G4VN21_SCHMA Loading...

N-acetyltransferase domain-containing protein

AlphaFold DB , UniProt , Accession G4VN21, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 230 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	94.3	Very high	95.1	Very high	144 Å²	144	96.3 Å²	96.3	71%	0.709	47%	0.465	S	S	*	.				0	-79	0	-161.3	-157.7	84.4	0	0	111.9	K3 I4 E5 L12	M1-K3 VanDerWaalsContact C-N 3.32Å; M1-K3 PolarHBondContact O-N 3.45Å; M1-K3 VanDerWaalsContact O-N 3.15Å; M1-I4 WeakPolarHBondContact O-CA 3.19Å; M1-I4 WeakPolarHBondContact O-CB 3.28Å; M1-I4 PolarHBondContact O-N 3.42Å; M1-E5 PolarHBondContact O-N 2.85Å; M1-L12 HydrophobicContact CE-CD1 4.18Å
2	L	95.9	Very high	95.1	Very high	37 Å²	37	92.3 Å²	92.3	19%	0.194	45%	0.447	C	S	.	.	H	α-helix	trans	-52.7	-42.4	-174.2	-65.5	170.2	0	0	0	114.9	I4 N6 I7 P9 L12 Y29	L2-I4 VanDerWaalsContact C-N 3.31Å; L2-I4 PolarHBondContact O-N 2.91Å; L2-N6 PolarHBondContact O-N 2.91Å; L2-I7 PolarHBondContact O-N 3.08Å; L2-P9 HydrophobicContact CD1-CG 3.73Å; L2-P9 HydrophobicContact CD2-CG 4.29Å; L2-L12 HydrophobicContact CD2-CD1 3.75Å; L2-Y29 HydrophobicContact CD1-CD1 4.49Å; L2-Y29 HydrophobicContact CD1-CE1 3.54Å; L2-Y29 HydrophobicContact CD1-CE2 4.48Å; L2-Y29 WeakPolarHBondContact CD1-OH 3.39Å
3	K	94.9	Very high	95.3	Very high	206 Å²	206	88.4 Å²	88.4	90%	0.896	44%	0.44	S	S	*	.	H	α-helix	trans	-65.2	-32.4	176.2	-69.3	-177	177.6	-177.4	0	113.3	M1	M1-K3 VanDerWaalsContact C-N 3.32Å; M1-K3 PolarHBondContact O-N 3.45Å; M1-K3 VanDerWaalsContact O-N 3.15Å
4	I	96.3	Very high	95.4	Very high	140 Å²	140	84.4 Å²	84.4	72%	0.718	42%	0.42	S	S	*	.	H	α-helix	trans	-75.6	-45.2	-178.9	-60.8	171.2	0	0	0	109.2	M1 L2 N6	M1-I4 WeakPolarHBondContact O-CA 3.19Å; M1-I4 WeakPolarHBondContact O-CB 3.28Å; M1-I4 PolarHBondContact O-N 3.42Å; L2-I4 VanDerWaalsContact C-N 3.31Å; L2-I4 PolarHBondContact O-N 2.91Å; I4-N6 VanDerWaalsContact C-N 3.28Å; I4-N6 PolarHBondContact O-N 2.96Å
5	E	94.4	Very high	95.6	Very high	119 Å²	119	85 Å²	85	56%	0.556	43%	0.425	S	S	*	.	H	α-helix	trans	-76.8	-13.2	179.5	-62.5	-57.7	144.2	0	0	113.6	M1 I7	M1-E5 PolarHBondContact O-N 2.85Å; E5-I7 VanDerWaalsContact C-N 3.26Å; E5-I7 HydrophobicContact CB-CB 4.42Å; E5-I7 HydrophobicContact CB-CD1 4.01Å; E5-I7 HydrophobicContact CB-CG1 4.21Å; E5-I7 WeakPolarHBondContact O-CG1 3.48Å; E5-I7 PolarHBondContact O-N 3.18Å
6	N	94.4	Very high	95.7	Very high	152 Å²	152	86.9 Å²	86.9	81%	0.813	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	42.7	-173.6	-166.7	33.8	0	0	0	113.1	L2 I4	L2-N6 PolarHBondContact O-N 2.91Å; I4-N6 VanDerWaalsContact C-N 3.28Å; I4-N6 PolarHBondContact O-N 2.96Å
7	I	93.4	Very high	95.8	Very high	47 Å²	47	83.4 Å²	83.4	24%	0.241	42%	0.421	C	S	.	.			trans	-117.4	131.8	-178.6	-68.7	168.2	0	0	0	110	L2 E5 L12	L2-I7 PolarHBondContact O-N 3.08Å; E5-I7 VanDerWaalsContact C-N 3.26Å; E5-I7 HydrophobicContact CB-CB 4.42Å; E5-I7 HydrophobicContact CB-CD1 4.01Å; E5-I7 HydrophobicContact CB-CG1 4.21Å; E5-I7 WeakPolarHBondContact O-CG1 3.48Å; E5-I7 PolarHBondContact O-N 3.18Å; I7-L12 HydrophobicContact CG2-CD2 3.76Å; I7-L12 HydrophobicContact CG2-CG 4.24Å
8	H	94.7	Very high	95.9	Very high	104 Å²	104	82.6 Å²	82.6	48%	0.481	42%	0.424	S	S	.	.			trans	-71	136.1	171.2	-168.8	-94.8	0	0	0	110.4	S10 Y11	H8-S10 PolarHBondContact CE1-OG 3.24Å; H8-S10 PolarHBondContact ND1-N 2.79Å; H8-S10 PolarHBondContact ND1-OG 2.91Å; H8-S10 PolarHBondContact O-N 2.75Å; H8-S10 VanDerWaalsContact O-N 3.1Å; H8-Y11 HydrophobicContact CB-CD2 3.63Å; H8-Y11 HydrophobicContact CB-CE2 3.6Å; H8-Y11 HydrophobicContact CB-CG 4.24Å; H8-Y11 WeakPolarHBondContact O-CB 3.26Å; H8-Y11 PolarHBondContact O-N 3.41Å
9	P	96.4	Very high	96	Very high	14 Å²	14	87.1 Å²	87.1	9%	0.091	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-52.7	-34.4	-176.8	-25.6	28.7	0	0	0	115.4	L2 Y11 L12 Y29 L31	L2-P9 HydrophobicContact CD1-CG 3.73Å; L2-P9 HydrophobicContact CD2-CG 4.29Å; P9-Y11 PolarHBondContact O-N 3.33Å; P9-L12 WeakPolarHBondContact O-CB 3.39Å; P9-L12 PolarHBondContact O-N 3.48Å; P9-L12 VanDerWaalsContact O-N 3.17Å; P9-Y29 HydrophobicContact CB-CD1 4.02Å; P9-Y29 HydrophobicContact CB-CD2 4.25Å; P9-Y29 HydrophobicContact CB-CG 3.83Å; P9-Y29 HydrophobicContact CG-CD1 3.35Å; P9-Y29 HydrophobicContact CG-CD2 4.38Å; P9-Y29 HydrophobicContact CG-CE1 3.74Å; P9-Y29 HydrophobicContact CG-CG 3.7Å; P9-L31 HydrophobicContact CB-CD1 4.02Å
10	S	95.9	Very high	96.1	Very high	13 Å²	13	91.3 Å²	91.3	9%	0.091	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-65.6	-17.1	179	63	0	0	0	0	113.4	H8 L12 G46 F47	H8-S10 PolarHBondContact CE1-OG 3.24Å; H8-S10 PolarHBondContact ND1-N 2.79Å; H8-S10 PolarHBondContact ND1-OG 2.91Å; H8-S10 PolarHBondContact O-N 2.75Å; H8-S10 VanDerWaalsContact O-N 3.1Å; S10-L12 VanDerWaalsContact C-N 3.33Å; S10-G46 CarbonylContact O-C 3.58Å; S10-F47 WeakPolarHBondContact O-CA 3.23Å; S10-F47 PolarHBondContact O-N 3.12Å
11	Y	95.4	Very high	96.2	Very high	83 Å²	83	90.8 Å²	90.8	33%	0.325	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-89.6	0.9	178.8	-52.7	-25.4	0	0	0	113.1	H8 P9 G46 F47 D49 K50	H8-Y11 HydrophobicContact CB-CD2 3.63Å; H8-Y11 HydrophobicContact CB-CE2 3.6Å; H8-Y11 HydrophobicContact CB-CG 4.24Å; H8-Y11 WeakPolarHBondContact O-CB 3.26Å; H8-Y11 PolarHBondContact O-N 3.41Å; P9-Y11 PolarHBondContact O-N 3.33Å; Y11-G46 WeakPolarHBondContact CD1-O 3.34Å; Y11-G46 WeakPolarHBondContact CE1-O 3.03Å; Y11-F47 WeakPolarHBondContact O-CD2 3.44Å; Y11-D49 HydrophobicContact CE1-CB 4.14Å; Y11-K50 HydrophobicContact CD1-CB 4.43Å; Y11-K50 HydrophobicContact CD2-CD 4.48Å; Y11-K50 HydrophobicContact CG-CB 4.34Å
12	L	95.8	Very high	96.3	Very high	48 Å²	48	85 Å²	85	25%	0.251	43%	0.425	S	S	.	.			trans	-87.5	138.5	178.7	-62.4	177.4	0	0	0	111.2	M1 L2 I7 P9 S10 I14	M1-L12 HydrophobicContact CE-CD1 4.18Å; L2-L12 HydrophobicContact CD2-CD1 3.75Å; I7-L12 HydrophobicContact CG2-CD2 3.76Å; I7-L12 HydrophobicContact CG2-CG 4.24Å; P9-L12 WeakPolarHBondContact O-CB 3.39Å; P9-L12 PolarHBondContact O-N 3.48Å; P9-L12 VanDerWaalsContact O-N 3.17Å; S10-L12 VanDerWaalsContact C-N 3.33Å; L12-I14 HydrophobicContact CB-CG1 4.37Å
13	A	97	Very high	96.4	Very high	42 Å²	42	88.2 Å²	88.2	35%	0.347	44%	0.439	S	S	.	.			trans	-96	130.6	159.3	0	0	0	0	0	108.5	F41 I43 F47	A13-F41 HydrophobicContact CB-CB 4.41Å; A13-F41 HydrophobicContact CB-CD1 3.77Å; A13-F41 HydrophobicContact CB-CE1 4.49Å; A13-F41 HydrophobicContact CB-CG 4.39Å; A13-I43 HydrophobicContact CB-CG2 3.67Å; A13-F47 HydrophobicContact CB-CD2 4.45Å; A13-F47 HydrophobicContact CB-CE2 3.83Å; A13-F47 HydrophobicContact CB-CZ 4.34Å
14	I	97.6	Very high	96.6	Very high	32 Å²	32	82.8 Å²	82.8	16%	0.164	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.1	-172.8	-52.5	177.2	0	0	0	108.4	L12 P17 L25 F41 V42 Y44	L12-I14 HydrophobicContact CB-CG1 4.37Å; I14-P17 HydrophobicContact CG2-CB 3.87Å; I14-P17 HydrophobicContact CG2-CG 4.29Å; I14-P17 WeakPolarHBondContact O-CD 3.49Å; I14-L25 HydrophobicContact CD1-CD1 3.21Å; I14-L25 HydrophobicContact CD1-CD2 4.1Å; I14-L25 HydrophobicContact CD1-CG 4.29Å; I14-F41 CarbonylContact O-C 3.54Å; I14-F41 WeakPolarHBondContact O-CA 3.38Å; I14-V42 PolarHBondContact N-O 3.03Å; I14-V42 PolarHBondContact O-N 2.96Å; I14-Y44 HydrophobicContact CD1-CE2 4.43Å
15	D	98	Very high	96.7	Very high	94 Å²	94	76.7 Å²	76.7	50%	0.503	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	125.1	179.9	-168.5	12.1	0	0	0	110.7	F41	D15-F41 HydrophobicContact CB-CD1 4.11Å; D15-F41 HydrophobicContact CB-CE1 3.7Å; D15-F41 HydrophobicContact CB-CZ 4.05Å
16	L	96.8	Very high	96.8	Very high	116 Å²	116	75.7 Å²	75.7	61%	0.607	38%	0.38	S	S	*	.	S	Bend	trans	42.9	54.3	175.1	-67.7	170	0	0	0	115.1	S18 N40	L16-S18 PolarHBondContact O-N 2.97Å; L16-N40 HydrophobicContact CD2-CB 3.62Å; L16-N40 HydrophobicContact CG-CB 3.81Å; L16-N40 PolarHBondContact N-O 3.19Å; L16-N40 VanDerWaalsContact N-O 3.09Å
17	P	97.1	Very high	97	Very high	26 Å²	26	75.9 Å²	75.9	17%	0.169	37%	0.373	C	S	.	.			trans	-65.1	132	-179.2	27.4	-34.8	0	0	0	111.6	I14 M21 I22 V42	I14-P17 HydrophobicContact CG2-CB 3.87Å; I14-P17 HydrophobicContact CG2-CG 4.29Å; I14-P17 WeakPolarHBondContact O-CD 3.49Å; P17-M21 HydrophobicContact CB-CB 4.16Å; P17-M21 HydrophobicContact CB-CG 4.03Å; P17-I22 HydrophobicContact CB-CD1 3.76Å; P17-I22 HydrophobicContact CB-CG1 4.09Å; P17-I22 HydrophobicContact CG-CD1 3.58Å; P17-I22 HydrophobicContact CG-CG1 4.18Å; P17-V42 HydrophobicContact CG-CB 3.74Å; P17-V42 HydrophobicContact CG-CG1 4.41Å; P17-V42 HydrophobicContact CG-CG2 3.45Å; P17-V42 VanDerWaalsContact CG-CG2 3.45Å
18	S	97.8	Very high	97.3	Very high	69 Å²	69	78.5 Å²	78.5	48%	0.483	38%	0.384	S	S	.	.			trans	-64.7	159.4	169.8	73.2	0	0	0	0	111.4	L16 K20 M21 I22	L16-S18 PolarHBondContact O-N 2.97Å; S18-K20 PolarHBondContact O-N 3.18Å; S18-M21 WeakPolarHBondContact O-CA 3.36Å; S18-M21 WeakPolarHBondContact O-CB 3.22Å; S18-M21 PolarHBondContact O-N 2.94Å; S18-M21 PolarHBondContact OG-N 3.5Å; S18-I22 PolarHBondContact O-N 2.97Å
