A0A077ZM01_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZM01, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 211 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	55.5	Low	80.7	Confident	163 Å²	163	103.5 Å²	103.5	80%	0.803	48%	0.48	S	S	*	.				0	175.7	0	-75.4	-163	-166.6	0	0	113.6	N53 E56	M1-N53 WeakPolarHBondContact CE-ND2 3.23Å; M1-N53 HydrophobicContact SD-CB 4.37Å; M1-N53 PolarHBondContact SD-ND2 3.32Å; M1-E56 WeakPolarHBondContact CB-OE2 3.36Å; M1-E56 WeakPolarHBondContact CG-OE2 3.44Å; M1-E56 PolarHBondContact N-OE1 2.93Å
2	S	62.4	Low	81.5	Confident	56 Å²	56	101.8 Å²	101.8	39%	0.392	47%	0.473	S	S	.	.			trans	-77.5	135.3	-145.7	-169.8	0	0	0	0	115.8	R4 T5	S2-R4 PolarHBondContact O-N 3.48Å; S2-R4 WeakPolarHBondContact OG-CB 3.49Å; S2-R4 WeakPolarHBondContact OG-CG 3.36Å; S2-R4 PolarHBondContact OG-N 3.04Å; S2-T5 PolarHBondContact O-N 2.83Å
3	I	73.6	Confident	82.4	Confident	140 Å²	140	94.2 Å²	94.2	72%	0.718	44%	0.437	S	S	*	.	H	α-helix	trans	-40.8	-31.1	162.8	-66.4	166.9	0	0	0	112.2	K6 R7	I3-K6 PolarHBondContact O-N 3.22Å; I3-R7 WeakPolarHBondContact O-CB 3.33Å; I3-R7 PolarHBondContact O-N 3.28Å
4	R	82.1	Confident	83.1	Confident	194 Å²	194	89 Å²	89	73%	0.732	41%	0.413	S	S	*	.	H	α-helix	trans	-60.8	-43.1	176.2	-62.1	178.5	-177.4	179.7	0.1	113	S2 R7 K8	S2-R4 PolarHBondContact O-N 3.48Å; S2-R4 WeakPolarHBondContact OG-CB 3.49Å; S2-R4 WeakPolarHBondContact OG-CG 3.36Å; S2-R4 PolarHBondContact OG-N 3.04Å; R4-R7 PolarHBondContact O-N 2.78Å; R4-K8 WeakPolarHBondContact O-CG 3.46Å; R4-K8 PolarHBondContact O-N 3.34Å
5	T	83.3	Confident	83.6	Confident	57 Å²	57	89.5 Å²	89.5	35%	0.35	41%	0.414	S	S	.	.	H	α-helix	trans	-66.7	-45.2	179.4	-53.2	0	0	0	0	110.7	S2 R7 K8 I9 I57	S2-T5 PolarHBondContact O-N 2.83Å; T5-R7 VanDerWaalsContact C-N 3.31Å; T5-R7 PolarHBondContact O-N 3.04Å; T5-K8 PolarHBondContact O-N 2.8Å; T5-I9 HydrophobicContact CG2-CD1 4.16Å; T5-I9 WeakPolarHBondContact O-CG1 3.34Å; T5-I9 PolarHBondContact O-N 3.11Å; T5-I9 VanDerWaalsContact O-N 3.08Å; T5-I57 HydrophobicContact CG2-CD1 4.23Å
6	K	85.6	Confident	84.1	Confident	68 Å²	68	86.3 Å²	86.3	30%	0.296	40%	0.401	S	S	.	.	H	α-helix	trans	-59.4	-43.1	176.1	-174.8	177.7	-177.5	178.2	0	111.6	I3 I9 L10	I3-K6 PolarHBondContact O-N 3.22Å; K6-I9 PolarHBondContact O-N 3.11Å; K6-L10 HydrophobicContact CG-CD1 4.21Å; K6-L10 WeakPolarHBondContact O-CG 3.38Å; K6-L10 PolarHBondContact O-N 2.97Å
7	R	86.8	Confident	84.5	Confident	155 Å²	155	81.2 Å²	81.2	59%	0.585	38%	0.377	S	S	*	.	H	α-helix	trans	-60.5	-48.9	177.3	-177.3	-177.1	-63.6	-125.7	1.6	111.8	I3 R4 T5 I9 L10 E11	I3-R7 WeakPolarHBondContact O-CB 3.33Å; I3-R7 PolarHBondContact O-N 3.28Å; R4-R7 PolarHBondContact O-N 2.78Å; T5-R7 VanDerWaalsContact C-N 3.31Å; T5-R7 PolarHBondContact O-N 3.04Å; R7-I9 VanDerWaalsContact C-N 3.32Å; R7-I9 PolarHBondContact O-N 3.11Å; R7-L10 PolarHBondContact O-N 3.39Å; R7-L10 VanDerWaalsContact O-N 3.14Å; R7-E11 WeakPolarHBondContact CD-OE1 3.48Å; R7-E11 HydrophobicContact CG-CG 4.42Å; R7-E11 VanDerWaalsContact CG-OE1 3.23Å; R7-E11 WeakPolarHBondContact CG-OE1 3.5Å; R7-E11 WeakPolarHBondContact O-CG 3.49Å; R7-E11 PolarHBondContact O-N 3.01Å
8	K	89.4	Confident	84.8	Confident	145 Å²	145	76.7 Å²	76.7	63%	0.63	36%	0.356	S	S	*	.	H	α-helix	trans	-57.8	-42.9	177.8	-73.3	-178.6	176.1	-169.2	0	112.5	R4 T5 E11 E12	R4-K8 WeakPolarHBondContact O-CG 3.46Å; R4-K8 PolarHBondContact O-N 3.34Å; T5-K8 PolarHBondContact O-N 2.8Å; K8-E11 PolarHBondContact O-N 3.08Å; K8-E12 PolarHBondContact O-N 3.12Å
9	I	89.8	Confident	85	Confident	14 Å²	14	73.2 Å²	73.2	7%	0.072	34%	0.34	C	S	.	.	H	α-helix	trans	-63.9	-41.8	177.2	-67	168.8	0	0	0	111.1	T5 K6 R7 M13 Y44 L47 I57	T5-I9 HydrophobicContact CG2-CD1 4.16Å; T5-I9 WeakPolarHBondContact O-CG1 3.34Å; T5-I9 PolarHBondContact O-N 3.11Å; T5-I9 VanDerWaalsContact O-N 3.08Å; K6-I9 PolarHBondContact O-N 3.11Å; R7-I9 VanDerWaalsContact C-N 3.32Å; R7-I9 PolarHBondContact O-N 3.11Å; I9-M13 VanDerWaalsContact O-CB 3.23Å; I9-M13 WeakPolarHBondContact O-CB 3.49Å; I9-M13 PolarHBondContact O-N 2.82Å; I9-Y44 HydrophobicContact CB-CE2 4.38Å; I9-Y44 HydrophobicContact CG2-CD2 3.66Å; I9-Y44 HydrophobicContact CG2-CE2 3.46Å; I9-Y44 VanDerWaalsContact CG2-CE2 3.46Å; I9-Y44 HydrophobicContact CG2-CG 4.44Å; I9-L47 HydrophobicContact CG2-CB 3.85Å; I9-L47 HydrophobicContact CG2-CD1 4.36Å; I9-I57 HydrophobicContact CD1-CD1 3.41Å; I9-I57 VanDerWaalsContact CD1-CD1 3.41Å; I9-I57 HydrophobicContact CD1-CG1 4.21Å; I9-I57 HydrophobicContact CD1-CG2 4.22Å
10	L	89.4	Confident	85.3	Confident	43 Å²	43	72 Å²	72	23%	0.225	33%	0.332	C	S	.	.	H	α-helix	trans	-64.3	-43.5	176.7	-71.1	169.6	0	0	0	111.7	K6 R7 M13 E14 Y44 F60	K6-L10 HydrophobicContact CG-CD1 4.21Å; K6-L10 WeakPolarHBondContact O-CG 3.38Å; K6-L10 PolarHBondContact O-N 2.97Å; R7-L10 PolarHBondContact O-N 3.39Å; R7-L10 VanDerWaalsContact O-N 3.14Å; L10-M13 PolarHBondContact O-N 3.46Å; L10-E14 WeakPolarHBondContact O-CB 3.48Å; L10-E14 VanDerWaalsContact O-CG 3.31Å; L10-E14 WeakPolarHBondContact O-CG 3.48Å; L10-E14 PolarHBondContact O-N 3.41Å; L10-Y44 HydrophobicContact CD2-CD2 4.06Å; L10-Y44 HydrophobicContact CD2-CE2 3.62Å; L10-Y44 HydrophobicContact CG-CE2 4.11Å; L10-F60 HydrophobicContact CD2-CD2 3.55Å; L10-F60 HydrophobicContact CD2-CE2 3.79Å
11	E	89.6	Confident	85.4	Confident	103 Å²	103	68.6 Å²	68.6	48%	0.481	32%	0.316	S	S	.	.	H	α-helix	trans	-61.9	-45.9	177.8	-72.5	168.2	-176.6	0	0	111.7	R7 K8 E14 K15	R7-E11 WeakPolarHBondContact CD-OE1 3.48Å; R7-E11 HydrophobicContact CG-CG 4.42Å; R7-E11 VanDerWaalsContact CG-OE1 3.23Å; R7-E11 WeakPolarHBondContact CG-OE1 3.5Å; R7-E11 WeakPolarHBondContact O-CG 3.49Å; R7-E11 PolarHBondContact O-N 3.01Å; K8-E11 PolarHBondContact O-N 3.08Å; E11-E14 PolarHBondContact O-N 3.48Å; E11-K15 WeakPolarHBondContact O-CB 3.4Å; E11-K15 PolarHBondContact O-N 2.87Å
12	E	91.3	Very high	86.8	Confident	84 Å²	84	62.2 Å²	62.2	39%	0.393	29%	0.285	S	S	.	.	H	α-helix	trans	-67.5	-38.7	175.4	-74.4	-59	156.6	0	0	112.2	K8 E14 K15 L16 L47	K8-E12 PolarHBondContact O-N 3.12Å; E12-E14 VanDerWaalsContact C-N 3.31Å; E12-E14 PolarHBondContact O-N 3.48Å; E12-K15 PolarHBondContact O-N 2.99Å; E12-K15 IonicContact OE1-NZ 3.73Å; E12-K15 IonicContact OE2-NZ 3.44Å; E12-K15 PolarHBondContact OE2-NZ 3.25Å; E12-L16 WeakPolarHBondContact O-CB 3.38Å; E12-L16 WeakPolarHBondContact O-CG 3.29Å; E12-L16 PolarHBondContact O-N 3.34Å; E12-L47 HydrophobicContact CB-CD1 3.88Å
13	M	93.1	Very high	87.8	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-58.8	-44.5	173.8	-175.3	-119.3	74.7	0	0	111.1	I9 L10 L16 L17 A40 I43 Y44 L47 F60	I9-M13 VanDerWaalsContact O-CB 3.23Å; I9-M13 WeakPolarHBondContact O-CB 3.49Å; I9-M13 PolarHBondContact O-N 2.82Å; L10-M13 PolarHBondContact O-N 3.46Å; M13-L16 PolarHBondContact O-N 3.19Å; M13-L17 HydrophobicContact CE-CB 3.99Å; M13-L17 HydrophobicContact CE-CD2 3.72Å; M13-L17 WeakPolarHBondContact O-CB 3.42Å; M13-L17 PolarHBondContact O-N 3.46Å; M13-A40 HydrophobicContact CE-CB 4.29Å; M13-A40 HydrophobicContact SD-CB 3.96Å; M13-I43 HydrophobicContact CB-CG2 4.06Å; M13-I43 HydrophobicContact CG-CB 4.05Å; M13-I43 HydrophobicContact CG-CG2 3.71Å; M13-Y44 HydrophobicContact CB-CD2 4.47Å; M13-Y44 HydrophobicContact CG-CD2 4.49Å; M13-L47 HydrophobicContact CB-CD1 3.97Å; M13-F60 HydrophobicContact SD-CD1 4.41Å; M13-F60 HydrophobicContact SD-CE1 4.08Å; M13-F60 HydrophobicContact SD-CE2 4.34Å; M13-F60 HydrophobicContact SD-CZ 4.04Å
14	E	91.7	Very high	88.3	Confident	22 Å²	22	55.2 Å²	55.2	10%	0.103	24%	0.243	C	C	.	.	H	α-helix	trans	-66.2	-41.2	-179.6	-74.6	-176.9	-170.5	0	0	111.6	L10 E11 E12 L17 S18 F70 R73 Y74	L10-E14 WeakPolarHBondContact O-CB 3.48Å; L10-E14 VanDerWaalsContact O-CG 3.31Å; L10-E14 WeakPolarHBondContact O-CG 3.48Å; L10-E14 PolarHBondContact O-N 3.41Å; E11-E14 PolarHBondContact O-N 3.48Å; E12-E14 VanDerWaalsContact C-N 3.31Å; E12-E14 PolarHBondContact O-N 3.48Å; E14-L17 PolarHBondContact O-N 3.26Å; E14-S18 WeakPolarHBondContact O-CB 3.33Å; E14-S18 PolarHBondContact O-N 3.08Å; E14-F70 HydrophobicContact CB-CD2 4.03Å; E14-F70 HydrophobicContact CB-CE2 4.09Å; E14-F70 HydrophobicContact CG-CD2 3.81Å; E14-F70 HydrophobicContact CG-CE2 4.32Å; E14-R73 IonicContact OE1-CZ 3.19Å; E14-R73 IonicContact OE1-NE 3.83Å; E14-R73 IonicContact OE1-NH2 2.76Å; E14-R73 PolarHBondContact OE1-NH2 2.96Å; E14-R73 IonicContact OE2-CZ 2.79Å; E14-R73 VanDerWaalsContact OE2-CZ 3.26Å; E14-R73 IonicContact OE2-NE 2.75Å; E14-R73 PolarHBondContact OE2-NE 3.34Å; E14-R73 IonicContact OE2-NH2 3.92Å; E14-R73 PolarHBondContact OE2-NH2 2.75Å; E14-Y74 HydrophobicContact CB-CE2 3.82Å; E14-Y74 WeakPolarHBondContact CB-OH 3.41Å
15	K	90.3	Very high	88.1	Confident	97 Å²	97	49.9 Å²	49.9	42%	0.422	23%	0.232	S	C	.	.	H	α-helix	trans	-60.2	-50.8	174.9	-178.5	-179.7	162.8	-156.6	0	111.3	E11 E12 S18 I19 Y74	E11-K15 WeakPolarHBondContact O-CB 3.4Å; E11-K15 PolarHBondContact O-N 2.87Å; E12-K15 PolarHBondContact O-N 2.99Å; E12-K15 IonicContact OE1-NZ 3.73Å; E12-K15 IonicContact OE2-NZ 3.44Å; E12-K15 PolarHBondContact OE2-NZ 3.25Å; K15-S18 PolarHBondContact O-N 2.92Å; K15-S18 PolarHBondContact O-OG 3.24Å; K15-I19 WeakPolarHBondContact O-CG1 3.3Å; K15-I19 PolarHBondContact O-N 3.01Å; K15-Y74 PolarHBondContact N-OH 3.17Å
16	L	91.7	Very high	87.7	Confident	38 Å²	38	53.5 Å²	53.5	20%	0.199	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-42	178	-69.8	174.2	0	0	0	112.2	E12 M13 S18 I19 W20 I43 L47 Y205	E12-L16 WeakPolarHBondContact O-CB 3.38Å; E12-L16 WeakPolarHBondContact O-CG 3.29Å; E12-L16 PolarHBondContact O-N 3.34Å; M13-L16 PolarHBondContact O-N 3.19Å; L16-S18 VanDerWaalsContact C-N 3.32Å; L16-S18 PolarHBondContact O-N 2.92Å; L16-I19 PolarHBondContact O-N 3.42Å; L16-W20 PolarHBondContact O-N 3.14Å; L16-I43 HydrophobicContact CB-CD1 3.99Å; L16-I43 HydrophobicContact CB-CG2 3.91Å; L16-I43 HydrophobicContact CD1-CG2 3.65Å; L16-I43 HydrophobicContact CG-CG2 4.43Å; L16-L47 HydrophobicContact CD1-CD1 4.23Å; L16-L47 HydrophobicContact CD1-CD2 4.25Å; L16-L47 HydrophobicContact CD1-CG 4.48Å; L16-Y205 HydrophobicContact CD2-CD2 4.3Å; L16-Y205 HydrophobicContact CD2-CE2 3.45Å; L16-Y205 VanDerWaalsContact CD2-CE2 3.45Å
17	L	91.7	Very high	87.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.5	-39.2	177.4	-172.1	68.2	0	0	0	111.3	M13 E14 W20 I21 I36 K39 A40 I43 F67 F70	M13-L17 HydrophobicContact CE-CB 3.99Å; M13-L17 HydrophobicContact CE-CD2 3.72Å; M13-L17 WeakPolarHBondContact O-CB 3.42Å; M13-L17 PolarHBondContact O-N 3.46Å; E14-L17 PolarHBondContact O-N 3.26Å; L17-W20 HydrophobicContact CD1-CE3 4.15Å; L17-W20 PolarHBondContact O-N 3.04Å; L17-I21 HydrophobicContact CG-CD1 4.07Å; L17-I21 HydrophobicContact CG-CG1 4.48Å; L17-I21 VanDerWaalsContact O-CG1 3.3Å; L17-I21 WeakPolarHBondContact O-CG1 3.44Å; L17-I21 PolarHBondContact O-N 3.12Å; L17-I36 HydrophobicContact CD1-CG2 4.23Å; L17-I36 HydrophobicContact CD2-CG2 4.05Å; L17-I36 HydrophobicContact CG-CG2 4.4Å; L17-K39 HydrophobicContact CD1-CB 3.96Å; L17-K39 HydrophobicContact CD1-CG 4Å; L17-A40 HydrophobicContact CD1-CB 4.11Å; L17-A40 HydrophobicContact CD2-CB 3.71Å; L17-I43 HydrophobicContact CB-CD1 4.21Å; L17-I43 HydrophobicContact CD1-CD1 4.22Å; L17-F67 HydrophobicContact CD2-CE1 4.02Å; L17-F70 HydrophobicContact CB-CZ 4.31Å; L17-F70 HydrophobicContact CD2-CE1 4.05Å; L17-F70 HydrophobicContact CD2-CE2 4.27Å; L17-F70 HydrophobicContact CD2-CZ 3.88Å; L17-F70 HydrophobicContact CG-CZ 4.07Å
18	S	89.6	Confident	86.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.7	-43.8	176.6	77.3	0	0	0	0	112.2	E14 K15 L16 I21 E22 Y74	E14-S18 WeakPolarHBondContact O-CB 3.33Å; E14-S18 PolarHBondContact O-N 3.08Å; K15-S18 PolarHBondContact O-N 2.92Å; K15-S18 PolarHBondContact O-OG 3.24Å; L16-S18 VanDerWaalsContact C-N 3.32Å; L16-S18 PolarHBondContact O-N 2.92Å; S18-I21 PolarHBondContact O-N 3.03Å; S18-E22 WeakPolarHBondContact O-CG 3.4Å; S18-E22 PolarHBondContact O-N 2.79Å; S18-Y74 WeakPolarHBondContact OG-CE1 3.47Å
19	I	88.6	Confident	85.7	Confident	9 Å²	9	56.3 Å²	56.3	5%	0.046	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-44.2	176.3	-65.7	167.6	0	0	0	109.9	K15 L16 E22 I23 R201 I202	K15-I19 WeakPolarHBondContact O-CG1 3.3Å; K15-I19 PolarHBondContact O-N 3.01Å; L16-I19 PolarHBondContact O-N 3.42Å; I19-E22 PolarHBondContact O-N 2.9Å; I19-I23 HydrophobicContact CG2-CD1 3.81Å; I19-I23 WeakPolarHBondContact O-CD1 3.2Å; I19-I23 VanDerWaalsContact O-CG1 3.29Å; I19-I23 WeakPolarHBondContact O-CG1 3.49Å; I19-I23 PolarHBondContact O-N 2.82Å; I19-R201 HydrophobicContact CD1-CG 4.43Å; I19-I202 HydrophobicContact CG2-CG1 4.44Å
20	W	90.6	Very high	84.6	Confident	50 Å²	50	59.2 Å²	59.2	19%	0.189	30%	0.296	C	S	.	.	H	α-helix	trans	-62	-45.7	178.1	-179.6	81.7	0	0	0	112.4	L16 L17 E22 I23 Q24 T31 I36 K39	L16-W20 PolarHBondContact O-N 3.14Å; L17-W20 HydrophobicContact CD1-CE3 4.15Å; L17-W20 PolarHBondContact O-N 3.04Å; W20-E22 VanDerWaalsContact C-N 3.35Å; W20-E22 PolarHBondContact O-N 2.84Å; W20-I23 PolarHBondContact O-N 3.33Å; W20-Q24 HydrophobicContact CD2-CG 3.97Å; W20-Q24 HydrophobicContact CE3-CG 4.24Å; W20-Q24 HydrophobicContact CH2-CG 4.01Å; W20-Q24 HydrophobicContact CZ2-CG 3.73Å; W20-Q24 HydrophobicContact CZ3-CG 4.25Å; W20-Q24 WeakPolarHBondContact O-CG 3.22Å; W20-Q24 PolarHBondContact O-N 3Å; W20-T31 HydrophobicContact CH2-CG2 4.01Å; W20-T31 HydrophobicContact CZ3-CG2 3.89Å; W20-I36 HydrophobicContact CZ3-CG1 4Å; W20-K39 VanDerWaalsContact CD1-CE 3.45Å; W20-K39 HydrophobicContact CD2-CB 4.12Å; W20-K39 HydrophobicContact CD2-CD 4.06Å; W20-K39 HydrophobicContact CD2-CG 3.52Å; W20-K39 HydrophobicContact CE3-CB 3.95Å; W20-K39 HydrophobicContact CE3-CG 3.78Å; W20-K39 HydrophobicContact CG-CD 4.18Å; W20-K39 HydrophobicContact CG-CG 3.86Å; W20-K39 HydrophobicContact CH2-CB 3.97Å; W20-K39 HydrophobicContact CH2-CG 4.4Å; W20-K39 HydrophobicContact CZ2-CB 4.12Å; W20-K39 HydrophobicContact CZ2-CD 4.29Å; W20-K39 HydrophobicContact CZ2-CG 4.17Å; W20-K39 HydrophobicContact CZ3-CB 3.87Å; W20-K39 HydrophobicContact CZ3-CG 4.21Å
