolarHBondContact O-CB 3.38Å; E22-K26 PolarHBondContact O-N 2.69Å
23	T	95.9	Very high	95.4	Very high	26 Å²	26	88 Å²	88	16%	0.16	46%	0.456	C	S	.	.	H	α-helix	trans	-65.6	-40	177.8	-56.4	0	0	0	0	110.9	T20 V21 K26 Y27	T20-T23 WeakPolarHBondContact O-CB 3.41Å; T20-T23 PolarHBondContact O-N 2.82Å; T20-T23 VanDerWaalsContact O-N 3.15Å; T20-T23 PolarHBondContact OG1-N 3.43Å; T20-T23 PolarHBondContact OG1-OG1 3.14Å; V21-T23 VanDerWaalsContact C-N 3.29Å; V21-T23 PolarHBondContact O-N 3.49Å; T23-K26 PolarHBondContact O-N 3.35Å; T23-Y27 HydrophobicContact CG2-CD2 4.16Å; T23-Y27 HydrophobicContact CG2-CE2 4.15Å; T23-Y27 VanDerWaalsContact O-CD2 3.26Å; T23-Y27 WeakPolarHBondContact O-CD2 3.35Å; T23-Y27 PolarHBondContact O-N 3.48Å
24	L	96.9	Very high	95.4	Very high	11 Å²	11	82.8 Å²	82.8	6%	0.058	43%	0.431	C	S	.	.	H	α-helix	trans	-66	-42.9	177.7	-61.2	178.6	0	0	0	111.5	T19 T20 V21 E22 Y27 D28 C29 C32 V51 R56	T19-L24 HydrophobicContact CG2-CD2 4.08Å; T19-L24 HydrophobicContact CG2-CG 4.3Å; T20-L24 PolarHBondContact O-N 3.21Å; V21-L24 WeakPolarHBondContact O-CB 3.31Å; V21-L24 PolarHBondContact O-N 3.15Å; E22-L24 VanDerWaalsContact C-N 3.33Å; E22-L24 PolarHBondContact O-N 2.84Å; L24-Y27 CarbonylContact O-C 3.57Å; L24-Y27 PolarHBondContact O-N 2.65Å; L24-D28 PolarHBondContact O-N 2.92Å; L24-C29 HydrophobicContact CB-CB 4.33Å; L24-C29 HydrophobicContact CD2-CB 3.94Å; L24-C29 PolarHBondContact O-N 2.8Å; L24-C32 HydrophobicContact CD2-CB 4.1Å; L24-V51 HydrophobicContact CD1-CG1 3.85Å; L24-R56 HydrophobicContact CD1-CB 4.05Å
25	D	97.1	Very high	95.2	Very high	95 Å²	95	76.5 Å²	76.5	51%	0.508	41%	0.405	S	S	.	.	H	α-helix	trans	-66	-38.5	178	-66.5	-19.9	0	0	0	112	V21 E22 Y27 D28 R56	V21-D25 PolarHBondContact O-N 2.98Å; E22-D25 PolarHBondContact O-N 3.31Å; D25-Y27 PolarHBondContact O-N 2.88Å; D25-D28 PolarHBondContact O-N 2.68Å; D25-R56 IonicContact OD1-CZ 3.74Å; D25-R56 VanDerWaalsContact OD1-CZ 3.27Å; D25-R56 IonicContact OD1-NH1 2.69Å; D25-R56 PolarHBondContact OD1-NH1 3.43Å; D25-R56 IonicContact OD1-NH2 3.45Å; D25-R56 PolarHBondContact OD1-NH2 2.74Å; D25-R56 IonicContact OD2-NH1 3.31Å
26	K	97.2	Very high	94.9	Very high	151 Å²	151	77.7 Å²	77.7	66%	0.657	40%	0.403	S	S	*	.	H	α-helix	trans	-58	-35.3	177.6	-177.7	-177.4	178	-163.7	0	112.8	E22 T23	E22-K26 WeakPolarHBondContact O-CB 3.38Å; E22-K26 PolarHBondContact O-N 2.69Å; T23-K26 PolarHBondContact O-N 3.35Å
27	Y	96.5	Very high	94.6	Very high	90 Å²	90	78.4 Å²	78.4	35%	0.353	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	17.8	-178.1	-60	-69.2	0	0	0	112.9	V12 T23 L24 D25 C29	V12-Y27 HydrophobicContact CG1-CE1 4.1Å; V12-Y27 HydrophobicContact CG1-CE2 3.76Å; V12-Y27 VanDerWaalsContact CG1-CZ 3.43Å; V12-Y27 WeakPolarHBondContact CG1-OH 3.03Å; V12-Y27 HydrophobicContact CG2-CD1 4.05Å; V12-Y27 HydrophobicContact CG2-CD2 4.41Å; V12-Y27 HydrophobicContact CG2-CE1 3.84Å; V12-Y27 HydrophobicContact CG2-CE2 4.2Å; V12-Y27 HydrophobicContact CG2-CG 4.35Å; T23-Y27 HydrophobicContact CG2-CD2 4.16Å; T23-Y27 HydrophobicContact CG2-CE2 4.15Å; T23-Y27 VanDerWaalsContact O-CD2 3.26Å; T23-Y27 WeakPolarHBondContact O-CD2 3.35Å; T23-Y27 PolarHBondContact O-N 3.48Å; L24-Y27 CarbonylContact O-C 3.57Å; L24-Y27 PolarHBondContact O-N 2.65Å; D25-Y27 PolarHBondContact O-N 2.88Å; Y27-C29 PolarHBondContact O-N 3.18Å; Y27-C29 VanDerWaalsContact O-N 3.15Å; Y27-C29 PolarHBondContact O-SG 2.95Å; Y27-C29 VanDerWaalsContact O-SG 3.4Å
28	D	97.4	Very high	94.3	Very high	150 Å²	150	74.8 Å²	74.8	80%	0.802	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	40.8	177.6	-159.4	32.3	0	0	0	113.6	L24 D25	L24-D28 PolarHBondContact O-N 2.92Å; D25-D28 PolarHBondContact O-N 2.68Å
29	C	97.4	Very high	93.9	Very high	54 Å²	54	74.9 Å²	74.9	37%	0.365	39%	0.394	S	S	.	.			trans	-94.2	124.4	-178.4	-70.8	0	0	0	0	110.7	L24 Y27 F31 R56	L24-C29 HydrophobicContact CB-CB 4.33Å; L24-C29 HydrophobicContact CD2-CB 3.94Å; L24-C29 PolarHBondContact O-N 2.8Å; Y27-C29 PolarHBondContact O-N 3.18Å; Y27-C29 VanDerWaalsContact O-N 3.15Å; Y27-C29 PolarHBondContact O-SG 2.95Å; Y27-C29 VanDerWaalsContact O-SG 3.4Å; C29-F31 PolarHBondContact O-N 3.32Å; C29-R56 PolarHBondContact O-NH2 3.04Å
30	D	98	Very high	93.4	Very high	131 Å²	131	78.3 Å²	78.3	70%	0.701	41%	0.411	S	S	*	.	S	Bend	trans	-60	-44.3	179.3	-66.6	-54.6	0	0	0	112.8	R56	D30-R56 WeakPolarHBondContact O-CG 3.36Å; D30-R56 PolarHBondContact O-NE 2.92Å
31	F	97.9	Very high	92.7	Very high	92 Å²	92	79.2 Å²	79.2	40%	0.404	42%	0.417	S	S	.	.			trans	-155.5	163.7	-177.9	57.5	-93.3	0	0	0	111.6	C29 V33 R56 R58	C29-F31 PolarHBondContact O-N 3.32Å; F31-V33 HydrophobicContact CD2-CG2 3.95Å; F31-V33 HydrophobicContact CE2-CG2 3.69Å; F31-R56 CarbonylContact C-O 3.49Å; F31-R56 WeakPolarHBondContact CA-O 3.43Å; F31-R56 HydrophobicContact CB-CB 4.28Å; F31-R56 WeakPolarHBondContact CB-O 3.2Å; F31-R58 HydrophobicContact CB-CG 4.42Å; F31-R58 HydrophobicContact CD2-CB 4.06Å; F31-R58 HydrophobicContact CD2-CG 3.41Å; F31-R58 VanDerWaalsContact CD2-CG 3.41Å; F31-R58 HydrophobicContact CE2-CB 4.33Å; F31-R58 HydrophobicContact CE2-CG 3.76Å; F31-R58 HydrophobicContact CG-CG 3.93Å
32	C	96.9	Very high	92	Very high	13 Å²	13	84 Å²	84	9%	0.088	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	157.3	167.7	67.9	0	0	0	0	112.1	T19 L24 R56 Y57 R58	T19-C32 HydrophobicContact CG2-CB 3.92Å; L24-C32 HydrophobicContact CD2-CB 4.1Å; C32-R56 PolarHBondContact N-O 3.41Å; C32-Y57 VanDerWaalsContact SG-CD2 3.59Å; C32-R58 PolarHBondContact O-N 2.8Å
33	V	97.3	Very high	91.3	Very high	80 Å²	80	83.5 Å²	83.5	49%	0.485	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.6	175.1	-172.2	0	0	0	0	109.1	F31 R58 C60	F31-V33 HydrophobicContact CD2-CG2 3.95Å; F31-V33 HydrophobicContact CE2-CG2 3.69Å; V33-R58 WeakPolarHBondContact CA-O 3.47Å; V33-R58 HydrophobicContact CG2-CB 4.21Å; V33-C60 HydrophobicContact CG1-CB 3.89Å
34	H	95.2	Very high	90.8	Very high	47 Å²	47	84.6 Å²	84.6	22%	0.218	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	165.4	175.3	-75.7	-85	0	0	0	110.8	T19 Y48 Y57 R58 E59 C60	T19-H34 PolarHBondContact OG1-NE2 3.3Å; H34-Y48 AromaticContact CE1-CE1 3.88Å; H34-Y48 AromaticContact CE1-CZ 3.56Å; H34-Y48 PolarHBondContact CE1-OH 3.25Å; H34-Y48 AromaticContact ND1-CZ 3.84Å; H34-Y48 PolarHBondContact ND1-OH 3.18Å; H34-Y48 AromaticContact NE2-CE1 3.66Å; H34-Y48 AromaticContact NE2-CZ 3.71Å; H34-Y57 HydrophobicContact CB-CE2 3.92Å; H34-Y57 WeakPolarHBondContact CB-OH 3.48Å; H34-Y57 AromaticContact CD2-CE2 3.53Å; H34-R58 PolarHBondContact N-O 3.47Å; H34-E59 CarbonylContact O-C 3.57Å; H34-E59 WeakPolarHBondContact O-CA 3.45Å; H34-C60 PolarHBondContact O-N 3.22Å
35	G	90.6	Very high	90.2	Very high	29 Å²	29	91.1 Å²	91.1	30%	0.299	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	166.7	170.6	0	0	0	0	0	112.1	D37	G35-D37 PolarHBondContact O-N 3.12Å; G35-D37 VanDerWaalsContact O-N 3.13Å
36	D	87.1	Confident	89.7	Confident	86 Å²	86	88.1 Å²	88.1	46%	0.46	49%	0.488	S	S	.	.	S	Bend	trans	-79.6	22.6	178.3	59.2	-19.1	0	0	0	114
37	D	85	Confident	89.4	Confident	93 Å²	93	83.4 Å²	83.4	50%	0.497	47%	0.471	S	S	.	.			trans	-72.6	147.9	178.6	-71.3	-31.4	0	0	0	110.9	G35 T39 R62	G35-D37 PolarHBondContact O-N 3.12Å; G35-D37 VanDerWaalsContact O-N 3.13Å; D37-T39 PolarHBondContact O-N 3.39Å; D37-R62 IonicContact OD1-NH1 3.16Å; D37-R62 PolarHBondContact OD1-NH1 3.26Å; D37-R62 IonicContact OD2-NH1 2.73Å; D37-R62 PolarHBondContact OD2-NH1 3.13Å
38	I	81.9	Confident	89.2	Confident	155 Å²	155	80.4 Å²	80.4	80%	0.795	46%	0.46	S	S	*	.			trans	-71.5	114.5	176.9	-60.7	173.8	0	0	0	109.6	L40	I38-L40 HydrophobicContact CG2-CD1 4Å; I38-L40 HydrophobicContact CG2-CG 3.88Å
39	T	82.4	Confident	89	Confident	36 Å²	36	77.5 Å²	77.5	22%	0.221	44%	0.441	C	S	.	.			trans	-115.3	80.9	-178.4	55.5	0	0	0	0	112.2	D37 D46 T47 Y48	D37-T39 PolarHBondContact O-N 3.39Å; T39-D46 WeakPolarHBondContact O-CA 3.41Å; T39-T47 PolarHBondContact O-N 2.91Å; T39-T47 PolarHBondContact O-OG1 3.33Å; T39-Y48 HydrophobicContact CG2-CE2 3.92Å
40	L	83.5	Confident	88.8	Confident	102 Å²	102	79.7 Å²	79.7	53%	0.534	45%	0.446	S	S	.	.	B	Isolated β-bridge	trans	-107.9	141.4	176.1	-59.6	176.4	0	0	0	111.1	I38 K45	I38-L40 HydrophobicContact CG2-CD1 4Å; I38-L40 HydrophobicContact CG2-CG 3.88Å; L40-K45 CarbonylContact C-O 3.59Å; L40-K45 WeakPolarHBondContact CA-O 3.42Å
41	T	80.6	Confident	88.7	Confident	59 Å²	59	73.5 Å²	73.5	36%	0.362	41%	0.413	S	S	.	.			trans	-71.8	169.9	167.2	67.5	0	0	0	0	110.7	D43 G44 K45	T41-D43 PolarHBondContact O-N 2.6Å; T41-D43 VanDerWaalsContact O-N 3.13Å; T41-G44 PolarHBondContact O-N 2.87Å; T41-K45 PolarHBondContact N-O 2.83Å; T41-K45 PolarHBondContact OG1-N 3Å; T41-K45 PolarHBondContact OG1-O 3.43Å
42	A	80.6	Confident	88.5	Confident	111 Å²	111	72 Å²	72	92%	0.917	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-26.7	176.8	0	0	0	0	0	113.1	G44	A42-G44 VanDerWaalsContact C-N 3.26Å; A42-G44 PolarHBondContact O-N 3.19Å
43	D	82.7	Confident	88.4	Confident	142 Å²	142	76.4 Å²	76.4	76%	0.759	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	5	177	-55.1	-48.4	0	0	0	113	T41 K45	T41-D43 PolarHBondContact O-N 2.6Å; T41-D43 VanDerWaalsContact O-N 3.13Å; D43-K45 VanDerWaalsContact C-N 3.33Å; D43-K45 PolarHBondContact O-N 2.83Å
44	G	84.1	Confident	88.4	Confident	49 Å²	49	77.8 Å²	77.8	51%	0.505	43%	0.43	S	S	.	.	S	Bend	trans	75.7	14.6	179.4	0	0	0	0	0	114.8	T41 A42	T41-G44 PolarHBondContact O-N 2.87Å; A42-G44 VanDerWaalsContact C-N 3.26Å; A42-G44 PolarHBondContact O-N 3.19Å
45	K	84.8	Confident	88.4	Confident	148 Å²	148	83 Å²	83	64%	0.643	45%	0.454	S	S	*	.			trans	-91.1	146.8	175.6	-66.9	-175.9	178.7	179.8	0	110.8	L40 T41 D43 T47	L40-K45 CarbonylContact C-O 3.59Å; L40-K45 WeakPolarHBondContact CA-O 3.42Å; T41-K45 PolarHBondContact N-O 2.83Å; T41-K45 PolarHBondContact OG1-N 3Å; T41-K45 PolarHBondContact OG1-O 3.43Å; D43-K45 VanDerWaalsContact C-N 3.33Å; D43-K45 PolarHBondContact O-N 2.83Å; K45-T47 PolarHBondContact O-N 3.12Å
46	D	87.6	Confident	88.8	Confident	33 Å²	33	83.8 Å²	83.8	18%	0.176	45%	0.448	C	S	.	.	B	Isolated β-bridge	trans	-64	129	175.7	-165.7	-44.5	0	0	0	110.8	T39 Y48 Q49 K52	T39-D46 WeakPolarHBondContact O-CA 3.41Å; D46-Y48 PolarHBondContact O-N 3.46Å; D46-Y48 PolarHBondContact OD1-N 2.94Å; D46-Q49 HydrophobicContact CB-CB 4.17Å; D46-Q49 WeakPolarHBondContact O-CB 3.38Å; D46-Q49 PolarHBondContact O-N 2.92Å; D46-K52 IonicContact OD1-NZ 3.49Å; D46-K52 WeakPolarHBondContact OD2-CE 3.37Å; D46-K52 IonicContact OD2-NZ 3.53Å; D46-K52 PolarHBondContact OD2-NZ 3.08Å
47	T	90.2	Very high	89.3	Confident	51 Å²	51	80.8 Å²	80.8	31%	0.313	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-29.8	177.8	-56.6	0	0	0	0	112.3	A18 T39 K45	A18-T47 HydrophobicContact CB-CG2 4.1Å; T39-T47 PolarHBondContact O-N 2.91Å; T39-T47 PolarHBondContact O-OG1 3.33Å; K45-T47 PolarHBondContact O-N 3.12Å
48	Y	92.3	Very high	89.8	Confident	27 Å²	27	82 Å²	82	11%	0.106	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	18.9	-177.7	-55	-66.9	0	0	0	113.1	H34 T39 D46 E50 V51 K52 Y57	H34-Y48 AromaticContact CE1-CE1 3.88Å; H34-Y48 AromaticContact CE1-CZ 3.56Å; H34-Y48 PolarHBondContact CE1-OH 3.25Å; H34-Y48 AromaticContact ND1-CZ 3.84Å; H34-Y48 PolarHBondContact ND1-OH 3.18Å; H34-Y48 AromaticContact NE2-CE1 3.66Å; H34-Y48 AromaticContact NE2-CZ 3.71Å; T39-Y48 HydrophobicContact CG2-CE2 3.92Å; D46-Y48 PolarHBondContact O-N 3.46Å; D46-Y48 PolarHBondContact OD1-N 2.94Å; Y48-E50 VanDerWaalsContact C-N 3.27Å; Y48-E50 PolarHBondContact O-N 3.1Å; Y48-V51 PolarHBondContact O-N 3.49Å; Y48-V51 VanDerWaalsContact O-N 3.08Å; Y48-K52 WeakPolarHBondContact O-CG 3.37Å; Y48-K52 PolarHBondContact O-N 2.73Å; Y48-Y57 HydrophobicContact CD1-CE2 4.46Å; Y48-Y57 AromaticContact CD2-CE2 3.63Å; Y48-Y57 HydrophobicContact CD2-CE2 3.63Å; Y48-Y57 HydrophobicContact CE2-CE2 4.27Å; Y48-Y57 HydrophobicContact CG-CD2 4.26Å; Y48-Y57 AromaticContact CG-CE2 3.72Å; Y48-Y57 HydrophobicContact CG-CE2 3.72Å
49	Q	92.5	Very high	90.5	Very high	89 Å²	89	80.4 Å²	80.4	42%	0.416	42%	0.418	S	S	.	.	H	α-helix	trans	-50.2	-48.2	-176.6	-171.4	65.9	61.4	0	0	112.1	D46 V51 K52 D53	D46-Q49 HydrophobicContact CB-CB 4.17Å; D46-Q49 WeakPolarHBondContact O-CB 3.38Å; D46-Q49 PolarHBondContact O-N 2.92Å; Q49-V51 VanDerWaalsContact C-N 3.34Å; Q49-V51 PolarHBondContact O-N 2.75Å; Q49-K52 PolarHBondContact O-N 2.85Å; Q49-D53 PolarHBondContact NE2-OD1 3.32Å; Q49-D53 WeakPolarHBondContact O-CB 3.37Å; Q49-D53 PolarHBondContact O-N 3.2Å
50	E	93.5	Very high	91	Very high	100 Å²	100	81.8 Å²	81.8	47%	0.467	43%	0.428	S	S	.	.	H	α-helix	trans	-56.9	-45.2	-179.6	-171.2	-167.4	158.6	0	0	112.3	V21 Y48 D53 H54	V21-E50 HydrophobicContact CG2-CG 3.95Å; Y48-E50 VanDerWaalsContact C-N 3.27Å; Y48-E50 PolarHBondContact O-N 3.1Å; E50-D53 PolarHBondContact O-N 3.38Å; E50-H54 PolarHBondContact O-N 3.37Å; E50-H54 PolarHBondContact O-ND1 3.22Å
51	V	95.4	Very high	91.4	Very high	1 Å²	1	86 Å²	86	1%	0.006	44%	0.442	C	S	.	.	H	α-helix	trans	-71.9	-35.5	-178.8	-175.2	0	0	0	0	111.3	T19 V21 L24 Y48 Q49 H54 Q55 R56	T19-V51 WeakPolarHBondContact O-CG2 3.33Å; V21-V51 HydrophobicContact CG2-CG2 4.19Å; L24-V51 HydrophobicContact CD1-CG1 3.85Å; Y48-V51 PolarHBondContact O-N 3.49Å; Y48-V51 VanDerWaalsContact O-N 3.08Å; Q49-V51 VanDerWaalsContact C-N 3.34Å; Q49-V51 PolarHBondContact O-N 2.75Å; V51-H54 PolarHBondContact O-N 3.31Å; V51-Q55 PolarHBondContact O-N 2.9Å; V51-R56 HydrophobicContact CG1-CB 4.04Å; V51-R56 WeakPolarHBondContact CG1-O 3.27Å; V51-R56 PolarHBondContact O-N 2.91Å; V51-R56 VanDerWaalsContact O-N 3.09Å
52	K	94.4	Very high	91.7	Very high	60 Å²	60	89.6 Å²	89.6	26%	0.261	45%	0.449	S	S	.	.	H	α-helix	trans	-65.6	-42.4	174.3	-72.6	-179.8	178.4	-174.7	0	111.6	D46 Y48 Q49 H54 Q55 Y57	D46-K52 IonicContact OD1-NZ 3.49Å; D46-K52 WeakPolarHBondContact OD2-CE 3.37Å; D46-K52 IonicContact OD2-NZ 3.53Å; D46-K52 PolarHBondContact OD2-NZ 3.08Å; Y48-K52 WeakPolarHBondContact O-CG 3.37Å; Y48-K52 PolarHBondContact O-N 2.73Å; Q49-K52 PolarHBondContact O-N 2.85Å; K52-H54 PolarHBondContact O-N 2.57Å; K52-Q55 WeakPolarHBondContact O-CA 3.43Å; K52-Q55 PolarHBondContact O-N 3.38Å; K52-Y57 HydrophobicContact CD-CD1 4.38Å; K52-Y57 HydrophobicContact CG-CD1 3.98Å; K52-Y57 HydrophobicContact CG-CD2 4.26Å; K52-Y57 HydrophobicContact CG-CG 3.74Å
53	D	95.8	Very high	92	Very high	106 Å²	106	89 Å²	89	57%	0.567	43%	0.434	S	S	*	.	H	α-helix	trans	-61.5	-32.7	177.7	-66.9	-15.6	0	0	0	111.6	Q49 E50 Q55	Q49-D53 PolarHBondContact NE2-OD1 3.32Å; Q49-D53 WeakPolarHBondContact O-CB 3.37Å; Q49-D53 PolarHBondContact O-N 3.2Å; E50-D53 PolarHBondContact O-N 3.38Å; D53-Q55 VanDerWaalsContact C-N 3.27Å; D53-Q55 PolarHBondContact O-N 3.09Å
54	H	95.9	Very high	91.9	Very high	110 Å²	110	87.2 Å²	87.2	51%	0.509	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	3.7	174.4	-70	73.9	0	0	0	113.9	V21 E50 V51 K52 R56	V21-H54 HydrophobicContact CG2-CB 4.29Å; E50-H54 PolarHBondContact O-N 3.37Å; E50-H54 PolarHBondContact O-ND1 3.22Å; V51-H54 PolarHBondContact O-N 3.31Å; K52-H54 PolarHBondContact O-N 2.57Å; H54-R56 HydrophobicContact CB-CG 4.41Å; H54-R56 WeakPolarHBondContact O-CG 3.26Å; H54-R56 PolarHBondContact O-N 2.99Å
55	Q	96.6	Very high	91.6	Very high	156 Å²	156	85.9 Å²	85.9	73%	0.729	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	23.4	-177.9	-54.4	-176.6	-13	0	0	114.6	V51 K52 D53 R58	V51-Q55 PolarHBondContact O-N 2.9Å; K52-Q55 WeakPolarHBondContact O-CA 3.43Å; K52-Q55 PolarHBondContact O-N 3.38Å; D53-Q55 VanDerWaalsContact C-N 3.27Å; D53-Q55 PolarHBondContact O-N 3.09Å; Q55-R58 PolarHBondContact O-NH1 2.82Å
56	R	97.5	Very high	91.5	Very high	46 Å²	46	81.3 Å²	81.3	17%	0.174	40%	0.402	C	S	.	.			trans	-106.4	24.7	-177.1	-67.3	175.8	71.6	-175.4	8.8	113	L24 D25 C29 D30 F31 C32 V51 H54	L24-R56 HydrophobicContact CD1-CB 4.05Å; D25-R56 IonicContact OD1-CZ 3.74Å; D25-R56 VanDerWaalsContact OD1-CZ 3.27Å; D25-R56 IonicContact OD1-NH1 2.69Å; D25-R56 PolarHBondContact OD1-NH1 3.43Å; D25-R56 IonicContact OD1-NH2 3.45Å; D25-R56 PolarHBondContact OD1-NH2 2.74Å; D25-R56 IonicContact OD2-NH1 3.31Å; C29-R56 PolarHBondContact O-NH2 3.04Å; D30-R56 WeakPolarHBondContact O-CG 3.36Å; D30-R56 PolarHBondContact O-NE 2.92Å; F31-R56 CarbonylContact C-O 3.49Å; F31-R56 WeakPolarHBondContact CA-O 3.43Å; F31-R56 HydrophobicContact CB-CB 4.28Å; F31-R56 WeakPolarHBondContact CB-O 3.2Å; C32-R56 PolarHBondContact N-O 3.41Å; V51-R56 HydrophobicContact CG1-CB 4.04Å; V51-R56 WeakPolarHBondContact CG1-O 3.27Å; V51-R56 PolarHBondContact O-N 2.91Å; V51-R56 VanDerWaalsContact O-N 3.09Å; H54-R56 HydrophobicContact CB-CG 4.41Å; H54-R56 WeakPolarHBondContact O-CG 3.26Å; H54-R56 PolarHBondContact O-N 2.99Å
57	Y	97.4	Very high	91.3	Very high	22 Å²	22	81.4 Å²	81.4	9%	0.086	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	137.6	176.6	-172.5	-90	0	0	0	110.4	C32 H34 Y48 K52 E59	C32-Y57 VanDerWaalsContact SG-CD2 3.59Å; H34-Y57 HydrophobicContact CB-CE2 3.92Å; H34-Y57 WeakPolarHBondContact CB-OH 3.48Å; H34-Y57 AromaticContact CD2-CE2 3.53Å; Y48-Y57 HydrophobicContact CD1-CE2 4.46Å; Y48-Y57 AromaticContact CD2-CE2 3.63Å; Y48-Y57 HydrophobicContact CD2-CE2 3.63Å; Y48-Y57 HydrophobicContact CE2-CE2 4.27Å; Y48-Y57 HydrophobicContact CG-CD2 4.26Å; Y48-Y57 AromaticContact CG-CE2 3.72Å; Y48-Y57 HydrophobicContact CG-CE2 3.72Å; K52-Y57 HydrophobicContact CD-CD1 4.38Å; K52-Y57 HydrophobicContact CG-CD1 3.98Å; K52-Y57 HydrophobicContact CG-CD2 4.26Å; K52-Y57 HydrophobicContact CG-CG 3.74Å; Y57-E59 HydrophobicContact CD1-CG 4.18Å; Y57-E59 HydrophobicContact CE1-CG 3.48Å; Y57-E59 VanDerWaalsContact CE1-CG 3.48Å
58	R	96.8	Very high	91	Very high	118 Å²	118	84.4 Å²	84.4	45%	0.445	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	151.1	174.6	-61.3	-65.2	-179.4	-84.9	-4.5	109.9	F31 C32 V33 H34 Q55	F31-R58 HydrophobicContact CB-CG 4.42Å; F31-R58 HydrophobicContact CD2-CB 4.06Å; F31-R58 HydrophobicContact CD2-CG 3.41Å; F31-R58 VanDerWaalsContact CD2-CG 3.41Å; F31-R58 HydrophobicContact CE2-CB 4.33Å; F31-R58 HydrophobicContact CE2-CG 3.76Å; F31-R58 HydrophobicContact CG-CG 3.93Å; C32-R58 PolarHBondContact O-N 2.8Å; V33-R58 WeakPolarHBondContact CA-O 3.47Å; V33-R58 HydrophobicContact CG2-CB 4.21Å; H34-R58 PolarHBondContact N-O 3.47Å; Q55-R58 PolarHBondContact O-NH1 2.82Å
59	E	95.9	Very high	90.2	Very high	123 Å²	123	88.1 Å²	88.1	58%	0.575	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.8	-179.6	-68	177.2	-175.4	0	0	110.7	H34 Y57	H34-E59 CarbonylContact O-C 3.57Å; H34-E59 WeakPolarHBondContact O-CA 3.45Å; Y57-E59 HydrophobicContact CD1-CG 4.18Å; Y57-E59 HydrophobicContact CE1-CG 3.48Å; Y57-E59 VanDerWaalsContact CE1-CG 3.48Å
60	C	93.9	Very high	89.7	Confident	64 Å²	64	85.7 Å²	85.7	43%	0.432	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	148.9	167	67.9	0	0	0	0	110.2	V33 H34	V33-C60 HydrophobicContact CG1-CB 3.89Å; H34-C60 PolarHBondContact O-N 3.22Å
61	K	90.4	Very high	89.2	Confident	191 Å²	191	82.3 Å²	82.3	83%	0.83	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-70.2	139.7	178.8	-66.4	-179.2	-179.3	176.3	0	110.1	T63	K61-T63 PolarHBondContact O-N 2.81Å
62	R	87.1	Confident	88.4	Confident	134 Å²	134	83.7 Å²	83.7	51%	0.506	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-56.4	132.2	170.7	-169.5	176	-173	88.7	10.3	112	D37 C64	D37-R62 IonicContact OD1-NH1 3.16Å; D37-R62 PolarHBondContact OD1-NH1 3.26Å; D37-R62 IonicContact OD2-NH1 2.73Å; D37-R62 PolarHBondContact OD2-NH1 3.13Å; R62-C64 PolarHBondContact O-N 3.33Å
63	T	86.6	Confident	87.5	Confident	99 Å²	99	81.3 Å²	81.3	61%	0.607	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-66.3	119.9	173.4	-51.6	0	0	0	0	110.7	K61 V66	K61-T63 PolarHBondContact O-N 2.81Å; T63-V66 HydrophobicContact CG2-CG1 4.23Å
64	C	81.4	Confident	86.7	Confident	104 Å²	104	76.4 Å²	76.4	70%	0.703	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	144.9	179.1	-68	0	0	0	0	112.1	R62 V66	R62-C64 PolarHBondContact O-N 3.33Å; C64-V66 PolarHBondContact O-N 3.15Å
65	G	77.8	Confident	85.9	Confident	21 Å²	21	71.6 Å²	71.6	22%	0.216	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	-4.2	166	0	0	0	0	0	116.5	R74	G65-R74 PolarHBondContact O-NH2 2.88Å
66	V	83.3	Confident	84.7	Confident	52 Å²	52	67.5 Å²	67.5	32%	0.315	36%	0.359	S	S	.	.			trans	-141	141.7	176.5	67.8	0	0	0	0	112	T63 C64 L71	T63-V66 HydrophobicContact CG2-CG1 4.23Å; C64-V66 PolarHBondContact O-N 3.15Å; V66-L71 HydrophobicContact CG2-CD1 4.04Å; V66-L71 HydrophobicContact CG2-CD2 4.32Å; V66-L71 HydrophobicContact CG2-CG 4.11Å