19	K	97.4	Very high	97.4	Very high	168 Å²	168	77.5 Å²	77.5	73%	0.73	38%	0.377	S	S	*	.	H	α-helix	trans	-54.8	-37.9	174.1	-173.9	176	-180	178.2	0	112.4	I22 Q23	K19-I22 PolarHBondContact O-N 3.17Å; K19-Q23 WeakPolarHBondContact O-CG 3.45Å; K19-Q23 PolarHBondContact O-N 2.88Å
20	K	98.3	Very high	97.4	Very high	171 Å²	171	83.9 Å²	83.9	74%	0.743	41%	0.405	S	S	*	.	H	α-helix	trans	-64.4	-39.7	175.4	-70	-175.8	178.9	179.3	0	111.7	S18 Q23 F24	S18-K20 PolarHBondContact O-N 3.18Å; K20-Q23 PolarHBondContact O-N 2.84Å; K20-F24 WeakPolarHBondContact O-CB 3.36Å; K20-F24 PolarHBondContact O-N 3.09Å
21	M	97.8	Very high	97.5	Very high	82 Å²	82	83.9 Å²	83.9	40%	0.404	40%	0.404	S	S	.	.	H	α-helix	trans	-64	-46	175.4	-177.9	63.4	85	0	0	111.2	P17 S18 Q23 F24 L25	P17-M21 HydrophobicContact CB-CB 4.16Å; P17-M21 HydrophobicContact CB-CG 4.03Å; S18-M21 WeakPolarHBondContact O-CA 3.36Å; S18-M21 WeakPolarHBondContact O-CB 3.22Å; S18-M21 PolarHBondContact O-N 2.94Å; S18-M21 PolarHBondContact OG-N 3.5Å; M21-Q23 VanDerWaalsContact C-N 3.33Å; M21-Q23 PolarHBondContact O-N 3.38Å; M21-F24 WeakPolarHBondContact O-CB 3.31Å; M21-F24 PolarHBondContact O-N 2.95Å; M21-F24 VanDerWaalsContact O-N 3.15Å; M21-F24 HydrophobicContact SD-CD1 4.19Å; M21-L25 HydrophobicContact CG-CD1 4.1Å; M21-L25 HydrophobicContact CG-CG 4.44Å; M21-L25 VanDerWaalsContact O-CG 3.27Å; M21-L25 WeakPolarHBondContact O-CG 2.99Å; M21-L25 PolarHBondContact O-N 3.43Å; M21-L25 HydrophobicContact SD-CG 4.39Å
22	I	97.8	Very high	97.5	Very high	22 Å²	22	86.2 Å²	86.2	11%	0.113	42%	0.416	C	S	.	.	H	α-helix	trans	-58.3	-45	176.4	-63.4	-62.7	0	0	0	111.3	P17 S18 K19 F24 L25 Q26 P34 V42	P17-I22 HydrophobicContact CB-CD1 3.76Å; P17-I22 HydrophobicContact CB-CG1 4.09Å; P17-I22 HydrophobicContact CG-CD1 3.58Å; P17-I22 HydrophobicContact CG-CG1 4.18Å; S18-I22 PolarHBondContact O-N 2.97Å; K19-I22 PolarHBondContact O-N 3.17Å; I22-F24 PolarHBondContact O-N 3.46Å; I22-L25 PolarHBondContact O-N 3.48Å; I22-Q26 WeakPolarHBondContact O-CB 3.5Å; I22-Q26 PolarHBondContact O-N 2.85Å; I22-P34 HydrophobicContact CD1-CB 4.48Å; I22-P34 HydrophobicContact CG2-CG 4.45Å; I22-V42 HydrophobicContact CD1-CG1 4.17Å
23	Q	98.2	Very high	97.6	Very high	105 Å²	105	90.5 Å²	90.5	49%	0.491	44%	0.439	S	S	.	.	H	α-helix	trans	-64	-39.1	176.1	-72.5	176.5	-22.2	0	0	112.6	K19 K20 M21 Q26 K27	K19-Q23 WeakPolarHBondContact O-CG 3.45Å; K19-Q23 PolarHBondContact O-N 2.88Å; K20-Q23 PolarHBondContact O-N 2.84Å; M21-Q23 VanDerWaalsContact C-N 3.33Å; M21-Q23 PolarHBondContact O-N 3.38Å; Q23-Q26 PolarHBondContact O-N 2.98Å; Q23-K27 WeakPolarHBondContact O-CB 3.38Å; Q23-K27 PolarHBondContact O-N 3.48Å
24	F	98.4	Very high	97.6	Very high	92 Å²	92	90.1 Å²	90.1	40%	0.404	43%	0.433	S	S	.	.	H	α-helix	trans	-60.4	-46.8	174.6	173.8	-94.4	0	0	0	111.3	K20 M21 I22 Q26 K27 H28 Y29	K20-F24 WeakPolarHBondContact O-CB 3.36Å; K20-F24 PolarHBondContact O-N 3.09Å; M21-F24 WeakPolarHBondContact O-CB 3.31Å; M21-F24 PolarHBondContact O-N 2.95Å; M21-F24 VanDerWaalsContact O-N 3.15Å; M21-F24 HydrophobicContact SD-CD1 4.19Å; I22-F24 PolarHBondContact O-N 3.46Å; F24-Q26 VanDerWaalsContact C-N 3.35Å; F24-Q26 PolarHBondContact O-N 3.47Å; F24-K27 PolarHBondContact O-N 3.09Å; F24-H28 AromaticContact CD2-CD2 3.35Å; F24-H28 WeakPolarHBondContact CD2-CD2 3.25Å; F24-H28 AromaticContact CD2-NE2 3.87Å; F24-H28 AromaticContact CE2-CD2 3.38Å; F24-H28 WeakPolarHBondContact CE2-CD2 3.28Å; F24-H28 AromaticContact CE2-NE2 3.8Å; F24-H28 WeakPolarHBondContact O-CB 3.43Å; F24-H28 PolarHBondContact O-CD2 2.87Å; F24-H28 PolarHBondContact O-N 3.17Å; F24-Y29 AromaticContact CE1-CE2 3.83Å; F24-Y29 HydrophobicContact CE1-CE2 3.83Å
25	L	98.1	Very high	97.6	Very high	12 Å²	12	92 Å²	92	6%	0.063	44%	0.442	C	S	.	.	H	α-helix	trans	-63.6	-40.2	178.1	-66.3	167.4	0	0	0	112.3	I14 M21 I22 Y29 H30 L31 Y44	I14-L25 HydrophobicContact CD1-CD1 3.21Å; I14-L25 HydrophobicContact CD1-CD2 4.1Å; I14-L25 HydrophobicContact CD1-CG 4.29Å; M21-L25 HydrophobicContact CG-CD1 4.1Å; M21-L25 HydrophobicContact CG-CG 4.44Å; M21-L25 VanDerWaalsContact O-CG 3.27Å; M21-L25 WeakPolarHBondContact O-CG 2.99Å; M21-L25 PolarHBondContact O-N 3.43Å; M21-L25 HydrophobicContact SD-CG 4.39Å; I22-L25 PolarHBondContact O-N 3.48Å; L25-Y29 HydrophobicContact CD2-CD2 3.77Å; L25-Y29 HydrophobicContact CD2-CE2 4.09Å; L25-Y29 CarbonylContact O-C 3.59Å; L25-Y29 WeakPolarHBondContact O-CA 3.39Å; L25-Y29 WeakPolarHBondContact O-CB 3.34Å; L25-Y29 PolarHBondContact O-N 3.4Å; L25-H30 PolarHBondContact O-N 2.96Å; L25-L31 HydrophobicContact CB-CB 4.41Å; L25-L31 HydrophobicContact CB-CD1 4.26Å; L25-L31 HydrophobicContact CD2-CD1 4.32Å; L25-L31 PolarHBondContact O-N 3.17Å; L25-Y44 HydrophobicContact CD1-CE2 4.04Å
26	Q	97.8	Very high	97.5	Very high	98 Å²	98	90.8 Å²	90.8	46%	0.458	43%	0.431	S	S	.	.	H	α-helix	trans	-63.3	-43.6	175	-176.6	-178.6	-7.4	0	0	111.8	I22 Q23 F24 H30 L31 K32	I22-Q26 WeakPolarHBondContact O-CB 3.5Å; I22-Q26 PolarHBondContact O-N 2.85Å; Q23-Q26 PolarHBondContact O-N 2.98Å; F24-Q26 VanDerWaalsContact C-N 3.35Å; F24-Q26 PolarHBondContact O-N 3.47Å; Q26-H30 VanDerWaalsContact O-CA 3.28Å; Q26-H30 WeakPolarHBondContact O-CA 3.13Å; Q26-H30 PolarHBondContact O-N 3.41Å; Q26-L31 WeakPolarHBondContact CA-O 3.43Å; Q26-K32 HydrophobicContact CG-CG 4.41Å
27	K	98.2	Very high	97.3	Very high	156 Å²	156	86.6 Å²	86.6	68%	0.678	41%	0.411	S	S	*	.	H	α-helix	trans	-72.5	-44.8	-177.2	-177.3	179.2	178.4	-177.6	0	112.9	Q23 F24	Q23-K27 WeakPolarHBondContact O-CB 3.38Å; Q23-K27 PolarHBondContact O-N 3.48Å; F24-K27 PolarHBondContact O-N 3.09Å
28	H	98.1	Very high	97.1	Very high	101 Å²	101	90.7 Å²	90.7	47%	0.468	44%	0.438	S	S	.	.	H	α-helix	trans	-95.6	-25.3	-169.7	-70.7	-79.2	0	0	0	113.9	F24	F24-H28 AromaticContact CD2-CD2 3.35Å; F24-H28 WeakPolarHBondContact CD2-CD2 3.25Å; F24-H28 AromaticContact CD2-NE2 3.87Å; F24-H28 AromaticContact CE2-CD2 3.38Å; F24-H28 WeakPolarHBondContact CE2-CD2 3.28Å; F24-H28 AromaticContact CE2-NE2 3.8Å; F24-H28 WeakPolarHBondContact O-CB 3.43Å; F24-H28 PolarHBondContact O-CD2 2.87Å; F24-H28 PolarHBondContact O-N 3.17Å
29	Y	97.6	Very high	97	Very high	84 Å²	84	92.1 Å²	92.1	33%	0.329	44%	0.441	S	S	.	.	H	α-helix	trans	-122	6.1	-177.7	-55.7	-64.6	0	0	0	113.2	L2 P9 F24 L25 L31	L2-Y29 HydrophobicContact CD1-CD1 4.49Å; L2-Y29 HydrophobicContact CD1-CE1 3.54Å; L2-Y29 HydrophobicContact CD1-CE2 4.48Å; L2-Y29 WeakPolarHBondContact CD1-OH 3.39Å; P9-Y29 HydrophobicContact CB-CD1 4.02Å; P9-Y29 HydrophobicContact CB-CD2 4.25Å; P9-Y29 HydrophobicContact CB-CG 3.83Å; P9-Y29 HydrophobicContact CG-CD1 3.35Å; P9-Y29 HydrophobicContact CG-CD2 4.38Å; P9-Y29 HydrophobicContact CG-CE1 3.74Å; P9-Y29 HydrophobicContact CG-CG 3.7Å; F24-Y29 AromaticContact CE1-CE2 3.83Å; F24-Y29 HydrophobicContact CE1-CE2 3.83Å; L25-Y29 HydrophobicContact CD2-CD2 3.77Å; L25-Y29 HydrophobicContact CD2-CE2 4.09Å; L25-Y29 CarbonylContact O-C 3.59Å; L25-Y29 WeakPolarHBondContact O-CA 3.39Å; L25-Y29 WeakPolarHBondContact O-CB 3.34Å; L25-Y29 PolarHBondContact O-N 3.4Å; Y29-L31 PolarHBondContact O-N 3.45Å; Y29-L31 VanDerWaalsContact O-N 3.08Å
30	H	97.5	Very high	96.9	Very high	147 Å²	147	87.3 Å²	87.3	68%	0.681	42%	0.423	S	S	*	.			trans	56.1	24.2	-179.5	-51.5	95.7	0	0	0	113.8	L25 Q26 K32	L25-H30 PolarHBondContact O-N 2.96Å; Q26-H30 VanDerWaalsContact O-CA 3.28Å; Q26-H30 WeakPolarHBondContact O-CA 3.13Å; Q26-H30 PolarHBondContact O-N 3.41Å; H30-K32 PolarHBondContact O-N 3.29Å
31	L	97	Very high	96.8	Very high	14 Å²	14	82.6 Å²	82.6	7%	0.073	40%	0.402	C	S	.	.			trans	-77.3	109.2	179.5	-60	-176.5	0	0	0	109.8	P9 L25 Q26 Y29 Y44	P9-L31 HydrophobicContact CB-CD1 4.02Å; L25-L31 HydrophobicContact CB-CB 4.41Å; L25-L31 HydrophobicContact CB-CD1 4.26Å; L25-L31 HydrophobicContact CD2-CD1 4.32Å; L25-L31 PolarHBondContact O-N 3.17Å; Q26-L31 WeakPolarHBondContact CA-O 3.43Å; Y29-L31 PolarHBondContact O-N 3.45Å; Y29-L31 VanDerWaalsContact O-N 3.08Å; L31-Y44 HydrophobicContact CB-CD1 3.62Å; L31-Y44 HydrophobicContact CB-CD2 4.11Å; L31-Y44 HydrophobicContact CB-CE1 3.49Å; L31-Y44 VanDerWaalsContact CB-CE1 3.49Å; L31-Y44 HydrophobicContact CB-CE2 4.02Å; L31-Y44 HydrophobicContact CB-CG 3.9Å; L31-Y44 HydrophobicContact CD1-CD2 3.66Å; L31-Y44 HydrophobicContact CD1-CE2 3.73Å; L31-Y44 HydrophobicContact CD1-CG 4.13Å; L31-Y44 HydrophobicContact CD2-CG 4.34Å; L31-Y44 HydrophobicContact CG-CD2 4.34Å; L31-Y44 HydrophobicContact CG-CE2 4.48Å; L31-Y44 HydrophobicContact CG-CG 4.34Å
32	K	96.3	Very high	96.8	Very high	132 Å²	132	78.9 Å²	78.9	57%	0.574	38%	0.384	S	S	*	.			trans	-113	159.3	179.3	-62.9	179.3	-176.7	178.5	0	110	Q26 H30 Y44	Q26-K32 HydrophobicContact CG-CG 4.41Å; H30-K32 PolarHBondContact O-N 3.29Å; K32-Y44 WeakPolarHBondContact O-CD1 3.16Å
33	N	96.5	Very high	96.8	Very high	138 Å²	138	78.3 Å²	78.3	74%	0.738	38%	0.381	S	S	*	.	S	Bend	trans	57	64.9	176.1	-51.9	-17.3	0	0	0	112.8	I35	N33-I35 PolarHBondContact O-N 3.44Å