21	I	88.2	Confident	84.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-42.4	176.9	-68.9	171.8	0	0	0	111.1	L17 S18 I23 Q24 T25 I36 F70 F76 V79 L81	L17-I21 HydrophobicContact CG-CD1 4.07Å; L17-I21 HydrophobicContact CG-CG1 4.48Å; L17-I21 VanDerWaalsContact O-CG1 3.3Å; L17-I21 WeakPolarHBondContact O-CG1 3.44Å; L17-I21 PolarHBondContact O-N 3.12Å; S18-I21 PolarHBondContact O-N 3.03Å; I21-I23 VanDerWaalsContact C-N 3.33Å; I21-I23 PolarHBondContact O-N 3.31Å; I21-Q24 PolarHBondContact O-N 3.24Å; I21-T25 WeakPolarHBondContact O-CB 3.35Å; I21-T25 PolarHBondContact O-N 3.47Å; I21-T25 PolarHBondContact O-OG1 3.33Å; I21-I36 HydrophobicContact CD1-CD1 4.3Å; I21-I36 HydrophobicContact CD1-CG1 4.31Å; I21-I36 HydrophobicContact CD1-CG2 3.78Å; I21-I36 HydrophobicContact CG1-CG1 4.28Å; I21-I36 HydrophobicContact CG1-CG2 4.41Å; I21-F70 HydrophobicContact CD1-CE1 3.6Å; I21-F70 HydrophobicContact CD1-CZ 3.87Å; I21-F76 HydrophobicContact CB-CZ 4.26Å; I21-F76 HydrophobicContact CD1-CD2 4.46Å; I21-F76 HydrophobicContact CD1-CE2 4.3Å; I21-F76 HydrophobicContact CG2-CD1 4.18Å; I21-F76 HydrophobicContact CG2-CE1 4Å; I21-F76 HydrophobicContact CG2-CE2 4.48Å; I21-F76 HydrophobicContact CG2-CZ 4.16Å; I21-V79 HydrophobicContact CG2-CG1 4.47Å; I21-V79 HydrophobicContact CG2-CG2 3.89Å; I21-L81 HydrophobicContact CD1-CD2 4.36Å
22	E	84.4	Confident	83.7	Confident	29 Å²	29	57.1 Å²	57.1	14%	0.136	29%	0.292	C	S	.	.	H	α-helix	trans	-59.1	-44.7	175.8	-75.5	175.7	173.8	0	0	111.3	S18 I19 W20 T25 M26 F76 R201	S18-E22 WeakPolarHBondContact O-CG 3.4Å; S18-E22 PolarHBondContact O-N 2.79Å; I19-E22 PolarHBondContact O-N 2.9Å; W20-E22 VanDerWaalsContact C-N 3.35Å; W20-E22 PolarHBondContact O-N 2.84Å; E22-T25 PolarHBondContact O-N 3.15Å; E22-M26 WeakPolarHBondContact O-CG 3.34Å; E22-M26 PolarHBondContact O-N 2.95Å; E22-F76 HydrophobicContact CG-CE1 3.99Å; E22-F76 HydrophobicContact CG-CZ 4.17Å; E22-R201 VanDerWaalsContact CD-NH2 3.31Å; E22-R201 IonicContact OE1-NH2 2.62Å; E22-R201 PolarHBondContact OE1-NH2 3.07Å; E22-R201 IonicContact OE2-CZ 3.8Å; E22-R201 IonicContact OE2-NH2 3.65Å; E22-R201 PolarHBondContact OE2-NH2 3.42Å
23	I	83.2	Confident	83.2	Confident	14 Å²	14	55.7 Å²	55.7	7%	0.072	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-44.5	177.2	-68.9	163.3	0	0	0	111.2	I19 W20 I21 T25 M26 K27 I202 Y206	I19-I23 HydrophobicContact CG2-CD1 3.81Å; I19-I23 WeakPolarHBondContact O-CD1 3.2Å; I19-I23 VanDerWaalsContact O-CG1 3.29Å; I19-I23 WeakPolarHBondContact O-CG1 3.49Å; I19-I23 PolarHBondContact O-N 2.82Å; W20-I23 PolarHBondContact O-N 3.33Å; I21-I23 VanDerWaalsContact C-N 3.33Å; I21-I23 PolarHBondContact O-N 3.31Å; I23-T25 VanDerWaalsContact C-N 3.33Å; I23-T25 PolarHBondContact O-N 3.11Å; I23-M26 PolarHBondContact O-N 3.29Å; I23-K27 HydrophobicContact CG2-CD 4.13Å; I23-K27 WeakPolarHBondContact O-CG 3.26Å; I23-K27 PolarHBondContact O-N 2.89Å; I23-I202 HydrophobicContact CD1-CG2 4.28Å; I23-I202 HydrophobicContact CG1-CD1 4.38Å; I23-I202 HydrophobicContact CG1-CG1 4.45Å; I23-I202 HydrophobicContact CG1-CG2 4.16Å; I23-Y206 HydrophobicContact CD1-CE2 4.12Å
24	Q	83.4	Confident	82.8	Confident	36 Å²	36	61.8 Å²	61.8	17%	0.168	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-41.6	177.2	-62.6	-50.5	-47.4	0	0	111.4	W20 I21 M26 K27 R28 T29 T31	W20-Q24 HydrophobicContact CD2-CG 3.97Å; W20-Q24 HydrophobicContact CE3-CG 4.24Å; W20-Q24 HydrophobicContact CH2-CG 4.01Å; W20-Q24 HydrophobicContact CZ2-CG 3.73Å; W20-Q24 HydrophobicContact CZ3-CG 4.25Å; W20-Q24 WeakPolarHBondContact O-CG 3.22Å; W20-Q24 PolarHBondContact O-N 3Å; I21-Q24 PolarHBondContact O-N 3.24Å; Q24-M26 VanDerWaalsContact C-N 3.32Å; Q24-M26 PolarHBondContact O-N 2.94Å; Q24-K27 PolarHBondContact O-N 3.16Å; Q24-K27 VanDerWaalsContact O-N 3.17Å; Q24-R28 PolarHBondContact O-N 3.12Å; Q24-T29 WeakPolarHBondContact CA-OG1 3.27Å; Q24-T29 WeakPolarHBondContact CB-OG1 3.48Å; Q24-T29 PolarHBondContact O-N 3.28Å; Q24-T29 VanDerWaalsContact O-N 3.17Å; Q24-T29 PolarHBondContact O-OG1 2.81Å; Q24-T29 PolarHBondContact OE1-OG1 3.18Å; Q24-T31 HydrophobicContact CB-CG2 4.48Å; Q24-T31 WeakPolarHBondContact CB-OG1 3.34Å
25	T	78	Confident	82.6	Confident	81 Å²	81	63 Å²	63	50%	0.497	32%	0.32	S	S	.	.	H	α-helix	trans	-60.9	-41.2	177	-53.2	0	0	0	0	111.3	I21 E22 I23 R28	I21-T25 WeakPolarHBondContact O-CB 3.35Å; I21-T25 PolarHBondContact O-N 3.47Å; I21-T25 PolarHBondContact O-OG1 3.33Å; E22-T25 PolarHBondContact O-N 3.15Å; I23-T25 VanDerWaalsContact C-N 3.33Å; I23-T25 PolarHBondContact O-N 3.11Å; T25-R28 PolarHBondContact O-N 3.08Å
26	M	75.6	Confident	82.5	Confident	134 Å²	134	58.3 Å²	58.3	66%	0.66	30%	0.3	S	S	*	.	H	α-helix	trans	-65.8	-38	175.3	-75.5	-175	162.5	0	0	113	E22 I23 Q24 R28 I202	E22-M26 WeakPolarHBondContact O-CG 3.34Å; E22-M26 PolarHBondContact O-N 2.95Å; I23-M26 PolarHBondContact O-N 3.29Å; Q24-M26 VanDerWaalsContact C-N 3.32Å; Q24-M26 PolarHBondContact O-N 2.94Å; M26-R28 PolarHBondContact O-N 2.57Å; M26-I202 HydrophobicContact CE-CD1 4.46Å; M26-I202 HydrophobicContact SD-CD1 4.18Å
27	K	79.4	Confident	82.4	Confident	128 Å²	128	60.6 Å²	60.6	56%	0.557	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-0.9	176.9	-70.1	-180	179	-174.8	0	113.3	I23 Q24 T29	I23-K27 HydrophobicContact CG2-CD 4.13Å; I23-K27 WeakPolarHBondContact O-CG 3.26Å; I23-K27 PolarHBondContact O-N 2.89Å; Q24-K27 PolarHBondContact O-N 3.16Å; Q24-K27 VanDerWaalsContact O-N 3.17Å; K27-T29 HydrophobicContact CB-CG2 4.16Å; K27-T29 PolarHBondContact O-N 3.1Å; K27-T29 VanDerWaalsContact O-N 3.16Å
28	R	73	Confident	82.4	Confident	237 Å²	237	65.5 Å²	65.5	89%	0.894	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	30.9	-171.7	-60.1	-161.7	177.8	-172.3	1.3	112.7	Q24 T25 M26	Q24-R28 PolarHBondContact O-N 3.12Å; T25-R28 PolarHBondContact O-N 3.08Å; M26-R28 PolarHBondContact O-N 2.57Å
29	T	67.1	Low	82.5	Confident	61 Å²	61	69.2 Å²	69.2	37%	0.374	35%	0.347	S	S	.	.			trans	-80.9	125.9	172.7	42.9	0	0	0	0	108.6	Q24 K27 T31	Q24-T29 WeakPolarHBondContact CA-OG1 3.27Å; Q24-T29 WeakPolarHBondContact CB-OG1 3.48Å; Q24-T29 PolarHBondContact O-N 3.28Å; Q24-T29 VanDerWaalsContact O-N 3.17Å; Q24-T29 PolarHBondContact O-OG1 2.81Å; Q24-T29 PolarHBondContact OE1-OG1 3.18Å; K27-T29 HydrophobicContact CB-CG2 4.16Å; K27-T29 PolarHBondContact O-N 3.1Å; K27-T29 VanDerWaalsContact O-N 3.16Å; T29-T31 PolarHBondContact O-N 3.16Å; T29-T31 PolarHBondContact O-OG1 2.71Å; T29-T31 VanDerWaalsContact O-OG1 3.11Å
30	G	68.2	Low	82.7	Confident	76 Å²	76	68.8 Å²	68.8	78%	0.784	35%	0.345	S	S	*	.			trans	-60.7	97	176.7	0	0	0	0	0	109.9	T32	G30-T32 PolarHBondContact O-N 2.73Å
31	T	77.6	Confident	82.7	Confident	28 Å²	28	69 Å²	69	17%	0.172	35%	0.351	C	S	.	.			trans	-88.3	112.7	-178.3	-48.1	0	0	0	0	108.2	W20 Q24 T29 T35 I36	W20-T31 HydrophobicContact CH2-CG2 4.01Å; W20-T31 HydrophobicContact CZ3-CG2 3.89Å; Q24-T31 HydrophobicContact CB-CG2 4.48Å; Q24-T31 WeakPolarHBondContact CB-OG1 3.34Å; T29-T31 PolarHBondContact O-N 3.16Å; T29-T31 PolarHBondContact O-OG1 2.71Å; T29-T31 VanDerWaalsContact O-OG1 3.11Å; T31-T35 WeakPolarHBondContact CG2-OG1 3.29Å; T31-I36 HydrophobicContact CG2-CD1 3.66Å; T31-I36 HydrophobicContact CG2-CG1 3.39Å
32	T	80.6	Confident	83	Confident	74 Å²	74	71.7 Å²	71.7	45%	0.454	37%	0.374	S	S	.	.			trans	-92.3	156.5	178.4	66.5	0	0	0	0	110.8	G30 F34 T35 I36	G30-T32 PolarHBondContact O-N 2.73Å; T32-F34 PolarHBondContact O-N 3.43Å; T32-F34 VanDerWaalsContact O-N 3.13Å; T32-T35 PolarHBondContact N-OG1 3Å; T32-T35 PolarHBondContact O-N 3.17Å; T32-T35 PolarHBondContact O-OG1 2.85Å; T32-T35 PolarHBondContact OG1-N 3.45Å; T32-I36 WeakPolarHBondContact O-CG1 3.43Å; T32-I36 PolarHBondContact O-N 3.41Å; T32-I36 VanDerWaalsContact O-N 3.08Å
33	F	82.3	Confident	83.3	Confident	54 Å²	54	71.2 Å²	71.2	24%	0.237	37%	0.372	C	S	.	.	H	α-helix	trans	-48.5	-40.8	172.3	175.8	-118	0	0	0	112.3	I36 K37 F67 R80 L81	F33-I36 PolarHBondContact O-N 3.15Å; F33-K37 WeakPolarHBondContact O-CB 3.33Å; F33-K37 PolarHBondContact O-N 2.99Å; F33-F67 HydrophobicContact CE2-CB 3.94Å; F33-F67 HydrophobicContact CE2-CD1 4.46Å; F33-F67 AromaticContact CE2-CD2 3.63Å; F33-F67 HydrophobicContact CE2-CD2 3.63Å; F33-F67 HydrophobicContact CE2-CE2 4.27Å; F33-F67 AromaticContact CE2-CG 3.75Å; F33-F67 HydrophobicContact CE2-CG 3.75Å; F33-F67 AromaticContact CZ-CD2 4Å; F33-F67 HydrophobicContact CZ-CD2 4Å; F33-R80 WeakPolarHBondContact CB-O 3.39Å; F33-L81 VanDerWaalsContact CD2-C 3.46Å; F33-L81 WeakPolarHBondContact CD2-O 3.45Å; F33-L81 WeakPolarHBondContact CE2-O 3.18Å
34	F	84.3	Confident	83.8	Confident	130 Å²	130	70.5 Å²	70.5	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-58.3	-50.5	177.1	-179.4	-101.2	0	0	0	112.3	T32 I36 K37 Q38	T32-F34 PolarHBondContact O-N 3.43Å; T32-F34 VanDerWaalsContact O-N 3.13Å; F34-I36 VanDerWaalsContact C-N 3.3Å; F34-I36 PolarHBondContact O-N 3.29Å; F34-K37 PolarHBondContact O-N 2.84Å; F34-Q38 HydrophobicContact CD1-CG 4.44Å; F34-Q38 HydrophobicContact CE1-CG 4.16Å; F34-Q38 HydrophobicContact CZ-CG 4.19Å; F34-Q38 WeakPolarHBondContact O-CG 3.41Å; F34-Q38 PolarHBondContact O-N 2.77Å
35	T	88.1	Confident	84.2	Confident	46 Å²	46	71.8 Å²	71.8	28%	0.282	37%	0.374	S	S	.	.	H	α-helix	trans	-63.5	-35.8	178.6	59.1	0	0	0	0	112.6	T31 T32 Q38 K39	T31-T35 WeakPolarHBondContact CG2-OG1 3.29Å; T32-T35 PolarHBondContact N-OG1 3Å; T32-T35 PolarHBondContact O-N 3.17Å; T32-T35 PolarHBondContact O-OG1 2.85Å; T32-T35 PolarHBondContact OG1-N 3.45Å; T35-Q38 PolarHBondContact O-N 3.47Å; T35-K39 WeakPolarHBondContact O-CB 3.46Å; T35-K39 PolarHBondContact O-N 2.97Å
36	I	88.1	Confident	84.8	Confident	0 Å²	0	73 Å²	73	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-68.5	-44.4	177.7	-62.3	165.7	0	0	0	110.2	L17 W20 I21 T31 T32 F33 F34 K39 A40 F67 V79 L81	L17-I36 HydrophobicContact CD1-CG2 4.23Å; L17-I36 HydrophobicContact CD2-CG2 4.05Å; L17-I36 HydrophobicContact CG-CG2 4.4Å; W20-I36 HydrophobicContact CZ3-CG1 4Å; I21-I36 HydrophobicContact CD1-CD1 4.3Å; I21-I36 HydrophobicContact CD1-CG1 4.31Å; I21-I36 HydrophobicContact CD1-CG2 3.78Å; I21-I36 HydrophobicContact CG1-CG1 4.28Å; I21-I36 HydrophobicContact CG1-CG2 4.41Å; T31-I36 HydrophobicContact CG2-CD1 3.66Å; T31-I36 HydrophobicContact CG2-CG1 3.39Å; T32-I36 WeakPolarHBondContact O-CG1 3.43Å; T32-I36 PolarHBondContact O-N 3.41Å; T32-I36 VanDerWaalsContact O-N 3.08Å; F33-I36 PolarHBondContact O-N 3.15Å; F34-I36 VanDerWaalsContact C-N 3.3Å; F34-I36 PolarHBondContact O-N 3.29Å; I36-K39 PolarHBondContact O-N 3.48Å; I36-A40 WeakPolarHBondContact O-CB 3.47Å; I36-A40 PolarHBondContact O-N 3.04Å; I36-F67 HydrophobicContact CG2-CD1 4.26Å; I36-F67 HydrophobicContact CG2-CE1 3.91Å; I36-V79 HydrophobicContact CD1-CG1 3.35Å; I36-L81 HydrophobicContact CB-CD2 4.19Å; I36-L81 HydrophobicContact CD1-CD2 3.38Å; I36-L81 HydrophobicContact CD1-CG 4.36Å; I36-L81 HydrophobicContact CG1-CD2 4.28Å; I36-L81 HydrophobicContact CG2-CD2 3.61Å
37	K	89.4	Confident	85.6	Confident	85 Å²	85	67.9 Å²	67.9	37%	0.37	35%	0.349	S	S	.	.	H	α-helix	trans	-59	-48	175.4	-174.7	178.5	175.7	172.8	0	111.2	F33 F34 K39 A40 V41 A62 F67	F33-K37 WeakPolarHBondContact O-CB 3.33Å; F33-K37 PolarHBondContact O-N 2.99Å; F34-K37 PolarHBondContact O-N 2.84Å; K37-K39 PolarHBondContact O-N 3.41Å; K37-A40 PolarHBondContact O-N 3.24Å; K37-V41 WeakPolarHBondContact O-CG2 3.49Å; K37-V41 PolarHBondContact O-N 2.88Å; K37-A62 HydrophobicContact CD-CB 4.35Å; K37-A62 WeakPolarHBondContact CE-O 3.44Å; K37-A62 HydrophobicContact CG-CB 3.96Å; K37-A62 PolarHBondContact NZ-O 3.32Å; K37-F67 HydrophobicContact CB-CE2 4.27Å; K37-F67 HydrophobicContact CB-CZ 4.19Å; K37-F67 HydrophobicContact CG-CE2 4.07Å; K37-F67 HydrophobicContact CG-CZ 4.28Å
38	Q	90.6	Very high	86.1	Confident	103 Å²	103	63.3 Å²	63.3	48%	0.481	33%	0.329	S	S	.	.	H	α-helix	trans	-59.7	-45.9	177.1	-73.5	-179.2	-49.3	0	0	111.9	F34 T35 A40 V41 A42	F34-Q38 HydrophobicContact CD1-CG 4.44Å; F34-Q38 HydrophobicContact CE1-CG 4.16Å; F34-Q38 HydrophobicContact CZ-CG 4.19Å; F34-Q38 WeakPolarHBondContact O-CG 3.41Å; F34-Q38 PolarHBondContact O-N 2.77Å; T35-Q38 PolarHBondContact O-N 3.47Å; Q38-A40 PolarHBondContact O-N 3.36Å; Q38-V41 PolarHBondContact O-N 2.99Å; Q38-A42 WeakPolarHBondContact O-CB 3.47Å; Q38-A42 PolarHBondContact O-N 3.34Å
39	K	92.9	Very high	87	Confident	78 Å²	78	59.6 Å²	59.6	34%	0.339	32%	0.32	S	S	.	.	H	α-helix	trans	-64.7	-40.8	178.7	-170.3	72.1	178.3	177.4	0	111.9	L17 W20 T35 I36 K37 V41 A42 I43	L17-K39 HydrophobicContact CD1-CB 3.96Å; L17-K39 HydrophobicContact CD1-CG 4Å; W20-K39 VanDerWaalsContact CD1-CE 3.45Å; W20-K39 HydrophobicContact CD2-CB 4.12Å; W20-K39 HydrophobicContact CD2-CD 4.06Å; W20-K39 HydrophobicContact CD2-CG 3.52Å; W20-K39 HydrophobicContact CE3-CB 3.95Å; W20-K39 HydrophobicContact CE3-CG 3.78Å; W20-K39 HydrophobicContact CG-CD 4.18Å; W20-K39 HydrophobicContact CG-CG 3.86Å; W20-K39 HydrophobicContact CH2-CB 3.97Å; W20-K39 HydrophobicContact CH2-CG 4.4Å; W20-K39 HydrophobicContact CZ2-CB 4.12Å; W20-K39 HydrophobicContact CZ2-CD 4.29Å; W20-K39 HydrophobicContact CZ2-CG 4.17Å; W20-K39 HydrophobicContact CZ3-CB 3.87Å; W20-K39 HydrophobicContact CZ3-CG 4.21Å; T35-K39 WeakPolarHBondContact O-CB 3.46Å; T35-K39 PolarHBondContact O-N 2.97Å; I36-K39 PolarHBondContact O-N 3.48Å; K37-K39 PolarHBondContact O-N 3.41Å; K39-V41 VanDerWaalsContact C-N 3.35Å; K39-V41 PolarHBondContact O-N 3.46Å; K39-A42 PolarHBondContact O-N 3.04Å; K39-I43 HydrophobicContact CD-CD1 4.48Å; K39-I43 HydrophobicContact CG-CD1 3.84Å; K39-I43 HydrophobicContact CG-CG1 4.34Å; K39-I43 VanDerWaalsContact O-CG1 3.3Å; K39-I43 WeakPolarHBondContact O-CG1 3.47Å; K39-I43 PolarHBondContact O-N 3.05Å
