G4VAW6_SCHMA Loading...

Protein CNPPD1

AlphaFold DB , UniProt , Accession G4VAW6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 319 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	41.6	Very low	47.1	Very low	207 Å²	207	101.7 Å²	101.7	100%	1.02	51%	0.507	S	S	*	.				0	104.7	0	-86.2	-177.2	180	0	0	105.3	F3	M1-F3 HydrophobicContact CB-CD2 4.25Å; M1-F3 PolarHBondContact O-N 3.42Å; M1-F3 HydrophobicContact SD-CD2 4.43Å; M1-F3 HydrophobicContact SD-CE2 4.13Å
2	D	54	Low	46	Very low	66 Å²	66	99.6 Å²	99.6	35%	0.353	52%	0.517	S	S	.	.			trans	-78.5	83.5	172.1	-102.9	-45.6	0	0	0	108.5	I4 Q5 D6 K116	D2-I4 PolarHBondContact O-N 3.08Å; D2-Q5 HydrophobicContact CB-CB 4.01Å; D2-Q5 HydrophobicContact CB-CG 3.92Å; D2-Q5 WeakPolarHBondContact O-CB 3.48Å; D2-Q5 PolarHBondContact O-N 3.22Å; D2-D6 PolarHBondContact O-N 2.98Å; D2-K116 IonicContact OD1-NZ 2.76Å
3	F	48.2	Very low	45.4	Very low	117 Å²	117	107.2 Å²	107.2	51%	0.513	54%	0.543	S	S	.	.	H	α-helix	trans	-61.3	-27.5	-172.3	-127.4	-89.5	0	0	0	112.7	M1 L7 W156	M1-F3 HydrophobicContact CB-CD2 4.25Å; M1-F3 PolarHBondContact O-N 3.42Å; M1-F3 HydrophobicContact SD-CD2 4.43Å; M1-F3 HydrophobicContact SD-CE2 4.13Å; F3-L7 PolarHBondContact O-N 3.36Å; F3-W156 AromaticContact CD1-CH2 3.64Å; F3-W156 HydrophobicContact CD1-CH2 3.64Å; F3-W156 HydrophobicContact CD1-CZ2 4.49Å; F3-W156 HydrophobicContact CD1-CZ3 4.34Å; F3-W156 HydrophobicContact CE1-CH2 4.1Å
4	I	52.1	Low	45.3	Very low	21 Å²	21	115.6 Å²	115.6	11%	0.108	57%	0.565	C	S	.	*	H	α-helix	trans	-74.7	-35.1	176.1	-60.8	-76.2	0	0	0	111.3	D2 D6 L7 R8 K116 I151	D2-I4 PolarHBondContact O-N 3.08Å; I4-D6 VanDerWaalsContact C-N 3.32Å; I4-D6 PolarHBondContact O-N 3.22Å; I4-L7 PolarHBondContact O-N 3.28Å; I4-R8 PolarHBondContact O-N 3.32Å; I4-R8 VanDerWaalsContact O-N 3.09Å; I4-K116 HydrophobicContact CB-CD 4.44Å; I4-K116 HydrophobicContact CG1-CD 4.24Å; I4-K116 HydrophobicContact CG2-CB 4Å; I4-K116 WeakPolarHBondContact CG2-O 3.34Å; I4-I151 HydrophobicContact CD1-CD1 3.86Å; I4-I151 HydrophobicContact CG1-CD1 4.36Å
5	Q	50.7	Low	45.5	Very low	82 Å²	82	111.6 Å²	111.6	38%	0.383	55%	0.552	S	S	.	*	H	α-helix	trans	-64.4	-37.7	175.8	-75.9	-164.7	-9.9	0	0	111.8	D2 L7 R8 Q9 D121	D2-Q5 HydrophobicContact CB-CB 4.01Å; D2-Q5 HydrophobicContact CB-CG 3.92Å; D2-Q5 WeakPolarHBondContact O-CB 3.48Å; D2-Q5 PolarHBondContact O-N 3.22Å; Q5-L7 VanDerWaalsContact C-N 3.33Å; Q5-L7 PolarHBondContact O-N 2.72Å; Q5-R8 WeakPolarHBondContact O-CB 3.15Å; Q5-R8 PolarHBondContact O-N 3.29Å; Q5-Q9 PolarHBondContact O-N 3.42Å; Q5-D121 PolarHBondContact NE2-OD2 3.43Å
6	D	45.8	Very low	45.8	Very low	98 Å²	98	107.8 Å²	107.8	52%	0.524	54%	0.539	S	S	.	.	H	α-helix	trans	-67.7	-32.9	177.1	-76.2	-19.8	0	0	0	112.3	D2 I4 Q9	D2-D6 PolarHBondContact O-N 2.98Å; I4-D6 VanDerWaalsContact C-N 3.32Å; I4-D6 PolarHBondContact O-N 3.22Å; D6-Q9 PolarHBondContact O-N 3.44Å
7	L	48.4	Very low	46	Very low	75 Å²	75	106.9 Å²	106.9	39%	0.393	54%	0.543	S	S	.	.	H	α-helix	trans	-68.1	-38.3	172.8	-86	161.9	0	0	0	112.2	F3 I4 Q5 Q9 S10 E11 W156	F3-L7 PolarHBondContact O-N 3.36Å; I4-L7 PolarHBondContact O-N 3.28Å; Q5-L7 VanDerWaalsContact C-N 3.33Å; Q5-L7 PolarHBondContact O-N 2.72Å; L7-Q9 VanDerWaalsContact C-N 3.26Å; L7-Q9 PolarHBondContact O-N 2.8Å; L7-S10 PolarHBondContact O-N 2.71Å; L7-S10 PolarHBondContact O-OG 3.37Å; L7-E11 PolarHBondContact O-N 3.44Å; L7-W156 HydrophobicContact CD1-CE3 3.6Å; L7-W156 HydrophobicContact CD1-CH2 4.42Å; L7-W156 HydrophobicContact CD1-CZ3 3.31Å
8	R	47.2	Very low	46.4	Very low	52 Å²	52	103.9 Å²	103.9	20%	0.196	53%	0.534	C	S	.	.	H	α-helix	trans	-63	-30.5	173.1	-78.7	-171.3	171.3	154.3	-4.2	113.5	I4 Q5 S10 E11 A12 K116 Y117 H119 D120	I4-R8 PolarHBondContact O-N 3.32Å; I4-R8 VanDerWaalsContact O-N 3.09Å; Q5-R8 WeakPolarHBondContact O-CB 3.15Å; Q5-R8 PolarHBondContact O-N 3.29Å; R8-S10 PolarHBondContact O-N 2.89Å; R8-E11 CarbonylContact O-C 3.58Å; R8-E11 PolarHBondContact O-N 3.16Å; R8-A12 WeakPolarHBondContact O-CA 3.4Å; R8-A12 WeakPolarHBondContact O-CB 3.41Å; R8-A12 PolarHBondContact O-N 3.19Å; R8-K116 PolarHBondContact NH2-O 2.86Å; R8-Y117 PolarHBondContact NH2-O 2.83Å; R8-Y117 VanDerWaalsContact NH2-O 3.14Å; R8-H119 PolarHBondContact NH1-O 2.89Å; R8-H119 VanDerWaalsContact NH2-N 3.18Å; R8-H119 PolarHBondContact NH2-O 3.46Å; R8-D120 WeakPolarHBondContact CD-OD1 3.4Å; R8-D120 IonicContact CZ-OD1 2.72Å; R8-D120 IonicContact NE-OD1 2.74Å; R8-D120 PolarHBondContact NE-OD1 3.03Å; R8-D120 IonicContact NH1-OD1 3.1Å; R8-D120 PolarHBondContact NH1-OD1 3.3Å; R8-D120 IonicContact NH2-OD1 3.77Å
9	Q	41.9	Very low	46.7	Very low	147 Å²	147	99.5 Å²	99.5	69%	0.687	51%	0.511	S	S	*	.	H	α-helix	trans	-67.5	-25.1	174.2	-69.2	-175	14.3	0	0	112.6	Q5 D6 L7	Q5-Q9 PolarHBondContact O-N 3.42Å; D6-Q9 PolarHBondContact O-N 3.44Å; L7-Q9 VanDerWaalsContact C-N 3.26Å; L7-Q9 PolarHBondContact O-N 2.8Å
10	S	40.6	Very low	47.2	Very low	91 Å²	91	99.2 Å²	99.2	64%	0.636	51%	0.51	S	S	*	.	H	α-helix	trans	-81.8	-23.2	174.1	77.9	0	0	0	0	113.7	L7 R8	L7-S10 PolarHBondContact O-N 2.71Å; L7-S10 PolarHBondContact O-OG 3.37Å; R8-S10 PolarHBondContact O-N 2.89Å
11	E	47.4	Very low	47.7	Very low	163 Å²	163	98.6 Å²	98.6	76%	0.762	51%	0.505	S	S	*	.	S	Bend	trans	-114	20	177.4	-65	-166.7	150.5	0	0	113.3	L7 R8 K13	L7-E11 PolarHBondContact O-N 3.44Å; R8-E11 CarbonylContact O-C 3.58Å; R8-E11 PolarHBondContact O-N 3.16Å; E11-K13 PolarHBondContact O-N 3.45Å
12	A	33.8	Very low	48.5	Very low	76 Å²	76	88.8 Å²	88.8	63%	0.628	46%	0.457	S	S	*	.			trans	-58	83.5	-167.7	0	0	0	0	0	114.5	R8	R8-A12 WeakPolarHBondContact O-CA 3.4Å; R8-A12 WeakPolarHBondContact O-CB 3.41Å; R8-A12 PolarHBondContact O-N 3.19Å
13	K	38.1	Very low	48.7	Very low	198 Å²	198	87.4 Å²	87.4	86%	0.861	45%	0.447	S	S	*	.	S	Bend	trans	-140.1	136.9	157.3	-79.4	-179.5	179.1	169.6	0	106.7	E11	E11-K13 PolarHBondContact O-N 3.45Å
14	R	44.6	Very low	49.3	Very low	226 Å²	226	86.2 Å²	86.2	85%	0.853	45%	0.446	S	S	*	.	S	Bend	trans	-19.4	148.8	165.7	-66.2	177.7	-169.5	176.4	1	113.3	S16	R14-S16 PolarHBondContact O-N 3.07Å
15	P	48.5	Very low	49.7	Very low	55 Å²	55	87.6 Å²	87.6	36%	0.357	46%	0.455	S	S	.	.	S	Bend	trans	-39.1	118.5	176.4	15.4	-30.6	0	0	0	108.9	I19	P15-I19 HydrophobicContact CB-CB 4.49Å; P15-I19 HydrophobicContact CB-CG2 4.4Å
16	S	49.1	Very low	50.2	Low	50 Å²	50	83.8 Å²	83.8	35%	0.35	44%	0.438	S	S	.	.			trans	-51	145.1	-169.2	66.6	0	0	0	0	108.6	R14 S18 I19 L20	R14-S16 PolarHBondContact O-N 3.07Å; S16-S18 CarbonylContact O-C 3.58Å; S16-S18 PolarHBondContact O-N 3.44Å; S16-S18 WeakPolarHBondContact OG-CB 3.48Å; S16-I19 PolarHBondContact O-N 2.96Å; S16-L20 PolarHBondContact O-N 3.48Å
17	P	50.1	Low	50.9	Low	93 Å²	93	82.4 Å²	82.4	60%	0.604	44%	0.435	S	S	*	.	H	α-helix	trans	-48.4	-26.7	174.7	-27.2	33.8	0	0	0	112.3	I19 E21 R162	P17-I19 PolarHBondContact O-N 3.42Å; P17-E21 WeakPolarHBondContact O-CG 3.44Å; P17-E21 PolarHBondContact O-N 2.64Å; P17-R162 PolarHBondContact O-NH2 2.86Å
18	S	52.6	Low	51.2	Low	54 Å²	54	85.2 Å²	85.2	38%	0.378	45%	0.451	S	S	.	.	H	α-helix	trans	-54.1	-43.6	169.4	-54.3	0	0	0	0	115.6	S16 I22 R162	S16-S18 CarbonylContact O-C 3.58Å; S16-S18 PolarHBondContact O-N 3.44Å; S16-S18 WeakPolarHBondContact OG-CB 3.48Å; S18-I22 WeakPolarHBondContact O-CD1 3.4Å; S18-I22 WeakPolarHBondContact O-CG1 3.33Å; S18-I22 PolarHBondContact O-N 3.27Å; S18-R162 VanDerWaalsContact CA-NH2 3.25Å; S18-R162 PolarHBondContact O-NE 3.48Å
19	I	53.2	Low	51.3	Low	19 Å²	19	85.6 Å²	85.6	10%	0.097	46%	0.457	C	S	.	.	H	α-helix	trans	-74.7	-48.8	-178.7	-69.2	172.1	0	0	0	110.8	P15 S16 P17 E21 I22 F23 L118	P15-I19 HydrophobicContact CB-CB 4.49Å; P15-I19 HydrophobicContact CB-CG2 4.4Å; S16-I19 PolarHBondContact O-N 2.96Å; P17-I19 PolarHBondContact O-N 3.42Å; I19-E21 VanDerWaalsContact C-N 3.29Å; I19-E21 PolarHBondContact O-N 2.89Å; I19-I22 WeakPolarHBondContact O-CA 3.44Å; I19-I22 WeakPolarHBondContact O-CB 3.27Å; I19-I22 PolarHBondContact O-N 3.27Å; I19-F23 HydrophobicContact CG2-CD2 3.63Å; I19-F23 HydrophobicContact CG2-CE2 3.37Å; I19-F23 VanDerWaalsContact O-CD2 3.24Å; I19-F23 WeakPolarHBondContact O-CD2 3.26Å; I19-F23 PolarHBondContact O-N 3.11Å; I19-L118 HydrophobicContact CD1-CD2 3.76Å; I19-L118 HydrophobicContact CG1-CD2 4.1Å; I19-L118 HydrophobicContact CG2-CD2 4.39Å
20	L	55.5	Low	51.6	Low	94 Å²	94	81.7 Å²	81.7	49%	0.492	44%	0.438	S	S	.	.	H	α-helix	trans	-58.2	-41.1	-179.9	-70.7	173.8	0	0	0	112.3	S16 I22 F23 D24	S16-L20 PolarHBondContact O-N 3.48Å; L20-I22 VanDerWaalsContact C-N 3.32Å; L20-I22 PolarHBondContact O-N 3.48Å; L20-F23 VanDerWaalsContact O-CB 3.31Å; L20-F23 WeakPolarHBondContact O-CB 3.33Å; L20-F23 PolarHBondContact O-N 3Å; L20-D24 PolarHBondContact O-N 3.35Å
21	E	57.7	Low	51.6	Low	86 Å²	86	80.6 Å²	80.6	40%	0.402	44%	0.442	S	S	.	.	H	α-helix	trans	-71.5	-23.8	175.5	-70.8	172.6	-122.2	0	0	112.9	P17 I19 V25 R162	P17-E21 WeakPolarHBondContact O-CG 3.44Å; P17-E21 PolarHBondContact O-N 2.64Å; I19-E21 VanDerWaalsContact C-N 3.29Å; I19-E21 PolarHBondContact O-N 2.89Å; E21-V25 VanDerWaalsContact O-CG2 3.24Å; E21-V25 WeakPolarHBondContact O-CG2 3.18Å; E21-V25 PolarHBondContact O-N 2.95Å; E21-R162 IonicContact OE1-NH2 3.81Å; E21-R162 PolarHBondContact OE1-NH2 3.02Å; E21-R162 VanDerWaalsContact OE1-NH2 3.15Å; E21-R162 IonicContact OE2-CZ 3.16Å; E21-R162 IonicContact OE2-NH1 3.06Å; E21-R162 PolarHBondContact OE2-NH1 3.1Å; E21-R162 IonicContact OE2-NH2 2.77Å; E21-R162 PolarHBondContact OE2-NH2 3.34Å
22	I	58.3	Low	51.6	Low	2 Å²	2	76.2 Å²	76.2	1%	0.01	44%	0.44	C	S	.	.	H	α-helix	trans	-69.6	-43.4	169.5	-69.2	161	0	0	0	109.9	S18 I19 L20 D24 V25 L26 V76 R162 I165	S18-I22 WeakPolarHBondContact O-CD1 3.4Å; S18-I22 WeakPolarHBondContact O-CG1 3.33Å; S18-I22 PolarHBondContact O-N 3.27Å; I19-I22 WeakPolarHBondContact O-CA 3.44Å; I19-I22 WeakPolarHBondContact O-CB 3.27Å; I19-I22 PolarHBondContact O-N 3.27Å; L20-I22 VanDerWaalsContact C-N 3.32Å; L20-I22 PolarHBondContact O-N 3.48Å; I22-D24 VanDerWaalsContact C-N 3.3Å; I22-D24 PolarHBondContact O-N 3.36Å; I22-V25 PolarHBondContact O-N 3.18Å; I22-L26 HydrophobicContact CG2-CD1 3.73Å; I22-L26 HydrophobicContact CG2-CG 4.32Å; I22-L26 WeakPolarHBondContact O-CB 3.49Å; I22-L26 WeakPolarHBondContact O-CG 3.45Å; I22-L26 PolarHBondContact O-N 3Å; I22-V76 HydrophobicContact CG2-CB 4.02Å; I22-V76 HydrophobicContact CG2-CG2 3.64Å; I22-R162 HydrophobicContact CD1-CB 3.82Å; I22-R162 HydrophobicContact CD1-CG 3.85Å; I22-R162 HydrophobicContact CG1-CB 4.05Å; I22-R162 HydrophobicContact CG1-CG 3.51Å; I22-I165 HydrophobicContact CD1-CB 4.45Å; I22-I165 HydrophobicContact CD1-CD1 3.82Å; I22-I165 HydrophobicContact CG2-CG2 4.06Å
23	F	59.3	Low	52.6	Low	37 Å²	37	76.9 Å²	76.9	16%	0.162	43%	0.433	C	S	.	.	H	α-helix	trans	-55.6	-48.9	171.3	-82.9	-85.3	0	0	0	110.2	I19 L20 V25 L26 C27 P74 V76 H119	I19-F23 HydrophobicContact CG2-CD2 3.63Å; I19-F23 HydrophobicContact CG2-CE2 3.37Å; I19-F23 VanDerWaalsContact O-CD2 3.24Å; I19-F23 WeakPolarHBondContact O-CD2 3.26Å; I19-F23 PolarHBondContact O-N 3.11Å; L20-F23 VanDerWaalsContact O-CB 3.31Å; L20-F23 WeakPolarHBondContact O-CB 3.33Å; L20-F23 PolarHBondContact O-N 3Å; F23-V25 VanDerWaalsContact C-N 3.34Å; F23-V25 PolarHBondContact O-N 3.01Å; F23-L26 PolarHBondContact O-N 3.39Å; F23-L26 VanDerWaalsContact O-N 3.14Å; F23-C27 WeakPolarHBondContact O-CB 3.45Å; F23-C27 PolarHBondContact O-N 3.18Å; F23-C27 PolarHBondContact O-SG 3.29Å; F23-P74 HydrophobicContact CD1-CB 4.27Å; F23-P74 HydrophobicContact CE1-CB 3.3Å; F23-P74 HydrophobicContact CE1-CG 3.68Å; F23-P74 HydrophobicContact CZ-CB 3.85Å; F23-P74 HydrophobicContact CZ-CG 4.14Å; F23-V76 HydrophobicContact CD1-CG1 4.11Å; F23-V76 HydrophobicContact CD2-CG1 4.11Å; F23-V76 HydrophobicContact CE1-CG1 3.55Å; F23-V76 HydrophobicContact CE2-CG1 3.47Å; F23-V76 VanDerWaalsContact CE2-CG1 3.47Å; F23-V76 HydrophobicContact CG-CG1 4.35Å; F23-V76 HydrophobicContact CZ-CG1 3.09Å; F23-H119 AromaticContact CZ-CE1 3.32Å; F23-H119 WeakPolarHBondContact CZ-CE1 3.34Å; F23-H119 AromaticContact CZ-NE2 3.91Å
24	D	61.2	Low	53.5	Low	92 Å²	92	68.7 Å²	68.7	49%	0.492	40%	0.401	S	S	.	.	H	α-helix	trans	-59.6	-43.5	177	-67.1	-26.2	0	0	0	111.4	L20 I22 L26 N28	L20-D24 PolarHBondContact O-N 3.35Å; I22-D24 VanDerWaalsContact C-N 3.3Å; I22-D24 PolarHBondContact O-N 3.36Å; D24-L26 VanDerWaalsContact C-N 3.33Å; D24-L26 PolarHBondContact O-N 3.14Å; D24-N28 WeakPolarHBondContact O-CB 3.19Å; D24-N28 PolarHBondContact O-N 3.3Å; D24-N28 PolarHBondContact O-ND2 3.41Å
25	V	59.8	Low	54.1	Low	49 Å²	49	58.6 Å²	58.6	30%	0.297	36%	0.363	S	S	.	.	H	α-helix	trans	-64.4	-37.9	176.7	170.4	0	0	0	0	112	E21 I22 F23 N29 L166 F175	E21-V25 VanDerWaalsContact O-CG2 3.24Å; E21-V25 WeakPolarHBondContact O-CG2 3.18Å; E21-V25 PolarHBondContact O-N 2.95Å; I22-V25 PolarHBondContact O-N 3.18Å; F23-V25 VanDerWaalsContact C-N 3.34Å; F23-V25 PolarHBondContact O-N 3.01Å; V25-N29 WeakPolarHBondContact O-CB 3.28Å; V25-N29 PolarHBondContact O-N 3.36Å; V25-N29 VanDerWaalsContact O-N 3.12Å; V25-N29 PolarHBondContact O-ND2 3.41Å; V25-L166 HydrophobicContact CB-CD2 4.43Å; V25-L166 HydrophobicContact CG1-CD2 3.73Å; V25-F175 HydrophobicContact CG1-CE1 4.17Å
26	L	61.6	Low	54.5	Low	2 Å²	2	61.5 Å²	61.5	1%	0.01	37%	0.372	C	S	.	.	H	α-helix	trans	-66.7	-55.5	175.7	-75.9	164.6	0	0	0	110.3	I22 F23 D24 N28 N29 E30 P75 V76 L79 V174 F175	I22-L26 HydrophobicContact CG2-CD1 3.73Å; I22-L26 HydrophobicContact CG2-CG 4.32Å; I22-L26 WeakPolarHBondContact O-CB 3.49Å; I22-L26 WeakPolarHBondContact O-CG 3.45Å; I22-L26 PolarHBondContact O-N 3Å; F23-L26 PolarHBondContact O-N 3.39Å; F23-L26 VanDerWaalsContact O-N 3.14Å; D24-L26 VanDerWaalsContact C-N 3.33Å; D24-L26 PolarHBondContact O-N 3.14Å; L26-N28 VanDerWaalsContact C-N 3.27Å; L26-N28 PolarHBondContact O-N 3.17Å; L26-N29 CarbonylContact O-C 3.53Å; L26-N29 PolarHBondContact O-N 3.26Å; L26-E30 VanDerWaalsContact C-CD 3.49Å; L26-E30 VanDerWaalsContact C-OE1 3.3Å; L26-E30 WeakPolarHBondContact O-CB 3.35Å; L26-E30 VanDerWaalsContact O-CD 3.27Å; L26-E30 WeakPolarHBondContact O-CG 3.38Å; L26-E30 PolarHBondContact O-N 3.01Å; L26-P75 HydrophobicContact CD1-CB 4.15Å; L26-P75 HydrophobicContact CD2-CB 3.91Å; L26-V76 HydrophobicContact CD1-CB 3.51Å; L26-V76 HydrophobicContact CD1-CG1 4.34Å; L26-V76 HydrophobicContact CD1-CG2 4.5Å; L26-V76 VanDerWaalsContact CD1-N 3.35Å; L26-L79 HydrophobicContact CD2-CD1 4.03Å; L26-V174 HydrophobicContact CD2-CG1 4.49Å; L26-F175 HydrophobicContact CD2-CD1 4.3Å; L26-F175 HydrophobicContact CD2-CE1 3.23Å; L26-F175 HydrophobicContact CD2-CZ 3.36Å; L26-F175 HydrophobicContact CG-CE1 3.89Å; L26-F175 HydrophobicContact CG-CZ 3.97Å
27	C	58.9	Low	55.3	Low	70 Å²	70	62.7 Å²	62.7	47%	0.473	37%	0.374	S	S	.	.	H	α-helix	trans	-58.5	-35	177.7	-65.1	0	0	0	0	113.1	F23 E30	F23-C27 WeakPolarHBondContact O-CB 3.45Å; F23-C27 PolarHBondContact O-N 3.18Å; F23-C27 PolarHBondContact O-SG 3.29Å; C27-E30 WeakPolarHBondContact O-CB 3.35Å; C27-E30 PolarHBondContact O-N 2.82Å
28	N	55.5	Low	56.2	Low	134 Å²	134	62 Å²	62	72%	0.717	37%	0.37	S	S	*	.	H	α-helix	trans	-77.5	-22.7	177	-72.5	-45	0	0	0	113.4	D24 L26 E30	D24-N28 WeakPolarHBondContact O-CB 3.19Å; D24-N28 PolarHBondContact O-N 3.3Å; D24-N28 PolarHBondContact O-ND2 3.41Å; L26-N28 VanDerWaalsContact C-N 3.27Å; L26-N28 PolarHBondContact O-N 3.17Å; N28-E30 VanDerWaalsContact C-N 3.35Å
29	N	50.4	Low	57.2	Low	60 Å²	60	63.1 Å²	63.1	32%	0.321	37%	0.374	S	S	.	.	H	α-helix	trans	-88	-7.9	170.4	-76.9	-60.4	0	0	0	112.3	V25 L26 G31 N178	V25-N29 WeakPolarHBondContact O-CB 3.28Å; V25-N29 PolarHBondContact O-N 3.36Å; V25-N29 VanDerWaalsContact O-N 3.12Å; V25-N29 PolarHBondContact O-ND2 3.41Å; L26-N29 CarbonylContact O-C 3.53Å; L26-N29 PolarHBondContact O-N 3.26Å; N29-G31 PolarHBondContact O-N 2.91Å; N29-N178 PolarHBondContact OD1-ND2 3.27Å
30	E	47.5	Very low	58.4	Low	64 Å²	64	62.4 Å²	62.4	30%	0.299	37%	0.37	S	S	.	.			trans	-86.3	92.4	-178.2	-80	160.1	-155.2	0	0	112.3	L26 C27 N28 G32 C34 P75	L26-E30 VanDerWaalsContact C-CD 3.49Å; L26-E30 VanDerWaalsContact C-OE1 3.3Å; L26-E30 WeakPolarHBondContact O-CB 3.35Å; L26-E30 VanDerWaalsContact O-CD 3.27Å; L26-E30 WeakPolarHBondContact O-CG 3.38Å; L26-E30 PolarHBondContact O-N 3.01Å; C27-E30 WeakPolarHBondContact O-CB 3.35Å; C27-E30 PolarHBondContact O-N 2.82Å; N28-E30 VanDerWaalsContact C-N 3.35Å; E30-G32 VanDerWaalsContact C-N 3.35Å; E30-G32 PolarHBondContact O-N 3.38Å; E30-C34 HydrophobicContact CG-CB 4.03Å; E30-C34 WeakPolarHBondContact CG-SG 3.12Å; E30-C34 PolarHBondContact OE1-SG 3.44Å; E30-C34 VanDerWaalsContact OE1-SG 3.37Å; E30-P75 WeakPolarHBondContact OE1-CG 3.22Å
31	G	41.4	Very low	59.7	Low	69 Å²	69	57.9 Å²	57.9	71%	0.711	35%	0.347	S	S	*	.	S	Bend	trans	-80.7	88.1	142.9	0	0	0	0	0	108.4	N29 D33	N29-G31 PolarHBondContact O-N 2.91Å; G31-D33 PolarHBondContact O-N 3.12Å
32	G	45.8	Very low	61	Low	70 Å²	70	56.9 Å²	56.9	72%	0.722	34%	0.344	S	S	*	.	S	Bend	trans	65.1	-27.3	161.9	0	0	0	0	0	120.4	E30	E30-G32 VanDerWaalsContact C-N 3.35Å; E30-G32 PolarHBondContact O-N 3.38Å
33	D	56.4	Low	62.4	Low	90 Å²	90	62.7 Å²	62.7	48%	0.481	37%	0.366	S	S	.	.			trans	-133.7	33.6	-151.2	-71.8	-4.4	0	0	0	114	G31 F35 E36	G31-D33 PolarHBondContact O-N 3.12Å; D33-F35 PolarHBondContact O-N 3.14Å; D33-E36 HydrophobicContact CB-CB 3.95Å; D33-E36 HydrophobicContact CB-CG 4.26Å; D33-E36 PolarHBondContact O-N 3.12Å; D33-E36 VanDerWaalsContact O-N 3.17Å
34	C	56.5	Low	63.9	Low	27 Å²	27	61 Å²	61	18%	0.182	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-32.1	-172.2	-110.2	0	0	0	0	114	E30 P75	E30-C34 HydrophobicContact CG-CB 4.03Å; E30-C34 WeakPolarHBondContact CG-SG 3.12Å; E30-C34 PolarHBondContact OE1-SG 3.44Å; E30-C34 VanDerWaalsContact OE1-SG 3.37Å; C34-P75 HydrophobicContact CB-CG 4.11Å
35	F	57.5	Low	65.4	Low	13 Å²	13	57.4 Å²	57.4	6%	0.057	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120	-3.9	178.1	-62	-64.1	0	0	0	115.3	D33 N37 V40 I44 L65 L68 P75 V78 V174	D33-F35 PolarHBondContact O-N 3.14Å; F35-N37 PolarHBondContact O-N 3.02Å; F35-V40 HydrophobicContact CD1-CG1 3.83Å; F35-V40 HydrophobicContact CE1-CG1 4.21Å; F35-I44 HydrophobicContact CD1-CD1 4.24Å; F35-I44 HydrophobicContact CE1-CD1 4.19Å; F35-L65 VanDerWaalsContact O-CD2 3.24Å; F35-L65 WeakPolarHBondContact O-CD2 3.47Å; F35-L68 HydrophobicContact CB-CB 3.88Å; F35-L68 HydrophobicContact CB-CD1 3.66Å; F35-L68 HydrophobicContact CB-CG 4.3Å; F35-L68 HydrophobicContact CD1-CD1 3.68Å; F35-L68 HydrophobicContact CD1-CD2 4.45Å; F35-L68 HydrophobicContact CD2-CB 4.14Å; F35-L68 HydrophobicContact CD2-CD1 4.23Å; F35-L68 HydrophobicContact CD2-CD2 3.97Å; F35-L68 HydrophobicContact CD2-CG 4.34Å; F35-L68 HydrophobicContact CE1-CD1 4.37Å; F35-L68 HydrophobicContact CE2-CD2 4.06Å; F35-L68 HydrophobicContact CG-CB 4.12Å; F35-L68 HydrophobicContact CG-CD1 3.6Å; F35-L68 HydrophobicContact CG-CD2 4.17Å; F35-L68 HydrophobicContact CG-CG 4.18Å; F35-L68 HydrophobicContact CZ-CD2 4.37Å; F35-P75 HydrophobicContact CD2-CG 4.39Å; F35-P75 HydrophobicContact CE2-CB 3.56Å; F35-P75 HydrophobicContact CE2-CG 3.63Å; F35-P75 HydrophobicContact CZ-CB 3.7Å; F35-P75 HydrophobicContact CZ-CG 4.28Å; F35-V78 HydrophobicContact CE1-CB 4.39Å; F35-V78 HydrophobicContact CE1-CG1 3.98Å; F35-V78 HydrophobicContact CE2-CB 4.27Å; F35-V78 HydrophobicContact CE2-CG2 3.91Å; F35-V78 HydrophobicContact CZ-CB 3.69Å; F35-V78 HydrophobicContact CZ-CG1 3.79Å; F35-V78 HydrophobicContact CZ-CG2 3.86Å; F35-V174 HydrophobicContact CE1-CG2 4.07Å
36	E	57	Low	66.9	Low	117 Å²	117	61.5 Å²	61.5	55%	0.547	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-12.6	174.2	-58.5	-160.7	169.3	0	0	112	D33 P38	D33-E36 HydrophobicContact CB-CB 3.95Å; D33-E36 HydrophobicContact CB-CG 4.26Å; D33-E36 PolarHBondContact O-N 3.12Å; D33-E36 VanDerWaalsContact O-N 3.17Å; E36-P38 WeakPolarHBondContact O-CD 3.48Å
37	N	65.9	Low	68.4	Low	74 Å²	74	63.4 Å²	63.4	40%	0.396	36%	0.363	S	S	.	.			trans	-68.5	111.9	172.7	-172	-18.1	0	0	0	110.8	F35 V39 V40 S41	F35-N37 PolarHBondContact O-N 3.02Å; N37-V39 PolarHBondContact O-N 3.18Å; N37-V39 VanDerWaalsContact OD1-CB 3.27Å; N37-V39 WeakPolarHBondContact OD1-CB 3.38Å; N37-V39 WeakPolarHBondContact OD1-CG2 3.46Å; N37-V39 PolarHBondContact OD1-N 2.82Å; N37-V40 HydrophobicContact CB-CB 4.48Å; N37-V40 HydrophobicContact CB-CG2 4.03Å; N37-V40 PolarHBondContact O-N 3.18Å; N37-S41 PolarHBondContact O-N 3.4Å
38	P	67.6	Low	70.1	Confident	79 Å²	79	60 Å²	60	51%	0.513	34%	0.34	S	S	.	.	H	α-helix	trans	-60.5	-22.1	-178.2	24.9	-34.5	0	0	0	112.9	E36 V40 S41 D42	E36-P38 WeakPolarHBondContact O-CD 3.48Å; P38-V40 VanDerWaalsContact C-N 3.34Å; P38-S41 WeakPolarHBondContact CA-OG 3.14Å; P38-S41 PolarHBondContact O-OG 3.4Å; P38-S41 VanDerWaalsContact O-OG 3.13Å; P38-D42 VanDerWaalsContact O-CB 3.28Å; P38-D42 WeakPolarHBondContact O-CB 3.31Å; P38-D42 VanDerWaalsContact O-CG 3.28Å; P38-D42 PolarHBondContact O-N 3.26Å
