A0A096MRU8_PAPAN Loading...

BCL2 interacting protein 1

AlphaFold DB (G7MTZ9), UniProt , Accession A0A096MRU8, Species PAPAN (Papio anubis, Olive baboon), Gene BNIP1, Length 228 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	40.2	Very low	70.8	Confident	241 Å²	241	93.8 Å²	93.8	100%	1.187	50%	0.504	S	S	*	.				0	117.2	0	-78.2	155.5	83.9	0	0	106.7
2	A	46.7	Very low	72.5	Confident	65 Å²	65	86.7 Å²	86.7	54%	0.537	47%	0.467	S	S	.	.			trans	-64	137.2	176.7	0	0	0	0	0	109.1
3	A	59	Low	73.8	Confident	53 Å²	53	82.9 Å²	82.9	44%	0.438	45%	0.447	S	S	.	.			trans	-62.8	146.4	179.3	0	0	0	0	0	110	Q5 D6	A3-Q5 PolarHBondContact O-N 3.26Å; A3-Q5 VanDerWaalsContact O-N 3.13Å; A3-D6 VanDerWaalsContact O-CB 3.29Å; A3-D6 WeakPolarHBondContact O-CB 3.34Å; A3-D6 PolarHBondContact O-N 2.85Å
4	P	61.3	Low	75.2	Confident	99 Å²	99	85.9 Å²	85.9	64%	0.643	46%	0.456	S	S	*	.	H	α-helix	trans	-55.2	-32	-179.7	17.8	-29.5	0	0	0	113.4	D6 V7 H8	P4-D6 VanDerWaalsContact C-N 3.31Å; P4-D6 PolarHBondContact O-N 3.25Å; P4-V7 PolarHBondContact O-N 3.49Å; P4-H8 PolarHBondContact O-CD2 3.11Å; P4-H8 PolarHBondContact O-N 3.14Å
5	Q	63.1	Low	76.4	Confident	86 Å²	86	83.8 Å²	83.8	40%	0.402	44%	0.443	S	S	.	.	H	α-helix	trans	-59.2	-37.9	173.4	-77.4	169.5	-24.4	0	0	113.2	A3 V7 H8 V9	A3-Q5 PolarHBondContact O-N 3.26Å; A3-Q5 VanDerWaalsContact O-N 3.13Å; Q5-V7 VanDerWaalsContact C-N 3.28Å; Q5-V7 PolarHBondContact O-N 3.41Å; Q5-H8 PolarHBondContact O-N 3.36Å; Q5-V9 WeakPolarHBondContact O-CG2 3.5Å; Q5-V9 PolarHBondContact O-N 3.38Å; Q5-V9 VanDerWaalsContact O-N 3.12Å
6	D	74.6	Confident	77.4	Confident	92 Å²	92	78.6 Å²	78.6	49%	0.492	42%	0.415	S	S	.	.	H	α-helix	trans	-68.6	-29.9	-179	-162.7	24.5	0	0	0	111.7	A3 P4 R10	A3-D6 VanDerWaalsContact O-CB 3.29Å; A3-D6 WeakPolarHBondContact O-CB 3.34Å; A3-D6 PolarHBondContact O-N 2.85Å; P4-D6 VanDerWaalsContact C-N 3.31Å; P4-D6 PolarHBondContact O-N 3.25Å; D6-R10 WeakPolarHBondContact O-CB 3.35Å; D6-R10 PolarHBondContact O-N 2.97Å
7	V	83.3	Confident	78.4	Confident	53 Å²	53	78.1 Å²	78.1	32%	0.321	42%	0.416	S	S	.	.	H	α-helix	trans	-71.3	-42.4	175	-178.3	0	0	0	0	111.1	P4 Q5 R10 I11	P4-V7 PolarHBondContact O-N 3.49Å; Q5-V7 VanDerWaalsContact C-N 3.28Å; Q5-V7 PolarHBondContact O-N 3.41Å; V7-R10 PolarHBondContact O-N 3.08Å; V7-I11 HydrophobicContact CG1-CD1 3.94Å; V7-I11 WeakPolarHBondContact O-CG1 3.48Å; V7-I11 PolarHBondContact O-N 3.03Å
8	H	83.8	Confident	79.4	Confident	115 Å²	115	80.3 Å²	80.3	53%	0.532	42%	0.421	S	S	.	.	H	α-helix	trans	-64.8	-43.6	178.8	-77.3	-72.1	0	0	0	112.4	P4 Q5 R10 I11 C12	P4-H8 PolarHBondContact O-CD2 3.11Å; P4-H8 PolarHBondContact O-N 3.14Å; Q5-H8 PolarHBondContact O-N 3.36Å; H8-R10 VanDerWaalsContact C-N 3.3Å; H8-R10 PolarHBondContact O-N 3.43Å; H8-I11 PolarHBondContact O-N 3.42Å; H8-C12 WeakPolarHBondContact O-CB 3.3Å; H8-C12 PolarHBondContact O-N 2.68Å