40	A	91.7	Very high	88	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-46.7	176.8	0	0	0	0	0	111.6	M13 L17 I36 K37 Q38 I43 Y44 F60 F67	M13-A40 HydrophobicContact CE-CB 4.29Å; M13-A40 HydrophobicContact SD-CB 3.96Å; L17-A40 HydrophobicContact CD1-CB 4.11Å; L17-A40 HydrophobicContact CD2-CB 3.71Å; I36-A40 WeakPolarHBondContact O-CB 3.47Å; I36-A40 PolarHBondContact O-N 3.04Å; K37-A40 PolarHBondContact O-N 3.24Å; Q38-A40 PolarHBondContact O-N 3.36Å; A40-I43 PolarHBondContact O-N 3.37Å; A40-Y44 WeakPolarHBondContact O-CB 3.34Å; A40-Y44 PolarHBondContact O-N 3.28Å; A40-F60 HydrophobicContact CB-CE1 3.88Å; A40-F67 HydrophobicContact CB-CE1 3.94Å; A40-F67 HydrophobicContact CB-CZ 3.7Å
41	V	91.7	Very high	88.8	Confident	55 Å²	55	60.6 Å²	60.6	33%	0.333	30%	0.302	S	S	.	.	H	α-helix	trans	-61.8	-45.9	175.9	173.5	0	0	0	0	110.9	K37 Q38 K39 I43 Y44 E45 F60 A62	K37-V41 WeakPolarHBondContact O-CG2 3.49Å; K37-V41 PolarHBondContact O-N 2.88Å; Q38-V41 PolarHBondContact O-N 2.99Å; K39-V41 VanDerWaalsContact C-N 3.35Å; K39-V41 PolarHBondContact O-N 3.46Å; V41-I43 PolarHBondContact O-N 3.42Å; V41-Y44 PolarHBondContact O-N 2.88Å; V41-E45 HydrophobicContact CG1-CG 4.34Å; V41-E45 WeakPolarHBondContact O-CG 3.48Å; V41-E45 PolarHBondContact O-N 3.04Å; V41-F60 HydrophobicContact CG2-CD1 4.28Å; V41-A62 HydrophobicContact CG2-CB 3.9Å
42	A	92.7	Very high	89.2	Confident	57 Å²	57	66.9 Å²	66.9	47%	0.471	33%	0.333	S	S	.	.	H	α-helix	trans	-60.8	-43.9	179.5	0	0	0	0	0	112.7	Q38 K39 H46	Q38-A42 WeakPolarHBondContact O-CB 3.47Å; Q38-A42 PolarHBondContact O-N 3.34Å; K39-A42 PolarHBondContact O-N 3.04Å; A42-H46 WeakPolarHBondContact O-CB 3.45Å; A42-H46 PolarHBondContact O-N 3.12Å; A42-H46 VanDerWaalsContact O-N 3.13Å
43	I	92.6	Very high	89.3	Confident	18 Å²	18	66.1 Å²	66.1	9%	0.092	33%	0.326	C	S	.	.	H	α-helix	trans	-63.6	-46.4	175.7	-68	167.2	0	0	0	110.2	M13 L16 L17 K39 A40 V41 E45 H46 L47	M13-I43 HydrophobicContact CB-CG2 4.06Å; M13-I43 HydrophobicContact CG-CB 4.05Å; M13-I43 HydrophobicContact CG-CG2 3.71Å; L16-I43 HydrophobicContact CB-CD1 3.99Å; L16-I43 HydrophobicContact CB-CG2 3.91Å; L16-I43 HydrophobicContact CD1-CG2 3.65Å; L16-I43 HydrophobicContact CG-CG2 4.43Å; L17-I43 HydrophobicContact CB-CD1 4.21Å; L17-I43 HydrophobicContact CD1-CD1 4.22Å; K39-I43 HydrophobicContact CD-CD1 4.48Å; K39-I43 HydrophobicContact CG-CD1 3.84Å; K39-I43 HydrophobicContact CG-CG1 4.34Å; K39-I43 VanDerWaalsContact O-CG1 3.3Å; K39-I43 WeakPolarHBondContact O-CG1 3.47Å; K39-I43 PolarHBondContact O-N 3.05Å; A40-I43 PolarHBondContact O-N 3.37Å; V41-I43 PolarHBondContact O-N 3.42Å; I43-E45 PolarHBondContact O-N 3.43Å; I43-H46 PolarHBondContact O-N 3.01Å; I43-L47 HydrophobicContact CG2-CD1 3.89Å; I43-L47 HydrophobicContact CG2-CG 4.34Å; I43-L47 WeakPolarHBondContact O-CG 3.36Å; I43-L47 PolarHBondContact O-N 3.31Å
44	Y	91.9	Very high	89.3	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.2	-46.8	-178.9	-172.9	-94.4	0	0	0	112.3	I9 L10 M13 A40 V41 H46 L47 K48 I57 L58 F60	I9-Y44 HydrophobicContact CB-CE2 4.38Å; I9-Y44 HydrophobicContact CG2-CD2 3.66Å; I9-Y44 HydrophobicContact CG2-CE2 3.46Å; I9-Y44 VanDerWaalsContact CG2-CE2 3.46Å; I9-Y44 HydrophobicContact CG2-CG 4.44Å; L10-Y44 HydrophobicContact CD2-CD2 4.06Å; L10-Y44 HydrophobicContact CD2-CE2 3.62Å; L10-Y44 HydrophobicContact CG-CE2 4.11Å; M13-Y44 HydrophobicContact CB-CD2 4.47Å; M13-Y44 HydrophobicContact CG-CD2 4.49Å; A40-Y44 WeakPolarHBondContact O-CB 3.34Å; A40-Y44 PolarHBondContact O-N 3.28Å; V41-Y44 PolarHBondContact O-N 2.88Å; Y44-H46 VanDerWaalsContact C-N 3.31Å; Y44-H46 PolarHBondContact O-N 3.4Å; Y44-L47 PolarHBondContact O-N 3.34Å; Y44-K48 HydrophobicContact CE1-CD 4.31Å; Y44-K48 VanDerWaalsContact O-CB 3.23Å; Y44-K48 WeakPolarHBondContact O-CB 3.49Å; Y44-K48 PolarHBondContact O-N 3.05Å; Y44-I57 HydrophobicContact CE1-CG2 4.28Å; Y44-I57 WeakPolarHBondContact OH-CG2 3.26Å; Y44-L58 WeakPolarHBondContact CE1-O 3.45Å; Y44-L58 PolarHBondContact OH-O 3.32Å; Y44-F60 HydrophobicContact CD1-CB 3.53Å; Y44-F60 HydrophobicContact CD2-CB 3.84Å; Y44-F60 HydrophobicContact CD2-CD2 4.41Å; Y44-F60 HydrophobicContact CD2-CG 4.28Å; Y44-F60 HydrophobicContact CE1-CB 3.86Å; Y44-F60 HydrophobicContact CE2-CB 4.15Å; Y44-F60 HydrophobicContact CG-CB 3.52Å; Y44-F60 HydrophobicContact CG-CG 4.26Å
45	E	91.7	Very high	89.2	Confident	62 Å²	62	66.3 Å²	66.3	29%	0.29	34%	0.344	S	S	.	.	H	α-helix	trans	-65.4	-34.9	178.7	-70	-57.6	139.8	0	0	112	V41 I43 K49	V41-E45 HydrophobicContact CG1-CG 4.34Å; V41-E45 WeakPolarHBondContact O-CG 3.48Å; V41-E45 PolarHBondContact O-N 3.04Å; I43-E45 PolarHBondContact O-N 3.43Å; E45-K49 VanDerWaalsContact O-CG 3.29Å; E45-K49 WeakPolarHBondContact O-CG 3.39Å; E45-K49 PolarHBondContact O-N 2.84Å; E45-K49 VanDerWaalsContact O-N 3.12Å
46	H	92.5	Very high	89	Confident	108 Å²	108	68.9 Å²	68.9	50%	0.5	35%	0.352	S	S	.	.	H	α-helix	trans	-64.1	-50	173.5	-176.2	82.4	0	0	0	111.8	A42 I43 Y44 K48 K49 Q50	A42-H46 WeakPolarHBondContact O-CB 3.45Å; A42-H46 PolarHBondContact O-N 3.12Å; A42-H46 VanDerWaalsContact O-N 3.13Å; I43-H46 PolarHBondContact O-N 3.01Å; Y44-H46 VanDerWaalsContact C-N 3.31Å; Y44-H46 PolarHBondContact O-N 3.4Å; H46-K48 VanDerWaalsContact C-N 3.32Å; H46-K48 PolarHBondContact O-N 3.01Å; H46-K49 PolarHBondContact O-N 3.24Å; H46-Q50 PolarHBondContact NE2-NE2 2.71Å; H46-Q50 PolarHBondContact O-N 3.26Å
47	L	91.7	Very high	88.8	Confident	26 Å²	26	69.5 Å²	69.5	14%	0.136	36%	0.356	C	S	.	.	H	α-helix	trans	-63.6	-37.5	177.8	-68.5	173.9	0	0	0	112.3	I9 E12 M13 L16 I43 Y44 K49 Q50 S51	I9-L47 HydrophobicContact CG2-CB 3.85Å; I9-L47 HydrophobicContact CG2-CD1 4.36Å; E12-L47 HydrophobicContact CB-CD1 3.88Å; M13-L47 HydrophobicContact CB-CD1 3.97Å; L16-L47 HydrophobicContact CD1-CD1 4.23Å; L16-L47 HydrophobicContact CD1-CD2 4.25Å; L16-L47 HydrophobicContact CD1-CG 4.48Å; I43-L47 HydrophobicContact CG2-CD1 3.89Å; I43-L47 HydrophobicContact CG2-CG 4.34Å; I43-L47 WeakPolarHBondContact O-CG 3.36Å; I43-L47 PolarHBondContact O-N 3.31Å; Y44-L47 PolarHBondContact O-N 3.34Å; L47-K49 VanDerWaalsContact C-N 3.35Å; L47-K49 PolarHBondContact O-N 3.47Å; L47-Q50 PolarHBondContact O-N 2.79Å; L47-S51 PolarHBondContact O-N 3.38Å
48	K	90.1	Very high	88.5	Confident	32 Å²	32	70.8 Å²	70.8	14%	0.139	37%	0.366	C	S	.	.	H	α-helix	trans	-60.2	-43.8	175.4	176.7	176.8	169.9	-178.8	0	111.4	Y44 H46 Q50 S51 P54 I57	Y44-K48 HydrophobicContact CE1-CD 4.31Å; Y44-K48 VanDerWaalsContact O-CB 3.23Å; Y44-K48 WeakPolarHBondContact O-CB 3.49Å; Y44-K48 PolarHBondContact O-N 3.05Å; H46-K48 VanDerWaalsContact C-N 3.32Å; H46-K48 PolarHBondContact O-N 3.01Å; K48-Q50 VanDerWaalsContact C-N 3.26Å; K48-Q50 PolarHBondContact O-N 3.16Å; K48-S51 WeakPolarHBondContact O-CB 3.45Å; K48-S51 PolarHBondContact O-N 3.21Å; K48-S51 VanDerWaalsContact O-N 3.16Å; K48-S51 PolarHBondContact O-OG 3.24Å; K48-P54 WeakPolarHBondContact CE-O 3.26Å; K48-P54 HydrophobicContact CG-CB 4.44Å; K48-P54 WeakPolarHBondContact O-CB 3.3Å; K48-I57 HydrophobicContact CD-CB 4.17Å; K48-I57 HydrophobicContact CD-CG2 4.05Å; K48-I57 WeakPolarHBondContact CE-O 3.5Å; K48-I57 HydrophobicContact CG-CB 4.04Å; K48-I57 HydrophobicContact CG-CD1 4.25Å; K48-I57 HydrophobicContact CG-CG2 4.06Å; K48-I57 PolarHBondContact NZ-O 3.16Å
49	K	90.4	Very high	88.2	Confident	159 Å²	159	69.8 Å²	69.8	69%	0.691	37%	0.368	S	S	*	.	H	α-helix	trans	-63.4	-28.7	177.7	-74.2	173.1	-177.7	-177	0	113.5	E45 H46 L47 S51	E45-K49 VanDerWaalsContact O-CG 3.29Å; E45-K49 WeakPolarHBondContact O-CG 3.39Å; E45-K49 PolarHBondContact O-N 2.84Å; E45-K49 VanDerWaalsContact O-N 3.12Å; H46-K49 PolarHBondContact O-N 3.24Å; L47-K49 VanDerWaalsContact C-N 3.35Å; L47-K49 PolarHBondContact O-N 3.47Å; K49-S51 VanDerWaalsContact C-N 3.32Å
50	Q	88.6	Confident	87.9	Confident	135 Å²	135	66.9 Å²	66.9	63%	0.631	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-9.4	177.3	-67.5	179.3	-16.4	0	0	113.8	H46 L47 K48	H46-Q50 PolarHBondContact NE2-NE2 2.71Å; H46-Q50 PolarHBondContact O-N 3.26Å; L47-Q50 PolarHBondContact O-N 2.79Å; K48-Q50 VanDerWaalsContact C-N 3.26Å; K48-Q50 PolarHBondContact O-N 3.16Å
51	S	86.1	Confident	87.2	Confident	22 Å²	22	70.9 Å²	70.9	15%	0.154	38%	0.382	C	S	.	.	S	Bend	trans	-77.8	158.3	-179.5	76.6	0	0	0	0	112.5	L47 K48 K49 N53 I57	L47-S51 PolarHBondContact O-N 3.38Å; K48-S51 WeakPolarHBondContact O-CB 3.45Å; K48-S51 PolarHBondContact O-N 3.21Å; K48-S51 VanDerWaalsContact O-N 3.16Å; K48-S51 PolarHBondContact O-OG 3.24Å; K49-S51 VanDerWaalsContact C-N 3.32Å; S51-N53 PolarHBondContact O-N 2.97Å; S51-I57 WeakPolarHBondContact OG-CD1 3.32Å
52	I	85.3	Confident	86.7	Confident	160 Å²	160	68.5 Å²	68.5	82%	0.821	37%	0.368	S	S	*	.	S	Bend	trans	-59.5	-34.5	-178.6	-56.6	171.8	0	0	0	111.9
53	N	82.5	Confident	86	Confident	59 Å²	59	67.7 Å²	67.7	32%	0.316	36%	0.359	S	S	.	.			trans	-134.7	78.2	-177.2	-65.6	-68.6	0	0	0	110.8	M1 S51 T55 E56	M1-N53 WeakPolarHBondContact CE-ND2 3.23Å; M1-N53 HydrophobicContact SD-CB 4.37Å; M1-N53 PolarHBondContact SD-ND2 3.32Å; S51-N53 PolarHBondContact O-N 2.97Å; N53-T55 VanDerWaalsContact C-N 3.25Å; N53-T55 PolarHBondContact O-N 2.93Å; N53-E56 HydrophobicContact CB-CB 4.42Å; N53-E56 HydrophobicContact CB-CG 4.29Å; N53-E56 VanDerWaalsContact CB-OE2 3.26Å; N53-E56 WeakPolarHBondContact CB-OE2 3.38Å; N53-E56 PolarHBondContact O-N 2.84Å
54	P	81.7	Confident	85.1	Confident	48 Å²	48	69.1 Å²	69.1	31%	0.312	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-61.6	-34	-175.6	24	-33.3	0	0	0	112.3	K48 E56 I57	K48-P54 WeakPolarHBondContact CE-O 3.26Å; K48-P54 HydrophobicContact CG-CB 4.44Å; K48-P54 WeakPolarHBondContact O-CB 3.3Å; P54-E56 VanDerWaalsContact C-N 3.3Å; P54-E56 PolarHBondContact O-N 3.21Å; P54-I57 PolarHBondContact O-N 2.9Å
55	T	83.3	Confident	84.3	Confident	140 Å²	140	70.7 Å²	70.7	86%	0.859	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-67.6	-28.4	-176.8	-45.8	0	0	0	0	113.1	N53 I57	N53-T55 VanDerWaalsContact C-N 3.25Å; N53-T55 PolarHBondContact O-N 2.93Å; T55-I57 VanDerWaalsContact C-N 3.34Å
56	E	82.4	Confident	83.8	Confident	99 Å²	99	69 Å²	69	46%	0.463	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-83.6	-9.1	-179	-64.8	-174.9	107.9	0	0	113.5	M1 N53 P54	M1-E56 WeakPolarHBondContact CB-OE2 3.36Å; M1-E56 WeakPolarHBondContact CG-OE2 3.44Å; M1-E56 PolarHBondContact N-OE1 2.93Å; N53-E56 HydrophobicContact CB-CB 4.42Å; N53-E56 HydrophobicContact CB-CG 4.29Å; N53-E56 VanDerWaalsContact CB-OE2 3.26Å; N53-E56 WeakPolarHBondContact CB-OE2 3.38Å; N53-E56 PolarHBondContact O-N 2.84Å; P54-E56 VanDerWaalsContact C-N 3.3Å; P54-E56 PolarHBondContact O-N 3.21Å
57	I	83.9	Confident	83.4	Confident	14 Å²	14	63.9 Å²	63.9	7%	0.072	35%	0.352	C	S	.	.	S	Bend	trans	-90.8	114.7	-177.8	-65.5	154.2	0	0	0	109.9	T5 I9 Y44 K48 S51 P54 T55	T5-I57 HydrophobicContact CG2-CD1 4.23Å; I9-I57 HydrophobicContact CD1-CD1 3.41Å; I9-I57 VanDerWaalsContact CD1-CD1 3.41Å; I9-I57 HydrophobicContact CD1-CG1 4.21Å; I9-I57 HydrophobicContact CD1-CG2 4.22Å; Y44-I57 HydrophobicContact CE1-CG2 4.28Å; Y44-I57 WeakPolarHBondContact OH-CG2 3.26Å; K48-I57 HydrophobicContact CD-CB 4.17Å; K48-I57 HydrophobicContact CD-CG2 4.05Å; K48-I57 WeakPolarHBondContact CE-O 3.5Å; K48-I57 HydrophobicContact CG-CB 4.04Å; K48-I57 HydrophobicContact CG-CD1 4.25Å; K48-I57 HydrophobicContact CG-CG2 4.06Å; K48-I57 PolarHBondContact NZ-O 3.16Å; S51-I57 WeakPolarHBondContact OG-CD1 3.32Å; P54-I57 PolarHBondContact O-N 2.9Å; T55-I57 VanDerWaalsContact C-N 3.34Å
58	L	84.2	Confident	82.7	Confident	111 Å²	111	64.6 Å²	64.6	58%	0.581	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-58.3	145.2	176.4	-73	167.5	0	0	0	112	Y44	Y44-L58 WeakPolarHBondContact CE1-O 3.45Å; Y44-L58 PolarHBondContact OH-O 3.32Å
59	P	84.7	Confident	82.4	Confident	83 Å²	83	71 Å²	71	54%	0.539	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-54.6	151.1	173.8	-23.7	33.2	0	0	0	112.8	P61	P59-P61 WeakPolarHBondContact O-CD 3.13Å
60	F	85.6	Confident	82.1	Confident	16 Å²	16	63.5 Å²	63.5	7%	0.07	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-71	119	171.6	178.8	-121.8	0	0	0	109.6	L10 M13 A40 V41 Y44 A62 F67	L10-F60 HydrophobicContact CD2-CD2 3.55Å; L10-F60 HydrophobicContact CD2-CE2 3.79Å; M13-F60 HydrophobicContact SD-CD1 4.41Å; M13-F60 HydrophobicContact SD-CE1 4.08Å; M13-F60 HydrophobicContact SD-CE2 4.34Å; M13-F60 HydrophobicContact SD-CZ 4.04Å; A40-F60 HydrophobicContact CB-CE1 3.88Å; V41-F60 HydrophobicContact CG2-CD1 4.28Å; Y44-F60 HydrophobicContact CD1-CB 3.53Å; Y44-F60 HydrophobicContact CD2-CB 3.84Å; Y44-F60 HydrophobicContact CD2-CD2 4.41Å; Y44-F60 HydrophobicContact CD2-CG 4.28Å; Y44-F60 HydrophobicContact CE1-CB 3.86Å; Y44-F60 HydrophobicContact CE2-CB 4.15Å; Y44-F60 HydrophobicContact CG-CB 3.52Å; Y44-F60 HydrophobicContact CG-CG 4.26Å; F60-A62 HydrophobicContact CD1-CB 3.7Å; F60-A62 HydrophobicContact CE1-CB 3.77Å; F60-A62 PolarHBondContact O-N 2.87Å; F60-A62 VanDerWaalsContact O-N 3.13Å; F60-F67 HydrophobicContact CE1-CE2 4.29Å; F60-F67 AromaticContact CE1-CZ 3.97Å; F60-F67 HydrophobicContact CE1-CZ 3.97Å; F60-F67 HydrophobicContact CZ-CZ 4.36Å
61	P	77.3	Confident	81.9	Confident	85 Å²	85	59.3 Å²	59.3	55%	0.552	33%	0.329	S	S	*	.			trans	-66.1	-18	-174.4	25.5	-34.3	0	0	0	113.3	P59 S63	P59-P61 WeakPolarHBondContact O-CD 3.13Å; P61-S63 PolarHBondContact O-N 2.95Å
62	A	81	Confident	81.5	Confident	4 Å²	4	63.4 Å²	63.4	3%	0.033	35%	0.35	C	S	.	.			trans	47.2	36.5	176.4	0	0	0	0	0	113.6	K37 V41 F60 F67	K37-A62 HydrophobicContact CD-CB 4.35Å; K37-A62 WeakPolarHBondContact CE-O 3.44Å; K37-A62 HydrophobicContact CG-CB 3.96Å; K37-A62 PolarHBondContact NZ-O 3.32Å; V41-A62 HydrophobicContact CG2-CB 3.9Å; F60-A62 HydrophobicContact CD1-CB 3.7Å; F60-A62 HydrophobicContact CE1-CB 3.77Å; F60-A62 PolarHBondContact O-N 2.87Å; F60-A62 VanDerWaalsContact O-N 3.13Å; A62-F67 HydrophobicContact CB-CE2 4.22Å