34	P	97.1	Very high	96.7	Very high	33 Å²	33	73.5 Å²	73.5	21%	0.214	36%	0.359	C	S	.	.			trans	-58.5	137	175	25.3	-32.9	0	0	0	110.9	I22 Y36 V42 Y44	I22-P34 HydrophobicContact CD1-CB 4.48Å; I22-P34 HydrophobicContact CG2-CG 4.45Å; P34-Y36 HydrophobicContact CB-CE2 4.13Å; P34-Y36 HydrophobicContact CG-CE2 3.83Å; P34-V42 HydrophobicContact CB-CG1 3.39Å; P34-Y44 HydrophobicContact CB-CE1 3.89Å
35	I	97.1	Very high	96.5	Very high	71 Å²	71	73.3 Å²	73.3	36%	0.364	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	114.9	176.3	-57.7	168.6	0	0	0	107.7	N33 V42 I43 F48	N33-I35 PolarHBondContact O-N 3.44Å; I35-V42 WeakPolarHBondContact O-CA 3.02Å; I35-I43 HydrophobicContact CB-CD1 4.5Å; I35-I43 HydrophobicContact CB-CG1 3.79Å; I35-I43 HydrophobicContact CD1-CG1 4.48Å; I35-I43 HydrophobicContact CG2-CD1 4.44Å; I35-I43 HydrophobicContact CG2-CG1 4.19Å; I35-I43 PolarHBondContact N-O 3Å; I35-I43 PolarHBondContact O-N 3.26Å; I35-I43 VanDerWaalsContact O-N 3.1Å; I35-F48 HydrophobicContact CD1-CE2 3.9Å
36	Y	96.5	Very high	96.3	Very high	70 Å²	70	72.9 Å²	72.9	28%	0.275	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	123.1	-177.7	-66.1	-87	0	0	0	111	P34 V42 F199	P34-Y36 HydrophobicContact CB-CE2 4.13Å; P34-Y36 HydrophobicContact CG-CE2 3.83Å; Y36-V42 HydrophobicContact CD1-CG2 3.48Å; Y36-V42 VanDerWaalsContact CD1-CG2 3.48Å; Y36-V42 HydrophobicContact CE1-CG1 4.47Å; Y36-V42 HydrophobicContact CE1-CG2 3.56Å; Y36-V42 HydrophobicContact CG-CG2 4.41Å; Y36-F199 HydrophobicContact CE1-CE2 4.28Å; Y36-F199 HydrophobicContact CE1-CZ 4.45Å; Y36-F199 HydrophobicContact CE2-CE2 4.48Å
37	S	92.9	Very high	96.2	Very high	27 Å²	27	70.9 Å²	70.9	19%	0.189	36%	0.357	C	S	.	.			trans	-99.8	147.8	178.2	-61.4	0	0	0	0	111.4	N39 N40 F41 R202	S37-N39 WeakPolarHBondContact CB-OD1 3.35Å; S37-N39 PolarHBondContact O-N 2.99Å; S37-N39 VanDerWaalsContact O-N 3.13Å; S37-N40 PolarHBondContact O-N 3.05Å; S37-N40 VanDerWaalsContact O-N 3.12Å; S37-F41 WeakPolarHBondContact CB-O 3.35Å; S37-F41 PolarHBondContact N-O 3.19Å; S37-R202 PolarHBondContact O-NH2 3.42Å
38	P	93.7	Very high	95.9	Very high	113 Å²	113	67.2 Å²	67.2	73%	0.734	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.5	178	-25.4	34	0	0	0	114.2	N40	P38-N40 PolarHBondContact O-N 3.39Å
39	N	95.2	Very high	95.5	Very high	99 Å²	99	66.8 Å²	66.8	53%	0.529	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	15.7	178.1	69.7	-7.5	0	0	0	114.3	S37 F41	S37-N39 WeakPolarHBondContact CB-OD1 3.35Å; S37-N39 PolarHBondContact O-N 2.99Å; S37-N39 VanDerWaalsContact O-N 3.13Å; N39-F41 HydrophobicContact CB-CD2 4.48Å; N39-F41 WeakPolarHBondContact O-CD2 3.41Å; N39-F41 PolarHBondContact O-N 3.39Å; N39-F41 PolarHBondContact OD1-N 3.5Å
40	N	94.7	Very high	94.4	Very high	66 Å²	66	68 Å²	68	35%	0.353	35%	0.35	S	S	.	.	S	Bend	trans	71	-1.5	-179.7	-57.2	-40.1	0	0	0	117.3	L16 S37 P38 R202	L16-N40 HydrophobicContact CD2-CB 3.62Å; L16-N40 HydrophobicContact CG-CB 3.81Å; L16-N40 PolarHBondContact N-O 3.19Å; L16-N40 VanDerWaalsContact N-O 3.09Å; S37-N40 PolarHBondContact O-N 3.05Å; S37-N40 VanDerWaalsContact O-N 3.12Å; P38-N40 PolarHBondContact O-N 3.39Å; N40-R202 PolarHBondContact OD1-NH1 3.48Å
41	F	97.4	Very high	93.4	Very high	73 Å²	73	65 Å²	65	32%	0.32	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	144.8	171	-73	-89.8	0	0	0	111.5	A13 I14 D15 S37 N39	A13-F41 HydrophobicContact CB-CB 4.41Å; A13-F41 HydrophobicContact CB-CD1 3.77Å; A13-F41 HydrophobicContact CB-CE1 4.49Å; A13-F41 HydrophobicContact CB-CG 4.39Å; I14-F41 CarbonylContact O-C 3.54Å; I14-F41 WeakPolarHBondContact O-CA 3.38Å; D15-F41 HydrophobicContact CB-CD1 4.11Å; D15-F41 HydrophobicContact CB-CE1 3.7Å; D15-F41 HydrophobicContact CB-CZ 4.05Å; S37-F41 WeakPolarHBondContact CB-O 3.35Å; S37-F41 PolarHBondContact N-O 3.19Å; N39-F41 HydrophobicContact CB-CD2 4.48Å; N39-F41 WeakPolarHBondContact O-CD2 3.41Å; N39-F41 PolarHBondContact O-N 3.39Å; N39-F41 PolarHBondContact OD1-N 3.5Å
42	V	97.5	Very high	92.1	Very high	4 Å²	4	70.2 Å²	70.2	2%	0.024	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	128.5	168.8	-179.6	0	0	0	0	108.4	I14 P17 I22 P34 I35 Y36	I14-V42 PolarHBondContact N-O 3.03Å; I14-V42 PolarHBondContact O-N 2.96Å; P17-V42 HydrophobicContact CG-CB 3.74Å; P17-V42 HydrophobicContact CG-CG1 4.41Å; P17-V42 HydrophobicContact CG-CG2 3.45Å; P17-V42 VanDerWaalsContact CG-CG2 3.45Å; I22-V42 HydrophobicContact CD1-CG1 4.17Å; P34-V42 HydrophobicContact CB-CG1 3.39Å; I35-V42 WeakPolarHBondContact O-CA 3.02Å; Y36-V42 HydrophobicContact CD1-CG2 3.48Å; Y36-V42 VanDerWaalsContact CD1-CG2 3.48Å; Y36-V42 HydrophobicContact CE1-CG1 4.47Å; Y36-V42 HydrophobicContact CE1-CG2 3.56Å; Y36-V42 HydrophobicContact CG-CG2 4.41Å
43	I	97.1	Very high	90.4	Very high	10 Å²	10	68.4 Å²	68.4	5%	0.051	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	168.7	177.4	63	-179.1	0	0	0	109.8	A13 I35 F47 F48	A13-I43 HydrophobicContact CB-CG2 3.67Å; I35-I43 HydrophobicContact CB-CD1 4.5Å; I35-I43 HydrophobicContact CB-CG1 3.79Å; I35-I43 HydrophobicContact CD1-CG1 4.48Å; I35-I43 HydrophobicContact CG2-CD1 4.44Å; I35-I43 HydrophobicContact CG2-CG1 4.19Å; I35-I43 PolarHBondContact N-O 3Å; I35-I43 PolarHBondContact O-N 3.26Å; I35-I43 VanDerWaalsContact O-N 3.1Å; I43-F47 HydrophobicContact CB-CB 3.95Å; I43-F47 HydrophobicContact CB-CD1 4.25Å; I43-F47 HydrophobicContact CB-CD2 4.33Å; I43-F47 HydrophobicContact CB-CG 3.92Å; I43-F47 HydrophobicContact CD1-CB 4.5Å; I43-F47 HydrophobicContact CD1-CD1 3.82Å; I43-F47 HydrophobicContact CD1-CE1 4.4Å; I43-F47 HydrophobicContact CD1-CG 4.32Å; I43-F47 HydrophobicContact CG2-CB 4.41Å; I43-F47 HydrophobicContact CG2-CD1 4.02Å; I43-F47 HydrophobicContact CG2-CD2 3.9Å; I43-F47 HydrophobicContact CG2-CE1 4.24Å; I43-F47 HydrophobicContact CG2-CE2 4.15Å; I43-F47 HydrophobicContact CG2-CG 3.84Å; I43-F47 HydrophobicContact CG2-CZ 4.31Å; I43-F48 HydrophobicContact CD1-CE1 4.17Å; I43-F48 HydrophobicContact CD1-CE2 3.75Å; I43-F48 HydrophobicContact CD1-CZ 3.39Å
44	Y	96.9	Very high	88.6	Confident	3 Å²	3	67.7 Å²	67.7	1%	0.012	36%	0.355	C	S	.	.			trans	-120.9	165.5	172.7	-67.4	-86.4	0	0	0	109.9	I14 L25 L31 K32 P34 G46 F47	I14-Y44 HydrophobicContact CD1-CE2 4.43Å; L25-Y44 HydrophobicContact CD1-CE2 4.04Å; L31-Y44 HydrophobicContact CB-CD1 3.62Å; L31-Y44 HydrophobicContact CB-CD2 4.11Å; L31-Y44 HydrophobicContact CB-CE1 3.49Å; L31-Y44 VanDerWaalsContact CB-CE1 3.49Å; L31-Y44 HydrophobicContact CB-CE2 4.02Å; L31-Y44 HydrophobicContact CB-CG 3.9Å; L31-Y44 HydrophobicContact CD1-CD2 3.66Å; L31-Y44 HydrophobicContact CD1-CE2 3.73Å; L31-Y44 HydrophobicContact CD1-CG 4.13Å; L31-Y44 HydrophobicContact CD2-CG 4.34Å; L31-Y44 HydrophobicContact CG-CD2 4.34Å; L31-Y44 HydrophobicContact CG-CE2 4.48Å; L31-Y44 HydrophobicContact CG-CG 4.34Å; K32-Y44 WeakPolarHBondContact O-CD1 3.16Å; P34-Y44 HydrophobicContact CB-CE1 3.89Å; Y44-G46 PolarHBondContact O-N 3.31Å; Y44-G46 VanDerWaalsContact O-N 3.08Å; Y44-F47 WeakPolarHBondContact O-CB 3.4Å; Y44-F47 PolarHBondContact O-N 3.36Å
45	S	93.9	Very high	86.8	Confident	89 Å²	89	68.8 Å²	68.8	62%	0.622	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	-42.2	-175	52.1	0	0	0	0	113.7	F47 F48	S45-F47 PolarHBondContact O-N 3.41Å; S45-F47 VanDerWaalsContact O-N 3.12Å; S45-F48 PolarHBondContact O-N 3.47Å
46	G	93.8	Very high	84.9	Confident	3 Å²	3	71 Å²	71	3%	0.031	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.3	-179.6	0	0	0	0	0	114.9	S10 Y11 Y44 F48 D49	S10-G46 CarbonylContact O-C 3.58Å; Y11-G46 WeakPolarHBondContact CD1-O 3.34Å; Y11-G46 WeakPolarHBondContact CE1-O 3.03Å; Y44-G46 PolarHBondContact O-N 3.31Å; Y44-G46 VanDerWaalsContact O-N 3.08Å; G46-F48 PolarHBondContact O-N 3.15Å; G46-F48 VanDerWaalsContact O-N 3.15Å; G46-D49 WeakPolarHBondContact CA-OD2 3.44Å; G46-D49 WeakPolarHBondContact O-CB 3.43Å; G46-D49 PolarHBondContact O-N 2.97Å
47	F	94.9	Very high	82.8	Confident	55 Å²	55	69 Å²	69	24%	0.241	38%	0.376	C	S	.	.	H	α-helix	trans	-54.1	-36.7	178.4	-176.6	-97.5	0	0	0	111.9	S10 Y11 A13 I43 Y44 S45 I51	S10-F47 WeakPolarHBondContact O-CA 3.23Å; S10-F47 PolarHBondContact O-N 3.12Å; Y11-F47 WeakPolarHBondContact O-CD2 3.44Å; A13-F47 HydrophobicContact CB-CD2 4.45Å; A13-F47 HydrophobicContact CB-CE2 3.83Å; A13-F47 HydrophobicContact CB-CZ 4.34Å; I43-F47 HydrophobicContact CB-CB 3.95Å; I43-F47 HydrophobicContact CB-CD1 4.25Å; I43-F47 HydrophobicContact CB-CD2 4.33Å; I43-F47 HydrophobicContact CB-CG 3.92Å; I43-F47 HydrophobicContact CD1-CB 4.5Å; I43-F47 HydrophobicContact CD1-CD1 3.82Å; I43-F47 HydrophobicContact CD1-CE1 4.4Å; I43-F47 HydrophobicContact CD1-CG 4.32Å; I43-F47 HydrophobicContact CG2-CB 4.41Å; I43-F47 HydrophobicContact CG2-CD1 4.02Å; I43-F47 HydrophobicContact CG2-CD2 3.9Å; I43-F47 HydrophobicContact CG2-CE1 4.24Å; I43-F47 HydrophobicContact CG2-CE2 4.15Å; I43-F47 HydrophobicContact CG2-CG 3.84Å; I43-F47 HydrophobicContact CG2-CZ 4.31Å; Y44-F47 WeakPolarHBondContact O-CB 3.4Å; Y44-F47 PolarHBondContact O-N 3.36Å; S45-F47 PolarHBondContact O-N 3.41Å; S45-F47 VanDerWaalsContact O-N 3.12Å; F47-I51 HydrophobicContact CD1-CD1 4.04Å; F47-I51 HydrophobicContact CE1-CD1 3.72Å