39	V	73.4	Confident	72	Confident	78 Å²	78	55.1 Å²	55.1	47%	0.473	31%	0.314	S	S	.	.	H	α-helix	trans	-68.1	-35.5	175.9	-179.5	0	0	0	0	111.7	N37 R43	N37-V39 PolarHBondContact O-N 3.18Å; N37-V39 VanDerWaalsContact OD1-CB 3.27Å; N37-V39 WeakPolarHBondContact OD1-CB 3.38Å; N37-V39 WeakPolarHBondContact OD1-CG2 3.46Å; N37-V39 PolarHBondContact OD1-N 2.82Å; V39-R43 WeakPolarHBondContact O-CD 3.43Å; V39-R43 VanDerWaalsContact O-CG 3.22Å; V39-R43 WeakPolarHBondContact O-CG 3.5Å; V39-R43 PolarHBondContact O-N 3.48Å
40	V	78.9	Confident	74	Confident	3 Å²	3	57 Å²	57	2%	0.018	33%	0.332	C	S	.	.	H	α-helix	trans	-73.7	-49.5	-179.4	175.7	0	0	0	0	109.7	F35 N37 P38 D42 R43 I44 V174	F35-V40 HydrophobicContact CD1-CG1 3.83Å; F35-V40 HydrophobicContact CE1-CG1 4.21Å; N37-V40 HydrophobicContact CB-CB 4.48Å; N37-V40 HydrophobicContact CB-CG2 4.03Å; N37-V40 PolarHBondContact O-N 3.18Å; P38-V40 VanDerWaalsContact C-N 3.34Å; V40-D42 VanDerWaalsContact C-N 3.33Å; V40-D42 PolarHBondContact O-N 3.38Å; V40-R43 WeakPolarHBondContact O-CB 3.47Å; V40-R43 PolarHBondContact O-N 3.47Å; V40-I44 HydrophobicContact CG1-CD1 4.02Å; V40-I44 HydrophobicContact CG1-CG1 4.49Å; V40-I44 WeakPolarHBondContact O-CG1 3.4Å; V40-I44 PolarHBondContact O-N 3.43Å; V40-V174 HydrophobicContact CG1-CG2 3.65Å
41	S	83.3	Confident	76.3	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.9	-42.3	177.9	54.9	0	0	0	0	111.8	N37 P38 R43 I44 V45 T61	N37-S41 PolarHBondContact O-N 3.4Å; P38-S41 WeakPolarHBondContact CA-OG 3.14Å; P38-S41 PolarHBondContact O-OG 3.4Å; P38-S41 VanDerWaalsContact O-OG 3.13Å; S41-R43 VanDerWaalsContact C-N 3.29Å; S41-R43 PolarHBondContact O-N 2.83Å; S41-I44 WeakPolarHBondContact O-CB 3.49Å; S41-I44 PolarHBondContact O-N 2.9Å; S41-V45 WeakPolarHBondContact O-CB 3.29Å; S41-V45 VanDerWaalsContact O-CG2 3.26Å; S41-V45 WeakPolarHBondContact O-CG2 3.46Å; S41-V45 PolarHBondContact O-N 3.37Å; S41-T61 VanDerWaalsContact OG-CG2 3.23Å; S41-T61 WeakPolarHBondContact OG-CG2 3.33Å
42	D	85.6	Confident	78.7	Confident	65 Å²	65	51.2 Å²	51.2	35%	0.348	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-34.2	174.1	-83.1	-4.3	0	0	0	113.4	P38 V40 K46 T61	P38-D42 VanDerWaalsContact O-CB 3.28Å; P38-D42 WeakPolarHBondContact O-CB 3.31Å; P38-D42 VanDerWaalsContact O-CG 3.28Å; P38-D42 PolarHBondContact O-N 3.26Å; V40-D42 VanDerWaalsContact C-N 3.33Å; V40-D42 PolarHBondContact O-N 3.38Å; D42-K46 WeakPolarHBondContact O-CB 3.25Å; D42-K46 WeakPolarHBondContact O-CD 3.48Å; D42-K46 WeakPolarHBondContact O-CG 3.36Å; D42-K46 PolarHBondContact O-N 3.24Å; D42-T61 WeakPolarHBondContact OD1-CG2 3.45Å; D42-T61 PolarHBondContact OD1-OG1 2.96Å
43	R	86.9	Confident	80.8	Confident	124 Å²	124	52.5 Å²	52.5	47%	0.468	27%	0.274	S	S	.	.	H	α-helix	trans	-71.7	-42.6	176.3	-76.5	170.9	-175.7	-97.3	2.9	111.3	V39 V40 S41 K46 M47 I172	V39-R43 WeakPolarHBondContact O-CD 3.43Å; V39-R43 VanDerWaalsContact O-CG 3.22Å; V39-R43 WeakPolarHBondContact O-CG 3.5Å; V39-R43 PolarHBondContact O-N 3.48Å; V40-R43 WeakPolarHBondContact O-CB 3.47Å; V40-R43 PolarHBondContact O-N 3.47Å; S41-R43 VanDerWaalsContact C-N 3.29Å; S41-R43 PolarHBondContact O-N 2.83Å; R43-K46 PolarHBondContact O-N 2.8Å; R43-M47 WeakPolarHBondContact O-CB 3.43Å; R43-M47 PolarHBondContact O-N 2.83Å; R43-I172 WeakPolarHBondContact CD-O 3.29Å
44	I	90.4	Very high	82.4	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-56.6	-52.5	173.6	-68.4	174.3	0	0	0	109.6	F35 V40 S41 K46 M47 V48 V64 L68 V78 L82 F107	F35-I44 HydrophobicContact CD1-CD1 4.24Å; F35-I44 HydrophobicContact CE1-CD1 4.19Å; V40-I44 HydrophobicContact CG1-CD1 4.02Å; V40-I44 HydrophobicContact CG1-CG1 4.49Å; V40-I44 WeakPolarHBondContact O-CG1 3.4Å; V40-I44 PolarHBondContact O-N 3.43Å; S41-I44 WeakPolarHBondContact O-CB 3.49Å; S41-I44 PolarHBondContact O-N 2.9Å; I44-K46 VanDerWaalsContact C-N 3.34Å; I44-K46 PolarHBondContact O-N 3.45Å; I44-M47 PolarHBondContact O-N 3.5Å; I44-M47 VanDerWaalsContact O-N 3.15Å; I44-V48 HydrophobicContact CG2-CG2 4.38Å; I44-V48 WeakPolarHBondContact O-CG2 3.46Å; I44-V48 PolarHBondContact O-N 3.43Å; I44-V64 HydrophobicContact CB-CG1 4.29Å; I44-V64 HydrophobicContact CD1-CG1 4.34Å; I44-V64 HydrophobicContact CG2-CG1 3.93Å; I44-V64 HydrophobicContact CG2-CG2 4.12Å; I44-L68 HydrophobicContact CD1-CD1 4.01Å; I44-V78 HydrophobicContact CD1-CG1 4.26Å; I44-L82 HydrophobicContact CD1-CD1 4.15Å; I44-L82 HydrophobicContact CG1-CD1 3.78Å; I44-L82 HydrophobicContact CG2-CD2 4.02Å; I44-F107 HydrophobicContact CG2-CE2 4.17Å
45	V	92.2	Very high	83.4	Confident	16 Å²	16	63.4 Å²	63.4	10%	0.097	30%	0.304	C	S	.	.	H	α-helix	trans	-54.3	-49.4	177.4	169.4	0	0	0	0	111.2	S41 M47 N49 L59 D60 V64	S41-V45 WeakPolarHBondContact O-CB 3.29Å; S41-V45 VanDerWaalsContact O-CG2 3.26Å; S41-V45 WeakPolarHBondContact O-CG2 3.46Å; S41-V45 PolarHBondContact O-N 3.37Å; V45-M47 PolarHBondContact O-N 2.85Å; V45-N49 VanDerWaalsContact CG1-ND2 3.32Å; V45-N49 WeakPolarHBondContact CG1-ND2 3.33Å; V45-N49 WeakPolarHBondContact O-CB 3.23Å; V45-N49 VanDerWaalsContact O-CG 3.3Å; V45-N49 PolarHBondContact O-N 2.84Å; V45-N49 PolarHBondContact O-ND2 3.35Å; V45-L59 WeakPolarHBondContact CG1-O 3.3Å; V45-L59 HydrophobicContact CG2-CG 4.49Å; V45-D60 VanDerWaalsContact CG2-C 3.47Å; V45-V64 HydrophobicContact CG2-CB 4.29Å; V45-V64 HydrophobicContact CG2-CG2 3.69Å
46	K	92.1	Very high	84.9	Confident	134 Å²	134	68.9 Å²	68.9	58%	0.583	33%	0.333	S	S	*	.	H	α-helix	trans	-61	-43.8	179	-77.5	168.7	-172.5	166.9	0	112.1	D42 R43 I44 S50	D42-K46 WeakPolarHBondContact O-CB 3.25Å; D42-K46 WeakPolarHBondContact O-CD 3.48Å; D42-K46 WeakPolarHBondContact O-CG 3.36Å; D42-K46 PolarHBondContact O-N 3.24Å; R43-K46 PolarHBondContact O-N 2.8Å; I44-K46 VanDerWaalsContact C-N 3.34Å; I44-K46 PolarHBondContact O-N 3.45Å; K46-S50 VanDerWaalsContact O-CB 3.24Å; K46-S50 WeakPolarHBondContact O-CB 3.28Å; K46-S50 PolarHBondContact O-N 3.47Å; K46-S50 PolarHBondContact O-OG 3.3Å
47	M	93.3	Very high	86.3	Confident	42 Å²	42	64.9 Å²	64.9	21%	0.207	32%	0.324	C	S	.	.	H	α-helix	trans	-62.5	-54.6	-179	-179.7	179.3	173.7	0	0	111.1	R43 I44 V45 S50 A51 L82 E86 F168	R43-M47 WeakPolarHBondContact O-CB 3.43Å; R43-M47 PolarHBondContact O-N 2.83Å; I44-M47 PolarHBondContact O-N 3.5Å; I44-M47 VanDerWaalsContact O-N 3.15Å; V45-M47 PolarHBondContact O-N 2.85Å; M47-S50 PolarHBondContact O-N 2.93Å; M47-A51 PolarHBondContact O-N 3.01Å; M47-L82 HydrophobicContact CE-CB 4.24Å; M47-L82 WeakPolarHBondContact CE-O 3.19Å; M47-L82 HydrophobicContact SD-CB 4.25Å; M47-L82 HydrophobicContact SD-CD2 4.27Å; M47-E86 HydrophobicContact CE-CB 3.69Å; M47-F168 HydrophobicContact CE-CE2 3.95Å; M47-F168 HydrophobicContact CE-CZ 3.6Å; M47-F168 HydrophobicContact SD-CE2 4.28Å; M47-F168 HydrophobicContact SD-CZ 3.66Å
48	V	94.8	Very high	87.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-66	-43.4	-177	-176.8	0	0	0	0	111.1	I44 S50 A51 S52 L59 L82 I85 A103 F107	I44-V48 HydrophobicContact CG2-CG2 4.38Å; I44-V48 WeakPolarHBondContact O-CG2 3.46Å; I44-V48 PolarHBondContact O-N 3.43Å; V48-S50 PolarHBondContact O-N 2.88Å; V48-A51 WeakPolarHBondContact O-CB 3.43Å; V48-A51 PolarHBondContact O-N 3.29Å; V48-A51 VanDerWaalsContact O-N 3.1Å; V48-S52 PolarHBondContact O-N 3.47Å; V48-S52 VanDerWaalsContact O-N 3.09Å; V48-L59 HydrophobicContact CB-CD2 3.94Å; V48-L59 HydrophobicContact CG1-CD2 4.11Å; V48-L59 HydrophobicContact CG2-CD2 4.11Å; V48-L82 HydrophobicContact CG2-CD2 3.85Å; V48-I85 HydrophobicContact CG1-CD1 4.34Å; V48-I85 HydrophobicContact CG2-CD1 4.02Å; V48-A103 HydrophobicContact CG1-CB 4.14Å; V48-A103 VanDerWaalsContact CG1-O 3.29Å; V48-A103 WeakPolarHBondContact CG1-O 3.39Å; V48-F107 HydrophobicContact CG1-CB 4.12Å; V48-F107 HydrophobicContact CG2-CD2 4.02Å
49	N	95.5	Very high	88.8	Confident	31 Å²	31	61.6 Å²	61.6	17%	0.166	30%	0.298	C	S	.	.	H	α-helix	trans	-64.7	-26.2	177.9	-79.3	-29.4	0	0	0	113.7	V45 S52 K58 L59 A103	V45-N49 VanDerWaalsContact CG1-ND2 3.32Å; V45-N49 WeakPolarHBondContact CG1-ND2 3.33Å; V45-N49 WeakPolarHBondContact O-CB 3.23Å; V45-N49 VanDerWaalsContact O-CG 3.3Å; V45-N49 PolarHBondContact O-N 2.84Å; V45-N49 PolarHBondContact O-ND2 3.35Å; N49-S52 VanDerWaalsContact O-O 3.14Å; N49-K58 HydrophobicContact CB-CD 4.06Å; N49-K58 PolarHBondContact O-NZ 2.82Å; N49-K58 WeakPolarHBondContact OD1-CA 3.27Å; N49-K58 VanDerWaalsContact OD1-CD 3.26Å; N49-K58 WeakPolarHBondContact OD1-CD 3.24Å; N49-L59 PolarHBondContact ND2-O 3.33Å; N49-L59 PolarHBondContact OD1-N 3.31Å; N49-A103 WeakPolarHBondContact OD1-CB 3.14Å
50	S	93.2	Very high	89.7	Confident	99 Å²	99	61.3 Å²	61.3	69%	0.692	29%	0.294	S	S	*	.	H	α-helix	trans	-80.4	-28.5	175.1	-59.4	0	0	0	0	112.2	K46 M47 V48	K46-S50 VanDerWaalsContact O-CB 3.24Å; K46-S50 WeakPolarHBondContact O-CB 3.28Å; K46-S50 PolarHBondContact O-N 3.47Å; K46-S50 PolarHBondContact O-OG 3.3Å; M47-S50 PolarHBondContact O-N 2.93Å; V48-S50 PolarHBondContact O-N 2.88Å
51	A	93.9	Very high	90.1	Very high	8 Å²	8	63 Å²	63	7%	0.066	30%	0.304	C	S	.	.	H	α-helix	trans	-70.7	-47.6	175	0	0	0	0	0	111.7	M47 V48 K53 I85 V89 L98 L106	M47-A51 PolarHBondContact O-N 3.01Å; V48-A51 WeakPolarHBondContact O-CB 3.43Å; V48-A51 PolarHBondContact O-N 3.29Å; V48-A51 VanDerWaalsContact O-N 3.1Å; A51-K53 PolarHBondContact O-N 3.49Å; A51-I85 HydrophobicContact CB-CG2 3.54Å; A51-V89 HydrophobicContact CB-CG2 3.58Å; A51-L98 HydrophobicContact CB-CD2 4.5Å; A51-L106 HydrophobicContact CB-CD2 3.92Å
52	S	93.1	Very high	90.2	Very high	3 Å²	3	69.7 Å²	69.7	2%	0.021	33%	0.334	C	S	.	.			trans	-75.8	119.3	176.1	174.3	0	0	0	0	111.5	V48 N49 R54 K58 V101	V48-S52 PolarHBondContact O-N 3.47Å; V48-S52 VanDerWaalsContact O-N 3.09Å; N49-S52 VanDerWaalsContact O-O 3.14Å; S52-R54 VanDerWaalsContact C-N 3.27Å; S52-R54 PolarHBondContact O-N 3.36Å; S52-R54 PolarHBondContact OG-N 3.39Å; S52-K58 PolarHBondContact O-NZ 3.45Å; S52-V101 PolarHBondContact OG-O 3.41Å
53	K	90.1	Very high	90.3	Very high	97 Å²	97	68.7 Å²	68.7	42%	0.422	33%	0.327	S	S	.	.			trans	-79.5	-10	176.6	-57.7	-179.8	-175.6	171.3	0	112.9	A51 P93 L98	A51-K53 PolarHBondContact O-N 3.49Å; K53-P93 WeakPolarHBondContact CE-O 3.23Å; K53-P93 PolarHBondContact NZ-O 2.96Å; K53-L98 PolarHBondContact N-O 3.18Å
54	R	88.5	Confident	90.3	Very high	113 Å²	113	62.8 Å²	62.8	43%	0.426	31%	0.305	S	S	.	.			trans	-67.2	140	177.8	-168.1	163.3	172.7	165.7	-5.1	110	S52 K58 E100	S52-R54 VanDerWaalsContact C-N 3.27Å; S52-R54 PolarHBondContact O-N 3.36Å; S52-R54 PolarHBondContact OG-N 3.39Å; R54-K58 WeakPolarHBondContact O-CE 3.27Å; R54-K58 PolarHBondContact O-NZ 3.08Å; R54-E100 VanDerWaalsContact CD-O 3.27Å; R54-E100 WeakPolarHBondContact CD-O 3.09Å; R54-E100 PolarHBondContact NH1-O 3.43Å
55	R	79.3	Confident	90	Very high	233 Å²	233	65.1 Å²	65.1	88%	0.879	32%	0.317	S	S	*	.	S	Bend	trans	-80.6	-26.8	-177.5	-68	-173.7	177.1	-170	-0.4	113.5
56	L	87	Confident	89.5	Confident	128 Å²	128	69 Å²	69	67%	0.67	34%	0.335	S	S	*	.	S	Bend	trans	-104.5	160.2	-179.8	-64.2	174.8	0	0	0	110.7
57	G	88	Confident	88.9	Confident	34 Å²	34	64.3 Å²	64.3	35%	0.351	31%	0.314	S	S	.	.	S	Bend	trans	66.2	49.2	-178.2	0	0	0	0	0	111.8	T102 A103 V104	G57-T102 WeakPolarHBondContact O-CB 3.39Å; G57-A103 WeakPolarHBondContact O-CB 3.29Å; G57-A103 PolarHBondContact O-N 2.97Å; G57-V104 PolarHBondContact O-N 3.41Å
58	K	93.2	Very high	88.2	Confident	79 Å²	79	63 Å²	63	34%	0.343	31%	0.307	S	S	.	.			trans	-76.9	141	172.9	-68.5	-64.1	-179.3	-169.3	0	109	N49 S52 R54 M63 A103	N49-K58 HydrophobicContact CB-CD 4.06Å; N49-K58 PolarHBondContact O-NZ 2.82Å; N49-K58 WeakPolarHBondContact OD1-CA 3.27Å; N49-K58 VanDerWaalsContact OD1-CD 3.26Å; N49-K58 WeakPolarHBondContact OD1-CD 3.24Å; S52-K58 PolarHBondContact O-NZ 3.45Å; R54-K58 WeakPolarHBondContact O-CE 3.27Å; R54-K58 PolarHBondContact O-NZ 3.08Å; K58-M63 WeakPolarHBondContact O-CE 3.39Å; K58-A103 HydrophobicContact CD-CB 4.47Å
59	L	92.7	Very high	87	Confident	5 Å²	5	66.8 Å²	66.8	3%	0.026	33%	0.333	C	S	.	.			trans	-72.3	143.3	172.5	-168.5	64.8	0	0	0	108.5	V45 V48 N49 M63 V64 A103 V104 F107	V45-L59 WeakPolarHBondContact CG1-O 3.3Å; V45-L59 HydrophobicContact CG2-CG 4.49Å; V48-L59 HydrophobicContact CB-CD2 3.94Å; V48-L59 HydrophobicContact CG1-CD2 4.11Å; V48-L59 HydrophobicContact CG2-CD2 4.11Å; N49-L59 PolarHBondContact ND2-O 3.33Å; N49-L59 PolarHBondContact OD1-N 3.31Å; L59-M63 HydrophobicContact CD1-CB 4.1Å; L59-V64 HydrophobicContact CD1-CG2 3.85Å; L59-V64 HydrophobicContact CD2-CG2 3.38Å; L59-V64 HydrophobicContact CG-CG2 3.49Å; L59-V64 VanDerWaalsContact CG-CG2 3.49Å; L59-A103 HydrophobicContact CB-CB 4.22Å; L59-V104 HydrophobicContact CD1-CG2 4.22Å; L59-F107 HydrophobicContact CD1-CD1 4.36Å; L59-F107 HydrophobicContact CD2-CB 4.2Å; L59-F107 HydrophobicContact CD2-CD1 4.43Å; L59-F107 HydrophobicContact CD2-CD2 4.28Å; L59-F107 HydrophobicContact CD2-CG 4.05Å
60	D	90.9	Very high	85.6	Confident	71 Å²	71	68.4 Å²	68.4	38%	0.38	35%	0.346	S	S	.	.			trans	-124.7	166.4	174	72.3	42.8	0	0	0	110.4	V45 F62 M63 V64	V45-D60 VanDerWaalsContact CG2-C 3.47Å; D60-F62 PolarHBondContact O-N 3.18Å; D60-F62 WeakPolarHBondContact OD1-CA 3.22Å; D60-F62 WeakPolarHBondContact OD1-CB 3.36Å; D60-F62 PolarHBondContact OD1-N 3.18Å; D60-M63 HydrophobicContact CB-CE 4.04Å; D60-M63 VanDerWaalsContact CG-CE 3.42Å; D60-M63 PolarHBondContact O-N 3.46Å; D60-M63 PolarHBondContact OD1-N 3.4Å; D60-M63 WeakPolarHBondContact OD2-CE 3.12Å; D60-V64 WeakPolarHBondContact O-CG2 3.24Å; D60-V64 PolarHBondContact O-N 3.02Å; D60-V64 VanDerWaalsContact O-N 3.13Å
61	T	87.7	Confident	84.1	Confident	38 Å²	38	67.6 Å²	67.6	23%	0.233	33%	0.328	C	S	.	.	H	α-helix	trans	-64.9	-31.5	-174.7	-49.7	0	0	0	0	111.7	S41 D42 L65	S41-T61 VanDerWaalsContact OG-CG2 3.23Å; S41-T61 WeakPolarHBondContact OG-CG2 3.33Å; D42-T61 WeakPolarHBondContact OD1-CG2 3.45Å; D42-T61 PolarHBondContact OD1-OG1 2.96Å; T61-L65 HydrophobicContact CG2-CD1 4.06Å; T61-L65 HydrophobicContact CG2-CG 4.39Å; T61-L65 WeakPolarHBondContact O-CB 3.14Å; T61-L65 WeakPolarHBondContact O-CG 3.25Å; T61-L65 PolarHBondContact O-N 3.43Å
62	F	86.4	Confident	82.6	Confident	141 Å²	141	72 Å²	72	62%	0.618	36%	0.358	S	S	*	.	H	α-helix	trans	-69.1	-48.1	178.8	-179.9	-91.7	0	0	0	110.8	D60 V64 L65 E66	D60-F62 PolarHBondContact O-N 3.18Å; D60-F62 WeakPolarHBondContact OD1-CA 3.22Å; D60-F62 WeakPolarHBondContact OD1-CB 3.36Å; D60-F62 PolarHBondContact OD1-N 3.18Å; F62-V64 VanDerWaalsContact C-N 3.31Å; F62-V64 PolarHBondContact O-N 2.71Å; F62-L65 PolarHBondContact O-N 3.03Å; F62-E66 HydrophobicContact CE1-CB 4.49Å; F62-E66 WeakPolarHBondContact CE1-OE2 3.28Å; F62-E66 VanDerWaalsContact O-CB 3.3Å; F62-E66 WeakPolarHBondContact O-CB 3.36Å; F62-E66 PolarHBondContact O-N 3.38Å
63	M	88	Confident	81.6	Confident	44 Å²	44	73 Å²	73	22%	0.217	36%	0.364	C	S	.	.	H	α-helix	trans	-56.1	-46.3	175	-73.3	-172.7	-99.8	0	0	111.3	K58 L59 D60 E66 Y67 V104	K58-M63 WeakPolarHBondContact O-CE 3.39Å; L59-M63 HydrophobicContact CD1-CB 4.1Å; D60-M63 HydrophobicContact CB-CE 4.04Å; D60-M63 VanDerWaalsContact CG-CE 3.42Å; D60-M63 PolarHBondContact O-N 3.46Å; D60-M63 PolarHBondContact OD1-N 3.4Å; D60-M63 WeakPolarHBondContact OD2-CE 3.12Å; M63-E66 PolarHBondContact O-N 2.96Å; M63-Y67 HydrophobicContact CB-CE2 4.26Å; M63-Y67 WeakPolarHBondContact O-CD2 3.27Å; M63-Y67 PolarHBondContact O-N 2.95Å; M63-V104 HydrophobicContact CE-CG2 4.21Å; M63-V104 HydrophobicContact SD-CG2 3.87Å
64	V	86.6	Confident	81	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.6	-48.3	178.2	171.6	0	0	0	0	111.4	I44 V45 L59 D60 F62 E66 Y67 L68	I44-V64 HydrophobicContact CB-CG1 4.29Å; I44-V64 HydrophobicContact CD1-CG1 4.34Å; I44-V64 HydrophobicContact CG2-CG1 3.93Å; I44-V64 HydrophobicContact CG2-CG2 4.12Å; V45-V64 HydrophobicContact CG2-CB 4.29Å; V45-V64 HydrophobicContact CG2-CG2 3.69Å; L59-V64 HydrophobicContact CD1-CG2 3.85Å; L59-V64 HydrophobicContact CD2-CG2 3.38Å; L59-V64 HydrophobicContact CG-CG2 3.49Å; L59-V64 VanDerWaalsContact CG-CG2 3.49Å; D60-V64 WeakPolarHBondContact O-CG2 3.24Å; D60-V64 PolarHBondContact O-N 3.02Å; D60-V64 VanDerWaalsContact O-N 3.13Å; F62-V64 VanDerWaalsContact C-N 3.31Å; F62-V64 PolarHBondContact O-N 2.71Å; V64-E66 VanDerWaalsContact C-N 3.33Å; V64-E66 PolarHBondContact O-N 3.26Å; V64-Y67 PolarHBondContact O-N 3.12Å; V64-L68 HydrophobicContact CG1-CD1 3.38Å; V64-L68 HydrophobicContact CG1-CG 4.14Å; V64-L68 WeakPolarHBondContact O-CB 3.26Å; V64-L68 WeakPolarHBondContact O-CG 3.47Å; V64-L68 PolarHBondContact O-N 3.33Å
65	L	83.2	Confident	80.5	Confident	51 Å²	51	64.3 Å²	64.3	27%	0.267	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-41.3	177.8	-72	171.8	0	0	0	111.7	F35 T61 F62 Y67 L68 C69	F35-L65 VanDerWaalsContact O-CD2 3.24Å; F35-L65 WeakPolarHBondContact O-CD2 3.47Å; T61-L65 HydrophobicContact CG2-CD1 4.06Å; T61-L65 HydrophobicContact CG2-CG 4.39Å; T61-L65 WeakPolarHBondContact O-CB 3.14Å; T61-L65 WeakPolarHBondContact O-CG 3.25Å; T61-L65 PolarHBondContact O-N 3.43Å; F62-L65 PolarHBondContact O-N 3.03Å; L65-Y67 PolarHBondContact O-N 3.45Å; L65-L68 PolarHBondContact O-N 3.06Å; L65-C69 WeakPolarHBondContact O-CB 3.28Å; L65-C69 PolarHBondContact O-N 3.24Å; L65-C69 PolarHBondContact O-SG 3.01Å
66	E	81.6	Confident	80.8	Confident	98 Å²	98	53.2 Å²	53.2	46%	0.458	29%	0.291	S	S	.	.	H	α-helix	trans	-58.1	-48.6	175.8	-176.7	168.9	-148.1	0	0	110.6	F62 M63 V64 L68 C69 S70	F62-E66 HydrophobicContact CE1-CB 4.49Å; F62-E66 WeakPolarHBondContact CE1-OE2 3.28Å; F62-E66 VanDerWaalsContact O-CB 3.3Å; F62-E66 WeakPolarHBondContact O-CB 3.36Å; F62-E66 PolarHBondContact O-N 3.38Å; M63-E66 PolarHBondContact O-N 2.96Å; V64-E66 VanDerWaalsContact C-N 3.33Å; V64-E66 PolarHBondContact O-N 3.26Å; E66-L68 PolarHBondContact O-N 2.88Å; E66-C69 PolarHBondContact O-N 3.17Å; E66-S70 WeakPolarHBondContact O-CA 3.15Å; E66-S70 WeakPolarHBondContact O-CB 3.4Å; E66-S70 PolarHBondContact O-N 2.71Å; E66-S70 PolarHBondContact O-OG 3.38Å
67	Y	80.3	Confident	80.8	Confident	36 Å²	36	47.2 Å²	47.2	14%	0.141	26%	0.259	C	S	.	.	H	α-helix	trans	-66.2	-38.9	177.1	-70.3	-55.2	0	0	0	113.7	M63 V64 L65 F107 E135 F136	M63-Y67 HydrophobicContact CB-CE2 4.26Å; M63-Y67 WeakPolarHBondContact O-CD2 3.27Å; M63-Y67 PolarHBondContact O-N 2.95Å; V64-Y67 PolarHBondContact O-N 3.12Å; L65-Y67 PolarHBondContact O-N 3.45Å; Y67-F107 HydrophobicContact CD2-CD1 4.47Å; Y67-F107 HydrophobicContact CD2-CE1 4.17Å; Y67-E135 HydrophobicContact CD1-CG 4.2Å; Y67-E135 HydrophobicContact CE1-CG 4.08Å; Y67-F136 HydrophobicContact CD1-CD1 4.29Å; Y67-F136 AromaticContact CD1-CE1 3.77Å; Y67-F136 HydrophobicContact CD1-CE1 3.77Å; Y67-F136 HydrophobicContact CD1-CZ 4.27Å; Y67-F136 AromaticContact CD2-CE1 3.87Å; Y67-F136 HydrophobicContact CD2-CE1 3.87Å; Y67-F136 AromaticContact CE1-CD1 3.56Å; Y67-F136 HydrophobicContact CE1-CD1 3.56Å; Y67-F136 AromaticContact CE1-CE1 3.5Å; Y67-F136 HydrophobicContact CE1-CE1 3.5Å; Y67-F136 HydrophobicContact CE1-CG 4.38Å; Y67-F136 HydrophobicContact CE1-CZ 4.31Å; Y67-F136 AromaticContact CE2-CD1 3.87Å; Y67-F136 HydrophobicContact CE2-CD1 3.87Å; Y67-F136 AromaticContact CE2-CE1 3.62Å; Y67-F136 HydrophobicContact CE2-CE1 3.62Å; Y67-F136 AromaticContact CG-CE1 3.97Å; Y67-F136 HydrophobicContact CG-CE1 3.97Å; Y67-F136 AromaticContact CZ-CD1 3.32Å; Y67-F136 AromaticContact CZ-CE1 3.44Å; Y67-F136 VanDerWaalsContact CZ-CE1 3.44Å; Y67-F136 WeakPolarHBondContact OH-CD1 3.36Å
68	L	78.9	Confident	80.8	Confident	15 Å²	15	45.6 Å²	45.6	8%	0.079	24%	0.242	C	C	.	.	H	α-helix	trans	-74.6	-26.9	-178.1	-65.1	174.7	0	0	0	112.7	F35 I44 V64 L65 E66 V78	F35-L68 HydrophobicContact CB-CB 3.88Å; F35-L68 HydrophobicContact CB-CD1 3.66Å; F35-L68 HydrophobicContact CB-CG 4.3Å; F35-L68 HydrophobicContact CD1-CD1 3.68Å; F35-L68 HydrophobicContact CD1-CD2 4.45Å; F35-L68 HydrophobicContact CD2-CB 4.14Å; F35-L68 HydrophobicContact CD2-CD1 4.23Å; F35-L68 HydrophobicContact CD2-CD2 3.97Å; F35-L68 HydrophobicContact CD2-CG 4.34Å; F35-L68 HydrophobicContact CE1-CD1 4.37Å; F35-L68 HydrophobicContact CE2-CD2 4.06Å; F35-L68 HydrophobicContact CG-CB 4.12Å; F35-L68 HydrophobicContact CG-CD1 3.6Å; F35-L68 HydrophobicContact CG-CD2 4.17Å; F35-L68 HydrophobicContact CG-CG 4.18Å; F35-L68 HydrophobicContact CZ-CD2 4.37Å; I44-L68 HydrophobicContact CD1-CD1 4.01Å; V64-L68 HydrophobicContact CG1-CD1 3.38Å; V64-L68 HydrophobicContact CG1-CG 4.14Å; V64-L68 WeakPolarHBondContact O-CB 3.26Å; V64-L68 WeakPolarHBondContact O-CG 3.47Å; V64-L68 PolarHBondContact O-N 3.33Å; L65-L68 PolarHBondContact O-N 3.06Å; E66-L68 PolarHBondContact O-N 2.88Å; L68-V78 HydrophobicContact CD2-CB 4.18Å; L68-V78 HydrophobicContact CD2-CG1 3.78Å; L68-V78 HydrophobicContact CD2-CG2 3.32Å
69	C	69.1	Low	80.7	Confident	78 Å²	78	41.8 Å²	41.8	53%	0.527	23%	0.226	S	C	.	.	H	α-helix	trans	-99.4	-30.3	-179.5	-63.2	0	0	0	0	113.6	L65 E66 R71	L65-C69 WeakPolarHBondContact O-CB 3.28Å; L65-C69 PolarHBondContact O-N 3.24Å; L65-C69 PolarHBondContact O-SG 3.01Å; E66-C69 PolarHBondContact O-N 3.17Å; C69-R71 VanDerWaalsContact C-N 3.28Å; C69-R71 PolarHBondContact O-N 2.99Å
70	S	65.7	Low	80.6	Confident	65 Å²	65	41.6 Å²	41.6	46%	0.455	23%	0.225	S	C	.	.	H	α-helix	trans	-68.6	-28.4	-175.5	58.8	0	0	0	0	112.9	E66 E135	E66-S70 WeakPolarHBondContact O-CA 3.15Å; E66-S70 WeakPolarHBondContact O-CB 3.4Å; E66-S70 PolarHBondContact O-N 2.71Å; E66-S70 PolarHBondContact O-OG 3.38Å; S70-E135 PolarHBondContact OG-OE1 2.99Å