63	S	77.5	Confident	81.5	Confident	41 Å²	41	61.9 Å²	61.9	29%	0.287	33%	0.333	S	S	.	.			trans	-81.6	155.7	-177.5	66.2	0	0	0	0	111.6	P61 C65 S66 F67	P61-S63 PolarHBondContact O-N 2.95Å; S63-C65 VanDerWaalsContact C-N 3.25Å; S63-C65 PolarHBondContact O-N 3.37Å; S63-S66 WeakPolarHBondContact O-CB 3.35Å; S63-S66 PolarHBondContact O-N 3.37Å; S63-S66 PolarHBondContact OG-N 3.11Å; S63-F67 VanDerWaalsContact O-CD2 3.26Å; S63-F67 WeakPolarHBondContact O-CD2 3.43Å; S63-F67 PolarHBondContact O-N 2.89Å
64	S	73.8	Confident	81.5	Confident	47 Å²	47	62.5 Å²	62.5	33%	0.329	33%	0.332	S	S	.	.	H	α-helix	trans	-50.6	-44.9	173.5	50.8	0	0	0	0	112	S66 F67 C68	S64-S66 VanDerWaalsContact C-N 3.29Å; S64-S66 PolarHBondContact O-N 2.97Å; S64-F67 PolarHBondContact O-N 3.25Å; S64-F67 VanDerWaalsContact O-N 3.1Å; S64-C68 PolarHBondContact O-N 2.92Å; S64-C68 PolarHBondContact O-SG 3.5Å
65	C	76.2	Confident	81.3	Confident	34 Å²	34	63.6 Å²	63.6	23%	0.23	34%	0.341	C	S	.	.	H	α-helix	trans	-53.9	-42.9	176.3	-134.7	0	0	0	0	112.3	S63 C68 R69 C92	S63-C65 VanDerWaalsContact C-N 3.25Å; S63-C65 PolarHBondContact O-N 3.37Å; C65-C68 PolarHBondContact O-N 3.44Å; C65-R69 WeakPolarHBondContact O-CG 3.39Å; C65-R69 PolarHBondContact O-N 2.91Å; C65-R69 VanDerWaalsContact O-N 3.14Å; C65-C92 WeakPolarHBondContact CB-SG 2.99Å; C65-C92 WeakPolarHBondContact SG-CB 3.35Å; C65-C92 CovalentContact SG-SG 2.07Å; C65-C92 PolarHBondContact SG-SG 3.19Å
66	S	81.2	Confident	81	Confident	25 Å²	25	58 Å²	58	18%	0.175	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-43.2	179.1	-168.5	0	0	0	0	111.3	S63 S64 R69 F70	S63-S66 WeakPolarHBondContact O-CB 3.35Å; S63-S66 PolarHBondContact O-N 3.37Å; S63-S66 PolarHBondContact OG-N 3.11Å; S64-S66 VanDerWaalsContact C-N 3.29Å; S64-S66 PolarHBondContact O-N 2.97Å; S66-R69 PolarHBondContact O-N 3.07Å; S66-F70 WeakPolarHBondContact O-CB 3.45Å; S66-F70 PolarHBondContact O-N 3.02Å
67	F	82.8	Confident	80.3	Confident	2 Å²	2	60 Å²	60	1%	0.009	31%	0.309	C	S	.	.	H	α-helix	trans	-72.7	-31.6	179.1	-73.2	-76.6	0	0	0	113	L17 F33 I36 K37 A40 F60 A62 S63 S64 F70 K71 L81	L17-F67 HydrophobicContact CD2-CE1 4.02Å; F33-F67 HydrophobicContact CE2-CB 3.94Å; F33-F67 HydrophobicContact CE2-CD1 4.46Å; F33-F67 AromaticContact CE2-CD2 3.63Å; F33-F67 HydrophobicContact CE2-CD2 3.63Å; F33-F67 HydrophobicContact CE2-CE2 4.27Å; F33-F67 AromaticContact CE2-CG 3.75Å; F33-F67 HydrophobicContact CE2-CG 3.75Å; F33-F67 AromaticContact CZ-CD2 4Å; F33-F67 HydrophobicContact CZ-CD2 4Å; I36-F67 HydrophobicContact CG2-CD1 4.26Å; I36-F67 HydrophobicContact CG2-CE1 3.91Å; K37-F67 HydrophobicContact CB-CE2 4.27Å; K37-F67 HydrophobicContact CB-CZ 4.19Å; K37-F67 HydrophobicContact CG-CE2 4.07Å; K37-F67 HydrophobicContact CG-CZ 4.28Å; A40-F67 HydrophobicContact CB-CE1 3.94Å; A40-F67 HydrophobicContact CB-CZ 3.7Å; F60-F67 HydrophobicContact CE1-CE2 4.29Å; F60-F67 AromaticContact CE1-CZ 3.97Å; F60-F67 HydrophobicContact CE1-CZ 3.97Å; F60-F67 HydrophobicContact CZ-CZ 4.36Å; A62-F67 HydrophobicContact CB-CE2 4.22Å; S63-F67 VanDerWaalsContact O-CD2 3.26Å; S63-F67 WeakPolarHBondContact O-CD2 3.43Å; S63-F67 PolarHBondContact O-N 2.89Å; S64-F67 PolarHBondContact O-N 3.25Å; S64-F67 VanDerWaalsContact O-N 3.1Å; F67-F70 HydrophobicContact CD1-CD1 4.43Å; F67-F70 PolarHBondContact O-N 2.77Å; F67-K71 WeakPolarHBondContact O-CB 3.44Å; F67-K71 PolarHBondContact O-N 2.9Å; F67-L81 WeakPolarHBondContact CB-O 3.35Å; F67-L81 HydrophobicContact CD1-CD2 4.47Å
68	C	78.5	Confident	79.5	Confident	41 Å²	41	65.6 Å²	65.6	28%	0.277	34%	0.339	S	S	.	.	H	α-helix	trans	-61.6	-46.9	171.7	-67.6	0	0	0	0	111.1	S64 C65 F70 K71 N72 C82	S64-C68 PolarHBondContact O-N 2.92Å; S64-C68 PolarHBondContact O-SG 3.5Å; C65-C68 PolarHBondContact O-N 3.44Å; C68-F70 VanDerWaalsContact C-N 3.33Å; C68-F70 PolarHBondContact O-N 3.47Å; C68-K71 WeakPolarHBondContact O-CB 2.93Å; C68-K71 PolarHBondContact O-N 2.75Å; C68-N72 PolarHBondContact O-N 3.35Å; C68-N72 VanDerWaalsContact O-N 3.08Å; C68-C82 PolarHBondContact SG-SG 3.35Å
69	R	83.2	Confident	78.7	Confident	165 Å²	165	61 Å²	61	62%	0.623	32%	0.316	S	S	*	.	H	α-helix	trans	-64.6	-38.4	176.3	-67.3	-178.7	179.8	176.4	1.1	112.1	C65 S66 N72 R73	C65-R69 WeakPolarHBondContact O-CG 3.39Å; C65-R69 PolarHBondContact O-N 2.91Å; C65-R69 VanDerWaalsContact O-N 3.14Å; S66-R69 PolarHBondContact O-N 3.07Å; R69-N72 PolarHBondContact O-N 2.83Å; R69-R73 WeakPolarHBondContact O-CG 3.46Å; R69-R73 PolarHBondContact O-N 3.11Å
70	F	85.1	Confident	77.9	Confident	3 Å²	3	67.3 Å²	67.3	1%	0.013	33%	0.329	C	S	.	.	H	α-helix	trans	-63.1	-46.2	173.9	169.1	-101	0	0	0	112.2	E14 L17 I21 S66 F67 C68 N72 R73 Y74 F76 L81	E14-F70 HydrophobicContact CB-CD2 4.03Å; E14-F70 HydrophobicContact CB-CE2 4.09Å; E14-F70 HydrophobicContact CG-CD2 3.81Å; E14-F70 HydrophobicContact CG-CE2 4.32Å; L17-F70 HydrophobicContact CB-CZ 4.31Å; L17-F70 HydrophobicContact CD2-CE1 4.05Å; L17-F70 HydrophobicContact CD2-CE2 4.27Å; L17-F70 HydrophobicContact CD2-CZ 3.88Å; L17-F70 HydrophobicContact CG-CZ 4.07Å; I21-F70 HydrophobicContact CD1-CE1 3.6Å; I21-F70 HydrophobicContact CD1-CZ 3.87Å; S66-F70 WeakPolarHBondContact O-CB 3.45Å; S66-F70 PolarHBondContact O-N 3.02Å; F67-F70 HydrophobicContact CD1-CD1 4.43Å; F67-F70 PolarHBondContact O-N 2.77Å; C68-F70 VanDerWaalsContact C-N 3.33Å; C68-F70 PolarHBondContact O-N 3.47Å; F70-N72 VanDerWaalsContact C-N 3.29Å; F70-N72 PolarHBondContact O-N 3.31Å; F70-R73 PolarHBondContact O-N 3.48Å; F70-Y74 AromaticContact CD2-CD2 3.49Å; F70-Y74 HydrophobicContact CD2-CD2 3.49Å; F70-Y74 VanDerWaalsContact CD2-CD2 3.49Å; F70-Y74 AromaticContact CD2-CE2 3.66Å; F70-Y74 HydrophobicContact CD2-CE2 3.66Å; F70-Y74 HydrophobicContact CD2-CG 4.46Å; F70-Y74 AromaticContact CE2-CD2 3.44Å; F70-Y74 HydrophobicContact CE2-CD2 3.44Å; F70-Y74 VanDerWaalsContact CE2-CD2 3.44Å; F70-Y74 AromaticContact CE2-CE2 3.63Å; F70-Y74 HydrophobicContact CE2-CE2 3.63Å; F70-Y74 HydrophobicContact CE2-CG 4.06Å; F70-Y74 HydrophobicContact CG-CD2 4.36Å; F70-Y74 HydrophobicContact CZ-CD2 4.28Å; F70-Y74 WeakPolarHBondContact O-CD2 2.94Å; F70-Y74 PolarHBondContact O-N 3.17Å; F70-F76 AromaticContact CE1-CD2 3.8Å; F70-F76 HydrophobicContact CE1-CD2 3.8Å; F70-F76 AromaticContact CE1-CE2 3.97Å; F70-F76 HydrophobicContact CE1-CE2 3.97Å; F70-F76 AromaticContact CZ-CD2 3.98Å; F70-F76 HydrophobicContact CZ-CD2 3.98Å; F70-F76 AromaticContact CZ-CE2 3.66Å; F70-F76 HydrophobicContact CZ-CE2 3.66Å; F70-L81 HydrophobicContact CD1-CD1 4.01Å; F70-L81 HydrophobicContact CE1-CD1 4.11Å; F70-L81 HydrophobicContact CE1-CD2 4.49Å
71	K	82.8	Confident	76.9	Confident	46 Å²	46	66.6 Å²	66.6	20%	0.2	33%	0.325	C	S	.	.	H	α-helix	trans	-54.4	-46.4	175.7	-177.9	179.2	174.5	-173.7	0	111.1	F67 C68 S75 F76 L81	F67-K71 WeakPolarHBondContact O-CB 3.44Å; F67-K71 PolarHBondContact O-N 2.9Å; C68-K71 WeakPolarHBondContact O-CB 2.93Å; C68-K71 PolarHBondContact O-N 2.75Å; K71-S75 PolarHBondContact O-N 3.39Å; K71-F76 WeakPolarHBondContact CE-O 3.34Å; K71-F76 WeakPolarHBondContact CG-O 3.37Å; K71-F76 PolarHBondContact O-N 3.02Å; K71-L81 HydrophobicContact CB-CB 4.31Å; K71-L81 HydrophobicContact CB-CD1 3.61Å; K71-L81 HydrophobicContact CD-CB 4.27Å; K71-L81 HydrophobicContact CD-CD1 4.4Å; K71-L81 HydrophobicContact CG-CD1 3.88Å
72	N	78.5	Confident	76	Confident	109 Å²	109	63.8 Å²	63.8	58%	0.583	31%	0.307	S	S	*	.	H	α-helix	trans	-65.8	-41.5	179.1	-70.4	0.6	0	0	0	112.1	C68 R69 F70	C68-N72 PolarHBondContact O-N 3.35Å; C68-N72 VanDerWaalsContact O-N 3.08Å; R69-N72 PolarHBondContact O-N 2.83Å; F70-N72 VanDerWaalsContact C-N 3.29Å; F70-N72 PolarHBondContact O-N 3.31Å
73	R	84.8	Confident	74.7	Confident	127 Å²	127	66.6 Å²	66.6	48%	0.479	34%	0.337	S	S	.	.	H	α-helix	trans	-63.9	-40.8	178.6	-79.9	-168.9	-70.5	-80.9	-2.6	113.5	E14 R69 F70	E14-R73 IonicContact OE1-CZ 3.19Å; E14-R73 IonicContact OE1-NE 3.83Å; E14-R73 IonicContact OE1-NH2 2.76Å; E14-R73 PolarHBondContact OE1-NH2 2.96Å; E14-R73 IonicContact OE2-CZ 2.79Å; E14-R73 VanDerWaalsContact OE2-CZ 3.26Å; E14-R73 IonicContact OE2-NE 2.75Å; E14-R73 PolarHBondContact OE2-NE 3.34Å; E14-R73 IonicContact OE2-NH2 3.92Å; E14-R73 PolarHBondContact OE2-NH2 2.75Å; R69-R73 WeakPolarHBondContact O-CG 3.46Å; R69-R73 PolarHBondContact O-N 3.11Å; F70-R73 PolarHBondContact O-N 3.48Å
74	Y	82	Confident	73.3	Confident	73 Å²	73	72.3 Å²	72.3	29%	0.286	36%	0.359	S	S	.	.	H	α-helix	trans	-101.9	4.1	-173.3	-70.3	-94.1	0	0	0	114	E14 K15 S18 F70 F76	E14-Y74 HydrophobicContact CB-CE2 3.82Å; E14-Y74 WeakPolarHBondContact CB-OH 3.41Å; K15-Y74 PolarHBondContact N-OH 3.17Å; S18-Y74 WeakPolarHBondContact OG-CE1 3.47Å; F70-Y74 AromaticContact CD2-CD2 3.49Å; F70-Y74 HydrophobicContact CD2-CD2 3.49Å; F70-Y74 VanDerWaalsContact CD2-CD2 3.49Å; F70-Y74 AromaticContact CD2-CE2 3.66Å; F70-Y74 HydrophobicContact CD2-CE2 3.66Å; F70-Y74 HydrophobicContact CD2-CG 4.46Å; F70-Y74 AromaticContact CE2-CD2 3.44Å; F70-Y74 HydrophobicContact CE2-CD2 3.44Å; F70-Y74 VanDerWaalsContact CE2-CD2 3.44Å; F70-Y74 AromaticContact CE2-CE2 3.63Å; F70-Y74 HydrophobicContact CE2-CE2 3.63Å; F70-Y74 HydrophobicContact CE2-CG 4.06Å; F70-Y74 HydrophobicContact CG-CD2 4.36Å; F70-Y74 HydrophobicContact CZ-CD2 4.28Å; F70-Y74 WeakPolarHBondContact O-CD2 2.94Å; F70-Y74 PolarHBondContact O-N 3.17Å; Y74-F76 VanDerWaalsContact C-N 3.27Å; Y74-F76 HydrophobicContact CD1-CE2 4.48Å; Y74-F76 HydrophobicContact CG-CE2 4.07Å; Y74-F76 PolarHBondContact O-N 3.31Å
75	S	79.4	Confident	72.1	Confident	71 Å²	71	74.3 Å²	74.3	50%	0.497	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	35.1	179.1	-61.9	0	0	0	0	114.2	K71 Y77	K71-S75 PolarHBondContact O-N 3.39Å; S75-Y77 VanDerWaalsContact O-CD2 3.3Å; S75-Y77 WeakPolarHBondContact O-CD2 3.49Å; S75-Y77 PolarHBondContact O-N 2.78Å
76	F	76.9	Confident	70.7	Confident	22 Å²	22	77.1 Å²	77.1	10%	0.096	41%	0.413	C	S	.	.			trans	-80.5	61.1	177	-70.4	-53.4	0	0	0	112	I21 E22 F70 K71 Y74 N78 V79 L81	I21-F76 HydrophobicContact CB-CZ 4.26Å; I21-F76 HydrophobicContact CD1-CD2 4.46Å; I21-F76 HydrophobicContact CD1-CE2 4.3Å; I21-F76 HydrophobicContact CG2-CD1 4.18Å; I21-F76 HydrophobicContact CG2-CE1 4Å; I21-F76 HydrophobicContact CG2-CE2 4.48Å; I21-F76 HydrophobicContact CG2-CZ 4.16Å; E22-F76 HydrophobicContact CG-CE1 3.99Å; E22-F76 HydrophobicContact CG-CZ 4.17Å; F70-F76 AromaticContact CE1-CD2 3.8Å; F70-F76 HydrophobicContact CE1-CD2 3.8Å; F70-F76 AromaticContact CE1-CE2 3.97Å; F70-F76 HydrophobicContact CE1-CE2 3.97Å; F70-F76 AromaticContact CZ-CD2 3.98Å; F70-F76 HydrophobicContact CZ-CD2 3.98Å; F70-F76 AromaticContact CZ-CE2 3.66Å; F70-F76 HydrophobicContact CZ-CE2 3.66Å; K71-F76 WeakPolarHBondContact CE-O 3.34Å; K71-F76 WeakPolarHBondContact CG-O 3.37Å; K71-F76 PolarHBondContact O-N 3.02Å; Y74-F76 VanDerWaalsContact C-N 3.27Å; Y74-F76 HydrophobicContact CD1-CE2 4.48Å; Y74-F76 HydrophobicContact CG-CE2 4.07Å; Y74-F76 PolarHBondContact O-N 3.31Å; F76-N78 PolarHBondContact O-N 3.46Å; F76-V79 HydrophobicContact CB-CB 4.22Å; F76-V79 HydrophobicContact CB-CG2 4.07Å; F76-V79 HydrophobicContact CD1-CG2 4.31Å; F76-V79 HydrophobicContact CG-CG2 4.41Å; F76-V79 PolarHBondContact O-N 2.96Å; F76-L81 HydrophobicContact CB-CD1 3.84Å; F76-L81 HydrophobicContact CD2-CD1 4.42Å
77	Y	67.5	Low	69	Low	141 Å²	141	81.4 Å²	81.4	55%	0.553	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-27.1	-178.4	-61.6	-71.9	0	0	0	113.3	S75	S75-Y77 VanDerWaalsContact O-CD2 3.3Å; S75-Y77 WeakPolarHBondContact O-CD2 3.49Å; S75-Y77 PolarHBondContact O-N 2.78Å
78	N	66.5	Low	67	Low	132 Å²	132	84.9 Å²	84.9	71%	0.706	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-0.7	-177.2	-59.3	-25.5	0	0	0	113.6	F76	F76-N78 PolarHBondContact O-N 3.46Å
79	V	68.1	Low	65.5	Low	15 Å²	15	89 Å²	89	9%	0.091	49%	0.492	C	S	.	.	S	Bend	trans	-107.4	123.2	-179.6	-170.5	0	0	0	0	108.6	I21 I36 F76 L81	I21-V79 HydrophobicContact CG2-CG1 4.47Å; I21-V79 HydrophobicContact CG2-CG2 3.89Å; I36-V79 HydrophobicContact CD1-CG1 3.35Å; F76-V79 HydrophobicContact CB-CB 4.22Å; F76-V79 HydrophobicContact CB-CG2 4.07Å; F76-V79 HydrophobicContact CD1-CG2 4.31Å; F76-V79 HydrophobicContact CG-CG2 4.41Å; F76-V79 PolarHBondContact O-N 2.96Å; V79-L81 VanDerWaalsContact C-N 3.28Å; V79-L81 HydrophobicContact CB-CD1 4.27Å; V79-L81 HydrophobicContact CB-CG 4.04Å; V79-L81 HydrophobicContact CG1-CD1 4.4Å; V79-L81 HydrophobicContact CG1-CD2 4Å; V79-L81 HydrophobicContact CG1-CG 3.78Å; V79-L81 PolarHBondContact O-N 3.21Å
80	R	67.2	Low	64	Low	215 Å²	215	86 Å²	86	81%	0.811	49%	0.491	S	S	*	.			trans	-72.5	85.4	174.4	-66.1	-174.4	-176.4	-171	0.5	109.1	F33	F33-R80 WeakPolarHBondContact CB-O 3.39Å
81	L	63.7	Low	62.3	Low	0 Å²	0	91.3 Å²	91.3	0%	0	52%	0.52	C	S	.	.			trans	-95.6	-6.6	-177.4	-73.9	169.4	0	0	0	114.1	I21 F33 I36 F67 F70 K71 F76 V79	I21-L81 HydrophobicContact CD1-CD2 4.36Å; F33-L81 VanDerWaalsContact CD2-C 3.46Å; F33-L81 WeakPolarHBondContact CD2-O 3.45Å; F33-L81 WeakPolarHBondContact CE2-O 3.18Å; I36-L81 HydrophobicContact CB-CD2 4.19Å; I36-L81 HydrophobicContact CD1-CD2 3.38Å; I36-L81 HydrophobicContact CD1-CG 4.36Å; I36-L81 HydrophobicContact CG1-CD2 4.28Å; I36-L81 HydrophobicContact CG2-CD2 3.61Å; F67-L81 WeakPolarHBondContact CB-O 3.35Å; F67-L81 HydrophobicContact CD1-CD2 4.47Å; F70-L81 HydrophobicContact CD1-CD1 4.01Å; F70-L81 HydrophobicContact CE1-CD1 4.11Å; F70-L81 HydrophobicContact CE1-CD2 4.49Å; K71-L81 HydrophobicContact CB-CB 4.31Å; K71-L81 HydrophobicContact CB-CD1 3.61Å; K71-L81 HydrophobicContact CD-CB 4.27Å; K71-L81 HydrophobicContact CD-CD1 4.4Å; K71-L81 HydrophobicContact CG-CD1 3.88Å; F76-L81 HydrophobicContact CB-CD1 3.84Å; F76-L81 HydrophobicContact CD2-CD1 4.42Å; V79-L81 VanDerWaalsContact C-N 3.28Å; V79-L81 HydrophobicContact CB-CD1 4.27Å; V79-L81 HydrophobicContact CB-CG 4.04Å; V79-L81 HydrophobicContact CG1-CD1 4.4Å; V79-L81 HydrophobicContact CG1-CD2 4Å; V79-L81 HydrophobicContact CG1-CG 3.78Å; V79-L81 PolarHBondContact O-N 3.21Å