48	F	92.9	Very high	80.6	Confident	80 Å²	80	72.2 Å²	72.2	35%	0.351	39%	0.389	S	S	.	.	H	α-helix	trans	-76.6	-25.8	180	-59.1	-70.6	0	0	0	113.4	I35 I43 S45 G46 K50 I51 F52	I35-F48 HydrophobicContact CD1-CE2 3.9Å; I43-F48 HydrophobicContact CD1-CE1 4.17Å; I43-F48 HydrophobicContact CD1-CE2 3.75Å; I43-F48 HydrophobicContact CD1-CZ 3.39Å; S45-F48 PolarHBondContact O-N 3.47Å; G46-F48 PolarHBondContact O-N 3.15Å; G46-F48 VanDerWaalsContact O-N 3.15Å; F48-K50 PolarHBondContact O-N 2.89Å; F48-I51 HydrophobicContact CD1-CD1 4.14Å; F48-I51 WeakPolarHBondContact O-CB 3.37Å; F48-I51 PolarHBondContact O-N 3.08Å; F48-F52 HydrophobicContact CB-CD2 4.15Å; F48-F52 HydrophobicContact CB-CE2 3.73Å; F48-F52 WeakPolarHBondContact O-CD2 3.26Å; F48-F52 PolarHBondContact O-N 2.93Å
49	D	88.5	Confident	78.5	Confident	91 Å²	91	73.6 Å²	73.6	49%	0.487	39%	0.389	S	S	.	.	H	α-helix	trans	-59	-38.6	178.6	-57.6	-20.5	0	0	0	111.2	Y11 G46 C53	Y11-D49 HydrophobicContact CE1-CB 4.14Å; G46-D49 WeakPolarHBondContact CA-OD2 3.44Å; G46-D49 WeakPolarHBondContact O-CB 3.43Å; G46-D49 PolarHBondContact O-N 2.97Å; D49-C53 WeakPolarHBondContact O-CB 3.34Å; D49-C53 PolarHBondContact O-N 3.2Å
50	K	76.1	Confident	76.6	Confident	110 Å²	110	77.7 Å²	77.7	48%	0.478	40%	0.402	S	S	.	.	H	α-helix	trans	-68.6	-37.5	177	-168.2	179	-179.5	-175.7	0	111.8	Y11 F48 C53 H54	Y11-K50 HydrophobicContact CD1-CB 4.43Å; Y11-K50 HydrophobicContact CD2-CD 4.48Å; Y11-K50 HydrophobicContact CG-CB 4.34Å; F48-K50 PolarHBondContact O-N 2.89Å; K50-C53 PolarHBondContact O-N 3.1Å; K50-H54 WeakPolarHBondContact O-CB 3.33Å; K50-H54 PolarHBondContact O-N 2.77Å
51	I	75.4	Confident	74.3	Confident	83 Å²	83	80.7 Å²	80.7	43%	0.426	41%	0.414	S	S	.	.	H	α-helix	trans	-66	-45.3	178.4	-60.8	176.2	0	0	0	109.7	F47 F48 H54 S55	F47-I51 HydrophobicContact CD1-CD1 4.04Å; F47-I51 HydrophobicContact CE1-CD1 3.72Å; F48-I51 HydrophobicContact CD1-CD1 4.14Å; F48-I51 WeakPolarHBondContact O-CB 3.37Å; F48-I51 PolarHBondContact O-N 3.08Å; I51-H54 PolarHBondContact O-N 3.49Å; I51-S55 WeakPolarHBondContact O-CB 3.45Å; I51-S55 PolarHBondContact O-N 3.37Å; I51-S55 PolarHBondContact O-OG 3.18Å; I51-S55 VanDerWaalsContact O-OG 3.09Å
52	F	69.4	Low	71.6	Confident	125 Å²	125	82.9 Å²	82.9	55%	0.548	44%	0.436	S	S	.	.	H	α-helix	trans	-66.3	-38.4	178	-65.9	-60.2	0	0	0	112.4	F48 S55 L56	F48-F52 HydrophobicContact CB-CD2 4.15Å; F48-F52 HydrophobicContact CB-CE2 3.73Å; F48-F52 WeakPolarHBondContact O-CD2 3.26Å; F48-F52 PolarHBondContact O-N 2.93Å; F52-S55 WeakPolarHBondContact CA-OG 3.46Å; F52-S55 PolarHBondContact O-OG 3.41Å; F52-L56 VanDerWaalsContact O-CB 3.26Å; F52-L56 WeakPolarHBondContact O-CB 3.48Å; F52-L56 WeakPolarHBondContact O-CD1 3.28Å; F52-L56 VanDerWaalsContact O-CG 3.22Å; F52-L56 WeakPolarHBondContact O-CG 3.32Å; F52-L56 PolarHBondContact O-N 3.31Å
53	C	60.1	Low	68.9	Low	94 Å²	94	87 Å²	87	64%	0.635	46%	0.464	S	S	*	.	H	α-helix	trans	-67.3	-40.8	176.6	-164.6	0	0	0	0	111.9	D49 K50 G57	D49-C53 WeakPolarHBondContact O-CB 3.34Å; D49-C53 PolarHBondContact O-N 3.2Å; K50-C53 PolarHBondContact O-N 3.1Å; C53-G57 PolarHBondContact O-N 2.99Å
54	H	59	Low	66.3	Low	123 Å²	123	93 Å²	93	57%	0.569	50%	0.502	S	S	*	.	H	α-helix	trans	-68.4	-43.7	176.3	-163.5	-95.5	0	0	0	111.5	K50 I51 L56 G57 M58	K50-H54 WeakPolarHBondContact O-CB 3.33Å; K50-H54 PolarHBondContact O-N 2.77Å; I51-H54 PolarHBondContact O-N 3.49Å; H54-L56 PolarHBondContact O-N 2.86Å; H54-G57 PolarHBondContact O-N 3.43Å; H54-M58 VanDerWaalsContact CE1-CE 3.49Å; H54-M58 WeakPolarHBondContact CE1-CE 3.45Å; H54-M58 VanDerWaalsContact O-CG 3.31Å; H54-M58 WeakPolarHBondContact O-CG 3.38Å; H54-M58 PolarHBondContact O-N 3.02Å
55	S	59.9	Low	64.3	Low	56 Å²	56	97.5 Å²	97.5	39%	0.392	53%	0.53	S	S	.	.	H	α-helix	trans	-67.4	-36.4	-179.8	66.2	0	0	0	0	113	I51 F52 M58	I51-S55 WeakPolarHBondContact O-CB 3.45Å; I51-S55 PolarHBondContact O-N 3.37Å; I51-S55 PolarHBondContact O-OG 3.18Å; I51-S55 VanDerWaalsContact O-OG 3.09Å; F52-S55 WeakPolarHBondContact CA-OG 3.46Å; F52-S55 PolarHBondContact O-OG 3.41Å; S55-M58 PolarHBondContact O-N 3.47Å
56	L	56.8	Low	61.8	Low	116 Å²	116	99.6 Å²	99.6	61%	0.607	54%	0.541	S	S	*	.	H	α-helix	trans	-72.4	-30.2	172.2	-69.4	164.6	0	0	0	112	F52 H54 I59	F52-L56 VanDerWaalsContact O-CB 3.26Å; F52-L56 WeakPolarHBondContact O-CB 3.48Å; F52-L56 WeakPolarHBondContact O-CD1 3.28Å; F52-L56 VanDerWaalsContact O-CG 3.22Å; F52-L56 WeakPolarHBondContact O-CG 3.32Å; F52-L56 PolarHBondContact O-N 3.31Å; H54-L56 PolarHBondContact O-N 2.86Å; L56-I59 PolarHBondContact O-N 2.86Å
57	G	53.1	Low	59.6	Low	29 Å²	29	103.5 Å²	103.5	30%	0.299	57%	0.568	S	S	.	*	H	α-helix	trans	-69.7	-29.5	173.6	0	0	0	0	0	113.9	C53 H54 I59 K60	C53-G57 PolarHBondContact O-N 2.99Å; H54-G57 PolarHBondContact O-N 3.43Å; G57-I59 PolarHBondContact O-N 3.15Å; G57-K60 PolarHBondContact O-N 3.1Å
58	M	45.5	Very low	57.2	Low	95 Å²	95	110.1 Å²	110.1	47%	0.468	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.4	-17.4	175.5	-64.3	-53.2	93.4	0	0	113.2	H54 S55 K60	H54-M58 VanDerWaalsContact CE1-CE 3.49Å; H54-M58 WeakPolarHBondContact CE1-CE 3.45Å; H54-M58 VanDerWaalsContact O-CG 3.31Å; H54-M58 WeakPolarHBondContact O-CG 3.38Å; H54-M58 PolarHBondContact O-N 3.02Å; S55-M58 PolarHBondContact O-N 3.47Å; M58-K60 VanDerWaalsContact C-N 3.33Å
59	I	50.7	Low	55.6	Low	142 Å²	142	113.1 Å²	113.1	73%	0.728	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-14	175.4	-57.8	174.9	0	0	0	111.4	L56 G57	L56-I59 PolarHBondContact O-N 2.86Å; G57-I59 PolarHBondContact O-N 3.15Å
60	K	54.6	Low	53.7	Low	184 Å²	184	113.3 Å²	113.3	80%	0.8	63%	0.626	S	S	*	*	S	Bend	trans	-106.3	-0.4	-175.9	-76.4	-173	175.7	-176.6	0	115.4	G57 M58 P62	G57-K60 PolarHBondContact O-N 3.1Å; M58-K60 VanDerWaalsContact C-N 3.33Å; K60-P62 WeakPolarHBondContact O-CD 3.43Å
61	Q	46.6	Very low	52.8	Low	129 Å²	129	113.2 Å²	113.2	60%	0.603	64%	0.637	S	S	*	*			trans	-93.4	120.6	172.1	-67.8	-164.9	35.4	0	0	110.1	S63	Q61-S63 PolarHBondContact O-N 3.24Å
62	P	40.7	Very low	52	Low	119 Å²	119	116.7 Å²	116.7	77%	0.773	66%	0.655	S	S	*	*			trans	-72.5	81.7	160.1	30.5	-29.2	0	0	0	107.1	K60 T64	K60-P62 WeakPolarHBondContact O-CD 3.43Å; P62-T64 VanDerWaalsContact C-N 3.28Å; P62-T64 PolarHBondContact O-N 2.9Å
63	S	42	Very low	51.4	Low	90 Å²	90	117.4 Å²	117.4	63%	0.629	66%	0.66	S	S	*	*			trans	-68.8	96	163.9	55.8	0	0	0	0	107.2	Q61 T65	Q61-S63 PolarHBondContact O-N 3.24Å; S63-T65 PolarHBondContact O-N 3.17Å
64	T	42.6	Very low	51.3	Low	137 Å²	137	119.5 Å²	119.5	84%	0.84	66%	0.663	S	S	*	*			trans	-65.2	76	162.6	30.6	0	0	0	0	109.5	P62	P62-T64 VanDerWaalsContact C-N 3.28Å; P62-T64 PolarHBondContact O-N 2.9Å
65	T	53.4	Low	50.5	Low	98 Å²	98	122.2 Å²	122.2	60%	0.601	67%	0.669	S	S	*	*	S	Bend	trans	-162.2	119.3	148.1	37.9	0	0	0	0	106	S63 S67	S63-T65 PolarHBondContact O-N 3.17Å; T65-S67 PolarHBondContact O-N 3.29Å
66	P	42.2	Very low	49.6	Very low	132 Å²	132	126 Å²	126	86%	0.857	68%	0.68	S	S	*	*			trans	-75	85	170.1	30.3	-28.9	0	0	0	107.1	E68	P66-E68 PolarHBondContact O-N 2.93Å
67	S	48.3	Very low	49.7	Very low	85 Å²	85	125.1 Å²	125.1	59%	0.594	68%	0.679	S	S	*	*			trans	-73.5	116.1	155.6	39.4	0	0	0	0	106.6	T65 I69	T65-S67 PolarHBondContact O-N 3.29Å; S67-I69 PolarHBondContact O-N 3.42Å
68	E	44	Very low	49.8	Very low	195 Å²	195	129 Å²	129	91%	0.911	69%	0.693	S	S	*	*			trans	-59.7	83.1	174.3	-67.1	179.3	157.2	0	0	109.7	P66 S70	P66-E68 PolarHBondContact O-N 2.93Å; E68-S70 VanDerWaalsContact C-N 3.31Å; E68-S70 PolarHBondContact O-N 3.45Å; E68-S70 VanDerWaalsContact O-N 3.08Å
69	I	59.9	Low	50.4	Low	143 Å²	143	129.9 Å²	129.9	73%	0.733	70%	0.7	S	S	*	*			trans	-78.3	93.8	165.7	-59.2	170.6	0	0	0	105.1	S67	S67-I69 PolarHBondContact O-N 3.42Å
70	S	48.1	Very low	50.5	Low	94 Å²	94	126.6 Å²	126.6	66%	0.657	68%	0.684	S	S	*	*			trans	-51.1	126.8	165.3	53.6	0	0	0	0	108.1	E68 I72	E68-S70 VanDerWaalsContact C-N 3.31Å; E68-S70 PolarHBondContact O-N 3.45Å; E68-S70 VanDerWaalsContact O-N 3.08Å; S70-I72 PolarHBondContact O-N 3.03Å
71	P	55.8	Low	50.5	Low	108 Å²	108	122 Å²	122	70%	0.701	67%	0.667	S	S	*	*			trans	-54.8	133.4	176.7	22.3	-30.8	0	0	0	107.8	Q73	P71-Q73 VanDerWaalsContact C-N 3.33Å; P71-Q73 PolarHBondContact O-N 3.3Å
72	I	59.8	Low	50.7	Low	157 Å²	157	120.5 Å²	120.5	81%	0.805	66%	0.663	S	S	*	*			trans	-53.2	105.8	171.8	-64.1	166.9	0	0	0	105.7	S70 I74	S70-I72 PolarHBondContact O-N 3.03Å; I72-I74 VanDerWaalsContact C-N 3.32Å; I72-I74 PolarHBondContact O-N 2.91Å
73	Q	56.6	Low	51.5	Low	140 Å²	140	122.4 Å²	122.4	65%	0.654	66%	0.659	S	S	*	*			trans	-66.3	104.3	170.2	-64.7	-152.7	-65.7	0	0	104.9	P71 W75	P71-Q73 VanDerWaalsContact C-N 3.33Å; P71-Q73 PolarHBondContact O-N 3.3Å; Q73-W75 PolarHBondContact O-N 3.43Å; Q73-W75 PolarHBondContact O-NE1 3.43Å