71	R	61.9	Low	80.8	Confident	83 Å²	83	38.2 Å²	38.2	31%	0.313	21%	0.207	S	C	.	.	S	Bend	trans	-125.9	148	-179.9	-72	-169.9	179.8	-122.6	5.7	110	C69 V73 M127 E135	C69-R71 VanDerWaalsContact C-N 3.28Å; C69-R71 PolarHBondContact O-N 2.99Å; R71-V73 HydrophobicContact CB-CG2 3.72Å; R71-V73 PolarHBondContact O-N 3.45Å; R71-M127 VanDerWaalsContact CZ-CE 3.44Å; R71-M127 PolarHBondContact NH1-SD 3.02Å; R71-E135 IonicContact CZ-OE2 2.72Å; R71-E135 IonicContact NE-OE1 2.6Å; R71-E135 IonicContact NE-OE2 3.15Å; R71-E135 PolarHBondContact NE-OE2 3.14Å; R71-E135 IonicContact NH2-OE2 3.93Å; R71-E135 PolarHBondContact NH2-OE2 3.28Å
72	S	63	Low	81.1	Confident	100 Å²	100	36.4 Å²	36.4	70%	0.699	20%	0.196	S	C	*	.			trans	-71.1	56.9	164.9	-167.9	0	0	0	0	109.5	P74 H125	S72-P74 VanDerWaalsContact O-CD 3.28Å; S72-P74 WeakPolarHBondContact O-CD 3.45Å; S72-H125 PolarHBondContact O-ND1 3.29Å
73	V	72.2	Confident	81.4	Confident	23 Å²	23	30.3 Å²	30.3	14%	0.139	17%	0.17	C	C	.	.			trans	-75	118.4	170.4	173.3	0	0	0	0	105.9	R71 V78 M111	R71-V73 HydrophobicContact CB-CG2 3.72Å; R71-V73 PolarHBondContact O-N 3.45Å; V73-V78 HydrophobicContact CG1-CG2 3.81Å; V73-M111 HydrophobicContact CG1-CE 3.39Å
74	P	76.5	Confident	81.8	Confident	10 Å²	10	28.2 Å²	28.2	7%	0.065	16%	0.159	C	C	.	.			trans	-63.7	141.8	-178.9	-27.7	38.8	0	0	0	111.9	F23 S72 V76 S77 V78 H125	F23-P74 HydrophobicContact CD1-CB 4.27Å; F23-P74 HydrophobicContact CE1-CB 3.3Å; F23-P74 HydrophobicContact CE1-CG 3.68Å; F23-P74 HydrophobicContact CZ-CB 3.85Å; F23-P74 HydrophobicContact CZ-CG 4.14Å; S72-P74 VanDerWaalsContact O-CD 3.28Å; S72-P74 WeakPolarHBondContact O-CD 3.45Å; P74-V76 HydrophobicContact CB-CG1 3.92Å; P74-V76 PolarHBondContact O-N 3.42Å; P74-S77 WeakPolarHBondContact O-CB 3.36Å; P74-S77 PolarHBondContact O-N 3.35Å; P74-V78 PolarHBondContact O-N 3.21Å; P74-H125 HydrophobicContact CG-CB 4.09Å
75	P	79.2	Confident	82.2	Confident	19 Å²	19	28.3 Å²	28.3	12%	0.123	16%	0.16	C	C	.	.	H	α-helix	trans	-57	-27.3	178.6	-31.3	40.2	0	0	0	114.5	L26 E30 C34 F35 S77 V78 L79	L26-P75 HydrophobicContact CD1-CB 4.15Å; L26-P75 HydrophobicContact CD2-CB 3.91Å; E30-P75 WeakPolarHBondContact OE1-CG 3.22Å; C34-P75 HydrophobicContact CB-CG 4.11Å; F35-P75 HydrophobicContact CD2-CG 4.39Å; F35-P75 HydrophobicContact CE2-CB 3.56Å; F35-P75 HydrophobicContact CE2-CG 3.63Å; F35-P75 HydrophobicContact CZ-CB 3.7Å; F35-P75 HydrophobicContact CZ-CG 4.28Å; P75-S77 VanDerWaalsContact C-N 3.33Å; P75-S77 PolarHBondContact O-N 2.93Å; P75-V78 PolarHBondContact O-N 2.98Å; P75-L79 WeakPolarHBondContact O-CG 3.37Å; P75-L79 PolarHBondContact O-N 3.09Å
76	V	83.7	Confident	82.7	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.9	-34.5	173.2	60.7	0	0	0	0	112.7	I22 F23 L26 P74 V78 L79 T80 L118 I165	I22-V76 HydrophobicContact CG2-CB 4.02Å; I22-V76 HydrophobicContact CG2-CG2 3.64Å; F23-V76 HydrophobicContact CD1-CG1 4.11Å; F23-V76 HydrophobicContact CD2-CG1 4.11Å; F23-V76 HydrophobicContact CE1-CG1 3.55Å; F23-V76 HydrophobicContact CE2-CG1 3.47Å; F23-V76 VanDerWaalsContact CE2-CG1 3.47Å; F23-V76 HydrophobicContact CG-CG1 4.35Å; F23-V76 HydrophobicContact CZ-CG1 3.09Å; L26-V76 HydrophobicContact CD1-CB 3.51Å; L26-V76 HydrophobicContact CD1-CG1 4.34Å; L26-V76 HydrophobicContact CD1-CG2 4.5Å; L26-V76 VanDerWaalsContact CD1-N 3.35Å; P74-V76 HydrophobicContact CB-CG1 3.92Å; P74-V76 PolarHBondContact O-N 3.42Å; V76-V78 VanDerWaalsContact C-N 3.34Å; V76-L79 PolarHBondContact O-N 2.84Å; V76-T80 VanDerWaalsContact O-CB 3.23Å; V76-T80 WeakPolarHBondContact O-CB 3.38Å; V76-T80 PolarHBondContact O-N 2.87Å; V76-T80 PolarHBondContact O-OG1 2.89Å; V76-L118 HydrophobicContact CB-CD1 4.38Å; V76-L118 HydrophobicContact CG1-CD1 3.99Å; V76-L118 HydrophobicContact CG2-CD1 3.92Å; V76-L118 HydrophobicContact CG2-CD2 4.38Å; V76-I165 HydrophobicContact CG2-CD1 4.23Å
77	S	87.7	Confident	83.3	Confident	1 Å²	1	27 Å²	27	1%	0.007	15%	0.151	C	C	.	.	H	α-helix	trans	-64.7	-42.9	176.1	-59.6	0	0	0	0	110.5	P74 P75 T80 A81 A114 H119	P74-S77 WeakPolarHBondContact O-CB 3.36Å; P74-S77 PolarHBondContact O-N 3.35Å; P75-S77 VanDerWaalsContact C-N 3.33Å; P75-S77 PolarHBondContact O-N 2.93Å; S77-T80 PolarHBondContact O-N 3.06Å; S77-A81 WeakPolarHBondContact O-CB 3.5Å; S77-A81 PolarHBondContact O-N 2.93Å; S77-A114 WeakPolarHBondContact O-CB 3.45Å; S77-H119 PolarHBondContact OG-NE2 3.34Å
78	V	88.8	Confident	84	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.1	-49.7	176.7	-176.2	0	0	0	0	110.8	F35 I44 L68 V73 P74 P75 V76 T80 A81 L82 M111	F35-V78 HydrophobicContact CE1-CB 4.39Å; F35-V78 HydrophobicContact CE1-CG1 3.98Å; F35-V78 HydrophobicContact CE2-CB 4.27Å; F35-V78 HydrophobicContact CE2-CG2 3.91Å; F35-V78 HydrophobicContact CZ-CB 3.69Å; F35-V78 HydrophobicContact CZ-CG1 3.79Å; F35-V78 HydrophobicContact CZ-CG2 3.86Å; I44-V78 HydrophobicContact CD1-CG1 4.26Å; L68-V78 HydrophobicContact CD2-CB 4.18Å; L68-V78 HydrophobicContact CD2-CG1 3.78Å; L68-V78 HydrophobicContact CD2-CG2 3.32Å; V73-V78 HydrophobicContact CG1-CG2 3.81Å; P74-V78 PolarHBondContact O-N 3.21Å; P75-V78 PolarHBondContact O-N 2.98Å; V76-V78 VanDerWaalsContact C-N 3.34Å; V78-T80 VanDerWaalsContact C-N 3.28Å; V78-T80 PolarHBondContact O-N 3.1Å; V78-A81 PolarHBondContact O-N 3.25Å; V78-L82 HydrophobicContact CG1-CD1 4.07Å; V78-L82 VanDerWaalsContact O-CG 3.27Å; V78-L82 WeakPolarHBondContact O-CG 3.29Å; V78-L82 PolarHBondContact O-N 2.65Å; V78-M111 HydrophobicContact CB-SD 4.49Å; V78-M111 HydrophobicContact CG2-CE 3.97Å; V78-M111 HydrophobicContact CG2-SD 4.35Å
79	L	90	Very high	84.7	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-58.8	-41.4	177.5	-72.7	173.8	0	0	0	111.9	L26 P75 V76 L83 I165 F168 I172 V174 F175	L26-L79 HydrophobicContact CD2-CD1 4.03Å; P75-L79 WeakPolarHBondContact O-CG 3.37Å; P75-L79 PolarHBondContact O-N 3.09Å; V76-L79 PolarHBondContact O-N 2.84Å; L79-L83 WeakPolarHBondContact O-CB 3.43Å; L79-L83 PolarHBondContact O-N 3.22Å; L79-I165 HydrophobicContact CB-CG2 4.1Å; L79-I165 HydrophobicContact CD1-CG2 3.88Å; L79-F168 HydrophobicContact CD2-CD1 4.1Å; L79-F168 HydrophobicContact CD2-CE1 4.41Å; L79-I172 HydrophobicContact CD2-CD1 3.58Å; L79-I172 HydrophobicContact CD2-CG1 4.22Å; L79-V174 HydrophobicContact CD1-CG1 4.46Å; L79-V174 HydrophobicContact CD2-CB 4.35Å; L79-V174 HydrophobicContact CD2-CG2 4.06Å; L79-F175 HydrophobicContact CD1-CE2 3.98Å; L79-F175 HydrophobicContact CD1-CZ 3.94Å
80	T	92	Very high	85.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67.7	-42	179.1	-58	0	0	0	0	111.4	V76 S77 V78 L83 F84 A114 Y117	V76-T80 VanDerWaalsContact O-CB 3.23Å; V76-T80 WeakPolarHBondContact O-CB 3.38Å; V76-T80 PolarHBondContact O-N 2.87Å; V76-T80 PolarHBondContact O-OG1 2.89Å; S77-T80 PolarHBondContact O-N 3.06Å; V78-T80 VanDerWaalsContact C-N 3.28Å; V78-T80 PolarHBondContact O-N 3.1Å; T80-L83 PolarHBondContact O-N 2.9Å; T80-F84 HydrophobicContact CG2-CD1 4.36Å; T80-F84 HydrophobicContact CG2-CD2 4.46Å; T80-F84 HydrophobicContact CG2-CE1 3.78Å; T80-F84 HydrophobicContact CG2-CE2 3.9Å; T80-F84 HydrophobicContact CG2-CZ 3.53Å; T80-F84 WeakPolarHBondContact O-CG 3.4Å; T80-F84 PolarHBondContact O-N 3.28Å; T80-A114 HydrophobicContact CG2-CB 4.02Å; T80-Y117 HydrophobicContact CG2-CD1 3.95Å; T80-Y117 HydrophobicContact CG2-CE1 4.32Å
81	A	94.3	Very high	86.9	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.3	-46.6	175.8	0	0	0	0	0	112	S77 V78 L83 F84 I85 S110 M111 A114	S77-A81 WeakPolarHBondContact O-CB 3.5Å; S77-A81 PolarHBondContact O-N 2.93Å; V78-A81 PolarHBondContact O-N 3.25Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 2.91Å; A81-F84 WeakPolarHBondContact O-CB 3.41Å; A81-F84 PolarHBondContact O-N 3.14Å; A81-I85 PolarHBondContact O-N 3.46Å; A81-S110 WeakPolarHBondContact CB-O 3.22Å; A81-M111 HydrophobicContact CB-CG 4.2Å; A81-M111 HydrophobicContact CB-SD 3.42Å; A81-M111 WeakPolarHBondContact CB-SD 3.27Å; A81-A114 HydrophobicContact CB-CB 3.74Å
82	L	94.1	Very high	88.3	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-63.1	-40.6	176.7	-66	171.1	0	0	0	111.7	I44 M47 V48 V78 F84 I85 E86 F107 F168 I172	I44-L82 HydrophobicContact CD1-CD1 4.15Å; I44-L82 HydrophobicContact CG1-CD1 3.78Å; I44-L82 HydrophobicContact CG2-CD2 4.02Å; M47-L82 HydrophobicContact CE-CB 4.24Å; M47-L82 WeakPolarHBondContact CE-O 3.19Å; M47-L82 HydrophobicContact SD-CB 4.25Å; M47-L82 HydrophobicContact SD-CD2 4.27Å; V48-L82 HydrophobicContact CG2-CD2 3.85Å; V78-L82 HydrophobicContact CG1-CD1 4.07Å; V78-L82 VanDerWaalsContact O-CG 3.27Å; V78-L82 WeakPolarHBondContact O-CG 3.29Å; V78-L82 PolarHBondContact O-N 2.65Å; L82-F84 VanDerWaalsContact C-N 3.32Å; L82-F84 PolarHBondContact O-N 3.07Å; L82-I85 WeakPolarHBondContact O-CB 3.34Å; L82-I85 PolarHBondContact O-N 3.13Å; L82-E86 PolarHBondContact O-N 3.47Å; L82-F107 HydrophobicContact CD2-CE2 4.43Å; L82-F168 HydrophobicContact CB-CE1 3.53Å; L82-F168 HydrophobicContact CB-CZ 3.77Å; L82-F168 HydrophobicContact CD1-CE1 4.29Å; L82-I172 HydrophobicContact CD1-CD1 3.87Å
83	L	93.5	Very high	89.6	Confident	13 Å²	13	26.4 Å²	26.4	7%	0.068	16%	0.158	C	C	.	.	H	α-helix	trans	-66.4	-34.2	175.9	-169.4	70.4	0	0	0	112.1	L79 T80 A81 E86 K87 V160 Q164 F168	L79-L83 WeakPolarHBondContact O-CB 3.43Å; L79-L83 PolarHBondContact O-N 3.22Å; T80-L83 PolarHBondContact O-N 2.9Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 2.91Å; L83-E86 PolarHBondContact O-N 2.91Å; L83-K87 WeakPolarHBondContact O-CB 3.41Å; L83-K87 WeakPolarHBondContact O-CG 3.43Å; L83-K87 PolarHBondContact O-N 2.9Å; L83-V160 HydrophobicContact CD2-CB 4.08Å; L83-V160 HydrophobicContact CD2-CG1 3.28Å; L83-V160 HydrophobicContact CD2-CG2 3.55Å; L83-V160 HydrophobicContact CG-CG2 4.41Å; L83-Q164 HydrophobicContact CD2-CB 4.13Å; L83-F168 HydrophobicContact CB-CD1 4.48Å; L83-F168 HydrophobicContact CD1-CB 4.15Å; L83-F168 HydrophobicContact CD1-CD2 3.92Å; L83-F168 HydrophobicContact CD1-CG 3.95Å
84	F	95.7	Very high	90.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.4	-42	171.4	-70.5	-9.7	0	0	0	111.7	T80 A81 L82 E86 K87 L88 V113 A114 Y117 F150 L154 F158 V160	T80-F84 HydrophobicContact CG2-CD1 4.36Å; T80-F84 HydrophobicContact CG2-CD2 4.46Å; T80-F84 HydrophobicContact CG2-CE1 3.78Å; T80-F84 HydrophobicContact CG2-CE2 3.9Å; T80-F84 HydrophobicContact CG2-CZ 3.53Å; T80-F84 WeakPolarHBondContact O-CG 3.4Å; T80-F84 PolarHBondContact O-N 3.28Å; A81-F84 WeakPolarHBondContact O-CB 3.41Å; A81-F84 PolarHBondContact O-N 3.14Å; L82-F84 VanDerWaalsContact C-N 3.32Å; L82-F84 PolarHBondContact O-N 3.07Å; F84-E86 VanDerWaalsContact C-N 3.35Å; F84-K87 PolarHBondContact O-N 3.42Å; F84-L88 PolarHBondContact O-N 3.37Å; F84-V113 HydrophobicContact CD2-CG1 4.09Å; F84-V113 HydrophobicContact CE2-CG1 3.9Å; F84-A114 HydrophobicContact CD2-CB 4.31Å; F84-A114 HydrophobicContact CE2-CB 4.15Å; F84-Y117 HydrophobicContact CZ-CD1 4.07Å; F84-Y117 HydrophobicContact CZ-CG 4.05Å; F84-F150 HydrophobicContact CB-CE1 4.11Å; F84-F150 HydrophobicContact CB-CZ 3.94Å; F84-F150 HydrophobicContact CD2-CE1 4.42Å; F84-L154 HydrophobicContact CB-CD1 4.08Å; F84-L154 HydrophobicContact CG-CD1 4.38Å; F84-F158 HydrophobicContact CE1-CB 4.09Å; F84-F158 WeakPolarHBondContact CE1-O 3.28Å; F84-F158 HydrophobicContact CE2-CD1 4.24Å; F84-F158 HydrophobicContact CZ-CB 3.81Å; F84-F158 HydrophobicContact CZ-CD1 4.23Å; F84-F158 HydrophobicContact CZ-CG 4.46Å; F84-V160 HydrophobicContact CD1-CG2 4.22Å; F84-V160 HydrophobicContact CE1-CG2 3.69Å
85	I	95.7	Very high	91.1	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-61.2	-45.2	172.9	-66.3	172	0	0	0	110.5	V48 A51 A81 L82 L88 V89 L106 S110	V48-I85 HydrophobicContact CG1-CD1 4.34Å; V48-I85 HydrophobicContact CG2-CD1 4.02Å; A51-I85 HydrophobicContact CB-CG2 3.54Å; A81-I85 PolarHBondContact O-N 3.46Å; L82-I85 WeakPolarHBondContact O-CB 3.34Å; L82-I85 PolarHBondContact O-N 3.13Å; I85-L88 PolarHBondContact O-N 2.84Å; I85-V89 HydrophobicContact CG2-CG2 4.39Å; I85-V89 WeakPolarHBondContact O-CG2 3.33Å; I85-V89 PolarHBondContact O-N 2.89Å; I85-L106 HydrophobicContact CD1-CG 4.18Å; I85-L106 HydrophobicContact CG1-CD1 4.5Å; I85-L106 HydrophobicContact CG1-CG 4.29Å; I85-L106 HydrophobicContact CG2-CD2 4.32Å; I85-S110 WeakPolarHBondContact CD1-OG 3.37Å
86	E	93.7	Very high	91.8	Very high	71 Å²	71	36.7 Å²	36.7	33%	0.332	21%	0.205	S	C	.	.	H	α-helix	trans	-59.9	-47.9	177.9	-173.8	172.1	-147.3	0	0	111.8	M47 L82 L83 F84 L88 V89 V90 F168	M47-E86 HydrophobicContact CE-CB 3.69Å; L82-E86 PolarHBondContact O-N 3.47Å; L83-E86 PolarHBondContact O-N 2.91Å; F84-E86 VanDerWaalsContact C-N 3.35Å; E86-L88 VanDerWaalsContact C-N 3.31Å; E86-L88 PolarHBondContact O-N 3Å; E86-V89 PolarHBondContact O-N 2.89Å; E86-V90 HydrophobicContact CG-CG2 4.36Å; E86-V90 WeakPolarHBondContact O-CG2 3.38Å; E86-V90 PolarHBondContact O-N 3.3Å; E86-F168 WeakPolarHBondContact OE2-CD2 3.47Å; E86-F168 WeakPolarHBondContact OE2-CE2 3.34Å
87	K	93.2	Very high	92.3	Very high	50 Å²	50	37 Å²	37	22%	0.217	21%	0.206	C	C	.	.	H	α-helix	trans	-55.1	-46.8	175.5	-81	-179.1	162.2	-169.9	0	111.7	L83 F84 V90 A91 L154 E157 F159	L83-K87 WeakPolarHBondContact O-CB 3.41Å; L83-K87 WeakPolarHBondContact O-CG 3.43Å; L83-K87 PolarHBondContact O-N 2.9Å; F84-K87 PolarHBondContact O-N 3.42Å; K87-V90 PolarHBondContact O-N 2.94Å; K87-A91 WeakPolarHBondContact O-CB 3.41Å; K87-A91 PolarHBondContact O-N 2.94Å; K87-L154 HydrophobicContact CB-CD2 4.01Å; K87-E157 PolarHBondContact NZ-O 3.23Å; K87-F159 PolarHBondContact NZ-O 3.36Å
88	L	94.3	Very high	92.6	Very high	1 Å²	1	37 Å²	37	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-46.8	178.4	177.2	59.8	0	0	0	111.6	F84 I85 E86 V90 A91 D92 L97 L98 F150 A153 L154	F84-L88 PolarHBondContact O-N 3.37Å; I85-L88 PolarHBondContact O-N 2.84Å; E86-L88 VanDerWaalsContact C-N 3.31Å; E86-L88 PolarHBondContact O-N 3Å; L88-V90 VanDerWaalsContact C-N 3.32Å; L88-V90 PolarHBondContact O-N 3.38Å; L88-A91 PolarHBondContact O-N 3.46Å; L88-D92 CarbonylContact O-C 3.37Å; L88-D92 PolarHBondContact O-N 3.45Å; L88-L97 HydrophobicContact CD2-CD2 3.78Å; L88-L98 HydrophobicContact CD2-CD2 3.74Å; L88-L98 HydrophobicContact CD2-CG 4.09Å; L88-L98 HydrophobicContact CG-CD1 4.3Å; L88-L98 HydrophobicContact CG-CD2 4.17Å; L88-L98 HydrophobicContact CG-CG 4.24Å; L88-F150 HydrophobicContact CD2-CD2 4.43Å; L88-F150 HydrophobicContact CD2-CE2 4.2Å; L88-A153 HydrophobicContact CD1-CB 3.74Å; L88-L154 HydrophobicContact CB-CD2 3.83Å; L88-L154 HydrophobicContact CB-CG 4.39Å
89	V	94.1	Very high	92.7	Very high	52 Å²	52	40.4 Å²	40.4	32%	0.315	23%	0.227	S	C	.	.	H	α-helix	trans	-63.4	-37.5	179.6	171.8	0	0	0	0	112	A51 I85 E86 P93 L98	A51-V89 HydrophobicContact CB-CG2 3.58Å; I85-V89 HydrophobicContact CG2-CG2 4.39Å; I85-V89 WeakPolarHBondContact O-CG2 3.33Å; I85-V89 PolarHBondContact O-N 2.89Å; E86-V89 PolarHBondContact O-N 2.89Å; V89-P93 WeakPolarHBondContact O-CA 3.2Å; V89-P93 WeakPolarHBondContact O-CB 3.29Å; V89-P93 WeakPolarHBondContact O-CD 3.4Å; V89-L98 HydrophobicContact CG2-CD1 3.97Å; V89-L98 HydrophobicContact CG2-CD2 4.24Å
90	V	91.5	Very high	92.8	Very high	110 Å²	110	45.7 Å²	45.7	67%	0.667	25%	0.252	S	S	*	.	H	α-helix	trans	-74.2	-43.8	178.9	171.5	0	0	0	0	111.6	E86 K87 L88	E86-V90 HydrophobicContact CG-CG2 4.36Å; E86-V90 WeakPolarHBondContact O-CG2 3.38Å; E86-V90 PolarHBondContact O-N 3.3Å; K87-V90 PolarHBondContact O-N 2.94Å; L88-V90 VanDerWaalsContact C-N 3.32Å; L88-V90 PolarHBondContact O-N 3.38Å
91	A	90.6	Very high	92.9	Very high	79 Å²	79	46.2 Å²	46.2	65%	0.653	26%	0.255	S	S	*	.	H	α-helix	trans	-73.7	-46.1	-176.2	0	0	0	0	0	112.4	K87 L88	K87-A91 WeakPolarHBondContact O-CB 3.41Å; K87-A91 PolarHBondContact O-N 2.94Å; L88-A91 PolarHBondContact O-N 3.46Å
92	D	91.1	Very high	93	Very high	67 Å²	67	47 Å²	47	36%	0.358	26%	0.26	S	S	.	.			trans	-138.7	79.5	179.7	-175.9	12.3	0	0	0	111.8	L88 Y94 S95	L88-D92 CarbonylContact O-C 3.37Å; L88-D92 PolarHBondContact O-N 3.45Å; D92-Y94 PolarHBondContact O-N 3.37Å; D92-Y94 PolarHBondContact OD1-N 3.44Å; D92-Y94 VanDerWaalsContact OD1-N 3.14Å; D92-S95 WeakPolarHBondContact O-CB 3.43Å; D92-S95 PolarHBondContact O-N 3.39Å; D92-S95 VanDerWaalsContact O-N 3.12Å; D92-S95 PolarHBondContact OD1-N 3.16Å; D92-S95 VanDerWaalsContact OD1-N 3.12Å; D92-S95 WeakPolarHBondContact OD2-CA 3.29Å; D92-S95 VanDerWaalsContact OD2-CB 3.28Å; D92-S95 WeakPolarHBondContact OD2-CB 3.42Å; D92-S95 PolarHBondContact OD2-N 3.32Å
93	P	89.4	Confident	93.1	Very high	56 Å²	56	47 Å²	47	36%	0.364	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-11.4	178.4	25	-33.9	0	0	0	113.2	K53 V89	K53-P93 WeakPolarHBondContact CE-O 3.23Å; K53-P93 PolarHBondContact NZ-O 2.96Å; V89-P93 WeakPolarHBondContact O-CA 3.2Å; V89-P93 WeakPolarHBondContact O-CB 3.29Å; V89-P93 WeakPolarHBondContact O-CD 3.4Å
94	Y	90.1	Very high	93.1	Very high	188 Å²	188	47.5 Å²	47.5	74%	0.737	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	10.5	179.4	-58.7	-77.7	0	0	0	113.5	D92 S96	D92-Y94 PolarHBondContact O-N 3.37Å; D92-Y94 PolarHBondContact OD1-N 3.44Å; D92-Y94 VanDerWaalsContact OD1-N 3.14Å; Y94-S96 PolarHBondContact O-N 3.01Å
95	S	91.1	Very high	93.1	Very high	7 Å²	7	49 Å²	49	5%	0.049	27%	0.271	C	S	.	.			trans	-48.8	134.1	176.9	-173.9	0	0	0	0	111.2	D92 L97 L98 T99	D92-S95 WeakPolarHBondContact O-CB 3.43Å; D92-S95 PolarHBondContact O-N 3.39Å; D92-S95 VanDerWaalsContact O-N 3.12Å; D92-S95 PolarHBondContact OD1-N 3.16Å; D92-S95 VanDerWaalsContact OD1-N 3.12Å; D92-S95 WeakPolarHBondContact OD2-CA 3.29Å; D92-S95 VanDerWaalsContact OD2-CB 3.28Å; D92-S95 WeakPolarHBondContact OD2-CB 3.42Å; D92-S95 PolarHBondContact OD2-N 3.32Å; S95-L97 PolarHBondContact O-N 3.38Å; S95-L97 PolarHBondContact OG-N 3.49Å; S95-L98 PolarHBondContact O-N 3.49Å; S95-T99 PolarHBondContact O-N 3.44Å; S95-T99 PolarHBondContact O-OG1 3.08Å
96	S	92.7	Very high	93.1	Very high	74 Å²	74	49 Å²	49	52%	0.517	27%	0.271	S	S	.	.	H	α-helix	trans	-56.6	-35.1	173.8	54	0	0	0	0	110.6	Y94 L98 T99 E100	Y94-S96 PolarHBondContact O-N 3.01Å; S96-L98 PolarHBondContact O-N 3.34Å; S96-T99 CarbonylContact O-C 3.6Å; S96-T99 PolarHBondContact O-N 3.04Å; S96-E100 WeakPolarHBondContact O-CB 3.39Å; S96-E100 WeakPolarHBondContact O-CG 3.38Å; S96-E100 PolarHBondContact O-N 3.39Å
97	L	93.8	Very high	93.2	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-56.1	-49.5	176.7	-166.8	76.7	0	0	0	112.1	L88 S95 T99 E100 V101 K149 F150 A153	L88-L97 HydrophobicContact CD2-CD2 3.78Å; S95-L97 PolarHBondContact O-N 3.38Å; S95-L97 PolarHBondContact OG-N 3.49Å; L97-T99 PolarHBondContact O-N 3.4Å; L97-E100 PolarHBondContact O-N 3.2Å; L97-V101 HydrophobicContact CD1-CG2 3.57Å; L97-V101 HydrophobicContact CG-CG2 4.06Å; L97-V101 VanDerWaalsContact O-CB 3.24Å; L97-V101 WeakPolarHBondContact O-CB 3.43Å; L97-V101 WeakPolarHBondContact O-CG2 3.47Å; L97-V101 PolarHBondContact O-N 2.72Å; L97-K149 HydrophobicContact CD1-CB 3.79Å; L97-F150 HydrophobicContact CD2-CB 4Å; L97-F150 HydrophobicContact CD2-CD2 3.61Å; L97-F150 HydrophobicContact CD2-CG 4.2Å; L97-A153 HydrophobicContact CB-CB 4.41Å; L97-A153 HydrophobicContact CD2-CB 4Å
98	L	94.2	Very high	93.3	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-65.8	-19	179	-64.3	178.9	0	0	0	113	A51 K53 L88 V89 S95 S96 L106	A51-L98 HydrophobicContact CB-CD2 4.5Å; K53-L98 PolarHBondContact N-O 3.18Å; L88-L98 HydrophobicContact CD2-CD2 3.74Å; L88-L98 HydrophobicContact CD2-CG 4.09Å; L88-L98 HydrophobicContact CG-CD1 4.3Å; L88-L98 HydrophobicContact CG-CD2 4.17Å; L88-L98 HydrophobicContact CG-CG 4.24Å; V89-L98 HydrophobicContact CG2-CD1 3.97Å; V89-L98 HydrophobicContact CG2-CD2 4.24Å; S95-L98 PolarHBondContact O-N 3.49Å; S96-L98 PolarHBondContact O-N 3.34Å; L98-L106 HydrophobicContact CD2-CD1 4.37Å; L98-L106 HydrophobicContact CD2-CD2 3.99Å
99	T	92.3	Very high	93.3	Very high	70 Å²	70	43.2 Å²	43.2	43%	0.429	25%	0.245	S	C	.	.	H	α-helix	trans	-96.2	-34.7	-177.8	-48.4	0	0	0	0	112.3	S95 S96 L97	S95-T99 PolarHBondContact O-N 3.44Å; S95-T99 PolarHBondContact O-OG1 3.08Å; S96-T99 CarbonylContact O-C 3.6Å; S96-T99 PolarHBondContact O-N 3.04Å; L97-T99 PolarHBondContact O-N 3.4Å
100	E	92.1	Very high	93.4	Very high	111 Å²	111	40.8 Å²	40.8	52%	0.519	23%	0.23	S	C	.	.	H	α-helix	trans	-92.5	-33.6	-174.4	-68.7	173.6	-167.6	0	0	112.9	R54 S96 L97	R54-E100 VanDerWaalsContact CD-O 3.27Å; R54-E100 WeakPolarHBondContact CD-O 3.09Å; R54-E100 PolarHBondContact NH1-O 3.43Å; S96-E100 WeakPolarHBondContact O-CB 3.39Å; S96-E100 WeakPolarHBondContact O-CG 3.38Å; S96-E100 PolarHBondContact O-N 3.39Å; L97-E100 PolarHBondContact O-N 3.2Å
101	V	94.2	Very high	93.5	Very high	12 Å²	12	35.8 Å²	35.8	7%	0.073	20%	0.2	C	C	.	.	S	Bend	trans	-89.9	142.9	-171.6	-178.2	0	0	0	0	111	S52 L97 D105 L106 L146	S52-V101 PolarHBondContact OG-O 3.41Å; L97-V101 HydrophobicContact CD1-CG2 3.57Å; L97-V101 HydrophobicContact CG-CG2 4.06Å; L97-V101 VanDerWaalsContact O-CB 3.24Å; L97-V101 WeakPolarHBondContact O-CB 3.43Å; L97-V101 WeakPolarHBondContact O-CG2 3.47Å; L97-V101 PolarHBondContact O-N 2.72Å; V101-D105 HydrophobicContact CG1-CB 3.33Å; V101-L106 HydrophobicContact CG1-CB 4.31Å; V101-L146 HydrophobicContact CG1-CD2 4.09Å; V101-L146 HydrophobicContact CG2-CD2 3.66Å