67	S	83.6	Confident	83	Confident	36 Å²	36	68 Å²	68	25%	0.252	37%	0.365	S	S	.	.			trans	-154.5	159.7	166.7	69.8	0	0	0	0	109.9	T69 D70 L71	S67-T69 VanDerWaalsContact C-N 3.27Å; S67-T69 PolarHBondContact O-N 3.16Å; S67-D70 WeakPolarHBondContact O-CB 3.29Å; S67-D70 PolarHBondContact O-N 3.43Å; S67-D70 VanDerWaalsContact OG-CB 3.25Å; S67-D70 WeakPolarHBondContact OG-CB 3.48Å; S67-D70 PolarHBondContact OG-N 2.88Å; S67-D70 VanDerWaalsContact OG-N 3.08Å; S67-L71 WeakPolarHBondContact O-CG 3.2Å; S67-L71 PolarHBondContact O-N 3.19Å
68	T	82.1	Confident	80.9	Confident	114 Å²	114	72.9 Å²	72.9	70%	0.699	39%	0.392	S	S	*	.	H	α-helix	trans	-59.1	-40.4	176.6	-47.8	0	0	0	0	111.6	D70 L71 V72	T68-D70 PolarHBondContact O-N 2.9Å; T68-L71 PolarHBondContact O-N 2.93Å; T68-V72 HydrophobicContact CG2-CG2 4.45Å; T68-V72 WeakPolarHBondContact O-CB 3.2Å; T68-V72 WeakPolarHBondContact O-CG2 3.18Å; T68-V72 PolarHBondContact O-N 3.02Å
69	T	77.3	Confident	78.7	Confident	104 Å²	104	69.7 Å²	69.7	64%	0.638	39%	0.385	S	S	*	.	H	α-helix	trans	-63.8	-40.7	177.2	-54.3	0	0	0	0	112.1	S67 G73	S67-T69 VanDerWaalsContact C-N 3.27Å; S67-T69 PolarHBondContact O-N 3.16Å; T69-G73 PolarHBondContact O-N 3.29Å
70	D	80.3	Confident	76.3	Confident	38 Å²	38	70.4 Å²	70.4	20%	0.203	39%	0.386	C	S	.	.	H	α-helix	trans	-62.2	-52.4	175.3	177.5	45.8	0	0	0	110.9	S67 T68 V72 G73 R74	S67-D70 WeakPolarHBondContact O-CB 3.29Å; S67-D70 PolarHBondContact O-N 3.43Å; S67-D70 VanDerWaalsContact OG-CB 3.25Å; S67-D70 WeakPolarHBondContact OG-CB 3.48Å; S67-D70 PolarHBondContact OG-N 2.88Å; S67-D70 VanDerWaalsContact OG-N 3.08Å; T68-D70 PolarHBondContact O-N 2.9Å; D70-V72 VanDerWaalsContact C-N 3.33Å; D70-V72 PolarHBondContact O-N 2.81Å; D70-G73 WeakPolarHBondContact O-CA 3.43Å; D70-G73 PolarHBondContact O-N 3.04Å; D70-R74 WeakPolarHBondContact O-CG 3.27Å; D70-R74 PolarHBondContact O-N 3.36Å; D70-R74 IonicContact OD1-NE 2.93Å; D70-R74 IonicContact OD2-CZ 3.16Å; D70-R74 IonicContact OD2-NE 2.81Å; D70-R74 PolarHBondContact OD2-NE 3.26Å; D70-R74 IonicContact OD2-NH2 3.44Å; D70-R74 PolarHBondContact OD2-NH2 3.15Å
71	L	82.9	Confident	73.8	Confident	29 Å²	29	71.3 Å²	71.3	15%	0.152	39%	0.387	C	S	.	.	H	α-helix	trans	-58.4	-42.6	178.1	-67.6	178.1	0	0	0	112.4	V66 S67 T68 G73 R74 M75 L167 M207	V66-L71 HydrophobicContact CG2-CD1 4.04Å; V66-L71 HydrophobicContact CG2-CD2 4.32Å; V66-L71 HydrophobicContact CG2-CG 4.11Å; S67-L71 WeakPolarHBondContact O-CG 3.2Å; S67-L71 PolarHBondContact O-N 3.19Å; T68-L71 PolarHBondContact O-N 2.93Å; L71-G73 VanDerWaalsContact C-N 3.3Å; L71-G73 PolarHBondContact O-N 3.49Å; L71-R74 WeakPolarHBondContact O-CB 3.43Å; L71-R74 PolarHBondContact O-N 2.99Å; L71-M75 HydrophobicContact CB-CE 4.14Å; L71-M75 VanDerWaalsContact O-CG 3.31Å; L71-M75 WeakPolarHBondContact O-CG 3.42Å; L71-M75 PolarHBondContact O-N 2.83Å; L71-L167 HydrophobicContact CD1-CD2 4.48Å; L71-L167 HydrophobicContact CD2-CD2 4.42Å; L71-M207 HydrophobicContact CD2-CG 4Å
72	V	79.8	Confident	71.9	Confident	31 Å²	31	63.3 Å²	63.3	19%	0.188	35%	0.353	C	S	.	.	H	α-helix	trans	-60.1	-42.5	173.8	170.4	0	0	0	0	110.7	T68 D70 R74 M75 L76 I295	T68-V72 HydrophobicContact CG2-CG2 4.45Å; T68-V72 WeakPolarHBondContact O-CB 3.2Å; T68-V72 WeakPolarHBondContact O-CG2 3.18Å; T68-V72 PolarHBondContact O-N 3.02Å; D70-V72 VanDerWaalsContact C-N 3.33Å; D70-V72 PolarHBondContact O-N 2.81Å; V72-R74 PolarHBondContact O-N 3.1Å; V72-M75 PolarHBondContact O-N 3.35Å; V72-L76 HydrophobicContact CG1-CD1 3.83Å; V72-L76 HydrophobicContact CG1-CG 4.36Å; V72-L76 VanDerWaalsContact O-CG 3.29Å; V72-L76 WeakPolarHBondContact O-CG 3.32Å; V72-L76 PolarHBondContact O-N 3.15Å; V72-I295 HydrophobicContact CG1-CG2 4.19Å; V72-I295 HydrophobicContact CG2-CG2 3.94Å
73	G	75.7	Confident	69.8	Low	9 Å²	9	60.3 Å²	60.3	9%	0.093	34%	0.344	C	S	.	.	H	α-helix	trans	-56.8	-47.7	174	0	0	0	0	0	112.4	T69 D70 L71 M75 L76 L77	T69-G73 PolarHBondContact O-N 3.29Å; D70-G73 WeakPolarHBondContact O-CA 3.43Å; D70-G73 PolarHBondContact O-N 3.04Å; L71-G73 VanDerWaalsContact C-N 3.3Å; L71-G73 PolarHBondContact O-N 3.49Å; G73-M75 VanDerWaalsContact C-N 3.32Å; G73-M75 PolarHBondContact O-N 3.37Å; G73-L76 PolarHBondContact O-N 3.46Å; G73-L76 VanDerWaalsContact O-N 3.15Å; G73-L77 WeakPolarHBondContact O-CD1 3.38Å; G73-L77 WeakPolarHBondContact O-CG 3.15Å; G73-L77 PolarHBondContact O-N 3.42Å
74	R	78.9	Confident	67.4	Low	4 Å²	4	60.3 Å²	60.3	2%	0.015	34%	0.344	C	S	.	.	H	α-helix	trans	-58.7	-41.8	176.6	-57.9	-178.4	-162.8	-170.6	4	112.1	G65 D70 L71 V72 L76 L77 V133 N203 I206 E211	G65-R74 PolarHBondContact O-NH2 2.88Å; D70-R74 WeakPolarHBondContact O-CG 3.27Å; D70-R74 PolarHBondContact O-N 3.36Å; D70-R74 IonicContact OD1-NE 2.93Å; D70-R74 IonicContact OD2-CZ 3.16Å; D70-R74 IonicContact OD2-NE 2.81Å; D70-R74 PolarHBondContact OD2-NE 3.26Å; D70-R74 IonicContact OD2-NH2 3.44Å; D70-R74 PolarHBondContact OD2-NH2 3.15Å; L71-R74 WeakPolarHBondContact O-CB 3.43Å; L71-R74 PolarHBondContact O-N 2.99Å; V72-R74 PolarHBondContact O-N 3.1Å; R74-L76 VanDerWaalsContact C-N 3.34Å; R74-L76 PolarHBondContact O-N 3.29Å; R74-L77 PolarHBondContact O-N 2.73Å; R74-V133 HydrophobicContact CB-CG1 4.44Å; R74-V133 HydrophobicContact CG-CG1 3.8Å; R74-V133 PolarHBondContact NE-O 3.13Å; R74-V133 PolarHBondContact NH2-O 2.95Å; R74-V133 VanDerWaalsContact NH2-O 3.09Å; R74-N203 PolarHBondContact O-ND2 3.2Å; R74-I206 HydrophobicContact CB-CG2 3.82Å; R74-I206 WeakPolarHBondContact CD-O 3.05Å; R74-I206 PolarHBondContact NH1-O 3.36Å; R74-E211 IonicContact CZ-OE1 3.66Å; R74-E211 IonicContact CZ-OE2 3.79Å; R74-E211 VanDerWaalsContact NH1-CD 3.35Å; R74-E211 IonicContact NH1-OE1 3.36Å; R74-E211 PolarHBondContact NH1-OE1 3.31Å; R74-E211 IonicContact NH1-OE2 3.93Å; R74-E211 PolarHBondContact NH1-OE2 3.26Å; R74-E211 IonicContact NH2-OE1 3.3Å; R74-E211 PolarHBondContact NH2-OE1 3.39Å
75	M	78.8	Confident	65.3	Low	9 Å²	9	64.8 Å²	64.8	4%	0.044	36%	0.355	C	S	.	.	H	α-helix	trans	-64.5	-38	177	-64.1	177.1	-149.4	0	0	112.3	L71 V72 G73 L167 I206 I292 I295	L71-M75 HydrophobicContact CB-CE 4.14Å; L71-M75 VanDerWaalsContact O-CG 3.31Å; L71-M75 WeakPolarHBondContact O-CG 3.42Å; L71-M75 PolarHBondContact O-N 2.83Å; V72-M75 PolarHBondContact O-N 3.35Å; G73-M75 VanDerWaalsContact C-N 3.32Å; G73-M75 PolarHBondContact O-N 3.37Å; M75-L167 HydrophobicContact CE-CD1 3.41Å; M75-L167 VanDerWaalsContact CE-CD1 3.41Å; M75-L167 HydrophobicContact CE-CD2 3.68Å; M75-L167 HydrophobicContact CE-CG 4.22Å; M75-L167 HydrophobicContact CG-CD1 4.5Å; M75-L167 HydrophobicContact SD-CD1 4.1Å; M75-I206 HydrophobicContact CG-CD1 4.37Å; M75-I206 HydrophobicContact CG-CG2 4.08Å; M75-I292 HydrophobicContact CB-CG1 4.43Å; M75-I292 HydrophobicContact CB-CG2 4.49Å; M75-I292 HydrophobicContact CG-CG1 3.96Å; M75-I292 HydrophobicContact SD-CG1 3.96Å; M75-I295 HydrophobicContact CE-CD1 3.75Å; M75-I295 HydrophobicContact SD-CB 4.4Å; M75-I295 HydrophobicContact SD-CD1 3.46Å; M75-I295 WeakPolarHBondContact SD-CD1 3.25Å; M75-I295 HydrophobicContact SD-CG2 4.27Å
76	L	71.2	Confident	63.3	Low	70 Å²	70	70.6 Å²	70.6	37%	0.366	38%	0.381	S	S	.	.	H	α-helix	trans	-78.2	-23.8	-178.1	-68.4	172.8	0	0	0	113.9	V72 G73 R74 L78 I296	V72-L76 HydrophobicContact CG1-CD1 3.83Å; V72-L76 HydrophobicContact CG1-CG 4.36Å; V72-L76 VanDerWaalsContact O-CG 3.29Å; V72-L76 WeakPolarHBondContact O-CG 3.32Å; V72-L76 PolarHBondContact O-N 3.15Å; G73-L76 PolarHBondContact O-N 3.46Å; G73-L76 VanDerWaalsContact O-N 3.15Å; R74-L76 VanDerWaalsContact C-N 3.34Å; R74-L76 PolarHBondContact O-N 3.29Å; L76-L78 VanDerWaalsContact C-N 3.25Å; L76-L78 PolarHBondContact O-N 3.2Å; L76-I296 HydrophobicContact CD2-CG1 3.95Å
77	L	62.4	Low	61.1	Low	56 Å²	56	76.2 Å²	76.2	29%	0.293	40%	0.404	S	S	.	.	H	α-helix	trans	-64	-27.8	-174.6	-88.1	151	0	0	0	112.7	G73 R74 T79 H82 W130	G73-L77 WeakPolarHBondContact O-CD1 3.38Å; G73-L77 WeakPolarHBondContact O-CG 3.15Å; G73-L77 PolarHBondContact O-N 3.42Å; R74-L77 PolarHBondContact O-N 2.73Å; L77-T79 VanDerWaalsContact O-CG2 3.32Å; L77-T79 WeakPolarHBondContact O-CG2 3.43Å; L77-T79 PolarHBondContact O-N 3.4Å; L77-T79 PolarHBondContact O-OG1 3.12Å; L77-H82 WeakPolarHBondContact CB-NE2 3.34Å; L77-W130 HydrophobicContact CD1-CE3 4.49Å
78	L	53.6	Low	58.9	Low	124 Å²	124	82.2 Å²	82.2	65%	0.649	43%	0.428	S	S	*	.			trans	44.6	20.3	177.8	-64.3	175.6	0	0	0	114.8	L76	L76-L78 VanDerWaalsContact C-N 3.25Å; L76-L78 PolarHBondContact O-N 3.2Å
79	T	48.9	Very low	57	Low	51 Å²	51	82.9 Å²	82.9	31%	0.313	43%	0.426	S	S	.	.			trans	-113.7	144.7	-176.6	51.7	0	0	0	0	111.1	L77 N81 H82 N203	L77-T79 VanDerWaalsContact O-CG2 3.32Å; L77-T79 WeakPolarHBondContact O-CG2 3.43Å; L77-T79 PolarHBondContact O-N 3.4Å; L77-T79 PolarHBondContact O-OG1 3.12Å; T79-N81 VanDerWaalsContact C-N 3.26Å; T79-N81 PolarHBondContact O-N 2.93Å; T79-H82 PolarHBondContact O-CD2 3.19Å; T79-H82 VanDerWaalsContact O-CD2 3.24Å; T79-N203 PolarHBondContact O-OD1 3.42Å; T79-N203 VanDerWaalsContact O-OD1 3.12Å
80	K	47	Very low	55.1	Low	138 Å²	138	86.4 Å²	86.4	60%	0.6	44%	0.435	S	S	*	.	S	Bend	trans	-79.2	-0.7	-178.7	-56.2	-172.1	176.6	-172.2	0	114.7	H82	K80-H82 PolarHBondContact O-N 2.97Å
81	N	41	Very low	53	Low	84 Å²	84	92.5 Å²	92.5	45%	0.449	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	3	-171.2	-66.2	-2.2	0	0	0	113.7	T79	T79-N81 VanDerWaalsContact C-N 3.26Å; T79-N81 PolarHBondContact O-N 2.93Å
82	H	50.7	Low	51	Low	22 Å²	22	96.4 Å²	96.4	10%	0.102	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-4.4	-170.3	-72	-35.3	0	0	0	113.8	L77 T79 K80 V133 N203	L77-H82 WeakPolarHBondContact CB-NE2 3.34Å; T79-H82 PolarHBondContact O-CD2 3.19Å; T79-H82 VanDerWaalsContact O-CD2 3.24Å; K80-H82 PolarHBondContact O-N 2.97Å; H82-V133 HydrophobicContact CB-CB 4Å; H82-V133 HydrophobicContact CB-CG1 3.67Å; H82-V133 HydrophobicContact CB-CG2 3.36Å; H82-V133 VanDerWaalsContact CG-CG2 3.43Å; H82-V133 WeakPolarHBondContact ND1-CG1 3.37Å; H82-V133 WeakPolarHBondContact ND1-CG2 3.45Å; H82-V133 WeakPolarHBondContact O-CG2 3.22Å; H82-N203 PolarHBondContact CD2-ND2 3.28Å; H82-N203 PolarHBondContact CD2-OD1 2.95Å
83	H	42.8	Very low	49.1	Very low	71 Å²	71	98.5 Å²	98.5	33%	0.329	49%	0.492	S	S	.	.	S	Bend	trans	-118.1	2.1	-177.6	-55.3	-57	0	0	0	114.2	H204	H83-H204 PolarHBondContact NE2-O 2.96Å
84	T	36.7	Very low	47.2	Very low	99 Å²	99	104 Å²	104	61%	0.607	52%	0.515	S	S	*	.			trans	-116.1	126.7	-175.1	49.4	0	0	0	0	111.2
85	Q	37.3	Very low	45.2	Very low	199 Å²	199	112.7 Å²	112.7	93%	0.93	55%	0.548	S	S	*	.			trans	-88.2	0.5	178.3	-119.8	172.1	-13.5	0	0	114.4
86	D	35	Very low	43.3	Very low	143 Å²	143	115.4 Å²	115.4	77%	0.765	57%	0.572	S	S	*	*	S	Bend	trans	-132.4	163.5	-169	-88.3	-39.9	0	0	0	117.9	H88	D86-H88 PolarHBondContact O-N 2.94Å
87	E	37.8	Very low	41.7	Very low	170 Å²	170	119.5 Å²	119.5	79%	0.794	58%	0.582	S	S	*	*			trans	-81	13.2	-139.5	-71.5	179.6	149.2	0	0	121.1	I89	E87-I89 PolarHBondContact O-N 2.9Å
88	H	37.5	Very low	40.6	Very low	162 Å²	162	120 Å²	120	75%	0.75	59%	0.591	S	S	*	*			trans	-102.9	76.8	-172.1	-75.5	-69.6	0	0	0	115.1	D86	D86-H88 PolarHBondContact O-N 2.94Å
89	I	41.9	Very low	39.8	Very low	128 Å²	128	120.4 Å²	120.4	66%	0.656	59%	0.593	S	S	*	*			trans	-74.5	-28.7	-177.3	-65.7	172.1	0	0	0	113.2	E87	E87-I89 PolarHBondContact O-N 2.9Å
90	E	37.2	Very low	39.5	Very low	178 Å²	178	121 Å²	121	83%	0.832	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-32.9	-164.5	-67.9	-173.8	158.3	0	0	114.8	H92	E90-H92 VanDerWaalsContact C-N 3.34Å; E90-H92 PolarHBondContact O-N 2.91Å
91	Q	35.3	Very low	39.1	Very low	165 Å²	165	117.8 Å²	117.8	77%	0.771	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-11	-173.7	-72.8	-179.8	-9.4	0	0	114.3
92	H	41.3	Very low	39	Very low	112 Å²	112	117.2 Å²	117.2	52%	0.519	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.6	-11.4	-174	-69.8	-71.4	0	0	0	114.8	E90 E94 R95 A96	E90-H92 VanDerWaalsContact C-N 3.34Å; E90-H92 PolarHBondContact O-N 2.91Å; H92-E94 VanDerWaalsContact C-N 3.29Å; H92-E94 PolarHBondContact O-N 3.23Å; H92-R95 PolarHBondContact O-N 2.9Å; H92-A96 PolarHBondContact O-N 3.4Å
93	V	39.6	Very low	38.5	Very low	75 Å²	75	121.7 Å²	121.7	46%	0.455	62%	0.621	S	S	.	*	H	α-helix	trans	-63.3	-33.9	176.5	177.1	0	0	0	0	111.9	R95 A96 R97	V93-R95 PolarHBondContact O-N 2.93Å; V93-A96 PolarHBondContact O-N 2.88Å; V93-R97 PolarHBondContact O-N 3.24Å
94	E	36.6	Very low	38.3	Very low	123 Å²	123	122.4 Å²	122.4	58%	0.575	63%	0.627	S	S	*	*	H	α-helix	trans	-70.5	-28.8	-178.3	-139.1	68.1	-126	0	0	112.8	H92 R97	H92-E94 VanDerWaalsContact C-N 3.29Å; H92-E94 PolarHBondContact O-N 3.23Å; E94-R97 IonicContact OE1-NH1 3.66Å; E94-R97 PolarHBondContact OE1-NH1 3.25Å; E94-R97 IonicContact OE2-NH1 2.94Å
95	R	36.4	Very low	38.5	Very low	188 Å²	188	123.8 Å²	123.8	71%	0.709	63%	0.627	S	S	*	*	H	α-helix	trans	-80.7	-31.4	175.6	-94.9	-178.3	178.2	153.1	-0.5	113.2	H92 V93 R97 S98 L99	H92-R95 PolarHBondContact O-N 2.9Å; V93-R95 PolarHBondContact O-N 2.93Å; R95-R97 VanDerWaalsContact C-N 3.26Å; R95-R97 PolarHBondContact O-N 3.05Å; R95-S98 PolarHBondContact O-N 2.71Å; R95-S98 PolarHBondContact O-OG 2.66Å; R95-S98 VanDerWaalsContact O-OG 3.04Å; R95-L99 PolarHBondContact O-N 3.49Å
96	A	38.5	Very low	38.5	Very low	66 Å²	66	124.3 Å²	124.3	55%	0.545	62%	0.621	S	S	.	*	H	α-helix	trans	-65.2	-32.5	172.1	0	0	0	0	0	111.6	H92 V93 S100	H92-A96 PolarHBondContact O-N 3.4Å; V93-A96 PolarHBondContact O-N 2.88Å; A96-S100 PolarHBondContact O-N 3.15Å
97	R	37.3	Very low	38.6	Very low	155 Å²	155	120.4 Å²	120.4	59%	0.585	61%	0.605	S	S	*	*	H	α-helix	trans	-62.4	-41.4	171.6	-84.8	-178.5	175.4	155.4	1.1	112.9	V93 E94 R95 S100 T101	V93-R97 PolarHBondContact O-N 3.24Å; E94-R97 IonicContact OE1-NH1 3.66Å; E94-R97 PolarHBondContact OE1-NH1 3.25Å; E94-R97 IonicContact OE2-NH1 2.94Å; R95-R97 VanDerWaalsContact C-N 3.26Å; R95-R97 PolarHBondContact O-N 3.05Å; R97-S100 WeakPolarHBondContact O-CB 3.37Å; R97-S100 PolarHBondContact O-N 2.91Å; R97-S100 PolarHBondContact O-OG 3.4Å; R97-T101 PolarHBondContact O-OG1 2.78Å
98	S	39	Very low	38.4	Very low	67 Å²	67	119.1 Å²	119.1	47%	0.469	60%	0.597	S	S	.	*	H	α-helix	trans	-73.1	-34.7	-174.5	67.6	0	0	0	0	113.3	R95 T101	R95-S98 PolarHBondContact O-N 2.71Å; R95-S98 PolarHBondContact O-OG 2.66Å; R95-S98 VanDerWaalsContact O-OG 3.04Å; S98-T101 VanDerWaalsContact O-CB 3.25Å; S98-T101 WeakPolarHBondContact O-CB 3.46Å; S98-T101 PolarHBondContact O-N 3.36Å; S98-T101 PolarHBondContact O-OG1 3.43Å
99	L	38	Very low	38.4	Very low	133 Å²	133	122.8 Å²	122.8	70%	0.696	61%	0.605	S	S	*	*	H	α-helix	trans	-72.6	-28.1	173.6	-111.5	86.9	0	0	0	113.1	R95 T101 A102	R95-L99 PolarHBondContact O-N 3.49Å; L99-T101 PolarHBondContact O-N 2.93Å; L99-A102 PolarHBondContact O-N 3.42Å
100	S	41.6	Very low	38	Very low	62 Å²	62	125.4 Å²	125.4	43%	0.434	62%	0.616	S	S	.	*	H	α-helix	trans	-59.3	-25.7	171.5	84.6	0	0	0	0	112	A96 R97 I103 L104	A96-S100 PolarHBondContact O-N 3.15Å; R97-S100 WeakPolarHBondContact O-CB 3.37Å; R97-S100 PolarHBondContact O-N 2.91Å; R97-S100 PolarHBondContact O-OG 3.4Å; S100-I103 PolarHBondContact O-N 3.3Å; S100-L104 VanDerWaalsContact O-CB 3.25Å; S100-L104 WeakPolarHBondContact O-CB 3.33Å; S100-L104 PolarHBondContact O-N 2.86Å
101	T	38.4	Very low	37.8	Very low	72 Å²	72	125.8 Å²	125.8	44%	0.442	62%	0.618	S	S	.	*	H	α-helix	trans	-68.7	-31.9	179.7	-25.7	0	0	0	0	113	R97 S98 L99 L104 E105	R97-T101 PolarHBondContact O-OG1 2.78Å; S98-T101 VanDerWaalsContact O-CB 3.25Å; S98-T101 WeakPolarHBondContact O-CB 3.46Å; S98-T101 PolarHBondContact O-N 3.36Å; S98-T101 PolarHBondContact O-OG1 3.43Å; L99-T101 PolarHBondContact O-N 2.93Å; T101-L104 VanDerWaalsContact O-CB 3.26Å; T101-L104 WeakPolarHBondContact O-CB 3.34Å; T101-L104 PolarHBondContact O-N 3.2Å; T101-E105 WeakPolarHBondContact O-CG 3.47Å; T101-E105 PolarHBondContact O-N 2.97Å; T101-E105 VanDerWaalsContact O-N 3.13Å
102	A	39	Very low	37.7	Very low	71 Å²	71	123.2 Å²	123.2	59%	0.587	62%	0.618	S	S	*	*	H	α-helix	trans	-73.6	-37.9	177	0	0	0	0	0	111.7	L99 L104 E105	L99-A102 PolarHBondContact O-N 3.42Å; A102-L104 VanDerWaalsContact C-N 3.3Å; A102-E105 PolarHBondContact O-N 3.29Å
103	I	42	Very low	37.4	Very low	117 Å²	117	127.4 Å²	127.4	60%	0.6	64%	0.635	S	S	*	*	H	α-helix	trans	-72.3	-27.8	170	-61.1	173.5	0	0	0	110.5	S100 E105 Y106 S107	S100-I103 PolarHBondContact O-N 3.3Å; I103-E105 VanDerWaalsContact C-N 3.31Å; I103-E105 PolarHBondContact O-N 3.41Å; I103-Y106 PolarHBondContact O-N 3.45Å; I103-S107 WeakPolarHBondContact O-CB 3.43Å; I103-S107 PolarHBondContact O-N 2.79Å; I103-S107 PolarHBondContact O-OG 3.18Å
104	L	38.5	Very low	37.3	Very low	85 Å²	85	131.9 Å²	131.9	45%	0.445	65%	0.648	S	S	.	*	H	α-helix	trans	-64	-33.9	174	-153.9	77.5	0	0	0	112.1	S100 T101 A102 S107 K108	S100-L104 VanDerWaalsContact O-CB 3.25Å; S100-L104 WeakPolarHBondContact O-CB 3.33Å; S100-L104 PolarHBondContact O-N 2.86Å; T101-L104 VanDerWaalsContact O-CB 3.26Å; T101-L104 WeakPolarHBondContact O-CB 3.34Å; T101-L104 PolarHBondContact O-N 3.2Å; A102-L104 VanDerWaalsContact C-N 3.3Å; L104-S107 VanDerWaalsContact CA-OG 3.22Å; L104-S107 WeakPolarHBondContact CA-OG 3.31Å; L104-S107 CarbonylContact O-C 3.45Å; L104-S107 PolarHBondContact O-N 2.87Å; L104-S107 PolarHBondContact O-OG 3.06Å; L104-K108 WeakPolarHBondContact O-CG 3.48Å; L104-K108 PolarHBondContact O-N 3.08Å
105	E	40.2	Very low	37.1	Very low	129 Å²	129	137.3 Å²	137.3	60%	0.603	66%	0.664	S	S	*	*	H	α-helix	trans	-69	-36.8	177.1	-60.7	-142.7	114.2	0	0	112.4	T101 A102 I103 S107 K108	T101-E105 WeakPolarHBondContact O-CG 3.47Å; T101-E105 PolarHBondContact O-N 2.97Å; T101-E105 VanDerWaalsContact O-N 3.13Å; A102-E105 PolarHBondContact O-N 3.29Å; I103-E105 VanDerWaalsContact C-N 3.31Å; I103-E105 PolarHBondContact O-N 3.41Å; E105-S107 VanDerWaalsContact C-N 3.33Å; E105-K108 IonicContact OE1-NZ 2.69Å; E105-K108 PolarHBondContact OE1-NZ 2.99Å
106	Y	38.3	Very low	37	Very low	209 Å²	209	139 Å²	139	82%	0.82	67%	0.67	S	S	*	*	H	α-helix	trans	-69.2	-32.7	172.1	-168.1	-99.3	0	0	0	112.2	I103	I103-Y106 PolarHBondContact O-N 3.45Å
107	S	36.6	Very low	36.8	Very low	61 Å²	61	141.3 Å²	141.3	43%	0.427	67%	0.673	S	S	.	*	H	α-helix	trans	-94.2	3	-178.7	54	0	0	0	0	115.2	I103 L104 E105 R109 M110	I103-S107 WeakPolarHBondContact O-CB 3.43Å; I103-S107 PolarHBondContact O-N 2.79Å; I103-S107 PolarHBondContact O-OG 3.18Å; L104-S107 VanDerWaalsContact CA-OG 3.22Å; L104-S107 WeakPolarHBondContact CA-OG 3.31Å; L104-S107 CarbonylContact O-C 3.45Å; L104-S107 PolarHBondContact O-N 2.87Å; L104-S107 PolarHBondContact O-OG 3.06Å; E105-S107 VanDerWaalsContact C-N 3.33Å; S107-R109 PolarHBondContact O-N 2.87Å; S107-M110 PolarHBondContact O-N 2.86Å
108	K	33.1	Very low	36.5	Very low	143 Å²	143	139 Å²	139	62%	0.622	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-9.3	168	-88.6	171.7	-174.7	169.4	0	113.3	L104 E105	L104-K108 WeakPolarHBondContact O-CG 3.48Å; L104-K108 PolarHBondContact O-N 3.08Å; E105-K108 IonicContact OE1-NZ 2.69Å; E105-K108 PolarHBondContact OE1-NZ 2.99Å
109	R	38.6	Very low	35.9	Very low	240 Å²	240	145.9 Å²	145.9	91%	0.906	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-0.4	-176.5	-114.9	177.5	179.5	-176.4	-0.1	117.4	S107	S107-R109 PolarHBondContact O-N 2.87Å
110	M	32.3	Very low	35.7	Very low	183 Å²	183	146.2 Å²	146.2	90%	0.901	69%	0.689	S	S	*	*			trans	-137.7	104.1	171.5	-90.3	-159.8	165.9	0	0	113.1	S107	S107-M110 PolarHBondContact O-N 2.86Å
111	Q	32.9	Very low	35.3	Very low	185 Å²	185	148.9 Å²	148.9	86%	0.864	70%	0.697	S	S	*	*			trans	-77.5	150.1	173.6	-79.6	178.8	-17.1	0	0	112.5
112	S	34.1	Very low	34.8	Very low	112 Å²	112	148.4 Å²	148.4	78%	0.783	70%	0.701	S	S	*	*	S	Bend	trans	87.2	75.7	159	78.3	0	0	0	0	119.1
113	K	35.3	Very low	34.2	Very low	199 Å²	199	150.9 Å²	150.9	87%	0.865	70%	0.704	S	S	*	*			trans	-167.7	38.9	140	-109.6	167.1	-175.6	179.4	0	114.1	R115	K113-R115 VanDerWaalsContact C-N 3.31Å; K113-R115 PolarHBondContact O-N 3.26Å; K113-R115 VanDerWaalsContact O-N 3.17Å
114	K	36.4	Very low	33.7	Very low	169 Å²	169	152.6 Å²	152.6	74%	0.735	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	6.1	-171.1	-160	171.3	179.1	176.8	0	116.4
115	R	33.3	Very low	33.3	Very low	238 Å²	238	155.3 Å²	155.3	90%	0.898	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	-11.1	-175.8	-78.3	-179.5	89.5	162.9	3.6	116.2	K113	K113-R115 VanDerWaalsContact C-N 3.31Å; K113-R115 PolarHBondContact O-N 3.26Å; K113-R115 VanDerWaalsContact O-N 3.17Å
116	R	33.6	Very low	32.8	Very low	223 Å²	223	152.6 Å²	152.6	84%	0.842	73%	0.734	S	S	*	*	S	Bend	trans	-99.4	-19.8	-177	-154	170.1	172.7	172.7	-4.1	114.2
117	L	34.6	Very low	32.4	Very low	115 Å²	115	150.5 Å²	150.5	60%	0.602	73%	0.734	S	S	*	*	S	Bend	trans	-79.5	-33.2	-179.2	-166.3	62.7	0	0	0	113	R119 L120 I121	L117-R119 PolarHBondContact O-N 3.29Å; L117-R119 VanDerWaalsContact O-N 3.16Å; L117-L120 PolarHBondContact O-N 3.32Å; L117-I121 HydrophobicContact CG-CD1 4.5Å