82	C	59.3	Low	60.6	Low	26 Å²	26	91.3 Å²	91.3	18%	0.176	53%	0.525	C	S	.	.	S	Bend	trans	-124.8	139.4	170.8	-155.8	0	0	0	0	107.1	C68 E84	C68-C82 PolarHBondContact SG-SG 3.35Å; C82-E84 PolarHBondContact O-N 3.3Å
83	G	53.8	Low	59.2	Low	64 Å²	64	88.9 Å²	88.9	66%	0.66	52%	0.52	S	S	*	.			trans	-73.9	57.4	174.7	0	0	0	0	0	111.1	A85	G83-A85 PolarHBondContact O-N 3.27Å
84	E	48.8	Very low	57.4	Low	160 Å²	160	90.2 Å²	90.2	75%	0.748	53%	0.532	S	S	*	.			trans	-75.8	87.6	-171.9	-119.4	155.7	-174.8	0	0	110.3	C82	C82-E84 PolarHBondContact O-N 3.3Å
85	A	47.1	Very low	55.7	Low	89 Å²	89	97.1 Å²	97.1	74%	0.736	56%	0.558	S	S	*	*	S	Bend	trans	-143.3	115.2	152.3	0	0	0	0	0	107.3	G83 S87	G83-A85 PolarHBondContact O-N 3.27Å; A85-S87 PolarHBondContact O-N 3.01Å
86	G	47.5	Very low	53.9	Low	93 Å²	93	101.4 Å²	101.4	96%	0.959	57%	0.567	S	S	*	*	S	Bend	trans	71.6	-15.5	157.4	0	0	0	0	0	121.3	A88	G86-A88 PolarHBondContact O-N 2.96Å
87	S	44.9	Very low	52.5	Low	115 Å²	115	103.9 Å²	103.9	80%	0.804	59%	0.586	S	S	*	*			trans	-89.5	97.1	-177.9	178.1	0	0	0	0	111.9	A85	A85-S87 PolarHBondContact O-N 3.01Å
88	A	42	Very low	51.4	Low	76 Å²	76	101.9 Å²	101.9	63%	0.628	59%	0.589	S	S	*	*			trans	-48	154.8	168.6	0	0	0	0	0	113.5	G86 V90	G86-A88 PolarHBondContact O-N 2.96Å; A88-V90 VanDerWaalsContact C-N 3.25Å; A88-V90 PolarHBondContact O-N 2.87Å
89	D	47	Very low	50.8	Low	128 Å²	128	103.5 Å²	103.5	68%	0.684	59%	0.592	S	S	*	*	S	Bend	trans	-58.3	57	-172.7	-155.2	1.1	0	0	0	115.9
90	V	50.8	Low	50.1	Low	100 Å²	100	107.9 Å²	107.9	61%	0.606	62%	0.619	S	S	*	*			trans	-87.2	-30.8	-176.9	-179.1	0	0	0	0	112.2	A88	A88-V90 VanDerWaalsContact C-N 3.25Å; A88-V90 PolarHBondContact O-N 2.87Å
91	D	50.6	Low	49.2	Very low	116 Å²	116	103.9 Å²	103.9	62%	0.62	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-23.8	-166.8	-139.8	21.4	0	0	0	114.1
92	C	45.8	Very low	48.2	Very low	46 Å²	46	109.9 Å²	109.9	31%	0.311	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.3	-27	174.3	-57.5	0	0	0	0	112.3	C65	C65-C92 WeakPolarHBondContact CB-SG 2.99Å; C65-C92 WeakPolarHBondContact SG-CB 3.35Å; C65-C92 CovalentContact SG-SG 2.07Å; C65-C92 PolarHBondContact SG-SG 3.19Å
93	A	48.8	Very low	47.5	Very low	58 Å²	58	113.8 Å²	113.8	48%	0.479	67%	0.669	S	S	.	*	G	3₁₀ helix	trans	-74.1	-28.3	178.6	0	0	0	0	0	113.5	R95 F96	A93-R95 PolarHBondContact O-N 3.13Å; A93-R95 VanDerWaalsContact O-N 3.15Å; A93-F96 PolarHBondContact O-N 2.86Å
94	Q	47.3	Very low	47.3	Very low	154 Å²	154	116.9 Å²	116.9	72%	0.72	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-75.4	-0.9	-176	-154.1	170.6	13.9	0	0	114.4
95	R	47.6	Very low	46.9	Very low	219 Å²	219	118.1 Å²	118.1	83%	0.826	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-119.6	27.4	178.1	-67.8	-170.8	174.6	-174.3	-0.1	113.6	A93	A93-R95 PolarHBondContact O-N 3.13Å; A93-R95 VanDerWaalsContact O-N 3.15Å
96	F	40.7	Very low	46.6	Very low	160 Å²	160	122 Å²	122	70%	0.702	68%	0.68	S	S	*	*	S	Bend	trans	-72.5	137.4	162.8	-98.9	-94	0	0	0	110	A93 T98	A93-F96 PolarHBondContact O-N 2.86Å; F96-T98 PolarHBondContact O-N 3.29Å
97	P	48	Very low	46.3	Very low	74 Å²	74	126.5 Å²	126.5	48%	0.481	67%	0.674	S	S	.	*			trans	-58.4	130.7	177.3	21.9	-30	0	0	0	110.2	E99 V100	P97-E99 PolarHBondContact O-N 3.12Å; P97-V100 PolarHBondContact O-N 3.06Å
98	T	43.1	Very low	45.7	Very low	100 Å²	100	129.6 Å²	129.6	61%	0.613	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-58.2	-7.2	-174.1	-32.2	0	0	0	0	114.1	F96 V100	F96-T98 PolarHBondContact O-N 3.29Å; T98-V100 VanDerWaalsContact C-N 3.32Å; T98-V100 PolarHBondContact O-N 3.46Å
99	E	54.2	Low	45.7	Very low	165 Å²	165	131.6 Å²	131.6	77%	0.771	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-76	-13.5	-179.7	-70.8	140.7	176.2	0	0	114	P97	P97-E99 PolarHBondContact O-N 3.12Å
100	V	54.7	Low	45.2	Very low	108 Å²	108	132.1 Å²	132.1	66%	0.655	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-101.3	-9.1	178.8	-169.9	0	0	0	0	112.5	P97 T98	P97-V100 PolarHBondContact O-N 3.06Å; T98-V100 VanDerWaalsContact C-N 3.32Å; T98-V100 PolarHBondContact O-N 3.46Å
101	Q	47.5	Very low	44.9	Very low	131 Å²	131	135.4 Å²	135.4	61%	0.612	70%	0.699	S	S	*	*	S	Bend	trans	-91.5	-8.9	-176.8	-153.9	168.4	30.4	0	0	113.8	S103	Q101-S103 VanDerWaalsContact C-N 3.35Å; Q101-S103 PolarHBondContact O-N 2.79Å
102	N	43.7	Very low	44.7	Very low	126 Å²	126	138.1 Å²	138.1	67%	0.674	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-1	-174.7	-69.1	-18.4	0	0	0	114.6
103	S	44	Very low	44.4	Very low	108 Å²	108	144.4 Å²	144.4	76%	0.755	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	3.6	-178.4	-50.5	0	0	0	0	114.6	Q101	Q101-S103 VanDerWaalsContact C-N 3.35Å; Q101-S103 PolarHBondContact O-N 2.79Å
104	V	48.5	Very low	43.9	Very low	129 Å²	129	150.1 Å²	150.1	78%	0.782	75%	0.754	S	S	*	*	S	Bend	trans	-129.2	17.7	-177.2	-166.8	0	0	0	0	112.3
105	K	40.8	Very low	43.6	Very low	186 Å²	186	151.8 Å²	151.8	81%	0.809	76%	0.759	S	S	*	*			trans	-127.8	15.2	-178.4	-105.9	-177.1	179.6	-176.9	0	115.4
106	E	41.4	Very low	43	Very low	170 Å²	170	149.7 Å²	149.7	79%	0.794	76%	0.763	S	S	*	*	S	Bend	trans	-100	123.5	162.2	-156.2	175	-165.7	0	0	106.2
107	K	40.7	Very low	42.6	Very low	188 Å²	188	147.6 Å²	147.6	82%	0.817	77%	0.768	S	S	*	*	S	Bend	trans	91.5	67.2	-179.5	-45.1	170.4	-158.9	-166	0	116.9
108	M	32.1	Very low	41.9	Very low	180 Å²	180	150.2 Å²	150.2	89%	0.887	78%	0.783	S	S	*	*			trans	-160.7	93.8	133.3	-161.5	126.9	-79	0	0	109.2	T110	M108-T110 PolarHBondContact O-N 3.46Å
109	T	41.8	Very low	41.4	Very low	117 Å²	117	150.4 Å²	150.4	72%	0.718	79%	0.794	S	S	*	*			trans	-67.6	117.6	-178.9	40.1	0	0	0	0	112.1	E111	T109-E111 VanDerWaalsContact C-N 3.28Å; T109-E111 PolarHBondContact O-N 2.81Å
110	T	36.2	Very low	40.6	Very low	140 Å²	140	146.4 Å²	146.4	86%	0.859	80%	0.798	S	S	*	*	S	Bend	trans	29.1	3.5	137.5	44.7	0	0	0	0	125.1	M108	M108-T110 PolarHBondContact O-N 3.46Å
111	E	45.5	Very low	39.7	Very low	168 Å²	168	150.7 Å²	150.7	79%	0.785	81%	0.81	S	S	*	*	S	Bend	trans	-125.7	-2.1	-173	-63.5	-165.3	147.8	0	0	116.6	T109	T109-E111 VanDerWaalsContact C-N 3.28Å; T109-E111 PolarHBondContact O-N 2.81Å
112	E	46.7	Very low	39.3	Very low	174 Å²	174	148.6 Å²	148.6	81%	0.813	82%	0.815	S	S	*	*	S	Bend	trans	-113.2	-4.7	-169.3	-74.6	-97.6	113.3	0	0	116.6
113	L	38.4	Very low	39	Very low	177 Å²	177	152 Å²	152	93%	0.927	83%	0.828	S	S	*	*	S	Bend	trans	-111.7	29.7	179.2	-66.4	-179.2	0	0	0	114.4
114	Q	39.6	Very low	38.6	Very low	179 Å²	179	150.3 Å²	150.3	84%	0.836	83%	0.827	S	S	*	*	S	Bend	trans	-100.3	15.4	172.1	-157.4	177.8	-3.6	0	0	113.4
115	K	40.6	Very low	38.3	Very low	189 Å²	189	154.7 Å²	154.7	82%	0.822	83%	0.829	S	S	*	*	S	Bend	trans	-141.7	45.3	-172.2	-96.1	-170	-177.9	-179.2	0	115.7
116	L	33.8	Very low	38.3	Very low	175 Å²	175	153 Å²	153	92%	0.916	82%	0.824	S	S	*	*			trans	-142.6	33.4	166.2	-73.6	176.6	0	0	0	113.5
117	S	32.3	Very low	38.4	Very low	115 Å²	115	152.5 Å²	152.5	80%	0.804	83%	0.827	S	S	*	*			trans	-102.8	30.4	176.9	73	0	0	0	0	114
118	V	34.8	Very low	38.6	Very low	130 Å²	130	150.9 Å²	150.9	79%	0.788	83%	0.827	S	S	*	*			trans	-133.6	127.2	-172.7	179.8	0	0	0	0	112.2
119	A	32.2	Very low	39.3	Very low	103 Å²	103	150.7 Å²	150.7	85%	0.851	82%	0.824	S	S	*	*			trans	81.3	110.6	154.8	0	0	0	0	0	118.3
120	G	37.9	Very low	39.6	Very low	82 Å²	82	152 Å²	152	85%	0.845	83%	0.827	S	S	*	*			trans	173.5	40.9	164.4	0	0	0	0	0	113.5
121	E	35.9	Very low	40.4	Very low	197 Å²	197	154.4 Å²	154.4	92%	0.921	83%	0.828	S	S	*	*			trans	-70.9	126.3	161.5	-62.9	179.7	143.3	0	0	108.4
122	A	39.2	Very low	40.8	Very low	87 Å²	87	155.3 Å²	155.3	72%	0.719	83%	0.832	S	S	*	*			trans	173.7	117.6	144	0	0	0	0	0	111.2
123	E	37.7	Very low	41.5	Very low	199 Å²	199	153.4 Å²	153.4	93%	0.93	83%	0.832	S	S	*	*			trans	60	138.4	131.9	-56.3	-162.4	145.7	0	0	122.6
124	G	34.7	Very low	42.9	Very low	72 Å²	72	148.6 Å²	148.6	74%	0.742	82%	0.819	S	S	*	*			trans	109.2	92.9	161.5	0	0	0	0	0	112.8
125	R	42.6	Very low	44.3	Very low	221 Å²	221	145.6 Å²	145.6	83%	0.834	82%	0.815	S	S	*	*				58.7	106.4	78.8	-150.5	178.1	-148.1	-140.6	4	112.4
126	E	40.7	Very low	45.6	Very low	149 Å²	149	142.1 Å²	142.1	70%	0.696	81%	0.811	S	S	*	*			trans	46.9	109.8	147.3	-62.5	165.7	-156.9	0	0	117.7
127	D	42.5	Very low	47.4	Very low	160 Å²	160	139.1 Å²	139.1	86%	0.856	80%	0.802	S	S	*	*			trans	167	101	132.1	-78.5	-24.6	0	0	0	110.3	E129	D127-E129 PolarHBondContact O-N 3.03Å
128	D	44.6	Very low	49.1	Very low	154 Å²	154	138.3 Å²	138.3	82%	0.824	79%	0.794	S	S	*	*			trans	-90.8	76.7	172.2	-170.6	17.6	0	0	0	109.6	N130	D128-N130 PolarHBondContact O-N 2.92Å
129	E	48.5	Very low	50.6	Low	177 Å²	177	144.5 Å²	144.5	83%	0.827	80%	0.803	S	S	*	*			trans	-82.3	92.1	157.1	-74	-166.5	159.2	0	0	108.8	D127	D127-E129 PolarHBondContact O-N 3.03Å
130	N	48.2	Very low	52.2	Low	143 Å²	143	145.1 Å²	145.1	77%	0.765	79%	0.789	S	S	*	*			trans	-147.5	71.3	160.9	-106.4	-13.1	0	0	0	111	D128 E132	D128-N130 PolarHBondContact O-N 2.92Å; N130-E132 PolarHBondContact O-N 3.37Å; N130-E132 VanDerWaalsContact O-N 3.11Å
131	Q	52	Low	54.3	Low	192 Å²	192	144.7 Å²	144.7	90%	0.897	77%	0.766	S	S	*	*			trans	-80.2	86.5	169.1	-149.5	159.8	38	0	0	109.1	V133	Q131-V133 PolarHBondContact O-N 3.27Å; Q131-V133 VanDerWaalsContact O-N 3.11Å
132	E	53.5	Low	56.9	Low	186 Å²	186	138.7 Å²	138.7	87%	0.869	74%	0.743	S	S	*	*			trans	-67.3	103.5	172.9	-169.2	179.6	172.5	0	0	109.7	N130 A134	N130-E132 PolarHBondContact O-N 3.37Å; N130-E132 VanDerWaalsContact O-N 3.11Å; E132-A134 PolarHBondContact O-N 3.08Å; E132-A134 VanDerWaalsContact O-N 3.11Å
133	V	61.4	Low	59.2	Low	134 Å²	134	137.4 Å²	137.4	81%	0.812	73%	0.726	S	S	*	*			trans	-69	106.3	175.8	177.8	0	0	0	0	108.9	Q131	Q131-V133 PolarHBondContact O-N 3.27Å; Q131-V133 VanDerWaalsContact O-N 3.11Å
134	A	68.1	Low	61.7	Low	77 Å²	77	131.4 Å²	131.4	64%	0.636	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-54.5	140.5	175.4	0	0	0	0	0	111.7	E132	E132-A134 PolarHBondContact O-N 3.08Å; E132-A134 VanDerWaalsContact O-N 3.11Å
135	P	68.8	Low	64.4	Low	116 Å²	116	132.6 Å²	132.6	75%	0.753	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-59.9	142.7	180	23.4	-32.7	0	0	0	111.1
136	P	68.8	Low	66.8	Low	116 Å²	116	122.2 Å²	122.2	75%	0.753	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-60.4	142.8	-178.1	24.1	-32.9	0	0	0	110.6
137	P	70.4	Confident	69.3	Low	111 Å²	111	116.6 Å²	116.6	72%	0.721	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-56.6	144.1	-179.7	21.3	-31	0	0	0	110.6	R139	P137-R139 PolarHBondContact O-N 2.74Å
138	P	67.9	Low	71.8	Confident	99 Å²	99	113.3 Å²	113.3	64%	0.643	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-53.5	132.3	178.7	-22.7	30.9	0	0	0	110.5	Q140	P138-Q140 HydrophobicContact CB-CG 4.43Å; P138-Q140 PolarHBondContact O-N 2.94Å
139	R	66.2	Low	74.3	Confident	259 Å²	259	108.8 Å²	108.8	98%	0.977	60%	0.595	S	S	*	*			trans	-64.1	97.6	177.1	-63.7	-176.4	-177.7	-147.2	1.1	109.3	P137	P137-R139 PolarHBondContact O-N 2.74Å
140	Q	67.4	Low	76.5	Confident	117 Å²	117	101.1 Å²	101.1	55%	0.547	56%	0.56	S	S	.	*			trans	-112	114.8	177.7	-67.2	-176.6	40.6	0	0	109.6	P138	P138-Q140 HydrophobicContact CB-CG 4.43Å; P138-Q140 PolarHBondContact O-N 2.94Å
141	M	82.3	Confident	78.8	Confident	72 Å²	72	100.2 Å²	100.2	36%	0.355	55%	0.549	S	S	.	.			trans	-84.1	122.5	167.9	-177.6	173.2	55	0	0	109.6	E145 L146 R191	M141-E145 HydrophobicContact CG-CB 3.55Å; M141-E145 HydrophobicContact SD-CB 4.32Å; M141-L146 HydrophobicContact CE-CB 3.86Å; M141-L146 HydrophobicContact CE-CD1 3.44Å; M141-L146 VanDerWaalsContact CE-CD1 3.44Å; M141-L146 HydrophobicContact CE-CG 4.19Å; M141-L146 HydrophobicContact CG-CB 4.38Å; M141-L146 HydrophobicContact SD-CB 4.2Å; M141-R191 PolarHBondContact O-NH1 2.99Å
142	T	89	Confident	81	Confident	72 Å²	72	93.5 Å²	93.5	44%	0.442	52%	0.521	S	S	.	.			trans	-65.1	163.1	176.8	66.4	0	0	0	0	112	A144 E145 L146	T142-A144 VanDerWaalsContact C-N 3.25Å; T142-A144 PolarHBondContact O-N 2.91Å; T142-E145 WeakPolarHBondContact CB-OE2 3.47Å; T142-E145 WeakPolarHBondContact CG2-OE2 3.38Å; T142-E145 PolarHBondContact N-OE2 3.48Å; T142-E145 PolarHBondContact O-N 3.47Å; T142-E145 WeakPolarHBondContact OG1-CB 3.42Å; T142-E145 WeakPolarHBondContact OG1-CG 3.45Å; T142-E145 PolarHBondContact OG1-N 3.41Å; T142-E145 VanDerWaalsContact OG1-N 3.17Å; T142-E145 PolarHBondContact OG1-OE2 3.19Å; T142-L146 WeakPolarHBondContact O-CB 3.41Å; T142-L146 PolarHBondContact O-N 2.92Å
143	T	87.2	Confident	83	Confident	60 Å²	60	87 Å²	87	37%	0.368	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-34.7	175.6	-49.8	0	0	0	0	112.2	S147 L188 R191	T143-S147 WeakPolarHBondContact O-CB 3.49Å; T143-S147 PolarHBondContact O-N 3.38Å; T143-L188 HydrophobicContact CG2-CD1 3.76Å; T143-R191 HydrophobicContact CG2-CB 3.9Å
144	A	90	Very high	84.7	Confident	73 Å²	73	83.2 Å²	83.2	60%	0.603	47%	0.466	S	S	*	.	H	α-helix	trans	-68.5	-46.9	177.9	0	0	0	0	0	111.4	T142 L146 S147 D148	T142-A144 VanDerWaalsContact C-N 3.25Å; T142-A144 PolarHBondContact O-N 2.91Å; A144-L146 VanDerWaalsContact C-N 3.35Å; A144-L146 PolarHBondContact O-N 3.45Å; A144-S147 PolarHBondContact O-N 3.01Å; A144-D148 WeakPolarHBondContact O-CB 3.3Å; A144-D148 PolarHBondContact O-N 3.33Å
145	E	92.3	Very high	86	Confident	97 Å²	97	86.4 Å²	86.4	45%	0.453	46%	0.461	S	S	.	.	H	α-helix	trans	-62.4	-40.6	175.9	-70.7	162.2	151.4	0	0	111.8	M141 T142 D148 T149	M141-E145 HydrophobicContact CG-CB 3.55Å; M141-E145 HydrophobicContact SD-CB 4.32Å; T142-E145 WeakPolarHBondContact CB-OE2 3.47Å; T142-E145 WeakPolarHBondContact CG2-OE2 3.38Å; T142-E145 PolarHBondContact N-OE2 3.48Å; T142-E145 PolarHBondContact O-N 3.47Å; T142-E145 WeakPolarHBondContact OG1-CB 3.42Å; T142-E145 WeakPolarHBondContact OG1-CG 3.45Å; T142-E145 PolarHBondContact OG1-N 3.41Å; T142-E145 VanDerWaalsContact OG1-N 3.17Å; T142-E145 PolarHBondContact OG1-OE2 3.19Å; E145-D148 PolarHBondContact O-N 3.31Å; E145-T149 VanDerWaalsContact O-CB 3.27Å; E145-T149 WeakPolarHBondContact O-CB 3.33Å; E145-T149 PolarHBondContact O-N 3.46Å; E145-T149 PolarHBondContact O-OG1 2.97Å