102	T	95.1	Very high	93.6	Very high	17 Å²	17	32 Å²	32	10%	0.104	17%	0.169	C	C	.	.			trans	-70.2	165.3	176.3	75.3	0	0	0	0	111	G57 V104 D105 L106	G57-T102 WeakPolarHBondContact O-CB 3.39Å; T102-V104 VanDerWaalsContact C-N 3.28Å; T102-D105 WeakPolarHBondContact CB-OD2 3.37Å; T102-D105 WeakPolarHBondContact CG2-OD2 3.4Å; T102-D105 PolarHBondContact N-OD2 2.95Å; T102-D105 PolarHBondContact OG1-N 3.17Å; T102-D105 VanDerWaalsContact OG1-N 3.12Å; T102-D105 PolarHBondContact OG1-OD1 3.43Å; T102-D105 PolarHBondContact OG1-OD2 3.27Å; T102-L106 VanDerWaalsContact O-CB 3.23Å; T102-L106 WeakPolarHBondContact O-CB 3.32Å; T102-L106 PolarHBondContact O-N 2.85Å
103	A	95.6	Very high	93.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-68.1	-33	176.9	0	0	0	0	0	111.6	V48 N49 G57 K58 L59 F107	V48-A103 HydrophobicContact CG1-CB 4.14Å; V48-A103 VanDerWaalsContact CG1-O 3.29Å; V48-A103 WeakPolarHBondContact CG1-O 3.39Å; N49-A103 WeakPolarHBondContact OD1-CB 3.14Å; G57-A103 WeakPolarHBondContact O-CB 3.29Å; G57-A103 PolarHBondContact O-N 2.97Å; K58-A103 HydrophobicContact CD-CB 4.47Å; L59-A103 HydrophobicContact CB-CB 4.22Å; A103-F107 WeakPolarHBondContact O-CB 3.37Å; A103-F107 PolarHBondContact O-N 3.42Å
104	V	94.7	Very high	93.8	Very high	24 Å²	24	26.3 Å²	26.3	15%	0.145	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-52.2	175.2	179	0	0	0	0	110.3	G57 L59 M63 T102 L106 F107 A108	G57-V104 PolarHBondContact O-N 3.41Å; L59-V104 HydrophobicContact CD1-CG2 4.22Å; M63-V104 HydrophobicContact CE-CG2 4.21Å; M63-V104 HydrophobicContact SD-CG2 3.87Å; T102-V104 VanDerWaalsContact C-N 3.28Å; V104-L106 VanDerWaalsContact C-N 3.3Å; V104-L106 PolarHBondContact O-N 2.8Å; V104-F107 WeakPolarHBondContact O-CB 3.21Å; V104-F107 PolarHBondContact O-N 3.1Å; V104-F107 VanDerWaalsContact O-N 3.15Å; V104-A108 WeakPolarHBondContact O-CB 3.43Å; V104-A108 PolarHBondContact O-N 3.3Å
105	D	95.5	Very high	93.8	Very high	30 Å²	30	17.6 Å²	17.6	16%	0.16	10%	0.101	C	C	.	.	H	α-helix	trans	-62.5	-37.5	178.6	-55.8	-27.8	0	0	0	112	V101 T102 A108 V109 M138 L146	V101-D105 HydrophobicContact CG1-CB 3.33Å; T102-D105 WeakPolarHBondContact CB-OD2 3.37Å; T102-D105 WeakPolarHBondContact CG2-OD2 3.4Å; T102-D105 PolarHBondContact N-OD2 2.95Å; T102-D105 PolarHBondContact OG1-N 3.17Å; T102-D105 VanDerWaalsContact OG1-N 3.12Å; T102-D105 PolarHBondContact OG1-OD1 3.43Å; T102-D105 PolarHBondContact OG1-OD2 3.27Å; D105-A108 PolarHBondContact O-N 3.12Å; D105-V109 WeakPolarHBondContact O-CG1 3.47Å; D105-V109 PolarHBondContact O-N 3.26Å; D105-M138 HydrophobicContact CB-CE 4.06Å; D105-M138 WeakPolarHBondContact OD1-CE 3.16Å; D105-L146 HydrophobicContact CB-CD1 4.04Å
106	L	96.5	Very high	93.7	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-64.1	-42.5	176	180	63.9	0	0	0	111.1	A51 I85 L98 V101 T102 V104 S110 F150	A51-L106 HydrophobicContact CB-CD2 3.92Å; I85-L106 HydrophobicContact CD1-CG 4.18Å; I85-L106 HydrophobicContact CG1-CD1 4.5Å; I85-L106 HydrophobicContact CG1-CG 4.29Å; I85-L106 HydrophobicContact CG2-CD2 4.32Å; L98-L106 HydrophobicContact CD2-CD1 4.37Å; L98-L106 HydrophobicContact CD2-CD2 3.99Å; V101-L106 HydrophobicContact CG1-CB 4.31Å; T102-L106 VanDerWaalsContact O-CB 3.23Å; T102-L106 WeakPolarHBondContact O-CB 3.32Å; T102-L106 PolarHBondContact O-N 2.85Å; V104-L106 VanDerWaalsContact C-N 3.3Å; V104-L106 PolarHBondContact O-N 2.8Å; L106-S110 VanDerWaalsContact O-CB 3.29Å; L106-S110 WeakPolarHBondContact O-CB 3.32Å; L106-S110 PolarHBondContact O-N 3.25Å; L106-S110 VanDerWaalsContact O-N 3.17Å; L106-S110 PolarHBondContact O-OG 2.89Å; L106-F150 HydrophobicContact CD1-CD2 4.07Å; L106-F150 HydrophobicContact CD1-CE2 3.81Å
107	F	95.2	Very high	93.5	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.009	9%	0.088	C	C	.	.	H	α-helix	trans	-62.8	-50.4	174	-174.7	-114.6	0	0	0	110.6	I44 V48 L59 Y67 L82 A103 V104 V109 S110 M111 F136	I44-F107 HydrophobicContact CG2-CE2 4.17Å; V48-F107 HydrophobicContact CG1-CB 4.12Å; V48-F107 HydrophobicContact CG2-CD2 4.02Å; L59-F107 HydrophobicContact CD1-CD1 4.36Å; L59-F107 HydrophobicContact CD2-CB 4.2Å; L59-F107 HydrophobicContact CD2-CD1 4.43Å; L59-F107 HydrophobicContact CD2-CD2 4.28Å; L59-F107 HydrophobicContact CD2-CG 4.05Å; Y67-F107 HydrophobicContact CD2-CD1 4.47Å; Y67-F107 HydrophobicContact CD2-CE1 4.17Å; L82-F107 HydrophobicContact CD2-CE2 4.43Å; A103-F107 WeakPolarHBondContact O-CB 3.37Å; A103-F107 PolarHBondContact O-N 3.42Å; V104-F107 WeakPolarHBondContact O-CB 3.21Å; V104-F107 PolarHBondContact O-N 3.1Å; V104-F107 VanDerWaalsContact O-N 3.15Å; F107-V109 PolarHBondContact O-N 3.41Å; F107-S110 PolarHBondContact O-N 3.45Å; F107-S110 PolarHBondContact O-OG 2.68Å; F107-M111 HydrophobicContact CD1-CG 4.47Å; F107-M111 HydrophobicContact CE1-CG 4.18Å; F107-M111 HydrophobicContact CE2-CG 4.24Å; F107-M111 HydrophobicContact CE2-SD 4.31Å; F107-M111 HydrophobicContact CZ-CG 4.07Å; F107-M111 HydrophobicContact CZ-SD 4.22Å; F107-M111 WeakPolarHBondContact O-CG 3.17Å; F107-M111 PolarHBondContact O-N 3.42Å; F107-F136 HydrophobicContact CD1-CE1 4.3Å
108	A	94.2	Very high	93.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-54	-56.8	180	0	0	0	0	0	112.3	V104 D105 S110 M111 V112 F136	V104-A108 WeakPolarHBondContact O-CB 3.43Å; V104-A108 PolarHBondContact O-N 3.3Å; D105-A108 PolarHBondContact O-N 3.12Å; A108-S110 VanDerWaalsContact C-N 3.29Å; A108-S110 PolarHBondContact O-N 3.42Å; A108-M111 WeakPolarHBondContact O-CB 3.37Å; A108-M111 PolarHBondContact O-N 3.15Å; A108-M111 VanDerWaalsContact O-N 3.09Å; A108-V112 WeakPolarHBondContact O-CG2 3.49Å; A108-V112 PolarHBondContact O-N 2.97Å; A108-F136 VanDerWaalsContact CA-CZ 3.5Å; A108-F136 HydrophobicContact CB-CB 4.1Å; A108-F136 HydrophobicContact CB-CD1 3.5Å; A108-F136 HydrophobicContact CB-CD2 3.48Å; A108-F136 VanDerWaalsContact CB-CD2 3.48Å; A108-F136 HydrophobicContact CB-CE1 3.72Å; A108-F136 HydrophobicContact CB-CE2 3.65Å; A108-F136 HydrophobicContact CB-CG 3.42Å; A108-F136 VanDerWaalsContact CB-CG 3.42Å; A108-F136 HydrophobicContact CB-CZ 3.8Å
109	V	95.6	Very high	92.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63.8	-35	-178.4	73.8	0	0	0	0	112.3	D105 F107 M111 V112 V113 L146 E147 F150	D105-V109 WeakPolarHBondContact O-CG1 3.47Å; D105-V109 PolarHBondContact O-N 3.26Å; F107-V109 PolarHBondContact O-N 3.41Å; V109-M111 VanDerWaalsContact C-N 3.31Å; V109-M111 PolarHBondContact O-N 2.92Å; V109-V112 PolarHBondContact O-N 2.66Å; V109-V113 WeakPolarHBondContact O-CG2 3.45Å; V109-V113 PolarHBondContact O-N 2.97Å; V109-L146 HydrophobicContact CB-CB 4.31Å; V109-L146 HydrophobicContact CG2-CB 4.01Å; V109-E147 VanDerWaalsContact CG2-CA 3.45Å; V109-E147 HydrophobicContact CG2-CB 4.27Å; V109-F150 HydrophobicContact CG1-CB 3.99Å; V109-F150 HydrophobicContact CG1-CD2 3.54Å; V109-F150 HydrophobicContact CG1-CE2 4.2Å; V109-F150 HydrophobicContact CG1-CG 3.85Å; V109-F150 HydrophobicContact CG2-CB 3.73Å; V109-F150 HydrophobicContact CG2-CG 4.18Å
110	S	95.5	Very high	92	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.4	-36.4	176.1	73.9	0	0	0	0	112.1	A81 I85 L106 F107 A108 A114	A81-S110 WeakPolarHBondContact CB-O 3.22Å; I85-S110 WeakPolarHBondContact CD1-OG 3.37Å; L106-S110 VanDerWaalsContact O-CB 3.29Å; L106-S110 WeakPolarHBondContact O-CB 3.32Å; L106-S110 PolarHBondContact O-N 3.25Å; L106-S110 VanDerWaalsContact O-N 3.17Å; L106-S110 PolarHBondContact O-OG 2.89Å; F107-S110 PolarHBondContact O-N 3.45Å; F107-S110 PolarHBondContact O-OG 2.68Å; A108-S110 VanDerWaalsContact C-N 3.29Å; A108-S110 PolarHBondContact O-N 3.42Å; S110-A114 VanDerWaalsContact O-CB 3.22Å; S110-A114 WeakPolarHBondContact O-CB 3.42Å; S110-A114 PolarHBondContact O-N 2.96Å
111	M	93	Very high	91.1	Very high	6 Å²	6	12.8 Å²	12.8	3%	0.03	7%	0.065	C	C	.	.	H	α-helix	trans	-67.1	-43.8	175.2	-72.9	-59.7	-56	0	0	111.8	V73 V78 A81 F107 A108 V109 A114 S115 W132 F136	V73-M111 HydrophobicContact CG1-CE 3.39Å; V78-M111 HydrophobicContact CB-SD 4.49Å; V78-M111 HydrophobicContact CG2-CE 3.97Å; V78-M111 HydrophobicContact CG2-SD 4.35Å; A81-M111 HydrophobicContact CB-CG 4.2Å; A81-M111 HydrophobicContact CB-SD 3.42Å; A81-M111 WeakPolarHBondContact CB-SD 3.27Å; F107-M111 HydrophobicContact CD1-CG 4.47Å; F107-M111 HydrophobicContact CE1-CG 4.18Å; F107-M111 HydrophobicContact CE2-CG 4.24Å; F107-M111 HydrophobicContact CE2-SD 4.31Å; F107-M111 HydrophobicContact CZ-CG 4.07Å; F107-M111 HydrophobicContact CZ-SD 4.22Å; F107-M111 WeakPolarHBondContact O-CG 3.17Å; F107-M111 PolarHBondContact O-N 3.42Å; A108-M111 WeakPolarHBondContact O-CB 3.37Å; A108-M111 PolarHBondContact O-N 3.15Å; A108-M111 VanDerWaalsContact O-N 3.09Å; V109-M111 VanDerWaalsContact C-N 3.31Å; V109-M111 PolarHBondContact O-N 2.92Å; M111-A114 PolarHBondContact O-N 3.35Å; M111-S115 WeakPolarHBondContact O-CB 3.34Å; M111-S115 PolarHBondContact O-N 3.12Å; M111-W132 HydrophobicContact CB-CH2 4.24Å; M111-W132 HydrophobicContact CB-CZ3 4.2Å; M111-W132 HydrophobicContact CE-CH2 4.5Å; M111-F136 HydrophobicContact CB-CZ 4.42Å
112	V	92.7	Very high	90.3	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-56.6	-53	175.2	177.4	0	0	0	0	110.7	A108 V109 A114 S115 K116 W132 L143	A108-V112 WeakPolarHBondContact O-CG2 3.49Å; A108-V112 PolarHBondContact O-N 2.97Å; V109-V112 PolarHBondContact O-N 2.66Å; V112-A114 VanDerWaalsContact C-N 3.35Å; V112-A114 PolarHBondContact O-N 3.23Å; V112-S115 PolarHBondContact O-N 3.17Å; V112-K116 HydrophobicContact CG1-CD 4.35Å; V112-K116 WeakPolarHBondContact O-CG 3.29Å; V112-K116 PolarHBondContact O-N 2.86Å; V112-W132 HydrophobicContact CB-CG 4.45Å; V112-W132 HydrophobicContact CG1-CG 4.5Å; V112-W132 HydrophobicContact CG2-CB 3.71Å; V112-W132 HydrophobicContact CG2-CD2 3.75Å; V112-W132 HydrophobicContact CG2-CE3 4.23Å; V112-W132 HydrophobicContact CG2-CG 3.54Å; V112-L143 HydrophobicContact CG2-CD1 4.08Å; V112-L143 HydrophobicContact CG2-CD2 4.23Å
113	V	93.7	Very high	89.5	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.012	11%	0.11	C	C	.	.	H	α-helix	trans	-65.3	-38.9	-177.3	175.4	0	0	0	0	111.1	F84 V109 Y117 E147 F150 I151 F158	F84-V113 HydrophobicContact CD2-CG1 4.09Å; F84-V113 HydrophobicContact CE2-CG1 3.9Å; V109-V113 WeakPolarHBondContact O-CG2 3.45Å; V109-V113 PolarHBondContact O-N 2.97Å; V113-Y117 VanDerWaalsContact O-CB 3.29Å; V113-Y117 WeakPolarHBondContact O-CB 3.28Å; V113-Y117 PolarHBondContact O-N 3.21Å; V113-E147 HydrophobicContact CG2-CG 3.95Å; V113-F150 HydrophobicContact CB-CD1 4.23Å; V113-F150 HydrophobicContact CB-CE1 4.29Å; V113-F150 HydrophobicContact CG1-CD1 4.36Å; V113-F150 HydrophobicContact CG1-CE1 4.36Å; V113-F150 HydrophobicContact CG2-CD1 3.9Å; V113-F150 HydrophobicContact CG2-CE1 4.45Å; V113-I151 HydrophobicContact CG1-CG1 4.23Å; V113-I151 HydrophobicContact CG2-CD1 4.26Å; V113-I151 HydrophobicContact CG2-CG1 4Å; V113-F158 HydrophobicContact CG1-CD1 4.08Å; V113-F158 HydrophobicContact CG1-CE1 4Å
114	A	92.1	Very high	88.5	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.5	-41.2	175.4	0	0	0	0	0	112.6	S77 T80 A81 F84 S110 M111 V112 Y117 L118	S77-A114 WeakPolarHBondContact O-CB 3.45Å; T80-A114 HydrophobicContact CG2-CB 4.02Å; A81-A114 HydrophobicContact CB-CB 3.74Å; F84-A114 HydrophobicContact CD2-CB 4.31Å; F84-A114 HydrophobicContact CE2-CB 4.15Å; S110-A114 VanDerWaalsContact O-CB 3.22Å; S110-A114 WeakPolarHBondContact O-CB 3.42Å; S110-A114 PolarHBondContact O-N 2.96Å; M111-A114 PolarHBondContact O-N 3.35Å; V112-A114 VanDerWaalsContact C-N 3.35Å; V112-A114 PolarHBondContact O-N 3.23Å; A114-Y117 WeakPolarHBondContact O-CB 3.36Å; A114-Y117 PolarHBondContact O-N 3.03Å; A114-L118 WeakPolarHBondContact O-CG 3.43Å; A114-L118 PolarHBondContact O-N 2.97Å
115	S	89.3	Confident	87.7	Confident	5 Å²	5	30.5 Å²	30.5	4%	0.035	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-50.4	176.6	-168	0	0	0	0	110.9	M111 V112 Y117 L118 H119	M111-S115 WeakPolarHBondContact O-CB 3.34Å; M111-S115 PolarHBondContact O-N 3.12Å; V112-S115 PolarHBondContact O-N 3.17Å; S115-Y117 PolarHBondContact O-N 3.47Å; S115-L118 PolarHBondContact O-N 3.36Å; S115-L118 VanDerWaalsContact O-N 3.1Å; S115-H119 WeakPolarHBondContact O-CB 3.19Å; S115-H119 PolarHBondContact O-N 3.15Å
116	K	89	Confident	86.9	Confident	7 Å²	7	29.8 Å²	29.8	3%	0.03	16%	0.157	C	C	.	.	H	α-helix	trans	-66.6	-16.6	175.6	-69.7	-173.5	178.4	-178	0	114.4	D2 I4 R8 V112 N129 E147	D2-K116 IonicContact OD1-NZ 2.76Å; I4-K116 HydrophobicContact CB-CD 4.44Å; I4-K116 HydrophobicContact CG1-CD 4.24Å; I4-K116 HydrophobicContact CG2-CB 4Å; I4-K116 WeakPolarHBondContact CG2-O 3.34Å; R8-K116 PolarHBondContact NH2-O 2.86Å; V112-K116 HydrophobicContact CG1-CD 4.35Å; V112-K116 WeakPolarHBondContact O-CG 3.29Å; V112-K116 PolarHBondContact O-N 2.86Å; K116-N129 WeakPolarHBondContact CE-OD1 3.47Å; K116-N129 VanDerWaalsContact NZ-CG 3.28Å; K116-N129 PolarHBondContact NZ-ND2 3.32Å; K116-N129 VanDerWaalsContact NZ-ND2 3.19Å; K116-N129 PolarHBondContact NZ-OD1 2.9Å; K116-E147 VanDerWaalsContact CD-OE1 3.29Å; K116-E147 WeakPolarHBondContact CD-OE1 3.49Å; K116-E147 WeakPolarHBondContact CE-OE1 3.41Å; K116-E147 IonicContact NZ-OE1 3.17Å; K116-E147 PolarHBondContact NZ-OE1 3.26Å; K116-E147 IonicContact NZ-OE2 3.22Å; K116-E147 PolarHBondContact NZ-OE2 2.94Å; K116-E147 VanDerWaalsContact NZ-OE2 3.16Å
117	Y	89.2	Confident	86.4	Confident	64 Å²	64	30.6 Å²	30.6	25%	0.251	16%	0.161	S	C	.	.	H	α-helix	trans	-76.7	-45.7	170	171.9	-104.9	0	0	0	110.3	R8 T80 F84 V113 A114 S115 F158 V160	R8-Y117 PolarHBondContact NH2-O 2.83Å; R8-Y117 VanDerWaalsContact NH2-O 3.14Å; T80-Y117 HydrophobicContact CG2-CD1 3.95Å; T80-Y117 HydrophobicContact CG2-CE1 4.32Å; F84-Y117 HydrophobicContact CZ-CD1 4.07Å; F84-Y117 HydrophobicContact CZ-CG 4.05Å; V113-Y117 VanDerWaalsContact O-CB 3.29Å; V113-Y117 WeakPolarHBondContact O-CB 3.28Å; V113-Y117 PolarHBondContact O-N 3.21Å; A114-Y117 WeakPolarHBondContact O-CB 3.36Å; A114-Y117 PolarHBondContact O-N 3.03Å; S115-Y117 PolarHBondContact O-N 3.47Å; Y117-F158 HydrophobicContact CD2-CB 4.16Å; Y117-F158 HydrophobicContact CE2-CB 4.31Å; Y117-V160 PolarHBondContact OH-N 2.89Å
118	L	85.6	Confident	86	Confident	9 Å²	9	36.2 Å²	36.2	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-87	-35.2	-171.9	-64	171.8	0	0	0	115.1	I19 V76 A114 S115	I19-L118 HydrophobicContact CD1-CD2 3.76Å; I19-L118 HydrophobicContact CG1-CD2 4.1Å; I19-L118 HydrophobicContact CG2-CD2 4.39Å; V76-L118 HydrophobicContact CB-CD1 4.38Å; V76-L118 HydrophobicContact CG1-CD1 3.99Å; V76-L118 HydrophobicContact CG2-CD1 3.92Å; V76-L118 HydrophobicContact CG2-CD2 4.38Å; A114-L118 WeakPolarHBondContact O-CG 3.43Å; A114-L118 PolarHBondContact O-N 2.97Å; S115-L118 PolarHBondContact O-N 3.36Å; S115-L118 VanDerWaalsContact O-N 3.1Å
119	H	84.3	Confident	85.9	Confident	12 Å²	12	37.1 Å²	37.1	6%	0.056	19%	0.188	C	C	.	.			trans	-120.9	131.8	-165.4	-60.5	-68.7	0	0	0	112.2	R8 F23 S77 S115 H125	R8-H119 PolarHBondContact NH1-O 2.89Å; R8-H119 VanDerWaalsContact NH2-N 3.18Å; R8-H119 PolarHBondContact NH2-O 3.46Å; F23-H119 AromaticContact CZ-CE1 3.32Å; F23-H119 WeakPolarHBondContact CZ-CE1 3.34Å; F23-H119 AromaticContact CZ-NE2 3.91Å; S77-H119 PolarHBondContact OG-NE2 3.34Å; S115-H119 WeakPolarHBondContact O-CB 3.19Å; S115-H119 PolarHBondContact O-N 3.15Å; H119-H125 AromaticContact CE1-CD2 3.86Å
120	D	78.8	Confident	85.8	Confident	56 Å²	56	39.2 Å²	39.2	30%	0.299	21%	0.205	S	C	.	.			trans	-71.7	146.8	169.1	-67.2	-47.2	0	0	0	111	R8 D122 T123 G126	R8-D120 WeakPolarHBondContact CD-OD1 3.4Å; R8-D120 IonicContact CZ-OD1 2.72Å; R8-D120 IonicContact NE-OD1 2.74Å; R8-D120 PolarHBondContact NE-OD1 3.03Å; R8-D120 IonicContact NH1-OD1 3.1Å; R8-D120 PolarHBondContact NH1-OD1 3.3Å; R8-D120 IonicContact NH2-OD1 3.77Å; D120-D122 WeakPolarHBondContact CB-OD1 3.42Å; D120-D122 PolarHBondContact O-N 3.28Å; D120-D122 VanDerWaalsContact O-N 3.08Å; D120-T123 HydrophobicContact CB-CG2 3.93Å; D120-T123 WeakPolarHBondContact O-CB 3.43Å; D120-T123 PolarHBondContact O-N 2.95Å; D120-T123 PolarHBondContact O-OG1 3.03Å; D120-G126 WeakPolarHBondContact O-CA 3.22Å
121	D	74	Confident	85.6	Confident	22 Å²	22	43 Å²	43	12%	0.118	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-15.2	-177.7	-61.7	-33.6	0	0	0	112.2	Q5 Y128	Q5-D121 PolarHBondContact NE2-OD2 3.43Å; D121-Y128 HydrophobicContact CB-CE1 4.07Å
122	D	77.1	Confident	85.5	Confident	143 Å²	143	43 Å²	43	77%	0.765	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.3	6.8	175.3	66.9	-19.4	0	0	0	113.8	D120	D120-D122 WeakPolarHBondContact CB-OD1 3.42Å; D120-D122 PolarHBondContact O-N 3.28Å; D120-D122 VanDerWaalsContact O-N 3.08Å
123	T	77.8	Confident	85.5	Confident	55 Å²	55	43.1 Å²	43.1	34%	0.337	22%	0.223	S	C	.	.	S	Bend	trans	-98.3	160.6	175.9	66.3	0	0	0	0	112.2	D120 H125 G126	D120-T123 HydrophobicContact CB-CG2 3.93Å; D120-T123 WeakPolarHBondContact O-CB 3.43Å; D120-T123 PolarHBondContact O-N 2.95Å; D120-T123 PolarHBondContact O-OG1 3.03Å; T123-H125 PolarHBondContact O-N 2.77Å; T123-G126 PolarHBondContact O-N 2.84Å; T123-G126 PolarHBondContact OG1-N 3.5Å
124	D	75	Confident	85.4	Confident	164 Å²	164	49.3 Å²	49.3	88%	0.877	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-21.5	-177.4	-65.5	-24.5	0	0	0	114.4
125	H	77.3	Confident	85.2	Confident	63 Å²	63	51.5 Å²	51.5	29%	0.292	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-0.2	180	-54.6	-66.4	0	0	0	113.7	S72 P74 H119 T123	S72-H125 PolarHBondContact O-ND1 3.29Å; P74-H125 HydrophobicContact CG-CB 4.09Å; H119-H125 AromaticContact CE1-CD2 3.86Å; T123-H125 PolarHBondContact O-N 2.77Å
126	G	79.8	Confident	85.2	Confident	14 Å²	14	52 Å²	52	14%	0.144	27%	0.268	C	S	.	.			trans	-68.8	138	174.3	0	0	0	0	0	110.9	D120 T123	D120-G126 WeakPolarHBondContact O-CA 3.22Å; T123-G126 PolarHBondContact O-N 2.84Å; T123-G126 PolarHBondContact OG1-N 3.5Å
127	M	85	Confident	85.3	Confident	18 Å²	18	59.2 Å²	59.2	9%	0.089	31%	0.307	C	S	.	.			trans	-142.2	136.2	180	-80.2	178.7	57.9	0	0	110.8	R71 E131 W132	R71-M127 VanDerWaalsContact CZ-CE 3.44Å; R71-M127 PolarHBondContact NH1-SD 3.02Å; M127-E131 VanDerWaalsContact CA-OE2 3.27Å; M127-E131 WeakPolarHBondContact CA-OE2 3.39Å; M127-E131 HydrophobicContact CE-CB 3.78Å; M127-W132 HydrophobicContact CB-CG 4.49Å; M127-W132 HydrophobicContact CB-CZ2 4.36Å; M127-W132 VanDerWaalsContact CB-NE1 3.32Å; M127-W132 HydrophobicContact CE-CD2 3.64Å; M127-W132 HydrophobicContact CE-CE3 3.91Å; M127-W132 HydrophobicContact CE-CG 3.91Å; M127-W132 HydrophobicContact CE-CZ2 4.35Å; M127-W132 HydrophobicContact CE-CZ3 4.41Å; M127-W132 PolarHBondContact O-NE1 2.87Å; M127-W132 HydrophobicContact SD-CD2 4.33Å; M127-W132 HydrophobicContact SD-CH2 4.27Å; M127-W132 HydrophobicContact SD-CZ2 3.94Å
128	Y	88	Confident	85.5	Confident	121 Å²	121	57 Å²	57	48%	0.475	30%	0.299	S	S	.	.			trans	-76.7	157	176	-61.9	-81.1	0	0	0	111.2	D121 A130 E131 W132	D121-Y128 HydrophobicContact CB-CE1 4.07Å; Y128-A130 PolarHBondContact O-N 3.34Å; Y128-A130 VanDerWaalsContact O-N 3.15Å; Y128-E131 PolarHBondContact N-OE2 2.81Å; Y128-E131 WeakPolarHBondContact O-CB 3.44Å; Y128-E131 PolarHBondContact O-N 3.48Å; Y128-W132 PolarHBondContact O-N 3.26Å; Y128-W132 VanDerWaalsContact O-N 3.1Å
129	N	91.6	Very high	86	Confident	19 Å²	19	63.2 Å²	63.2	10%	0.102	33%	0.328	C	S	.	.	H	α-helix	trans	-58	-31.5	177.9	-76	1.4	0	0	0	113.4	K116 E131 W132 A133 L140 L143 N144 E147	K116-N129 WeakPolarHBondContact CE-OD1 3.47Å; K116-N129 VanDerWaalsContact NZ-CG 3.28Å; K116-N129 PolarHBondContact NZ-ND2 3.32Å; K116-N129 VanDerWaalsContact NZ-ND2 3.19Å; K116-N129 PolarHBondContact NZ-OD1 2.9Å; N129-E131 VanDerWaalsContact C-N 3.32Å; N129-E131 PolarHBondContact O-N 2.99Å; N129-W132 PolarHBondContact O-N 3.09Å; N129-A133 VanDerWaalsContact O-CB 3.23Å; N129-A133 WeakPolarHBondContact O-CB 3.38Å; N129-A133 PolarHBondContact O-N 3.25Å; N129-L140 HydrophobicContact CB-CD1 3.71Å; N129-L143 HydrophobicContact CB-CD2 4.39Å; N129-L143 VanDerWaalsContact O-CD2 3.3Å; N129-L143 WeakPolarHBondContact O-CD2 3.11Å; N129-N144 PolarHBondContact ND2-OD1 3.16Å; N129-E147 PolarHBondContact ND2-OE2 3.09Å
130	A	92.9	Very high	86.6	Confident	43 Å²	43	66.2 Å²	66.2	36%	0.355	34%	0.344	S	S	.	.	H	α-helix	trans	-61	-42.8	174.8	0	0	0	0	0	111.6	Y128 A133 D134 L140	Y128-A130 PolarHBondContact O-N 3.34Å; Y128-A130 VanDerWaalsContact O-N 3.15Å; A130-A133 PolarHBondContact O-N 3.23Å; A130-D134 VanDerWaalsContact O-CG 3.29Å; A130-D134 PolarHBondContact O-N 3Å; A130-L140 HydrophobicContact CB-CD2 4.26Å
131	E	90.6	Very high	87.5	Confident	79 Å²	79	70.1 Å²	70.1	37%	0.369	36%	0.359	S	S	.	.	H	α-helix	trans	-71.9	-35.6	-179.3	-57.4	172	143.4	0	0	111.7	M127 Y128 N129 E135	M127-E131 VanDerWaalsContact CA-OE2 3.27Å; M127-E131 WeakPolarHBondContact CA-OE2 3.39Å; M127-E131 HydrophobicContact CE-CB 3.78Å; Y128-E131 PolarHBondContact N-OE2 2.81Å; Y128-E131 WeakPolarHBondContact O-CB 3.44Å; Y128-E131 PolarHBondContact O-N 3.48Å; N129-E131 VanDerWaalsContact C-N 3.32Å; N129-E131 PolarHBondContact O-N 2.99Å; E131-E135 WeakPolarHBondContact O-CB 3.42Å; E131-E135 PolarHBondContact O-N 3.37Å