118	N	30.1	Very low	32.3	Very low	107 Å²	107	149.9 Å²	149.9	57%	0.572	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-15.6	-178.2	-72.5	2.9	0	0	0	114.3
119	R	27.7	Very low	32.5	Very low	210 Å²	210	147.1 Å²	147.1	79%	0.792	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-22.6	178.2	-158.6	-179.5	-65.7	-179.9	-2.1	112.8	L117 I121	L117-R119 PolarHBondContact O-N 3.29Å; L117-R119 VanDerWaalsContact O-N 3.16Å; R119-I121 VanDerWaalsContact C-N 3.31Å
120	L	33	Very low	32.5	Very low	140 Å²	140	141.8 Å²	141.8	73%	0.733	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-12.7	175.8	-75.2	162.7	0	0	0	113	L117	L117-L120 PolarHBondContact O-N 3.32Å
121	I	33.7	Very low	33	Very low	118 Å²	118	136.7 Å²	136.7	61%	0.605	69%	0.686	S	S	*	*	S	Bend	trans	-91.9	-10.5	-178.7	-59.9	171.4	0	0	0	111	L117 R119	L117-I121 HydrophobicContact CG-CD1 4.5Å; R119-I121 VanDerWaalsContact C-N 3.31Å
122	A	28	Very low	33.4	Very low	62 Å²	62	135.8 Å²	135.8	51%	0.512	67%	0.674	S	S	.	*			trans	-99.6	7.8	-170.2	0	0	0	0	0	115.3	N124	A122-N124 VanDerWaalsContact C-N 3.34Å; A122-N124 PolarHBondContact O-N 2.68Å; A122-N124 VanDerWaalsContact O-N 3.14Å
123	D	26.8	Very low	34.6	Very low	123 Å²	123	131.6 Å²	131.6	66%	0.658	64%	0.644	S	S	*	*			trans	-87.9	78.2	172.9	-72	-20.6	0	0	0	109.9	V125 A126	D123-V125 PolarHBondContact O-N 3.4Å; D123-A126 PolarHBondContact O-N 3.05Å; D123-A126 VanDerWaalsContact O-N 3.17Å
124	N	30.8	Very low	36	Very low	153 Å²	153	123.5 Å²	123.5	82%	0.818	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	30.2	179.3	-75.9	-31.4	0	0	0	114.8	A122	A122-N124 VanDerWaalsContact C-N 3.34Å; A122-N124 PolarHBondContact O-N 2.68Å; A122-N124 VanDerWaalsContact O-N 3.14Å
125	V	30.4	Very low	37.6	Very low	142 Å²	142	122 Å²	122	86%	0.861	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	-3.1	168.6	-176.2	0	0	0	0	111.6	D123 M127	D123-V125 PolarHBondContact O-N 3.4Å; V125-M127 PolarHBondContact O-N 2.89Å
126	A	28.6	Very low	39.9	Very low	73 Å²	73	112.3 Å²	112.3	60%	0.603	57%	0.566	S	S	*	*			trans	-83.5	94.7	167.4	0	0	0	0	0	109	D123 S128	D123-A126 PolarHBondContact O-N 3.05Å; D123-A126 VanDerWaalsContact O-N 3.17Å; A126-S128 VanDerWaalsContact C-N 3.31Å; A126-S128 PolarHBondContact O-N 3.37Å
127	M	30.2	Very low	42.4	Very low	164 Å²	164	107.5 Å²	107.5	81%	0.808	56%	0.556	S	S	*	*			trans	-50.3	107.9	150.8	-70	-139.2	85	0	0	106	V125	V125-M127 PolarHBondContact O-N 2.89Å
128	S	34	Very low	44.8	Very low	48 Å²	48	104.4 Å²	104.4	34%	0.336	54%	0.543	S	S	.	.			trans	-57.9	134.9	-174.8	85.3	0	0	0	0	107.7	A126 W130 T131	A126-S128 VanDerWaalsContact C-N 3.31Å; A126-S128 PolarHBondContact O-N 3.37Å; S128-W130 PolarHBondContact O-N 2.85Å; S128-W130 PolarHBondContact OG-N 3.49Å; S128-T131 PolarHBondContact O-N 2.89Å; S128-T131 PolarHBondContact O-OG1 2.89Å; S128-T131 WeakPolarHBondContact OG-CG2 3.42Å; S128-T131 PolarHBondContact OG-N 3.11Å
129	P	37.8	Very low	47.7	Very low	86 Å²	86	102.1 Å²	102.1	56%	0.558	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-10.5	174.8	-24.2	32	0	0	0	113.9	R135	P129-R135 PolarHBondContact O-NH2 3.41Å; P129-R135 VanDerWaalsContact O-NH2 3.13Å
130	W	39.3	Very low	50.7	Low	128 Å²	128	97.4 Å²	97.4	49%	0.485	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	0.7	-163.7	-62.7	97.3	0	0	0	114.8	L77 S128	L77-W130 HydrophobicContact CD1-CE3 4.49Å; S128-W130 PolarHBondContact O-N 2.85Å; S128-W130 PolarHBondContact OG-N 3.49Å
131	T	41.7	Very low	53.6	Low	76 Å²	76	94.5 Å²	94.5	47%	0.466	52%	0.516	S	S	.	.	S	Bend	trans	-91.7	-3	174.8	42.8	0	0	0	0	113.6	S128	S128-T131 PolarHBondContact O-N 2.89Å; S128-T131 PolarHBondContact O-OG1 2.89Å; S128-T131 WeakPolarHBondContact OG-CG2 3.42Å; S128-T131 PolarHBondContact OG-N 3.11Å
132	R	41.4	Very low	56.2	Low	165 Å²	165	90.3 Å²	90.3	62%	0.623	50%	0.496	S	S	*	.			trans	-109.9	105.1	172.7	-170.4	172.6	158.3	166.1	-5.3	109.4	R135	R132-R135 HydrophobicContact CG-CG 4.48Å
133	V	59.2	Low	59.3	Low	24 Å²	24	89.5 Å²	89.5	15%	0.145	48%	0.483	C	S	.	.			trans	-83.4	-48.3	-155.2	-143.2	0	0	0	0	113.2	R74 H82	R74-V133 HydrophobicContact CB-CG1 4.44Å; R74-V133 HydrophobicContact CG-CG1 3.8Å; R74-V133 PolarHBondContact NE-O 3.13Å; R74-V133 PolarHBondContact NH2-O 2.95Å; R74-V133 VanDerWaalsContact NH2-O 3.09Å; H82-V133 HydrophobicContact CB-CB 4Å; H82-V133 HydrophobicContact CB-CG1 3.67Å; H82-V133 HydrophobicContact CB-CG2 3.36Å; H82-V133 VanDerWaalsContact CG-CG2 3.43Å; H82-V133 WeakPolarHBondContact ND1-CG1 3.37Å; H82-V133 WeakPolarHBondContact ND1-CG2 3.45Å; H82-V133 WeakPolarHBondContact O-CG2 3.22Å
134	S	64.9	Low	62.4	Low	30 Å²	30	89.8 Å²	89.8	21%	0.21	48%	0.483	C	S	.	.			trans	-112.6	131.2	165.2	-175.8	0	0	0	0	108.5	F136 E211	S134-F136 VanDerWaalsContact C-N 3.35Å; S134-F136 VanDerWaalsContact OG-CB 3.23Å; S134-F136 WeakPolarHBondContact OG-CB 3.22Å; S134-F136 PolarHBondContact OG-N 3.28Å; S134-F136 VanDerWaalsContact OG-N 3.12Å; S134-E211 WeakPolarHBondContact CB-OE1 3.43Å; S134-E211 PolarHBondContact OG-OE1 2.94Å; S134-E211 PolarHBondContact OG-OE2 2.89Å
135	R	70.7	Confident	65.4	Low	138 Å²	138	88.2 Å²	88.2	52%	0.521	47%	0.471	S	S	.	.			trans	-100.7	9	168.8	-61.8	-177.4	-179	-173.7	0.3	111	P129 R132 I137	P129-R135 PolarHBondContact O-NH2 3.41Å; P129-R135 VanDerWaalsContact O-NH2 3.13Å; R132-R135 HydrophobicContact CG-CG 4.48Å; R135-I137 PolarHBondContact O-N 2.96Å
136	F	81.8	Confident	68.4	Low	33 Å²	33	83.9 Å²	83.9	15%	0.145	44%	0.441	C	S	.	.			trans	-65.7	127.6	176.2	-176.5	-112.9	0	0	0	109.5	S134 P138 T142 H210 E211 L214	S134-F136 VanDerWaalsContact C-N 3.35Å; S134-F136 VanDerWaalsContact OG-CB 3.23Å; S134-F136 WeakPolarHBondContact OG-CB 3.22Å; S134-F136 PolarHBondContact OG-N 3.28Å; S134-F136 VanDerWaalsContact OG-N 3.12Å; F136-P138 HydrophobicContact CD1-CB 4.46Å; F136-P138 HydrophobicContact CE1-CB 3.83Å; F136-P138 WeakPolarHBondContact O-CD 3.36Å; F136-T142 HydrophobicContact CZ-CG2 4.07Å; F136-H210 HydrophobicContact CD1-CB 4.03Å; F136-H210 HydrophobicContact CE1-CB 4.04Å; F136-E211 HydrophobicContact CB-CG 3.94Å; F136-E211 HydrophobicContact CD1-CG 4.03Å; F136-E211 HydrophobicContact CG-CG 4.1Å; F136-L214 HydrophobicContact CE1-CD1 3.67Å; F136-L214 HydrophobicContact CE2-CD1 4.02Å; F136-L214 HydrophobicContact CZ-CD1 3.25Å
137	I	85.4	Confident	71.4	Confident	122 Å²	122	81.6 Å²	81.6	63%	0.626	42%	0.422	S	S	*	.			trans	-108.6	102	176.7	-59.8	176.8	0	0	0	105.8	R135	R135-I137 PolarHBondContact O-N 2.96Å
138	P	85.3	Confident	74.1	Confident	50 Å²	50	77.3 Å²	77.3	33%	0.325	40%	0.4	S	S	.	.			trans	-66.9	137.2	177.7	28.1	-34.1	0	0	0	109.7	F136 H210	F136-P138 HydrophobicContact CD1-CB 4.46Å; F136-P138 HydrophobicContact CE1-CB 3.83Å; F136-P138 WeakPolarHBondContact O-CD 3.36Å; P138-H210 HydrophobicContact CB-CB 4.05Å; P138-H210 HydrophobicContact CG-CB 4.19Å
139	T	90.2	Very high	76.5	Confident	60 Å²	60	78.2 Å²	78.2	37%	0.368	42%	0.417	S	S	.	.			trans	-125.2	155.2	169	72.4	0	0	0	0	109	T141 T142 I143	T139-T141 PolarHBondContact O-N 3.2Å; T139-T142 PolarHBondContact O-N 3.25Å; T139-T142 PolarHBondContact OG1-N 3.47Å; T139-T142 VanDerWaalsContact OG1-N 3.08Å; T139-T142 PolarHBondContact OG1-OG1 2.89Å; T139-I143 PolarHBondContact O-N 3.3Å
140	T	92.4	Very high	79	Confident	110 Å²	110	82.7 Å²	82.7	68%	0.675	42%	0.423	S	S	*	.	H	α-helix	trans	-57.7	-38.4	172.9	47.7	0	0	0	0	111.1	T142 I143 L144	T140-T142 PolarHBondContact O-N 2.72Å; T140-I143 PolarHBondContact O-N 2.96Å; T140-L144 WeakPolarHBondContact O-CG 3.46Å; T140-L144 PolarHBondContact O-N 3.09Å
141	T	92	Very high	81.5	Confident	80 Å²	80	81.6 Å²	81.6	49%	0.491	43%	0.432	S	S	.	.	H	α-helix	trans	-57.4	-48.7	174.7	-51.6	0	0	0	0	112	T139 I143 L144 E145	T139-T141 PolarHBondContact O-N 3.2Å; T141-I143 VanDerWaalsContact C-N 3.28Å; T141-I143 PolarHBondContact O-N 3Å; T141-L144 PolarHBondContact O-N 3.03Å; T141-L144 VanDerWaalsContact O-N 3.12Å; T141-E145 WeakPolarHBondContact O-CG 3.49Å; T141-E145 PolarHBondContact O-N 3.48Å
142	T	90.1	Very high	84	Confident	29 Å²	29	80.6 Å²	80.6	18%	0.178	43%	0.426	C	S	.	.	H	α-helix	trans	-62.2	-37.2	179.4	-49.8	0	0	0	0	112	F136 T139 T140 F146 L214	F136-T142 HydrophobicContact CZ-CG2 4.07Å; T139-T142 PolarHBondContact O-N 3.25Å; T139-T142 PolarHBondContact OG1-N 3.47Å; T139-T142 VanDerWaalsContact OG1-N 3.08Å; T139-T142 PolarHBondContact OG1-OG1 2.89Å; T140-T142 PolarHBondContact O-N 2.72Å; T142-F146 HydrophobicContact CG2-CD2 4.49Å; T142-F146 HydrophobicContact CG2-CE2 4.46Å; T142-F146 VanDerWaalsContact O-CD2 3.26Å; T142-F146 WeakPolarHBondContact O-CD2 3.46Å; T142-F146 PolarHBondContact O-N 3.09Å; T142-L214 HydrophobicContact CG2-CD1 3.7Å; T142-L214 HydrophobicContact CG2-CD2 4.22Å
143	I	91.8	Very high	86.5	Confident	46 Å²	46	79.4 Å²	79.4	24%	0.236	43%	0.426	C	S	.	.	H	α-helix	trans	-66.2	-44.3	175.4	-65.5	164.7	0	0	0	110.3	T139 T140 T141 E145 F146 A147 F227	T139-I143 PolarHBondContact O-N 3.3Å; T140-I143 PolarHBondContact O-N 2.96Å; T141-I143 VanDerWaalsContact C-N 3.28Å; T141-I143 PolarHBondContact O-N 3Å; I143-E145 VanDerWaalsContact C-N 3.34Å; I143-E145 PolarHBondContact O-N 2.75Å; I143-F146 CarbonylContact O-C 3.57Å; I143-F146 PolarHBondContact O-N 2.76Å; I143-F146 VanDerWaalsContact O-N 3.12Å; I143-A147 WeakPolarHBondContact O-CB 3.25Å; I143-A147 PolarHBondContact O-N 3.09Å; I143-F227 HydrophobicContact CD1-CE2 3.82Å; I143-F227 HydrophobicContact CD1-CZ 4.08Å; I143-F227 HydrophobicContact CG1-CZ 4.4Å; I143-F227 HydrophobicContact CG2-CZ 4.04Å
144	L	92.8	Very high	88.1	Confident	128 Å²	128	85.1 Å²	85.1	67%	0.67	46%	0.463	S	S	*	.	H	α-helix	trans	-64.6	-35.7	179.4	-72	171.7	0	0	0	113	T140 T141 F146 A147	T140-L144 WeakPolarHBondContact O-CG 3.46Å; T140-L144 PolarHBondContact O-N 3.09Å; T141-L144 PolarHBondContact O-N 3.03Å; T141-L144 VanDerWaalsContact O-N 3.12Å; L144-F146 PolarHBondContact O-N 3.17Å; L144-A147 PolarHBondContact O-N 2.99Å
145	E	92.3	Very high	89.5	Confident	120 Å²	120	89.5 Å²	89.5	56%	0.561	49%	0.489	S	S	*	.	H	α-helix	trans	-61.8	-31.9	173.8	-72.9	168.6	174.3	0	0	111.9	T141 I143	T141-E145 WeakPolarHBondContact O-CG 3.49Å; T141-E145 PolarHBondContact O-N 3.48Å; I143-E145 VanDerWaalsContact C-N 3.34Å; I143-E145 PolarHBondContact O-N 2.75Å
146	F	93.6	Very high	90.7	Very high	52 Å²	52	84.3 Å²	84.3	23%	0.228	47%	0.472	C	S	.	.	H	α-helix	trans	-95.4	-21.1	-179.1	-82.3	-111.5	0	0	0	113.7	K6 W7 T142 I143 L144 L214 L217 A218	K6-F146 VanDerWaalsContact NZ-C 3.34Å; K6-F146 PolarHBondContact NZ-O 3.02Å; W7-F146 AromaticContact CH2-CD1 3.65Å; W7-F146 HydrophobicContact CH2-CD1 3.65Å; W7-F146 HydrophobicContact CH2-CD2 4.27Å; W7-F146 AromaticContact CH2-CE1 3.7Å; W7-F146 HydrophobicContact CH2-CE1 3.7Å; W7-F146 HydrophobicContact CH2-CE2 4.33Å; W7-F146 AromaticContact CH2-CG 3.95Å; W7-F146 HydrophobicContact CH2-CG 3.95Å; W7-F146 HydrophobicContact CH2-CZ 4.05Å; W7-F146 HydrophobicContact CZ3-CD1 4.39Å; W7-F146 HydrophobicContact CZ3-CE1 4.11Å; T142-F146 HydrophobicContact CG2-CD2 4.49Å; T142-F146 HydrophobicContact CG2-CE2 4.46Å; T142-F146 VanDerWaalsContact O-CD2 3.26Å; T142-F146 WeakPolarHBondContact O-CD2 3.46Å; T142-F146 PolarHBondContact O-N 3.09Å; I143-F146 CarbonylContact O-C 3.57Å; I143-F146 PolarHBondContact O-N 2.76Å; I143-F146 VanDerWaalsContact O-N 3.12Å; L144-F146 PolarHBondContact O-N 3.17Å; F146-L214 HydrophobicContact CB-CD2 3.79Å; F146-L214 HydrophobicContact CD1-CB 4.08Å; F146-L214 HydrophobicContact CD1-CD2 4.11Å; F146-L214 WeakPolarHBondContact CD1-O 3.4Å; F146-L214 HydrophobicContact CD2-CD2 3.96Å; F146-L214 HydrophobicContact CE1-CB 4.19Å; F146-L214 HydrophobicContact CG-CD2 3.69Å; F146-L217 HydrophobicContact CB-CB 3.97Å; F146-L217 HydrophobicContact CB-CD1 4.17Å; F146-A218 HydrophobicContact CD1-CB 4.17Å; F146-A218 HydrophobicContact CE1-CB 4.09Å
147	A	92.3	Very high	91.4	Very high	25 Å²	25	86.6 Å²	86.6	21%	0.207	48%	0.482	C	S	.	.			trans	-79.8	148.9	178.4	0	0	0	0	0	111.3	I143 L144	I143-A147 WeakPolarHBondContact O-CB 3.25Å; I143-A147 PolarHBondContact O-N 3.09Å; L144-A147 PolarHBondContact O-N 2.99Å
148	E	86.6	Confident	92	Very high	73 Å²	73	81 Å²	81	34%	0.341	45%	0.453	S	S	.	.			trans	-77.5	-29.2	168.2	-63.1	-167.5	148.3	0	0	111.8	R150 N223	E148-R150 PolarHBondContact O-N 3.12Å; E148-N223 PolarHBondContact OE2-ND2 3.05Å
149	G	85.6	Confident	92.6	Very high	67 Å²	67	78.6 Å²	78.6	69%	0.691	44%	0.438	S	S	*	.			trans	68.3	16.9	177	0	0	0	0	0	114.8
150	R	89.6	Confident	93	Very high	181 Å²	181	75.8 Å²	75.8	68%	0.683	42%	0.42	S	S	*	.			trans	-105.4	122.6	-179	-65.3	179.1	-174.8	171.4	2.3	109.8	E148 Y185	E148-R150 PolarHBondContact O-N 3.12Å; R150-Y185 VanDerWaalsContact O-CE2 3.28Å; R150-Y185 WeakPolarHBondContact O-CE2 3.39Å; R150-Y185 PolarHBondContact O-OH 3.12Å
151	P	92.2	Very high	93.3	Very high	105 Å²	105	70.6 Å²	70.6	68%	0.682	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-70.8	160.5	174.4	30.8	-35.1	0	0	0	111.6
152	P	94.4	Very high	93.4	Very high	54 Å²	54	67.9 Å²	67.9	35%	0.351	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-62	139.4	173.1	26.2	-33.3	0	0	0	110.6	D156 V158 Y185	P152-D156 HydrophobicContact CB-CB 4.44Å; P152-V158 HydrophobicContact CB-CG2 4Å; P152-V158 HydrophobicContact CG-CG2 4.36Å; P152-Y185 HydrophobicContact CB-CD1 4.1Å; P152-Y185 HydrophobicContact CB-CD2 3.77Å; P152-Y185 HydrophobicContact CB-CE1 4.44Å; P152-Y185 HydrophobicContact CB-CE2 4.13Å; P152-Y185 HydrophobicContact CB-CG 3.74Å; P152-Y185 HydrophobicContact CG-CD1 4.5Å; P152-Y185 HydrophobicContact CG-CE1 4.47Å
153	K	94	Very high	93.6	Very high	140 Å²	140	67.2 Å²	67.2	61%	0.609	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-71.5	156	172.1	-57.6	170.1	-173.8	165	0	109.4	T155 D156	K153-T155 PolarHBondContact O-N 2.81Å; K153-D156 HydrophobicContact CB-CB 4.41Å; K153-D156 WeakPolarHBondContact CB-OD2 3.49Å; K153-D156 WeakPolarHBondContact CG-OD2 3.45Å; K153-D156 PolarHBondContact N-OD2 3.12Å; K153-D156 WeakPolarHBondContact O-CB 3.35Å; K153-D156 PolarHBondContact O-N 3.36Å
154	P	91.3	Very high	93.6	Very high	144 Å²	144	65.4 Å²	65.4	94%	0.935	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-21.2	177.7	-26.1	35.3	0	0	0	114.9
155	T	94.6	Very high	93.7	Very high	122 Å²	122	59.6 Å²	59.6	75%	0.748	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-12.5	178	53.2	0	0	0	0	113.7	K153	K153-T155 PolarHBondContact O-N 2.81Å
156	D	96	Very high	93.8	Very high	30 Å²	30	53.9 Å²	53.9	16%	0.16	31%	0.305	C	S	.	.			trans	-74.3	135.2	-173.4	-70.1	-10.5	0	0	0	109.9	P152 K153 V158 D184	P152-D156 HydrophobicContact CB-CB 4.44Å; K153-D156 HydrophobicContact CB-CB 4.41Å; K153-D156 WeakPolarHBondContact CB-OD2 3.49Å; K153-D156 WeakPolarHBondContact CG-OD2 3.45Å; K153-D156 PolarHBondContact N-OD2 3.12Å; K153-D156 WeakPolarHBondContact O-CB 3.35Å; K153-D156 PolarHBondContact O-N 3.36Å; D156-V158 PolarHBondContact O-N 3.2Å; D156-D184 HydrophobicContact CB-CB 3.91Å
157	K	97.4	Very high	93.7	Very high	81 Å²	81	52.1 Å²	52.1	35%	0.352	30%	0.298	S	S	.	.			trans	-81.9	113.6	170.2	-171.6	177.6	172.1	-156.2	0	109.9	F182 G183 D184 Y185 Q244	K157-F182 WeakPolarHBondContact CD-O 3.38Å; K157-F182 WeakPolarHBondContact CE-O 3.34Å; K157-F182 PolarHBondContact NZ-O 2.62Å; K157-G183 CarbonylContact O-C 3.57Å; K157-G183 WeakPolarHBondContact O-CA 3.42Å; K157-D184 PolarHBondContact N-OD2 2.91Å; K157-D184 PolarHBondContact O-N 3.11Å; K157-Y185 PolarHBondContact O-N 3Å; K157-Q244 HydrophobicContact CD-CB 4.47Å; K157-Q244 HydrophobicContact CG-CB 3.76Å; K157-Q244 HydrophobicContact CG-CG 4.3Å
158	V	98.1	Very high	93.9	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.024	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	124.6	-179.6	-175.7	0	0	0	0	110.5	P152 D156 Y185 I187 N242 V243 Q244 A245	P152-V158 HydrophobicContact CB-CG2 4Å; P152-V158 HydrophobicContact CG-CG2 4.36Å; D156-V158 PolarHBondContact O-N 3.2Å; V158-Y185 WeakPolarHBondContact CA-O 3.34Å; V158-Y185 HydrophobicContact CG1-CD1 4.47Å; V158-I187 HydrophobicContact CG1-CD1 3.53Å; V158-I187 HydrophobicContact CG1-CG1 3.93Å; V158-N242 WeakPolarHBondContact CB-O 3.21Å; V158-V243 HydrophobicContact CG1-CG2 4.43Å; V158-Q244 PolarHBondContact O-N 2.69Å; V158-A245 PolarHBondContact O-N 2.79Å
159	V	98.2	Very high	94.2	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.5	177	-174.1	0	0	0	0	109	F182 Y185 L186 I187 A245 I247	V159-F182 HydrophobicContact CG2-CB 4.11Å; V159-Y185 PolarHBondContact N-O 3.18Å; V159-L186 HydrophobicContact CB-CD1 3.93Å; V159-L186 HydrophobicContact CG1-CD1 3.81Å; V159-I187 PolarHBondContact O-N 3.12Å; V159-A245 CarbonylContact C-O 3.52Å; V159-A245 WeakPolarHBondContact CA-O 3.34Å; V159-A245 HydrophobicContact CG1-CB 4.46Å; V159-A245 HydrophobicContact CG2-CB 4.39Å; V159-I247 HydrophobicContact CG1-CD1 4.29Å; V159-I247 HydrophobicContact CG1-CG1 3.45Å; V159-I247 VanDerWaalsContact CG1-CG1 3.45Å
160	Y	98.3	Very high	94.6	Very high	1 Å²	1	49.2 Å²	49.2	0%	0.004	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.8	176.4	-175.5	-101.3	0	0	0	111.3	T162 I187 V226 I233 I237 A245 V246 I247	Y160-T162 HydrophobicContact CE1-CG2 4.34Å; Y160-I187 WeakPolarHBondContact CA-O 3.36Å; Y160-I187 HydrophobicContact CD2-CB 4.02Å; Y160-I187 HydrophobicContact CD2-CG2 3.84Å; Y160-I187 HydrophobicContact CE2-CG2 4.12Å; Y160-V226 HydrophobicContact CE2-CG2 4.3Å; Y160-I233 HydrophobicContact CD1-CD1 4.15Å; Y160-I233 HydrophobicContact CE1-CD1 4.04Å; Y160-I233 HydrophobicContact CE1-CG1 4.19Å; Y160-I237 HydrophobicContact CD2-CG2 4.46Å; Y160-I237 HydrophobicContact CE1-CG2 4.48Å; Y160-I237 HydrophobicContact CE2-CG2 4.05Å; Y160-A245 PolarHBondContact N-O 2.95Å; Y160-V246 VanDerWaalsContact O-CA 3.31Å; Y160-V246 WeakPolarHBondContact O-CA 3.42Å; Y160-I247 PolarHBondContact O-N 3.05Å
161	V	97.5	Very high	94.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	151	171.3	-58.4	0	0	0	0	108.8	F165 F175 L176 A179 L186 I187 V188 G189 I247	V161-F165 HydrophobicContact CG2-CZ 4.21Å; V161-F175 HydrophobicContact CB-CE1 4.05Å; V161-F175 HydrophobicContact CB-CZ 4.12Å; V161-F175 HydrophobicContact CG1-CE1 4.11Å; V161-F175 HydrophobicContact CG1-CZ 3.87Å; V161-F175 HydrophobicContact CG2-CE1 4.39Å; V161-L176 HydrophobicContact CG2-CD2 3.69Å; V161-A179 HydrophobicContact CG1-CB 3.85Å; V161-L186 HydrophobicContact CG1-CD1 3.99Å; V161-L186 HydrophobicContact CG2-CD1 4.16Å; V161-I187 PolarHBondContact N-O 2.7Å; V161-V188 HydrophobicContact CG2-CB 4.07Å; V161-V188 HydrophobicContact CG2-CG1 3.98Å; V161-V188 HydrophobicContact CG2-CG2 3.7Å; V161-V188 CarbonylContact O-C 3.47Å; V161-G189 PolarHBondContact O-N 3.19Å; V161-I247 HydrophobicContact CG1-CB 3.87Å; V161-I247 HydrophobicContact CG1-CG1 4.47Å
162	T	95.3	Very high	95	Very high	23 Å²	23	37.2 Å²	37.2	14%	0.141	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	149.1	178.5	-172.8	0	0	0	0	111.3	Y160 G189 I233 F268	Y160-T162 HydrophobicContact CE1-CG2 4.34Å; T162-G189 WeakPolarHBondContact CA-O 3.16Å; T162-G189 PolarHBondContact OG1-O 3.05Å; T162-I233 HydrophobicContact CG2-CD1 4.1Å; T162-I233 HydrophobicContact CG2-CG1 4.27Å; T162-F268 HydrophobicContact CG2-CE1 4.3Å; T162-F268 HydrophobicContact CG2-CZ 4.45Å
163	G	93.4	Very high	95.1	Very high	16 Å²	16	34.8 Å²	34.8	17%	0.165	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.4	-176	177.3	0	0	0	0	0	114.6	G189 L191	G163-G189 PolarHBondContact N-O 3.49Å; G163-L191 PolarHBondContact O-N 2.8Å; G163-L191 VanDerWaalsContact O-N 3.09Å
164	S	92.3	Very high	95.2	Very high	8 Å²	8	29 Å²	29	6%	0.056	17%	0.17	C	C	.	.			trans	-71.6	-42.4	174.9	52.2	0	0	0	0	112.6	D166 Y199 K200 R212	S164-D166 PolarHBondContact O-N 3.23Å; S164-D166 VanDerWaalsContact O-N 3.12Å; S164-Y199 VanDerWaalsContact CB-OH 3.27Å; S164-Y199 WeakPolarHBondContact CB-OH 3.48Å; S164-Y199 PolarHBondContact OG-OH 3.47Å; S164-K200 PolarHBondContact OG-NZ 2.97Å; S164-R212 WeakPolarHBondContact O-CD 3.41Å; S164-R212 PolarHBondContact O-NH1 3.18Å
165	F	95.5	Very high	95.4	Very high	5 Å²	5	23.1 Å²	23.1	2%	0.022	13%	0.13	C	C	.	.			trans	47.1	37.1	-170.8	-60.8	-85.1	0	0	0	113.7	V161 F168 H172 F175 L176 V188 I190 V216	V161-F165 HydrophobicContact CG2-CZ 4.21Å; F165-F168 HydrophobicContact CB-CD2 4.45Å; F165-F168 HydrophobicContact CD1-CD2 4.27Å; F165-F168 HydrophobicContact CD1-CE2 4.13Å; F165-H172 HydrophobicContact CD1-CB 4.09Å; F165-H172 AromaticContact CD1-CD2 3.73Å; F165-H172 AromaticContact CD1-CG 3.88Å; F165-H172 HydrophobicContact CE1-CB 4.42Å; F165-F175 HydrophobicContact CE1-CD1 4.48Å; F165-F175 HydrophobicContact CZ-CE1 4.32Å; F165-L176 HydrophobicContact CE1-CD1 4.12Å; F165-L176 HydrophobicContact CE1-CD2 3.97Å; F165-L176 HydrophobicContact CE1-CG 4.19Å; F165-L176 HydrophobicContact CZ-CD2 4.14Å; F165-V188 HydrophobicContact CD2-CG1 3.82Å; F165-V188 HydrophobicContact CE1-CG1 4.21Å; F165-V188 HydrophobicContact CE2-CG1 3.31Å; F165-V188 HydrophobicContact CG-CG1 4.45Å; F165-V188 HydrophobicContact CZ-CG1 3.54Å; F165-I190 HydrophobicContact CB-CD1 4.04Å; F165-I190 HydrophobicContact CD2-CD1 3.5Å; F165-I190 HydrophobicContact CE2-CD1 4.27Å; F165-I190 HydrophobicContact CG-CD1 4.01Å; F165-V216 HydrophobicContact CB-CG2 3.65Å; F165-V216 HydrophobicContact CD1-CG2 4.24Å; F165-V216 HydrophobicContact CG-CG2 3.97Å