146	L	92.3	Very high	87.3	Confident	2 Å²	2	89 Å²	89	1%	0.01	46%	0.456	C	S	.	.	H	α-helix	trans	-60.8	-46.5	174.3	176.2	61.8	0	0	0	111.3	M141 T142 A144 T149 L150 Y184 L187 L188	M141-L146 HydrophobicContact CE-CB 3.86Å; M141-L146 HydrophobicContact CE-CD1 3.44Å; M141-L146 VanDerWaalsContact CE-CD1 3.44Å; M141-L146 HydrophobicContact CE-CG 4.19Å; M141-L146 HydrophobicContact CG-CB 4.38Å; M141-L146 HydrophobicContact SD-CB 4.2Å; T142-L146 WeakPolarHBondContact O-CB 3.41Å; T142-L146 PolarHBondContact O-N 2.92Å; A144-L146 VanDerWaalsContact C-N 3.35Å; A144-L146 PolarHBondContact O-N 3.45Å; L146-T149 PolarHBondContact O-N 2.77Å; L146-L150 HydrophobicContact CD1-CD1 4.06Å; L146-L150 HydrophobicContact CD1-CG 4.25Å; L146-L150 HydrophobicContact CG-CD1 4.19Å; L146-L150 WeakPolarHBondContact O-CB 3.19Å; L146-L150 WeakPolarHBondContact O-CG 3.31Å; L146-L150 PolarHBondContact O-N 3.24Å; L146-Y184 HydrophobicContact CD1-CD1 3.86Å; L146-Y184 HydrophobicContact CD1-CG 4.38Å; L146-L187 HydrophobicContact CD2-CB 4.34Å; L146-L187 HydrophobicContact CD2-CD2 3.9Å; L146-L187 HydrophobicContact CD2-CG 3.97Å; L146-L188 HydrophobicContact CD2-CB 3.95Å; L146-L188 HydrophobicContact CD2-CD1 4.24Å; L146-L188 HydrophobicContact CG-CB 4.42Å; L146-L188 HydrophobicContact CG-CD1 4.35Å
147	S	93.7	Very high	88.5	Confident	31 Å²	31	84 Å²	84	22%	0.217	42%	0.422	C	S	.	.	H	α-helix	trans	-62.7	-44.2	178.2	-174.9	0	0	0	0	112	T143 A144 K151	T143-S147 WeakPolarHBondContact O-CB 3.49Å; T143-S147 PolarHBondContact O-N 3.38Å; A144-S147 PolarHBondContact O-N 3.01Å; S147-K151 WeakPolarHBondContact O-CB 3.49Å; S147-K151 VanDerWaalsContact O-CG 3.29Å; S147-K151 WeakPolarHBondContact O-CG 3.45Å; S147-K151 PolarHBondContact O-N 3.49Å
148	D	95.7	Very high	89.6	Confident	91 Å²	91	83.6 Å²	83.6	49%	0.487	41%	0.411	S	S	.	.	H	α-helix	trans	-67.2	-40.1	179.1	-174.2	61.1	0	0	0	112.3	A144 E145 K151 T152	A144-D148 WeakPolarHBondContact O-CB 3.3Å; A144-D148 PolarHBondContact O-N 3.33Å; E145-D148 PolarHBondContact O-N 3.31Å; D148-K151 PolarHBondContact O-N 3.2Å; D148-T152 WeakPolarHBondContact O-CB 3.35Å; D148-T152 PolarHBondContact O-N 3.36Å; D148-T152 PolarHBondContact O-OG1 3.29Å
149	T	95.7	Very high	90.8	Very high	60 Å²	60	85.6 Å²	85.6	37%	0.368	41%	0.406	S	S	.	.	H	α-helix	trans	-60.5	-49.9	175	-59.3	0	0	0	0	110.7	E145 L146 K151 T152 I153	E145-T149 VanDerWaalsContact O-CB 3.27Å; E145-T149 WeakPolarHBondContact O-CB 3.33Å; E145-T149 PolarHBondContact O-N 3.46Å; E145-T149 PolarHBondContact O-OG1 2.97Å; L146-T149 PolarHBondContact O-N 2.77Å; T149-K151 PolarHBondContact O-N 3.11Å; T149-T152 WeakPolarHBondContact O-CB 3.3Å; T149-T152 PolarHBondContact O-N 2.78Å; T149-T152 VanDerWaalsContact O-N 3.15Å; T149-I153 HydrophobicContact CG2-CD1 3.91Å; T149-I153 WeakPolarHBondContact O-CG1 3.19Å; T149-I153 PolarHBondContact O-N 3.28Å
150	L	95.7	Very high	91.9	Very high	16 Å²	16	76 Å²	76	8%	0.084	37%	0.374	C	S	.	.	H	α-helix	trans	-60.8	-43.7	177.8	-73.2	172.2	0	0	0	112	L146 T152 I153 E154 L181 K185 L188	L146-L150 HydrophobicContact CD1-CD1 4.06Å; L146-L150 HydrophobicContact CD1-CG 4.25Å; L146-L150 HydrophobicContact CG-CD1 4.19Å; L146-L150 WeakPolarHBondContact O-CB 3.19Å; L146-L150 WeakPolarHBondContact O-CG 3.31Å; L146-L150 PolarHBondContact O-N 3.24Å; L150-T152 VanDerWaalsContact C-N 3.31Å; L150-T152 PolarHBondContact O-N 3.01Å; L150-I153 PolarHBondContact O-N 3.48Å; L150-E154 WeakPolarHBondContact O-CG 3.29Å; L150-E154 PolarHBondContact O-N 2.87Å; L150-L181 HydrophobicContact CD2-CB 4.32Å; L150-L181 HydrophobicContact CD2-CD2 4.1Å; L150-K185 HydrophobicContact CD1-CG 4.45Å; L150-L188 HydrophobicContact CD1-CB 4.32Å; L150-L188 HydrophobicContact CD1-CD2 4.03Å
151	K	96	Very high	92.9	Very high	124 Å²	124	73.5 Å²	73.5	54%	0.539	36%	0.362	S	S	.	.	H	α-helix	trans	-60.2	-41.3	174.3	-75.6	173.8	-177.6	177	0	112	S147 D148 T149 R155	S147-K151 WeakPolarHBondContact O-CB 3.49Å; S147-K151 VanDerWaalsContact O-CG 3.29Å; S147-K151 WeakPolarHBondContact O-CG 3.45Å; S147-K151 PolarHBondContact O-N 3.49Å; D148-K151 PolarHBondContact O-N 3.2Å; T149-K151 PolarHBondContact O-N 3.11Å; K151-R155 WeakPolarHBondContact O-CG 2.98Å; K151-R155 PolarHBondContact O-N 3.1Å; K151-R155 VanDerWaalsContact O-N 3.07Å
152	T	97.6	Very high	93.1	Very high	50 Å²	50	76.1 Å²	76.1	31%	0.307	37%	0.373	S	S	.	.	H	α-helix	trans	-65	-43.8	178.5	-63.3	0	0	0	0	111.6	D148 T149 L150 R155 R156	D148-T152 WeakPolarHBondContact O-CB 3.35Å; D148-T152 PolarHBondContact O-N 3.36Å; D148-T152 PolarHBondContact O-OG1 3.29Å; T149-T152 WeakPolarHBondContact O-CB 3.3Å; T149-T152 PolarHBondContact O-N 2.78Å; T149-T152 VanDerWaalsContact O-N 3.15Å; L150-T152 VanDerWaalsContact C-N 3.31Å; L150-T152 PolarHBondContact O-N 3.01Å; T152-R155 PolarHBondContact O-N 2.78Å; T152-R155 PolarHBondContact OG1-NH2 3.47Å; T152-R156 WeakPolarHBondContact O-CG 3.44Å; T152-R156 PolarHBondContact O-N 2.07Å; T152-R156 VanDerWaalsContact O-N 3.14Å
153	I	96.9	Very high	93.1	Very high	51 Å²	51	77.1 Å²	77.1	26%	0.262	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-47.5	177.6	-63.5	164.4	0	0	0	110.4	T149 L150 R155 R156 L157 I177 L181	T149-I153 HydrophobicContact CG2-CD1 3.91Å; T149-I153 WeakPolarHBondContact O-CG1 3.19Å; T149-I153 PolarHBondContact O-N 3.28Å; L150-I153 PolarHBondContact O-N 3.48Å; I153-R155 VanDerWaalsContact C-N 3.32Å; I153-R155 PolarHBondContact O-N 3.03Å; I153-R156 WeakPolarHBondContact O-CA 3.37Å; I153-R156 WeakPolarHBondContact O-CB 3.29Å; I153-R156 PolarHBondContact O-N 3.45Å; I153-L157 HydrophobicContact CG2-CD1 4.14Å; I153-L157 HydrophobicContact CG2-CG 4.15Å; I153-L157 WeakPolarHBondContact O-CG 3.46Å; I153-L157 PolarHBondContact O-N 3.14Å; I153-I177 HydrophobicContact CG2-CG2 4.36Å; I153-L181 HydrophobicContact CB-CD1 4.3Å; I153-L181 HydrophobicContact CD1-CD2 4.02Å; I153-L181 HydrophobicContact CG2-CD1 3.58Å
154	E	95.7	Very high	92.9	Very high	54 Å²	54	76.5 Å²	76.5	25%	0.252	37%	0.371	S	S	.	.	H	α-helix	trans	-58.9	-41.7	178.4	-72.5	-67.2	171.9	0	0	112.3	L150 R156 L157 Q158 R178 K185	L150-E154 WeakPolarHBondContact O-CG 3.29Å; L150-E154 PolarHBondContact O-N 2.87Å; E154-R156 VanDerWaalsContact C-N 3.28Å; E154-R156 PolarHBondContact O-N 3.03Å; E154-L157 PolarHBondContact O-N 3.08Å; E154-Q158 WeakPolarHBondContact O-CB 3.49Å; E154-Q158 PolarHBondContact O-N 3.32Å; E154-R178 IonicContact OE2-NE 3.39Å; E154-R178 PolarHBondContact OE2-NE 3.33Å; E154-K185 IonicContact OE1-NZ 3.79Å
155	R	96.7	Very high	92.4	Very high	143 Å²	143	79.4 Å²	79.4	54%	0.54	39%	0.385	S	S	.	.	H	α-helix	trans	-57.9	-39.8	173.1	-74.5	-176.1	-64.1	-129.5	1.6	112.5	K151 T152 I153 W159	K151-R155 WeakPolarHBondContact O-CG 2.98Å; K151-R155 PolarHBondContact O-N 3.1Å; K151-R155 VanDerWaalsContact O-N 3.07Å; T152-R155 PolarHBondContact O-N 2.78Å; T152-R155 PolarHBondContact OG1-NH2 3.47Å; I153-R155 VanDerWaalsContact C-N 3.32Å; I153-R155 PolarHBondContact O-N 3.03Å; R155-W159 WeakPolarHBondContact O-CB 3.34Å; R155-W159 PolarHBondContact O-N 3.45Å
156	R	96.3	Very high	91.9	Very high	172 Å²	172	78.1 Å²	78.1	65%	0.649	38%	0.381	S	S	*	.	H	α-helix	trans	-72.8	-36.2	178.8	-68.1	-62.2	-174.3	-177	1	112.4	T152 I153 E154 W159 L160	T152-R156 WeakPolarHBondContact O-CG 3.44Å; T152-R156 PolarHBondContact O-N 2.07Å; T152-R156 VanDerWaalsContact O-N 3.14Å; I153-R156 WeakPolarHBondContact O-CA 3.37Å; I153-R156 WeakPolarHBondContact O-CB 3.29Å; I153-R156 PolarHBondContact O-N 3.45Å; E154-R156 VanDerWaalsContact C-N 3.28Å; E154-R156 PolarHBondContact O-N 3.03Å; R156-W159 PolarHBondContact O-N 3.26Å; R156-L160 PolarHBondContact O-N 3.46Å
157	L	94.4	Very high	91.3	Very high	9 Å²	9	83.1 Å²	83.1	5%	0.047	41%	0.412	C	S	.	.	H	α-helix	trans	-64.2	-44.5	173.6	-66.2	-177.8	0	0	0	111.3	I153 E154 L160 E161 T174 I177 R178	I153-L157 HydrophobicContact CG2-CD1 4.14Å; I153-L157 HydrophobicContact CG2-CG 4.15Å; I153-L157 WeakPolarHBondContact O-CG 3.46Å; I153-L157 PolarHBondContact O-N 3.14Å; E154-L157 PolarHBondContact O-N 3.08Å; L157-L160 WeakPolarHBondContact O-CB 3.26Å; L157-L160 PolarHBondContact O-N 3.34Å; L157-E161 WeakPolarHBondContact O-CG 3.2Å; L157-E161 PolarHBondContact O-N 3.17Å; L157-T174 HydrophobicContact CB-CG2 4.11Å; L157-T174 HydrophobicContact CD2-CG2 3.98Å; L157-I177 HydrophobicContact CD1-CB 4.25Å; L157-I177 HydrophobicContact CD1-CG2 3.91Å; L157-I177 HydrophobicContact CD2-CB 4.05Å; L157-I177 HydrophobicContact CD2-CD1 3.61Å; L157-I177 HydrophobicContact CD2-CG1 4.44Å; L157-I177 HydrophobicContact CD2-CG2 3.99Å; L157-I177 HydrophobicContact CG-CG2 4.47Å; L157-R178 HydrophobicContact CD1-CG 3.75Å
158	Q	92.2	Very high	90.7	Very high	103 Å²	103	88.9 Å²	88.9	48%	0.481	44%	0.435	S	S	.	.	H	α-helix	trans	-60.9	-46.8	175.5	-178.6	178.2	-5.8	0	0	111.5	E154 L160 E161 E162	E154-Q158 WeakPolarHBondContact O-CB 3.49Å; E154-Q158 PolarHBondContact O-N 3.32Å; Q158-L160 VanDerWaalsContact C-N 3.27Å; Q158-L160 PolarHBondContact O-N 2.8Å; Q158-E161 PolarHBondContact O-N 2.97Å; Q158-E161 VanDerWaalsContact O-N 3.12Å; Q158-E162 HydrophobicContact CG-CG 4.5Å; Q158-E162 VanDerWaalsContact CG-OE1 3.29Å; Q158-E162 WeakPolarHBondContact CG-OE1 3.47Å; Q158-E162 PolarHBondContact NE2-OE1 3.33Å; Q158-E162 WeakPolarHBondContact O-CG 3.43Å; Q158-E162 PolarHBondContact O-N 3.06Å
159	W	92.9	Very high	90.1	Very high	141 Å²	141	87.1 Å²	87.1	53%	0.534	43%	0.43	S	S	.	.	H	α-helix	trans	-58.3	-39.9	176.3	-176.5	88.6	0	0	0	111.9	R155 R156 E162 N163	R155-W159 WeakPolarHBondContact O-CB 3.34Å; R155-W159 PolarHBondContact O-N 3.45Å; R156-W159 PolarHBondContact O-N 3.26Å; W159-E162 PolarHBondContact O-N 3.48Å; W159-N163 HydrophobicContact CD2-CB 4.41Å; W159-N163 HydrophobicContact CH2-CB 4.2Å; W159-N163 HydrophobicContact CZ2-CB 4.08Å; W159-N163 HydrophobicContact CZ3-CB 4.41Å; W159-N163 PolarHBondContact NE1-ND2 3Å; W159-N163 WeakPolarHBondContact O-CB 3.36Å; W159-N163 PolarHBondContact O-N 3.48Å; W159-N163 PolarHBondContact O-ND2 2.88Å
160	L	90.6	Very high	89.6	Confident	58 Å²	58	84.4 Å²	84.4	30%	0.304	41%	0.414	S	S	.	.	H	α-helix	trans	-63.9	-41.2	176	-175.2	68.1	0	0	0	112	R156 L157 Q158 E162 N163 D164 T174	R156-L160 PolarHBondContact O-N 3.46Å; L157-L160 WeakPolarHBondContact O-CB 3.26Å; L157-L160 PolarHBondContact O-N 3.34Å; Q158-L160 VanDerWaalsContact C-N 3.27Å; Q158-L160 PolarHBondContact O-N 2.8Å; L160-E162 VanDerWaalsContact C-N 3.32Å; L160-E162 PolarHBondContact O-N 3.34Å; L160-N163 PolarHBondContact O-N 3.06Å; L160-D164 VanDerWaalsContact O-CB 3.23Å; L160-D164 WeakPolarHBondContact O-CB 3.49Å; L160-D164 PolarHBondContact O-N 3.32Å; L160-T174 HydrophobicContact CD2-CG2 4.17Å
161	E	87.8	Confident	89.2	Confident	64 Å²	64	84 Å²	84	30%	0.299	41%	0.413	S	S	.	.	H	α-helix	trans	-64.3	-36.1	176.4	-72.4	172	160.6	0	0	112.5	L157 Q158 T174 R178	L157-E161 WeakPolarHBondContact O-CG 3.2Å; L157-E161 PolarHBondContact O-N 3.17Å; Q158-E161 PolarHBondContact O-N 2.97Å; Q158-E161 VanDerWaalsContact O-N 3.12Å; E161-T174 HydrophobicContact CG-CG2 3.58Å; E161-T174 WeakPolarHBondContact OE1-CB 3.31Å; E161-T174 PolarHBondContact OE1-OG1 3.15Å; E161-R178 VanDerWaalsContact CD-NH2 3.33Å; E161-R178 IonicContact OE1-CZ 3.26Å; E161-R178 IonicContact OE1-NH1 3.05Å; E161-R178 PolarHBondContact OE1-NH1 3.38Å; E161-R178 IonicContact OE1-NH2 3.53Å; E161-R178 PolarHBondContact OE1-NH2 3.49Å; E161-R178 VanDerWaalsContact OE1-NH2 3.16Å; E161-R178 IonicContact OE2-CZ 3.16Å; E161-R178 IonicContact OE2-NH1 3.29Å; E161-R178 IonicContact OE2-NH2 2.71Å; E161-R178 PolarHBondContact OE2-NH2 2.87Å
162	E	87.6	Confident	88.9	Confident	127 Å²	127	85.4 Å²	85.4	59%	0.593	42%	0.419	S	S	*	.	H	α-helix	trans	-78.4	-26	-179.5	-70.4	171	-175.6	0	0	113.5	Q158 W159 L160	Q158-E162 HydrophobicContact CG-CG 4.5Å; Q158-E162 VanDerWaalsContact CG-OE1 3.29Å; Q158-E162 WeakPolarHBondContact CG-OE1 3.47Å; Q158-E162 PolarHBondContact NE2-OE1 3.33Å; Q158-E162 WeakPolarHBondContact O-CG 3.43Å; Q158-E162 PolarHBondContact O-N 3.06Å; W159-E162 PolarHBondContact O-N 3.48Å; L160-E162 VanDerWaalsContact C-N 3.32Å; L160-E162 PolarHBondContact O-N 3.34Å
163	N	88.4	Confident	88.6	Confident	94 Å²	94	86.5 Å²	86.5	50%	0.503	43%	0.426	S	S	.	.	H	α-helix	trans	-113.8	-8.4	-170.6	-66.7	-94.9	0	0	0	114.6	W159 L160	W159-N163 HydrophobicContact CD2-CB 4.41Å; W159-N163 HydrophobicContact CH2-CB 4.2Å; W159-N163 HydrophobicContact CZ2-CB 4.08Å; W159-N163 HydrophobicContact CZ3-CB 4.41Å; W159-N163 PolarHBondContact NE1-ND2 3Å; W159-N163 WeakPolarHBondContact O-CB 3.36Å; W159-N163 PolarHBondContact O-N 3.48Å; W159-N163 PolarHBondContact O-ND2 2.88Å; L160-N163 PolarHBondContact O-N 3.06Å
164	D	82.3	Confident	88.4	Confident	47 Å²	47	84 Å²	84	25%	0.251	41%	0.413	S	S	.	.			trans	-78.5	125.7	178.6	-166.5	-12.9	0	0	0	111.7	L160 N166 S170	L160-D164 VanDerWaalsContact O-CB 3.23Å; L160-D164 WeakPolarHBondContact O-CB 3.49Å; L160-D164 PolarHBondContact O-N 3.32Å; D164-N166 PolarHBondContact O-N 2.97Å; D164-N166 PolarHBondContact OD1-N 3.32Å; D164-S170 WeakPolarHBondContact OD2-CB 3.4Å; D164-S170 PolarHBondContact OD2-N 3.3Å
165	C	78.9	Confident	88.3	Confident	134 Å²	134	88.9 Å²	88.9	91%	0.905	43%	0.429	S	S	*	.	S	Bend	trans	-60.1	-23.2	172.2	63.2	0	0	0	0	113.4
166	N	82.5	Confident	88.2	Confident	69 Å²	69	83.8 Å²	83.8	37%	0.369	42%	0.422	S	S	.	.			trans	-110.3	87.9	175.6	-174	-13.2	0	0	0	110.4	D164 E168 S169 S170	D164-N166 PolarHBondContact O-N 2.97Å; D164-N166 PolarHBondContact OD1-N 3.32Å; N166-E168 PolarHBondContact O-N 2.67Å; N166-E168 PolarHBondContact OD1-N 3.29Å; N166-S169 VanDerWaalsContact CG-OG 3.28Å; N166-S169 PolarHBondContact ND2-OG 3.15Å; N166-S169 PolarHBondContact O-N 2.76Å; N166-S169 VanDerWaalsContact O-N 3.12Å; N166-S169 PolarHBondContact OD1-N 3.45Å; N166-S169 VanDerWaalsContact OD1-N 3.08Å; N166-S170 PolarHBondContact O-N 3.5Å; N166-S170 PolarHBondContact O-OG 3.44Å