132	W	91.1	Very high	88.5	Confident	8 Å²	8	73.2 Å²	73.2	3%	0.03	37%	0.373	C	S	.	.	H	α-helix	trans	-67	-38.5	171.6	-77.9	115.7	0	0	0	112.7	M111 V112 M127 Y128 N129 E135 F136 L143	M111-W132 HydrophobicContact CB-CH2 4.24Å; M111-W132 HydrophobicContact CB-CZ3 4.2Å; M111-W132 HydrophobicContact CE-CH2 4.5Å; V112-W132 HydrophobicContact CB-CG 4.45Å; V112-W132 HydrophobicContact CG1-CG 4.5Å; V112-W132 HydrophobicContact CG2-CB 3.71Å; V112-W132 HydrophobicContact CG2-CD2 3.75Å; V112-W132 HydrophobicContact CG2-CE3 4.23Å; V112-W132 HydrophobicContact CG2-CG 3.54Å; M127-W132 HydrophobicContact CB-CG 4.49Å; M127-W132 HydrophobicContact CB-CZ2 4.36Å; M127-W132 VanDerWaalsContact CB-NE1 3.32Å; M127-W132 HydrophobicContact CE-CD2 3.64Å; M127-W132 HydrophobicContact CE-CE3 3.91Å; M127-W132 HydrophobicContact CE-CG 3.91Å; M127-W132 HydrophobicContact CE-CZ2 4.35Å; M127-W132 HydrophobicContact CE-CZ3 4.41Å; M127-W132 PolarHBondContact O-NE1 2.87Å; M127-W132 HydrophobicContact SD-CD2 4.33Å; M127-W132 HydrophobicContact SD-CH2 4.27Å; M127-W132 HydrophobicContact SD-CZ2 3.94Å; Y128-W132 PolarHBondContact O-N 3.26Å; Y128-W132 VanDerWaalsContact O-N 3.1Å; N129-W132 PolarHBondContact O-N 3.09Å; W132-E135 PolarHBondContact O-N 3.26Å; W132-F136 HydrophobicContact CE3-CD2 4.05Å; W132-F136 AromaticContact CE3-CE2 3.45Å; W132-F136 HydrophobicContact CE3-CE2 3.45Å; W132-F136 VanDerWaalsContact CE3-CE2 3.45Å; W132-F136 HydrophobicContact CE3-CZ 4.43Å; W132-F136 AromaticContact CZ3-CE2 3.69Å; W132-F136 HydrophobicContact CZ3-CE2 3.69Å; W132-F136 HydrophobicContact CZ3-CZ 4.25Å; W132-F136 WeakPolarHBondContact O-CD2 3.34Å; W132-F136 PolarHBondContact O-N 2.83Å; W132-F136 VanDerWaalsContact O-N 3.08Å; W132-L143 HydrophobicContact CB-CD2 3.64Å
133	A	93.1	Very high	89.5	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.008	34%	0.336	C	S	.	.	H	α-helix	trans	-65.3	-44.6	178	0	0	0	0	0	110.7	N129 A130 E135 F136 D137 M138 L140 L143	N129-A133 VanDerWaalsContact O-CB 3.23Å; N129-A133 WeakPolarHBondContact O-CB 3.38Å; N129-A133 PolarHBondContact O-N 3.25Å; A130-A133 PolarHBondContact O-N 3.23Å; A133-E135 VanDerWaalsContact C-N 3.32Å; A133-E135 PolarHBondContact O-N 3.34Å; A133-F136 PolarHBondContact O-N 3.37Å; A133-D137 PolarHBondContact O-N 3.16Å; A133-D137 VanDerWaalsContact O-N 3.16Å; A133-M138 CarbonylContact C-O 3.43Å; A133-M138 WeakPolarHBondContact CB-O 3.43Å; A133-M138 PolarHBondContact O-N 3.19Å; A133-L140 HydrophobicContact CB-CB 4.14Å; A133-L140 HydrophobicContact CB-CD1 4.28Å; A133-L143 HydrophobicContact CB-CB 4.33Å; A133-L143 HydrophobicContact CB-CD2 3.85Å
134	D	91.9	Very high	90.4	Very high	133 Å²	133	66.6 Å²	66.6	71%	0.711	34%	0.335	S	S	*	.	H	α-helix	trans	-61.7	-39.4	174.4	-68.5	-18.2	0	0	0	111.7	A130 D137	A130-D134 VanDerWaalsContact O-CG 3.29Å; A130-D134 PolarHBondContact O-N 3Å; D134-D137 PolarHBondContact O-N 3.47Å
135	E	87.7	Confident	91.4	Very high	45 Å²	45	63.3 Å²	63.3	21%	0.21	31%	0.314	C	S	.	.	H	α-helix	trans	-64.9	-41.1	179.4	-174.6	61.4	-160.4	0	0	113.2	Y67 S70 R71 E131 W132 A133 D137	Y67-E135 HydrophobicContact CD1-CG 4.2Å; Y67-E135 HydrophobicContact CE1-CG 4.08Å; S70-E135 PolarHBondContact OG-OE1 2.99Å; R71-E135 IonicContact CZ-OE2 2.72Å; R71-E135 IonicContact NE-OE1 2.6Å; R71-E135 IonicContact NE-OE2 3.15Å; R71-E135 PolarHBondContact NE-OE2 3.14Å; R71-E135 IonicContact NH2-OE2 3.93Å; R71-E135 PolarHBondContact NH2-OE2 3.28Å; E131-E135 WeakPolarHBondContact O-CB 3.42Å; E131-E135 PolarHBondContact O-N 3.37Å; W132-E135 PolarHBondContact O-N 3.26Å; A133-E135 VanDerWaalsContact C-N 3.32Å; A133-E135 PolarHBondContact O-N 3.34Å; E135-D137 VanDerWaalsContact C-N 3.33Å
136	F	89.6	Confident	92.3	Very high	16 Å²	16	60.9 Å²	60.9	7%	0.07	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	9.4	-179	-72.5	-70.3	0	0	0	113.6	Y67 F107 A108 M111 W132 A133 M138	Y67-F136 HydrophobicContact CD1-CD1 4.29Å; Y67-F136 AromaticContact CD1-CE1 3.77Å; Y67-F136 HydrophobicContact CD1-CE1 3.77Å; Y67-F136 HydrophobicContact CD1-CZ 4.27Å; Y67-F136 AromaticContact CD2-CE1 3.87Å; Y67-F136 HydrophobicContact CD2-CE1 3.87Å; Y67-F136 AromaticContact CE1-CD1 3.56Å; Y67-F136 HydrophobicContact CE1-CD1 3.56Å; Y67-F136 AromaticContact CE1-CE1 3.5Å; Y67-F136 HydrophobicContact CE1-CE1 3.5Å; Y67-F136 HydrophobicContact CE1-CG 4.38Å; Y67-F136 HydrophobicContact CE1-CZ 4.31Å; Y67-F136 AromaticContact CE2-CD1 3.87Å; Y67-F136 HydrophobicContact CE2-CD1 3.87Å; Y67-F136 AromaticContact CE2-CE1 3.62Å; Y67-F136 HydrophobicContact CE2-CE1 3.62Å; Y67-F136 AromaticContact CG-CE1 3.97Å; Y67-F136 HydrophobicContact CG-CE1 3.97Å; Y67-F136 AromaticContact CZ-CD1 3.32Å; Y67-F136 AromaticContact CZ-CE1 3.44Å; Y67-F136 VanDerWaalsContact CZ-CE1 3.44Å; Y67-F136 WeakPolarHBondContact OH-CD1 3.36Å; F107-F136 HydrophobicContact CD1-CE1 4.3Å; A108-F136 VanDerWaalsContact CA-CZ 3.5Å; A108-F136 HydrophobicContact CB-CB 4.1Å; A108-F136 HydrophobicContact CB-CD1 3.5Å; A108-F136 HydrophobicContact CB-CD2 3.48Å; A108-F136 VanDerWaalsContact CB-CD2 3.48Å; A108-F136 HydrophobicContact CB-CE1 3.72Å; A108-F136 HydrophobicContact CB-CE2 3.65Å; A108-F136 HydrophobicContact CB-CG 3.42Å; A108-F136 VanDerWaalsContact CB-CG 3.42Å; A108-F136 HydrophobicContact CB-CZ 3.8Å; M111-F136 HydrophobicContact CB-CZ 4.42Å; W132-F136 HydrophobicContact CE3-CD2 4.05Å; W132-F136 AromaticContact CE3-CE2 3.45Å; W132-F136 HydrophobicContact CE3-CE2 3.45Å; W132-F136 VanDerWaalsContact CE3-CE2 3.45Å; W132-F136 HydrophobicContact CE3-CZ 4.43Å; W132-F136 AromaticContact CZ3-CE2 3.69Å; W132-F136 HydrophobicContact CZ3-CE2 3.69Å; W132-F136 HydrophobicContact CZ3-CZ 4.25Å; W132-F136 WeakPolarHBondContact O-CD2 3.34Å; W132-F136 PolarHBondContact O-N 2.83Å; W132-F136 VanDerWaalsContact O-N 3.08Å; A133-F136 PolarHBondContact O-N 3.37Å; F136-M138 HydrophobicContact CB-CB 4.5Å; F136-M138 PolarHBondContact O-N 3.06Å
137	D	91.8	Very high	93.1	Very high	159 Å²	159	60.9 Å²	60.9	85%	0.85	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	45.9	-174.9	-166.4	34.4	0	0	0	112.1	A133 D134 E135	A133-D137 PolarHBondContact O-N 3.16Å; A133-D137 VanDerWaalsContact O-N 3.16Å; D134-D137 PolarHBondContact O-N 3.47Å; E135-D137 VanDerWaalsContact C-N 3.33Å
138	M	93.1	Very high	93.6	Very high	17 Å²	17	64.4 Å²	64.4	8%	0.084	32%	0.322	C	S	.	.			trans	-118	146.4	-175.1	-175.1	178.6	-71.9	0	0	110.6	D105 A133 F136 L140 E142 L143 L146	D105-M138 HydrophobicContact CB-CE 4.06Å; D105-M138 WeakPolarHBondContact OD1-CE 3.16Å; A133-M138 CarbonylContact C-O 3.43Å; A133-M138 WeakPolarHBondContact CB-O 3.43Å; A133-M138 PolarHBondContact O-N 3.19Å; F136-M138 HydrophobicContact CB-CB 4.5Å; F136-M138 PolarHBondContact O-N 3.06Å; M138-L140 PolarHBondContact O-N 3.32Å; M138-E142 HydrophobicContact CG-CB 3.99Å; M138-E142 HydrophobicContact CG-CG 4Å; M138-E142 HydrophobicContact SD-CB 4.36Å; M138-E142 HydrophobicContact SD-CG 3.99Å; M138-L143 HydrophobicContact CG-CB 4.35Å; M138-L143 VanDerWaalsContact SD-CA 3.57Å; M138-L143 HydrophobicContact SD-CB 3.7Å; M138-L143 HydrophobicContact SD-CD1 3.72Å; M138-L143 HydrophobicContact SD-CG 4.34Å; M138-L146 HydrophobicContact CE-CD1 3.67Å; M138-L146 HydrophobicContact SD-CD1 3.7Å
139	E	96.6	Very high	93.9	Very high	139 Å²	139	63.4 Å²	63.4	65%	0.65	32%	0.32	S	S	*	.			trans	-64.2	130.5	171.2	-68	-172.6	-176.8	0	0	110.2	K141 E142 L143	E139-K141 PolarHBondContact O-N 2.85Å; E139-E142 HydrophobicContact CB-CB 4.13Å; E139-E142 WeakPolarHBondContact O-CA 3.14Å; E139-E142 WeakPolarHBondContact O-CB 3.25Å; E139-E142 PolarHBondContact O-N 3.03Å; E139-L143 PolarHBondContact O-N 3.04Å
140	L	96.6	Very high	94.1	Very high	76 Å²	76	62.5 Å²	62.5	40%	0.398	32%	0.315	S	S	.	.	H	α-helix	trans	-51	-36.8	177.9	174.6	57.5	0	0	0	112.9	N129 A130 A133 M138 L143 N144	N129-L140 HydrophobicContact CB-CD1 3.71Å; A130-L140 HydrophobicContact CB-CD2 4.26Å; A133-L140 HydrophobicContact CB-CB 4.14Å; A133-L140 HydrophobicContact CB-CD1 4.28Å; M138-L140 PolarHBondContact O-N 3.32Å; L140-L143 PolarHBondContact O-N 2.76Å; L140-N144 WeakPolarHBondContact O-CB 3.47Å; L140-N144 PolarHBondContact O-N 3.04Å; L140-N144 PolarHBondContact O-ND2 3.34Å
141	K	96.7	Very high	94.2	Very high	138 Å²	138	60.9 Å²	60.9	60%	0.6	30%	0.3	S	S	*	.	H	α-helix	trans	-63.8	-44.2	176.3	-174	-174.4	171.4	-160.3	0	111.7	E139 N144 E145	E139-K141 PolarHBondContact O-N 2.85Å; K141-N144 PolarHBondContact O-N 3.47Å; K141-E145 WeakPolarHBondContact CE-OE1 3.42Å; K141-E145 IonicContact NZ-OE1 2.96Å; K141-E145 WeakPolarHBondContact O-CG 3.11Å; K141-E145 PolarHBondContact O-N 2.72Å; K141-E145 VanDerWaalsContact O-N 3.08Å
142	E	96.2	Very high	94.4	Very high	87 Å²	87	60.3 Å²	60.3	41%	0.407	31%	0.305	S	S	.	.	H	α-helix	trans	-63.3	-45.2	177.2	-179.5	173.8	-163.5	0	0	111.1	M138 E139 N144 E145 L146	M138-E142 HydrophobicContact CG-CB 3.99Å; M138-E142 HydrophobicContact CG-CG 4Å; M138-E142 HydrophobicContact SD-CB 4.36Å; M138-E142 HydrophobicContact SD-CG 3.99Å; E139-E142 HydrophobicContact CB-CB 4.13Å; E139-E142 WeakPolarHBondContact O-CA 3.14Å; E139-E142 WeakPolarHBondContact O-CB 3.25Å; E139-E142 PolarHBondContact O-N 3.03Å; E142-N144 PolarHBondContact O-N 3.49Å; E142-E145 PolarHBondContact O-N 2.77Å; E142-L146 HydrophobicContact CG-CD1 4.23Å; E142-L146 WeakPolarHBondContact O-CG 3.47Å; E142-L146 PolarHBondContact O-N 3.06Å
143	L	96.4	Very high	94.5	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.3	-44.9	177.9	-173.9	68.3	0	0	0	111.9	V112 N129 W132 A133 M138 E139 L140 E145 L146 E147	V112-L143 HydrophobicContact CG2-CD1 4.08Å; V112-L143 HydrophobicContact CG2-CD2 4.23Å; N129-L143 HydrophobicContact CB-CD2 4.39Å; N129-L143 VanDerWaalsContact O-CD2 3.3Å; N129-L143 WeakPolarHBondContact O-CD2 3.11Å; W132-L143 HydrophobicContact CB-CD2 3.64Å; A133-L143 HydrophobicContact CB-CB 4.33Å; A133-L143 HydrophobicContact CB-CD2 3.85Å; M138-L143 HydrophobicContact CG-CB 4.35Å; M138-L143 VanDerWaalsContact SD-CA 3.57Å; M138-L143 HydrophobicContact SD-CB 3.7Å; M138-L143 HydrophobicContact SD-CD1 3.72Å; M138-L143 HydrophobicContact SD-CG 4.34Å; E139-L143 PolarHBondContact O-N 3.04Å; L140-L143 PolarHBondContact O-N 2.76Å; L143-E145 VanDerWaalsContact C-N 3.33Å; L143-E145 PolarHBondContact O-N 2.97Å; L143-L146 PolarHBondContact O-N 3.38Å; L143-E147 WeakPolarHBondContact O-CB 3.47Å; L143-E147 PolarHBondContact O-N 3.48Å
144	N	96.7	Very high	94.5	Very high	59 Å²	59	61.7 Å²	61.7	32%	0.316	32%	0.317	S	S	.	.	H	α-helix	trans	-61.7	-40.8	177.4	-71.2	-30.8	0	0	0	112	N129 L140 K141 E142 V148	N129-N144 PolarHBondContact ND2-OD1 3.16Å; L140-N144 WeakPolarHBondContact O-CB 3.47Å; L140-N144 PolarHBondContact O-N 3.04Å; L140-N144 PolarHBondContact O-ND2 3.34Å; K141-N144 PolarHBondContact O-N 3.47Å; E142-N144 PolarHBondContact O-N 3.49Å; N144-V148 WeakPolarHBondContact O-CG2 3.39Å; N144-V148 PolarHBondContact O-N 2.99Å
145	E	96.5	Very high	94.5	Very high	94 Å²	94	60.6 Å²	60.6	44%	0.439	31%	0.311	S	S	.	.	H	α-helix	trans	-66.3	-40.2	176.2	-73.5	179.9	-166.5	0	0	111.7	K141 E142 L143 K149	K141-E145 WeakPolarHBondContact CE-OE1 3.42Å; K141-E145 IonicContact NZ-OE1 2.96Å; K141-E145 WeakPolarHBondContact O-CG 3.11Å; K141-E145 PolarHBondContact O-N 2.72Å; K141-E145 VanDerWaalsContact O-N 3.08Å; E142-E145 PolarHBondContact O-N 2.77Å; L143-E145 VanDerWaalsContact C-N 3.33Å; L143-E145 PolarHBondContact O-N 2.97Å; E145-K149 VanDerWaalsContact O-CG 3.28Å; E145-K149 WeakPolarHBondContact O-CG 3.46Å; E145-K149 PolarHBondContact O-N 3.31Å; E145-K149 VanDerWaalsContact O-N 3.12Å
146	L	96.4	Very high	94.6	Very high	12 Å²	12	63.8 Å²	63.8	6%	0.063	32%	0.321	C	S	.	.	H	α-helix	trans	-64.6	-43.9	175.4	-76.3	174.4	0	0	0	111.9	V101 D105 V109 M138 E142 L143 V148 K149 F150	V101-L146 HydrophobicContact CG1-CD2 4.09Å; V101-L146 HydrophobicContact CG2-CD2 3.66Å; D105-L146 HydrophobicContact CB-CD1 4.04Å; V109-L146 HydrophobicContact CB-CB 4.31Å; V109-L146 HydrophobicContact CG2-CB 4.01Å; M138-L146 HydrophobicContact CE-CD1 3.67Å; M138-L146 HydrophobicContact SD-CD1 3.7Å; E142-L146 HydrophobicContact CG-CD1 4.23Å; E142-L146 WeakPolarHBondContact O-CG 3.47Å; E142-L146 PolarHBondContact O-N 3.06Å; L143-L146 PolarHBondContact O-N 3.38Å; L146-V148 PolarHBondContact O-N 2.69Å; L146-K149 PolarHBondContact O-N 3.23Å; L146-F150 WeakPolarHBondContact O-CB 3.38Å; L146-F150 PolarHBondContact O-N 3.46Å
147	E	95.8	Very high	94.5	Very high	15 Å²	15	68.9 Å²	68.9	7%	0.07	35%	0.345	C	S	.	.	H	α-helix	trans	-55.7	-50.4	178.5	-176	-177.5	-167.3	0	0	110.9	V109 V113 K116 N129 L143 K149 F150 I151	V109-E147 VanDerWaalsContact CG2-CA 3.45Å; V109-E147 HydrophobicContact CG2-CB 4.27Å; V113-E147 HydrophobicContact CG2-CG 3.95Å; K116-E147 VanDerWaalsContact CD-OE1 3.29Å; K116-E147 WeakPolarHBondContact CD-OE1 3.49Å; K116-E147 WeakPolarHBondContact CE-OE1 3.41Å; K116-E147 IonicContact NZ-OE1 3.17Å; K116-E147 PolarHBondContact NZ-OE1 3.26Å; K116-E147 IonicContact NZ-OE2 3.22Å; K116-E147 PolarHBondContact NZ-OE2 2.94Å; K116-E147 VanDerWaalsContact NZ-OE2 3.16Å; N129-E147 PolarHBondContact ND2-OE2 3.09Å; L143-E147 WeakPolarHBondContact O-CB 3.47Å; L143-E147 PolarHBondContact O-N 3.48Å; E147-K149 VanDerWaalsContact C-N 3.35Å; E147-K149 PolarHBondContact O-N 2.85Å; E147-F150 PolarHBondContact O-N 3.31Å; E147-I151 HydrophobicContact CG-CD1 3.81Å; E147-I151 WeakPolarHBondContact O-CB 3.45Å; E147-I151 WeakPolarHBondContact O-CG1 3.26Å; E147-I151 PolarHBondContact O-N 3.11Å
148	V	95.5	Very high	94.2	Very high	91 Å²	91	62.3 Å²	62.3	55%	0.552	31%	0.309	S	S	*	.	H	α-helix	trans	-61.1	-43	177.9	174.5	0	0	0	0	111.4	N144 L146 S152	N144-V148 WeakPolarHBondContact O-CG2 3.39Å; N144-V148 PolarHBondContact O-N 2.99Å; L146-V148 PolarHBondContact O-N 2.69Å; V148-S152 VanDerWaalsContact O-CB 3.27Å; V148-S152 WeakPolarHBondContact O-CB 3.46Å; V148-S152 PolarHBondContact O-N 2.92Å; V148-S152 PolarHBondContact O-OG 3.28Å
149	K	95.4	Very high	93.9	Very high	100 Å²	100	68.6 Å²	68.6	44%	0.435	34%	0.336	S	S	.	.	H	α-helix	trans	-65.1	-41.9	178	-71.7	173.4	-177.7	174.9	0	111.9	L97 E145 L146 E147 S152 A153	L97-K149 HydrophobicContact CD1-CB 3.79Å; E145-K149 VanDerWaalsContact O-CG 3.28Å; E145-K149 WeakPolarHBondContact O-CG 3.46Å; E145-K149 PolarHBondContact O-N 3.31Å; E145-K149 VanDerWaalsContact O-N 3.12Å; L146-K149 PolarHBondContact O-N 3.23Å; E147-K149 VanDerWaalsContact C-N 3.35Å; E147-K149 PolarHBondContact O-N 2.85Å; K149-S152 PolarHBondContact O-N 2.89Å; K149-A153 VanDerWaalsContact O-CB 3.29Å; K149-A153 WeakPolarHBondContact O-CB 3.04Å; K149-A153 PolarHBondContact O-N 3.45Å
150	F	96.1	Very high	93.3	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-64.9	-47.2	179.5	-173.9	-91	0	0	0	111.5	F84 L88 L97 L106 V109 V113 L146 E147 S152 A153 L154	F84-F150 HydrophobicContact CB-CE1 4.11Å; F84-F150 HydrophobicContact CB-CZ 3.94Å; F84-F150 HydrophobicContact CD2-CE1 4.42Å; L88-F150 HydrophobicContact CD2-CD2 4.43Å; L88-F150 HydrophobicContact CD2-CE2 4.2Å; L97-F150 HydrophobicContact CD2-CB 4Å; L97-F150 HydrophobicContact CD2-CD2 3.61Å; L97-F150 HydrophobicContact CD2-CG 4.2Å; L106-F150 HydrophobicContact CD1-CD2 4.07Å; L106-F150 HydrophobicContact CD1-CE2 3.81Å; V109-F150 HydrophobicContact CG1-CB 3.99Å; V109-F150 HydrophobicContact CG1-CD2 3.54Å; V109-F150 HydrophobicContact CG1-CE2 4.2Å; V109-F150 HydrophobicContact CG1-CG 3.85Å; V109-F150 HydrophobicContact CG2-CB 3.73Å; V109-F150 HydrophobicContact CG2-CG 4.18Å; V113-F150 HydrophobicContact CB-CD1 4.23Å; V113-F150 HydrophobicContact CB-CE1 4.29Å; V113-F150 HydrophobicContact CG1-CD1 4.36Å; V113-F150 HydrophobicContact CG1-CE1 4.36Å; V113-F150 HydrophobicContact CG2-CD1 3.9Å; V113-F150 HydrophobicContact CG2-CE1 4.45Å; L146-F150 WeakPolarHBondContact O-CB 3.38Å; L146-F150 PolarHBondContact O-N 3.46Å; E147-F150 PolarHBondContact O-N 3.31Å; F150-S152 VanDerWaalsContact C-N 3.32Å; F150-S152 PolarHBondContact O-N 3.19Å; F150-A153 PolarHBondContact O-N 2.97Å; F150-L154 HydrophobicContact CD1-CD1 3.81Å; F150-L154 HydrophobicContact CE1-CD1 3.29Å; F150-L154 HydrophobicContact CE1-CG 4.44Å; F150-L154 HydrophobicContact CZ-CD1 3.81Å; F150-L154 PolarHBondContact O-N 2.99Å
151	I	94.5	Very high	92.6	Very high	9 Å²	9	61.2 Å²	61.2	5%	0.046	30%	0.304	C	S	.	.	H	α-helix	trans	-58.9	-45.1	175.3	-74.5	169.2	0	0	0	111.2	I4 V113 E147 L154 N155 W156 F158	I4-I151 HydrophobicContact CD1-CD1 3.86Å; I4-I151 HydrophobicContact CG1-CD1 4.36Å; V113-I151 HydrophobicContact CG1-CG1 4.23Å; V113-I151 HydrophobicContact CG2-CD1 4.26Å; V113-I151 HydrophobicContact CG2-CG1 4Å; E147-I151 HydrophobicContact CG-CD1 3.81Å; E147-I151 WeakPolarHBondContact O-CB 3.45Å; E147-I151 WeakPolarHBondContact O-CG1 3.26Å; E147-I151 PolarHBondContact O-N 3.11Å; I151-L154 PolarHBondContact O-N 3.26Å; I151-N155 PolarHBondContact O-N 3.16Å; I151-W156 HydrophobicContact CG2-CD2 3.63Å; I151-W156 HydrophobicContact CG2-CE3 3.61Å; I151-W156 HydrophobicContact CG2-CG 4.41Å; I151-W156 HydrophobicContact CG2-CH2 3.53Å; I151-W156 HydrophobicContact CG2-CZ2 3.57Å; I151-W156 HydrophobicContact CG2-CZ3 3.53Å; I151-W156 PolarHBondContact O-N 2.91Å; I151-F158 HydrophobicContact CB-CE1 4.47Å; I151-F158 HydrophobicContact CB-CZ 3.77Å; I151-F158 HydrophobicContact CG1-CE1 4.15Å; I151-F158 HydrophobicContact CG1-CE2 4.48Å; I151-F158 HydrophobicContact CG1-CZ 3.69Å; I151-F158 HydrophobicContact CG2-CE2 4.08Å; I151-F158 HydrophobicContact CG2-CZ 3.62Å
152	S	94	Very high	91.7	Very high	67 Å²	67	57.6 Å²	57.6	47%	0.469	29%	0.286	S	S	.	.	H	α-helix	trans	-64.9	-39.8	178.4	-59.2	0	0	0	0	112	V148 K149 F150 L154 N155	V148-S152 VanDerWaalsContact O-CB 3.27Å; V148-S152 WeakPolarHBondContact O-CB 3.46Å; V148-S152 PolarHBondContact O-N 2.92Å; V148-S152 PolarHBondContact O-OG 3.28Å; K149-S152 PolarHBondContact O-N 2.89Å; F150-S152 VanDerWaalsContact C-N 3.32Å; F150-S152 PolarHBondContact O-N 3.19Å; S152-L154 VanDerWaalsContact C-N 3.29Å; S152-L154 PolarHBondContact O-N 2.9Å; S152-N155 PolarHBondContact O-N 2.87Å
153	A	94.3	Very high	91	Very high	27 Å²	27	56.7 Å²	56.7	22%	0.223	29%	0.294	C	S	.	.	H	α-helix	trans	-67.2	-30.4	178.6	0	0	0	0	0	112.6	L88 L97 K149 F150 N155	L88-A153 HydrophobicContact CD1-CB 3.74Å; L97-A153 HydrophobicContact CB-CB 4.41Å; L97-A153 HydrophobicContact CD2-CB 4Å; K149-A153 VanDerWaalsContact O-CB 3.29Å; K149-A153 WeakPolarHBondContact O-CB 3.04Å; K149-A153 PolarHBondContact O-N 3.45Å; F150-A153 PolarHBondContact O-N 2.97Å; A153-N155 PolarHBondContact O-N 3.3Å
154	L	92.1	Very high	90.5	Very high	11 Å²	11	60.7 Å²	60.7	6%	0.058	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-0.2	171.5	-79.8	169.4	0	0	0	113.8	F84 K87 L88 F150 I151 S152 W156 E157 F158	F84-L154 HydrophobicContact CB-CD1 4.08Å; F84-L154 HydrophobicContact CG-CD1 4.38Å; K87-L154 HydrophobicContact CB-CD2 4.01Å; L88-L154 HydrophobicContact CB-CD2 3.83Å; L88-L154 HydrophobicContact CB-CG 4.39Å; F150-L154 HydrophobicContact CD1-CD1 3.81Å; F150-L154 HydrophobicContact CE1-CD1 3.29Å; F150-L154 HydrophobicContact CE1-CG 4.44Å; F150-L154 HydrophobicContact CZ-CD1 3.81Å; F150-L154 PolarHBondContact O-N 2.99Å; I151-L154 PolarHBondContact O-N 3.26Å; S152-L154 VanDerWaalsContact C-N 3.29Å; S152-L154 PolarHBondContact O-N 2.9Å; L154-W156 PolarHBondContact O-N 3.25Å; L154-W156 VanDerWaalsContact O-N 3.12Å; L154-E157 WeakPolarHBondContact O-CB 3.22Å; L154-E157 PolarHBondContact O-N 3.14Å; L154-F158 HydrophobicContact CB-CD1 4.48Å; L154-F158 HydrophobicContact CB-CE1 3.79Å; L154-F158 HydrophobicContact CB-CZ 4.34Å; L154-F158 HydrophobicContact CD1-CD1 3.91Å; L154-F158 HydrophobicContact CD1-CE1 3.56Å; L154-F158 HydrophobicContact CG-CE1 4.33Å
155	N	92.2	Very high	89.8	Confident	110 Å²	110	58 Å²	58	59%	0.588	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	32.9	-176.7	-168.8	48.3	0	0	0	113	I151 S152 A153 E157	I151-N155 PolarHBondContact O-N 3.16Å; S152-N155 PolarHBondContact O-N 2.87Å; A153-N155 PolarHBondContact O-N 3.3Å; N155-E157 PolarHBondContact O-N 3.15Å
156	W	89.7	Confident	89.1	Confident	112 Å²	112	55.7 Å²	55.7	42%	0.424	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	16.3	-175.3	-55.7	80.8	0	0	0	115.9	F3 L7 I151 L154 F158	F3-W156 AromaticContact CD1-CH2 3.64Å; F3-W156 HydrophobicContact CD1-CH2 3.64Å; F3-W156 HydrophobicContact CD1-CZ2 4.49Å; F3-W156 HydrophobicContact CD1-CZ3 4.34Å; F3-W156 HydrophobicContact CE1-CH2 4.1Å; L7-W156 HydrophobicContact CD1-CE3 3.6Å; L7-W156 HydrophobicContact CD1-CH2 4.42Å; L7-W156 HydrophobicContact CD1-CZ3 3.31Å; I151-W156 HydrophobicContact CG2-CD2 3.63Å; I151-W156 HydrophobicContact CG2-CE3 3.61Å; I151-W156 HydrophobicContact CG2-CG 4.41Å; I151-W156 HydrophobicContact CG2-CH2 3.53Å; I151-W156 HydrophobicContact CG2-CZ2 3.57Å; I151-W156 HydrophobicContact CG2-CZ3 3.53Å; I151-W156 PolarHBondContact O-N 2.91Å; L154-W156 PolarHBondContact O-N 3.25Å; L154-W156 VanDerWaalsContact O-N 3.12Å; W156-F158 VanDerWaalsContact C-N 3.34Å; W156-F158 HydrophobicContact CB-CE2 4.04Å; W156-F158 HydrophobicContact CD2-CE2 4.35Å; W156-F158 AromaticContact CE3-CE2 3.88Å; W156-F158 HydrophobicContact CE3-CE2 3.88Å; W156-F158 HydrophobicContact CG-CE2 4.46Å; W156-F158 WeakPolarHBondContact O-CD2 3.43Å; W156-F158 PolarHBondContact O-N 2.94Å; W156-F158 VanDerWaalsContact O-N 3.1Å