166	D	92.9	Very high	95.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	138.3	-179.9	-170.9	25	0	0	0	110.6	S164 H204 P205 I206 M207 T288	S164-D166 PolarHBondContact O-N 3.23Å; S164-D166 VanDerWaalsContact O-N 3.12Å; D166-H204 IonicContact OD2-ND1 2.66Å; D166-H204 PolarHBondContact OD2-ND1 3.34Å; D166-P205 HydrophobicContact CB-CB 4.22Å; D166-P205 VanDerWaalsContact OD2-CA 3.25Å; D166-P205 WeakPolarHBondContact OD2-CA 3.49Å; D166-I206 VanDerWaalsContact CG-N 3.35Å; D166-I206 PolarHBondContact OD1-N 3.43Å; D166-I206 VanDerWaalsContact OD1-N 3.16Å; D166-I206 PolarHBondContact OD2-N 3.06Å; D166-M207 PolarHBondContact OD1-N 3.23Å; D166-T288 HydrophobicContact CB-CG2 4.27Å; D166-T288 PolarHBondContact O-OG1 3.33Å; D166-T288 VanDerWaalsContact O-OG1 3.12Å
167	L	92.3	Very high	95.6	Very high	15 Å²	15	20.3 Å²	20.3	8%	0.079	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.3	63.5	-168.8	-61.6	175.5	0	0	0	111.9	L71 M75 H169 I206 M207 T288 I291 I292	L71-L167 HydrophobicContact CD1-CD2 4.48Å; L71-L167 HydrophobicContact CD2-CD2 4.42Å; M75-L167 HydrophobicContact CE-CD1 3.41Å; M75-L167 VanDerWaalsContact CE-CD1 3.41Å; M75-L167 HydrophobicContact CE-CD2 3.68Å; M75-L167 HydrophobicContact CE-CG 4.22Å; M75-L167 HydrophobicContact CG-CD1 4.5Å; M75-L167 HydrophobicContact SD-CD1 4.1Å; L167-H169 WeakPolarHBondContact O-CB 3.33Å; L167-H169 PolarHBondContact O-CD2 3.17Å; L167-H169 PolarHBondContact O-N 3.32Å; L167-I206 HydrophobicContact CD1-CB 4.36Å; L167-I206 HydrophobicContact CD1-CG1 4.25Å; L167-I206 HydrophobicContact CD1-CG2 4.45Å; L167-I206 HydrophobicContact CD2-CB 4.27Å; L167-I206 HydrophobicContact CD2-CG2 4Å; L167-I206 HydrophobicContact CG-CB 4.16Å; L167-I206 HydrophobicContact CG-CG2 4.36Å; L167-M207 HydrophobicContact CD2-CG 4Å; L167-M207 HydrophobicContact CD2-SD 3.91Å; L167-T288 HydrophobicContact CB-CG2 4.23Å; L167-T288 HydrophobicContact CD1-CG2 3.81Å; L167-T288 HydrophobicContact CG-CG2 4.15Å; L167-I291 HydrophobicContact CD1-CG2 4.29Å; L167-I292 HydrophobicContact CD1-CG1 4.26Å
168	F	95.8	Very high	95.5	Very high	21 Å²	21	19.8 Å²	19.8	9%	0.092	11%	0.105	C	C	.	.			trans	-45.1	125	-173.6	-167.5	-80.8	0	0	0	112.6	M1 F165 H172 L173 L176 V216 Y219	M1-F168 HydrophobicContact CE-CD1 4.22Å; F165-F168 HydrophobicContact CB-CD2 4.45Å; F165-F168 HydrophobicContact CD1-CD2 4.27Å; F165-F168 HydrophobicContact CD1-CE2 4.13Å; F168-H172 HydrophobicContact CD2-CB 4Å; F168-H172 HydrophobicContact CE1-CB 4.38Å; F168-H172 HydrophobicContact CE2-CB 3.73Å; F168-H172 HydrophobicContact CG-CB 4.46Å; F168-H172 HydrophobicContact CZ-CB 3.94Å; F168-L173 HydrophobicContact CE1-CB 4.19Å; F168-L173 HydrophobicContact CZ-CB 4.48Å; F168-L176 HydrophobicContact CE2-CD1 3.71Å; F168-L176 HydrophobicContact CZ-CD1 3.78Å; F168-V216 HydrophobicContact CD2-CG2 3.63Å; F168-V216 HydrophobicContact CE2-CG2 3.87Å; F168-Y219 AromaticContact CD1-CD2 3.83Å; F168-Y219 HydrophobicContact CD1-CD2 3.83Å; F168-Y219 HydrophobicContact CD1-CE1 4.38Å; F168-Y219 AromaticContact CD1-CE2 3.29Å; F168-Y219 HydrophobicContact CD1-CE2 3.29Å; F168-Y219 AromaticContact CD1-CZ 3.62Å; F168-Y219 AromaticContact CE1-CD1 3.91Å; F168-Y219 HydrophobicContact CE1-CD1 3.91Å; F168-Y219 AromaticContact CE1-CD2 3.37Å; F168-Y219 HydrophobicContact CE1-CD2 3.37Å; F168-Y219 AromaticContact CE1-CE1 3.8Å; F168-Y219 HydrophobicContact CE1-CE1 3.8Å; F168-Y219 AromaticContact CE1-CE2 3.25Å; F168-Y219 HydrophobicContact CE1-CE2 3.25Å; F168-Y219 AromaticContact CE1-CG 3.71Å; F168-Y219 HydrophobicContact CE1-CG 3.71Å; F168-Y219 AromaticContact CE1-CZ 3.47Å; F168-Y219 VanDerWaalsContact CE1-CZ 3.47Å; F168-Y219 HydrophobicContact CG-CE2 4.18Å; F168-Y219 HydrophobicContact CZ-CD1 4.45Å; F168-Y219 AromaticContact CZ-CD2 3.75Å; F168-Y219 HydrophobicContact CZ-CD2 3.75Å; F168-Y219 HydrophobicContact CZ-CE2 4.09Å; F168-Y219 AromaticContact CZ-CG 3.96Å; F168-Y219 HydrophobicContact CZ-CG 3.96Å
169	H	94.6	Very high	95.5	Very high	13 Å²	13	19.6 Å²	19.6	6%	0.06	10%	0.103	C	C	.	.			trans	-144.5	175.5	-164	58	64.1	0	0	0	111.8	M1 L167 G171 H172 L173 M286 T288 I291	M1-H169 VanDerWaalsContact SD-C 3.57Å; L167-H169 WeakPolarHBondContact O-CB 3.33Å; L167-H169 PolarHBondContact O-CD2 3.17Å; L167-H169 PolarHBondContact O-N 3.32Å; H169-G171 VanDerWaalsContact C-N 3.26Å; H169-G171 PolarHBondContact ND1-N 2.83Å; H169-G171 PolarHBondContact O-N 3.5Å; H169-H172 AromaticContact CD2-CE1 3.59Å; H169-H172 AromaticContact CD2-ND1 3.58Å; H169-H172 AromaticContact CE1-CE1 3.56Å; H169-H172 AromaticContact CE1-CG 3.9Å; H169-H172 AromaticContact CE1-ND1 3.54Å; H169-H172 AromaticContact CE1-NE2 3.95Å; H169-H172 AromaticContact CG-ND1 3.73Å; H169-H172 PolarHBondContact ND1-N 3.34Å; H169-H172 AromaticContact ND1-ND1 3.69Å; H169-H172 AromaticContact NE2-CE1 3.18Å; H169-H172 PolarHBondContact NE2-CE1 3.22Å; H169-H172 AromaticContact NE2-ND1 3.48Å; H169-H172 PolarHBondContact NE2-ND1 3.08Å; H169-H172 AromaticContact NE2-NE2 3.82Å; H169-H172 WeakPolarHBondContact O-CB 3.32Å; H169-H172 PolarHBondContact O-N 3.5Å; H169-L173 PolarHBondContact O-N 3.22Å; H169-L173 VanDerWaalsContact O-N 3.12Å; H169-M286 PolarHBondContact CE1-O 3.46Å; H169-T288 PolarHBondContact NE2-N 3.44Å; H169-I291 HydrophobicContact CB-CD1 3.44Å; H169-I291 VanDerWaalsContact CB-CD1 3.44Å; H169-I291 WeakPolarHBondContact CD2-CD1 3.35Å
170	I	93.7	Very high	95.3	Very high	70 Å²	70	22 Å²	22	36%	0.359	11%	0.114	S	C	.	.	H	α-helix	trans	-59	-35.2	-172.3	-168.2	59.8	0	0	0	113.5	M1 H172 L173 A174 M286	M1-I170 HydrophobicContact CG-CB 4.13Å; M1-I170 HydrophobicContact CG-CD1 4.13Å; M1-I170 WeakPolarHBondContact SD-CA 3.42Å; M1-I170 HydrophobicContact SD-CB 3.79Å; M1-I170 HydrophobicContact SD-CD1 3.88Å; M1-I170 HydrophobicContact SD-CG1 4.44Å; M1-I170 PolarHBondContact SD-N 3.01Å; I170-H172 PolarHBondContact O-N 3.15Å; I170-L173 HydrophobicContact CD1-CB 4.45Å; I170-L173 HydrophobicContact CD1-CD2 4.12Å; I170-L173 PolarHBondContact O-N 3.07Å; I170-A174 WeakPolarHBondContact O-CB 3.5Å; I170-A174 PolarHBondContact O-N 2.82Å; I170-M286 HydrophobicContact CG2-CB 4.06Å; I170-M286 HydrophobicContact CG2-CG 4.13Å
171	G	93.3	Very high	95.3	Very high	6 Å²	6	29.4 Å²	29.4	6%	0.062	15%	0.148	C	C	.	.	H	α-helix	trans	-60.3	-40.9	173.4	0	0	0	0	0	113.6	H169 F175	H169-G171 VanDerWaalsContact C-N 3.26Å; H169-G171 PolarHBondContact ND1-N 2.83Å; H169-G171 PolarHBondContact O-N 3.5Å; G171-F175 VanDerWaalsContact O-CB 3.31Å; G171-F175 WeakPolarHBondContact O-CB 3.31Å; G171-F175 PolarHBondContact O-N 3.21Å
172	H	95.7	Very high	95.2	Very high	28 Å²	28	32.3 Å²	32.3	13%	0.13	16%	0.161	C	C	.	.	H	α-helix	trans	-66.3	-43.3	174.2	-64.5	131.4	0	0	0	111.1	F165 F168 H169 I170 F175 L176	F165-H172 HydrophobicContact CD1-CB 4.09Å; F165-H172 AromaticContact CD1-CD2 3.73Å; F165-H172 AromaticContact CD1-CG 3.88Å; F165-H172 HydrophobicContact CE1-CB 4.42Å; F168-H172 HydrophobicContact CD2-CB 4Å; F168-H172 HydrophobicContact CE1-CB 4.38Å; F168-H172 HydrophobicContact CE2-CB 3.73Å; F168-H172 HydrophobicContact CG-CB 4.46Å; F168-H172 HydrophobicContact CZ-CB 3.94Å; H169-H172 AromaticContact CD2-CE1 3.59Å; H169-H172 AromaticContact CD2-ND1 3.58Å; H169-H172 AromaticContact CE1-CE1 3.56Å; H169-H172 AromaticContact CE1-CG 3.9Å; H169-H172 AromaticContact CE1-ND1 3.54Å; H169-H172 AromaticContact CE1-NE2 3.95Å; H169-H172 AromaticContact CG-ND1 3.73Å; H169-H172 PolarHBondContact ND1-N 3.34Å; H169-H172 AromaticContact ND1-ND1 3.69Å; H169-H172 AromaticContact NE2-CE1 3.18Å; H169-H172 PolarHBondContact NE2-CE1 3.22Å; H169-H172 AromaticContact NE2-ND1 3.48Å; H169-H172 PolarHBondContact NE2-ND1 3.08Å; H169-H172 AromaticContact NE2-NE2 3.82Å; H169-H172 WeakPolarHBondContact O-CB 3.32Å; H169-H172 PolarHBondContact O-N 3.5Å; I170-H172 PolarHBondContact O-N 3.15Å; H172-F175 PolarHBondContact O-N 3.23Å; H172-L176 WeakPolarHBondContact O-CB 3.44Å; H172-L176 VanDerWaalsContact O-CG 3.26Å; H172-L176 WeakPolarHBondContact O-CG 3.27Å; H172-L176 PolarHBondContact O-N 3.17Å
173	L	96.4	Very high	95.3	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-51.2	178.5	178.8	57	0	0	0	111.7	M1 F168 H169 I170 F175 L176 E177 Y219 P221	M1-L173 HydrophobicContact SD-CB 4.42Å; M1-L173 HydrophobicContact SD-CD2 4.21Å; F168-L173 HydrophobicContact CE1-CB 4.19Å; F168-L173 HydrophobicContact CZ-CB 4.48Å; H169-L173 PolarHBondContact O-N 3.22Å; H169-L173 VanDerWaalsContact O-N 3.12Å; I170-L173 HydrophobicContact CD1-CB 4.45Å; I170-L173 HydrophobicContact CD1-CD2 4.12Å; I170-L173 PolarHBondContact O-N 3.07Å; L173-F175 VanDerWaalsContact C-N 3.26Å; L173-F175 PolarHBondContact O-N 3.32Å; L173-L176 PolarHBondContact O-N 3.42Å; L173-L176 VanDerWaalsContact O-N 3.11Å; L173-E177 HydrophobicContact CD1-CG 4.13Å; L173-E177 HydrophobicContact CG-CG 4.48Å; L173-E177 WeakPolarHBondContact O-CG 3.13Å; L173-E177 PolarHBondContact O-N 3.27Å; L173-Y219 HydrophobicContact CD1-CD1 3.63Å; L173-Y219 HydrophobicContact CD1-CE1 4.34Å; L173-Y219 HydrophobicContact CD1-CG 4.35Å; L173-Y219 HydrophobicContact CD2-CD1 4.08Å; L173-Y219 HydrophobicContact CD2-CE1 3.99Å; L173-Y219 HydrophobicContact CG-CD1 4.36Å; L173-P221 HydrophobicContact CD1-CG 4.23Å
174	A	95.9	Very high	95.4	Very high	19 Å²	19	35.5 Å²	35.5	16%	0.157	18%	0.176	C	C	.	.	H	α-helix	trans	-60.6	-36.4	178.7	0	0	0	0	0	112.3	I170 K178	I170-A174 WeakPolarHBondContact O-CB 3.5Å; I170-A174 PolarHBondContact O-N 2.82Å; A174-K178 PolarHBondContact O-N 3.24Å
175	F	96.6	Very high	95.7	Very high	20 Å²	20	35.7 Å²	35.7	9%	0.088	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-48.1	172.4	166.1	-109.1	0	0	0	112.2	V161 F165 G171 H172 L173 E177 K178 A179 I247 G249 V280	V161-F175 HydrophobicContact CB-CE1 4.05Å; V161-F175 HydrophobicContact CB-CZ 4.12Å; V161-F175 HydrophobicContact CG1-CE1 4.11Å; V161-F175 HydrophobicContact CG1-CZ 3.87Å; V161-F175 HydrophobicContact CG2-CE1 4.39Å; F165-F175 HydrophobicContact CE1-CD1 4.48Å; F165-F175 HydrophobicContact CZ-CE1 4.32Å; G171-F175 VanDerWaalsContact O-CB 3.31Å; G171-F175 WeakPolarHBondContact O-CB 3.31Å; G171-F175 PolarHBondContact O-N 3.21Å; H172-F175 PolarHBondContact O-N 3.23Å; L173-F175 VanDerWaalsContact C-N 3.26Å; L173-F175 PolarHBondContact O-N 3.32Å; F175-E177 PolarHBondContact O-N 2.88Å; F175-K178 PolarHBondContact O-N 3.12Å; F175-A179 WeakPolarHBondContact O-CB 3.45Å; F175-A179 PolarHBondContact O-N 3.34Å; F175-I247 HydrophobicContact CE2-CG2 4.12Å; F175-G249 VanDerWaalsContact CE2-N 3.32Å; F175-V280 HydrophobicContact CD2-CG2 3.69Å; F175-V280 HydrophobicContact CE2-CG2 3.63Å
176	L	97.3	Very high	95.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.6	-34.8	-178.4	-67.7	173.5	0	0	0	112.3	V161 F165 F168 H172 L173 A179 K180 L186 V188 P221 V222	V161-L176 HydrophobicContact CG2-CD2 3.69Å; F165-L176 HydrophobicContact CE1-CD1 4.12Å; F165-L176 HydrophobicContact CE1-CD2 3.97Å; F165-L176 HydrophobicContact CE1-CG 4.19Å; F165-L176 HydrophobicContact CZ-CD2 4.14Å; F168-L176 HydrophobicContact CE2-CD1 3.71Å; F168-L176 HydrophobicContact CZ-CD1 3.78Å; H172-L176 WeakPolarHBondContact O-CB 3.44Å; H172-L176 VanDerWaalsContact O-CG 3.26Å; H172-L176 WeakPolarHBondContact O-CG 3.27Å; H172-L176 PolarHBondContact O-N 3.17Å; L173-L176 PolarHBondContact O-N 3.42Å; L173-L176 VanDerWaalsContact O-N 3.11Å; L176-A179 PolarHBondContact O-N 2.8Å; L176-K180 VanDerWaalsContact O-CB 3.32Å; L176-K180 WeakPolarHBondContact O-CB 3.23Å; L176-K180 PolarHBondContact O-N 2.97Å; L176-L186 HydrophobicContact CB-CD2 4.27Å; L176-L186 HydrophobicContact CD2-CD2 4.02Å; L176-V188 HydrophobicContact CD2-CG2 3.91Å; L176-P221 HydrophobicContact CB-CB 4.27Å; L176-V222 HydrophobicContact CD1-CG2 3.92Å
177	E	96.5	Very high	96	Very high	92 Å²	92	35.6 Å²	35.6	43%	0.43	18%	0.175	S	C	.	.	H	α-helix	trans	-59.9	-46.6	172.5	-74.4	171.6	166.5	0	0	110.9	L173 F175 K180 E181 P221	L173-E177 HydrophobicContact CD1-CG 4.13Å; L173-E177 HydrophobicContact CG-CG 4.48Å; L173-E177 WeakPolarHBondContact O-CG 3.13Å; L173-E177 PolarHBondContact O-N 3.27Å; F175-E177 PolarHBondContact O-N 2.88Å; E177-K180 WeakPolarHBondContact O-CB 3.42Å; E177-K180 PolarHBondContact O-N 3.32Å; E177-E181 PolarHBondContact O-N 3.48Å; E177-P221 HydrophobicContact CG-CG 3.84Å
178	K	96.4	Very high	96.3	Very high	71 Å²	71	34.9 Å²	34.9	31%	0.309	17%	0.172	S	C	.	.	H	α-helix	trans	-67.5	-39.4	175.2	-74.5	177.1	172.1	170	0	113.1	A174 F175 K180 E181 F182 V280 D281 S282	A174-K178 PolarHBondContact O-N 3.24Å; F175-K178 PolarHBondContact O-N 3.12Å; K178-K180 PolarHBondContact O-N 3.06Å; K178-E181 WeakPolarHBondContact O-CB 3.42Å; K178-E181 PolarHBondContact O-N 2.95Å; K178-F182 WeakPolarHBondContact O-CD2 3.44Å; K178-V280 HydrophobicContact CB-CG2 4.42Å; K178-D281 WeakPolarHBondContact CD-O 3.26Å; K178-D281 WeakPolarHBondContact CE-O 3.42Å; K178-D281 PolarHBondContact NZ-O 3.46Å; K178-S282 PolarHBondContact NZ-O 2.81Å
179	A	96.9	Very high	96.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.9	-35.6	175.9	0	0	0	0	0	111.5	V161 F175 L176 E181 F182 L186 I247	V161-A179 HydrophobicContact CG1-CB 3.85Å; F175-A179 WeakPolarHBondContact O-CB 3.45Å; F175-A179 PolarHBondContact O-N 3.34Å; L176-A179 PolarHBondContact O-N 2.8Å; A179-E181 PolarHBondContact O-N 3.47Å; A179-F182 WeakPolarHBondContact O-CB 3.35Å; A179-F182 PolarHBondContact O-N 3.48Å; A179-F182 VanDerWaalsContact O-N 3.15Å; A179-L186 HydrophobicContact CB-CD1 4.35Å; A179-I247 HydrophobicContact CB-CB 4.05Å; A179-I247 HydrophobicContact CB-CG1 4.17Å; A179-I247 HydrophobicContact CB-CG2 4.04Å
180	K	95.9	Very high	96.5	Very high	51 Å²	51	33.2 Å²	33.2	22%	0.222	16%	0.164	C	C	.	.	H	α-helix	trans	-64.1	-26.4	177.2	-173.4	62.3	177.3	-178.4	0	112.9	L176 E177 K178 F182 G183 D184 L186 P221 N223	L176-K180 VanDerWaalsContact O-CB 3.32Å; L176-K180 WeakPolarHBondContact O-CB 3.23Å; L176-K180 PolarHBondContact O-N 2.97Å; E177-K180 WeakPolarHBondContact O-CB 3.42Å; E177-K180 PolarHBondContact O-N 3.32Å; K178-K180 PolarHBondContact O-N 3.06Å; K180-F182 PolarHBondContact O-N 3.21Å; K180-F182 VanDerWaalsContact O-N 3.13Å; K180-G183 PolarHBondContact O-N 3.19Å; K180-D184 PolarHBondContact NZ-O 3.29Å; K180-L186 HydrophobicContact CB-CD2 4.42Å; K180-L186 HydrophobicContact CD-CB 3.91Å; K180-P221 HydrophobicContact CB-CB 4.21Å; K180-P221 HydrophobicContact CG-CB 4.43Å; K180-N223 PolarHBondContact NZ-OD1 3.26Å
181	E	96.4	Very high	96.5	Very high	155 Å²	155	30.2 Å²	30.2	72%	0.724	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-17.5	175.5	-63.2	173.7	-163.9	0	0	113	E177 K178 A179	E177-E181 PolarHBondContact O-N 3.48Å; K178-E181 WeakPolarHBondContact O-CB 3.42Å; K178-E181 PolarHBondContact O-N 2.95Å; A179-E181 PolarHBondContact O-N 3.47Å
182	F	96.9	Very high	96.4	Very high	61 Å²	61	31.1 Å²	31.1	27%	0.268	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-5.7	-179.5	-72.1	-103.8	0	0	0	113.9	K157 V159 K178 A179 K180 A245 I247 H278 V280	K157-F182 WeakPolarHBondContact CD-O 3.38Å; K157-F182 WeakPolarHBondContact CE-O 3.34Å; K157-F182 PolarHBondContact NZ-O 2.62Å; V159-F182 HydrophobicContact CG2-CB 4.11Å; K178-F182 WeakPolarHBondContact O-CD2 3.44Å; A179-F182 WeakPolarHBondContact O-CB 3.35Å; A179-F182 PolarHBondContact O-N 3.48Å; A179-F182 VanDerWaalsContact O-N 3.15Å; K180-F182 PolarHBondContact O-N 3.21Å; K180-F182 VanDerWaalsContact O-N 3.13Å; F182-A245 HydrophobicContact CB-CB 4.47Å; F182-I247 HydrophobicContact CB-CD1 3.8Å; F182-I247 HydrophobicContact CB-CG1 4.32Å; F182-I247 HydrophobicContact CD1-CD1 3.64Å; F182-I247 HydrophobicContact CD2-CD1 3.96Å; F182-I247 HydrophobicContact CD2-CG1 4.43Å; F182-I247 HydrophobicContact CE1-CD1 4.2Å; F182-I247 HydrophobicContact CG-CD1 3.51Å; F182-I247 HydrophobicContact CG-CG1 4.28Å; F182-H278 HydrophobicContact CD1-CB 4.39Å; F182-H278 HydrophobicContact CE1-CB 3.9Å; F182-H278 AromaticContact CE1-CG 3.83Å; F182-H278 HydrophobicContact CZ-CB 4.46Å; F182-V280 HydrophobicContact CD2-CG1 4.43Å; F182-V280 HydrophobicContact CE2-CG1 3.45Å; F182-V280 VanDerWaalsContact CE2-CG1 3.45Å; F182-V280 HydrophobicContact CZ-CG1 3.67Å
183	G	96.1	Very high	96	Very high	11 Å²	11	31.1 Å²	31.1	11%	0.113	16%	0.155	C	C	.	.			trans	175.7	176	176.9	0	0	0	0	0	115.2	K157 K180	K157-G183 CarbonylContact O-C 3.57Å; K157-G183 WeakPolarHBondContact O-CA 3.42Å; K180-G183 PolarHBondContact O-N 3.19Å
184	D	96.4	Very high	95.5	Very high	96 Å²	96	37 Å²	37	51%	0.513	18%	0.182	S	C	.	.	S	Bend	trans	-87.7	-16.1	-167.3	-46.9	-76.7	0	0	0	113.7	D156 K157 K180	D156-D184 HydrophobicContact CB-CB 3.91Å; K157-D184 PolarHBondContact N-OD2 2.91Å; K157-D184 PolarHBondContact O-N 3.11Å; K180-D184 PolarHBondContact NZ-O 3.29Å
185	Y	97.6	Very high	95	Very high	12 Å²	12	37.1 Å²	37.1	5%	0.047	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	115.3	-176.8	-162.9	-85.6	0	0	0	111.2	R150 P152 K157 V158 V159 I187 N223 E224	R150-Y185 VanDerWaalsContact O-CE2 3.28Å; R150-Y185 WeakPolarHBondContact O-CE2 3.39Å; R150-Y185 PolarHBondContact O-OH 3.12Å; P152-Y185 HydrophobicContact CB-CD1 4.1Å; P152-Y185 HydrophobicContact CB-CD2 3.77Å; P152-Y185 HydrophobicContact CB-CE1 4.44Å; P152-Y185 HydrophobicContact CB-CE2 4.13Å; P152-Y185 HydrophobicContact CB-CG 3.74Å; P152-Y185 HydrophobicContact CG-CD1 4.5Å; P152-Y185 HydrophobicContact CG-CE1 4.47Å; K157-Y185 PolarHBondContact O-N 3Å; V158-Y185 WeakPolarHBondContact CA-O 3.34Å; V158-Y185 HydrophobicContact CG1-CD1 4.47Å; V159-Y185 PolarHBondContact N-O 3.18Å; Y185-I187 HydrophobicContact CD1-CD1 4.25Å; Y185-I187 HydrophobicContact CD1-CG1 3.75Å; Y185-I187 HydrophobicContact CE1-CD1 4.15Å; Y185-I187 HydrophobicContact CE1-CG1 3.74Å; Y185-N223 HydrophobicContact CD1-CB 4.11Å; Y185-N223 HydrophobicContact CD2-CB 3.83Å; Y185-N223 HydrophobicContact CE1-CB 3.87Å; Y185-N223 HydrophobicContact CE2-CB 3.58Å; Y185-N223 HydrophobicContact CG-CB 4.1Å; Y185-E224 HydrophobicContact CE1-CB 3.78Å
186	L	97.9	Very high	94.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.6	-175.4	-179	63.3	0	0	0	111.1	V159 V161 L176 A179 K180 V188 P221 N223 E224	V159-L186 HydrophobicContact CB-CD1 3.93Å; V159-L186 HydrophobicContact CG1-CD1 3.81Å; V161-L186 HydrophobicContact CG1-CD1 3.99Å; V161-L186 HydrophobicContact CG2-CD1 4.16Å; L176-L186 HydrophobicContact CB-CD2 4.27Å; L176-L186 HydrophobicContact CD2-CD2 4.02Å; A179-L186 HydrophobicContact CB-CD1 4.35Å; K180-L186 HydrophobicContact CB-CD2 4.42Å; K180-L186 HydrophobicContact CD-CB 3.91Å; L186-V188 HydrophobicContact CG-CG2 4.29Å; L186-P221 WeakPolarHBondContact CB-O 3.34Å; L186-P221 HydrophobicContact CD2-CB 4.16Å; L186-P221 WeakPolarHBondContact CD2-O 3.45Å; L186-N223 PolarHBondContact N-OD1 3.17Å; L186-N223 PolarHBondContact O-N 2.76Å; L186-E224 PolarHBondContact O-N 3.4Å
187	I	97.8	Very high	93.8	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	126.5	175.1	-52.5	-174	0	0	0	109	V158 V159 Y160 V161 Y185 E224 V226 F241	V158-I187 HydrophobicContact CG1-CD1 3.53Å; V158-I187 HydrophobicContact CG1-CG1 3.93Å; V159-I187 PolarHBondContact O-N 3.12Å; Y160-I187 WeakPolarHBondContact CA-O 3.36Å; Y160-I187 HydrophobicContact CD2-CB 4.02Å; Y160-I187 HydrophobicContact CD2-CG2 3.84Å; Y160-I187 HydrophobicContact CE2-CG2 4.12Å; V161-I187 PolarHBondContact N-O 2.7Å; Y185-I187 HydrophobicContact CD1-CD1 4.25Å; Y185-I187 HydrophobicContact CD1-CG1 3.75Å; Y185-I187 HydrophobicContact CE1-CD1 4.15Å; Y185-I187 HydrophobicContact CE1-CG1 3.74Å; I187-E224 CarbonylContact C-O 3.53Å; I187-E224 WeakPolarHBondContact CA-O 3.4Å; I187-E224 HydrophobicContact CG1-CB 4.2Å; I187-E224 HydrophobicContact CG2-CB 4.41Å; I187-V226 HydrophobicContact CG2-CG2 3.72Å; I187-F241 HydrophobicContact CD1-CB 3.72Å; I187-F241 HydrophobicContact CD1-CD1 3.73Å; I187-F241 HydrophobicContact CD1-CG 3.81Å