167	T	80	Confident	88.2	Confident	107 Å²	107	78.5 Å²	78.5	66%	0.656	41%	0.406	S	S	*	.	H	α-helix	trans	-60.1	-27.2	-179.7	55.2	0	0	0	0	113.6	S170 G171	T167-S170 WeakPolarHBondContact CA-OG 3.2Å; T167-S170 PolarHBondContact O-OG 3.35Å; T167-G171 PolarHBondContact O-N 3.19Å; T167-G171 VanDerWaalsContact O-N 3.08Å
168	E	82.1	Confident	88.3	Confident	153 Å²	153	81 Å²	81	72%	0.715	41%	0.414	S	S	*	.	H	α-helix	trans	-71.5	-43.9	176.3	-170.1	179.9	177.3	0	0	111.3	N166 K172	N166-E168 PolarHBondContact O-N 2.67Å; N166-E168 PolarHBondContact OD1-N 3.29Å; E168-K172 WeakPolarHBondContact O-CB 3.3Å; E168-K172 PolarHBondContact O-N 2.87Å
169	S	81.4	Confident	88.5	Confident	54 Å²	54	79.1 Å²	79.1	38%	0.378	42%	0.417	S	S	.	.	H	α-helix	trans	-69.6	-45.2	178.5	-70.5	0	0	0	0	112.6	N166 K172 T173	N166-S169 VanDerWaalsContact CG-OG 3.28Å; N166-S169 PolarHBondContact ND2-OG 3.15Å; N166-S169 PolarHBondContact O-N 2.76Å; N166-S169 VanDerWaalsContact O-N 3.12Å; N166-S169 PolarHBondContact OD1-N 3.45Å; N166-S169 VanDerWaalsContact OD1-N 3.08Å; S169-K172 PolarHBondContact O-N 3.35Å; S169-T173 WeakPolarHBondContact O-CB 3.35Å; S169-T173 PolarHBondContact O-N 2.97Å; S169-T173 PolarHBondContact O-OG1 3.15Å
170	S	84.9	Confident	88.6	Confident	3 Å²	3	77 Å²	77	2%	0.021	42%	0.422	C	S	.	.	H	α-helix	trans	-60.1	-50	174.9	58.6	0	0	0	0	110.4	D164 N166 T167 K172 T173 T174	D164-S170 WeakPolarHBondContact OD2-CB 3.4Å; D164-S170 PolarHBondContact OD2-N 3.3Å; N166-S170 PolarHBondContact O-N 3.5Å; N166-S170 PolarHBondContact O-OG 3.44Å; T167-S170 WeakPolarHBondContact CA-OG 3.2Å; T167-S170 PolarHBondContact O-OG 3.35Å; S170-K172 VanDerWaalsContact C-N 3.34Å; S170-K172 PolarHBondContact O-N 3.2Å; S170-T173 PolarHBondContact O-N 2.83Å; S170-T173 VanDerWaalsContact O-N 3.15Å; S170-T174 WeakPolarHBondContact O-CB 3.33Å; S170-T174 VanDerWaalsContact O-CG2 3.26Å; S170-T174 WeakPolarHBondContact O-CG2 3.19Å; S170-T174 PolarHBondContact O-N 3.3Å; S170-T174 PolarHBondContact O-OG1 3.48Å; S170-T174 VanDerWaalsContact O-OG1 3.08Å
171	G	87.8	Confident	88.9	Confident	7 Å²	7	75 Å²	75	7%	0.072	41%	0.412	C	S	.	.	H	α-helix	trans	-59.3	-40.6	179.2	0	0	0	0	0	113.2	T167 T174 R175	T167-G171 PolarHBondContact O-N 3.19Å; T167-G171 VanDerWaalsContact O-N 3.08Å; G171-T174 PolarHBondContact O-OG1 2.98Å; G171-T174 VanDerWaalsContact O-OG1 3.12Å; G171-R175 VanDerWaalsContact C-CZ 3.48Å; G171-R175 VanDerWaalsContact C-NH1 3.34Å; G171-R175 WeakPolarHBondContact O-CB 3.46Å; G171-R175 WeakPolarHBondContact O-CG 3.5Å; G171-R175 PolarHBondContact O-N 2.62Å; G171-R175 VanDerWaalsContact O-N 3.1Å; G171-R175 PolarHBondContact O-NE 2.75Å; G171-R175 PolarHBondContact O-NH1 2.79Å
172	K	89.9	Confident	89.2	Confident	154 Å²	154	76.7 Å²	76.7	67%	0.67	42%	0.419	S	S	*	.	H	α-helix	trans	-66.2	-43.5	176.4	-173.4	175.6	180	177.8	0	111.5	E168 S169 S170 G176	E168-K172 WeakPolarHBondContact O-CB 3.3Å; E168-K172 PolarHBondContact O-N 2.87Å; S169-K172 PolarHBondContact O-N 3.35Å; S170-K172 VanDerWaalsContact C-N 3.34Å; S170-K172 PolarHBondContact O-N 3.2Å; K172-G176 PolarHBondContact O-N 3.31Å; K172-G176 VanDerWaalsContact O-N 3.11Å
173	T	91.2	Very high	89.5	Confident	72 Å²	72	74.8 Å²	74.8	44%	0.442	42%	0.418	S	S	.	.	H	α-helix	trans	-65.7	-48.4	180	-58.5	0	0	0	0	111.3	S169 S170 R175 G176 I177	S169-T173 WeakPolarHBondContact O-CB 3.35Å; S169-T173 PolarHBondContact O-N 2.97Å; S169-T173 PolarHBondContact O-OG1 3.15Å; S170-T173 PolarHBondContact O-N 2.83Å; S170-T173 VanDerWaalsContact O-N 3.15Å; T173-R175 PolarHBondContact O-N 2.94Å; T173-G176 PolarHBondContact O-N 3.3Å; T173-G176 VanDerWaalsContact O-N 3.16Å; T173-I177 HydrophobicContact CG2-CD1 3.93Å; T173-I177 WeakPolarHBondContact O-CG1 3.31Å; T173-I177 PolarHBondContact O-N 3.06Å
174	T	93.1	Very high	89.7	Confident	0 Å²	0	76 Å²	76	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-64.7	-40.1	-179.9	59.6	0	0	0	0	112.1	L157 L160 E161 S170 G171 G176 I177 R178	L157-T174 HydrophobicContact CB-CG2 4.11Å; L157-T174 HydrophobicContact CD2-CG2 3.98Å; L160-T174 HydrophobicContact CD2-CG2 4.17Å; E161-T174 HydrophobicContact CG-CG2 3.58Å; E161-T174 WeakPolarHBondContact OE1-CB 3.31Å; E161-T174 PolarHBondContact OE1-OG1 3.15Å; S170-T174 WeakPolarHBondContact O-CB 3.33Å; S170-T174 VanDerWaalsContact O-CG2 3.26Å; S170-T174 WeakPolarHBondContact O-CG2 3.19Å; S170-T174 PolarHBondContact O-N 3.3Å; S170-T174 PolarHBondContact O-OG1 3.48Å; S170-T174 VanDerWaalsContact O-OG1 3.08Å; G171-T174 PolarHBondContact O-OG1 2.98Å; G171-T174 VanDerWaalsContact O-OG1 3.12Å; T174-G176 VanDerWaalsContact C-N 3.33Å; T174-G176 PolarHBondContact O-N 3.13Å; T174-I177 PolarHBondContact O-N 3.4Å; T174-R178 WeakPolarHBondContact O-CB 3.38Å; T174-R178 VanDerWaalsContact O-CG 3.3Å; T174-R178 WeakPolarHBondContact O-CG 3.32Å; T174-R178 PolarHBondContact O-N 3.48Å; T174-R178 PolarHBondContact OG1-NH1 3.05Å
175	R	93.2	Very high	90.2	Very high	155 Å²	155	77 Å²	77	59%	0.585	42%	0.419	S	S	*	.	H	α-helix	trans	-58.5	-44.7	171.8	-76.4	-172.6	-58.4	-91	4.9	111.8	G171 T173 R178 A179	G171-R175 VanDerWaalsContact C-CZ 3.48Å; G171-R175 VanDerWaalsContact C-NH1 3.34Å; G171-R175 WeakPolarHBondContact O-CB 3.46Å; G171-R175 WeakPolarHBondContact O-CG 3.5Å; G171-R175 PolarHBondContact O-N 2.62Å; G171-R175 VanDerWaalsContact O-N 3.1Å; G171-R175 PolarHBondContact O-NE 2.75Å; G171-R175 PolarHBondContact O-NH1 2.79Å; T173-R175 PolarHBondContact O-N 2.94Å; R175-R178 PolarHBondContact O-N 3.32Å; R175-A179 PolarHBondContact O-N 3.43Å
176	G	95.9	Very high	90.8	Very high	37 Å²	37	75.1 Å²	75.1	38%	0.381	40%	0.397	S	S	.	.	H	α-helix	trans	-60.4	-47.8	176.5	0	0	0	0	0	112.7	K172 T173 T174 A179 C180	K172-G176 PolarHBondContact O-N 3.31Å; K172-G176 VanDerWaalsContact O-N 3.11Å; T173-G176 PolarHBondContact O-N 3.3Å; T173-G176 VanDerWaalsContact O-N 3.16Å; T174-G176 VanDerWaalsContact C-N 3.33Å; T174-G176 PolarHBondContact O-N 3.13Å; G176-A179 WeakPolarHBondContact O-CB 3.47Å; G176-A179 PolarHBondContact O-N 2.9Å; G176-C180 PolarHBondContact O-N 3.25Å; G176-C180 PolarHBondContact O-SG 3.44Å; G176-C180 VanDerWaalsContact O-SG 3.34Å
177	I	95.7	Very high	91.1	Very high	61 Å²	61	74.4 Å²	74.4	31%	0.313	39%	0.393	S	S	.	.	H	α-helix	trans	-63.5	-44.3	178.2	-63.7	168	0	0	0	110.8	I153 L157 T173 T174 A179 C180 L181	I153-I177 HydrophobicContact CG2-CG2 4.36Å; L157-I177 HydrophobicContact CD1-CB 4.25Å; L157-I177 HydrophobicContact CD1-CG2 3.91Å; L157-I177 HydrophobicContact CD2-CB 4.05Å; L157-I177 HydrophobicContact CD2-CD1 3.61Å; L157-I177 HydrophobicContact CD2-CG1 4.44Å; L157-I177 HydrophobicContact CD2-CG2 3.99Å; L157-I177 HydrophobicContact CG-CG2 4.47Å; T173-I177 HydrophobicContact CG2-CD1 3.93Å; T173-I177 WeakPolarHBondContact O-CG1 3.31Å; T173-I177 PolarHBondContact O-N 3.06Å; T174-I177 PolarHBondContact O-N 3.4Å; I177-A179 VanDerWaalsContact C-N 3.28Å; I177-A179 PolarHBondContact O-N 3.35Å; I177-C180 CarbonylContact O-C 3.6Å; I177-C180 WeakPolarHBondContact O-CA 3.49Å; I177-C180 WeakPolarHBondContact O-CB 3.42Å; I177-C180 PolarHBondContact O-N 2.94Å; I177-L181 HydrophobicContact CG2-CD1 4.01Å; I177-L181 HydrophobicContact CG2-CG 4.31Å; I177-L181 WeakPolarHBondContact O-CG 3.43Å; I177-L181 PolarHBondContact O-N 3.47Å
178	R	95.9	Very high	91.6	Very high	61 Å²	61	71 Å²	71	23%	0.23	37%	0.37	C	S	.	.	H	α-helix	trans	-57.9	-42.4	177.1	-73.5	-178.8	-171.1	115.2	-5.2	111.5	E154 L157 E161 T174 R175 C180 L181 E182	E154-R178 IonicContact OE2-NE 3.39Å; E154-R178 PolarHBondContact OE2-NE 3.33Å; L157-R178 HydrophobicContact CD1-CG 3.75Å; E161-R178 VanDerWaalsContact CD-NH2 3.33Å; E161-R178 IonicContact OE1-CZ 3.26Å; E161-R178 IonicContact OE1-NH1 3.05Å; E161-R178 PolarHBondContact OE1-NH1 3.38Å; E161-R178 IonicContact OE1-NH2 3.53Å; E161-R178 PolarHBondContact OE1-NH2 3.49Å; E161-R178 VanDerWaalsContact OE1-NH2 3.16Å; E161-R178 IonicContact OE2-CZ 3.16Å; E161-R178 IonicContact OE2-NH1 3.29Å; E161-R178 IonicContact OE2-NH2 2.71Å; E161-R178 PolarHBondContact OE2-NH2 2.87Å; T174-R178 WeakPolarHBondContact O-CB 3.38Å; T174-R178 VanDerWaalsContact O-CG 3.3Å; T174-R178 WeakPolarHBondContact O-CG 3.32Å; T174-R178 PolarHBondContact O-N 3.48Å; T174-R178 PolarHBondContact OG1-NH1 3.05Å; R175-R178 PolarHBondContact O-N 3.32Å; R178-C180 PolarHBondContact O-N 3.25Å; R178-L181 PolarHBondContact O-N 2.93Å; R178-L181 VanDerWaalsContact O-N 3.12Å; R178-E182 PolarHBondContact O-N 3.02Å
179	A	96.1	Very high	91.9	Very high	64 Å²	64	70.6 Å²	70.6	53%	0.529	36%	0.363	S	S	.	.	H	α-helix	trans	-61.3	-41.3	174.2	0	0	0	0	0	112.3	R175 G176 I177 L181 E182	R175-A179 PolarHBondContact O-N 3.43Å; G176-A179 WeakPolarHBondContact O-CB 3.47Å; G176-A179 PolarHBondContact O-N 2.9Å; I177-A179 VanDerWaalsContact C-N 3.28Å; I177-A179 PolarHBondContact O-N 3.35Å; A179-L181 PolarHBondContact O-N 3.45Å; A179-E182 PolarHBondContact O-N 3.45Å
180	C	96	Very high	92.2	Very high	95 Å²	95	72.5 Å²	72.5	64%	0.642	37%	0.366	S	S	*	.	H	α-helix	trans	-66	-22.3	175	-65.7	0	0	0	0	113.7	G176 I177 R178 P183	G176-C180 PolarHBondContact O-N 3.25Å; G176-C180 PolarHBondContact O-SG 3.44Å; G176-C180 VanDerWaalsContact O-SG 3.34Å; I177-C180 CarbonylContact O-C 3.6Å; I177-C180 WeakPolarHBondContact O-CA 3.49Å; I177-C180 WeakPolarHBondContact O-CB 3.42Å; I177-C180 PolarHBondContact O-N 2.94Å; R178-C180 PolarHBondContact O-N 3.25Å; C180-P183 WeakPolarHBondContact O-CD 3.44Å
181	L	95.9	Very high	92.3	Very high	18 Å²	18	76.3 Å²	76.3	9%	0.094	38%	0.38	C	S	.	.	H	α-helix	trans	-87.6	-9.2	178.9	-66	173.1	0	0	0	113.9	L150 I153 I177 R178 A179 P183 Y184 K185	L150-L181 HydrophobicContact CD2-CB 4.32Å; L150-L181 HydrophobicContact CD2-CD2 4.1Å; I153-L181 HydrophobicContact CB-CD1 4.3Å; I153-L181 HydrophobicContact CD1-CD2 4.02Å; I153-L181 HydrophobicContact CG2-CD1 3.58Å; I177-L181 HydrophobicContact CG2-CD1 4.01Å; I177-L181 HydrophobicContact CG2-CG 4.31Å; I177-L181 WeakPolarHBondContact O-CG 3.43Å; I177-L181 PolarHBondContact O-N 3.47Å; R178-L181 PolarHBondContact O-N 2.93Å; R178-L181 VanDerWaalsContact O-N 3.12Å; A179-L181 PolarHBondContact O-N 3.45Å; L181-P183 VanDerWaalsContact C-CD 3.49Å; L181-Y184 WeakPolarHBondContact O-CB 3.48Å; L181-Y184 PolarHBondContact O-N 2.92Å; L181-K185 PolarHBondContact O-N 2.85Å
182	E	94.2	Very high	91.8	Very high	98 Å²	98	78.1 Å²	78.1	46%	0.458	39%	0.392	S	S	.	.	H	α-helix	trans	-55.2	-42.3	-179.3	-69	-55	128.6	0	0	114.2	R178 A179 Y184 K185 Q186	R178-E182 PolarHBondContact O-N 3.02Å; A179-E182 PolarHBondContact O-N 3.45Å; E182-Y184 PolarHBondContact O-N 3.37Å; E182-K185 PolarHBondContact O-N 2.94Å; E182-K185 VanDerWaalsContact O-N 3.16Å; E182-K185 WeakPolarHBondContact OE1-CD 3.47Å; E182-K185 IonicContact OE1-NZ 2.84Å; E182-K185 PolarHBondContact OE1-NZ 3.39Å; E182-Q186 WeakPolarHBondContact O-CB 3.34Å; E182-Q186 PolarHBondContact O-N 3.13Å
183	P	94	Very high	91.4	Very high	88 Å²	88	73.1 Å²	73.1	57%	0.571	37%	0.374	S	S	*	.	H	α-helix	trans	-58.5	-34.5	175.7	-24.9	35.2	0	0	0	113.3	C180 L181 L187	C180-P183 WeakPolarHBondContact O-CD 3.44Å; L181-P183 VanDerWaalsContact C-CD 3.49Å; P183-L187 WeakPolarHBondContact O-CB 3.3Å; P183-L187 PolarHBondContact O-N 2.63Å
184	Y	93.6	Very high	90.6	Very high	118 Å²	118	71.8 Å²	71.8	46%	0.463	37%	0.367	S	S	.	.	H	α-helix	trans	-77.8	-34.5	179	-71	-72.9	0	0	0	112.5	L146 L181 E182 Q186 L187 L188	L146-Y184 HydrophobicContact CD1-CD1 3.86Å; L146-Y184 HydrophobicContact CD1-CG 4.38Å; L181-Y184 WeakPolarHBondContact O-CB 3.48Å; L181-Y184 PolarHBondContact O-N 2.92Å; E182-Y184 PolarHBondContact O-N 3.37Å; Y184-Q186 VanDerWaalsContact C-N 3.33Å; Y184-L187 PolarHBondContact O-N 3.43Å; Y184-L188 WeakPolarHBondContact O-CB 3.34Å; Y184-L188 PolarHBondContact O-N 3.23Å
185	K	92.7	Very high	89.6	Confident	68 Å²	68	74.6 Å²	74.6	30%	0.296	39%	0.39	S	S	.	.	H	α-helix	trans	-63.7	-42.8	170.6	-67.4	178.6	-172.2	167.9	0	110.7	L150 E154 L181 E182 L188 Y189	L150-K185 HydrophobicContact CD1-CG 4.45Å; E154-K185 IonicContact OE1-NZ 3.79Å; L181-K185 PolarHBondContact O-N 2.85Å; E182-K185 PolarHBondContact O-N 2.94Å; E182-K185 VanDerWaalsContact O-N 3.16Å; E182-K185 WeakPolarHBondContact OE1-CD 3.47Å; E182-K185 IonicContact OE1-NZ 2.84Å; E182-K185 PolarHBondContact OE1-NZ 3.39Å; K185-L188 PolarHBondContact O-N 3.46Å; K185-Y189 PolarHBondContact O-N 3.5Å
186	Q	90.6	Very high	88.7	Confident	96 Å²	96	74.5 Å²	74.5	45%	0.449	39%	0.394	S	S	.	.	H	α-helix	trans	-62.5	-45.7	175.1	-175.6	57.7	29.6	0	0	111.4	E182 Y184 L188 Y189 E190	E182-Q186 WeakPolarHBondContact O-CB 3.34Å; E182-Q186 PolarHBondContact O-N 3.13Å; Y184-Q186 VanDerWaalsContact C-N 3.33Å; Q186-L188 VanDerWaalsContact C-N 3.32Å; Q186-L188 PolarHBondContact O-N 3.33Å; Q186-Y189 WeakPolarHBondContact O-CB 3.25Å; Q186-Y189 PolarHBondContact O-N 3.05Å; Q186-E190 WeakPolarHBondContact CG-OE1 3.39Å; Q186-E190 PolarHBondContact NE2-OE1 3.14Å; Q186-E190 WeakPolarHBondContact O-CB 3.23Å; Q186-E190 WeakPolarHBondContact O-CG 3.23Å; Q186-E190 PolarHBondContact O-N 3.22Å
187	L	89.8	Confident	87.4	Confident	54 Å²	54	79.5 Å²	79.5	28%	0.283	41%	0.408	S	S	.	.	H	α-helix	trans	-59	-40.9	173.7	179.5	64.3	0	0	0	112.4	L146 P183 Y184 R191	L146-L187 HydrophobicContact CD2-CB 4.34Å; L146-L187 HydrophobicContact CD2-CD2 3.9Å; L146-L187 HydrophobicContact CD2-CG 3.97Å; P183-L187 WeakPolarHBondContact O-CB 3.3Å; P183-L187 PolarHBondContact O-N 2.63Å; Y184-L187 PolarHBondContact O-N 3.43Å; L187-R191 HydrophobicContact CD1-CG 4.32Å; L187-R191 WeakPolarHBondContact O-CB 3.46Å; L187-R191 VanDerWaalsContact O-CG 3.26Å; L187-R191 WeakPolarHBondContact O-CG 3.41Å; L187-R191 PolarHBondContact O-N 3.08Å