157	E	87.5	Confident	88.5	Confident	124 Å²	124	59.6 Å²	59.6	58%	0.579	31%	0.307	S	S	*	.			trans	-88.6	58.5	-176.7	-62.6	-173.7	-176.5	0	0	113.7	K87 L154 N155	K87-E157 PolarHBondContact NZ-O 3.23Å; L154-E157 WeakPolarHBondContact O-CB 3.22Å; L154-E157 PolarHBondContact O-N 3.14Å; N155-E157 PolarHBondContact O-N 3.15Å
158	F	85.9	Confident	88	Confident	21 Å²	21	59.3 Å²	59.3	9%	0.092	31%	0.305	C	S	.	.			trans	-81.3	-11.3	-177.6	-48.5	-67.1	0	0	0	114.6	F84 V113 Y117 I151 L154 W156 V160	F84-F158 HydrophobicContact CE1-CB 4.09Å; F84-F158 WeakPolarHBondContact CE1-O 3.28Å; F84-F158 HydrophobicContact CE2-CD1 4.24Å; F84-F158 HydrophobicContact CZ-CB 3.81Å; F84-F158 HydrophobicContact CZ-CD1 4.23Å; F84-F158 HydrophobicContact CZ-CG 4.46Å; V113-F158 HydrophobicContact CG1-CD1 4.08Å; V113-F158 HydrophobicContact CG1-CE1 4Å; Y117-F158 HydrophobicContact CD2-CB 4.16Å; Y117-F158 HydrophobicContact CE2-CB 4.31Å; I151-F158 HydrophobicContact CB-CE1 4.47Å; I151-F158 HydrophobicContact CB-CZ 3.77Å; I151-F158 HydrophobicContact CG1-CE1 4.15Å; I151-F158 HydrophobicContact CG1-CE2 4.48Å; I151-F158 HydrophobicContact CG1-CZ 3.69Å; I151-F158 HydrophobicContact CG2-CE2 4.08Å; I151-F158 HydrophobicContact CG2-CZ 3.62Å; L154-F158 HydrophobicContact CB-CD1 4.48Å; L154-F158 HydrophobicContact CB-CE1 3.79Å; L154-F158 HydrophobicContact CB-CZ 4.34Å; L154-F158 HydrophobicContact CD1-CD1 3.91Å; L154-F158 HydrophobicContact CD1-CE1 3.56Å; L154-F158 HydrophobicContact CG-CE1 4.33Å; W156-F158 VanDerWaalsContact C-N 3.34Å; W156-F158 HydrophobicContact CB-CE2 4.04Å; W156-F158 HydrophobicContact CD2-CE2 4.35Å; W156-F158 AromaticContact CE3-CE2 3.88Å; W156-F158 HydrophobicContact CE3-CE2 3.88Å; W156-F158 HydrophobicContact CG-CE2 4.46Å; W156-F158 WeakPolarHBondContact O-CD2 3.43Å; W156-F158 PolarHBondContact O-N 2.94Å; W156-F158 VanDerWaalsContact O-N 3.1Å; F158-V160 WeakPolarHBondContact O-CG2 3.45Å; F158-V160 PolarHBondContact O-N 2.92Å; F158-V160 VanDerWaalsContact O-N 3.11Å
159	F	87.1	Confident	87.4	Confident	148 Å²	148	55 Å²	55	65%	0.649	28%	0.279	S	S	*	.			trans	-60.7	121.3	-174.4	179.9	-103.8	0	0	0	111.7	K87 T161	K87-F159 PolarHBondContact NZ-O 3.36Å; F159-T161 HydrophobicContact CD1-CG2 4.4Å; F159-T161 HydrophobicContact CE1-CG2 3.46Å; F159-T161 VanDerWaalsContact CE1-CG2 3.46Å; F159-T161 HydrophobicContact CZ-CG2 3.88Å
160	V	83.7	Confident	86.8	Confident	10 Å²	10	53.7 Å²	53.7	6%	0.061	28%	0.276	C	S	.	.			trans	-128.8	128	179.5	170.2	0	0	0	0	108.8	L83 F84 Y117 F158 Q164 I165	L83-V160 HydrophobicContact CD2-CB 4.08Å; L83-V160 HydrophobicContact CD2-CG1 3.28Å; L83-V160 HydrophobicContact CD2-CG2 3.55Å; L83-V160 HydrophobicContact CG-CG2 4.41Å; F84-V160 HydrophobicContact CD1-CG2 4.22Å; F84-V160 HydrophobicContact CE1-CG2 3.69Å; Y117-V160 PolarHBondContact OH-N 2.89Å; F158-V160 WeakPolarHBondContact O-CG2 3.45Å; F158-V160 PolarHBondContact O-N 2.92Å; F158-V160 VanDerWaalsContact O-N 3.11Å; V160-Q164 HydrophobicContact CG1-CB 4.22Å; V160-I165 HydrophobicContact CG1-CD1 3.57Å; V160-I165 HydrophobicContact CG1-CG1 3.39Å
161	T	82.8	Confident	86.2	Confident	50 Å²	50	58.1 Å²	58.1	31%	0.307	30%	0.297	S	S	.	.			trans	-82.9	156.8	176.1	64.4	0	0	0	0	111.5	F159 A163 Q164 I165	F159-T161 HydrophobicContact CD1-CG2 4.4Å; F159-T161 HydrophobicContact CE1-CG2 3.46Å; F159-T161 VanDerWaalsContact CE1-CG2 3.46Å; F159-T161 HydrophobicContact CZ-CG2 3.88Å; T161-A163 VanDerWaalsContact C-N 3.28Å; T161-A163 PolarHBondContact O-N 3.23Å; T161-Q164 WeakPolarHBondContact O-CB 3.49Å; T161-Q164 PolarHBondContact O-N 3.49Å; T161-Q164 VanDerWaalsContact O-N 3.15Å; T161-Q164 VanDerWaalsContact OG1-CG 3.25Å; T161-Q164 WeakPolarHBondContact OG1-CG 3.46Å; T161-Q164 PolarHBondContact OG1-N 3.36Å; T161-Q164 PolarHBondContact OG1-OE1 3.13Å; T161-I165 PolarHBondContact O-N 3.22Å; T161-I165 VanDerWaalsContact O-N 3.16Å
162	R	77.5	Confident	85.5	Confident	62 Å²	62	58.6 Å²	58.6	23%	0.234	30%	0.299	C	S	.	.	H	α-helix	trans	-52.6	-47	170.4	177	177.1	-43.2	165.4	13.4	112.6	P17 S18 E21 I22 Q164 I165 L166	P17-R162 PolarHBondContact O-NH2 2.86Å; S18-R162 VanDerWaalsContact CA-NH2 3.25Å; S18-R162 PolarHBondContact O-NE 3.48Å; E21-R162 IonicContact OE1-NH2 3.81Å; E21-R162 PolarHBondContact OE1-NH2 3.02Å; E21-R162 VanDerWaalsContact OE1-NH2 3.15Å; E21-R162 IonicContact OE2-CZ 3.16Å; E21-R162 IonicContact OE2-NH1 3.06Å; E21-R162 PolarHBondContact OE2-NH1 3.1Å; E21-R162 IonicContact OE2-NH2 2.77Å; E21-R162 PolarHBondContact OE2-NH2 3.34Å; I22-R162 HydrophobicContact CD1-CB 3.82Å; I22-R162 HydrophobicContact CD1-CG 3.85Å; I22-R162 HydrophobicContact CG1-CB 4.05Å; I22-R162 HydrophobicContact CG1-CG 3.51Å; R162-Q164 PolarHBondContact O-N 3.42Å; R162-I165 PolarHBondContact O-N 3.05Å; R162-I165 VanDerWaalsContact O-N 3.14Å; R162-L166 HydrophobicContact CG-CD1 3.75Å; R162-L166 HydrophobicContact CG-CG 4.1Å; R162-L166 WeakPolarHBondContact O-CG 3.23Å; R162-L166 PolarHBondContact O-N 3.24Å
163	A	81.4	Confident	84.7	Confident	69 Å²	69	57 Å²	57	57%	0.57	29%	0.294	S	S	*	.	H	α-helix	trans	-58.2	-39.4	-178.9	0	0	0	0	0	111.5	T161 Q167	T161-A163 VanDerWaalsContact C-N 3.28Å; T161-A163 PolarHBondContact O-N 3.23Å; A163-Q167 WeakPolarHBondContact O-CB 3.27Å; A163-Q167 PolarHBondContact O-N 3.03Å
164	Q	84.9	Confident	83.8	Confident	83 Å²	83	56.5 Å²	56.5	39%	0.388	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-44.2	175.7	-73.8	166.1	-46.3	0	0	112.2	L83 V160 T161 R162 F168	L83-Q164 HydrophobicContact CD2-CB 4.13Å; V160-Q164 HydrophobicContact CG1-CB 4.22Å; T161-Q164 WeakPolarHBondContact O-CB 3.49Å; T161-Q164 PolarHBondContact O-N 3.49Å; T161-Q164 VanDerWaalsContact O-N 3.15Å; T161-Q164 VanDerWaalsContact OG1-CG 3.25Å; T161-Q164 WeakPolarHBondContact OG1-CG 3.46Å; T161-Q164 PolarHBondContact OG1-N 3.36Å; T161-Q164 PolarHBondContact OG1-OE1 3.13Å; R162-Q164 PolarHBondContact O-N 3.42Å; Q164-F168 WeakPolarHBondContact O-CB 3.5Å; Q164-F168 PolarHBondContact O-N 2.97Å
165	I	82.7	Confident	82.8	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-64.3	-44.3	178.1	-70.3	163.9	0	0	0	111.2	I22 V76 L79 V160 T161 R162 F168 G169	I22-I165 HydrophobicContact CD1-CB 4.45Å; I22-I165 HydrophobicContact CD1-CD1 3.82Å; I22-I165 HydrophobicContact CG2-CG2 4.06Å; V76-I165 HydrophobicContact CG2-CD1 4.23Å; L79-I165 HydrophobicContact CB-CG2 4.1Å; L79-I165 HydrophobicContact CD1-CG2 3.88Å; V160-I165 HydrophobicContact CG1-CD1 3.57Å; V160-I165 HydrophobicContact CG1-CG1 3.39Å; T161-I165 PolarHBondContact O-N 3.22Å; T161-I165 VanDerWaalsContact O-N 3.16Å; R162-I165 PolarHBondContact O-N 3.05Å; R162-I165 VanDerWaalsContact O-N 3.14Å; I165-F168 PolarHBondContact O-N 3.39Å; I165-G169 PolarHBondContact O-N 3.31Å
166	L	81.2	Confident	81.4	Confident	46 Å²	46	61.5 Å²	61.5	24%	0.241	30%	0.298	C	S	.	.	H	α-helix	trans	-64.6	-46.9	178.7	-68.7	177.8	0	0	0	111.8	V25 R162 G169 L170 F175	V25-L166 HydrophobicContact CB-CD2 4.43Å; V25-L166 HydrophobicContact CG1-CD2 3.73Å; R162-L166 HydrophobicContact CG-CD1 3.75Å; R162-L166 HydrophobicContact CG-CG 4.1Å; R162-L166 WeakPolarHBondContact O-CG 3.23Å; R162-L166 PolarHBondContact O-N 3.24Å; L166-G169 PolarHBondContact O-N 3.13Å; L166-L170 WeakPolarHBondContact O-CG 3.44Å; L166-L170 PolarHBondContact O-N 2.8Å; L166-F175 HydrophobicContact CD2-CE1 4.37Å; L166-F175 HydrophobicContact CD2-CE2 3.91Å; L166-F175 HydrophobicContact CD2-CZ 3.76Å
167	Q	83.9	Confident	79.6	Confident	94 Å²	94	63.7 Å²	63.7	44%	0.439	31%	0.313	S	S	.	.	H	α-helix	trans	-58.8	-49.3	176.3	-179.1	66.6	29	0	0	110.6	A163 G169 L170 E171	A163-Q167 WeakPolarHBondContact O-CB 3.27Å; A163-Q167 PolarHBondContact O-N 3.03Å; Q167-G169 PolarHBondContact O-N 2.81Å; Q167-L170 WeakPolarHBondContact O-CB 2.95Å; Q167-L170 PolarHBondContact O-N 2.69Å; Q167-E171 WeakPolarHBondContact CG-OE1 3.49Å; Q167-E171 PolarHBondContact NE2-OE1 3.45Å; Q167-E171 WeakPolarHBondContact O-CG 3.42Å; Q167-E171 PolarHBondContact O-N 3.41Å
168	F	86.3	Confident	77.4	Confident	8 Å²	8	63 Å²	63	4%	0.035	31%	0.314	C	S	.	.	H	α-helix	trans	-63.4	-44.1	-179.7	-176.5	-102.8	0	0	0	111.9	M47 L79 L82 L83 E86 Q164 I165 L170 E171 I172	M47-F168 HydrophobicContact CE-CE2 3.95Å; M47-F168 HydrophobicContact CE-CZ 3.6Å; M47-F168 HydrophobicContact SD-CE2 4.28Å; M47-F168 HydrophobicContact SD-CZ 3.66Å; L79-F168 HydrophobicContact CD2-CD1 4.1Å; L79-F168 HydrophobicContact CD2-CE1 4.41Å; L82-F168 HydrophobicContact CB-CE1 3.53Å; L82-F168 HydrophobicContact CB-CZ 3.77Å; L82-F168 HydrophobicContact CD1-CE1 4.29Å; L83-F168 HydrophobicContact CB-CD1 4.48Å; L83-F168 HydrophobicContact CD1-CB 4.15Å; L83-F168 HydrophobicContact CD1-CD2 3.92Å; L83-F168 HydrophobicContact CD1-CG 3.95Å; E86-F168 WeakPolarHBondContact OE2-CD2 3.47Å; E86-F168 WeakPolarHBondContact OE2-CE2 3.34Å; Q164-F168 WeakPolarHBondContact O-CB 3.5Å; Q164-F168 PolarHBondContact O-N 2.97Å; I165-F168 PolarHBondContact O-N 3.39Å; F168-L170 VanDerWaalsContact C-N 3.28Å; F168-L170 PolarHBondContact O-N 2.98Å; F168-E171 WeakPolarHBondContact O-CB 3.23Å; F168-E171 PolarHBondContact O-N 3.39Å; F168-E171 VanDerWaalsContact O-N 3.1Å; F168-I172 HydrophobicContact CD1-CD1 4.44Å; F168-I172 HydrophobicContact CE1-CD1 3.92Å; F168-I172 HydrophobicContact CE1-CG1 4.42Å; F168-I172 HydrophobicContact CE1-CG2 3.98Å; F168-I172 HydrophobicContact CE2-CG2 3.97Å; F168-I172 HydrophobicContact CZ-CG2 3.64Å; F168-I172 WeakPolarHBondContact O-CG1 3.3Å; F168-I172 PolarHBondContact O-N 3.06Å
169	G	82.8	Confident	74.9	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-32.3	176.2	0	0	0	0	0	113.5	I165 L166 Q167 G173 V174 F175	I165-G169 PolarHBondContact O-N 3.31Å; L166-G169 PolarHBondContact O-N 3.13Å; Q167-G169 PolarHBondContact O-N 2.81Å; G169-G173 PolarHBondContact O-N 3.42Å; G169-G173 VanDerWaalsContact O-N 3.13Å; G169-V174 PolarHBondContact O-N 3.41Å; G169-F175 VanDerWaalsContact C-CD2 3.42Å; G169-F175 PolarHBondContact O-N 3.46Å
170	L	82.8	Confident	72.2	Confident	73 Å²	73	69.3 Å²	69.3	38%	0.382	35%	0.352	S	S	.	.	H	α-helix	trans	-69.4	-41.2	172.4	-75.8	165.1	0	0	0	111	L166 Q167 F168 G173 F175 Q177	L166-L170 WeakPolarHBondContact O-CG 3.44Å; L166-L170 PolarHBondContact O-N 2.8Å; Q167-L170 WeakPolarHBondContact O-CB 2.95Å; Q167-L170 PolarHBondContact O-N 2.69Å; F168-L170 VanDerWaalsContact C-N 3.28Å; F168-L170 PolarHBondContact O-N 2.98Å; L170-G173 PolarHBondContact O-N 3.09Å; L170-F175 HydrophobicContact CD2-CB 3.65Å; L170-F175 HydrophobicContact CG-CB 4.01Å; L170-F175 HydrophobicContact CG-CD2 4.28Å; L170-Q177 HydrophobicContact CD2-CG 4.07Å
171	E	82.7	Confident	69.5	Low	93 Å²	93	75.1 Å²	75.1	44%	0.435	39%	0.392	S	S	.	.	H	α-helix	trans	-65.1	-42.1	-180	-73.6	173.7	-168.4	0	0	112.7	Q167 F168 G173	Q167-E171 WeakPolarHBondContact CG-OE1 3.49Å; Q167-E171 PolarHBondContact NE2-OE1 3.45Å; Q167-E171 WeakPolarHBondContact O-CG 3.42Å; Q167-E171 PolarHBondContact O-N 3.41Å; F168-E171 WeakPolarHBondContact O-CB 3.23Å; F168-E171 PolarHBondContact O-N 3.39Å; F168-E171 VanDerWaalsContact O-N 3.1Å; E171-G173 VanDerWaalsContact C-N 3.27Å
172	I	80.1	Confident	66.9	Low	19 Å²	19	79.1 Å²	79.1	10%	0.097	41%	0.411	C	S	.	.	H	α-helix	trans	-82.3	-6.3	175.8	69.7	164.1	0	0	0	113.1	R43 L79 L82 F168 V174	R43-I172 WeakPolarHBondContact CD-O 3.29Å; L79-I172 HydrophobicContact CD2-CD1 3.58Å; L79-I172 HydrophobicContact CD2-CG1 4.22Å; L82-I172 HydrophobicContact CD1-CD1 3.87Å; F168-I172 HydrophobicContact CD1-CD1 4.44Å; F168-I172 HydrophobicContact CE1-CD1 3.92Å; F168-I172 HydrophobicContact CE1-CG1 4.42Å; F168-I172 HydrophobicContact CE1-CG2 3.98Å; F168-I172 HydrophobicContact CE2-CG2 3.97Å; F168-I172 HydrophobicContact CZ-CG2 3.64Å; F168-I172 WeakPolarHBondContact O-CG1 3.3Å; F168-I172 PolarHBondContact O-N 3.06Å; I172-V174 HydrophobicContact CD1-CG2 3.63Å; I172-V174 HydrophobicContact CG1-CB 4.42Å; I172-V174 HydrophobicContact CG1-CG2 3.83Å
173	G	76.5	Confident	64.8	Low	34 Å²	34	79.8 Å²	79.8	35%	0.351	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	21.5	174.5	0	0	0	0	0	115.2	G169 L170 E171	G169-G173 PolarHBondContact O-N 3.42Å; G169-G173 VanDerWaalsContact O-N 3.13Å; L170-G173 PolarHBondContact O-N 3.09Å; E171-G173 VanDerWaalsContact C-N 3.27Å
174	V	75.4	Confident	62.6	Low	17 Å²	17	85.5 Å²	85.5	10%	0.103	44%	0.438	C	S	.	.			trans	-68.8	-46.2	169.6	168.4	0	0	0	0	109.8	L26 F35 V40 L79 G169 I172	L26-V174 HydrophobicContact CD2-CG1 4.49Å; F35-V174 HydrophobicContact CE1-CG2 4.07Å; V40-V174 HydrophobicContact CG1-CG2 3.65Å; L79-V174 HydrophobicContact CD1-CG1 4.46Å; L79-V174 HydrophobicContact CD2-CB 4.35Å; L79-V174 HydrophobicContact CD2-CG2 4.06Å; G169-V174 PolarHBondContact O-N 3.41Å; I172-V174 HydrophobicContact CD1-CG2 3.63Å; I172-V174 HydrophobicContact CG1-CB 4.42Å; I172-V174 HydrophobicContact CG1-CG2 3.83Å
175	F	71.6	Confident	60.3	Low	15 Å²	15	86.6 Å²	86.6	7%	0.066	45%	0.454	C	S	.	.	S	Bend	trans	-84.1	127.6	176.3	-61.8	-62.4	0	0	0	110.8	V25 L26 L79 L166 G169 L170	V25-F175 HydrophobicContact CG1-CE1 4.17Å; L26-F175 HydrophobicContact CD2-CD1 4.3Å; L26-F175 HydrophobicContact CD2-CE1 3.23Å; L26-F175 HydrophobicContact CD2-CZ 3.36Å; L26-F175 HydrophobicContact CG-CE1 3.89Å; L26-F175 HydrophobicContact CG-CZ 3.97Å; L79-F175 HydrophobicContact CD1-CE2 3.98Å; L79-F175 HydrophobicContact CD1-CZ 3.94Å; L166-F175 HydrophobicContact CD2-CE1 4.37Å; L166-F175 HydrophobicContact CD2-CE2 3.91Å; L166-F175 HydrophobicContact CD2-CZ 3.76Å; G169-F175 VanDerWaalsContact C-CD2 3.42Å; G169-F175 PolarHBondContact O-N 3.46Å; L170-F175 HydrophobicContact CD2-CB 3.65Å; L170-F175 HydrophobicContact CG-CB 4.01Å; L170-F175 HydrophobicContact CG-CD2 4.28Å
176	R	61.9	Low	58.3	Low	211 Å²	211	92.9 Å²	92.9	80%	0.796	49%	0.488	S	S	*	.			trans	-72.7	127.6	166.5	-159.9	176.1	-160.2	150.5	4.5	107.9	N178	R176-N178 PolarHBondContact O-N 3.37Å
177	Q	53.4	Low	56.2	Low	157 Å²	157	98.8 Å²	98.8	73%	0.734	51%	0.512	S	S	*	.			trans	-61.1	104.3	164.5	-77.5	-177.5	-1.2	0	0	107.7	L170 T179	L170-Q177 HydrophobicContact CD2-CG 4.07Å; Q177-T179 PolarHBondContact O-N 3.43Å
178	N	41	Very low	54.3	Low	111 Å²	111	99.5 Å²	99.5	59%	0.594	52%	0.524	S	S	*	.			trans	-67.8	102.4	169.2	-81	-21.6	0	0	0	107.5	N29 R176 K180	N29-N178 PolarHBondContact OD1-ND2 3.27Å; R176-N178 PolarHBondContact O-N 3.37Å; N178-K180 PolarHBondContact O-N 3.48Å
179	T	32.2	Very low	52.2	Low	136 Å²	136	108.3 Å²	108.3	83%	0.834	57%	0.566	S	S	*	*			trans	-73	24	173.1	48.8	0	0	0	0	113.1	Q177	Q177-T179 PolarHBondContact O-N 3.43Å
180	K	30.4	Very low	50.6	Low	165 Å²	165	114.5 Å²	114.5	72%	0.717	59%	0.593	S	S	*	*			trans	-111.7	91.2	170.9	-78.4	-173.4	174.6	-173.9	0	109.8	N178 D182	N178-K180 PolarHBondContact O-N 3.48Å; K180-D182 PolarHBondContact O-N 3.34Å
181	C	28.5	Very low	49.3	Very low	131 Å²	131	115.2 Å²	115.2	89%	0.885	60%	0.597	S	S	*	*			trans	-70.1	77.7	157.9	-70.3	0	0	0	0	108.4
182	D	28.4	Very low	48	Very low	134 Å²	134	111.9 Å²	111.9	72%	0.717	58%	0.583	S	S	*	*			trans	-113	49.5	174.6	-76.5	-29.6	0	0	0	110.4	K180	K180-D182 PolarHBondContact O-N 3.34Å
183	S	33.3	Very low	46.9	Very low	76 Å²	76	120 Å²	120	53%	0.531	61%	0.614	S	S	.	*			trans	-168.4	134.6	145	99.3	0	0	0	0	110	S185	S183-S185 PolarHBondContact O-N 3.45Å; S183-S185 VanDerWaalsContact O-N 3.13Å
184	F	34.6	Very low	46	Very low	190 Å²	190	121.1 Å²	121.1	83%	0.833	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	14.9	-174.2	-168.2	-102.6	0	0	0	113.7
185	S	36.6	Very low	45.4	Very low	105 Å²	105	124.4 Å²	124.4	73%	0.734	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.9	-13.3	-170.7	-65.8	0	0	0	0	115.7	S183	S183-S185 PolarHBondContact O-N 3.45Å; S183-S185 VanDerWaalsContact O-N 3.13Å
186	D	40	Very low	45.1	Very low	135 Å²	135	126.2 Å²	126.2	72%	0.722	64%	0.642	S	S	*	*			trans	-118.3	71.6	177.9	-64.6	-39.1	0	0	0	109.9	P188	D186-P188 WeakPolarHBondContact O-CD 3.44Å
187	K	38.8	Very low	45.3	Very low	170 Å²	170	118.8 Å²	118.8	74%	0.739	62%	0.622	S	S	*	*			trans	-70.5	120.8	164.8	-77.6	-176.2	-179.7	177.4	0	106.9	E189	K187-E189 PolarHBondContact O-N 3.37Å; K187-E189 VanDerWaalsContact O-N 3.08Å
188	P	42.7	Very low	45.9	Very low	109 Å²	109	116 Å²	116	71%	0.708	61%	0.608	S	S	*	*			trans	-56.1	123.6	161.3	24.8	-30	0	0	0	105.3	D186 F190	D186-P188 WeakPolarHBondContact O-CD 3.44Å; P188-F190 PolarHBondContact O-N 3.17Å
189	E	43.2	Very low	47.2	Very low	194 Å²	194	112.9 Å²	112.9	91%	0.907	59%	0.592	S	S	*	*			trans	-59.3	91.3	164.4	-75.6	-171.9	167	0	0	105.8	K187 N191	K187-E189 PolarHBondContact O-N 3.37Å; K187-E189 VanDerWaalsContact O-N 3.08Å; E189-N191 PolarHBondContact O-N 3.27Å
190	F	49.2	Very low	48.9	Very low	129 Å²	129	109.4 Å²	109.4	57%	0.566	57%	0.573	S	S	*	*			trans	-66.7	94.3	176.6	-163.7	-93.6	0	0	0	104.8	P188 V192 M195	P188-F190 PolarHBondContact O-N 3.17Å; F190-V192 VanDerWaalsContact C-N 3.28Å; F190-V192 PolarHBondContact O-N 3.18Å; F190-M195 HydrophobicContact CE1-SD 3.82Å; F190-M195 HydrophobicContact CZ-SD 4.26Å
191	N	54.7	Low	50.7	Low	89 Å²	89	106.9 Å²	106.9	48%	0.476	56%	0.564	S	S	.	*			trans	-72.3	91.9	-173.6	-171.3	-20	0	0	0	107.9	E189 Y193 S194 M195	E189-N191 PolarHBondContact O-N 3.27Å; N191-Y193 PolarHBondContact O-N 2.73Å; N191-Y193 WeakPolarHBondContact OD1-CA 3.34Å; N191-Y193 WeakPolarHBondContact OD1-CB 3.38Å; N191-Y193 VanDerWaalsContact OD1-CD2 3.32Å; N191-Y193 WeakPolarHBondContact OD1-CD2 3.41Å; N191-Y193 PolarHBondContact OD1-N 3.04Å; N191-S194 PolarHBondContact O-N 3.05Å; N191-S194 PolarHBondContact O-OG 2.74Å; N191-S194 PolarHBondContact OD1-N 3.03Å; N191-M195 PolarHBondContact O-N 3.19Å
192	V	55	Low	52.6	Low	23 Å²	23	106.3 Å²	106.3	14%	0.139	55%	0.551	C	S	.	*	H	α-helix	trans	-48.9	-32.7	176.4	175.3	0	0	0	0	110.5	F190 M195 L196 Y229 L230	F190-V192 VanDerWaalsContact C-N 3.28Å; F190-V192 PolarHBondContact O-N 3.18Å; V192-M195 PolarHBondContact O-N 3.24Å; V192-L196 HydrophobicContact CG1-CD1 3.7Å; V192-L196 HydrophobicContact CG1-CG 4.06Å; V192-L196 VanDerWaalsContact O-CB 3.28Å; V192-L196 WeakPolarHBondContact O-CB 3.35Å; V192-L196 WeakPolarHBondContact O-CG 3.23Å; V192-L196 PolarHBondContact O-N 3.27Å; V192-Y229 HydrophobicContact CG2-CE1 4.24Å; V192-L230 HydrophobicContact CG1-CD2 3.77Å
193	Y	56.5	Low	54.4	Low	190 Å²	190	104 Å²	104	75%	0.745	53%	0.534	S	S	*	.	H	α-helix	trans	-67.4	-34.3	176.7	-56.3	-81.9	0	0	0	113.6	N191 S197	N191-Y193 PolarHBondContact O-N 2.73Å; N191-Y193 WeakPolarHBondContact OD1-CA 3.34Å; N191-Y193 WeakPolarHBondContact OD1-CB 3.38Å; N191-Y193 VanDerWaalsContact OD1-CD2 3.32Å; N191-Y193 WeakPolarHBondContact OD1-CD2 3.41Å; N191-Y193 PolarHBondContact OD1-N 3.04Å; Y193-S197 VanDerWaalsContact O-CB 3.25Å; Y193-S197 WeakPolarHBondContact O-CB 3.47Å; Y193-S197 PolarHBondContact O-N 3.36Å
194	S	57.9	Low	56	Low	56 Å²	56	105.5 Å²	105.5	39%	0.392	54%	0.536	S	S	.	.	H	α-helix	trans	-70.1	-44.7	176.1	93.4	0	0	0	0	110.6	N191 L196 S197 H198	N191-S194 PolarHBondContact O-N 3.05Å; N191-S194 PolarHBondContact O-OG 2.74Å; N191-S194 PolarHBondContact OD1-N 3.03Å; S194-L196 PolarHBondContact O-N 3.09Å; S194-S197 WeakPolarHBondContact O-CB 3.27Å; S194-S197 PolarHBondContact O-N 3.31Å; S194-S197 VanDerWaalsContact O-N 3.14Å; S194-H198 PolarHBondContact O-CD2 3.36Å; S194-H198 PolarHBondContact O-N 3.22Å
195	M	62.4	Low	57.5	Low	87 Å²	87	104.2 Å²	104.2	43%	0.429	53%	0.53	S	S	.	.	H	α-helix	trans	-61	-46.4	176.3	-171.3	-166.4	-177.4	0	0	111.1	F190 N191 V192 S197 H198 I199	F190-M195 HydrophobicContact CE1-SD 3.82Å; F190-M195 HydrophobicContact CZ-SD 4.26Å; N191-M195 PolarHBondContact O-N 3.19Å; V192-M195 PolarHBondContact O-N 3.24Å; M195-S197 VanDerWaalsContact C-N 3.29Å; M195-S197 PolarHBondContact O-N 3.49Å; M195-H198 PolarHBondContact O-N 3.21Å; M195-I199 HydrophobicContact CE-CD1 3.98Å; M195-I199 HydrophobicContact CG-CD1 3.94Å; M195-I199 WeakPolarHBondContact O-CB 3.42Å; M195-I199 VanDerWaalsContact O-CG1 3.27Å; M195-I199 WeakPolarHBondContact O-CG1 3.38Å; M195-I199 PolarHBondContact O-N 2.87Å; M195-I199 HydrophobicContact SD-CD1 4.44Å
196	L	65.8	Low	58.6	Low	53 Å²	53	106.4 Å²	106.4	28%	0.277	52%	0.523	S	S	.	.	H	α-helix	trans	-62.5	-36.4	175.7	-71.9	175.5	0	0	0	112	V192 S194 S200 V226 L230	V192-L196 HydrophobicContact CG1-CD1 3.7Å; V192-L196 HydrophobicContact CG1-CG 4.06Å; V192-L196 VanDerWaalsContact O-CB 3.28Å; V192-L196 WeakPolarHBondContact O-CB 3.35Å; V192-L196 WeakPolarHBondContact O-CG 3.23Å; V192-L196 PolarHBondContact O-N 3.27Å; S194-L196 PolarHBondContact O-N 3.09Å; L196-S200 WeakPolarHBondContact O-CB 3.33Å; L196-S200 PolarHBondContact O-N 2.92Å; L196-V226 HydrophobicContact CD2-CG1 3.57Å; L196-V226 HydrophobicContact CD2-CG2 4.39Å; L196-L230 HydrophobicContact CD1-CD2 4.46Å