188	V	98.1	Very high	93	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	111.5	179.4	-174.7	0	0	0	0	110.4	V161 F165 L176 L186 I190 V216 V222 E224 V225 V226	V161-V188 HydrophobicContact CG2-CB 4.07Å; V161-V188 HydrophobicContact CG2-CG1 3.98Å; V161-V188 HydrophobicContact CG2-CG2 3.7Å; V161-V188 CarbonylContact O-C 3.47Å; F165-V188 HydrophobicContact CD2-CG1 3.82Å; F165-V188 HydrophobicContact CE1-CG1 4.21Å; F165-V188 HydrophobicContact CE2-CG1 3.31Å; F165-V188 HydrophobicContact CG-CG1 4.45Å; F165-V188 HydrophobicContact CZ-CG1 3.54Å; L176-V188 HydrophobicContact CD2-CG2 3.91Å; L186-V188 HydrophobicContact CG-CG2 4.29Å; V188-I190 HydrophobicContact CG1-CD1 3.72Å; V188-V216 HydrophobicContact CB-CG1 3.9Å; V188-V216 HydrophobicContact CG1-CG1 3.81Å; V188-V216 HydrophobicContact CG2-CG1 4.06Å; V188-V222 HydrophobicContact CG2-CB 4.49Å; V188-V222 HydrophobicContact CG2-CG1 3.94Å; V188-V222 HydrophobicContact CG2-CG2 3.91Å; V188-E224 PolarHBondContact N-O 2.8Å; V188-V225 HydrophobicContact CB-CG2 4.35Å; V188-V225 CarbonylContact O-C 3.57Å; V188-V225 VanDerWaalsContact O-CA 3.27Å; V188-V225 WeakPolarHBondContact O-CA 3.35Å; V188-V226 PolarHBondContact O-N 3.48Å
189	G	97.6	Very high	92	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	121.5	169.8	0	0	0	0	0	112.2	V161 T162 G163	V161-G189 PolarHBondContact O-N 3.19Å; T162-G189 WeakPolarHBondContact CA-O 3.16Å; T162-G189 PolarHBondContact OG1-O 3.05Å; G163-G189 PolarHBondContact N-O 3.49Å
190	I	97	Very high	90.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	111.5	179.2	-56.3	-60.6	0	0	0	108.5	F165 V188 I209 R212 V213 V216 V225 V226 G228 A229	F165-I190 HydrophobicContact CB-CD1 4.04Å; F165-I190 HydrophobicContact CD2-CD1 3.5Å; F165-I190 HydrophobicContact CE2-CD1 4.27Å; F165-I190 HydrophobicContact CG-CD1 4.01Å; V188-I190 HydrophobicContact CG1-CD1 3.72Å; I190-I209 HydrophobicContact CG2-CG1 4.01Å; I190-R212 HydrophobicContact CG2-CB 4.25Å; I190-V213 HydrophobicContact CB-CG2 4.46Å; I190-V213 HydrophobicContact CG1-CG2 4.33Å; I190-V213 HydrophobicContact CG2-CG2 4.39Å; I190-V216 HydrophobicContact CD1-CB 4.31Å; I190-V216 HydrophobicContact CD1-CG1 4.34Å; I190-V216 HydrophobicContact CD1-CG2 3.79Å; I190-V225 HydrophobicContact CB-CG1 4.41Å; I190-V225 HydrophobicContact CG1-CG1 3.46Å; I190-V225 VanDerWaalsContact CG1-CG1 3.46Å; I190-V226 PolarHBondContact N-O 3.38Å; I190-G228 CarbonylContact O-C 3.6Å; I190-G228 VanDerWaalsContact O-CA 3.22Å; I190-G228 WeakPolarHBondContact O-CA 3.36Å; I190-G228 PolarHBondContact O-N 2.92Å; I190-A229 PolarHBondContact O-N 3.34Å
191	L	94	Very high	89.7	Confident	7 Å²	7	38.3 Å²	38.3	4%	0.037	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	148.8	179	-61.9	179.1	0	0	0	111.3	G163 T195 V196 Y199 R212 A229 P230 Y231	G163-L191 PolarHBondContact O-N 2.8Å; G163-L191 VanDerWaalsContact O-N 3.09Å; L191-T195 HydrophobicContact CB-CG2 4.4Å; L191-T195 HydrophobicContact CD1-CG2 4.36Å; L191-T195 HydrophobicContact CD2-CG2 4.45Å; L191-V196 HydrophobicContact CB-CG2 3.72Å; L191-V196 HydrophobicContact CD1-CG2 4.45Å; L191-Y199 HydrophobicContact CD1-CE1 3.77Å; L191-R212 PolarHBondContact O-NH1 3.23Å; L191-R212 PolarHBondContact O-NH2 3.02Å; L191-A229 WeakPolarHBondContact CD2-O 3.23Å; L191-P230 WeakPolarHBondContact CD2-O 3.48Å; L191-Y231 HydrophobicContact CD1-CD2 4.3Å
192	S	90.6	Very high	88.5	Confident	25 Å²	25	34.6 Å²	34.6	18%	0.175	18%	0.182	C	C	.	.			trans	-63.5	155.8	175.7	79.9	0	0	0	0	112.4	Q194 T195 V196	S192-Q194 PolarHBondContact O-N 2.66Å; S192-T195 PolarHBondContact O-N 2.96Å; S192-T195 WeakPolarHBondContact OG-CB 3.39Å; S192-T195 PolarHBondContact OG-N 3.41Å; S192-T195 PolarHBondContact OG-OG1 2.79Å; S192-V196 WeakPolarHBondContact O-CG2 3.47Å; S192-V196 PolarHBondContact O-N 3.16Å
193	D	87.9	Confident	87.4	Confident	27 Å²	27	32.1 Å²	32.1	14%	0.144	17%	0.172	C	C	.	.	H	α-helix	trans	-60	-38.4	178.3	-65.9	-20.1	0	0	0	111.2	V196 N197 P205 I209 R212	D193-V196 PolarHBondContact O-N 3.19Å; D193-N197 WeakPolarHBondContact O-CB 3.32Å; D193-N197 PolarHBondContact O-N 2.73Å; D193-P205 HydrophobicContact CB-CG 3.99Å; D193-P205 WeakPolarHBondContact O-CD 3.37Å; D193-P205 VanDerWaalsContact OD1-CG 3.32Å; D193-P205 WeakPolarHBondContact OD1-CG 3.37Å; D193-I209 PolarHBondContact OD1-N 2.93Å; D193-I209 PolarHBondContact OD2-N 2.67Å; D193-R212 IonicContact OD1-CZ 2.75Å; D193-R212 IonicContact OD1-NE 3.43Å; D193-R212 IonicContact OD1-NH2 3.61Å; D193-R212 PolarHBondContact OD1-NH2 3.14Å
194	Q	84.9	Confident	86.6	Confident	127 Å²	127	32.3 Å²	32.3	59%	0.593	17%	0.169	S	C	*	.	H	α-helix	trans	-64.4	-46.3	177.1	-62.8	81.2	1.2	0	0	111.4	S192 V196 N197 Q198	S192-Q194 PolarHBondContact O-N 2.66Å; Q194-V196 PolarHBondContact O-N 3.09Å; Q194-N197 PolarHBondContact O-N 3.43Å; Q194-Q198 VanDerWaalsContact O-CG 3.23Å; Q194-Q198 WeakPolarHBondContact O-CG 3.26Å; Q194-Q198 PolarHBondContact O-N 3.36Å
195	T	85.9	Confident	86.1	Confident	22 Å²	22	28 Å²	28	14%	0.135	15%	0.146	C	C	.	.	H	α-helix	trans	-60.8	-46.2	177.4	-57.4	0	0	0	0	110.6	L191 S192 N197 Q198 Y199 Y231	L191-T195 HydrophobicContact CB-CG2 4.4Å; L191-T195 HydrophobicContact CD1-CG2 4.36Å; L191-T195 HydrophobicContact CD2-CG2 4.45Å; S192-T195 PolarHBondContact O-N 2.96Å; S192-T195 WeakPolarHBondContact OG-CB 3.39Å; S192-T195 PolarHBondContact OG-N 3.41Å; S192-T195 PolarHBondContact OG-OG1 2.79Å; T195-N197 PolarHBondContact O-N 3.46Å; T195-Q198 WeakPolarHBondContact O-CB 3.46Å; T195-Q198 PolarHBondContact O-N 3.18Å; T195-Y199 WeakPolarHBondContact O-CD1 3.18Å; T195-Y199 PolarHBondContact O-N 2.88Å; T195-Y231 HydrophobicContact CG2-CD2 3.95Å; T195-Y231 HydrophobicContact CG2-CG 4.28Å
196	V	85.4	Confident	85.5	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-43	179.1	177.4	0	0	0	0	111.9	L191 S192 D193 Q194 Q198 Y199 K200 H204 P205	L191-V196 HydrophobicContact CB-CG2 3.72Å; L191-V196 HydrophobicContact CD1-CG2 4.45Å; S192-V196 WeakPolarHBondContact O-CG2 3.47Å; S192-V196 PolarHBondContact O-N 3.16Å; D193-V196 PolarHBondContact O-N 3.19Å; Q194-V196 PolarHBondContact O-N 3.09Å; V196-Q198 VanDerWaalsContact C-N 3.31Å; V196-Q198 PolarHBondContact O-N 2.76Å; V196-Y199 VanDerWaalsContact CA-CE1 3.43Å; V196-Y199 HydrophobicContact CB-CE1 4.13Å; V196-Y199 HydrophobicContact CG1-CE1 4.32Å; V196-Y199 HydrophobicContact CG2-CE1 4.01Å; V196-Y199 PolarHBondContact O-N 3.2Å; V196-K200 HydrophobicContact CG1-CD 4.15Å; V196-K200 HydrophobicContact CG1-CG 4.31Å; V196-K200 WeakPolarHBondContact O-CB 3.32Å; V196-K200 PolarHBondContact O-N 2.94Å; V196-H204 HydrophobicContact CG1-CB 4.25Å; V196-P205 HydrophobicContact CB-CB 4.45Å; V196-P205 HydrophobicContact CB-CG 4.27Å; V196-P205 HydrophobicContact CG1-CB 3.96Å; V196-P205 HydrophobicContact CG1-CG 4.27Å
197	N	83.8	Confident	85.1	Confident	41 Å²	41	28.5 Å²	28.5	22%	0.219	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-36.8	176.2	-167.5	-94.7	0	0	0	112.3	D193 Q194 T195 Y199 G201 S202 H204	D193-N197 WeakPolarHBondContact O-CB 3.32Å; D193-N197 PolarHBondContact O-N 2.73Å; Q194-N197 PolarHBondContact O-N 3.43Å; T195-N197 PolarHBondContact O-N 3.46Å; N197-Y199 PolarHBondContact O-N 2.98Å; N197-G201 WeakPolarHBondContact O-CA 3.41Å; N197-G201 PolarHBondContact O-N 3.43Å; N197-S202 PolarHBondContact ND2-O 3.34Å; N197-H204 VanDerWaalsContact CA-O 3.31Å; N197-H204 WeakPolarHBondContact CA-O 3.48Å; N197-H204 WeakPolarHBondContact CB-O 3.38Å; N197-H204 PolarHBondContact ND2-O 3.34Å
198	Q	79.9	Confident	84.8	Confident	115 Å²	115	29.6 Å²	29.6	54%	0.537	16%	0.158	S	C	.	.	H	α-helix	trans	-60.8	-46	179.4	-76.4	167.3	-2.7	0	0	112.3	Q194 T195 V196 N259 L262	Q194-Q198 VanDerWaalsContact O-CG 3.23Å; Q194-Q198 WeakPolarHBondContact O-CG 3.26Å; Q194-Q198 PolarHBondContact O-N 3.36Å; T195-Q198 WeakPolarHBondContact O-CB 3.46Å; T195-Q198 PolarHBondContact O-N 3.18Å; V196-Q198 VanDerWaalsContact C-N 3.31Å; V196-Q198 PolarHBondContact O-N 2.76Å; Q198-N259 PolarHBondContact O-ND2 3.04Å; Q198-L262 HydrophobicContact CB-CD1 4.16Å
199	Y	74.1	Confident	84.5	Confident	36 Å²	36	30.8 Å²	30.8	14%	0.141	16%	0.164	C	C	.	.	H	α-helix	trans	-89	-34.5	-175.9	78.8	-100.3	0	0	0	114.2	S164 L191 T195 V196 N197 Y231	S164-Y199 VanDerWaalsContact CB-OH 3.27Å; S164-Y199 WeakPolarHBondContact CB-OH 3.48Å; S164-Y199 PolarHBondContact OG-OH 3.47Å; L191-Y199 HydrophobicContact CD1-CE1 3.77Å; T195-Y199 WeakPolarHBondContact O-CD1 3.18Å; T195-Y199 PolarHBondContact O-N 2.88Å; V196-Y199 VanDerWaalsContact CA-CE1 3.43Å; V196-Y199 HydrophobicContact CB-CE1 4.13Å; V196-Y199 HydrophobicContact CG1-CE1 4.32Å; V196-Y199 HydrophobicContact CG2-CE1 4.01Å; V196-Y199 PolarHBondContact O-N 3.2Å; N197-Y199 PolarHBondContact O-N 2.98Å; Y199-Y231 HydrophobicContact CD1-CE2 4.3Å
200	K	74.6	Confident	84.2	Confident	59 Å²	59	34.4 Å²	34.4	26%	0.257	18%	0.18	S	C	.	.	H	α-helix	trans	-88.2	-28.5	176.9	-64.2	-160.6	176.8	-174.8	0	113.6	S164 V196 H204	S164-K200 PolarHBondContact OG-NZ 2.97Å; V196-K200 HydrophobicContact CG1-CD 4.15Å; V196-K200 HydrophobicContact CG1-CG 4.31Å; V196-K200 WeakPolarHBondContact O-CB 3.32Å; V196-K200 PolarHBondContact O-N 2.94Å; K200-H204 HydrophobicContact CB-CB 3.79Å; K200-H204 HydrophobicContact CD-CB 4.15Å
201	G	71.9	Confident	84	Confident	9 Å²	9	34.9 Å²	34.9	9%	0.093	18%	0.183	C	C	.	.			trans	68.3	-159.8	-176.4	0	0	0	0	0	114	N197 N203 H204	N197-G201 WeakPolarHBondContact O-CA 3.41Å; N197-G201 PolarHBondContact O-N 3.43Å; G201-N203 PolarHBondContact O-N 3.5Å; G201-H204 PolarHBondContact O-N 3.13Å
202	S	70.5	Confident	84.1	Confident	77 Å²	77	34.6 Å²	34.6	54%	0.538	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	-131.1	176.6	-59.6	0	0	0	0	112.6	N197	N197-S202 PolarHBondContact ND2-O 3.34Å
203	N	73.3	Confident	84.3	Confident	9 Å²	9	33.4 Å²	33.4	5%	0.048	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	25.8	179.2	-168.8	25.8	0	0	0	112.4	R74 T79 H82 G201 P205 I206	R74-N203 PolarHBondContact O-ND2 3.2Å; T79-N203 PolarHBondContact O-OD1 3.42Å; T79-N203 VanDerWaalsContact O-OD1 3.12Å; H82-N203 PolarHBondContact CD2-ND2 3.28Å; H82-N203 PolarHBondContact CD2-OD1 2.95Å; G201-N203 PolarHBondContact O-N 3.5Å; N203-P205 CarbonylContact O-C 3.52Å; N203-I206 WeakPolarHBondContact O-CD1 3.38Å
204	H	78.9	Confident	84.7	Confident	14 Å²	14	33 Å²	33	7%	0.065	17%	0.17	C	C	.	.			trans	-88.5	146.5	176.2	-72.1	-75.9	0	0	0	111.7	H83 D166 V196 N197 K200 G201 D289	H83-H204 PolarHBondContact NE2-O 2.96Å; D166-H204 IonicContact OD2-ND1 2.66Å; D166-H204 PolarHBondContact OD2-ND1 3.34Å; V196-H204 HydrophobicContact CG1-CB 4.25Å; N197-H204 VanDerWaalsContact CA-O 3.31Å; N197-H204 WeakPolarHBondContact CA-O 3.48Å; N197-H204 WeakPolarHBondContact CB-O 3.38Å; N197-H204 PolarHBondContact ND2-O 3.34Å; K200-H204 HydrophobicContact CB-CB 3.79Å; K200-H204 HydrophobicContact CD-CB 4.15Å; G201-H204 PolarHBondContact O-N 3.13Å; H204-D289 IonicContact CE1-OD1 3.88Å; H204-D289 IonicContact NE2-OD1 3.96Å; H204-D289 PolarHBondContact NE2-OD1 3.22Å
205	P	85.7	Confident	85.2	Confident	5 Å²	5	28.2 Å²	28.2	3%	0.032	15%	0.151	C	C	.	.			cis	-77.2	151.9	-7.7	31.9	-33.2	0	0	0	112.1	D166 D193 V196 N203 M207	D166-P205 HydrophobicContact CB-CB 4.22Å; D166-P205 VanDerWaalsContact OD2-CA 3.25Å; D166-P205 WeakPolarHBondContact OD2-CA 3.49Å; D193-P205 HydrophobicContact CB-CG 3.99Å; D193-P205 WeakPolarHBondContact O-CD 3.37Å; D193-P205 VanDerWaalsContact OD1-CG 3.32Å; D193-P205 WeakPolarHBondContact OD1-CG 3.37Å; V196-P205 HydrophobicContact CB-CB 4.45Å; V196-P205 HydrophobicContact CB-CG 4.27Å; V196-P205 HydrophobicContact CG1-CB 3.96Å; V196-P205 HydrophobicContact CG1-CG 4.27Å; N203-P205 CarbonylContact O-C 3.52Å; P205-M207 WeakPolarHBondContact CB-O 3.43Å; P205-M207 WeakPolarHBondContact CG-O 3.31Å
206	I	85.8	Confident	85.7	Confident	8 Å²	8	27.2 Å²	27.2	4%	0.041	15%	0.145	C	C	.	.	S	Bend	trans	-72.4	-36.7	176.7	-56.3	-66.4	0	0	0	110.6	R74 M75 D166 L167 N203 I292	R74-I206 HydrophobicContact CB-CG2 3.82Å; R74-I206 WeakPolarHBondContact CD-O 3.05Å; R74-I206 PolarHBondContact NH1-O 3.36Å; M75-I206 HydrophobicContact CG-CD1 4.37Å; M75-I206 HydrophobicContact CG-CG2 4.08Å; D166-I206 VanDerWaalsContact CG-N 3.35Å; D166-I206 PolarHBondContact OD1-N 3.43Å; D166-I206 VanDerWaalsContact OD1-N 3.16Å; D166-I206 PolarHBondContact OD2-N 3.06Å; L167-I206 HydrophobicContact CD1-CB 4.36Å; L167-I206 HydrophobicContact CD1-CG1 4.25Å; L167-I206 HydrophobicContact CD1-CG2 4.45Å; L167-I206 HydrophobicContact CD2-CB 4.27Å; L167-I206 HydrophobicContact CD2-CG2 4Å; L167-I206 HydrophobicContact CG-CB 4.16Å; L167-I206 HydrophobicContact CG-CG2 4.36Å; N203-I206 WeakPolarHBondContact O-CD1 3.38Å; I206-I292 HydrophobicContact CD1-CD1 4.25Å; I206-I292 HydrophobicContact CG1-CD1 4.13Å
207	M	89.8	Confident	86.3	Confident	16 Å²	16	27.5 Å²	27.5	8%	0.079	15%	0.146	C	C	.	.	S	Bend	trans	-100.9	134.6	173.1	-64	178.6	73.4	0	0	110.2	L71 D166 L167 P205 E211 R212 S215	L71-M207 HydrophobicContact CD2-CG 4Å; D166-M207 PolarHBondContact OD1-N 3.23Å; L167-M207 HydrophobicContact CD2-CG 4Å; L167-M207 HydrophobicContact CD2-SD 3.91Å; P205-M207 WeakPolarHBondContact CB-O 3.43Å; P205-M207 WeakPolarHBondContact CG-O 3.31Å; M207-E211 HydrophobicContact CB-CB 4.04Å; M207-E211 HydrophobicContact CE-CB 3.68Å; M207-R212 HydrophobicContact CB-CG 3.65Å; M207-R212 VanDerWaalsContact O-CD 3.29Å; M207-R212 WeakPolarHBondContact O-CD 3.41Å; M207-R212 PolarHBondContact O-NE 3.27Å; M207-R212 VanDerWaalsContact O-NE 3.09Å; M207-S215 VanDerWaalsContact CE-OG 3.23Å; M207-S215 WeakPolarHBondContact CE-OG 3.27Å
208	S	90.6	Very high	86.9	Confident	25 Å²	25	26 Å²	26	18%	0.175	14%	0.14	C	C	.	.			trans	-61.1	161.1	172.2	63.6	0	0	0	0	111.5	H210 E211 R212	S208-H210 PolarHBondContact O-N 3.35Å; S208-E211 WeakPolarHBondContact CB-OE2 3.37Å; S208-E211 PolarHBondContact N-OE2 2.77Å; S208-E211 PolarHBondContact O-N 3.46Å; S208-E211 VanDerWaalsContact O-N 3.09Å; S208-E211 WeakPolarHBondContact OG-CG 3.06Å; S208-E211 PolarHBondContact OG-OE2 3.42Å; S208-R212 WeakPolarHBondContact O-CG 3.48Å; S208-R212 PolarHBondContact O-N 3.35Å
209	I	91.8	Very high	87.7	Confident	25 Å²	25	21.6 Å²	21.6	13%	0.128	12%	0.119	C	C	.	.	H	α-helix	trans	-52.4	-41.2	178.3	-168.3	171.8	0	0	0	113.1	I190 D193 R212 V213 G228	I190-I209 HydrophobicContact CG2-CG1 4.01Å; D193-I209 PolarHBondContact OD1-N 2.93Å; D193-I209 PolarHBondContact OD2-N 2.67Å; I209-R212 VanDerWaalsContact CA-NH2 3.32Å; I209-R212 PolarHBondContact O-N 3.3Å; I209-V213 HydrophobicContact CG1-CG2 4.38Å; I209-V213 WeakPolarHBondContact O-CB 3.47Å; I209-V213 WeakPolarHBondContact O-CG2 3.34Å; I209-V213 PolarHBondContact O-N 2.8Å; I209-G228 VanDerWaalsContact CD1-N 3.34Å
210	H	92.1	Very high	88.8	Confident	76 Å²	76	24.2 Å²	24.2	35%	0.352	13%	0.131	S	C	.	.	H	α-helix	trans	-67.5	-39.1	-178.9	-57.8	-62.8	0	0	0	112.3	F136 P138 S208 L214	F136-H210 HydrophobicContact CD1-CB 4.03Å; F136-H210 HydrophobicContact CE1-CB 4.04Å; P138-H210 HydrophobicContact CB-CB 4.05Å; P138-H210 HydrophobicContact CG-CB 4.19Å; S208-H210 PolarHBondContact O-N 3.35Å; H210-L214 PolarHBondContact O-N 3.33Å
211	E	93.3	Very high	89.8	Confident	10 Å²	10	22 Å²	22	5%	0.047	12%	0.122	C	C	.	.	H	α-helix	trans	-67.7	-38.9	175.2	-68.4	166.5	135.8	0	0	111.3	R74 S134 F136 M207 S208 S215	R74-E211 IonicContact CZ-OE1 3.66Å; R74-E211 IonicContact CZ-OE2 3.79Å; R74-E211 VanDerWaalsContact NH1-CD 3.35Å; R74-E211 IonicContact NH1-OE1 3.36Å; R74-E211 PolarHBondContact NH1-OE1 3.31Å; R74-E211 IonicContact NH1-OE2 3.93Å; R74-E211 PolarHBondContact NH1-OE2 3.26Å; R74-E211 IonicContact NH2-OE1 3.3Å; R74-E211 PolarHBondContact NH2-OE1 3.39Å; S134-E211 WeakPolarHBondContact CB-OE1 3.43Å; S134-E211 PolarHBondContact OG-OE1 2.94Å; S134-E211 PolarHBondContact OG-OE2 2.89Å; F136-E211 HydrophobicContact CB-CG 3.94Å; F136-E211 HydrophobicContact CD1-CG 4.03Å; F136-E211 HydrophobicContact CG-CG 4.1Å; M207-E211 HydrophobicContact CB-CB 4.04Å; M207-E211 HydrophobicContact CE-CB 3.68Å; S208-E211 WeakPolarHBondContact CB-OE2 3.37Å; S208-E211 PolarHBondContact N-OE2 2.77Å; S208-E211 PolarHBondContact O-N 3.46Å; S208-E211 VanDerWaalsContact O-N 3.09Å; S208-E211 WeakPolarHBondContact OG-CG 3.06Å; S208-E211 PolarHBondContact OG-OE2 3.42Å; E211-S215 WeakPolarHBondContact O-CB 3.29Å; E211-S215 PolarHBondContact O-N 3.33Å; E211-S215 PolarHBondContact O-OG 2.96Å
212	R	95.3	Very high	91	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-67.5	-42.4	178	-67.7	-178.1	-65.3	112.9	-0.8	112	S164 I190 L191 D193 M207 S208 I209 L214 S215 V216	S164-R212 WeakPolarHBondContact O-CD 3.41Å; S164-R212 PolarHBondContact O-NH1 3.18Å; I190-R212 HydrophobicContact CG2-CB 4.25Å; L191-R212 PolarHBondContact O-NH1 3.23Å; L191-R212 PolarHBondContact O-NH2 3.02Å; D193-R212 IonicContact OD1-CZ 2.75Å; D193-R212 IonicContact OD1-NE 3.43Å; D193-R212 IonicContact OD1-NH2 3.61Å; D193-R212 PolarHBondContact OD1-NH2 3.14Å; M207-R212 HydrophobicContact CB-CG 3.65Å; M207-R212 VanDerWaalsContact O-CD 3.29Å; M207-R212 WeakPolarHBondContact O-CD 3.41Å; M207-R212 PolarHBondContact O-NE 3.27Å; M207-R212 VanDerWaalsContact O-NE 3.09Å; S208-R212 WeakPolarHBondContact O-CG 3.48Å; S208-R212 PolarHBondContact O-N 3.35Å; I209-R212 VanDerWaalsContact CA-NH2 3.32Å; I209-R212 PolarHBondContact O-N 3.3Å; R212-L214 PolarHBondContact O-N 3.08Å; R212-S215 WeakPolarHBondContact O-CB 3.32Å; R212-S215 PolarHBondContact O-N 3.42Å; R212-V216 WeakPolarHBondContact O-CG2 3.24Å; R212-V216 PolarHBondContact O-N 3.49Å
213	V	96	Very high	92.2	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.006	10%	0.099	C	C	.	.	H	α-helix	trans	-54.2	-52.2	173.9	162.2	0	0	0	0	111	I190 I209 S215 V216 L217 V225 F227	I190-V213 HydrophobicContact CB-CG2 4.46Å; I190-V213 HydrophobicContact CG1-CG2 4.33Å; I190-V213 HydrophobicContact CG2-CG2 4.39Å; I209-V213 HydrophobicContact CG1-CG2 4.38Å; I209-V213 WeakPolarHBondContact O-CB 3.47Å; I209-V213 WeakPolarHBondContact O-CG2 3.34Å; I209-V213 PolarHBondContact O-N 2.8Å; V213-S215 VanDerWaalsContact C-N 3.3Å; V213-S215 PolarHBondContact O-N 3.14Å; V213-V216 PolarHBondContact O-N 3.11Å; V213-L217 HydrophobicContact CG1-CD1 3.8Å; V213-L217 HydrophobicContact CG1-CG 4.42Å; V213-L217 WeakPolarHBondContact O-CB 3.18Å; V213-L217 WeakPolarHBondContact O-CG 3.32Å; V213-L217 PolarHBondContact O-N 3.18Å; V213-V225 HydrophobicContact CB-CG1 4.47Å; V213-V225 HydrophobicContact CG1-CG1 4.25Å; V213-V225 HydrophobicContact CG2-CG1 3.95Å; V213-F227 HydrophobicContact CB-CZ 4.38Å; V213-F227 HydrophobicContact CG1-CD1 4.3Å; V213-F227 HydrophobicContact CG1-CE1 3.57Å; V213-F227 HydrophobicContact CG1-CE2 3.83Å; V213-F227 HydrophobicContact CG1-CZ 3.31Å; V213-F227 HydrophobicContact CG2-CD1 4.05Å; V213-F227 HydrophobicContact CG2-CD2 4.1Å; V213-F227 HydrophobicContact CG2-CE1 4.15Å; V213-F227 HydrophobicContact CG2-CE2 4.2Å; V213-F227 HydrophobicContact CG2-CG 4.04Å; V213-F227 HydrophobicContact CG2-CZ 4.24Å
214	L	95.4	Very high	93.3	Very high	17 Å²	17	21.9 Å²	21.9	9%	0.089	11%	0.112	C	C	.	.	H	α-helix	trans	-65.2	-36.9	179.4	-64.5	179.2	0	0	0	112.1	F136 T142 F146 H210 R212 V216 L217 A218	F136-L214 HydrophobicContact CE1-CD1 3.67Å; F136-L214 HydrophobicContact CE2-CD1 4.02Å; F136-L214 HydrophobicContact CZ-CD1 3.25Å; T142-L214 HydrophobicContact CG2-CD1 3.7Å; T142-L214 HydrophobicContact CG2-CD2 4.22Å; F146-L214 HydrophobicContact CB-CD2 3.79Å; F146-L214 HydrophobicContact CD1-CB 4.08Å; F146-L214 HydrophobicContact CD1-CD2 4.11Å; F146-L214 WeakPolarHBondContact CD1-O 3.4Å; F146-L214 HydrophobicContact CD2-CD2 3.96Å; F146-L214 HydrophobicContact CE1-CB 4.19Å; F146-L214 HydrophobicContact CG-CD2 3.69Å; H210-L214 PolarHBondContact O-N 3.33Å; R212-L214 PolarHBondContact O-N 3.08Å; L214-V216 VanDerWaalsContact C-N 3.25Å; L214-V216 PolarHBondContact O-N 2.92Å; L214-L217 PolarHBondContact O-N 2.96Å; L214-A218 PolarHBondContact O-N 3.34Å
215	S	95.6	Very high	94.2	Very high	28 Å²	28	21.5 Å²	21.5	20%	0.196	11%	0.11	C	C	.	.	H	α-helix	trans	-61.1	-36.2	176.3	-58.7	0	0	0	0	112.1	M207 E211 R212 V213 Y219	M207-S215 VanDerWaalsContact CE-OG 3.23Å; M207-S215 WeakPolarHBondContact CE-OG 3.27Å; E211-S215 WeakPolarHBondContact O-CB 3.29Å; E211-S215 PolarHBondContact O-N 3.33Å; E211-S215 PolarHBondContact O-OG 2.96Å; R212-S215 WeakPolarHBondContact O-CB 3.32Å; R212-S215 PolarHBondContact O-N 3.42Å; V213-S215 VanDerWaalsContact C-N 3.3Å; V213-S215 PolarHBondContact O-N 3.14Å; S215-Y219 WeakPolarHBondContact O-CD2 3.44Å; S215-Y219 VanDerWaalsContact O-CE2 3.27Å; S215-Y219 WeakPolarHBondContact O-CE2 3.46Å
216	V	97.1	Very high	94.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-79.8	-44.4	179.5	170.9	0	0	0	0	111.5	F165 F168 V188 I190 R212 V213 L214 A218 Y219 V222 V225	F165-V216 HydrophobicContact CB-CG2 3.65Å; F165-V216 HydrophobicContact CD1-CG2 4.24Å; F165-V216 HydrophobicContact CG-CG2 3.97Å; F168-V216 HydrophobicContact CD2-CG2 3.63Å; F168-V216 HydrophobicContact CE2-CG2 3.87Å; V188-V216 HydrophobicContact CB-CG1 3.9Å; V188-V216 HydrophobicContact CG1-CG1 3.81Å; V188-V216 HydrophobicContact CG2-CG1 4.06Å; I190-V216 HydrophobicContact CD1-CB 4.31Å; I190-V216 HydrophobicContact CD1-CG1 4.34Å; I190-V216 HydrophobicContact CD1-CG2 3.79Å; R212-V216 WeakPolarHBondContact O-CG2 3.24Å; R212-V216 PolarHBondContact O-N 3.49Å; V213-V216 PolarHBondContact O-N 3.11Å; L214-V216 VanDerWaalsContact C-N 3.25Å; L214-V216 PolarHBondContact O-N 2.92Å; V216-A218 PolarHBondContact O-N 3.02Å; V216-A218 VanDerWaalsContact O-N 3.15Å; V216-Y219 PolarHBondContact O-N 3.44Å; V216-V222 HydrophobicContact CG1-CG1 4Å; V216-V222 HydrophobicContact CG1-CG2 3.93Å; V216-V225 HydrophobicContact CB-CG2 4.41Å; V216-V225 HydrophobicContact CG1-CG2 3.78Å