74	I	57.9	Low	52.1	Low	138 Å²	138	126.6 Å²	126.6	71%	0.708	66%	0.661	S	S	*	*			trans	-63.9	96.4	164.1	-60.2	177.5	0	0	0	103.5	I72 H76	I72-I74 VanDerWaalsContact C-N 3.32Å; I72-I74 PolarHBondContact O-N 2.91Å; I74-H76 VanDerWaalsContact C-N 3.34Å; I74-H76 PolarHBondContact O-N 3.48Å
75	W	42.2	Very low	52.6	Low	179 Å²	179	128.3 Å²	128.3	68%	0.678	65%	0.652	S	S	*	*			trans	-57	105.5	172.5	-55.9	83.9	0	0	0	105.5	Q73 T77 L80	Q73-W75 PolarHBondContact O-N 3.43Å; Q73-W75 PolarHBondContact O-NE1 3.43Å; W75-T77 PolarHBondContact O-N 2.7Å; W75-L80 HydrophobicContact CB-CD1 3.88Å; W75-L80 HydrophobicContact CG-CD1 4.45Å
76	H	41.3	Very low	52.7	Low	136 Å²	136	130 Å²	130	63%	0.63	66%	0.655	S	S	*	*			trans	-55.1	111.3	170.1	-81.4	-74.7	0	0	0	105.7	I74 N78 D79	I74-H76 VanDerWaalsContact C-N 3.34Å; I74-H76 PolarHBondContact O-N 3.48Å; H76-N78 PolarHBondContact O-N 3.22Å; H76-D79 PolarHBondContact O-N 3.13Å
77	T	58.6	Low	53.2	Low	97 Å²	97	130.1 Å²	130.1	60%	0.595	65%	0.648	S	S	*	*	H	α-helix	trans	-56.2	-24.7	-174.2	45.2	0	0	0	0	111.7	W75 D79 L80 I81	W75-T77 PolarHBondContact O-N 2.7Å; T77-D79 VanDerWaalsContact C-N 3.34Å; T77-D79 PolarHBondContact O-N 3.19Å; T77-L80 PolarHBondContact O-N 3.12Å; T77-I81 WeakPolarHBondContact O-CD1 3.27Å; T77-I81 VanDerWaalsContact O-CG1 3.25Å; T77-I81 WeakPolarHBondContact O-CG1 3.5Å; T77-I81 PolarHBondContact O-N 2.96Å
78	N	55.9	Low	53.3	Low	111 Å²	111	133.2 Å²	133.2	59%	0.594	66%	0.657	S	S	*	*	H	α-helix	trans	-62.7	-35.3	176.6	-62.9	-15.9	0	0	0	113.1	H76 I81 N82	H76-N78 PolarHBondContact O-N 3.22Å; N78-I81 PolarHBondContact O-N 3.48Å; N78-N82 PolarHBondContact O-N 3.27Å
79	D	57.9	Low	53.5	Low	113 Å²	113	130.3 Å²	130.3	60%	0.604	65%	0.647	S	S	*	*	H	α-helix	trans	-75.3	-35.2	-178.3	-68.3	-23.1	0	0	0	112.1	H76 T77 I81 N82 K83	H76-D79 PolarHBondContact O-N 3.13Å; T77-D79 VanDerWaalsContact C-N 3.34Å; T77-D79 PolarHBondContact O-N 3.19Å; D79-I81 VanDerWaalsContact C-N 3.3Å; D79-I81 PolarHBondContact O-N 2.68Å; D79-N82 PolarHBondContact O-N 3.08Å; D79-K83 PolarHBondContact O-N 2.87Å; D79-K83 VanDerWaalsContact O-N 3.17Å
80	L	52.9	Low	52.9	Low	74 Å²	74	129.1 Å²	129.1	39%	0.387	65%	0.647	S	S	.	*	H	α-helix	trans	-69	-30.4	174.3	-79.2	162.3	0	0	0	112.3	W75 T77 R84	W75-L80 HydrophobicContact CB-CD1 3.88Å; W75-L80 HydrophobicContact CG-CD1 4.45Å; T77-L80 PolarHBondContact O-N 3.12Å; L80-R84 PolarHBondContact O-N 3.11Å
81	I	53.8	Low	52.4	Low	86 Å²	86	132.3 Å²	132.3	44%	0.441	66%	0.656	S	S	.	*	H	α-helix	trans	-68.3	-43.2	176.6	-69.9	163.8	0	0	0	110.1	T77 N78 D79 R84 R85	T77-I81 WeakPolarHBondContact O-CD1 3.27Å; T77-I81 VanDerWaalsContact O-CG1 3.25Å; T77-I81 WeakPolarHBondContact O-CG1 3.5Å; T77-I81 PolarHBondContact O-N 2.96Å; N78-I81 PolarHBondContact O-N 3.48Å; D79-I81 VanDerWaalsContact C-N 3.3Å; D79-I81 PolarHBondContact O-N 2.68Å; I81-R84 PolarHBondContact O-N 2.83Å; I81-R85 VanDerWaalsContact O-CG 3.28Å; I81-R85 WeakPolarHBondContact O-CG 3.4Å; I81-R85 PolarHBondContact O-N 3.1Å
82	N	51.3	Low	52.1	Low	98 Å²	98	132.3 Å²	132.3	52%	0.524	65%	0.654	S	S	.	*	H	α-helix	trans	-70	-35.9	179.6	-72.7	-23	0	0	0	112.6	N78 D79 R84 R85 M86	N78-N82 PolarHBondContact O-N 3.27Å; D79-N82 PolarHBondContact O-N 3.08Å; N82-R84 VanDerWaalsContact C-N 3.35Å; N82-R84 PolarHBondContact O-N 3.39Å; N82-R85 PolarHBondContact O-N 2.89Å; N82-M86 PolarHBondContact O-N 2.87Å; N82-M86 VanDerWaalsContact O-N 3.09Å
83	K	57.3	Low	51.1	Low	159 Å²	159	132.1 Å²	132.1	69%	0.691	66%	0.655	S	S	*	*	H	α-helix	trans	-67.5	-34.7	177.2	-145.4	170.3	-171.9	176.2	0	112.6	D79	D79-K83 PolarHBondContact O-N 2.87Å; D79-K83 VanDerWaalsContact O-N 3.17Å
84	R	53.5	Low	50.3	Low	179 Å²	179	134.2 Å²	134.2	68%	0.675	66%	0.664	S	S	*	*	H	α-helix	trans	-72	-31.4	171.6	-83.4	-170.9	168.8	101.8	-2	113	L80 I81 N82 L88	L80-R84 PolarHBondContact O-N 3.11Å; I81-R84 PolarHBondContact O-N 2.83Å; N82-R84 VanDerWaalsContact C-N 3.35Å; N82-R84 PolarHBondContact O-N 3.39Å; R84-L88 PolarHBondContact O-N 3.24Å
85	R	54.8	Low	49.5	Very low	172 Å²	172	134.8 Å²	134.8	65%	0.649	67%	0.669	S	S	*	*	H	α-helix	trans	-71.1	-32.8	178.1	-72.5	178.9	91.5	111.5	4.4	112.9	I81 N82	I81-R85 VanDerWaalsContact O-CG 3.28Å; I81-R85 WeakPolarHBondContact O-CG 3.4Å; I81-R85 PolarHBondContact O-N 3.1Å; N82-R85 PolarHBondContact O-N 2.89Å
86	M	54.4	Low	49.5	Very low	135 Å²	135	134.2 Å²	134.2	67%	0.665	67%	0.673	S	S	*	*	H	α-helix	trans	-74.5	-31.1	177.2	-63.2	-59	-99.6	0	0	113	N82 L88 L89	N82-M86 PolarHBondContact O-N 2.87Å; N82-M86 VanDerWaalsContact O-N 3.09Å; M86-L88 VanDerWaalsContact C-N 3.28Å; M86-L88 PolarHBondContact O-N 2.83Å; M86-L89 PolarHBondContact O-N 3.09Å
87	N	52.1	Low	49.5	Very low	134 Å²	134	134.3 Å²	134.3	72%	0.717	68%	0.678	S	S	*	*	H	α-helix	trans	-76.4	-13.4	177.5	-72.5	-12.1	0	0	0	114
88	L	50.9	Low	48.8	Very low	149 Å²	149	136.4 Å²	136.4	78%	0.78	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-4.5	177.1	-99	144.1	0	0	0	113.8	R84 M86	R84-L88 PolarHBondContact O-N 3.24Å; M86-L88 VanDerWaalsContact C-N 3.28Å; M86-L88 PolarHBondContact O-N 2.83Å
89	L	48.9	Very low	48.1	Very low	135 Å²	135	138.4 Å²	138.4	71%	0.707	70%	0.697	S	S	*	*	S	Bend	trans	-98.6	0.2	-179.8	-78.3	166.5	0	0	0	114.6	M86 N91	M86-L89 PolarHBondContact O-N 3.09Å; L89-N91 PolarHBondContact O-N 2.9Å
90	V	47.4	Very low	47.1	Very low	118 Å²	118	141.1 Å²	141.1	72%	0.715	71%	0.706	S	S	*	*			trans	-100.9	74	174.2	-171.1	0	0	0	0	109.1
91	N	37.8	Very low	46.3	Very low	160 Å²	160	147.7 Å²	147.7	86%	0.856	73%	0.727	S	S	*	*			trans	-138.4	75	151.8	-142.8	6.2	0	0	0	106.8	L89 N93	L89-N91 PolarHBondContact O-N 2.9Å; N91-N93 PolarHBondContact O-N 3.37Å
92	T	47.9	Very low	45.6	Very low	108 Å²	108	151.2 Å²	151.2	66%	0.663	75%	0.746	S	S	*	*			trans	-77.6	115.5	176.9	46.2	0	0	0	0	108.9	H94	T92-H94 PolarHBondContact O-N 3.02Å
93	N	39.2	Very low	44.8	Very low	153 Å²	153	152.9 Å²	152.9	82%	0.818	76%	0.755	S	S	*	*			trans	6.8	102.8	146.5	-60.8	-29.6	0	0	0	115.1	N91 N95	N91-N93 PolarHBondContact O-N 3.37Å; N93-N95 PolarHBondContact O-N 3.01Å
94	H	40.8	Very low	43.7	Very low	185 Å²	185	151.3 Å²	151.3	86%	0.856	76%	0.759	S	S	*	*			trans	-80.2	102.8	152.1	-116.6	43.8	0	0	0	107.1	T92	T92-H94 PolarHBondContact O-N 3.02Å
95	N	40.9	Very low	42.8	Very low	150 Å²	150	148.7 Å²	148.7	80%	0.802	76%	0.763	S	S	*	*			trans	-116.3	106.3	166.4	-137.6	1.2	0	0	0	105.2	N93	N93-N95 PolarHBondContact O-N 3.01Å
96	H	42	Very low	41.9	Very low	167 Å²	167	146.5 Å²	146.5	77%	0.773	77%	0.769	S	S	*	*			trans	-128.3	88.2	173.4	-130.1	-45.7	0	0	0	107.9
97	N	40.9	Very low	41	Very low	137 Å²	137	145 Å²	145	73%	0.733	77%	0.772	S	S	*	*			trans	-97.3	123.9	152.2	-86.4	-15.6	0	0	0	106.2
98	N	44.6	Very low	40.3	Very low	142 Å²	142	148 Å²	148	76%	0.759	78%	0.781	S	S	*	*			trans	157.8	111.3	136.2	-78	-19.3	0	0	0	110.3
99	N	40.9	Very low	39.7	Very low	152 Å²	152	149.9 Å²	149.9	81%	0.813	79%	0.786	S	S	*	*			trans	18.6	120.9	135.6	-65.1	-22.6	0	0	0	118.6
100	H	36.8	Very low	39.2	Very low	171 Å²	171	150.8 Å²	150.8	79%	0.792	79%	0.79	S	S	*	*			trans	66.8	102.1	130.9	-115.9	-72.6	0	0	0	119.6
101	Y	35.8	Very low	38.3	Very low	212 Å²	212	150.8 Å²	150.8	83%	0.831	80%	0.795	S	S	*	*			trans	7.1	118.9	150.8	-66.4	-85.7	0	0	0	119.4
102	D	38.8	Very low	38.2	Very low	160 Å²	160	150 Å²	150	86%	0.856	79%	0.79	S	S	*	*			trans	-150.9	157.4	152	-112.1	-31.4	0	0	0	112.6
103	N	35.4	Very low	37.2	Very low	132 Å²	132	148 Å²	148	71%	0.706	79%	0.791	S	S	*	*			trans	-82.2	153.7	-160.6	-74	-53.7	0	0	0	116.1
104	T	33.4	Very low	37	Very low	126 Å²	126	151.5 Å²	151.5	77%	0.773	79%	0.794	S	S	*	*			trans	63.8	158.6	138.1	54.9	0	0	0	0	121.8
105	V	36	Very low	36.4	Very low	125 Å²	125	151 Å²	151	76%	0.758	79%	0.793	S	S	*	*			trans	99.1	92.6	159	-173.3	0	0	0	0	115
106	T	35.5	Very low	36.2	Very low	125 Å²	125	149.5 Å²	149.5	77%	0.767	79%	0.791	S	S	*	*				82.4	137.1	97.9	-5.9	0	0	0	0	116.1
107	S	34.1	Very low	35.8	Very low	105 Å²	105	148.5 Å²	148.5	73%	0.734	79%	0.791	S	S	*	*			trans	-62.1	140.3	-178.8	41.8	0	0	0	0	115.9
108	E	38.7	Very low	35.5	Very low	196 Å²	196	148.2 Å²	148.2	92%	0.916	80%	0.797	S	S	*	*			trans	-139.1	140.7	152.8	-77.5	-168.2	161.4	0	0	112.1
109	Q	37.5	Very low	35.1	Very low	188 Å²	188	147.2 Å²	147.2	88%	0.879	80%	0.801	S	S	*	*			trans	-74.3	142.1	-176.5	-60.5	164.4	-50	0	0	111.3
110	I	38.4	Very low	34.7	Very low	155 Å²	155	143.5 Å²	143.5	80%	0.795	80%	0.798	S	S	*	*			trans	-135.3	99.2	150.7	-56.9	-179.8	0	0	0	108.5	L112	I110-L112 HydrophobicContact CG2-CB 4.48Å; I110-L112 HydrophobicContact CG2-CD1 3.96Å; I110-L112 HydrophobicContact CG2-CG 4.05Å
111	S	29.6	Very low	34.3	Very low	117 Å²	117	145.7 Å²	145.7	82%	0.818	80%	0.801	S	S	*	*			trans	-91.5	113.7	159.6	-174.6	0	0	0	0	107
112	L	35.4	Very low	34.4	Very low	145 Å²	145	143.2 Å²	143.2	76%	0.759	80%	0.801	S	S	*	*			trans	-137.6	106.8	166.5	-79.4	173.1	0	0	0	108.1	I110	I110-L112 HydrophobicContact CG2-CB 4.48Å; I110-L112 HydrophobicContact CG2-CD1 3.96Å; I110-L112 HydrophobicContact CG2-CG 4.05Å