188	L	89.8	Confident	86.1	Confident	35 Å²	35	80.8 Å²	80.8	18%	0.183	41%	0.411	C	S	.	.	H	α-helix	trans	-65.9	-42	177	-177.4	67.4	0	0	0	111.4	T143 L146 L150 Y184 K185 Q186 R191 S192	T143-L188 HydrophobicContact CG2-CD1 3.76Å; L146-L188 HydrophobicContact CD2-CB 3.95Å; L146-L188 HydrophobicContact CD2-CD1 4.24Å; L146-L188 HydrophobicContact CG-CB 4.42Å; L146-L188 HydrophobicContact CG-CD1 4.35Å; L150-L188 HydrophobicContact CD1-CB 4.32Å; L150-L188 HydrophobicContact CD1-CD2 4.03Å; Y184-L188 WeakPolarHBondContact O-CB 3.34Å; Y184-L188 PolarHBondContact O-N 3.23Å; K185-L188 PolarHBondContact O-N 3.46Å; Q186-L188 VanDerWaalsContact C-N 3.32Å; Q186-L188 PolarHBondContact O-N 3.33Å; L188-R191 PolarHBondContact O-N 2.88Å; L188-S192 VanDerWaalsContact O-CB 3.32Å; L188-S192 WeakPolarHBondContact O-CB 3.42Å; L188-S192 PolarHBondContact O-N 3.47Å; L188-S192 PolarHBondContact O-OG 3.33Å
189	Y	87.8	Confident	85	Confident	145 Å²	145	84.6 Å²	84.6	57%	0.569	43%	0.429	S	S	*	.	H	α-helix	trans	-60.2	-50.1	174.8	175.3	-97	0	0	0	110.8	K185 Q186 R191 S192 T193	K185-Y189 PolarHBondContact O-N 3.5Å; Q186-Y189 WeakPolarHBondContact O-CB 3.25Å; Q186-Y189 PolarHBondContact O-N 3.05Å; Y189-R191 PolarHBondContact O-N 3.03Å; Y189-S192 CarbonylContact O-C 3.6Å; Y189-S192 WeakPolarHBondContact O-CB 3.48Å; Y189-S192 PolarHBondContact O-N 2.85Å; Y189-S192 VanDerWaalsContact O-N 3.11Å; Y189-T193 HydrophobicContact CD1-CG2 4.19Å; Y189-T193 HydrophobicContact CD2-CG2 4.21Å; Y189-T193 HydrophobicContact CE1-CG2 3.77Å; Y189-T193 HydrophobicContact CE2-CG2 3.8Å; Y189-T193 HydrophobicContact CG-CG2 4.4Å; Y189-T193 WeakPolarHBondContact O-CG2 3.34Å; Y189-T193 PolarHBondContact O-N 3.38Å; Y189-T193 PolarHBondContact O-OG1 2.98Å; Y189-T193 VanDerWaalsContact O-OG1 3.06Å
190	E	87.6	Confident	83.8	Confident	93 Å²	93	83.7 Å²	83.7	44%	0.435	42%	0.422	S	S	.	.	H	α-helix	trans	-59.8	-44.8	177.2	-73.4	170.5	-166.5	0	0	112.4	Q186 S192 T193 C194	Q186-E190 WeakPolarHBondContact CG-OE1 3.39Å; Q186-E190 PolarHBondContact NE2-OE1 3.14Å; Q186-E190 WeakPolarHBondContact O-CB 3.23Å; Q186-E190 WeakPolarHBondContact O-CG 3.23Å; Q186-E190 PolarHBondContact O-N 3.22Å; E190-S192 VanDerWaalsContact C-N 3.26Å; E190-S192 PolarHBondContact O-N 3.35Å; E190-T193 WeakPolarHBondContact CA-OG1 3.41Å; E190-T193 PolarHBondContact O-N 2.92Å; E190-T193 PolarHBondContact O-OG1 3.25Å; E190-T193 VanDerWaalsContact O-OG1 3.12Å; E190-C194 WeakPolarHBondContact O-CA 3.49Å; E190-C194 WeakPolarHBondContact O-CB 3.05Å; E190-C194 PolarHBondContact O-N 3.33Å
191	R	87.7	Confident	82.7	Confident	83 Å²	83	83.4 Å²	83.4	31%	0.313	41%	0.407	S	S	.	.	H	α-helix	trans	-62.3	-36.7	175.7	-75.6	175	174.6	-166.4	-3.4	111.5	M141 T143 L187 L188 Y189 A195	M141-R191 PolarHBondContact O-NH1 2.99Å; T143-R191 HydrophobicContact CG2-CB 3.9Å; L187-R191 HydrophobicContact CD1-CG 4.32Å; L187-R191 WeakPolarHBondContact O-CB 3.46Å; L187-R191 VanDerWaalsContact O-CG 3.26Å; L187-R191 WeakPolarHBondContact O-CG 3.41Å; L187-R191 PolarHBondContact O-N 3.08Å; L188-R191 PolarHBondContact O-N 2.88Å; Y189-R191 PolarHBondContact O-N 3.03Å; R191-A195 VanDerWaalsContact O-CB 3.26Å; R191-A195 WeakPolarHBondContact O-CB 3.29Å; R191-A195 PolarHBondContact O-N 2.85Å
192	S	78.2	Confident	81.4	Confident	46 Å²	46	83.3 Å²	83.3	32%	0.322	41%	0.407	S	S	.	.	H	α-helix	trans	-74.4	-41.4	179.5	-59.1	0	0	0	0	112.7	L188 Y189 E190 K196	L188-S192 VanDerWaalsContact O-CB 3.32Å; L188-S192 WeakPolarHBondContact O-CB 3.42Å; L188-S192 PolarHBondContact O-N 3.47Å; L188-S192 PolarHBondContact O-OG 3.33Å; Y189-S192 CarbonylContact O-C 3.6Å; Y189-S192 WeakPolarHBondContact O-CB 3.48Å; Y189-S192 PolarHBondContact O-N 2.85Å; Y189-S192 VanDerWaalsContact O-N 3.11Å; E190-S192 VanDerWaalsContact C-N 3.26Å; E190-S192 PolarHBondContact O-N 3.35Å; S192-K196 VanDerWaalsContact O-CG 3.3Å; S192-K196 WeakPolarHBondContact O-CG 3.43Å; S192-K196 PolarHBondContact O-N 3.41Å; S192-K196 VanDerWaalsContact O-N 3.11Å
193	T	79.6	Confident	80.5	Confident	49 Å²	49	83 Å²	83	30%	0.301	41%	0.408	S	S	.	.	H	α-helix	trans	-72.5	-41	176.3	53.6	0	0	0	0	111.4	Y189 E190 A195 K196 Q197	Y189-T193 HydrophobicContact CD1-CG2 4.19Å; Y189-T193 HydrophobicContact CD2-CG2 4.21Å; Y189-T193 HydrophobicContact CE1-CG2 3.77Å; Y189-T193 HydrophobicContact CE2-CG2 3.8Å; Y189-T193 HydrophobicContact CG-CG2 4.4Å; Y189-T193 WeakPolarHBondContact O-CG2 3.34Å; Y189-T193 PolarHBondContact O-N 3.38Å; Y189-T193 PolarHBondContact O-OG1 2.98Å; Y189-T193 VanDerWaalsContact O-OG1 3.06Å; E190-T193 WeakPolarHBondContact CA-OG1 3.41Å; E190-T193 PolarHBondContact O-N 2.92Å; E190-T193 PolarHBondContact O-OG1 3.25Å; E190-T193 VanDerWaalsContact O-OG1 3.12Å; T193-A195 VanDerWaalsContact C-N 3.33Å; T193-A195 PolarHBondContact O-N 3.45Å; T193-K196 PolarHBondContact O-N 3.39Å; T193-Q197 WeakPolarHBondContact O-CB 3.23Å; T193-Q197 PolarHBondContact O-N 3.45Å
194	C	75.8	Confident	79.6	Confident	44 Å²	44	83.9 Å²	83.9	30%	0.297	41%	0.407	S	S	.	.	H	α-helix	trans	-60.1	-42.8	173	-175.6	0	0	0	0	110.9	E190 K196 Q197 K198	E190-C194 WeakPolarHBondContact O-CA 3.49Å; E190-C194 WeakPolarHBondContact O-CB 3.05Å; E190-C194 PolarHBondContact O-N 3.33Å; C194-K196 PolarHBondContact O-N 3.44Å; C194-Q197 PolarHBondContact O-N 3.12Å; C194-K198 WeakPolarHBondContact O-CB 3.41Å; C194-K198 WeakPolarHBondContact O-CG 3.42Å; C194-K198 PolarHBondContact O-N 3.03Å; C194-K198 WeakPolarHBondContact SG-CE 2.9Å
195	A	72.4	Confident	78.1	Confident	59 Å²	59	81.5 Å²	81.5	49%	0.488	40%	0.398	S	S	.	.	H	α-helix	trans	-62	-43.1	174.9	0	0	0	0	0	112.3	R191 T193 K199	R191-A195 VanDerWaalsContact O-CB 3.26Å; R191-A195 WeakPolarHBondContact O-CB 3.29Å; R191-A195 PolarHBondContact O-N 2.85Å; T193-A195 VanDerWaalsContact C-N 3.33Å; T193-A195 PolarHBondContact O-N 3.45Å; A195-K199 VanDerWaalsContact O-CB 3.31Å; A195-K199 WeakPolarHBondContact O-CB 3.17Å; A195-K199 PolarHBondContact O-N 2.99Å
196	K	72.6	Confident	76.8	Confident	153 Å²	153	82.6 Å²	82.6	67%	0.665	40%	0.401	S	S	*	.	H	α-helix	trans	-63.1	-45.8	175.1	-71.7	172.6	-175.4	-179.1	0	111.8	S192 T193 C194 K199 A200	S192-K196 VanDerWaalsContact O-CG 3.3Å; S192-K196 WeakPolarHBondContact O-CG 3.43Å; S192-K196 PolarHBondContact O-N 3.41Å; S192-K196 VanDerWaalsContact O-N 3.11Å; T193-K196 PolarHBondContact O-N 3.39Å; C194-K196 PolarHBondContact O-N 3.44Å; K196-K199 PolarHBondContact O-N 2.92Å; K196-A200 WeakPolarHBondContact O-CB 3.47Å; K196-A200 PolarHBondContact O-N 3.37Å
197	Q	69.6	Low	75.6	Confident	142 Å²	142	82.9 Å²	82.9	66%	0.664	41%	0.405	S	S	*	.	H	α-helix	trans	-66.8	-41.9	179.1	-169.9	-175.8	34	0	0	111.5	T193 C194 A200 R201	T193-Q197 WeakPolarHBondContact O-CB 3.23Å; T193-Q197 PolarHBondContact O-N 3.45Å; C194-Q197 PolarHBondContact O-N 3.12Å; Q197-A200 PolarHBondContact O-N 3.41Å; Q197-R201 VanDerWaalsContact O-CB 3.31Å; Q197-R201 WeakPolarHBondContact O-CB 3.39Å; Q197-R201 PolarHBondContact O-N 3.05Å
198	K	68.2	Low	74.2	Confident	88 Å²	88	87.3 Å²	87.3	38%	0.383	43%	0.425	S	S	.	.	H	α-helix	trans	-60	-45.9	173.1	-78.4	173.8	170.3	173.8	0	110.9	C194 R201 I202	C194-K198 WeakPolarHBondContact O-CB 3.41Å; C194-K198 WeakPolarHBondContact O-CG 3.42Å; C194-K198 PolarHBondContact O-N 3.03Å; C194-K198 WeakPolarHBondContact SG-CE 2.9Å; K198-R201 PolarHBondContact O-N 2.7Å; K198-I202 VanDerWaalsContact O-CG1 3.3Å; K198-I202 WeakPolarHBondContact O-CG1 3.26Å; K198-I202 PolarHBondContact O-N 3.42Å
199	K	73.3	Confident	72.5	Confident	140 Å²	140	91.6 Å²	91.6	61%	0.609	44%	0.444	S	S	*	.	H	α-helix	trans	-61.4	-45.9	175	-172.9	177.6	-179.9	-179.7	0	111.6	A195 K196 I202 L203	A195-K199 VanDerWaalsContact O-CB 3.31Å; A195-K199 WeakPolarHBondContact O-CB 3.17Å; A195-K199 PolarHBondContact O-N 2.99Å; K196-K199 PolarHBondContact O-N 2.92Å; K199-I202 PolarHBondContact O-N 3.25Å; K199-L203 HydrophobicContact CG-CD1 4.26Å; K199-L203 WeakPolarHBondContact O-CG 3.38Å; K199-L203 PolarHBondContact O-N 2.83Å
200	A	69.8	Low	70.6	Confident	46 Å²	46	89.9 Å²	89.9	38%	0.38	45%	0.449	S	S	.	.	H	α-helix	trans	-61.5	-43.7	176.3	0	0	0	0	0	111.9	K196 Q197 I202 L203 L204	K196-A200 WeakPolarHBondContact O-CB 3.47Å; K196-A200 PolarHBondContact O-N 3.37Å; Q197-A200 PolarHBondContact O-N 3.41Å; A200-I202 VanDerWaalsContact C-N 3.35Å; A200-I202 PolarHBondContact O-N 3.49Å; A200-L203 PolarHBondContact O-N 3.08Å; A200-L204 WeakPolarHBondContact O-CG 3.35Å; A200-L204 PolarHBondContact O-N 3.3Å
201	R	72.8	Confident	68.2	Low	88 Å²	88	96 Å²	96	33%	0.332	48%	0.483	S	S	.	.	H	α-helix	trans	-59.8	-43.6	176.3	-174.5	178.7	71.7	172.9	2.4	111.9	I19 E22 Q197 K198 L204 Y205	I19-R201 HydrophobicContact CD1-CG 4.43Å; E22-R201 VanDerWaalsContact CD-NH2 3.31Å; E22-R201 IonicContact OE1-NH2 2.62Å; E22-R201 PolarHBondContact OE1-NH2 3.07Å; E22-R201 IonicContact OE2-CZ 3.8Å; E22-R201 IonicContact OE2-NH2 3.65Å; E22-R201 PolarHBondContact OE2-NH2 3.42Å; Q197-R201 VanDerWaalsContact O-CB 3.31Å; Q197-R201 WeakPolarHBondContact O-CB 3.39Å; Q197-R201 PolarHBondContact O-N 3.05Å; K198-R201 PolarHBondContact O-N 2.7Å; R201-L204 PolarHBondContact O-N 3.16Å; R201-Y205 PolarHBondContact O-N 3.35Å; R201-Y205 VanDerWaalsContact O-N 3.15Å
202	I	70	Confident	67.2	Low	17 Å²	17	96.6 Å²	96.6	9%	0.087	49%	0.491	C	S	.	.	H	α-helix	trans	-64.7	-43.3	175.8	-68.7	167.3	0	0	0	110.6	I19 I23 M26 K198 K199 A200 Y205 Y206	I19-I202 HydrophobicContact CG2-CG1 4.44Å; I23-I202 HydrophobicContact CD1-CG2 4.28Å; I23-I202 HydrophobicContact CG1-CD1 4.38Å; I23-I202 HydrophobicContact CG1-CG1 4.45Å; I23-I202 HydrophobicContact CG1-CG2 4.16Å; M26-I202 HydrophobicContact CE-CD1 4.46Å; M26-I202 HydrophobicContact SD-CD1 4.18Å; K198-I202 VanDerWaalsContact O-CG1 3.3Å; K198-I202 WeakPolarHBondContact O-CG1 3.26Å; K198-I202 PolarHBondContact O-N 3.42Å; K199-I202 PolarHBondContact O-N 3.25Å; A200-I202 VanDerWaalsContact C-N 3.35Å; A200-I202 PolarHBondContact O-N 3.49Å; I202-Y205 WeakPolarHBondContact O-CB 2.95Å; I202-Y205 PolarHBondContact O-N 3.35Å; I202-Y206 HydrophobicContact CG2-CD2 3.77Å; I202-Y206 HydrophobicContact CG2-CE2 3.53Å; I202-Y206 WeakPolarHBondContact O-CD2 3.04Å; I202-Y206 PolarHBondContact O-N 3.24Å; I202-Y206 VanDerWaalsContact O-N 3.15Å
203	L	74.5	Confident	66.7	Low	92 Å²	92	99.3 Å²	99.3	48%	0.482	50%	0.5	S	S	.	.	H	α-helix	trans	-63.7	-39.9	177.6	-72.3	170.8	0	0	0	112.8	K199 A200 Y205 Y206 N207	K199-L203 HydrophobicContact CG-CD1 4.26Å; K199-L203 WeakPolarHBondContact O-CG 3.38Å; K199-L203 PolarHBondContact O-N 2.83Å; A200-L203 PolarHBondContact O-N 3.08Å; L203-Y205 VanDerWaalsContact C-N 3.33Å; L203-Y206 PolarHBondContact O-N 2.86Å; L203-N207 PolarHBondContact O-N 2.9Å
204	L	75	Confident	65.9	Low	106 Å²	106	102.1 Å²	102.1	56%	0.555	51%	0.511	S	S	*	.	H	α-helix	trans	-61.6	-42.8	175.2	-71	172.9	0	0	0	111.3	A200 R201 Y206 N207 E208	A200-L204 WeakPolarHBondContact O-CG 3.35Å; A200-L204 PolarHBondContact O-N 3.3Å; R201-L204 PolarHBondContact O-N 3.16Å; L204-Y206 VanDerWaalsContact C-N 3.32Å; L204-Y206 PolarHBondContact O-N 3.28Å; L204-N207 PolarHBondContact O-N 3.26Å; L204-E208 WeakPolarHBondContact O-CG 2.97Å; L204-E208 PolarHBondContact O-N 3.48Å
205	Y	63.2	Low	65.4	Low	67 Å²	67	105.5 Å²	105.5	26%	0.263	52%	0.524	S	S	.	.	H	α-helix	trans	-59.8	-41.2	176.1	-171.7	-89.3	0	0	0	112.5	L16 R201 I202 L203 E208 E209	L16-Y205 HydrophobicContact CD2-CD2 4.3Å; L16-Y205 HydrophobicContact CD2-CE2 3.45Å; L16-Y205 VanDerWaalsContact CD2-CE2 3.45Å; R201-Y205 PolarHBondContact O-N 3.35Å; R201-Y205 VanDerWaalsContact O-N 3.15Å; I202-Y205 WeakPolarHBondContact O-CB 2.95Å; I202-Y205 PolarHBondContact O-N 3.35Å; L203-Y205 VanDerWaalsContact C-N 3.33Å; Y205-E208 PolarHBondContact O-N 3.33Å; Y205-E209 VanDerWaalsContact CE1-CD 3.46Å; Y205-E209 HydrophobicContact CE1-CG 4.27Å; Y205-E209 VanDerWaalsContact CE1-OE1 3.25Å; Y205-E209 WeakPolarHBondContact CE1-OE1 3.06Å; Y205-E209 PolarHBondContact O-N 3.37Å; Y205-E209 PolarHBondContact OH-OE1 3.3Å
206	Y	64.9	Low	64.9	Low	92 Å²	92	108.4 Å²	108.4	36%	0.361	53%	0.526	S	S	.	.	H	α-helix	trans	-69.7	-33.6	177.3	-80	-66.4	0	0	0	113.6	I23 I202 L203 L204 T210	I23-Y206 HydrophobicContact CD1-CE2 4.12Å; I202-Y206 HydrophobicContact CG2-CD2 3.77Å; I202-Y206 HydrophobicContact CG2-CE2 3.53Å; I202-Y206 WeakPolarHBondContact O-CD2 3.04Å; I202-Y206 PolarHBondContact O-N 3.24Å; I202-Y206 VanDerWaalsContact O-N 3.15Å; L203-Y206 PolarHBondContact O-N 2.86Å; L204-Y206 VanDerWaalsContact C-N 3.32Å; L204-Y206 PolarHBondContact O-N 3.28Å; Y206-T210 PolarHBondContact O-OG1 3.02Å
207	N	66.2	Low	64.4	Low	102 Å²	102	105.4 Å²	105.4	55%	0.545	52%	0.517	S	S	.	.	H	α-helix	trans	-73.3	-31.1	177.7	-70.7	-17.2	0	0	0	112.2	L203 L204 T210	L203-N207 PolarHBondContact O-N 2.9Å; L204-N207 PolarHBondContact O-N 3.26Å; N207-T210 PolarHBondContact O-N 2.84Å; N207-T210 PolarHBondContact O-OG1 3.24Å; N207-T210 VanDerWaalsContact O-OG1 3.08Å
208	E	58.6	Low	64	Low	147 Å²	147	102.8 Å²	102.8	69%	0.687	51%	0.506	S	S	*	.	H	α-helix	trans	-72.8	-24.7	176.2	-73.9	176.9	177	0	0	113.4	L204 Y205	L204-E208 WeakPolarHBondContact O-CG 2.97Å; L204-E208 PolarHBondContact O-N 3.48Å; Y205-E208 PolarHBondContact O-N 3.33Å
209	E	55.3	Low	63.7	Low	124 Å²	124	103.9 Å²	103.9	58%	0.579	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-0	174.4	-73.5	-172.9	166.4	0	0	113.6	Y205	Y205-E209 VanDerWaalsContact CE1-CD 3.46Å; Y205-E209 HydrophobicContact CE1-CG 4.27Å; Y205-E209 VanDerWaalsContact CE1-OE1 3.25Å; Y205-E209 WeakPolarHBondContact CE1-OE1 3.06Å; Y205-E209 PolarHBondContact O-N 3.37Å; Y205-E209 PolarHBondContact OH-OE1 3.3Å
210	T	48.2	Very low	62.9	Low	110 Å²	110	100.9 Å²	100.9	68%	0.675	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	11.3	-179	51.8	0	0	0	0	115.4	Y206 N207	Y206-T210 PolarHBondContact O-OG1 3.02Å; N207-T210 PolarHBondContact O-N 2.84Å; N207-T210 PolarHBondContact O-OG1 3.24Å; N207-T210 VanDerWaalsContact O-OG1 3.08Å
211	L	37	Very low	62.3	Low	220 Å²	220	105.9 Å²	105.9	100%	1.152	52%	0.52	S	S	*	.			trans	-119.7	0	170.2	-87.5	159.9	0	0	0	110

Retrieved 211 of 211 residues in 250 ms (Link to these results)

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