217	L	96.8	Very high	95.1	Very high	6 Å²	6	26.3 Å²	26.3	3%	0.031	13%	0.132	C	C	.	.	H	α-helix	trans	-62	-20.3	178.2	-76.3	175.1	0	0	0	114.2	F146 V213 L214 Y219 V225	F146-L217 HydrophobicContact CB-CB 3.97Å; F146-L217 HydrophobicContact CB-CD1 4.17Å; V213-L217 HydrophobicContact CG1-CD1 3.8Å; V213-L217 HydrophobicContact CG1-CG 4.42Å; V213-L217 WeakPolarHBondContact O-CB 3.18Å; V213-L217 WeakPolarHBondContact O-CG 3.32Å; V213-L217 PolarHBondContact O-N 3.18Å; L214-L217 PolarHBondContact O-N 2.96Å; L217-Y219 PolarHBondContact O-N 3.3Å; L217-V225 HydrophobicContact CD2-CB 4.08Å; L217-V225 HydrophobicContact CD2-CG2 3.57Å; L217-V225 HydrophobicContact CG-CB 4.32Å; L217-V225 HydrophobicContact CG-CG2 3.79Å
218	A	96.6	Very high	95.1	Very high	10 Å²	10	27.3 Å²	27.3	8%	0.083	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-15.3	179.3	0	0	0	0	0	114.1	I5 K6 W7 F146 L214 V216	I5-A218 CarbonylContact C-O 3.4Å; I5-A218 WeakPolarHBondContact CA-O 3.45Å; K6-A218 PolarHBondContact N-O 3.23Å; W7-A218 HydrophobicContact CZ3-CB 4.05Å; F146-A218 HydrophobicContact CD1-CB 4.17Å; F146-A218 HydrophobicContact CE1-CB 4.09Å; L214-A218 PolarHBondContact O-N 3.34Å; V216-A218 PolarHBondContact O-N 3.02Å; V216-A218 VanDerWaalsContact O-N 3.15Å
219	Y	96.9	Very high	95.3	Very high	23 Å²	23	26.2 Å²	26.2	9%	0.09	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-102.2	140.8	-170.5	-73.9	-94.4	0	0	0	113.7	M1 G4 I5 F168 L173 S215 V216 L217 P221 V222	M1-Y219 HydrophobicContact CE-CE1 4.35Å; M1-Y219 WeakPolarHBondContact CE-OH 3.03Å; G4-Y219 VanDerWaalsContact C-CD1 3.48Å; G4-Y219 CarbonylContact O-C 3.55Å; G4-Y219 VanDerWaalsContact O-CA 3.32Å; G4-Y219 WeakPolarHBondContact O-CA 3.39Å; G4-Y219 VanDerWaalsContact O-CD1 3.31Å; G4-Y219 WeakPolarHBondContact O-CD1 3.12Å; I5-Y219 HydrophobicContact CG1-CE1 4.05Å; F168-Y219 AromaticContact CD1-CD2 3.83Å; F168-Y219 HydrophobicContact CD1-CD2 3.83Å; F168-Y219 HydrophobicContact CD1-CE1 4.38Å; F168-Y219 AromaticContact CD1-CE2 3.29Å; F168-Y219 HydrophobicContact CD1-CE2 3.29Å; F168-Y219 AromaticContact CD1-CZ 3.62Å; F168-Y219 AromaticContact CE1-CD1 3.91Å; F168-Y219 HydrophobicContact CE1-CD1 3.91Å; F168-Y219 AromaticContact CE1-CD2 3.37Å; F168-Y219 HydrophobicContact CE1-CD2 3.37Å; F168-Y219 AromaticContact CE1-CE1 3.8Å; F168-Y219 HydrophobicContact CE1-CE1 3.8Å; F168-Y219 AromaticContact CE1-CE2 3.25Å; F168-Y219 HydrophobicContact CE1-CE2 3.25Å; F168-Y219 AromaticContact CE1-CG 3.71Å; F168-Y219 HydrophobicContact CE1-CG 3.71Å; F168-Y219 AromaticContact CE1-CZ 3.47Å; F168-Y219 VanDerWaalsContact CE1-CZ 3.47Å; F168-Y219 HydrophobicContact CG-CE2 4.18Å; F168-Y219 HydrophobicContact CZ-CD1 4.45Å; F168-Y219 AromaticContact CZ-CD2 3.75Å; F168-Y219 HydrophobicContact CZ-CD2 3.75Å; F168-Y219 HydrophobicContact CZ-CE2 4.09Å; F168-Y219 AromaticContact CZ-CG 3.96Å; F168-Y219 HydrophobicContact CZ-CG 3.96Å; L173-Y219 HydrophobicContact CD1-CD1 3.63Å; L173-Y219 HydrophobicContact CD1-CE1 4.34Å; L173-Y219 HydrophobicContact CD1-CG 4.35Å; L173-Y219 HydrophobicContact CD2-CD1 4.08Å; L173-Y219 HydrophobicContact CD2-CE1 3.99Å; L173-Y219 HydrophobicContact CG-CD1 4.36Å; S215-Y219 WeakPolarHBondContact O-CD2 3.44Å; S215-Y219 VanDerWaalsContact O-CE2 3.27Å; S215-Y219 WeakPolarHBondContact O-CE2 3.46Å; V216-Y219 PolarHBondContact O-N 3.44Å; L217-Y219 PolarHBondContact O-N 3.3Å; Y219-P221 VanDerWaalsContact C-CD 3.4Å; Y219-V222 PolarHBondContact O-N 2.85Å; Y219-V222 VanDerWaalsContact O-N 3.16Å
220	K	95.9	Very high	95.3	Very high	90 Å²	90	27.5 Å²	27.5	39%	0.391	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-40.7	-175.5	-69.6	172.8	178	170.7	0	115.8	A3 G4 I5 K6 V8 V222	A3-K220 WeakPolarHBondContact O-CE 3.23Å; A3-K220 PolarHBondContact O-NZ 2.83Å; G4-K220 WeakPolarHBondContact O-CG 3.34Å; G4-K220 PolarHBondContact O-N 2.93Å; I5-K220 VanDerWaalsContact O-CE 3.27Å; I5-K220 WeakPolarHBondContact O-CE 3.4Å; K6-K220 HydrophobicContact CB-CG 4.03Å; V8-K220 VanDerWaalsContact O-CE 3.29Å; V8-K220 WeakPolarHBondContact O-CE 3.42Å; V8-K220 PolarHBondContact O-NZ 2.64Å; K220-V222 PolarHBondContact O-N 3.42Å
221	P	96.1	Very high	95.2	Very high	12 Å²	12	26.4 Å²	26.4	8%	0.078	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-20.5	-176.1	-21.5	34.6	0	0	0	113.7	L173 L176 E177 K180 L186 Y219	L173-P221 HydrophobicContact CD1-CG 4.23Å; L176-P221 HydrophobicContact CB-CB 4.27Å; E177-P221 HydrophobicContact CG-CG 3.84Å; K180-P221 HydrophobicContact CB-CB 4.21Å; K180-P221 HydrophobicContact CG-CB 4.43Å; L186-P221 WeakPolarHBondContact CB-O 3.34Å; L186-P221 HydrophobicContact CD2-CB 4.16Å; L186-P221 WeakPolarHBondContact CD2-O 3.45Å; Y219-P221 VanDerWaalsContact C-CD 3.4Å
222	V	97.2	Very high	95.2	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.018	16%	0.161	C	C	.	.			trans	-90.4	127.3	-169.2	-179.6	0	0	0	0	110.9	L176 V188 V216 Y219 K220 V225	L176-V222 HydrophobicContact CD1-CG2 3.92Å; V188-V222 HydrophobicContact CG2-CB 4.49Å; V188-V222 HydrophobicContact CG2-CG1 3.94Å; V188-V222 HydrophobicContact CG2-CG2 3.91Å; V216-V222 HydrophobicContact CG1-CG1 4Å; V216-V222 HydrophobicContact CG1-CG2 3.93Å; Y219-V222 PolarHBondContact O-N 2.85Å; Y219-V222 VanDerWaalsContact O-N 3.16Å; K220-V222 PolarHBondContact O-N 3.42Å; V222-V225 HydrophobicContact CG1-CG2 3.93Å
223	N	96.8	Very high	95.1	Very high	23 Å²	23	30.7 Å²	30.7	12%	0.123	16%	0.162	C	C	.	.			trans	-103.5	-37.9	175.4	-58.3	106.9	0	0	0	112.6	E148 K180 Y185 L186	E148-N223 PolarHBondContact OE2-ND2 3.05Å; K180-N223 PolarHBondContact NZ-OD1 3.26Å; Y185-N223 HydrophobicContact CD1-CB 4.11Å; Y185-N223 HydrophobicContact CD2-CB 3.83Å; Y185-N223 HydrophobicContact CE1-CB 3.87Å; Y185-N223 HydrophobicContact CE2-CB 3.58Å; Y185-N223 HydrophobicContact CG-CB 4.1Å; L186-N223 PolarHBondContact N-OD1 3.17Å; L186-N223 PolarHBondContact O-N 2.76Å
224	E	96.3	Very high	94.9	Very high	68 Å²	68	33.1 Å²	33.1	32%	0.318	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	154.1	-177.8	-172.7	57.6	-80.7	0	0	111.9	Y185 L186 I187 V188	Y185-E224 HydrophobicContact CE1-CB 3.78Å; L186-E224 PolarHBondContact O-N 3.4Å; I187-E224 CarbonylContact C-O 3.53Å; I187-E224 WeakPolarHBondContact CA-O 3.4Å; I187-E224 HydrophobicContact CG1-CB 4.2Å; I187-E224 HydrophobicContact CG2-CB 4.41Å; V188-E224 PolarHBondContact N-O 2.8Å
225	V	96.8	Very high	94.9	Very high	6 Å²	6	34.3 Å²	34.3	4%	0.036	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.1	178	170.3	0	0	0	0	111	V188 I190 V213 V216 L217 V222 F227	V188-V225 HydrophobicContact CB-CG2 4.35Å; V188-V225 CarbonylContact O-C 3.57Å; V188-V225 VanDerWaalsContact O-CA 3.27Å; V188-V225 WeakPolarHBondContact O-CA 3.35Å; I190-V225 HydrophobicContact CB-CG1 4.41Å; I190-V225 HydrophobicContact CG1-CG1 3.46Å; I190-V225 VanDerWaalsContact CG1-CG1 3.46Å; V213-V225 HydrophobicContact CB-CG1 4.47Å; V213-V225 HydrophobicContact CG1-CG1 4.25Å; V213-V225 HydrophobicContact CG2-CG1 3.95Å; V216-V225 HydrophobicContact CB-CG2 4.41Å; V216-V225 HydrophobicContact CG1-CG2 3.78Å; L217-V225 HydrophobicContact CD2-CB 4.08Å; L217-V225 HydrophobicContact CD2-CG2 3.57Å; L217-V225 HydrophobicContact CG-CB 4.32Å; L217-V225 HydrophobicContact CG-CG2 3.79Å; V222-V225 HydrophobicContact CG1-CG2 3.93Å; V225-F227 HydrophobicContact CB-CD1 4.5Å; V225-F227 HydrophobicContact CB-CE1 4.28Å; V225-F227 HydrophobicContact CG1-CD1 3.89Å; V225-F227 HydrophobicContact CG1-CE1 4Å; V225-F227 WeakPolarHBondContact O-CD1 3.25Å
226	V	95.8	Very high	94.8	Very high	25 Å²	25	38.3 Å²	38.3	15%	0.152	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	119	170.8	179.7	0	0	0	0	109.3	Y160 I187 V188 I190 A229 F241	Y160-V226 HydrophobicContact CE2-CG2 4.3Å; I187-V226 HydrophobicContact CG2-CG2 3.72Å; V188-V226 PolarHBondContact O-N 3.48Å; I190-V226 PolarHBondContact N-O 3.38Å; V226-A229 HydrophobicContact CB-CB 4.45Å; V226-A229 HydrophobicContact CG1-CB 4.11Å; V226-F241 HydrophobicContact CG2-CE2 3.76Å; V226-F241 HydrophobicContact CG2-CZ 3.8Å
227	F	94.1	Very high	94.7	Very high	89 Å²	89	39 Å²	39	39%	0.39	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	121.2	-175.5	-69.2	39.8	0	0	0	108.7	I143 V213 V225	I143-F227 HydrophobicContact CD1-CE2 3.82Å; I143-F227 HydrophobicContact CD1-CZ 4.08Å; I143-F227 HydrophobicContact CG1-CZ 4.4Å; I143-F227 HydrophobicContact CG2-CZ 4.04Å; V213-F227 HydrophobicContact CB-CZ 4.38Å; V213-F227 HydrophobicContact CG1-CD1 4.3Å; V213-F227 HydrophobicContact CG1-CE1 3.57Å; V213-F227 HydrophobicContact CG1-CE2 3.83Å; V213-F227 HydrophobicContact CG1-CZ 3.31Å; V213-F227 HydrophobicContact CG2-CD1 4.05Å; V213-F227 HydrophobicContact CG2-CD2 4.1Å; V213-F227 HydrophobicContact CG2-CE1 4.15Å; V213-F227 HydrophobicContact CG2-CE2 4.2Å; V213-F227 HydrophobicContact CG2-CG 4.04Å; V213-F227 HydrophobicContact CG2-CZ 4.24Å; V225-F227 HydrophobicContact CB-CD1 4.5Å; V225-F227 HydrophobicContact CB-CE1 4.28Å; V225-F227 HydrophobicContact CG1-CD1 3.89Å; V225-F227 HydrophobicContact CG1-CE1 4Å; V225-F227 WeakPolarHBondContact O-CD1 3.25Å
228	G	91.4	Very high	94.6	Very high	36 Å²	36	38.8 Å²	38.8	37%	0.371	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	70.3	40.1	177.7	0	0	0	0	0	111.6	I190 I209	I190-G228 CarbonylContact O-C 3.6Å; I190-G228 VanDerWaalsContact O-CA 3.22Å; I190-G228 WeakPolarHBondContact O-CA 3.36Å; I190-G228 PolarHBondContact O-N 2.92Å; I209-G228 VanDerWaalsContact CD1-N 3.34Å
229	A	94.5	Very high	94.6	Very high	2 Å²	2	42.9 Å²	42.9	2%	0.017	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.9	140.7	176.7	0	0	0	0	0	110.4	I190 L191 V226	I190-A229 PolarHBondContact O-N 3.34Å; L191-A229 WeakPolarHBondContact CD2-O 3.23Å; V226-A229 HydrophobicContact CB-CB 4.45Å; V226-A229 HydrophobicContact CG1-CB 4.11Å
230	P	91.8	Very high	94.5	Very high	52 Å²	52	48.7 Å²	48.7	34%	0.338	26%	0.257	S	S	.	.			trans	-62.6	154.2	174.7	28.6	-34.7	0	0	0	110.4	L191 E232 I237	L191-P230 WeakPolarHBondContact CD2-O 3.48Å; P230-E232 WeakPolarHBondContact CG-O 3.19Å; P230-I237 HydrophobicContact CG-CD1 3.28Å
231	Y	89.9	Confident	94.4	Very high	53 Å²	53	47 Å²	47	21%	0.208	25%	0.25	C	C	.	.	S	Bend	trans	-63.9	-44.4	176	-176.9	-106.9	0	0	0	111.4	L191 T195 Y199 L262 P267	L191-Y231 HydrophobicContact CD1-CD2 4.3Å; T195-Y231 HydrophobicContact CG2-CD2 3.95Å; T195-Y231 HydrophobicContact CG2-CG 4.28Å; Y199-Y231 HydrophobicContact CD1-CE2 4.3Å; Y231-L262 HydrophobicContact CD1-CD2 4.29Å; Y231-L262 HydrophobicContact CE1-CB 4.36Å; Y231-L262 HydrophobicContact CE1-CD2 4.41Å; Y231-P267 HydrophobicContact CD1-CB 4.24Å; Y231-P267 HydrophobicContact CE1-CB 4.07Å; Y231-P267 HydrophobicContact CE1-CG 4.21Å; Y231-P267 WeakPolarHBondContact O-CB 3.44Å
232	E	92.1	Very high	94.4	Very high	94 Å²	94	51.6 Å²	51.6	44%	0.439	27%	0.273	S	S	.	.	S	Bend	trans	-86.6	136.6	174.3	-65	174.4	-122.8	0	0	110.7	P230 T234 I265	P230-E232 WeakPolarHBondContact CG-O 3.19Å; E232-T234 PolarHBondContact O-N 2.84Å; E232-I265 HydrophobicContact CG-CG2 3.63Å
233	I	93.1	Very high	94.4	Very high	6 Å²	6	52 Å²	52	3%	0.031	28%	0.276	C	S	.	.			trans	-79	106.5	174.2	-58.7	-176.8	0	0	0	108.1	Y160 T162 L238 V246 P267 F268 E270	Y160-I233 HydrophobicContact CD1-CD1 4.15Å; Y160-I233 HydrophobicContact CE1-CD1 4.04Å; Y160-I233 HydrophobicContact CE1-CG1 4.19Å; T162-I233 HydrophobicContact CG2-CD1 4.1Å; T162-I233 HydrophobicContact CG2-CG1 4.27Å; I233-L238 HydrophobicContact CG2-CD1 4.08Å; I233-L238 HydrophobicContact CG2-CD2 3.65Å; I233-L238 HydrophobicContact CG2-CG 3.83Å; I233-V246 HydrophobicContact CD1-CG1 3.48Å; I233-V246 VanDerWaalsContact CD1-CG1 3.48Å; I233-P267 WeakPolarHBondContact CB-O 3.5Å; I233-P267 PolarHBondContact N-O 3.44Å; I233-F268 HydrophobicContact CD1-CD1 3.47Å; I233-F268 VanDerWaalsContact CD1-CD1 3.47Å; I233-F268 HydrophobicContact CD1-CE1 3.65Å; I233-F268 HydrophobicContact CG1-CD1 4.48Å; I233-E270 VanDerWaalsContact O-CB 3.25Å; I233-E270 WeakPolarHBondContact O-CB 3.31Å
234	T	93.3	Very high	94.4	Very high	53 Å²	53	53.5 Å²	53.5	33%	0.325	28%	0.282	S	S	.	.			trans	-85	158.2	-180	63.3	0	0	0	0	111.8	E232 D236 I237 L238	E232-T234 PolarHBondContact O-N 2.84Å; T234-D236 PolarHBondContact O-N 3.17Å; T234-I237 PolarHBondContact O-N 3.24Å; T234-L238 WeakPolarHBondContact O-CG 3.49Å; T234-L238 PolarHBondContact O-N 2.96Å
235	S	94.6	Very high	94.5	Very high	41 Å²	41	50.3 Å²	50.3	29%	0.287	27%	0.267	S	S	.	.	H	α-helix	trans	-53.9	-39.8	170.2	49.6	0	0	0	0	112	I237 L238 D239	S235-I237 VanDerWaalsContact C-N 3.32Å; S235-I237 PolarHBondContact O-N 3.12Å; S235-L238 PolarHBondContact O-N 3.34Å; S235-L238 VanDerWaalsContact O-N 3.1Å; S235-D239 WeakPolarHBondContact O-CB 3.25Å; S235-D239 PolarHBondContact O-N 3.31Å; S235-D239 VanDerWaalsContact O-OD2 3.04Å
236	D	94.6	Very high	94.5	Very high	112 Å²	112	50 Å²	50	60%	0.599	27%	0.266	S	S	*	.	H	α-helix	trans	-59.9	-41.4	-175.5	-58.1	-16.1	0	0	0	112.1	T234 Q240	T234-D236 PolarHBondContact O-N 3.17Å; D236-Q240 WeakPolarHBondContact O-CB 3.35Å; D236-Q240 PolarHBondContact O-N 3.46Å
237	I	93.8	Very high	94.6	Very high	14 Å²	14	48.9 Å²	48.9	7%	0.072	26%	0.259	C	S	.	.	H	α-helix	trans	-68.3	-44.1	176.4	-71.1	178.1	0	0	0	110.7	Y160 P230 T234 S235 D239 F241	Y160-I237 HydrophobicContact CD2-CG2 4.46Å; Y160-I237 HydrophobicContact CE1-CG2 4.48Å; Y160-I237 HydrophobicContact CE2-CG2 4.05Å; P230-I237 HydrophobicContact CG-CD1 3.28Å; T234-I237 PolarHBondContact O-N 3.24Å; S235-I237 VanDerWaalsContact C-N 3.32Å; S235-I237 PolarHBondContact O-N 3.12Å; I237-D239 VanDerWaalsContact C-N 3.29Å; I237-D239 PolarHBondContact O-N 3.34Å; I237-F241 HydrophobicContact CG2-CD2 4.01Å; I237-F241 HydrophobicContact CG2-CE2 4.41Å; I237-F241 WeakPolarHBondContact O-CD2 3.41Å; I237-F241 PolarHBondContact O-N 3.21Å; I237-F241 VanDerWaalsContact O-N 3.15Å
238	L	95.6	Very high	94.6	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-39.1	-179.5	-62	178.8	0	0	0	111.5	I233 T234 S235 N242 V243 V246 E270 I276	I233-L238 HydrophobicContact CG2-CD1 4.08Å; I233-L238 HydrophobicContact CG2-CD2 3.65Å; I233-L238 HydrophobicContact CG2-CG 3.83Å; T234-L238 WeakPolarHBondContact O-CG 3.49Å; T234-L238 PolarHBondContact O-N 2.96Å; S235-L238 PolarHBondContact O-N 3.34Å; S235-L238 VanDerWaalsContact O-N 3.1Å; L238-N242 CarbonylContact O-C 3.59Å; L238-N242 VanDerWaalsContact O-CA 3.31Å; L238-N242 WeakPolarHBondContact O-CA 3.45Å; L238-N242 PolarHBondContact O-N 2.88Å; L238-N242 VanDerWaalsContact O-N 3.14Å; L238-V243 HydrophobicContact CB-CB 4.47Å; L238-V243 HydrophobicContact CD2-CB 3.75Å; L238-V243 HydrophobicContact CD2-CG1 3.83Å; L238-V243 HydrophobicContact CD2-CG2 4.09Å; L238-V243 PolarHBondContact O-N 2.79Å; L238-V246 HydrophobicContact CD2-CG2 3.71Å; L238-E270 HydrophobicContact CD1-CB 4.41Å; L238-E270 HydrophobicContact CD1-CG 3.48Å; L238-E270 VanDerWaalsContact CD1-CG 3.48Å; L238-I276 HydrophobicContact CD1-CD1 4.34Å; L238-I276 HydrophobicContact CD2-CD1 4.34Å
239	D	96	Very high	94.3	Very high	97 Å²	97	45.9 Å²	45.9	52%	0.519	24%	0.243	S	C	.	.	H	α-helix	trans	-79.6	-42.1	-178.3	-63.5	-33.9	0	0	0	111.4	S235 I237 F241 N242 R274	S235-D239 WeakPolarHBondContact O-CB 3.25Å; S235-D239 PolarHBondContact O-N 3.31Å; S235-D239 VanDerWaalsContact O-OD2 3.04Å; I237-D239 VanDerWaalsContact C-N 3.29Å; I237-D239 PolarHBondContact O-N 3.34Å; D239-F241 PolarHBondContact O-N 3.13Å; D239-N242 PolarHBondContact O-N 3.5Å; D239-R274 IonicContact OD1-CZ 3.19Å; D239-R274 IonicContact OD1-NH1 2.8Å; D239-R274 PolarHBondContact OD1-NH1 2.87Å; D239-R274 IonicContact OD1-NH2 3.36Å; D239-R274 PolarHBondContact OD1-NH2 3.24Å; D239-R274 IonicContact OD2-CZ 3.29Å; D239-R274 IonicContact OD2-NH1 2.7Å; D239-R274 IonicContact OD2-NH2 3Å; D239-R274 PolarHBondContact OD2-NH2 3.36Å
240	Q	94.2	Very high	93.4	Very high	145 Å²	145	50.7 Å²	50.7	68%	0.678	26%	0.264	S	S	*	.	H	α-helix	trans	-59.6	-44.1	178.4	176.5	179.7	-12.5	0	0	112.3	D236	D236-Q240 WeakPolarHBondContact O-CB 3.35Å; D236-Q240 PolarHBondContact O-N 3.46Å
241	F	94.3	Very high	92.2	Very high	55 Å²	55	54.5 Å²	54.5	24%	0.241	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	1.5	-179.4	-65.5	-69.8	0	0	0	113.2	I187 V226 I237 D239 V243	I187-F241 HydrophobicContact CD1-CB 3.72Å; I187-F241 HydrophobicContact CD1-CD1 3.73Å; I187-F241 HydrophobicContact CD1-CG 3.81Å; V226-F241 HydrophobicContact CG2-CE2 3.76Å; V226-F241 HydrophobicContact CG2-CZ 3.8Å; I237-F241 HydrophobicContact CG2-CD2 4.01Å; I237-F241 HydrophobicContact CG2-CE2 4.41Å; I237-F241 WeakPolarHBondContact O-CD2 3.41Å; I237-F241 PolarHBondContact O-N 3.21Å; I237-F241 VanDerWaalsContact O-N 3.15Å; D239-F241 PolarHBondContact O-N 3.13Å; F241-V243 HydrophobicContact CB-CG2 3.9Å; F241-V243 PolarHBondContact O-N 3.47Å
242	N	95.5	Very high	90.6	Very high	107 Å²	107	58.1 Å²	58.1	57%	0.572	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.3	63.1	-173.2	-176.9	38	0	0	0	110.2	V158 L238 D239 Q244	V158-N242 WeakPolarHBondContact CB-O 3.21Å; L238-N242 CarbonylContact O-C 3.59Å; L238-N242 VanDerWaalsContact O-CA 3.31Å; L238-N242 WeakPolarHBondContact O-CA 3.45Å; L238-N242 PolarHBondContact O-N 2.88Å; L238-N242 VanDerWaalsContact O-N 3.14Å; D239-N242 PolarHBondContact O-N 3.5Å; N242-Q244 PolarHBondContact ND2-NE2 3.17Å; N242-Q244 VanDerWaalsContact O-CD 3.23Å; N242-Q244 PolarHBondContact O-NE2 3.21Å; N242-Q244 PolarHBondContact O-OE1 3.38Å; N242-Q244 PolarHBondContact OD1-NE2 2.98Å
243	V	97.2	Very high	88.5	Confident	11 Å²	11	60.9 Å²	60.9	7%	0.067	31%	0.312	C	S	.	.			trans	-80.4	126	-176.4	177.6	0	0	0	0	110.1	V158 L238 F241 A245 V246	V158-V243 HydrophobicContact CG1-CG2 4.43Å; L238-V243 HydrophobicContact CB-CB 4.47Å; L238-V243 HydrophobicContact CD2-CB 3.75Å; L238-V243 HydrophobicContact CD2-CG1 3.83Å; L238-V243 HydrophobicContact CD2-CG2 4.09Å; L238-V243 PolarHBondContact O-N 2.79Å; F241-V243 HydrophobicContact CB-CG2 3.9Å; F241-V243 PolarHBondContact O-N 3.47Å; V243-A245 WeakPolarHBondContact CG1-O 3.31Å; V243-V246 HydrophobicContact CG1-CG2 3.92Å
244	Q	97.6	Very high	86.1	Confident	56 Å²	56	67.4 Å²	67.4	26%	0.262	35%	0.347	S	S	.	.	S	Bend	trans	-100.5	-18	176.1	-71.3	79.5	47.1	0	0	114	K157 V158 N242 I276	K157-Q244 HydrophobicContact CD-CB 4.47Å; K157-Q244 HydrophobicContact CG-CB 3.76Å; K157-Q244 HydrophobicContact CG-CG 4.3Å; V158-Q244 PolarHBondContact O-N 2.69Å; N242-Q244 PolarHBondContact ND2-NE2 3.17Å; N242-Q244 VanDerWaalsContact O-CD 3.23Å; N242-Q244 PolarHBondContact O-NE2 3.21Å; N242-Q244 PolarHBondContact O-OE1 3.38Å; N242-Q244 PolarHBondContact OD1-NE2 2.98Å; Q244-I276 WeakPolarHBondContact O-CB 3.23Å; Q244-I276 WeakPolarHBondContact O-CG2 3.4Å
245	A	97.8	Very high	83.8	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	135.4	178.3	0	0	0	0	0	110.9	V158 V159 Y160 F182 V243 I247 I276	V158-A245 PolarHBondContact O-N 2.79Å; V159-A245 CarbonylContact C-O 3.52Å; V159-A245 WeakPolarHBondContact CA-O 3.34Å; V159-A245 HydrophobicContact CG1-CB 4.46Å; V159-A245 HydrophobicContact CG2-CB 4.39Å; Y160-A245 PolarHBondContact N-O 2.95Å; F182-A245 HydrophobicContact CB-CB 4.47Å; V243-A245 WeakPolarHBondContact CG1-O 3.31Å; A245-I247 HydrophobicContact CB-CD1 4.13Å; A245-I276 WeakPolarHBondContact CA-O 3.09Å
246	V	97.9	Very high	81.4	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.9	172.6	175.3	0	0	0	0	108.2	Y160 I233 L238 V243 F268 A271 I276 Y277 H278	Y160-V246 VanDerWaalsContact O-CA 3.31Å; Y160-V246 WeakPolarHBondContact O-CA 3.42Å; I233-V246 HydrophobicContact CD1-CG1 3.48Å; I233-V246 VanDerWaalsContact CD1-CG1 3.48Å; L238-V246 HydrophobicContact CD2-CG2 3.71Å; V243-V246 HydrophobicContact CG1-CG2 3.92Å; V246-F268 HydrophobicContact CG1-CD1 3.85Å; V246-F268 HydrophobicContact CG1-CE1 4.09Å; V246-A271 HydrophobicContact CB-CB 3.8Å; V246-A271 HydrophobicContact CG1-CB 4.05Å; V246-A271 HydrophobicContact CG2-CB 3.75Å; V246-I276 HydrophobicContact CG2-CD1 4.22Å; V246-I276 HydrophobicContact CG2-CG1 4.41Å; V246-I276 PolarHBondContact N-O 3.48Å; V246-Y277 HydrophobicContact CG1-CD2 4.45Å; V246-Y277 WeakPolarHBondContact O-CA 3.43Å; V246-H278 PolarHBondContact O-N 3.46Å