113	G	26.4	Very low	33.9	Very low	66 Å²	66	141.8 Å²	141.8	68%	0.68	79%	0.789	S	S	*	*			trans	-72.4	146.1	176.7	0	0	0	0	0	112.1
114	Y	34.9	Very low	33.9	Very low	225 Å²	225	146.1 Å²	146.1	88%	0.882	80%	0.797	S	S	*	*			trans	-147.1	112.3	156.1	-86.6	-79.4	0	0	0	108.7
115	Q	29.2	Very low	33.8	Very low	176 Å²	176	148.1 Å²	148.1	82%	0.822	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-92.6	129.7	163.4	-92.3	-95.9	-25.8	0	0	108.1
116	P	35.8	Very low	33.7	Very low	118 Å²	118	148.8 Å²	148.8	77%	0.766	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-103	122.1	160.1	9.5	10.3	0	0	0	110.7
117	N	33.5	Very low	33.6	Very low	146 Å²	146	150.8 Å²	150.8	78%	0.781	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-49.8	150.8	173.4	-69.2	-45.1	0	0	0	114.2
118	P	35	Very low	33.4	Very low	130 Å²	130	152.5 Å²	152.5	84%	0.844	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-86	117.1	163.2	33.5	-25.6	0	0	0	109.4
119	S	35.4	Very low	33.3	Very low	121 Å²	121	151.2 Å²	151.2	85%	0.846	81%	0.805	S	S	*	*			trans	-151.7	116	164.6	-169.3	0	0	0	0	109.8
120	G	33.2	Very low	33.3	Very low	74 Å²	74	149.9 Å²	149.9	76%	0.763	80%	0.799	S	S	*	*			trans	179.4	49.3	-178.3	0	0	0	0	0	111.1	I122	G120-I122 PolarHBondContact O-N 3.44Å
121	Y	28.2	Very low	33.2	Very low	217 Å²	217	151.1 Å²	151.1	85%	0.851	80%	0.801	S	S	*	*			trans	-67.9	121.8	170	-89.8	-90.8	0	0	0	109.6
122	I	37.3	Very low	33.3	Very low	161 Å²	161	148.6 Å²	148.6	83%	0.826	79%	0.793	S	S	*	*			trans	-104.8	121.9	152.4	-61.6	-178.1	0	0	0	106.6	G120	G120-I122 PolarHBondContact O-N 3.44Å
123	H	28.5	Very low	33.2	Very low	130 Å²	130	148.9 Å²	148.9	60%	0.602	80%	0.796	S	S	*	*			trans	-109.8	123.4	-165.5	-172.2	-134.3	0	0	0	108.1	K125	H123-K125 WeakPolarHBondContact CE1-CD 3.45Å; H123-K125 WeakPolarHBondContact CE1-CE 3.45Å; H123-K125 WeakPolarHBondContact CE1-CG 3.44Å
124	Y	36.1	Very low	33.7	Very low	223 Å²	223	153.9 Å²	153.9	88%	0.875	80%	0.801	S	S	*	*			trans	-108.2	108.3	159.7	37.2	-93.8	0	0	0	108.1
125	K	31.9	Very low	33.7	Very low	168 Å²	168	151.2 Å²	151.2	73%	0.73	80%	0.801	S	S	*	*			trans	-93.3	124.6	169.3	-93.7	174	164.4	171.8	0	108.2	H123	H123-K125 WeakPolarHBondContact CE1-CD 3.45Å; H123-K125 WeakPolarHBondContact CE1-CE 3.45Å; H123-K125 WeakPolarHBondContact CE1-CG 3.44Å
126	T	32.3	Very low	33.8	Very low	138 Å²	138	148 Å²	148	85%	0.847	80%	0.796	S	S	*	*			trans	-140.8	106.1	144.7	-53.4	0	0	0	0	110.2
127	L	34.6	Very low	33.8	Very low	167 Å²	167	151.6 Å²	151.6	87%	0.874	81%	0.805	S	S	*	*			trans	11.4	124.1	158.2	-73.3	131.9	0	0	0	121.8
128	N	29.8	Very low	33.7	Very low	141 Å²	141	152.3 Å²	152.3	75%	0.754	80%	0.803	S	S	*	*			trans	-59.3	153.4	156.3	-73.2	-24.5	0	0	0	112.8
129	N	35.6	Very low	33.7	Very low	169 Å²	169	153.3 Å²	153.3	90%	0.904	80%	0.8	S	S	*	*				-159.8	126.8	117.5	-96.2	-20	0	0	0	110.7
130	Q	37.9	Very low	33.7	Very low	161 Å²	161	155.2 Å²	155.2	75%	0.752	79%	0.793	S	S	*	*			trans	-93.6	166.6	173.3	-67.1	-178.7	-29.7	0	0	110.5
131	H	36.1	Very low	33.5	Very low	180 Å²	180	157.7 Å²	157.7	83%	0.833	80%	0.796	S	S	*	*			trans	93.6	122.8	160	-69.2	73.9	0	0	0	118.1
132	G	32.2	Very low	33.6	Very low	65 Å²	65	156.5 Å²	156.5	67%	0.67	79%	0.791	S	S	*	*			trans	133.3	82.5	143.4	0	0	0	0	0	116.8
133	N	34.3	Very low	33.3	Very low	151 Å²	151	155.4 Å²	155.4	81%	0.807	79%	0.792	S	S	*	*			trans	64.9	137.5	131.2	-61	-17.8	0	0	0	122.5
134	Q	36.2	Very low	33.5	Very low	171 Å²	171	155.6 Å²	155.6	80%	0.799	80%	0.802	S	S	*	*			trans	86.1	102.2	147.8	-72.3	173.2	55.8	0	0	120.5
135	L	33.9	Very low	33.2	Very low	168 Å²	168	152.7 Å²	152.7	88%	0.88	80%	0.802	S	S	*	*			trans	53.1	147.3	130.4	-73.2	160.6	0	0	0	122.3
136	P	31.9	Very low	33	Very low	110 Å²	110	148.4 Å²	148.4	71%	0.714	79%	0.791	S	S	*	*			trans	-104.5	153.7	-154.8	39.7	-31.5	0	0	0	114.3
137	M	35.1	Very low	32.9	Very low	192 Å²	192	151.5 Å²	151.5	95%	0.946	79%	0.789	S	S	*	*			trans	-135.1	143.5	164.8	-82.5	-68.7	-76.1	0	0	111.5
138	H	31.6	Very low	32.6	Very low	162 Å²	162	149.9 Å²	149.9	75%	0.75	79%	0.786	S	S	*	*			trans	-103.2	116.8	-160.5	169.4	-71.6	0	0	0	111.4
139	I	36.7	Very low	32.9	Very low	151 Å²	151	149.3 Å²	149.3	77%	0.774	78%	0.783	S	S	*	*			trans	-144.8	139.2	165.2	-54.9	-177.7	0	0	0	111.6
140	K	35	Very low	32.5	Very low	161 Å²	161	148.2 Å²	148.2	70%	0.7	78%	0.776	S	S	*	*			trans	-66.6	166.5	-170	-69	173.5	177.2	177.9	0	116
141	P	28.3	Very low	32.2	Very low	126 Å²	126	146.9 Å²	146.9	82%	0.818	78%	0.782	S	S	*	*			trans	-88.2	147.8	-163.9	35.6	-32.6	0	0	0	113.9
142	Y	31	Very low	31.8	Very low	192 Å²	192	145.7 Å²	145.7	75%	0.753	78%	0.782	S	S	*	*			trans	-107.9	131	169.2	-14.7	-80.1	0	0	0	109
143	T	30.1	Very low	31.7	Very low	138 Å²	138	148.8 Å²	148.8	85%	0.847	79%	0.788	S	S	*	*			trans	-71.3	133.1	165.7	47.7	0	0	0	0	109.1
144	T	32.9	Very low	31.6	Very low	133 Å²	133	146.1 Å²	146.1	82%	0.816	78%	0.782	S	S	*	*			trans	-165.8	121.9	155.2	8.8	0	0	0	0	108.6	P146	T144-P146 WeakPolarHBondContact O-CD 3.37Å
145	N	28.7	Very low	31.5	Very low	162 Å²	162	147 Å²	147	87%	0.866	78%	0.783	S	S	*	*			trans	-96.5	117.7	174.2	-165.7	20	0	0	0	107.4
146	P	29	Very low	31.6	Very low	79 Å²	79	145.3 Å²	145.3	51%	0.513	77%	0.773	S	S	.	*			trans	-113.4	133	152.2	33.1	-20.8	0	0	0	106.4	T144	T144-P146 WeakPolarHBondContact O-CD 3.37Å
147	Y	30.1	Very low	31.4	Very low	202 Å²	202	146.4 Å²	146.4	79%	0.792	77%	0.773	S	S	*	*				-168.6	119.4	73.9	-83.9	-83.2	0	0	0	108.8
148	T	28.9	Very low	31.5	Very low	134 Å²	134	144.8 Å²	144.8	82%	0.822	77%	0.767	S	S	*	*			trans	-77.6	125.8	151	41	0	0	0	0	108.1
149	N	34.6	Very low	31.4	Very low	129 Å²	129	144.9 Å²	144.9	69%	0.69	77%	0.768	S	S	*	*			trans	-159.1	93.9	159.4	-94.3	-26.1	0	0	0	106.4
150	I	28.5	Very low	31.2	Very low	146 Å²	146	144.8 Å²	144.8	75%	0.749	77%	0.769	S	S	*	*				57.9	96.6	101.1	-56.9	167.2	0	0	0	111.9
151	C	30.5	Very low	31.3	Very low	132 Å²	132	145.6 Å²	145.6	89%	0.892	78%	0.78	S	S	*	*			trans	-143.6	80.7	145.9	-83.9	0	0	0	0	107.6
152	N	27.3	Very low	31.6	Very low	155 Å²	155	149.2 Å²	149.2	83%	0.829	78%	0.782	S	S	*	*			trans	-83.8	116.9	159.1	-88.1	-26.7	0	0	0	107.5
153	T	31.5	Very low	31.5	Very low	130 Å²	130	147.5 Å²	147.5	80%	0.798	79%	0.785	S	S	*	*			trans	-134.9	108.6	151	51.8	0	0	0	0	109.4
154	S	32.1	Very low	31.8	Very low	95 Å²	95	150.3 Å²	150.3	66%	0.664	79%	0.786	S	S	*	*			trans	57.6	92	151	61.7	0	0	0	0	118.3
155	K	34.3	Very low	31.8	Very low	190 Å²	190	152 Å²	152	83%	0.826	78%	0.784	S	S	*	*				-52.9	123.2	128.1	-74.7	176.5	173.4	-177.3	0	108.4
156	I	34.4	Very low	32.1	Very low	132 Å²	132	151.9 Å²	151.9	68%	0.677	78%	0.784	S	S	*	*			trans	-113	96.9	155.9	-62.7	175.7	0	0	0	104.4	L158	I156-L158 HydrophobicContact CG2-CD1 3.68Å; I156-L158 PolarHBondContact O-N 3.05Å
157	D	28.9	Very low	32.5	Very low	133 Å²	133	156 Å²	156	71%	0.711	80%	0.796	S	S	*	*			trans	-76	109.3	161.2	-68	-42.7	0	0	0	106.5
158	L	36.5	Very low	32.7	Very low	158 Å²	158	152.9 Å²	152.9	83%	0.827	79%	0.793	S	S	*	*			trans	-115.1	84.5	155.7	-108.3	85	0	0	0	107.3	I156	I156-L158 HydrophobicContact CG2-CD1 3.68Å; I156-L158 PolarHBondContact O-N 3.05Å
159	E	29.8	Very low	32.9	Very low	164 Å²	164	154.5 Å²	154.5	77%	0.766	79%	0.791	S	S	*	*			trans	-57.9	153.8	150.4	-71.2	-175.1	145.5	0	0	109.5
160	N	32.6	Very low	32.8	Very low	150 Å²	150	154.9 Å²	154.9	80%	0.802	79%	0.789	S	S	*	*			trans	93.3	70.8	172	-50.6	-45.6	0	0	0	117.1
161	I	37.7	Very low	33.1	Very low	178 Å²	178	156.4 Å²	156.4	91%	0.913	79%	0.79	S	S	*	*			trans	-122.6	105.5	139.2	-59.7	-178	0	0	0	108.3
162	K	34.7	Very low	33.2	Very low	201 Å²	201	159.6 Å²	159.6	87%	0.874	79%	0.789	S	S	*	*			trans	-70.5	128.6	-175.2	-149.4	167.5	-175.2	175.6	0	109.6	K164	K162-K164 PolarHBondContact O-N 3.44Å
163	L	29.1	Very low	33.2	Very low	156 Å²	156	163.7 Å²	163.7	82%	0.817	79%	0.794	S	S	*	*			trans	-49.4	127.6	162.2	-83.2	149.1	0	0	0	110.8
164	K	36.4	Very low	33.3	Very low	198 Å²	198	160.7 Å²	160.7	86%	0.861	79%	0.789	S	S	*	*			trans	-131.8	106.4	145.4	-78.8	-164.7	173.6	-169.2	0	107.7	K162	K162-K164 PolarHBondContact O-N 3.44Å
165	Q	32.6	Very low	33.1	Very low	168 Å²	168	163.6 Å²	163.6	79%	0.785	80%	0.797	S	S	*	*			trans	-63.6	135.3	154.5	-75.1	167.3	-46.2	0	0	107.3
166	D	34.7	Very low	33.1	Very low	159 Å²	159	162.7 Å²	162.7	85%	0.85	80%	0.8	S	S	*	*			trans	-153.4	145.4	141	-93.5	-32.8	0	0	0	109.4
167	H	36.8	Very low	33.1	Very low	167 Å²	167	162.9 Å²	162.9	77%	0.773	80%	0.802	S	S	*	*			trans	-70.3	170.2	-166.4	-78.3	-97.9	0	0	0	115.3
168	N	33.9	Very low	33.2	Very low	136 Å²	136	164.2 Å²	164.2	73%	0.727	81%	0.809	S	S	*	*			trans	114.9	99.8	154.8	-60.7	-11.8	0	0	0	112.4
169	E	33.3	Very low	33.1	Very low	168 Å²	168	162.7 Å²	162.7	79%	0.785	81%	0.806	S	S	*	*				101.9	133	72.6	-96.7	-169.4	164.2	0	0	110.8
170	E	32.6	Very low	33.4	Very low	137 Å²	137	161.9 Å²	161.9	64%	0.64	81%	0.807	S	S	*	*			trans	71.4	108.7	155.2	-66.1	-155.5	123.8	0	0	121.8
171	K	34.5	Very low	33.2	Very low	177 Å²	177	166.9 Å²	166.9	77%	0.77	82%	0.815	S	S	*	*				46.4	122.9	119.2	-60.5	170.3	-172.4	155.6	0	116.8