197	S	67.5	Low	59.7	Low	54 Å²	54	102.2 Å²	102.2	38%	0.378	51%	0.505	S	S	.	.	H	α-helix	trans	-63.5	-47.7	174.1	-176.9	0	0	0	0	111.4	Y193 S194 M195 I199 S200 Q201	Y193-S197 VanDerWaalsContact O-CB 3.25Å; Y193-S197 WeakPolarHBondContact O-CB 3.47Å; Y193-S197 PolarHBondContact O-N 3.36Å; S194-S197 WeakPolarHBondContact O-CB 3.27Å; S194-S197 PolarHBondContact O-N 3.31Å; S194-S197 VanDerWaalsContact O-N 3.14Å; M195-S197 VanDerWaalsContact C-N 3.29Å; M195-S197 PolarHBondContact O-N 3.49Å; S197-I199 PolarHBondContact O-N 3.44Å; S197-S200 WeakPolarHBondContact O-CB 3.1Å; S197-S200 PolarHBondContact O-N 3Å; S197-Q201 WeakPolarHBondContact O-CB 2.95Å; S197-Q201 VanDerWaalsContact O-CG 3.31Å; S197-Q201 WeakPolarHBondContact O-CG 3.3Å; S197-Q201 PolarHBondContact O-N 3.14Å
198	H	65.2	Low	60.7	Low	98 Å²	98	105 Å²	105	45%	0.454	51%	0.511	S	S	.	.	H	α-helix	trans	-62.8	-43.1	176.8	-76.9	-74.9	0	0	0	112.2	S194 M195 S200 Q201 L202	S194-H198 PolarHBondContact O-CD2 3.36Å; S194-H198 PolarHBondContact O-N 3.22Å; M195-H198 PolarHBondContact O-N 3.21Å; H198-S200 VanDerWaalsContact C-N 3.35Å; H198-S200 PolarHBondContact O-N 2.71Å; H198-Q201 PolarHBondContact O-N 3.44Å; H198-L202 WeakPolarHBondContact O-CB 3.22Å; H198-L202 VanDerWaalsContact O-CG 3.29Å; H198-L202 WeakPolarHBondContact O-CG 3.38Å; H198-L202 PolarHBondContact O-N 3.08Å
199	I	67.6	Low	61.6	Low	47 Å²	47	107.7 Å²	107.7	24%	0.241	51%	0.514	C	S	.	.	H	α-helix	trans	-63	-43.3	175.8	-67.4	169.1	0	0	0	110.5	M195 S197 L202 F203 L222	M195-I199 HydrophobicContact CE-CD1 3.98Å; M195-I199 HydrophobicContact CG-CD1 3.94Å; M195-I199 WeakPolarHBondContact O-CB 3.42Å; M195-I199 VanDerWaalsContact O-CG1 3.27Å; M195-I199 WeakPolarHBondContact O-CG1 3.38Å; M195-I199 PolarHBondContact O-N 2.87Å; M195-I199 HydrophobicContact SD-CD1 4.44Å; S197-I199 PolarHBondContact O-N 3.44Å; I199-L202 PolarHBondContact O-N 2.89Å; I199-F203 VanDerWaalsContact O-CB 3.26Å; I199-F203 WeakPolarHBondContact O-CB 3.39Å; I199-F203 PolarHBondContact O-N 3.16Å; I199-L222 HydrophobicContact CG2-CD2 3.65Å
200	S	68	Low	62.4	Low	62 Å²	62	107.4 Å²	107.4	43%	0.434	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-45.1	176.1	177.1	0	0	0	0	111.7	L196 S197 H198 F203 L204	L196-S200 WeakPolarHBondContact O-CB 3.33Å; L196-S200 PolarHBondContact O-N 2.92Å; S197-S200 WeakPolarHBondContact O-CB 3.1Å; S197-S200 PolarHBondContact O-N 3Å; H198-S200 VanDerWaalsContact C-N 3.35Å; H198-S200 PolarHBondContact O-N 2.71Å; S200-F203 WeakPolarHBondContact O-CB 3.33Å; S200-F203 PolarHBondContact O-N 2.96Å; S200-L204 WeakPolarHBondContact O-CB 3.24Å; S200-L204 WeakPolarHBondContact O-CG 3.41Å; S200-L204 PolarHBondContact O-N 3.27Å
201	Q	68.3	Low	62.8	Low	113 Å²	113	108.3 Å²	108.3	53%	0.528	52%	0.52	S	S	.	.	H	α-helix	trans	-65	-43.6	177.7	-72.8	-178.3	23	0	0	112.1	S197 H198 F203 L204 K205	S197-Q201 WeakPolarHBondContact O-CB 2.95Å; S197-Q201 VanDerWaalsContact O-CG 3.31Å; S197-Q201 WeakPolarHBondContact O-CG 3.3Å; S197-Q201 PolarHBondContact O-N 3.14Å; H198-Q201 PolarHBondContact O-N 3.44Å; Q201-F203 VanDerWaalsContact C-N 3.29Å; Q201-F203 PolarHBondContact O-N 3.04Å; Q201-L204 PolarHBondContact O-N 3.34Å; Q201-K205 VanDerWaalsContact O-CB 3.27Å; Q201-K205 WeakPolarHBondContact O-CB 3.33Å; Q201-K205 PolarHBondContact O-N 2.85Å
202	L	67.9	Low	63.6	Low	118 Å²	118	106.1 Å²	106.1	62%	0.618	51%	0.512	S	S	*	.	H	α-helix	trans	-60	-42.6	173.4	-74.4	170.2	0	0	0	110.8	H198 I199 K205 Y206	H198-L202 WeakPolarHBondContact O-CB 3.22Å; H198-L202 VanDerWaalsContact O-CG 3.29Å; H198-L202 WeakPolarHBondContact O-CG 3.38Å; H198-L202 PolarHBondContact O-N 3.08Å; I199-L202 PolarHBondContact O-N 2.89Å; L202-K205 PolarHBondContact O-N 3.38Å; L202-Y206 WeakPolarHBondContact O-CB 3.4Å; L202-Y206 PolarHBondContact O-N 3.41Å
203	F	66.8	Low	64.4	Low	85 Å²	85	109.4 Å²	109.4	37%	0.373	53%	0.534	S	S	.	.	H	α-helix	trans	-65.9	-43.3	178.1	-167.7	-97.9	0	0	0	112.4	I199 S200 Q201 Y206 S207 S219	I199-F203 VanDerWaalsContact O-CB 3.26Å; I199-F203 WeakPolarHBondContact O-CB 3.39Å; I199-F203 PolarHBondContact O-N 3.16Å; S200-F203 WeakPolarHBondContact O-CB 3.33Å; S200-F203 PolarHBondContact O-N 2.96Å; Q201-F203 VanDerWaalsContact C-N 3.29Å; Q201-F203 PolarHBondContact O-N 3.04Å; F203-Y206 PolarHBondContact O-N 3.42Å; F203-S207 WeakPolarHBondContact O-CB 3.42Å; F203-S207 PolarHBondContact O-N 2.7Å; F203-S207 PolarHBondContact O-OG 2.88Å; F203-S219 VanDerWaalsContact CZ-CB 3.44Å
204	L	66.5	Low	65	Low	108 Å²	108	105.1 Å²	105.1	57%	0.565	52%	0.521	S	S	*	.	H	α-helix	trans	-64.4	-43.2	175.5	-74.1	171.3	0	0	0	111.3	S200 Q201 Y206 S207 R208	S200-L204 WeakPolarHBondContact O-CB 3.24Å; S200-L204 WeakPolarHBondContact O-CG 3.41Å; S200-L204 PolarHBondContact O-N 3.27Å; Q201-L204 PolarHBondContact O-N 3.34Å; L204-Y206 VanDerWaalsContact C-N 3.34Å; L204-Y206 PolarHBondContact O-N 3.45Å; L204-S207 PolarHBondContact O-OG 3.05Å; L204-R208 WeakPolarHBondContact O-CB 3.34Å; L204-R208 PolarHBondContact O-N 3.47Å
205	K	66.2	Low	65.4	Low	164 Å²	164	103.7 Å²	103.7	71%	0.713	51%	0.508	S	S	*	.	H	α-helix	trans	-64.4	-39.3	177.6	-165.6	173.8	-175.4	175.4	0	111.7	Q201 L202	Q201-K205 VanDerWaalsContact O-CB 3.27Å; Q201-K205 WeakPolarHBondContact O-CB 3.33Å; Q201-K205 PolarHBondContact O-N 2.85Å; L202-K205 PolarHBondContact O-N 3.38Å
206	Y	60.8	Low	65.7	Low	150 Å²	150	106.7 Å²	106.7	59%	0.588	52%	0.519	S	S	*	.	H	α-helix	trans	-79.8	-40.3	-178.1	-160.9	-97.1	0	0	0	113	L202 F203 L204 R208 H209 I215	L202-Y206 WeakPolarHBondContact O-CB 3.4Å; L202-Y206 PolarHBondContact O-N 3.41Å; F203-Y206 PolarHBondContact O-N 3.42Å; L204-Y206 VanDerWaalsContact C-N 3.34Å; L204-Y206 PolarHBondContact O-N 3.45Å; Y206-R208 VanDerWaalsContact C-N 3.33Å; Y206-R208 PolarHBondContact O-N 3.35Å; Y206-H209 PolarHBondContact O-N 3.4Å; Y206-I215 HydrophobicContact CD1-CD1 4.27Å; Y206-I215 HydrophobicContact CD1-CG2 4.21Å; Y206-I215 HydrophobicContact CE1-CD1 3.67Å; Y206-I215 HydrophobicContact CE1-CG1 3.92Å; Y206-I215 HydrophobicContact CE1-CG2 4.25Å
207	S	63.4	Low	66.1	Low	48 Å²	48	111.6 Å²	111.6	34%	0.336	53%	0.534	S	S	.	.	H	α-helix	trans	-68	-29.5	178.7	59.7	0	0	0	0	113.2	F203 L204 H209	F203-S207 WeakPolarHBondContact O-CB 3.42Å; F203-S207 PolarHBondContact O-N 2.7Å; F203-S207 PolarHBondContact O-OG 2.88Å; L204-S207 PolarHBondContact O-OG 3.05Å; S207-H209 PolarHBondContact O-N 2.92Å
208	R	60.2	Low	66.4	Low	227 Å²	227	113.3 Å²	113.3	86%	0.857	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-16.2	178.8	-148.9	170.6	-171.8	156	0.5	113.6	L204 Y206	L204-R208 WeakPolarHBondContact O-CB 3.34Å; L204-R208 PolarHBondContact O-N 3.47Å; Y206-R208 VanDerWaalsContact C-N 3.33Å; Y206-R208 PolarHBondContact O-N 3.35Å
209	H	59.7	Low	66.7	Low	167 Å²	167	110.2 Å²	110.2	77%	0.773	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-6	-173	-102.7	-62.5	0	0	0	116	Y206 S207	Y206-H209 PolarHBondContact O-N 3.4Å; S207-H209 PolarHBondContact O-N 2.92Å
210	R	60.3	Low	66.9	Low	188 Å²	188	114.8 Å²	114.8	71%	0.709	55%	0.549	S	S	*	.			trans	-163.1	123.5	179.4	-125.8	169.4	176.8	170.7	-1.3	114.5	S212 I215	R210-S212 VanDerWaalsContact C-N 3.34Å; R210-S212 PolarHBondContact O-N 3.45Å; R210-I215 HydrophobicContact CB-CD1 3.74Å; R210-I215 WeakPolarHBondContact O-CD1 3.12Å
211	T	58.5	Low	67.4	Low	147 Å²	147	116.9 Å²	116.9	90%	0.902	56%	0.555	S	S	*	*			trans	-92.3	41.1	178.4	53.7	0	0	0	0	113.4
212	S	70.4	Confident	67.8	Low	43 Å²	43	115 Å²	115	30%	0.301	55%	0.547	S	S	.	.			trans	-79.4	139	-179.2	171.5	0	0	0	0	111.9	R210 E214 I215	R210-S212 VanDerWaalsContact C-N 3.34Å; R210-S212 PolarHBondContact O-N 3.45Å; S212-E214 PolarHBondContact O-N 3.32Å; S212-E214 PolarHBondContact OG-N 3.13Å; S212-I215 WeakPolarHBondContact O-CB 3.1Å; S212-I215 PolarHBondContact O-N 3.48Å; S212-I215 VanDerWaalsContact O-N 3.08Å
213	P	72	Confident	68.1	Low	92 Å²	92	114.3 Å²	114.3	60%	0.597	54%	0.544	S	S	*	.	H	α-helix	trans	-58.8	-28	176.7	23	-33.1	0	0	0	113.8	I215 K216 R217	P213-I215 VanDerWaalsContact C-N 3.3Å; P213-I215 PolarHBondContact O-N 3.34Å; P213-K216 PolarHBondContact O-N 2.94Å; P213-R217 PolarHBondContact O-N 3.37Å
214	E	69.6	Low	68.6	Low	101 Å²	101	114.8 Å²	114.8	47%	0.472	55%	0.554	S	S	.	*	H	α-helix	trans	-67.2	-31.2	176.9	-61.6	-56.2	152.9	0	0	112.2	S212 K216 R217 V218	S212-E214 PolarHBondContact O-N 3.32Å; S212-E214 PolarHBondContact OG-N 3.13Å; E214-K216 VanDerWaalsContact C-N 3.32Å; E214-K216 PolarHBondContact O-N 2.86Å; E214-R217 WeakPolarHBondContact O-CB 3.49Å; E214-R217 PolarHBondContact O-N 3.48Å; E214-R217 VanDerWaalsContact O-N 3.16Å; E214-R217 IonicContact OE1-CZ 3.98Å; E214-R217 IonicContact OE1-NH1 3.89Å; E214-R217 PolarHBondContact OE1-NH1 2.82Å; E214-R217 IonicContact OE2-CZ 3.9Å; E214-R217 IonicContact OE2-NH1 2.98Å; E214-R217 PolarHBondContact OE2-NH1 2.78Å; E214-V218 WeakPolarHBondContact O-CG2 3.44Å; E214-V218 PolarHBondContact O-N 3.35Å; E214-V218 VanDerWaalsContact O-N 3.07Å
215	I	67.1	Low	69.1	Low	26 Å²	26	114.8 Å²	114.8	13%	0.133	55%	0.554	C	S	.	*	H	α-helix	trans	-69.2	-34	178	-61.5	175.6	0	0	0	110.6	Y206 R210 S212 P213 R217 V218 S219	Y206-I215 HydrophobicContact CD1-CD1 4.27Å; Y206-I215 HydrophobicContact CD1-CG2 4.21Å; Y206-I215 HydrophobicContact CE1-CD1 3.67Å; Y206-I215 HydrophobicContact CE1-CG1 3.92Å; Y206-I215 HydrophobicContact CE1-CG2 4.25Å; R210-I215 HydrophobicContact CB-CD1 3.74Å; R210-I215 WeakPolarHBondContact O-CD1 3.12Å; S212-I215 WeakPolarHBondContact O-CB 3.1Å; S212-I215 PolarHBondContact O-N 3.48Å; S212-I215 VanDerWaalsContact O-N 3.08Å; P213-I215 VanDerWaalsContact C-N 3.3Å; P213-I215 PolarHBondContact O-N 3.34Å; I215-R217 VanDerWaalsContact C-N 3.3Å; I215-R217 PolarHBondContact O-N 3.42Å; I215-V218 PolarHBondContact O-N 3.34Å; I215-S219 WeakPolarHBondContact O-CB 3.37Å; I215-S219 PolarHBondContact O-N 2.93Å
216	K	67.1	Low	69.5	Low	149 Å²	149	108.5 Å²	108.5	65%	0.648	53%	0.529	S	S	*	.	H	α-helix	trans	-62.5	-38.5	172.8	-67.1	-173	178.1	-178.1	0	111.3	P213 E214 S219 K220	P213-K216 PolarHBondContact O-N 2.94Å; E214-K216 VanDerWaalsContact C-N 3.32Å; E214-K216 PolarHBondContact O-N 2.86Å; K216-S219 PolarHBondContact O-OG 2.85Å; K216-K220 WeakPolarHBondContact O-CG 3.33Å; K216-K220 PolarHBondContact O-N 3.47Å
217	R	74.2	Confident	70.3	Confident	156 Å²	156	106.3 Å²	106.3	59%	0.589	53%	0.527	S	S	*	.	H	α-helix	trans	-65.3	-47.7	175.8	-70	-178.8	177.6	154.8	-4.7	111.7	P213 E214 I215 S219 K220 I221	P213-R217 PolarHBondContact O-N 3.37Å; E214-R217 WeakPolarHBondContact O-CB 3.49Å; E214-R217 PolarHBondContact O-N 3.48Å; E214-R217 VanDerWaalsContact O-N 3.16Å; E214-R217 IonicContact OE1-CZ 3.98Å; E214-R217 IonicContact OE1-NH1 3.89Å; E214-R217 PolarHBondContact OE1-NH1 2.82Å; E214-R217 IonicContact OE2-CZ 3.9Å; E214-R217 IonicContact OE2-NH1 2.98Å; E214-R217 PolarHBondContact OE2-NH1 2.78Å; I215-R217 VanDerWaalsContact C-N 3.3Å; I215-R217 PolarHBondContact O-N 3.42Å; R217-S219 VanDerWaalsContact C-N 3.3Å; R217-S219 PolarHBondContact O-N 2.96Å; R217-K220 PolarHBondContact O-N 2.92Å; R217-I221 WeakPolarHBondContact O-CG1 3.39Å; R217-I221 PolarHBondContact O-N 3.34Å; R217-I221 VanDerWaalsContact O-N 3.11Å
218	V	74.9	Confident	70.9	Confident	91 Å²	91	106.4 Å²	106.4	55%	0.552	53%	0.53	S	S	*	.	H	α-helix	trans	-60.9	-41.2	178.1	178.2	0	0	0	0	111.1	E214 I215 K220 I221 L222	E214-V218 WeakPolarHBondContact O-CG2 3.44Å; E214-V218 PolarHBondContact O-N 3.35Å; E214-V218 VanDerWaalsContact O-N 3.07Å; I215-V218 PolarHBondContact O-N 3.34Å; V218-K220 VanDerWaalsContact C-N 3.31Å; V218-K220 PolarHBondContact O-N 3.41Å; V218-I221 PolarHBondContact O-N 3.45Å; V218-L222 WeakPolarHBondContact O-CB 3.32Å; V218-L222 PolarHBondContact O-N 3.23Å
219	S	70.4	Confident	71.4	Confident	32 Å²	32	100.6 Å²	100.6	22%	0.224	51%	0.509	C	S	.	.	H	α-helix	trans	-60.2	-38.6	177	75	0	0	0	0	113.3	F203 I215 K216 R217 L223	F203-S219 VanDerWaalsContact CZ-CB 3.44Å; I215-S219 WeakPolarHBondContact O-CB 3.37Å; I215-S219 PolarHBondContact O-N 2.93Å; K216-S219 PolarHBondContact O-OG 2.85Å; R217-S219 VanDerWaalsContact C-N 3.3Å; R217-S219 PolarHBondContact O-N 2.96Å; S219-L223 WeakPolarHBondContact O-CB 3.43Å; S219-L223 PolarHBondContact O-N 3.22Å
220	K	72.6	Confident	72.1	Confident	144 Å²	144	95.8 Å²	95.8	63%	0.626	49%	0.489	S	S	*	.	H	α-helix	trans	-68.2	-44.1	177.4	-73.2	-179.9	177.7	-168.4	0	111.3	K216 R217 V218 L222 L223 V224	K216-K220 WeakPolarHBondContact O-CG 3.33Å; K216-K220 PolarHBondContact O-N 3.47Å; R217-K220 PolarHBondContact O-N 2.92Å; V218-K220 VanDerWaalsContact C-N 3.31Å; V218-K220 PolarHBondContact O-N 3.41Å; K220-L222 VanDerWaalsContact C-N 3.33Å; K220-L222 PolarHBondContact O-N 3.01Å; K220-L223 PolarHBondContact O-N 3.08Å; K220-V224 WeakPolarHBondContact O-CG2 3.33Å; K220-V224 PolarHBondContact O-N 3.01Å
221	I	78.7	Confident	72.6	Confident	106 Å²	106	88 Å²	88	54%	0.544	47%	0.468	S	S	.	.	H	α-helix	trans	-61.3	-45.4	177.6	-64	167.4	0	0	0	110	R217 V218 L223 V224 L225	R217-I221 WeakPolarHBondContact O-CG1 3.39Å; R217-I221 PolarHBondContact O-N 3.34Å; R217-I221 VanDerWaalsContact O-N 3.11Å; V218-I221 PolarHBondContact O-N 3.45Å; I221-L223 PolarHBondContact O-N 3.37Å; I221-V224 PolarHBondContact O-N 3.1Å; I221-L225 HydrophobicContact CG2-CD1 4.13Å; I221-L225 WeakPolarHBondContact O-CG 3.22Å; I221-L225 PolarHBondContact O-N 3.15Å
222	L	76.3	Confident	72.8	Confident	72 Å²	72	86.3 Å²	86.3	38%	0.377	45%	0.452	S	S	.	.	H	α-helix	trans	-63.2	-42.2	179.3	-152.9	83.6	0	0	0	111.9	I199 V218 K220 L225 V226	I199-L222 HydrophobicContact CG2-CD2 3.65Å; V218-L222 WeakPolarHBondContact O-CB 3.32Å; V218-L222 PolarHBondContact O-N 3.23Å; K220-L222 VanDerWaalsContact C-N 3.33Å; K220-L222 PolarHBondContact O-N 3.01Å; L222-L225 PolarHBondContact O-N 2.89Å; L222-V226 WeakPolarHBondContact O-CG2 3.33Å; L222-V226 PolarHBondContact O-N 3.45Å
223	L	75.1	Confident	71.8	Confident	105 Å²	105	87.2 Å²	87.2	55%	0.55	45%	0.453	S	S	.	.	H	α-helix	trans	-60.4	-44.9	175.6	-175.5	75.9	0	0	0	111.6	S219 K220 I221 L225 V226 L227	S219-L223 WeakPolarHBondContact O-CB 3.43Å; S219-L223 PolarHBondContact O-N 3.22Å; K220-L223 PolarHBondContact O-N 3.08Å; I221-L223 PolarHBondContact O-N 3.37Å; L223-L225 VanDerWaalsContact C-N 3.33Å; L223-L225 PolarHBondContact O-N 2.71Å; L223-V226 PolarHBondContact O-N 2.82Å; L223-L227 HydrophobicContact CG-CD1 4.08Å; L223-L227 HydrophobicContact CG-CG 4.47Å; L223-L227 WeakPolarHBondContact O-CB 3.28Å; L223-L227 VanDerWaalsContact O-CG 3.3Å; L223-L227 WeakPolarHBondContact O-CG 2.96Å; L223-L227 PolarHBondContact O-N 2.72Å
224	V	76.3	Confident	70.7	Confident	94 Å²	94	89.5 Å²	89.5	57%	0.57	46%	0.456	S	S	*	.	H	α-helix	trans	-62	-42.2	177.6	171.4	0	0	0	0	111	K220 I221 L227 A228	K220-V224 WeakPolarHBondContact O-CG2 3.33Å; K220-V224 PolarHBondContact O-N 3.01Å; I221-V224 PolarHBondContact O-N 3.1Å; V224-L227 PolarHBondContact O-N 2.75Å; V224-A228 VanDerWaalsContact O-CB 3.25Å; V224-A228 WeakPolarHBondContact O-CB 3.24Å; V224-A228 PolarHBondContact O-N 2.98Å
225	L	77.8	Confident	69.4	Low	108 Å²	108	90 Å²	90	57%	0.565	46%	0.457	S	S	*	.	H	α-helix	trans	-64.9	-41.2	176.8	-69	172.2	0	0	0	112.3	I221 L222 L223 A228 Y229	I221-L225 HydrophobicContact CG2-CD1 4.13Å; I221-L225 WeakPolarHBondContact O-CG 3.22Å; I221-L225 PolarHBondContact O-N 3.15Å; L222-L225 PolarHBondContact O-N 2.89Å; L223-L225 VanDerWaalsContact C-N 3.33Å; L223-L225 PolarHBondContact O-N 2.71Å; L225-A228 PolarHBondContact O-N 3.22Å; L225-Y229 WeakPolarHBondContact O-CB 3.4Å; L225-Y229 PolarHBondContact O-N 2.81Å
226	V	75.3	Confident	68.1	Low	33 Å²	33	91.4 Å²	91.4	20%	0.2	47%	0.469	C	S	.	.	H	α-helix	trans	-63.8	-46.2	175.6	168.4	0	0	0	0	111	L196 L222 L223 Y229 L230	L196-V226 HydrophobicContact CD2-CG1 3.57Å; L196-V226 HydrophobicContact CD2-CG2 4.39Å; L222-V226 WeakPolarHBondContact O-CG2 3.33Å; L222-V226 PolarHBondContact O-N 3.45Å; L223-V226 PolarHBondContact O-N 2.82Å; V226-Y229 PolarHBondContact O-N 2.81Å; V226-L230 HydrophobicContact CG1-CD1 3.89Å; V226-L230 HydrophobicContact CG1-CG 4.37Å; V226-L230 WeakPolarHBondContact O-CB 3.34Å; V226-L230 VanDerWaalsContact O-CG 3.28Å; V226-L230 WeakPolarHBondContact O-CG 3.18Å; V226-L230 PolarHBondContact O-N 3.1Å
227	L	76.9	Confident	66.8	Low	103 Å²	103	91 Å²	91	54%	0.539	47%	0.47	S	S	.	.	H	α-helix	trans	-65.6	-38.9	177.5	-69.4	174.7	0	0	0	112.1	L223 V224 Y229 L230 G231	L223-L227 HydrophobicContact CG-CD1 4.08Å; L223-L227 HydrophobicContact CG-CG 4.47Å; L223-L227 WeakPolarHBondContact O-CB 3.28Å; L223-L227 VanDerWaalsContact O-CG 3.3Å; L223-L227 WeakPolarHBondContact O-CG 2.96Å; L223-L227 PolarHBondContact O-N 2.72Å; V224-L227 PolarHBondContact O-N 2.75Å; L227-Y229 VanDerWaalsContact C-N 3.34Å; L227-L230 PolarHBondContact O-N 3.1Å; L227-G231 PolarHBondContact O-N 2.96Å
228	A	76.1	Confident	64.8	Low	50 Å²	50	88.3 Å²	88.3	41%	0.413	47%	0.473	S	S	.	.	H	α-helix	trans	-62.4	-42.9	174.4	0	0	0	0	0	111.1	V224 L225 G231 I232	V224-A228 VanDerWaalsContact O-CB 3.25Å; V224-A228 WeakPolarHBondContact O-CB 3.24Å; V224-A228 PolarHBondContact O-N 2.98Å; L225-A228 PolarHBondContact O-N 3.22Å; A228-G231 PolarHBondContact O-N 3.04Å; A228-I232 WeakPolarHBondContact O-CD1 3.32Å; A228-I232 WeakPolarHBondContact O-CG1 3.43Å; A228-I232 PolarHBondContact O-N 2.71Å
229	Y	71	Confident	63.1	Low	106 Å²	106	88.6 Å²	88.6	42%	0.416	48%	0.479	S	S	.	.	H	α-helix	trans	-65.1	-46.9	176.4	-173.9	-94.5	0	0	0	112.3	V192 L225 V226 L227 G231 I232 D233	V192-Y229 HydrophobicContact CG2-CE1 4.24Å; L225-Y229 WeakPolarHBondContact O-CB 3.4Å; L225-Y229 PolarHBondContact O-N 2.81Å; V226-Y229 PolarHBondContact O-N 2.81Å; L227-Y229 VanDerWaalsContact C-N 3.34Å; Y229-G231 VanDerWaalsContact C-N 3.26Å; Y229-G231 PolarHBondContact O-N 2.72Å; Y229-I232 WeakPolarHBondContact O-CB 3.19Å; Y229-I232 PolarHBondContact O-N 3.42Å; Y229-I232 VanDerWaalsContact O-N 3.14Å; Y229-D233 PolarHBondContact O-N 3.48Å
230	L	73.6	Confident	61.4	Low	65 Å²	65	93.9 Å²	93.9	34%	0.34	50%	0.504	S	S	.	.	H	α-helix	trans	-62	-34.8	175.5	-69.6	173.6	0	0	0	112.1	V192 L196 V226 L227 D233 Q234	V192-L230 HydrophobicContact CG1-CD2 3.77Å; L196-L230 HydrophobicContact CD1-CD2 4.46Å; V226-L230 HydrophobicContact CG1-CD1 3.89Å; V226-L230 HydrophobicContact CG1-CG 4.37Å; V226-L230 WeakPolarHBondContact O-CB 3.34Å; V226-L230 VanDerWaalsContact O-CG 3.28Å; V226-L230 WeakPolarHBondContact O-CG 3.18Å; V226-L230 PolarHBondContact O-N 3.1Å; L227-L230 PolarHBondContact O-N 3.1Å; L230-D233 PolarHBondContact O-N 3.04Å; L230-Q234 PolarHBondContact O-N 2.76Å
231	G	70.8	Confident	59.5	Low	26 Å²	26	95.5 Å²	95.5	27%	0.268	51%	0.514	S	S	.	.	H	α-helix	trans	-65.2	-44.1	172.5	0	0	0	0	0	112.2	L227 A228 Y229 D233 Q234 F235	L227-G231 PolarHBondContact O-N 2.96Å; A228-G231 PolarHBondContact O-N 3.04Å; Y229-G231 VanDerWaalsContact C-N 3.26Å; Y229-G231 PolarHBondContact O-N 2.72Å; G231-D233 PolarHBondContact O-N 2.75Å; G231-Q234 PolarHBondContact O-N 3.36Å; G231-F235 WeakPolarHBondContact O-CD2 3.41Å; G231-F235 PolarHBondContact O-N 3.46Å
232	I	62.9	Low	57.4	Low	111 Å²	111	96 Å²	96	57%	0.569	52%	0.522	S	S	*	.	H	α-helix	trans	-60.8	-35.7	175.4	-67.9	161.2	0	0	0	110.9	A228 Y229 F235 S236	A228-I232 WeakPolarHBondContact O-CD1 3.32Å; A228-I232 WeakPolarHBondContact O-CG1 3.43Å; A228-I232 PolarHBondContact O-N 2.71Å; Y229-I232 WeakPolarHBondContact O-CB 3.19Å; Y229-I232 PolarHBondContact O-N 3.42Å; Y229-I232 VanDerWaalsContact O-N 3.14Å; I232-F235 WeakPolarHBondContact O-CB 3.17Å; I232-F235 PolarHBondContact O-N 3.06Å; I232-S236 PolarHBondContact O-N 2.86Å
233	D	50.1	Low	55.4	Low	61 Å²	61	101.6 Å²	101.6	33%	0.326	54%	0.544	S	S	.	.	H	α-helix	trans	-76.9	-31.2	178.9	-135.5	7.7	0	0	0	113	Y229 L230 G231 F235 S236 Q237	Y229-D233 PolarHBondContact O-N 3.48Å; L230-D233 PolarHBondContact O-N 3.04Å; G231-D233 PolarHBondContact O-N 2.75Å; D233-F235 VanDerWaalsContact C-N 3.29Å; D233-F235 PolarHBondContact O-N 2.7Å; D233-S236 PolarHBondContact O-N 3.31Å; D233-S236 PolarHBondContact O-OG 2.93Å; D233-S236 PolarHBondContact OD1-OG 3.46Å; D233-Q237 PolarHBondContact O-N 2.95Å
234	Q	48.1	Very low	53.3	Low	141 Å²	141	107.9 Å²	107.9	66%	0.659	56%	0.562	S	S	*	*	H	α-helix	trans	-63.7	-35.9	165.5	-89.9	-171	-17.7	0	0	112.1	L230 G231 S236 Q237 C238	L230-Q234 PolarHBondContact O-N 2.76Å; G231-Q234 PolarHBondContact O-N 3.36Å; Q234-S236 VanDerWaalsContact C-N 3.32Å; Q234-Q237 PolarHBondContact O-N 3.02Å; Q234-C238 PolarHBondContact O-N 2.86Å; Q234-C238 VanDerWaalsContact O-N 3.09Å
235	F	41.9	Very low	51.4	Low	111 Å²	111	108 Å²	108	49%	0.487	57%	0.572	S	S	.	*	H	α-helix	trans	-67	-31.8	173.6	-94.5	-84	0	0	0	112.8	G231 I232 D233 Q237 S239 C260	G231-F235 WeakPolarHBondContact O-CD2 3.41Å; G231-F235 PolarHBondContact O-N 3.46Å; I232-F235 WeakPolarHBondContact O-CB 3.17Å; I232-F235 PolarHBondContact O-N 3.06Å; D233-F235 VanDerWaalsContact C-N 3.29Å; D233-F235 PolarHBondContact O-N 2.7Å; F235-Q237 VanDerWaalsContact C-N 3.34Å; F235-S239 PolarHBondContact O-N 2.84Å; F235-C260 HydrophobicContact CZ-CB 4.47Å