247	I	97.2	Very high	79	Confident	1 Å²	1	73 Å²	73	1%	0.005	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	130.3	-174.9	-42.8	-60.4	0	0	0	110	V159 Y160 V161 F175 A179 F182 A245 H278 V280	V159-I247 HydrophobicContact CG1-CD1 4.29Å; V159-I247 HydrophobicContact CG1-CG1 3.45Å; V159-I247 VanDerWaalsContact CG1-CG1 3.45Å; Y160-I247 PolarHBondContact O-N 3.05Å; V161-I247 HydrophobicContact CG1-CB 3.87Å; V161-I247 HydrophobicContact CG1-CG1 4.47Å; F175-I247 HydrophobicContact CE2-CG2 4.12Å; A179-I247 HydrophobicContact CB-CB 4.05Å; A179-I247 HydrophobicContact CB-CG1 4.17Å; A179-I247 HydrophobicContact CB-CG2 4.04Å; F182-I247 HydrophobicContact CB-CD1 3.8Å; F182-I247 HydrophobicContact CB-CG1 4.32Å; F182-I247 HydrophobicContact CD1-CD1 3.64Å; F182-I247 HydrophobicContact CD2-CD1 3.96Å; F182-I247 HydrophobicContact CD2-CG1 4.43Å; F182-I247 HydrophobicContact CE1-CD1 4.2Å; F182-I247 HydrophobicContact CG-CD1 3.51Å; F182-I247 HydrophobicContact CG-CG1 4.28Å; A245-I247 HydrophobicContact CB-CD1 4.13Å; I247-H278 WeakPolarHBondContact CA-O 3.16Å; I247-H278 HydrophobicContact CD1-CB 3.73Å; I247-V280 HydrophobicContact CG2-CB 4.23Å; I247-V280 HydrophobicContact CG2-CG1 3.7Å; I247-V280 HydrophobicContact CG2-CG2 3.49Å; I247-V280 VanDerWaalsContact CG2-CG2 3.49Å
248	N	93.8	Very high	77	Confident	42 Å²	42	75.1 Å²	75.1	23%	0.225	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	146.4	172	-175.3	35.6	0	0	0	110.8	F268 Y277 H278 E279 V280	N248-F268 HydrophobicContact CB-CE1 4.03Å; N248-F268 HydrophobicContact CB-CE2 4.25Å; N248-F268 HydrophobicContact CB-CZ 3.81Å; N248-Y277 HydrophobicContact CB-CE2 3.67Å; N248-Y277 WeakPolarHBondContact CB-OH 3.48Å; N248-Y277 PolarHBondContact ND2-OH 3.04Å; N248-Y277 VanDerWaalsContact ND2-OH 3.11Å; N248-H278 PolarHBondContact N-O 3.38Å; N248-E279 WeakPolarHBondContact O-CA 3.47Å; N248-V280 PolarHBondContact O-N 2.9Å
249	G	86.4	Confident	74.9	Confident	20 Å²	20	79.1 Å²	79.1	21%	0.206	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	124.4	175.7	0	0	0	0	0	110.3	F175 R251 V280	F175-G249 VanDerWaalsContact CE2-N 3.32Å; G249-R251 PolarHBondContact O-N 3.3Å; G249-V280 CarbonylContact C-O 3.5Å; G249-V280 WeakPolarHBondContact CA-O 3.37Å
250	F	75.7	Confident	72.9	Confident	104 Å²	104	79.5 Å²	79.5	46%	0.456	44%	0.436	S	S	.	.			trans	-66	131.7	170.5	179.8	-96.3	0	0	0	109.5	V280 D281	F250-V280 PolarHBondContact N-O 3.42Å; F250-D281 HydrophobicContact CB-CB 4.46Å
251	R	66.7	Low	71	Confident	131 Å²	131	77.4 Å²	77.4	49%	0.494	44%	0.438	S	S	.	.			trans	-136.2	135.9	171.3	-55.7	-166.2	77.4	-148.3	-13.1	108.5	G249 N253	G249-R251 PolarHBondContact O-N 3.3Å; R251-N253 PolarHBondContact O-N 2.99Å
252	D	55.7	Low	69.3	Low	130 Å²	130	76.4 Å²	76.4	70%	0.695	43%	0.434	S	S	*	.			trans	-64.5	120.4	172.6	-153	-3	0	0	0	108.3	N254	D252-N254 PolarHBondContact O-N 2.93Å
253	N	48	Very low	67.6	Low	151 Å²	151	74.5 Å²	74.5	81%	0.807	43%	0.434	S	S	*	.	S	Bend	trans	-69.5	16.3	-159.7	-81	-36.9	0	0	0	115.5	R251	R251-N253 PolarHBondContact O-N 2.99Å
254	N	42.6	Very low	66.1	Low	144 Å²	144	79 Å²	79	77%	0.77	47%	0.466	S	S	*	.	S	Bend	trans	-90.9	5.9	-168.7	-89.6	-23.7	0	0	0	116.1	D252	D252-N254 PolarHBondContact O-N 2.93Å
255	S	44.4	Very low	65.3	Low	111 Å²	111	79.3 Å²	79.3	78%	0.776	47%	0.468	S	S	*	.	S	Bend	trans	-146	11.4	-174	-72.5	0	0	0	0	118
256	S	45.3	Very low	64.8	Low	75 Å²	75	82.4 Å²	82.4	52%	0.524	49%	0.485	S	S	.	.			trans	-106.2	97.2	173.7	-49	0	0	0	0	109.4	V258	S256-V258 PolarHBondContact O-N 3.34Å
257	V	43.9	Very low	64.4	Low	136 Å²	136	83.3 Å²	83.3	82%	0.824	49%	0.491	S	S	*	.			trans	-68.2	84.9	166.2	-178	0	0	0	0	106.9	N259	V257-N259 PolarHBondContact O-N 3.28Å
258	V	52.2	Low	64.2	Low	59 Å²	59	84.2 Å²	84.2	36%	0.358	50%	0.495	S	S	.	.			trans	-71.6	121	171.6	-171.2	0	0	0	0	106.5	S256 S260 A263	S256-V258 PolarHBondContact O-N 3.34Å; V258-S260 PolarHBondContact O-N 2.83Å; V258-A263 HydrophobicContact CG1-CB 4.46Å
259	N	50.7	Low	64.2	Low	86 Å²	86	84.5 Å²	84.5	46%	0.46	50%	0.503	S	S	.	.			trans	-52.8	134.9	173.6	-100.7	-37.8	0	0	0	110.3	Q198 V257 S261 L262	Q198-N259 PolarHBondContact O-ND2 3.04Å; V257-N259 PolarHBondContact O-N 3.28Å; N259-S261 PolarHBondContact O-N 3.36Å; N259-L262 PolarHBondContact O-N 2.97Å
260	S	53.3	Low	64.5	Low	105 Å²	105	84.7 Å²	84.7	73%	0.734	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-12.6	-164.1	55	0	0	0	0	116.4	V258	V258-S260 PolarHBondContact O-N 2.83Å
261	S	55.1	Low	65.5	Low	102 Å²	102	79.7 Å²	79.7	71%	0.713	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-27	-177.5	-49.4	0	0	0	0	114.5	N259	N259-S261 PolarHBondContact O-N 3.36Å
262	L	58.8	Low	66.8	Low	33 Å²	33	77.9 Å²	77.9	17%	0.173	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-5.5	179.2	-71.6	170.2	0	0	0	113.1	Q198 Y231 N259 S264 I265	Q198-L262 HydrophobicContact CB-CD1 4.16Å; Y231-L262 HydrophobicContact CD1-CD2 4.29Å; Y231-L262 HydrophobicContact CE1-CB 4.36Å; Y231-L262 HydrophobicContact CE1-CD2 4.41Å; N259-L262 PolarHBondContact O-N 2.97Å; L262-S264 PolarHBondContact O-N 3.26Å; L262-I265 PolarHBondContact O-N 3.48Å
263	A	60	Low	68.8	Low	68 Å²	68	79.8 Å²	79.8	56%	0.562	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-17.7	-176.8	0	0	0	0	0	113.8	V258	V258-A263 HydrophobicContact CG1-CB 4.46Å
264	S	65.7	Low	71	Confident	106 Å²	106	76.8 Å²	76.8	74%	0.741	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-6.3	-179	58.6	0	0	0	0	114.4	L262	L262-S264 PolarHBondContact O-N 3.26Å
265	I	79.6	Confident	73.6	Confident	61 Å²	61	72.8 Å²	72.8	31%	0.313	44%	0.44	S	S	.	.			trans	-110.9	124.7	-175.5	-58.1	176.3	0	0	0	108.1	E232 L262 P267	E232-I265 HydrophobicContact CG-CG2 3.63Å; L262-I265 PolarHBondContact O-N 3.48Å; I265-P267 WeakPolarHBondContact O-CD 3.46Å
266	D	87.3	Confident	76.1	Confident	65 Å²	65	69 Å²	69	35%	0.348	41%	0.411	S	S	.	.			trans	-83.6	104.7	170.2	178.3	6.3	0	0	0	109	F268 A269 K272	D266-F268 PolarHBondContact O-N 2.85Å; D266-F268 PolarHBondContact OD1-N 3.36Å; D266-A269 HydrophobicContact CB-CB 4.24Å; D266-A269 WeakPolarHBondContact O-CB 3.27Å; D266-A269 PolarHBondContact O-N 3.01Å; D266-A269 VanDerWaalsContact O-N 3.12Å; D266-K272 VanDerWaalsContact CG-NZ 3.31Å; D266-K272 IonicContact OD1-NZ 2.99Å; D266-K272 PolarHBondContact OD1-NZ 3.41Å; D266-K272 WeakPolarHBondContact OD2-CD 3.5Å; D266-K272 IonicContact OD2-NZ 2.57Å; D266-K272 PolarHBondContact OD2-NZ 2.99Å
267	P	89.4	Confident	78.6	Confident	19 Å²	19	67.3 Å²	67.3	12%	0.123	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.6	-176.5	26.4	-33.3	0	0	0	113.1	Y231 I233 I265	Y231-P267 HydrophobicContact CD1-CB 4.24Å; Y231-P267 HydrophobicContact CE1-CB 4.07Å; Y231-P267 HydrophobicContact CE1-CG 4.21Å; Y231-P267 WeakPolarHBondContact O-CB 3.44Å; I233-P267 WeakPolarHBondContact CB-O 3.5Å; I233-P267 PolarHBondContact N-O 3.44Å; I265-P267 WeakPolarHBondContact O-CD 3.46Å
268	F	93.3	Very high	81.1	Confident	21 Å²	21	64.2 Å²	64.2	9%	0.092	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	8.3	-179.3	-58.4	-81.3	0	0	0	113.4	T162 I233 V246 N248 D266 E270 A271 K272 Y277	T162-F268 HydrophobicContact CG2-CE1 4.3Å; T162-F268 HydrophobicContact CG2-CZ 4.45Å; I233-F268 HydrophobicContact CD1-CD1 3.47Å; I233-F268 VanDerWaalsContact CD1-CD1 3.47Å; I233-F268 HydrophobicContact CD1-CE1 3.65Å; I233-F268 HydrophobicContact CG1-CD1 4.48Å; V246-F268 HydrophobicContact CG1-CD1 3.85Å; V246-F268 HydrophobicContact CG1-CE1 4.09Å; N248-F268 HydrophobicContact CB-CE1 4.03Å; N248-F268 HydrophobicContact CB-CE2 4.25Å; N248-F268 HydrophobicContact CB-CZ 3.81Å; D266-F268 PolarHBondContact O-N 2.85Å; D266-F268 PolarHBondContact OD1-N 3.36Å; F268-E270 VanDerWaalsContact C-N 3.31Å; F268-E270 PolarHBondContact O-N 3.49Å; F268-A271 PolarHBondContact O-N 3.17Å; F268-A271 VanDerWaalsContact O-N 3.12Å; F268-K272 HydrophobicContact CB-CD 4.48Å; F268-K272 WeakPolarHBondContact O-CG 3.27Å; F268-K272 PolarHBondContact O-N 3.39Å; F268-Y277 HydrophobicContact CB-CD2 3.74Å; F268-Y277 HydrophobicContact CB-CE2 3.63Å; F268-Y277 AromaticContact CD1-CD2 3.84Å; F268-Y277 HydrophobicContact CD1-CD2 3.84Å; F268-Y277 AromaticContact CD1-CE2 3.55Å; F268-Y277 HydrophobicContact CD1-CE2 3.55Å; F268-Y277 AromaticContact CD2-CE2 3.98Å; F268-Y277 HydrophobicContact CD2-CE2 3.98Å; F268-Y277 HydrophobicContact CE1-CE2 4.17Å; F268-Y277 AromaticContact CG-CD2 3.92Å; F268-Y277 HydrophobicContact CG-CD2 3.92Å; F268-Y277 AromaticContact CG-CE2 3.44Å; F268-Y277 HydrophobicContact CG-CE2 3.44Å; F268-Y277 VanDerWaalsContact CG-CE2 3.44Å
269	A	93.4	Very high	83.1	Confident	48 Å²	48	66.5 Å²	66.5	40%	0.397	38%	0.377	S	S	.	.	H	α-helix	trans	-55.3	-41.7	-174.8	0	0	0	0	0	113.6	D266 R273	D266-A269 HydrophobicContact CB-CB 4.24Å; D266-A269 WeakPolarHBondContact O-CB 3.27Å; D266-A269 PolarHBondContact O-N 3.01Å; D266-A269 VanDerWaalsContact O-N 3.12Å; A269-R273 WeakPolarHBondContact O-CB 3.43Å; A269-R273 PolarHBondContact O-N 3.48Å
270	E	94	Very high	85.1	Confident	23 Å²	23	63.1 Å²	63.1	11%	0.107	36%	0.359	C	S	.	.	H	α-helix	trans	-63.5	-48.3	176	178	71.3	-128.2	0	0	111.7	I233 L238 F268 K272 R273 R274	I233-E270 VanDerWaalsContact O-CB 3.25Å; I233-E270 WeakPolarHBondContact O-CB 3.31Å; L238-E270 HydrophobicContact CD1-CB 4.41Å; L238-E270 HydrophobicContact CD1-CG 3.48Å; L238-E270 VanDerWaalsContact CD1-CG 3.48Å; F268-E270 VanDerWaalsContact C-N 3.31Å; F268-E270 PolarHBondContact O-N 3.49Å; E270-K272 VanDerWaalsContact C-N 3.31Å; E270-K272 PolarHBondContact O-N 3.36Å; E270-R273 VanDerWaalsContact CD-CZ 3.47Å; E270-R273 PolarHBondContact O-N 3.15Å; E270-R273 IonicContact OE1-CZ 3.02Å; E270-R273 IonicContact OE1-NH1 2.73Å; E270-R273 PolarHBondContact OE1-NH1 3.35Å; E270-R273 IonicContact OE1-NH2 3.35Å; E270-R273 IonicContact OE2-CZ 3.18Å; E270-R273 IonicContact OE2-NH1 2.88Å; E270-R273 PolarHBondContact OE2-NH1 3.47Å; E270-R273 IonicContact OE2-NH2 3.92Å; E270-R273 PolarHBondContact OE2-NH2 2.77Å; E270-R274 WeakPolarHBondContact O-CG 3.48Å; E270-R274 PolarHBondContact O-N 3.4Å; E270-R274 IonicContact OE1-CZ 3.87Å; E270-R274 IonicContact OE1-NE 3.81Å; E270-R274 PolarHBondContact OE1-NE 3.28Å; E270-R274 IonicContact OE1-NH2 2.98Å; E270-R274 PolarHBondContact OE1-NH2 3.5Å
271	A	95.2	Very high	87	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62.2	-39.7	-180	0	0	0	0	0	111.9	V246 F268 R274 G275 I276	V246-A271 HydrophobicContact CB-CB 3.8Å; V246-A271 HydrophobicContact CG1-CB 4.05Å; V246-A271 HydrophobicContact CG2-CB 3.75Å; F268-A271 PolarHBondContact O-N 3.17Å; F268-A271 VanDerWaalsContact O-N 3.12Å; A271-R274 PolarHBondContact O-N 2.89Å; A271-G275 PolarHBondContact O-N 3.41Å; A271-G275 VanDerWaalsContact O-N 3.15Å; A271-I276 HydrophobicContact CB-CG1 4.26Å; A271-I276 PolarHBondContact O-N 3.21Å; A271-I276 VanDerWaalsContact O-N 3.1Å
272	K	95.4	Very high	88.6	Confident	93 Å²	93	58.7 Å²	58.7	40%	0.404	32%	0.32	S	S	.	.	H	α-helix	trans	-64.6	-44.1	174.1	-71	172.6	-175.8	167.7	0	111.5	D266 F268 E270 R274 G275 Y277	D266-K272 VanDerWaalsContact CG-NZ 3.31Å; D266-K272 IonicContact OD1-NZ 2.99Å; D266-K272 PolarHBondContact OD1-NZ 3.41Å; D266-K272 WeakPolarHBondContact OD2-CD 3.5Å; D266-K272 IonicContact OD2-NZ 2.57Å; D266-K272 PolarHBondContact OD2-NZ 2.99Å; F268-K272 HydrophobicContact CB-CD 4.48Å; F268-K272 WeakPolarHBondContact O-CG 3.27Å; F268-K272 PolarHBondContact O-N 3.39Å; E270-K272 VanDerWaalsContact C-N 3.31Å; E270-K272 PolarHBondContact O-N 3.36Å; K272-R274 VanDerWaalsContact C-N 3.26Å; K272-R274 PolarHBondContact O-N 3.14Å; K272-G275 PolarHBondContact O-N 3.48Å; K272-Y277 HydrophobicContact CD-CD1 4.43Å; K272-Y277 HydrophobicContact CG-CD1 3.81Å; K272-Y277 HydrophobicContact CG-CD2 4.35Å; K272-Y277 HydrophobicContact CG-CG 3.71Å
273	R	96.2	Very high	90	Very high	170 Å²	170	60 Å²	60	64%	0.642	34%	0.343	S	S	*	.	H	α-helix	trans	-60.5	-35.4	175.5	170.4	166.2	34.5	89.6	-0.9	112.4	A269 E270 G275	A269-R273 WeakPolarHBondContact O-CB 3.43Å; A269-R273 PolarHBondContact O-N 3.48Å; E270-R273 VanDerWaalsContact CD-CZ 3.47Å; E270-R273 PolarHBondContact O-N 3.15Å; E270-R273 IonicContact OE1-CZ 3.02Å; E270-R273 IonicContact OE1-NH1 2.73Å; E270-R273 PolarHBondContact OE1-NH1 3.35Å; E270-R273 IonicContact OE1-NH2 3.35Å; E270-R273 IonicContact OE2-CZ 3.18Å; E270-R273 IonicContact OE2-NH1 2.88Å; E270-R273 PolarHBondContact OE2-NH1 3.47Å; E270-R273 IonicContact OE2-NH2 3.92Å; E270-R273 PolarHBondContact OE2-NH2 2.77Å; R273-G275 VanDerWaalsContact C-N 3.31Å
274	R	96.3	Very high	91.3	Very high	87 Å²	87	58.4 Å²	58.4	33%	0.328	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-7.1	175.6	-67.1	-175.6	-172.6	-152.1	-1.5	114	D239 E270 A271 K272 I276	D239-R274 IonicContact OD1-CZ 3.19Å; D239-R274 IonicContact OD1-NH1 2.8Å; D239-R274 PolarHBondContact OD1-NH1 2.87Å; D239-R274 IonicContact OD1-NH2 3.36Å; D239-R274 PolarHBondContact OD1-NH2 3.24Å; D239-R274 IonicContact OD2-CZ 3.29Å; D239-R274 IonicContact OD2-NH1 2.7Å; D239-R274 IonicContact OD2-NH2 3Å; D239-R274 PolarHBondContact OD2-NH2 3.36Å; E270-R274 WeakPolarHBondContact O-CG 3.48Å; E270-R274 PolarHBondContact O-N 3.4Å; E270-R274 IonicContact OE1-CZ 3.87Å; E270-R274 IonicContact OE1-NE 3.81Å; E270-R274 PolarHBondContact OE1-NE 3.28Å; E270-R274 IonicContact OE1-NH2 2.98Å; E270-R274 PolarHBondContact OE1-NH2 3.5Å; A271-R274 PolarHBondContact O-N 2.89Å; K272-R274 VanDerWaalsContact C-N 3.26Å; K272-R274 PolarHBondContact O-N 3.14Å; R274-I276 VanDerWaalsContact C-N 3.28Å; R274-I276 HydrophobicContact CB-CD1 4.25Å; R274-I276 HydrophobicContact CB-CG1 4.01Å; R274-I276 HydrophobicContact CB-CG2 4.49Å; R274-I276 PolarHBondContact O-N 3.27Å
275	G	96.7	Very high	92.3	Very high	61 Å²	61	59.4 Å²	59.4	63%	0.629	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	20.5	-179.1	0	0	0	0	0	114.5	A271 K272 R273	A271-G275 PolarHBondContact O-N 3.41Å; A271-G275 VanDerWaalsContact O-N 3.15Å; K272-G275 PolarHBondContact O-N 3.48Å; R273-G275 VanDerWaalsContact C-N 3.31Å
276	I	97.2	Very high	92.7	Very high	30 Å²	30	58.1 Å²	58.1	15%	0.154	32%	0.317	C	S	.	.			trans	-109.2	6.8	-177.3	64.1	174.2	0	0	0	113	L238 Q244 A245 V246 A271 R274 H278	L238-I276 HydrophobicContact CD1-CD1 4.34Å; L238-I276 HydrophobicContact CD2-CD1 4.34Å; Q244-I276 WeakPolarHBondContact O-CB 3.23Å; Q244-I276 WeakPolarHBondContact O-CG2 3.4Å; A245-I276 WeakPolarHBondContact CA-O 3.09Å; V246-I276 HydrophobicContact CG2-CD1 4.22Å; V246-I276 HydrophobicContact CG2-CG1 4.41Å; V246-I276 PolarHBondContact N-O 3.48Å; A271-I276 HydrophobicContact CB-CG1 4.26Å; A271-I276 PolarHBondContact O-N 3.21Å; A271-I276 VanDerWaalsContact O-N 3.1Å; R274-I276 VanDerWaalsContact C-N 3.28Å; R274-I276 HydrophobicContact CB-CD1 4.25Å; R274-I276 HydrophobicContact CB-CG1 4.01Å; R274-I276 HydrophobicContact CB-CG2 4.49Å; R274-I276 PolarHBondContact O-N 3.27Å; I276-H278 PolarHBondContact O-CD2 2.93Å
277	Y	97.3	Very high	92.7	Very high	41 Å²	41	55.7 Å²	55.7	16%	0.161	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.9	178.5	177.1	-99.6	0	0	0	111.3	V246 N248 F268 K272 E279	V246-Y277 HydrophobicContact CG1-CD2 4.45Å; V246-Y277 WeakPolarHBondContact O-CA 3.43Å; N248-Y277 HydrophobicContact CB-CE2 3.67Å; N248-Y277 WeakPolarHBondContact CB-OH 3.48Å; N248-Y277 PolarHBondContact ND2-OH 3.04Å; N248-Y277 VanDerWaalsContact ND2-OH 3.11Å; F268-Y277 HydrophobicContact CB-CD2 3.74Å; F268-Y277 HydrophobicContact CB-CE2 3.63Å; F268-Y277 AromaticContact CD1-CD2 3.84Å; F268-Y277 HydrophobicContact CD1-CD2 3.84Å; F268-Y277 AromaticContact CD1-CE2 3.55Å; F268-Y277 HydrophobicContact CD1-CE2 3.55Å; F268-Y277 AromaticContact CD2-CE2 3.98Å; F268-Y277 HydrophobicContact CD2-CE2 3.98Å; F268-Y277 HydrophobicContact CE1-CE2 4.17Å; F268-Y277 AromaticContact CG-CD2 3.92Å; F268-Y277 HydrophobicContact CG-CD2 3.92Å; F268-Y277 AromaticContact CG-CE2 3.44Å; F268-Y277 HydrophobicContact CG-CE2 3.44Å; F268-Y277 VanDerWaalsContact CG-CE2 3.44Å; K272-Y277 HydrophobicContact CD-CD1 4.43Å; K272-Y277 HydrophobicContact CG-CD1 3.81Å; K272-Y277 HydrophobicContact CG-CD2 4.35Å; K272-Y277 HydrophobicContact CG-CG 3.71Å; Y277-E279 HydrophobicContact CE1-CG 3.49Å; Y277-E279 VanDerWaalsContact CE1-CG 3.49Å; Y277-E279 VanDerWaalsContact OH-CG 3.24Å; Y277-E279 WeakPolarHBondContact OH-CG 3.27Å; Y277-E279 PolarHBondContact OH-OE1 3.41Å
278	H	96.1	Very high	92.5	Very high	70 Å²	70	55 Å²	55	32%	0.324	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	146.6	174.3	-53.9	-79.2	0	0	0	111	F182 V246 I247 N248 I276	F182-H278 HydrophobicContact CD1-CB 4.39Å; F182-H278 HydrophobicContact CE1-CB 3.9Å; F182-H278 AromaticContact CE1-CG 3.83Å; F182-H278 HydrophobicContact CZ-CB 4.46Å; V246-H278 PolarHBondContact O-N 3.46Å; I247-H278 WeakPolarHBondContact CA-O 3.16Å; I247-H278 HydrophobicContact CD1-CB 3.73Å; N248-H278 PolarHBondContact N-O 3.38Å; I276-H278 PolarHBondContact O-CD2 2.93Å
279	E	94.2	Very high	92	Very high	108 Å²	108	57.4 Å²	57.4	51%	0.505	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	138.8	172.6	-70.2	-175.9	153.1	0	0	110.4	N248 Y277	N248-E279 WeakPolarHBondContact O-CA 3.47Å; Y277-E279 HydrophobicContact CE1-CG 3.49Å; Y277-E279 VanDerWaalsContact CE1-CG 3.49Å; Y277-E279 VanDerWaalsContact OH-CG 3.24Å; Y277-E279 WeakPolarHBondContact OH-CG 3.27Å; Y277-E279 PolarHBondContact OH-OE1 3.41Å
280	V	93.5	Very high	91.6	Very high	14 Å²	14	58.4 Å²	58.4	9%	0.085	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.9	178.2	-60.1	0	0	0	0	110.1	F175 K178 F182 I247 N248 G249 F250	F175-V280 HydrophobicContact CD2-CG2 3.69Å; F175-V280 HydrophobicContact CE2-CG2 3.63Å; K178-V280 HydrophobicContact CB-CG2 4.42Å; F182-V280 HydrophobicContact CD2-CG1 4.43Å; F182-V280 HydrophobicContact CE2-CG1 3.45Å; F182-V280 VanDerWaalsContact CE2-CG1 3.45Å; F182-V280 HydrophobicContact CZ-CG1 3.67Å; I247-V280 HydrophobicContact CG2-CB 4.23Å; I247-V280 HydrophobicContact CG2-CG1 3.7Å; I247-V280 HydrophobicContact CG2-CG2 3.49Å; I247-V280 VanDerWaalsContact CG2-CG2 3.49Å; N248-V280 PolarHBondContact O-N 2.9Å; G249-V280 CarbonylContact C-O 3.5Å; G249-V280 WeakPolarHBondContact CA-O 3.37Å; F250-V280 PolarHBondContact N-O 3.42Å
281	D	91.8	Very high	91.3	Very high	94 Å²	94	58.8 Å²	58.8	50%	0.503	32%	0.315	S	S	.	.			trans	-80.8	122	168.4	-179.2	3.6	0	0	0	108.8	K178 F250 G283	K178-D281 WeakPolarHBondContact CD-O 3.26Å; K178-D281 WeakPolarHBondContact CE-O 3.42Å; K178-D281 PolarHBondContact NZ-O 3.46Å; F250-D281 HydrophobicContact CB-CB 4.46Å; D281-G283 PolarHBondContact O-N 3.16Å; D281-G283 PolarHBondContact OD1-N 2.9Å
282	S	88.6	Confident	90.6	Very high	20 Å²	20	59.6 Å²	59.6	14%	0.14	32%	0.319	C	S	.	.			trans	-65.4	-24.7	175.5	73.3	0	0	0	0	112.6	K178 S284	K178-S282 PolarHBondContact NZ-O 2.81Å; S282-S284 PolarHBondContact OG-N 3.28Å; S282-S284 VanDerWaalsContact OG-N 3.14Å; S282-S284 PolarHBondContact OG-O 3.3Å
283	G	88.1	Confident	89.9	Confident	62 Å²	62	59.9 Å²	59.9	64%	0.639	33%	0.325	S	S	*	.	S	Bend	trans	74.3	8.9	-170.9	0	0	0	0	0	113.4	D281	D281-G283 PolarHBondContact O-N 3.16Å; D281-G283 PolarHBondContact OD1-N 2.9Å
284	S	87.8	Confident	89.3	Confident	34 Å²	34	58.2 Å²	58.2	24%	0.238	32%	0.319	C	S	.	.			trans	-119.7	135.9	176	-174.1	0	0	0	0	110.5	S282 M286	S282-S284 PolarHBondContact OG-N 3.28Å; S282-S284 VanDerWaalsContact OG-N 3.14Å; S282-S284 PolarHBondContact OG-O 3.3Å; S284-M286 VanDerWaalsContact C-N 3.34Å; S284-M286 WeakPolarHBondContact OG-CB 3.29Å; S284-M286 PolarHBondContact OG-N 3.27Å
285	D	88.1	Confident	88.5	Confident	126 Å²	126	56.3 Å²	56.3	67%	0.674	32%	0.315	S	S	*	.			trans	-85.4	-7.1	173	63.2	-16.4	0	0	0	113.1	T287 L290	D285-T287 PolarHBondContact O-N 3.43Å; D285-L290 WeakPolarHBondContact O-CD1 3.36Å
286	M	87.5	Confident	87.5	Confident	35 Å²	35	55.6 Å²	55.6	17%	0.172	30%	0.296	C	S	.	.			trans	-66.4	131.8	-170.5	-164.8	61.5	46.5	0	0	112.7	H169 I170 S284 I291 R294	H169-M286 PolarHBondContact CE1-O 3.46Å; I170-M286 HydrophobicContact CG2-CB 4.06Å; I170-M286 HydrophobicContact CG2-CG 4.13Å; S284-M286 VanDerWaalsContact C-N 3.34Å; S284-M286 WeakPolarHBondContact OG-CB 3.29Å; S284-M286 PolarHBondContact OG-N 3.27Å; M286-I291 HydrophobicContact CG-CD1 4.16Å; M286-I291 HydrophobicContact CG-CG1 4.21Å; M286-I291 HydrophobicContact SD-CD1 4.34Å; M286-I291 HydrophobicContact SD-CG1 3.74Å; M286-R294 VanDerWaalsContact CE-NH1 3.35Å
287	T	87.1	Confident	86.4	Confident	14 Å²	14	59.2 Å²	59.2	9%	0.086	31%	0.312	C	S	.	.			trans	-133.6	164.2	176.3	69.6	0	0	0	0	112.1	D285 D289 L290 I291	D285-T287 PolarHBondContact O-N 3.43Å; T287-D289 PolarHBondContact O-N 3.04Å; T287-D289 PolarHBondContact OG1-N 3.28Å; T287-L290 HydrophobicContact CG2-CD1 4.31Å; T287-L290 PolarHBondContact O-N 3.4Å; T287-L290 WeakPolarHBondContact OG1-CB 3.3Å; T287-L290 WeakPolarHBondContact OG1-CG 3.33Å; T287-L290 PolarHBondContact OG1-N 2.91Å; T287-I291 VanDerWaalsContact O-CG1 3.27Å; T287-I291 WeakPolarHBondContact O-CG1 3.26Å; T287-I291 PolarHBondContact O-N 3.24Å