172	K	32.7	Very low	33	Very low	199 Å²	199	163 Å²	163	87%	0.865	80%	0.804	S	S	*	*				166.1	119.6	104.8	-170.6	169.4	-175.5	-179.8	0	109.5	G174	K172-G174 PolarHBondContact O-N 2.88Å
173	Y	29.3	Very low	32.9	Very low	241 Å²	241	160 Å²	160	95%	0.945	80%	0.802	S	S	*	*			trans	-63.2	123.3	166.4	-69.6	-87.5	0	0	0	108.6
174	G	32.4	Very low	33.3	Very low	67 Å²	67	158.8 Å²	158.8	69%	0.691	80%	0.795	S	S	*	*			trans	-141.3	100.4	-179.9	0	0	0	0	0	109.9	K172 L176	K172-G174 PolarHBondContact O-N 2.88Å; G174-L176 PolarHBondContact O-N 3.16Å
175	L	29.2	Very low	33.2	Very low	157 Å²	157	158.8 Å²	158.8	82%	0.822	80%	0.798	S	S	*	*			trans	-43.9	122.2	160.2	-173.4	80.5	0	0	0	110.1
176	L	33.2	Very low	33.6	Very low	171 Å²	171	159.2 Å²	159.2	90%	0.895	80%	0.798	S	S	*	*			trans	-138.9	122.4	162.8	-95.3	168.8	0	0	0	109.9	G174	G174-L176 PolarHBondContact O-N 3.16Å
177	D	34.1	Very low	33.5	Very low	135 Å²	135	162 Å²	162	72%	0.722	80%	0.802	S	S	*	*			trans	-67.2	155.2	-174.1	-66.7	-56.2	0	0	0	114	V179	D177-V179 PolarHBondContact O-N 2.95Å
178	N	30.9	Very low	33.6	Very low	162 Å²	162	158.6 Å²	158.6	87%	0.866	80%	0.797	S	S	*	*			trans	-37.3	119.4	159.8	-85.7	-36.6	0	0	0	112.6
179	V	35.7	Very low	34	Very low	125 Å²	125	159.4 Å²	159.4	76%	0.758	80%	0.802	S	S	*	*				-163.5	114.8	129.6	-179	0	0	0	0	106.8	D177	D177-V179 PolarHBondContact O-N 2.95Å
180	N	34.6	Very low	34.3	Very low	148 Å²	148	159.6 Å²	159.6	79%	0.791	81%	0.808	S	S	*	*			trans	170.5	86.7	134	-85.9	-36.1	0	0	0	110.6	S182	N180-S182 PolarHBondContact O-N 3.42Å
181	R	28.7	Very low	35.2	Very low	254 Å²	254	158.4 Å²	158.4	96%	0.958	81%	0.814	S	S	*	*			trans	-68.3	105	155.4	178.6	-170.4	-95.9	-150.6	-3.3	107
182	S	33.7	Very low	36.5	Very low	97 Å²	97	157.6 Å²	157.6	68%	0.678	82%	0.817	S	S	*	*			trans	-134.3	127.2	157.8	62.3	0	0	0	0	109.6	N180 I184	N180-S182 PolarHBondContact O-N 3.42Å; S182-I184 PolarHBondContact O-N 2.9Å
183	T	33.5	Very low	38.2	Very low	137 Å²	137	152.6 Å²	152.6	84%	0.84	80%	0.798	S	S	*	*			trans	-66.8	117.5	-178.3	38.3	0	0	0	0	111
184	I	36.6	Very low	40.3	Very low	131 Å²	131	145.3 Å²	145.3	67%	0.672	78%	0.779	S	S	*	*			trans	-129.6	106.7	158.5	-60.6	-179.9	0	0	0	107.2	S182 K186	S182-I184 PolarHBondContact O-N 2.9Å; I184-K186 HydrophobicContact CG2-CD 4.42Å; I184-K186 HydrophobicContact CG2-CG 4.05Å; I184-K186 PolarHBondContact O-N 3.27Å
185	Q	34.6	Very low	41.8	Very low	199 Å²	199	147.7 Å²	147.7	93%	0.93	78%	0.776	S	S	*	*			trans	-60.6	104.2	162.3	-66.9	178.6	7.6	0	0	107.7
186	K	41.7	Very low	43.8	Very low	177 Å²	177	143.8 Å²	143.8	77%	0.77	76%	0.761	S	S	*	*			trans	-114.9	106.9	167.5	-102.7	178.7	179.6	177.8	0	109.2	I184 S188	I184-K186 HydrophobicContact CG2-CD 4.42Å; I184-K186 HydrophobicContact CG2-CG 4.05Å; I184-K186 PolarHBondContact O-N 3.27Å; K186-S188 PolarHBondContact O-N 3.35Å
187	K	31.6	Very low	45.5	Very low	217 Å²	217	136.6 Å²	136.6	94%	0.943	73%	0.729	S	S	*	*			trans	-62.7	115.1	160.9	-136.8	175.4	-175.9	178.3	0	106.8
188	S	39.8	Very low	47	Very low	96 Å²	96	132.7 Å²	132.7	67%	0.671	71%	0.706	S	S	*	*			trans	-156.2	109.2	167.9	59.2	0	0	0	0	112	K186	K186-S188 PolarHBondContact O-N 3.35Å
189	N	40.7	Very low	48.6	Very low	153 Å²	153	130.1 Å²	130.1	82%	0.818	69%	0.688	S	S	*	*			trans	25.5	128.3	145.6	-53	-15.3	0	0	0	117.9	S191	N189-S191 VanDerWaalsContact C-N 3.3Å; N189-S191 PolarHBondContact O-N 3.38Å
190	N	40.3	Very low	49.9	Very low	172 Å²	172	129.7 Å²	129.7	92%	0.92	68%	0.681	S	S	*	*			trans	-45.9	87	170.9	-61.9	-23.6	0	0	0	111.8	I192	N190-I192 PolarHBondContact O-N 3.39Å
191	S	50.8	Low	51.1	Low	111 Å²	111	128.9 Å²	128.9	78%	0.776	67%	0.668	S	S	*	*			trans	-85.7	109.8	175.5	-174.5	0	0	0	0	107.5	N189 M193	N189-S191 VanDerWaalsContact C-N 3.3Å; N189-S191 PolarHBondContact O-N 3.38Å; S191-M193 PolarHBondContact O-N 3.43Å
192	I	63.1	Low	52.4	Low	161 Å²	161	119.4 Å²	119.4	83%	0.826	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-59.2	121.3	168.7	-61.4	172.6	0	0	0	106.8	N190 T194	N190-I192 PolarHBondContact O-N 3.39Å; I192-T194 PolarHBondContact O-N 3.04Å
193	M	68	Low	53.4	Low	94 Å²	94	117.8 Å²	117.8	46%	0.463	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-64.4	131.4	-179.9	-163.2	149.2	87.5	0	0	109.2	S191 M198 Y201	S191-M193 PolarHBondContact O-N 3.43Å; M193-M198 HydrophobicContact CE-CB 4.48Å; M193-M198 HydrophobicContact CE-CG 3.95Å; M193-Y201 HydrophobicContact CE-CD2 4.42Å; M193-Y201 HydrophobicContact CE-CG 4.04Å
194	T	72.3	Confident	54.3	Low	88 Å²	88	117.4 Å²	117.4	54%	0.54	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-65.3	157.5	177.5	58.8	0	0	0	0	111	I192 S196 G197 M198	I192-T194 PolarHBondContact O-N 3.04Å; T194-S196 PolarHBondContact O-N 2.96Å; T194-S196 VanDerWaalsContact O-N 3.16Å; T194-S196 PolarHBondContact OG1-OG 3.4Å; T194-G197 WeakPolarHBondContact O-CA 3.32Å; T194-G197 PolarHBondContact O-N 3.33Å; T194-G197 PolarHBondContact OG1-N 3Å; T194-M198 PolarHBondContact O-N 3.49Å
195	D	65.1	Low	55	Low	117 Å²	117	116.1 Å²	116.1	63%	0.626	60%	0.599	S	S	*	*	H	α-helix	trans	-53.1	-37.3	176.7	-69.1	-21.2	0	0	0	112.5	M198 F199	D195-M198 PolarHBondContact O-N 2.91Å; D195-F199 PolarHBondContact O-N 3.15Å
196	S	70.2	Confident	56	Low	75 Å²	75	113 Å²	113	52%	0.524	59%	0.588	S	S	.	*	H	α-helix	trans	-65.9	-40.9	173.9	52.4	0	0	0	0	112.7	T194 M198 F199 N200	T194-S196 PolarHBondContact O-N 2.96Å; T194-S196 VanDerWaalsContact O-N 3.16Å; T194-S196 PolarHBondContact OG1-OG 3.4Å; S196-M198 VanDerWaalsContact C-N 3.34Å; S196-F199 PolarHBondContact O-N 3.27Å; S196-N200 PolarHBondContact O-N 3.41Å; S196-N200 VanDerWaalsContact O-N 3.09Å
197	G	68.7	Low	56.6	Low	20 Å²	20	112.5 Å²	112.5	21%	0.206	59%	0.589	C	S	.	*	H	α-helix	trans	-62.2	-41	174.4	0	0	0	0	0	111.9	T194 N200 Y201	T194-G197 WeakPolarHBondContact O-CA 3.32Å; T194-G197 PolarHBondContact O-N 3.33Å; T194-G197 PolarHBondContact OG1-N 3Å; G197-N200 PolarHBondContact O-N 3.4Å; G197-Y201 WeakPolarHBondContact O-CB 3.48Å; G197-Y201 PolarHBondContact O-N 3.35Å
198	M	67.2	Low	57.6	Low	52 Å²	52	106.5 Å²	106.5	26%	0.256	57%	0.567	S	S	.	*	H	α-helix	trans	-62.2	-43.2	173.3	-84	-148.1	76.6	0	0	112.9	M193 T194 D195 S196 Y201 R202	M193-M198 HydrophobicContact CE-CB 4.48Å; M193-M198 HydrophobicContact CE-CG 3.95Å; T194-M198 PolarHBondContact O-N 3.49Å; D195-M198 PolarHBondContact O-N 2.91Å; S196-M198 VanDerWaalsContact C-N 3.34Å; M198-Y201 PolarHBondContact O-N 3.47Å; M198-R202 WeakPolarHBondContact O-CG 3.47Å; M198-R202 PolarHBondContact O-N 3.31Å
199	F	62.6	Low	57.9	Low	109 Å²	109	110.7 Å²	110.7	48%	0.478	57%	0.568	S	S	.	*	H	α-helix	trans	-62.6	-42.2	178	-107.2	-82.3	0	0	0	112.6	Y36 D195 S196 R202 S203	Y36-F199 HydrophobicContact CE1-CE2 4.28Å; Y36-F199 HydrophobicContact CE1-CZ 4.45Å; Y36-F199 HydrophobicContact CE2-CE2 4.48Å; D195-F199 PolarHBondContact O-N 3.15Å; S196-F199 PolarHBondContact O-N 3.27Å; F199-R202 PolarHBondContact O-N 3.42Å; F199-S203 PolarHBondContact O-N 2.94Å; F199-S203 VanDerWaalsContact O-N 3.12Å; F199-S203 PolarHBondContact O-OG 3.47Å
200	N	63.3	Low	58.3	Low	116 Å²	116	107 Å²	107	62%	0.62	55%	0.554	S	S	*	*	H	α-helix	trans	-68	-42.2	177.9	-72.3	-18.5	0	0	0	111.9	S196 G197 R202 S203 F204	S196-N200 PolarHBondContact O-N 3.41Å; S196-N200 VanDerWaalsContact O-N 3.09Å; G197-N200 PolarHBondContact O-N 3.4Å; N200-R202 VanDerWaalsContact C-N 3.33Å; N200-R202 PolarHBondContact O-N 3.44Å; N200-S203 PolarHBondContact O-N 2.92Å; N200-F204 WeakPolarHBondContact O-CB 3.39Å; N200-F204 PolarHBondContact O-N 2.89Å
201	Y	59.8	Low	58.9	Low	131 Å²	131	109.1 Å²	109.1	51%	0.514	56%	0.555	S	S	.	*	H	α-helix	trans	-59.9	-43.6	176	-168	-89.7	0	0	0	111.6	M193 G197 M198 S203 F204 E205	M193-Y201 HydrophobicContact CE-CD2 4.42Å; M193-Y201 HydrophobicContact CE-CG 4.04Å; G197-Y201 WeakPolarHBondContact O-CB 3.48Å; G197-Y201 PolarHBondContact O-N 3.35Å; M198-Y201 PolarHBondContact O-N 3.47Å; Y201-S203 VanDerWaalsContact C-N 3.34Å; Y201-S203 PolarHBondContact O-N 3.28Å; Y201-F204 PolarHBondContact O-N 2.94Å; Y201-E205 WeakPolarHBondContact CE1-OE2 3.38Å; Y201-E205 WeakPolarHBondContact O-CB 3.38Å; Y201-E205 PolarHBondContact O-N 2.93Å
202	R	56.3	Low	59.2	Low	54 Å²	54	112.6 Å²	112.6	20%	0.204	56%	0.559	C	S	.	*	H	α-helix	trans	-60.3	-41.4	175.2	-75.4	173.8	-176.6	-103.2	1.8	113	S37 N40 M198 F199 N200 F204 L206	S37-R202 PolarHBondContact O-NH2 3.42Å; N40-R202 PolarHBondContact OD1-NH1 3.48Å; M198-R202 WeakPolarHBondContact O-CG 3.47Å; M198-R202 PolarHBondContact O-N 3.31Å; F199-R202 PolarHBondContact O-N 3.42Å; N200-R202 VanDerWaalsContact C-N 3.33Å; N200-R202 PolarHBondContact O-N 3.44Å; R202-F204 VanDerWaalsContact C-N 3.34Å; R202-L206 WeakPolarHBondContact O-CG 3.35Å; R202-L206 PolarHBondContact O-N 2.99Å
203	S	54.3	Low	58.9	Low	64 Å²	64	108.6 Å²	108.6	45%	0.448	54%	0.542	S	S	.	.	H	α-helix	trans	-68.5	-37.5	-178.8	-55.6	0	0	0	0	111.2	F199 N200 Y201	F199-S203 PolarHBondContact O-N 2.94Å; F199-S203 VanDerWaalsContact O-N 3.12Å; F199-S203 PolarHBondContact O-OG 3.47Å; N200-S203 PolarHBondContact O-N 2.92Å; Y201-S203 VanDerWaalsContact C-N 3.34Å; Y201-S203 PolarHBondContact O-N 3.28Å