236	S	40.7	Very low	49.3	Very low	55 Å²	55	110.4 Å²	110.4	39%	0.385	59%	0.586	S	S	.	*	H	α-helix	trans	-68.7	-33.8	176.5	85.2	0	0	0	0	111.7	I232 D233 Q234	I232-S236 PolarHBondContact O-N 2.86Å; D233-S236 PolarHBondContact O-N 3.31Å; D233-S236 PolarHBondContact O-OG 2.93Å; D233-S236 PolarHBondContact OD1-OG 3.46Å; Q234-S236 VanDerWaalsContact C-N 3.32Å
237	Q	38.9	Very low	47.3	Very low	142 Å²	142	117.6 Å²	117.6	66%	0.664	62%	0.617	S	S	*	*	H	α-helix	trans	-76.6	-34.6	175.1	-71	-175.5	-14.1	0	0	113.3	D233 Q234 F235 S239 L240	D233-Q237 PolarHBondContact O-N 2.95Å; Q234-Q237 PolarHBondContact O-N 3.02Å; F235-Q237 VanDerWaalsContact C-N 3.34Å; Q237-S239 VanDerWaalsContact C-N 3.32Å; Q237-S239 PolarHBondContact O-N 3.48Å; Q237-L240 PolarHBondContact O-N 2.79Å
238	C	32	Very low	45.3	Very low	99 Å²	99	120.2 Å²	120.2	67%	0.669	63%	0.632	S	S	*	*	H	α-helix	trans	-70.2	-21.5	176.5	-87.7	0	0	0	0	114.6	Q234	Q234-C238 PolarHBondContact O-N 2.86Å; Q234-C238 VanDerWaalsContact O-N 3.09Å
239	S	39.4	Very low	43.5	Very low	96 Å²	96	125.7 Å²	125.7	67%	0.671	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-0.1	178.2	-90.8	0	0	0	0	114.7	F235 Q237	F235-S239 PolarHBondContact O-N 2.84Å; Q237-S239 VanDerWaalsContact C-N 3.32Å; Q237-S239 PolarHBondContact O-N 3.48Å
240	L	34.6	Very low	41.7	Very low	144 Å²	144	126.7 Å²	126.7	75%	0.754	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-4.6	-178.5	-100.1	148	0	0	0	114.6	Q237	Q237-L240 PolarHBondContact O-N 2.79Å
241	E	34.1	Very low	39.9	Very low	177 Å²	177	130.4 Å²	130.4	83%	0.827	69%	0.686	S	S	*	*	S	Bend	trans	-97.2	3.6	-179.8	-79.2	-167.1	148.2	0	0	115.9
242	T	33.8	Very low	38.2	Very low	117 Å²	117	134.8 Å²	134.8	72%	0.718	70%	0.703	S	S	*	*			trans	-93.6	12.7	178.5	50.3	0	0	0	0	115.1	Y244	T242-Y244 VanDerWaalsContact C-N 3.3Å; T242-Y244 PolarHBondContact O-N 3.31Å
243	K	33.6	Very low	36.9	Very low	190 Å²	190	134.4 Å²	134.4	83%	0.826	71%	0.71	S	S	*	*	S	Bend	trans	-90.1	41.7	-178.2	-119.9	-176.6	-171.2	179.5	0	114.5
244	Y	30.7	Very low	36.3	Very low	236 Å²	236	136.5 Å²	136.5	93%	0.925	73%	0.725	S	S	*	*	S	Bend	trans	-158.6	72.6	162.9	-89.7	-79.9	0	0	0	108.8	T242	T242-Y244 VanDerWaalsContact C-N 3.3Å; T242-Y244 PolarHBondContact O-N 3.31Å
245	A	36.5	Very low	35.7	Very low	96 Å²	96	133.8 Å²	133.8	79%	0.793	72%	0.718	S	S	*	*			trans	-152.1	137.5	166.1	0	0	0	0	0	110.5
246	D	35.1	Very low	35.5	Very low	160 Å²	160	133.1 Å²	133.1	86%	0.856	72%	0.723	S	S	*	*			trans	-40	144.3	-167.3	-93.7	-50.8	0	0	0	118.5	N248	D246-N248 PolarHBondContact O-N 2.91Å
247	Q	33.2	Very low	35.3	Very low	183 Å²	183	133.6 Å²	133.6	86%	0.855	73%	0.73	S	S	*	*	S	Bend	trans	-60.2	94.9	157.8	-72.2	172.8	-40.5	0	0	109.4
248	N	34.7	Very low	35.2	Very low	158 Å²	158	132.6 Å²	132.6	85%	0.845	73%	0.729	S	S	*	*			trans	164.4	66.8	148.6	-87.9	-22.2	0	0	0	110.5	D246	D246-N248 PolarHBondContact O-N 2.91Å
249	Q	37	Very low	35.6	Very low	166 Å²	166	133.6 Å²	133.6	78%	0.776	72%	0.724	S	S	*	*			trans	-161.8	82.8	155.9	-124.1	160.6	0.5	0	0	111.2
250	T	33.6	Very low	35.6	Very low	126 Å²	126	131.5 Å²	131.5	77%	0.773	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	139.4	153	37.6	0	0	0	0	108.7
251	D	36.8	Very low	36	Very low	144 Å²	144	129.4 Å²	129.4	77%	0.77	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	102.7	15.7	172.9	-56.1	-23.6	0	0	0	119.3
252	L	34.8	Very low	36.3	Very low	117 Å²	117	129 Å²	129	61%	0.613	69%	0.69	S	S	*	*			trans	-116.5	8.3	177.7	-137.8	76.5	0	0	0	116.7
253	S	36.1	Very low	36.7	Very low	104 Å²	104	127.2 Å²	127.2	73%	0.727	68%	0.676	S	S	*	*	S	Bend	trans	-91.3	-20.6	-176.1	57.5	0	0	0	0	114.9
254	T	36.2	Very low	37.2	Very low	104 Å²	104	121.2 Å²	121.2	64%	0.638	66%	0.656	S	S	*	*	H	α-helix	trans	-85.9	-28.9	-178.6	37.1	0	0	0	0	113.6
255	V	35.5	Very low	37.8	Very low	85 Å²	85	113.7 Å²	113.7	52%	0.515	63%	0.631	S	S	.	*	H	α-helix	trans	-76	-30.8	-176.8	-179.2	0	0	0	0	112.4	Q259	V255-Q259 PolarHBondContact O-N 3.49Å
256	V	37.8	Very low	38	Very low	97 Å²	97	110.7 Å²	110.7	59%	0.588	60%	0.604	S	S	*	*	H	α-helix	trans	-76.7	-31.3	-176.4	-177.8	0	0	0	0	112.1	C260	V256-C260 PolarHBondContact O-N 2.74Å
257	A	37.8	Very low	38.4	Very low	64 Å²	64	108.6 Å²	108.6	53%	0.529	59%	0.593	S	S	.	*	H	α-helix	trans	-69.9	-42.6	177.9	0	0	0	0	0	112.3	C260 L261	A257-C260 PolarHBondContact O-N 3.15Å; A257-L261 PolarHBondContact O-N 3.5Å; A257-L261 VanDerWaalsContact O-N 3.16Å
258	D	36	Very low	38.5	Very low	121 Å²	121	105.4 Å²	105.4	65%	0.647	58%	0.579	S	S	*	*	H	α-helix	trans	-68	-39.2	179.2	-93.3	-4.3	0	0	0	112.4	C260 L261 Y262	D258-C260 VanDerWaalsContact C-N 3.29Å; D258-C260 PolarHBondContact O-N 2.6Å; D258-L261 PolarHBondContact O-N 2.83Å; D258-Y262 WeakPolarHBondContact O-CB 3.43Å; D258-Y262 PolarHBondContact O-N 3.22Å
259	Q	40.6	Very low	38.9	Very low	120 Å²	120	103.2 Å²	103.2	56%	0.561	57%	0.572	S	S	*	*	H	α-helix	trans	-64.9	-35.4	179.1	-150	87.2	21	0	0	112	V255 N263	V255-Q259 PolarHBondContact O-N 3.49Å; Q259-N263 VanDerWaalsContact O-CG 3.26Å; Q259-N263 PolarHBondContact O-N 3.26Å; Q259-N263 PolarHBondContact O-ND2 2.94Å
260	C	38.6	Very low	39	Very low	52 Å²	52	102.8 Å²	102.8	35%	0.351	57%	0.57	S	S	.	*	H	α-helix	trans	-76	-40.8	-178.4	-138.3	0	0	0	0	111.5	F235 V256 A257 D258 Y262 N263 V264	F235-C260 HydrophobicContact CZ-CB 4.47Å; V256-C260 PolarHBondContact O-N 2.74Å; A257-C260 PolarHBondContact O-N 3.15Å; D258-C260 VanDerWaalsContact C-N 3.29Å; D258-C260 PolarHBondContact O-N 2.6Å; C260-Y262 VanDerWaalsContact C-N 3.33Å; C260-Y262 PolarHBondContact O-N 3.43Å; C260-N263 PolarHBondContact O-N 2.81Å; C260-V264 WeakPolarHBondContact O-CG2 3.39Å; C260-V264 PolarHBondContact O-N 3.17Å; C260-V264 VanDerWaalsContact O-N 3.08Å
261	L	42.8	Very low	39.3	Very low	101 Å²	101	100.8 Å²	100.8	53%	0.529	56%	0.561	S	S	.	*	H	α-helix	trans	-62.8	-40.7	174.1	-150.9	93.8	0	0	0	111.4	A257 D258 V264 L265	A257-L261 PolarHBondContact O-N 3.5Å; A257-L261 VanDerWaalsContact O-N 3.16Å; D258-L261 PolarHBondContact O-N 2.83Å; L261-V264 PolarHBondContact O-N 3.21Å; L261-L265 HydrophobicContact CD2-CD1 4.03Å; L261-L265 HydrophobicContact CG-CD1 4.19Å; L261-L265 WeakPolarHBondContact O-CB 3.01Å; L261-L265 VanDerWaalsContact O-CG 3.29Å; L261-L265 WeakPolarHBondContact O-CG 3.27Å; L261-L265 PolarHBondContact O-N 3.4Å
262	Y	41.1	Very low	39.2	Very low	167 Å²	167	101.2 Å²	101.2	66%	0.655	56%	0.564	S	S	*	*	H	α-helix	trans	-61.6	-43.4	175.9	-170.4	-93	0	0	0	112.1	D258 C260 L265 S266	D258-Y262 WeakPolarHBondContact O-CB 3.43Å; D258-Y262 PolarHBondContact O-N 3.22Å; C260-Y262 VanDerWaalsContact C-N 3.33Å; C260-Y262 PolarHBondContact O-N 3.43Å; Y262-L265 PolarHBondContact O-N 2.9Å; Y262-S266 VanDerWaalsContact O-CB 3.23Å; Y262-S266 WeakPolarHBondContact O-CB 3.31Å; Y262-S266 PolarHBondContact O-N 2.98Å; Y262-S266 PolarHBondContact O-OG 2.99Å
263	N	41.6	Very low	39.2	Very low	80 Å²	80	104.7 Å²	104.7	43%	0.428	58%	0.576	S	S	.	*	H	α-helix	trans	-66.6	-42	179.1	-72.2	-18.6	0	0	0	112.4	Q259 C260 S266 N267	Q259-N263 VanDerWaalsContact O-CG 3.26Å; Q259-N263 PolarHBondContact O-N 3.26Å; Q259-N263 PolarHBondContact O-ND2 2.94Å; C260-N263 PolarHBondContact O-N 2.81Å; N263-S266 PolarHBondContact O-N 3.01Å; N263-S266 PolarHBondContact O-OG 3.45Å; N263-N267 WeakPolarHBondContact O-CB 3.24Å; N263-N267 PolarHBondContact O-N 3.08Å; N263-N267 PolarHBondContact O-ND2 2.66Å
264	V	44.1	Very low	39.2	Very low	65 Å²	65	105.8 Å²	105.8	39%	0.394	57%	0.573	S	S	.	*	H	α-helix	trans	-65.8	-40.5	177.4	170.4	0	0	0	0	111.5	C260 L261 M268	C260-V264 WeakPolarHBondContact O-CG2 3.39Å; C260-V264 PolarHBondContact O-N 3.17Å; C260-V264 VanDerWaalsContact O-N 3.08Å; L261-V264 PolarHBondContact O-N 3.21Å; V264-M268 HydrophobicContact CG1-CE 3.52Å; V264-M268 WeakPolarHBondContact O-CE 3.1Å; V264-M268 WeakPolarHBondContact O-CG 3.33Å; V264-M268 PolarHBondContact O-N 3.49Å
265	L	43	Very low	39	Very low	77 Å²	77	107.5 Å²	107.5	40%	0.403	58%	0.584	S	S	.	*	H	α-helix	trans	-71.2	-37.1	175.1	-70.7	167.8	0	0	0	112.5	L261 Y262 M268 T269	L261-L265 HydrophobicContact CD2-CD1 4.03Å; L261-L265 HydrophobicContact CG-CD1 4.19Å; L261-L265 WeakPolarHBondContact O-CB 3.01Å; L261-L265 VanDerWaalsContact O-CG 3.29Å; L261-L265 WeakPolarHBondContact O-CG 3.27Å; L261-L265 PolarHBondContact O-N 3.4Å; Y262-L265 PolarHBondContact O-N 2.9Å; L265-M268 HydrophobicContact CD2-CE 4.36Å; L265-M268 PolarHBondContact O-N 2.94Å; L265-T269 WeakPolarHBondContact O-CG2 3.44Å; L265-T269 PolarHBondContact O-N 2.96Å; L265-T269 PolarHBondContact O-OG1 2.98Å
266	S	41.9	Very low	39	Very low	33 Å²	33	111.1 Å²	111.1	23%	0.231	60%	0.6	C	S	.	*	H	α-helix	trans	-68.6	-33.2	177.8	78.5	0	0	0	0	113.1	Y262 N263 M268 T269	Y262-S266 VanDerWaalsContact O-CB 3.23Å; Y262-S266 WeakPolarHBondContact O-CB 3.31Å; Y262-S266 PolarHBondContact O-N 2.98Å; Y262-S266 PolarHBondContact O-OG 2.99Å; N263-S266 PolarHBondContact O-N 3.01Å; N263-S266 PolarHBondContact O-OG 3.45Å; S266-M268 VanDerWaalsContact C-N 3.33Å; S266-T269 PolarHBondContact O-OG1 3.19Å
267	N	42.3	Very low	39.1	Very low	116 Å²	116	110.6 Å²	110.6	62%	0.62	60%	0.597	S	S	*	*	H	α-helix	trans	-75	-25.1	175.3	-76.3	-18.4	0	0	0	112.2	N263	N263-N267 WeakPolarHBondContact O-CB 3.24Å; N263-N267 PolarHBondContact O-N 3.08Å; N263-N267 PolarHBondContact O-ND2 2.66Å
268	M	37.2	Very low	39	Very low	117 Å²	117	111.7 Å²	111.7	58%	0.576	59%	0.594	S	S	*	*	H	α-helix	trans	-80.4	-22.6	174.9	-77.3	-164.9	-92.2	0	0	113.5	V264 L265 S266	V264-M268 HydrophobicContact CG1-CE 3.52Å; V264-M268 WeakPolarHBondContact O-CE 3.1Å; V264-M268 WeakPolarHBondContact O-CG 3.33Å; V264-M268 PolarHBondContact O-N 3.49Å; L265-M268 HydrophobicContact CD2-CE 4.36Å; L265-M268 PolarHBondContact O-N 2.94Å; S266-M268 VanDerWaalsContact C-N 3.33Å
269	T	42.5	Very low	39	Very low	112 Å²	112	110.1 Å²	110.1	69%	0.687	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-3.2	-179.9	50.8	0	0	0	0	114.3	L265 S266	L265-T269 WeakPolarHBondContact O-CG2 3.44Å; L265-T269 PolarHBondContact O-N 2.96Å; L265-T269 PolarHBondContact O-OG1 2.98Å; S266-T269 PolarHBondContact O-OG1 3.19Å
270	Q	39.5	Very low	38.8	Very low	156 Å²	156	110.3 Å²	110.3	73%	0.729	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	4.1	175.6	-76.9	-176	9.6	0	0	114.6
271	S	40.1	Very low	38.7	Very low	85 Å²	85	113.2 Å²	113.2	59%	0.594	61%	0.606	S	S	*	*	S	Bend	trans	-96.2	100	167.9	-176.9	0	0	0	0	108.9
272	D	32.8	Very low	38.4	Very low	153 Å²	153	112.8 Å²	112.8	82%	0.818	60%	0.603	S	S	*	*	S	Bend	trans	-47	140.8	172.5	-74.7	-43	0	0	0	111.3
273	E	36.8	Very low	38.2	Very low	189 Å²	189	109.9 Å²	109.9	88%	0.883	60%	0.595	S	S	*	*			trans	90	51.9	-174.7	-54	-171.5	156.2	0	0	117.5
274	L	35.5	Very low	37.9	Very low	127 Å²	127	110.9 Å²	110.9	67%	0.665	60%	0.604	S	S	*	*			trans	-129	58.6	161.8	-104.6	146.3	0	0	0	111.4	N276 V277	L274-N276 PolarHBondContact O-N 2.97Å; L274-V277 HydrophobicContact CD2-CG2 3.91Å
275	T	31.5	Very low	37.4	Very low	140 Å²	140	111.7 Å²	111.7	86%	0.859	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	122.3	164.7	50.5	0	0	0	0	109.5
276	N	36.4	Very low	37.1	Very low	161 Å²	161	110.3 Å²	110.3	86%	0.861	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	100	24	160	-137.3	16.6	0	0	0	119.1	L274	L274-N276 PolarHBondContact O-N 2.97Å
277	V	38.3	Very low	36.8	Very low	86 Å²	86	114.7 Å²	114.7	52%	0.521	63%	0.627	S	S	.	*			trans	-95	108	157.6	-177.7	0	0	0	0	108	L274 S279 I282	L274-V277 HydrophobicContact CD2-CG2 3.91Å; V277-S279 PolarHBondContact O-N 2.98Å; V277-I282 HydrophobicContact CG1-CD1 4.11Å; V277-I282 HydrophobicContact CG1-CG1 4.48Å
278	N	35.9	Very low	36.4	Very low	88 Å²	88	113.8 Å²	113.8	47%	0.471	62%	0.622	S	S	.	*			trans	-60.5	116.4	-176.8	-154.6	17.7	0	0	0	109.7	Q280 N281	N278-Q280 PolarHBondContact O-N 3.21Å; N278-N281 PolarHBondContact O-N 2.74Å
279	S	35.7	Very low	36.3	Very low	88 Å²	88	114 Å²	114	62%	0.615	63%	0.625	S	S	*	*	H	α-helix	trans	-54.1	-24.5	-175.7	41	0	0	0	0	113.8	V277 N281 I282 E283	V277-S279 PolarHBondContact O-N 2.98Å; S279-N281 VanDerWaalsContact C-N 3.32Å; S279-N281 PolarHBondContact O-N 3.35Å; S279-I282 PolarHBondContact O-N 3.41Å; S279-E283 PolarHBondContact O-N 2.86Å
280	Q	37	Very low	35.9	Very low	124 Å²	124	111.2 Å²	111.2	58%	0.579	61%	0.613	S	S	*	*	H	α-helix	trans	-63.2	-31.3	174.5	-74.9	173.9	-31.9	0	0	113.9	N278 I282 V284	N278-Q280 PolarHBondContact O-N 3.21Å; Q280-I282 VanDerWaalsContact C-N 3.34Å; Q280-V284 VanDerWaalsContact O-CG2 3.27Å; Q280-V284 WeakPolarHBondContact O-CG2 3.47Å; Q280-V284 PolarHBondContact O-N 3.26Å
281	N	37.2	Very low	35.5	Very low	112 Å²	112	107.9 Å²	107.9	60%	0.599	61%	0.606	S	S	*	*	H	α-helix	trans	-75.9	-26.7	-177.9	-69.8	-16.8	0	0	0	112.4	N278 S279 C285	N278-N281 PolarHBondContact O-N 2.74Å; S279-N281 VanDerWaalsContact C-N 3.32Å; S279-N281 PolarHBondContact O-N 3.35Å; N281-C285 PolarHBondContact O-N 2.76Å
282	I	37.1	Very low	35.2	Very low	93 Å²	93	112.8 Å²	112.8	48%	0.477	61%	0.611	S	S	.	*	H	α-helix	trans	-77.9	-38.7	177.3	-61.7	172.8	0	0	0	109.8	V277 S279 Q280 C285 A286	V277-I282 HydrophobicContact CG1-CD1 4.11Å; V277-I282 HydrophobicContact CG1-CG1 4.48Å; S279-I282 PolarHBondContact O-N 3.41Å; Q280-I282 VanDerWaalsContact C-N 3.34Å; I282-C285 PolarHBondContact O-N 2.92Å; I282-A286 WeakPolarHBondContact O-CB 3.13Å; I282-A286 PolarHBondContact O-N 3.38Å
283	E	35.5	Very low	35.2	Very low	105 Å²	105	114 Å²	114	49%	0.491	61%	0.606	S	S	.	*	H	α-helix	trans	-68.3	-37.9	178.7	-157.5	-170.5	153.6	0	0	112.8	S279 A286 K287	S279-E283 PolarHBondContact O-N 2.86Å; E283-A286 PolarHBondContact O-N 3.37Å; E283-K287 PolarHBondContact O-N 3.12Å; E283-K287 IonicContact OE1-NZ 2.75Å; E283-K287 PolarHBondContact OE1-NZ 3.24Å
284	V	35	Very low	35.3	Very low	102 Å²	102	112.7 Å²	112.7	62%	0.618	60%	0.599	S	S	*	*	H	α-helix	trans	-66.4	-39.9	175.4	172.6	0	0	0	0	111	Q280 D288	Q280-V284 VanDerWaalsContact O-CG2 3.27Å; Q280-V284 WeakPolarHBondContact O-CG2 3.47Å; Q280-V284 PolarHBondContact O-N 3.26Å; V284-D288 PolarHBondContact O-N 2.8Å
285	C	33.6	Very low	35.5	Very low	81 Å²	81	111.4 Å²	111.4	55%	0.547	60%	0.601	S	S	.	*	H	α-helix	trans	-68.6	-37.3	178.4	-133	0	0	0	0	112	N281 I282 L289	N281-C285 PolarHBondContact O-N 2.76Å; I282-C285 PolarHBondContact O-N 2.92Å; C285-L289 VanDerWaalsContact O-CD1 3.28Å; C285-L289 WeakPolarHBondContact O-CD1 3.47Å; C285-L289 PolarHBondContact O-N 3.14Å
286	A	36.7	Very low	35.8	Very low	49 Å²	49	112.8 Å²	112.8	41%	0.405	60%	0.598	S	S	.	*	H	α-helix	trans	-69.4	-40.8	177.3	0	0	0	0	0	112.9	I282 E283 A290	I282-A286 WeakPolarHBondContact O-CB 3.13Å; I282-A286 PolarHBondContact O-N 3.38Å; E283-A286 PolarHBondContact O-N 3.37Å; A286-A290 PolarHBondContact O-N 2.78Å; A286-A290 VanDerWaalsContact O-N 3.16Å
287	K	35.4	Very low	35.8	Very low	125 Å²	125	112.4 Å²	112.4	54%	0.543	59%	0.59	S	S	.	*	H	α-helix	trans	-66.5	-37.7	177.6	-81.2	173.4	171.2	162	0	112.6	E283 A290 C291	E283-K287 PolarHBondContact O-N 3.12Å; E283-K287 IonicContact OE1-NZ 2.75Å; E283-K287 PolarHBondContact OE1-NZ 3.24Å; K287-A290 PolarHBondContact O-N 3.4Å; K287-C291 PolarHBondContact O-N 3.33Å; K287-C291 VanDerWaalsContact O-N 3.09Å; K287-C291 PolarHBondContact O-SG 3Å
288	D	34.2	Very low	35.7	Very low	96 Å²	96	117.4 Å²	117.4	51%	0.513	61%	0.608	S	S	.	*	H	α-helix	trans	-72.9	-32.3	-178.2	-145.4	34.4	0	0	0	112.3	V284 R292	V284-D288 PolarHBondContact O-N 2.8Å; D288-R292 PolarHBondContact O-N 3.24Å
289	L	35.2	Very low	35.5	Very low	122 Å²	122	118.8 Å²	118.8	64%	0.639	63%	0.625	S	S	*	*	H	α-helix	trans	-70.1	-38.9	171.4	-96.4	110.6	0	0	0	112.8	C285 Y293	C285-L289 VanDerWaalsContact O-CD1 3.28Å; C285-L289 WeakPolarHBondContact O-CD1 3.47Å; C285-L289 PolarHBondContact O-N 3.14Å; L289-Y293 PolarHBondContact O-N 3.46Å
290	A	35.1	Very low	35.3	Very low	53 Å²	53	120.3 Å²	120.3	44%	0.438	63%	0.63	S	S	.	*	H	α-helix	trans	-68.5	-38.1	178.4	0	0	0	0	0	112.7	A286 K287 Y293 H294	A286-A290 PolarHBondContact O-N 2.78Å; A286-A290 VanDerWaalsContact O-N 3.16Å; K287-A290 PolarHBondContact O-N 3.4Å; A290-Y293 PolarHBondContact O-N 2.99Å; A290-H294 PolarHBondContact O-N 3.31Å
291	C	30.7	Very low	34.9	Very low	87 Å²	87	119.7 Å²	119.7	59%	0.588	64%	0.639	S	S	*	*	H	α-helix	trans	-69.2	-35.3	178.3	-76.2	0	0	0	0	113.3	K287 Y293	K287-C291 PolarHBondContact O-N 3.33Å; K287-C291 VanDerWaalsContact O-N 3.09Å; K287-C291 PolarHBondContact O-SG 3Å; C291-Y293 VanDerWaalsContact C-N 3.29Å; C291-Y293 PolarHBondContact O-N 2.76Å
292	R	32.9	Very low	34.5	Very low	188 Å²	188	124.7 Å²	124.7	71%	0.709	65%	0.651	S	S	*	*	H	α-helix	trans	-69.7	-26.7	175.8	-75	-173.6	-170.3	-165.9	4	113.1	D288	D288-R292 PolarHBondContact O-N 3.24Å
293	Y	34	Very low	34.1	Very low	178 Å²	178	125.6 Å²	125.6	70%	0.698	67%	0.666	S	S	*	*	H	α-helix	trans	-79	-34.2	-179.2	-155.6	-97.3	0	0	0	112.8	L289 A290 C291	L289-Y293 PolarHBondContact O-N 3.46Å; A290-Y293 PolarHBondContact O-N 2.99Å; C291-Y293 VanDerWaalsContact C-N 3.29Å; C291-Y293 PolarHBondContact O-N 2.76Å
294	H	38.7	Very low	33.8	Very low	161 Å²	161	131.5 Å²	131.5	75%	0.745	69%	0.685	S	S	*	*	H	α-helix	trans	-78.9	-21.5	179.4	-91.9	-58.2	0	0	0	114.8	A290 Q296	A290-H294 PolarHBondContact O-N 3.31Å; H294-Q296 VanDerWaalsContact C-N 3.34Å; H294-Q296 PolarHBondContact O-N 3.13Å
295	S	39.1	Very low	33.8	Very low	100 Å²	100	131.8 Å²	131.8	70%	0.699	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-10.1	-177.8	174.5	0	0	0	0	114.7
296	Q	38.9	Very low	33.6	Very low	169 Å²	169	137.8 Å²	137.8	79%	0.79	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	8.6	-175	-69.1	-169.3	-19.7	0	0	114.1	H294	H294-Q296 VanDerWaalsContact C-N 3.34Å; H294-Q296 PolarHBondContact O-N 3.13Å
297	H	35.8	Very low	33.6	Very low	154 Å²	154	144.8 Å²	144.8	71%	0.713	73%	0.733	S	S	*	*			trans	-121.2	63.8	178	-90.2	-80.7	0	0	0	111.5
298	E	35.8	Very low	33.6	Very low	191 Å²	191	145 Å²	145	89%	0.893	75%	0.745	S	S	*	*			trans	-113.3	122.3	156.7	-89.2	-174.2	162.6	0	0	109.6
299	S	32.6	Very low	33.7	Very low	117 Å²	117	147.9 Å²	147.9	82%	0.818	76%	0.76	S	S	*	*			trans	-71.2	129.9	-168.8	49.5	0	0	0	0	113.6
300	V	30.8	Very low	33.7	Very low	120 Å²	120	147 Å²	147	73%	0.727	76%	0.761	S	S	*	*			trans	-109.9	109.2	158	-176.7	0	0	0	0	108.6	Y302	V300-Y302 HydrophobicContact CG1-CD2 4.02Å; V300-Y302 HydrophobicContact CG1-CE2 3.56Å
301	S	29.9	Very low	33.5	Very low	110 Å²	110	150.5 Å²	150.5	77%	0.769	78%	0.778	S	S	*	*			trans	-86	125.6	175.2	51.5	0	0	0	0	111
302	Y	27.7	Very low	33.8	Very low	217 Å²	217	153.9 Å²	153.9	85%	0.851	79%	0.788	S	S	*	*			trans	-114	123	163.6	-78.7	-81.1	0	0	0	110.4	V300	V300-Y302 HydrophobicContact CG1-CD2 4.02Å; V300-Y302 HydrophobicContact CG1-CE2 3.56Å
303	S	29.4	Very low	33.8	Very low	112 Å²	112	155.7 Å²	155.7	78%	0.783	80%	0.795	S	S	*	*			trans	-83.1	123.4	173.5	47.2	0	0	0	0	110.6
304	Y	29.3	Very low	33.6	Very low	230 Å²	230	155.5 Å²	155.5	90%	0.902	80%	0.803	S	S	*	*			trans	-103.4	112	170.4	-139.2	-88.3	0	0	0	109.6
305	S	33.7	Very low	33.5	Very low	107 Å²	107	155.8 Å²	155.8	75%	0.748	81%	0.808	S	S	*	*			trans	-77.7	123.8	174.1	-52	0	0	0	0	109.6
306	K	30.7	Very low	33.2	Very low	208 Å²	208	154.2 Å²	154.2	90%	0.904	81%	0.808	S	S	*	*			trans	-73.3	129.1	166.2	-81.9	178.8	173.5	177	0	108.9
307	E	36.1	Very low	32.7	Very low	195 Å²	195	152.2 Å²	152.2	91%	0.911	81%	0.811	S	S	*	*			trans	-130.3	124.2	160.4	-148.8	163.4	-153.3	0	0	109.8
308	T	36	Very low	32.7	Very low	130 Å²	130	150.1 Å²	150.1	80%	0.798	81%	0.811	S	S	*	*			trans	-94	127.8	-178.9	41.9	0	0	0	0	109.6
309	D	34.8	Very low	33.3	Very low	157 Å²	157	151.3 Å²	151.3	84%	0.84	83%	0.832	S	S	*	*			trans	-168.4	134.1	137.6	-141.2	-6.1	0	0	0	111
310	P	35.2	Very low	33.4	Very low	102 Å²	102	153.1 Å²	153.1	66%	0.662	83%	0.832	S	S	*	*			trans	-93.8	169.1	170.9	31.8	-19.1	0	0	0	111.1
311	T	32.1	Very low	33.5	Very low	127 Å²	127	154.8 Å²	154.8	78%	0.779	84%	0.838	S	S	*	*			trans	93.2	107.9	169.5	-24.5	0	0	0	0	114.9
312	I	37.2	Very low	33.7	Very low	158 Å²	158	157.3 Å²	157.3	81%	0.81	84%	0.842	S	S	*	*				179.9	111.3	121	-86.2	152.7	0	0	0	109.8
313	R	32	Very low	34.1	Very low	226 Å²	226	153.8 Å²	153.8	85%	0.853	84%	0.841	S	S	*	*			trans	27.5	123.1	142.9	-65.8	180	174.1	-170.9	-2.2	120.7
314	M	30.4	Very low	34.3	Very low	175 Å²	175	156.4 Å²	156.4	86%	0.862	85%	0.845	S	S	*	*				30.1	123.5	119.6	-67.4	-113	-75.7	0	0	117.6
315	I	36.7	Very low	34.7	Very low	166 Å²	166	151.5 Å²	151.5	85%	0.851	84%	0.841	S	S	*	*				-166	117.7	125.3	-87	140	0	0	0	106.8
316	G	31.6	Very low	34.8	Very low	68 Å²	68	154.6 Å²	154.6	70%	0.701	85%	0.848	S	S	*	*			trans	-82.3	165.5	162.6	0	0	0	0	0	110.8
317	C	29.5	Very low	35.1	Very low	126 Å²	126	150.5 Å²	150.5	85%	0.851	84%	0.843	S	S	*	*			trans	-156	157.3	159.2	-108.7	0	0	0	0	110.8
318	P	35.8	Very low	35	Very low	110 Å²	110	146.8 Å²	146.8	71%	0.714	84%	0.838	S	S	*	*			trans	-127.6	160.1	-136.3	39.5	-23.8	0	0	0	114.7
319	T	48.4	Very low	34.9	Very low	217 Å²	217	148.4 Å²	148.4	100%	1.331	84%	0.841	S	S	*	*				-178.4	0	122.7	31.9	0	0	0	0	107.8

Retrieved 319 of 319 residues in 634.9 ms (Link to these results)

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