288	T	85.2	Confident	85.3	Confident	3 Å²	3	62.6 Å²	62.6	2%	0.018	33%	0.329	C	S	.	.	H	α-helix	trans	-52.3	-44.7	167.6	-43.2	0	0	0	0	111.4	D166 L167 H169 I291 I292	D166-T288 HydrophobicContact CB-CG2 4.27Å; D166-T288 PolarHBondContact O-OG1 3.33Å; D166-T288 VanDerWaalsContact O-OG1 3.12Å; L167-T288 HydrophobicContact CB-CG2 4.23Å; L167-T288 HydrophobicContact CD1-CG2 3.81Å; L167-T288 HydrophobicContact CG-CG2 4.15Å; H169-T288 PolarHBondContact NE2-N 3.44Å; T288-I291 WeakPolarHBondContact O-CB 3.31Å; T288-I291 PolarHBondContact O-N 3.45Å; T288-I292 HydrophobicContact CG2-CD1 4.12Å; T288-I292 VanDerWaalsContact O-CG1 3.27Å; T288-I292 WeakPolarHBondContact O-CG1 3.38Å; T288-I292 PolarHBondContact O-N 2.9Å
289	D	82.5	Confident	84.1	Confident	73 Å²	73	64.4 Å²	64.4	39%	0.39	33%	0.333	S	S	.	.	H	α-helix	trans	-66.3	-43.8	-178.3	-54	-51.8	0	0	0	112	H204 T287 I291 I292 D293	H204-D289 IonicContact CE1-OD1 3.88Å; H204-D289 IonicContact NE2-OD1 3.96Å; H204-D289 PolarHBondContact NE2-OD1 3.22Å; T287-D289 PolarHBondContact O-N 3.04Å; T287-D289 PolarHBondContact OG1-N 3.28Å; D289-I291 VanDerWaalsContact C-N 3.29Å; D289-I291 PolarHBondContact O-N 3.44Å; D289-I292 WeakPolarHBondContact O-CB 3.32Å; D289-I292 PolarHBondContact O-N 2.9Å; D289-I292 VanDerWaalsContact O-N 3.17Å; D289-D293 WeakPolarHBondContact O-CB 3.13Å; D289-D293 PolarHBondContact O-N 2.87Å
290	L	85	Confident	82.8	Confident	68 Å²	68	63.8 Å²	63.8	36%	0.356	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-35.2	176	-71.5	174.8	0	0	0	111.9	D285 T287 R294	D285-L290 WeakPolarHBondContact O-CD1 3.36Å; T287-L290 HydrophobicContact CG2-CD1 4.31Å; T287-L290 PolarHBondContact O-N 3.4Å; T287-L290 WeakPolarHBondContact OG1-CB 3.3Å; T287-L290 WeakPolarHBondContact OG1-CG 3.33Å; T287-L290 PolarHBondContact OG1-N 2.91Å; L290-R294 VanDerWaalsContact O-CB 3.3Å; L290-R294 WeakPolarHBondContact O-CB 3.39Å; L290-R294 WeakPolarHBondContact O-CG 3.5Å; L290-R294 PolarHBondContact O-N 3.16Å
291	I	86.9	Confident	81.8	Confident	31 Å²	31	67.9 Å²	67.9	16%	0.159	35%	0.35	C	S	.	.	H	α-helix	trans	-64.5	-46.7	173.9	-70.9	166.1	0	0	0	110.1	L167 H169 M286 T287 T288 D289 R294 I295	L167-I291 HydrophobicContact CD1-CG2 4.29Å; H169-I291 HydrophobicContact CB-CD1 3.44Å; H169-I291 VanDerWaalsContact CB-CD1 3.44Å; H169-I291 WeakPolarHBondContact CD2-CD1 3.35Å; M286-I291 HydrophobicContact CG-CD1 4.16Å; M286-I291 HydrophobicContact CG-CG1 4.21Å; M286-I291 HydrophobicContact SD-CD1 4.34Å; M286-I291 HydrophobicContact SD-CG1 3.74Å; T287-I291 VanDerWaalsContact O-CG1 3.27Å; T287-I291 WeakPolarHBondContact O-CG1 3.26Å; T287-I291 PolarHBondContact O-N 3.24Å; T288-I291 WeakPolarHBondContact O-CB 3.31Å; T288-I291 PolarHBondContact O-N 3.45Å; D289-I291 VanDerWaalsContact C-N 3.29Å; D289-I291 PolarHBondContact O-N 3.44Å; I291-R294 PolarHBondContact O-N 3.07Å; I291-I295 HydrophobicContact CG2-CD1 3.66Å; I291-I295 HydrophobicContact CG2-CG1 4.47Å; I291-I295 WeakPolarHBondContact O-CB 3.42Å; I291-I295 VanDerWaalsContact O-CG1 3.27Å; I291-I295 WeakPolarHBondContact O-CG1 3.46Å; I291-I295 PolarHBondContact O-N 3.14Å
292	I	81.9	Confident	80.7	Confident	18 Å²	18	68.9 Å²	68.9	9%	0.092	35%	0.348	C	S	.	.	H	α-helix	trans	-58.8	-49.9	177.2	-69.2	165.5	0	0	0	109.8	M75 L167 I206 T288 D289 R294 I295 I296	M75-I292 HydrophobicContact CB-CG1 4.43Å; M75-I292 HydrophobicContact CB-CG2 4.49Å; M75-I292 HydrophobicContact CG-CG1 3.96Å; M75-I292 HydrophobicContact SD-CG1 3.96Å; L167-I292 HydrophobicContact CD1-CG1 4.26Å; I206-I292 HydrophobicContact CD1-CD1 4.25Å; I206-I292 HydrophobicContact CG1-CD1 4.13Å; T288-I292 HydrophobicContact CG2-CD1 4.12Å; T288-I292 VanDerWaalsContact O-CG1 3.27Å; T288-I292 WeakPolarHBondContact O-CG1 3.38Å; T288-I292 PolarHBondContact O-N 2.9Å; D289-I292 WeakPolarHBondContact O-CB 3.32Å; D289-I292 PolarHBondContact O-N 2.9Å; D289-I292 VanDerWaalsContact O-N 3.17Å; I292-R294 PolarHBondContact O-N 2.65Å; I292-I295 PolarHBondContact O-N 3.17Å; I292-I296 HydrophobicContact CG2-CD1 3.57Å; I292-I296 HydrophobicContact CG2-CG1 4.31Å; I292-I296 WeakPolarHBondContact O-CB 2.92Å; I292-I296 VanDerWaalsContact O-CG1 3.26Å; I292-I296 WeakPolarHBondContact O-CG1 3.45Å; I292-I296 PolarHBondContact O-N 2.94Å
293	D	81	Confident	79.7	Confident	99 Å²	99	70.9 Å²	70.9	53%	0.529	36%	0.355	S	S	.	.	H	α-helix	trans	-59.2	-45.1	179.3	-73.6	-20.4	0	0	0	112.1	D289 I295 I296 H297	D289-D293 WeakPolarHBondContact O-CB 3.13Å; D289-D293 PolarHBondContact O-N 2.87Å; D293-I295 PolarHBondContact O-N 3.44Å; D293-I296 PolarHBondContact O-N 3.04Å; D293-H297 VanDerWaalsContact O-CB 3.31Å; D293-H297 WeakPolarHBondContact O-CB 3.49Å; D293-H297 PolarHBondContact O-N 3.24Å
294	R	83.6	Confident	78.8	Confident	135 Å²	135	71.3 Å²	71.3	51%	0.509	35%	0.345	S	S	.	.	H	α-helix	trans	-61.7	-43	176.7	-74.9	173.2	71	-172.5	4.4	112.1	M286 L290 I291 I292 H297 H298	M286-R294 VanDerWaalsContact CE-NH1 3.35Å; L290-R294 VanDerWaalsContact O-CB 3.3Å; L290-R294 WeakPolarHBondContact O-CB 3.39Å; L290-R294 WeakPolarHBondContact O-CG 3.5Å; L290-R294 PolarHBondContact O-N 3.16Å; I291-R294 PolarHBondContact O-N 3.07Å; I292-R294 PolarHBondContact O-N 2.65Å; R294-H297 PolarHBondContact O-N 3.38Å; R294-H298 PolarHBondContact O-N 3.21Å
295	I	79.3	Confident	78	Confident	47 Å²	47	77.6 Å²	77.6	24%	0.241	36%	0.364	C	S	.	.	H	α-helix	trans	-66.4	-45.4	179.6	-73.4	169.8	0	0	0	110.7	V72 M75 I291 I292 D293 H297 H298 R299	V72-I295 HydrophobicContact CG1-CG2 4.19Å; V72-I295 HydrophobicContact CG2-CG2 3.94Å; M75-I295 HydrophobicContact CE-CD1 3.75Å; M75-I295 HydrophobicContact SD-CB 4.4Å; M75-I295 HydrophobicContact SD-CD1 3.46Å; M75-I295 WeakPolarHBondContact SD-CD1 3.25Å; M75-I295 HydrophobicContact SD-CG2 4.27Å; I291-I295 HydrophobicContact CG2-CD1 3.66Å; I291-I295 HydrophobicContact CG2-CG1 4.47Å; I291-I295 WeakPolarHBondContact O-CB 3.42Å; I291-I295 VanDerWaalsContact O-CG1 3.27Å; I291-I295 WeakPolarHBondContact O-CG1 3.46Å; I291-I295 PolarHBondContact O-N 3.14Å; I292-I295 PolarHBondContact O-N 3.17Å; D293-I295 PolarHBondContact O-N 3.44Å; I295-H297 VanDerWaalsContact C-N 3.33Å; I295-H297 PolarHBondContact O-N 2.73Å; I295-H298 PolarHBondContact O-N 3.24Å; I295-R299 WeakPolarHBondContact O-CB 3.37Å; I295-R299 PolarHBondContact O-N 2.95Å
296	I	74.3	Confident	77.2	Confident	45 Å²	45	74.3 Å²	74.3	23%	0.231	35%	0.346	C	S	.	.	H	α-helix	trans	-61.3	-45	177.4	-67.9	172.3	0	0	0	110	L76 I292 D293 R299 L300	L76-I296 HydrophobicContact CD2-CG1 3.95Å; I292-I296 HydrophobicContact CG2-CD1 3.57Å; I292-I296 HydrophobicContact CG2-CG1 4.31Å; I292-I296 WeakPolarHBondContact O-CB 2.92Å; I292-I296 VanDerWaalsContact O-CG1 3.26Å; I292-I296 WeakPolarHBondContact O-CG1 3.45Å; I292-I296 PolarHBondContact O-N 2.94Å; D293-I296 PolarHBondContact O-N 3.04Å; I296-R299 PolarHBondContact O-N 3.44Å; I296-L300 HydrophobicContact CG2-CD1 4.15Å; I296-L300 WeakPolarHBondContact O-CG 3.48Å; I296-L300 PolarHBondContact O-N 3.27Å
297	H	74.6	Confident	76.5	Confident	107 Å²	107	78.8 Å²	78.8	50%	0.495	37%	0.365	S	S	.	.	H	α-helix	trans	-59.6	-52.8	178.9	-170.6	74.6	0	0	0	112.1	D293 R294 I295 R299 L300 E301	D293-H297 VanDerWaalsContact O-CB 3.31Å; D293-H297 WeakPolarHBondContact O-CB 3.49Å; D293-H297 PolarHBondContact O-N 3.24Å; R294-H297 PolarHBondContact O-N 3.38Å; I295-H297 VanDerWaalsContact C-N 3.33Å; I295-H297 PolarHBondContact O-N 2.73Å; H297-R299 PolarHBondContact O-N 3.2Å; H297-L300 WeakPolarHBondContact O-CB 3.4Å; H297-L300 PolarHBondContact O-N 3.07Å; H297-L300 VanDerWaalsContact O-N 3.14Å; H297-E301 IonicContact NE2-OE1 2.76Å; H297-E301 PolarHBondContact O-N 2.81Å
298	H	75.3	Confident	76	Confident	111 Å²	111	84.7 Å²	84.7	51%	0.514	39%	0.389	S	S	.	.	H	α-helix	trans	-61.5	-33.4	178.6	-72.2	-176.9	0	0	0	112.7	R294 I295 E301 Y302	R294-H298 PolarHBondContact O-N 3.21Å; I295-H298 PolarHBondContact O-N 3.24Å; H298-E301 IonicContact CD2-OE2 3.52Å; H298-E301 PolarHBondContact O-N 3.3Å; H298-Y302 WeakPolarHBondContact O-CB 3.35Å; H298-Y302 PolarHBondContact O-N 2.96Å
299	R	70.2	Confident	75.5	Confident	108 Å²	108	90.3 Å²	90.3	41%	0.408	41%	0.413	S	S	.	.	H	α-helix	trans	-65.2	-45.1	175.5	179.3	61.1	-176.7	-148.2	-0.6	111.4	I295 I296 H297 E301 Y302 E303	I295-R299 WeakPolarHBondContact O-CB 3.37Å; I295-R299 PolarHBondContact O-N 2.95Å; I296-R299 PolarHBondContact O-N 3.44Å; H297-R299 PolarHBondContact O-N 3.2Å; R299-E301 VanDerWaalsContact C-N 3.3Å; R299-E301 PolarHBondContact O-N 2.93Å; R299-Y302 PolarHBondContact O-N 2.72Å; R299-E303 IonicContact CZ-OE1 2.68Å; R299-E303 IonicContact NE-OE1 3.82Å; R299-E303 PolarHBondContact NE-OE1 2.89Å; R299-E303 IonicContact NH2-OE1 3.27Å; R299-E303 PolarHBondContact NH2-OE1 3.12Å; R299-E303 VanDerWaalsContact NH2-OE1 3.16Å; R299-E303 WeakPolarHBondContact O-CG 3.32Å; R299-E303 PolarHBondContact O-N 3.02Å
300	L	66.5	Low	75.1	Confident	96 Å²	96	91.6 Å²	91.6	50%	0.503	42%	0.417	S	S	.	.	H	α-helix	trans	-61.6	-39.7	177.2	-69.8	170.6	0	0	0	111.6	I296 H297 T304	I296-L300 HydrophobicContact CG2-CD1 4.15Å; I296-L300 WeakPolarHBondContact O-CG 3.48Å; I296-L300 PolarHBondContact O-N 3.27Å; H297-L300 WeakPolarHBondContact O-CB 3.4Å; H297-L300 PolarHBondContact O-N 3.07Å; H297-L300 VanDerWaalsContact O-N 3.14Å; L300-T304 VanDerWaalsContact O-CB 3.32Å; L300-T304 WeakPolarHBondContact O-CB 3.36Å; L300-T304 PolarHBondContact O-N 3.34Å; L300-T304 PolarHBondContact O-OG1 3.44Å
301	E	72.2	Confident	74.8	Confident	99 Å²	99	95.1 Å²	95.1	46%	0.463	43%	0.43	S	S	.	.	H	α-helix	trans	-64.4	-46.1	173.8	-67.8	-172.5	140.3	0	0	112.1	H297 H298 R299 T304 R305	H297-E301 IonicContact NE2-OE1 2.76Å; H297-E301 PolarHBondContact O-N 2.81Å; H298-E301 IonicContact CD2-OE2 3.52Å; H298-E301 PolarHBondContact O-N 3.3Å; R299-E301 VanDerWaalsContact C-N 3.3Å; R299-E301 PolarHBondContact O-N 2.93Å; E301-T304 PolarHBondContact O-N 2.73Å; E301-R305 WeakPolarHBondContact O-CG 3.36Å; E301-R305 PolarHBondContact O-N 3.44Å
302	Y	69.4	Low	74.3	Confident	116 Å²	116	100.8 Å²	100.8	46%	0.455	45%	0.453	S	S	.	.	H	α-helix	trans	-57.7	-49.3	176.1	176.6	-94.6	0	0	0	111.6	H298 R299 T304 R305 N306	H298-Y302 WeakPolarHBondContact O-CB 3.35Å; H298-Y302 PolarHBondContact O-N 2.96Å; R299-Y302 PolarHBondContact O-N 2.72Å; Y302-T304 VanDerWaalsContact C-N 3.31Å; Y302-T304 PolarHBondContact O-N 3.4Å; Y302-R305 PolarHBondContact O-N 2.77Å; Y302-N306 PolarHBondContact O-N 3.29Å
303	E	67.4	Low	74	Confident	62 Å²	62	104.9 Å²	104.9	29%	0.29	47%	0.472	S	S	.	.	H	α-helix	trans	-63.6	-37.3	178.3	-72.3	-175.6	-177.8	0	0	112.3	R299 N306 K307	R299-E303 IonicContact CZ-OE1 2.68Å; R299-E303 IonicContact NE-OE1 3.82Å; R299-E303 PolarHBondContact NE-OE1 2.89Å; R299-E303 IonicContact NH2-OE1 3.27Å; R299-E303 PolarHBondContact NH2-OE1 3.12Å; R299-E303 VanDerWaalsContact NH2-OE1 3.16Å; R299-E303 WeakPolarHBondContact O-CG 3.32Å; R299-E303 PolarHBondContact O-N 3.02Å; E303-N306 PolarHBondContact O-N 3.43Å; E303-K307 WeakPolarHBondContact O-CB 3.22Å; E303-K307 VanDerWaalsContact O-CG 3.26Å; E303-K307 WeakPolarHBondContact O-CG 3.48Å; E303-K307 PolarHBondContact O-N 3.32Å
304	T	69.9	Low	73.5	Confident	70 Å²	70	102.5 Å²	102.5	43%	0.429	47%	0.466	S	S	.	.	H	α-helix	trans	-65.8	-41.3	175.9	-59.6	0	0	0	0	111.4	L300 E301 Y302 K308	L300-T304 VanDerWaalsContact O-CB 3.32Å; L300-T304 WeakPolarHBondContact O-CB 3.36Å; L300-T304 PolarHBondContact O-N 3.34Å; L300-T304 PolarHBondContact O-OG1 3.44Å; E301-T304 PolarHBondContact O-N 2.73Å; Y302-T304 VanDerWaalsContact C-N 3.31Å; Y302-T304 PolarHBondContact O-N 3.4Å; T304-K308 WeakPolarHBondContact O-CG 3.46Å; T304-K308 PolarHBondContact O-N 3.46Å; T304-K308 VanDerWaalsContact O-N 3.12Å
305	R	69.5	Low	73.2	Confident	167 Å²	167	100 Å²	100	63%	0.63	46%	0.463	S	S	*	.	H	α-helix	trans	-65.1	-44.5	174.6	-73	-170.2	-62.3	143.7	-2.5	111.6	E301 Y302 K308 K309	E301-R305 WeakPolarHBondContact O-CG 3.36Å; E301-R305 PolarHBondContact O-N 3.44Å; Y302-R305 PolarHBondContact O-N 2.77Å; R305-K308 WeakPolarHBondContact O-CB 3.26Å; R305-K308 PolarHBondContact O-N 3.28Å; R305-K309 PolarHBondContact O-N 3.3Å
306	N	71.1	Confident	72.9	Confident	56 Å²	56	101.8 Å²	101.8	30%	0.299	48%	0.475	S	S	.	.	H	α-helix	trans	-65.3	-43.7	-179.7	-144	53.7	0	0	0	111.4	Y302 E303 K308 K309 E310	Y302-N306 PolarHBondContact O-N 3.29Å; E303-N306 PolarHBondContact O-N 3.43Å; N306-K308 VanDerWaalsContact C-N 3.28Å; N306-K308 PolarHBondContact O-N 2.86Å; N306-K309 PolarHBondContact O-N 3.1Å; N306-K309 VanDerWaalsContact O-N 3.07Å; N306-E310 PolarHBondContact ND2-OE1 2.92Å; N306-E310 WeakPolarHBondContact O-CB 3.25Å; N306-E310 WeakPolarHBondContact O-CG 3.26Å; N306-E310 PolarHBondContact O-N 3.39Å
307	K	73.2	Confident	72.6	Confident	129 Å²	129	101 Å²	101	56%	0.561	48%	0.476	S	S	*	.	H	α-helix	trans	-57.6	-38.6	172.8	-76	169.1	-177.2	162.1	0	112.7	E303 K311	E303-K307 WeakPolarHBondContact O-CB 3.22Å; E303-K307 VanDerWaalsContact O-CG 3.26Å; E303-K307 WeakPolarHBondContact O-CG 3.48Å; E303-K307 PolarHBondContact O-N 3.32Å; K307-K311 VanDerWaalsContact O-CB 3.29Å; K307-K311 WeakPolarHBondContact O-CB 3.39Å; K307-K311 PolarHBondContact O-N 3.38Å
308	K	76.1	Confident	72.4	Confident	138 Å²	138	102.7 Å²	102.7	60%	0.6	48%	0.482	S	S	*	.	H	α-helix	trans	-67.4	-40	175.1	-75.6	175.8	-178.6	178.6	0	111.8	T304 R305 N306 K312	T304-K308 WeakPolarHBondContact O-CG 3.46Å; T304-K308 PolarHBondContact O-N 3.46Å; T304-K308 VanDerWaalsContact O-N 3.12Å; R305-K308 WeakPolarHBondContact O-CB 3.26Å; R305-K308 PolarHBondContact O-N 3.28Å; N306-K308 VanDerWaalsContact C-N 3.28Å; N306-K308 PolarHBondContact O-N 2.86Å; K308-K312 WeakPolarHBondContact O-CG 3.45Å; K308-K312 PolarHBondContact O-N 3.06Å; K308-K312 VanDerWaalsContact O-N 3.1Å
309	K	74.9	Confident	72.2	Confident	121 Å²	121	101.5 Å²	101.5	53%	0.526	49%	0.491	S	S	.	.	H	α-helix	trans	-66.6	-50.4	177	-175.6	177.4	169.7	-177.8	0	111.2	R305 N306 K311 K312 E313	R305-K309 PolarHBondContact O-N 3.3Å; N306-K309 PolarHBondContact O-N 3.1Å; N306-K309 VanDerWaalsContact O-N 3.07Å; K309-K311 VanDerWaalsContact C-N 3.27Å; K309-K311 PolarHBondContact O-N 2.85Å; K309-K312 WeakPolarHBondContact O-CB 3.26Å; K309-K312 PolarHBondContact O-N 2.88Å; K309-E313 WeakPolarHBondContact CE-OE1 3.28Å; K309-E313 IonicContact NZ-OE1 3.57Å; K309-E313 WeakPolarHBondContact O-CG 3.33Å; K309-E313 PolarHBondContact O-N 2.9Å
310	E	75.8	Confident	72.2	Confident	101 Å²	101	102.4 Å²	102.4	47%	0.472	50%	0.502	S	S	.	.	H	α-helix	trans	-56.4	-40.5	174.9	-72.7	168.6	-163.1	0	0	111.8	N306 E313 A314	N306-E310 PolarHBondContact ND2-OE1 2.92Å; N306-E310 WeakPolarHBondContact O-CB 3.25Å; N306-E310 WeakPolarHBondContact O-CG 3.26Å; N306-E310 PolarHBondContact O-N 3.39Å; E310-E313 PolarHBondContact O-N 2.87Å; E310-A314 VanDerWaalsContact O-CB 3.28Å; E310-A314 WeakPolarHBondContact O-CB 3.4Å; E310-A314 PolarHBondContact O-N 3.13Å
311	K	76.9	Confident	72	Confident	141 Å²	141	104.9 Å²	104.9	61%	0.613	52%	0.515	S	S	*	.	H	α-helix	trans	-62.7	-46.3	175.2	-172.2	-180	177.7	-173.8	0	111.6	K307 K309 A314 D315	K307-K311 VanDerWaalsContact O-CB 3.29Å; K307-K311 WeakPolarHBondContact O-CB 3.39Å; K307-K311 PolarHBondContact O-N 3.38Å; K309-K311 VanDerWaalsContact C-N 3.27Å; K309-K311 PolarHBondContact O-N 2.85Å; K311-A314 PolarHBondContact O-N 3.17Å; K311-D315 WeakPolarHBondContact O-CB 3.5Å; K311-D315 PolarHBondContact O-N 2.92Å
312	K	77.6	Confident	71.1	Confident	151 Å²	151	106.4 Å²	106.4	66%	0.657	53%	0.526	S	S	*	.	H	α-helix	trans	-61.9	-43.9	176	-74	180	178.1	-173	0	111.9	K308 K309 D315 V316	K308-K312 WeakPolarHBondContact O-CG 3.45Å; K308-K312 PolarHBondContact O-N 3.06Å; K308-K312 VanDerWaalsContact O-N 3.1Å; K309-K312 WeakPolarHBondContact O-CB 3.26Å; K309-K312 PolarHBondContact O-N 2.88Å; K312-D315 PolarHBondContact O-N 3.01Å; K312-V316 WeakPolarHBondContact O-CB 3.37Å; K312-V316 VanDerWaalsContact O-CG2 3.26Å; K312-V316 WeakPolarHBondContact O-CG2 3.43Å; K312-V316 PolarHBondContact O-N 3.47Å
313	E	75.6	Confident	70.1	Confident	103 Å²	103	109.9 Å²	109.9	48%	0.481	55%	0.551	S	S	.	*	H	α-helix	trans	-63.5	-42	177.7	-72.4	172.6	177.1	0	0	111.6	K309 E310 V316 A317	K309-E313 WeakPolarHBondContact CE-OE1 3.28Å; K309-E313 IonicContact NZ-OE1 3.57Å; K309-E313 WeakPolarHBondContact O-CG 3.33Å; K309-E313 PolarHBondContact O-N 2.9Å; E310-E313 PolarHBondContact O-N 2.87Å; E313-V316 PolarHBondContact O-N 3.28Å; E313-A317 WeakPolarHBondContact O-CB 3.48Å; E313-A317 PolarHBondContact O-N 2.76Å
314	A	70.3	Confident	70.2	Confident	49 Å²	49	112.3 Å²	112.3	41%	0.405	56%	0.564	S	S	.	*	H	α-helix	trans	-66.2	-37.8	175.1	0	0	0	0	0	112.7	E310 K311 K318	E310-A314 VanDerWaalsContact O-CB 3.28Å; E310-A314 WeakPolarHBondContact O-CB 3.4Å; E310-A314 PolarHBondContact O-N 3.13Å; K311-A314 PolarHBondContact O-N 3.17Å; A314-K318 WeakPolarHBondContact O-CB 3.29Å; A314-K318 WeakPolarHBondContact O-CG 3.41Å; A314-K318 PolarHBondContact O-N 3.45Å; A314-K318 VanDerWaalsContact O-N 3.07Å
315	D	76.3	Confident	70.2	Confident	84 Å²	84	114.5 Å²	114.5	45%	0.449	57%	0.571	S	S	.	*	H	α-helix	trans	-67.8	-38.5	176.2	-68.1	-22.7	0	0	0	110.9	K311 K312 A319	K311-D315 WeakPolarHBondContact O-CB 3.5Å; K311-D315 PolarHBondContact O-N 2.92Å; K312-D315 PolarHBondContact O-N 3.01Å; D315-A319 WeakPolarHBondContact O-CB 3.39Å; D315-A319 PolarHBondContact O-N 3.4Å
316	V	74.5	Confident	70.3	Confident	83 Å²	83	111.6 Å²	111.6	50%	0.503	57%	0.567	S	S	.	*	H	α-helix	trans	-68.4	-44.8	173.9	171.4	0	0	0	0	111.6	K312 E313 K318 A319 M320	K312-V316 WeakPolarHBondContact O-CB 3.37Å; K312-V316 VanDerWaalsContact O-CG2 3.26Å; K312-V316 WeakPolarHBondContact O-CG2 3.43Å; K312-V316 PolarHBondContact O-N 3.47Å; E313-V316 PolarHBondContact O-N 3.28Å; V316-K318 VanDerWaalsContact C-N 3.28Å; V316-K318 PolarHBondContact O-N 3.14Å; V316-A319 PolarHBondContact O-N 3.42Å; V316-A319 VanDerWaalsContact O-N 3.07Å; V316-M320 HydrophobicContact CG1-CG 4.36Å; V316-M320 HydrophobicContact CG1-SD 3.84Å; V316-M320 WeakPolarHBondContact O-CG 3.49Å; V316-M320 PolarHBondContact O-N 2.95Å
317	A	67.2	Low	70.2	Confident	29 Å²	29	114.9 Å²	114.9	24%	0.24	58%	0.583	C	S	.	*	H	α-helix	trans	-60.7	-37.7	177.9	0	0	0	0	0	112.2	E313 M320 N321 L322	E313-A317 WeakPolarHBondContact O-CB 3.48Å; E313-A317 PolarHBondContact O-N 2.76Å; A317-M320 PolarHBondContact O-N 3.07Å; A317-N321 PolarHBondContact O-N 3.07Å; A317-L322 PolarHBondContact O-N 3.38Å
318	K	70.9	Confident	70.1	Confident	142 Å²	142	114 Å²	114	62%	0.617	58%	0.584	S	S	*	*	H	α-helix	trans	-66.9	-40.1	171.5	-79	179.3	176.8	-178.9	0	112.9	A314 V316 M320 N321	A314-K318 WeakPolarHBondContact O-CB 3.29Å; A314-K318 WeakPolarHBondContact O-CG 3.41Å; A314-K318 PolarHBondContact O-N 3.45Å; A314-K318 VanDerWaalsContact O-N 3.07Å; V316-K318 VanDerWaalsContact C-N 3.28Å; V316-K318 PolarHBondContact O-N 3.14Å; K318-M320 PolarHBondContact O-N 3.05Å; K318-N321 PolarHBondContact O-N 3.29Å
319	A	70.9	Confident	69.7	Low	86 Å²	86	112.4 Å²	112.4	71%	0.711	58%	0.583	S	S	*	*	H	α-helix	trans	-67.7	-25	176.9	0	0	0	0	0	112.8	D315 V316	D315-A319 WeakPolarHBondContact O-CB 3.39Å; D315-A319 PolarHBondContact O-N 3.4Å; V316-A319 PolarHBondContact O-N 3.42Å; V316-A319 VanDerWaalsContact O-N 3.07Å
320	M	70.6	Confident	69.3	Low	128 Å²	128	111.8 Å²	111.8	63%	0.631	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	7.4	178.6	-66.2	-177.6	73.4	0	0	114.1	V316 A317 K318 L322	V316-M320 HydrophobicContact CG1-CG 4.36Å; V316-M320 HydrophobicContact CG1-SD 3.84Å; V316-M320 WeakPolarHBondContact O-CG 3.49Å; V316-M320 PolarHBondContact O-N 2.95Å; A317-M320 PolarHBondContact O-N 3.07Å; K318-M320 PolarHBondContact O-N 3.05Å; M320-L322 HydrophobicContact CB-CD1 4.06Å; M320-L322 PolarHBondContact O-N 3.35Å; M320-L322 VanDerWaalsContact O-N 3.14Å
321	N	61.6	Low	68.8	Low	147 Å²	147	112.6 Å²	112.6	79%	0.786	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.1	30.1	-179.3	-95	9.5	0	0	0	114.4	A317 K318 I323	A317-N321 PolarHBondContact O-N 3.07Å; K318-N321 PolarHBondContact O-N 3.29Å; N321-I323 VanDerWaalsContact C-N 3.27Å
322	L	54.6	Low	68.1	Low	132 Å²	132	110.3 Å²	110.3	69%	0.691	60%	0.595	S	S	*	*			trans	-84.1	-4.1	175.3	-85.4	153.9	0	0	0	112.7	A317 M320	A317-L322 PolarHBondContact O-N 3.38Å; M320-L322 HydrophobicContact CB-CD1 4.06Å; M320-L322 PolarHBondContact O-N 3.35Å; M320-L322 VanDerWaalsContact O-N 3.14Å
323	I	47.3	Very low	67.2	Low	189 Å²	189	106.5 Å²	106.5	97%	0.969	59%	0.589	S	S	*	*			trans	-145	0	169.8	-45.6	176.2	0	0	0	108.3	N321	N321-I323 VanDerWaalsContact C-N 3.27Å

Retrieved 323 of 323 residues in 81.2 ms (Link to these results)

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