204	F	52.6	Low	58.5	Low	128 Å²	128	111.5 Å²	111.5	56%	0.561	55%	0.549	S	S	*	.	H	α-helix	trans	-69.9	-41	176.3	-172.3	-100.8	0	0	0	112.7	N200 Y201 R202 L206 Q207 N208	N200-F204 WeakPolarHBondContact O-CB 3.39Å; N200-F204 PolarHBondContact O-N 2.89Å; Y201-F204 PolarHBondContact O-N 2.94Å; R202-F204 VanDerWaalsContact C-N 3.34Å; F204-L206 VanDerWaalsContact C-N 3.32Å; F204-L206 PolarHBondContact O-N 3.21Å; F204-Q207 PolarHBondContact O-N 3.03Å; F204-N208 WeakPolarHBondContact CE1-ND2 3.13Å; F204-N208 VanDerWaalsContact CE2-ND2 3.35Å; F204-N208 WeakPolarHBondContact CE2-ND2 3.41Å; F204-N208 WeakPolarHBondContact CZ-ND2 3.42Å; F204-N208 PolarHBondContact O-N 3.44Å; F204-N208 VanDerWaalsContact O-N 3.15Å
205	E	52.3	Low	58.4	Low	104 Å²	104	108.9 Å²	108.9	49%	0.486	53%	0.534	S	S	.	.	H	α-helix	trans	-68.1	-30.9	-178.9	-163.6	164.6	-155	0	0	112.6	Y201	Y201-E205 WeakPolarHBondContact CE1-OE2 3.38Å; Y201-E205 WeakPolarHBondContact O-CB 3.38Å; Y201-E205 PolarHBondContact O-N 2.93Å
206	L	55	Low	58.8	Low	135 Å²	135	112.5 Å²	112.5	71%	0.707	54%	0.541	S	S	*	.	H	α-helix	trans	-69.8	-32.3	173.6	-71.8	176	0	0	0	113	R202 F204	R202-L206 WeakPolarHBondContact O-CG 3.35Å; R202-L206 PolarHBondContact O-N 2.99Å; F204-L206 VanDerWaalsContact C-N 3.32Å; F204-L206 PolarHBondContact O-N 3.21Å
207	Q	55.3	Low	58.6	Low	165 Å²	165	113.8 Å²	113.8	77%	0.771	54%	0.541	S	S	*	.	H	α-helix	trans	-81	-27.9	179.8	-71.2	179.9	-4.8	0	0	113	F204	F204-Q207 PolarHBondContact O-N 3.03Å
208	N	51.4	Low	58.6	Low	91 Å²	91	115.9 Å²	115.9	49%	0.487	55%	0.547	S	S	.	.			trans	-98.7	17.1	-176	-79.2	-28.6	0	0	0	115.5	F204 S210	F204-N208 WeakPolarHBondContact CE1-ND2 3.13Å; F204-N208 VanDerWaalsContact CE2-ND2 3.35Å; F204-N208 WeakPolarHBondContact CE2-ND2 3.41Å; F204-N208 WeakPolarHBondContact CZ-ND2 3.42Å; F204-N208 PolarHBondContact O-N 3.44Å; F204-N208 VanDerWaalsContact O-N 3.15Å; N208-S210 PolarHBondContact O-N 3.01Å
209	R	46.6	Very low	58.8	Low	185 Å²	185	114.1 Å²	114.1	70%	0.698	54%	0.541	S	S	*	.			trans	-69.6	74.5	166.2	-84.9	-175.1	165.9	-170.1	-1.5	110.4
210	S	49.1	Very low	59.2	Low	74 Å²	74	111.6 Å²	111.6	52%	0.517	53%	0.534	S	S	.	.			trans	-61.8	142.8	159.6	71.9	0	0	0	0	108.1	N208 Q212 T213	N208-S210 PolarHBondContact O-N 3.01Å; S210-Q212 PolarHBondContact O-N 3.45Å; S210-T213 PolarHBondContact O-N 2.89Å
211	K	53.3	Low	59.3	Low	217 Å²	217	114.3 Å²	114.3	94%	0.943	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	7.5	-168.4	-66.3	175.7	176.9	176	0	115.5
212	Q	57.2	Low	59.6	Low	184 Å²	184	114 Å²	114	86%	0.86	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.7	-1.9	-172.3	-75.2	175.6	-16.4	0	0	114.9	S210 Y214	S210-Q212 PolarHBondContact O-N 3.45Å; Q212-Y214 PolarHBondContact O-N 3.09Å
213	T	55.4	Low	59.9	Low	78 Å²	78	118.4 Å²	118.4	48%	0.479	57%	0.566	S	S	.	*	S	Bend	trans	-76.1	123	178.7	58.3	0	0	0	0	111.3	S210 S215	S210-T213 PolarHBondContact O-N 2.89Å; T213-S215 PolarHBondContact O-N 3.12Å
214	Y	60.5	Low	60.2	Low	154 Å²	154	120.5 Å²	120.5	60%	0.604	57%	0.572	S	S	*	*			trans	-47	97.2	173.6	-174	-99.9	0	0	0	111.2	Q212 A219	Q212-Y214 PolarHBondContact O-N 3.09Å; Y214-A219 HydrophobicContact CD1-CB 4.44Å; Y214-A219 HydrophobicContact CE1-CB 3.55Å; Y214-A219 HydrophobicContact CE2-CB 4.17Å; Y214-A219 VanDerWaalsContact OH-CB 3.23Å; Y214-A219 WeakPolarHBondContact OH-CB 3.48Å
215	S	69.7	Low	60.3	Low	33 Å²	33	119.2 Å²	119.2	23%	0.231	58%	0.578	C	S	.	*			trans	-82.1	152.9	175.7	75.1	0	0	0	0	109.9	T213 I217 N218 A219	T213-S215 PolarHBondContact O-N 3.12Å; S215-I217 PolarHBondContact O-N 3.3Å; S215-I217 VanDerWaalsContact O-N 3.11Å; S215-I217 PolarHBondContact OG-N 3.42Å; S215-N218 CarbonylContact O-C 3.59Å; S215-N218 WeakPolarHBondContact O-CA 3.33Å; S215-N218 WeakPolarHBondContact O-CB 3.44Å; S215-N218 PolarHBondContact O-N 3.05Å; S215-N218 PolarHBondContact OG-N 3.26Å; S215-A219 PolarHBondContact O-N 2.75Å
216	Y	73.4	Confident	60.1	Low	194 Å²	194	122.7 Å²	122.7	76%	0.761	59%	0.593	S	S	*	*	H	α-helix	trans	-51.1	-34.5	170	-179.7	-103	0	0	0	111.8	A219 V220	Y216-A219 WeakPolarHBondContact O-CB 3.47Å; Y216-A219 PolarHBondContact O-N 3.15Å; Y216-V220 HydrophobicContact CD1-CG2 4.18Å; Y216-V220 HydrophobicContact CE1-CG2 3.83Å; Y216-V220 HydrophobicContact CE2-CG2 4.26Å; Y216-V220 VanDerWaalsContact O-CG2 3.26Å; Y216-V220 WeakPolarHBondContact O-CG2 3.38Å; Y216-V220 PolarHBondContact O-N 2.73Å
217	I	67.3	Low	59.8	Low	102 Å²	102	122.2 Å²	122.2	52%	0.523	60%	0.596	S	S	.	*	H	α-helix	trans	-65.6	-41.4	175.1	-63.6	170	0	0	0	111.5	S215 R221	S215-I217 PolarHBondContact O-N 3.3Å; S215-I217 VanDerWaalsContact O-N 3.11Å; S215-I217 PolarHBondContact OG-N 3.42Å; I217-R221 WeakPolarHBondContact O-CG 3.37Å; I217-R221 PolarHBondContact O-N 2.96Å
218	N	68.1	Low	59.3	Low	63 Å²	63	123.1 Å²	123.1	34%	0.337	59%	0.593	S	S	.	*	H	α-helix	trans	-68.2	-36.8	173.7	-79.9	-1.3	0	0	0	111.8	S215 R221 N222	S215-N218 CarbonylContact O-C 3.59Å; S215-N218 WeakPolarHBondContact O-CA 3.33Å; S215-N218 WeakPolarHBondContact O-CB 3.44Å; S215-N218 PolarHBondContact O-N 3.05Å; S215-N218 PolarHBondContact OG-N 3.26Å; N218-R221 PolarHBondContact O-N 3.22Å; N218-N222 WeakPolarHBondContact O-CB 2.96Å; N218-N222 PolarHBondContact O-N 3.17Å
219	A	70.7	Confident	59	Low	15 Å²	15	126.2 Å²	126.2	12%	0.124	61%	0.608	C	S	.	*	H	α-helix	trans	-60.3	-49.9	174.7	0	0	0	0	0	110.9	Y214 S215 Y216 R221 N222 H223	Y214-A219 HydrophobicContact CD1-CB 4.44Å; Y214-A219 HydrophobicContact CE1-CB 3.55Å; Y214-A219 HydrophobicContact CE2-CB 4.17Å; Y214-A219 VanDerWaalsContact OH-CB 3.23Å; Y214-A219 WeakPolarHBondContact OH-CB 3.48Å; S215-A219 PolarHBondContact O-N 2.75Å; Y216-A219 WeakPolarHBondContact O-CB 3.47Å; Y216-A219 PolarHBondContact O-N 3.15Å; A219-R221 PolarHBondContact O-N 3.2Å; A219-N222 PolarHBondContact O-N 3.27Å; A219-H223 WeakPolarHBondContact O-CB 3.35Å; A219-H223 PolarHBondContact O-N 3.44Å
220	V	72.9	Confident	59.3	Low	57 Å²	57	130.1 Å²	130.1	35%	0.345	62%	0.623	S	S	.	*	H	α-helix	trans	-62.7	-40.7	178.8	172.4	0	0	0	0	111.3	Y216 N224	Y216-V220 HydrophobicContact CD1-CG2 4.18Å; Y216-V220 HydrophobicContact CE1-CG2 3.83Å; Y216-V220 HydrophobicContact CE2-CG2 4.26Å; Y216-V220 VanDerWaalsContact O-CG2 3.26Å; Y216-V220 WeakPolarHBondContact O-CG2 3.38Å; Y216-V220 PolarHBondContact O-N 2.73Å; V220-N224 WeakPolarHBondContact O-CB 3.35Å; V220-N224 PolarHBondContact O-N 3.31Å
221	R	64.4	Low	59.8	Low	173 Å²	173	132.9 Å²	132.9	65%	0.653	63%	0.628	S	S	*	*	H	α-helix	trans	-65	-42.1	175.4	-77.5	-175.4	-155.4	149	2.4	113.2	I217 N218 A219	I217-R221 WeakPolarHBondContact O-CG 3.37Å; I217-R221 PolarHBondContact O-N 2.96Å; N218-R221 PolarHBondContact O-N 3.22Å; A219-R221 PolarHBondContact O-N 3.2Å
222	N	66.3	Low	60.2	Low	123 Å²	123	128.5 Å²	128.5	66%	0.658	61%	0.612	S	S	*	*	H	α-helix	trans	-77.2	-32.1	-177.1	-78.8	-15.2	0	0	0	112.8	N218 A219	N218-N222 WeakPolarHBondContact O-CB 2.96Å; N218-N222 PolarHBondContact O-N 3.17Å; A219-N222 PolarHBondContact O-N 3.27Å
223	H	62.4	Low	60.3	Low	148 Å²	148	125.4 Å²	125.4	69%	0.685	60%	0.598	S	S	*	*	H	α-helix	trans	-83.4	-28.7	-179.5	-108.6	-76	0	0	0	113.9	A219	A219-H223 WeakPolarHBondContact O-CB 3.35Å; A219-H223 PolarHBondContact O-N 3.44Å
224	N	60.3	Low	60.6	Low	107 Å²	107	128.2 Å²	128.2	57%	0.572	61%	0.605	S	S	*	*	S	Bend	trans	-99.4	28.8	-174	-69.8	-22.9	0	0	0	114.4	V220 H226	V220-N224 WeakPolarHBondContact O-CB 3.35Å; V220-N224 PolarHBondContact O-N 3.31Å; N224-H226 CarbonylContact O-C 3.48Å; N224-H226 PolarHBondContact O-N 3.44Å
225	C	55	Low	60.6	Low	102 Å²	102	126.6 Å²	126.6	69%	0.689	61%	0.605	S	S	*	*			trans	17.3	73.3	162	-51.6	0	0	0	0	113.9
226	H	48.5	Very low	60	Low	177 Å²	177	132.8 Å²	132.8	82%	0.819	63%	0.63	S	S	*	*			trans	59.3	100.1	176.8	-64.2	-93.7	0	0	0	117.7	N224	N224-H226 CarbonylContact O-C 3.48Å; N224-H226 PolarHBondContact O-N 3.44Å
227	T	47.5	Very low	59.1	Low	125 Å²	125	128.4 Å²	128.4	77%	0.767	62%	0.621	S	S	*	*				-131.3	101.6	124.1	45.6	0	0	0	0	108.4	L229	T227-L229 PolarHBondContact O-N 3.37Å; T227-L229 VanDerWaalsContact O-N 3.1Å
228	R	46.3	Very low	58.4	Low	184 Å²	184	130.5 Å²	130.5	69%	0.694	63%	0.628	S	S	*	*			trans	-61.1	104.1	167.6	177.2	176.3	169.2	156.1	-0.4	107.5	W230	R228-W230 VanDerWaalsContact NE-CZ3 3.34Å; R228-W230 VanDerWaalsContact NH2-CZ3 3.33Å
229	L	43.4	Very low	57.6	Low	155 Å²	155	136.1 Å²	136.1	81%	0.812	65%	0.653	S	S	*	*			trans	-101.1	120.9	158.3	-68.2	175.6	0	0	0	106.3	T227	T227-L229 PolarHBondContact O-N 3.37Å; T227-L229 VanDerWaalsContact O-N 3.1Å
230	W	53.6	Low	56.4	Low	267 Å²	267	147.1 Å²	147.1	100%	1.011	70%	0.701	S	S	*	*			trans	-56.8	0	177.9	-31.8	81.6	0	0	0	111.5	R228	R228-W230 VanDerWaalsContact NE-CZ3 3.34Å; R228-W230 VanDerWaalsContact NH2-CZ3 3.33Å

Retrieved 230 of 230 residues in 47 ms (Link to these results)

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