9	V	86.9	Confident	80.1	Confident	14 Å²	14	77.3 Å²	77.3	9%	0.085	40%	0.404	C	S	.	.	H	α-helix	trans	-57.5	-45.6	174.1	170.5	0	0	0	0	110.7	Q5 I11 C12 N13 L61 L64 L77	Q5-V9 WeakPolarHBondContact O-CG2 3.5Å; Q5-V9 PolarHBondContact O-N 3.38Å; Q5-V9 VanDerWaalsContact O-N 3.12Å; V9-I11 PolarHBondContact O-N 3.38Å; V9-C12 PolarHBondContact O-N 2.97Å; V9-N13 PolarHBondContact O-N 2.86Å; V9-L61 HydrophobicContact CG1-CD1 4.15Å; V9-L64 HydrophobicContact CG2-CB 4.29Å; V9-L64 HydrophobicContact CG2-CD1 4.34Å; V9-L77 HydrophobicContact CG1-CD1 4.42Å; V9-L77 HydrophobicContact CG1-CD2 3.5Å; V9-L77 HydrophobicContact CG2-CD1 4.18Å
10	R	88.6	Confident	80.8	Confident	138 Å²	138	73.9 Å²	73.9	52%	0.521	39%	0.386	S	S	.	.	H	α-helix	trans	-64.5	-41.1	-179.9	-165.4	174.7	70	-145.4	1.8	112.7	D6 V7 H8 N13 Q14	D6-R10 WeakPolarHBondContact O-CB 3.35Å; D6-R10 PolarHBondContact O-N 2.97Å; V7-R10 PolarHBondContact O-N 3.08Å; H8-R10 VanDerWaalsContact C-N 3.3Å; H8-R10 PolarHBondContact O-N 3.43Å; R10-N13 PolarHBondContact O-N 3.31Å; R10-Q14 WeakPolarHBondContact O-CG 3.15Å; R10-Q14 PolarHBondContact O-N 3.36Å
11	I	91.3	Very high	81.4	Confident	76 Å²	76	75.3 Å²	75.3	39%	0.39	39%	0.394	S	S	.	.	H	α-helix	trans	-63	-46.5	175.8	-68.9	166.3	0	0	0	110.1	V7 H8 V9 N13 Q14 E15	V7-I11 HydrophobicContact CG1-CD1 3.94Å; V7-I11 WeakPolarHBondContact O-CG1 3.48Å; V7-I11 PolarHBondContact O-N 3.03Å; H8-I11 PolarHBondContact O-N 3.42Å; V9-I11 PolarHBondContact O-N 3.38Å; I11-N13 PolarHBondContact O-N 3.45Å; I11-Q14 PolarHBondContact O-N 3.43Å; I11-Q14 VanDerWaalsContact O-N 3.17Å; I11-E15 WeakPolarHBondContact O-CG 3.49Å; I11-E15 PolarHBondContact O-N 2.99Å
12	C	91	Very high	84	Confident	8 Å²	8	66.4 Å²	66.4	5%	0.054	35%	0.35	C	S	.	.	H	α-helix	trans	-59.4	-46.2	179.3	-164.2	0	0	0	0	111.4	H8 V9 Q14 E15 I16 R57 L61 L64	H8-C12 WeakPolarHBondContact O-CB 3.3Å; H8-C12 PolarHBondContact O-N 2.68Å; V9-C12 PolarHBondContact O-N 2.97Å; C12-Q14 PolarHBondContact O-N 3.41Å; C12-E15 PolarHBondContact O-N 3.39Å; C12-I16 VanDerWaalsContact O-CG1 3.31Å; C12-I16 WeakPolarHBondContact O-CG1 3.33Å; C12-I16 PolarHBondContact O-N 3.32Å; C12-R57 PolarHBondContact SG-O 3.16Å; C12-L61 HydrophobicContact CB-CD1 4.37Å; C12-L64 HydrophobicContact CB-CD1 4.26Å
13	N	90.4	Very high	86.2	Confident	38 Å²	38	63.3 Å²	63.3	20%	0.203	32%	0.324	C	S	.	.	H	α-helix	trans	-59.9	-41.9	175.1	-80.9	-19.3	0	0	0	112.9	V9 R10 I11 E15 I16 V17 L61	V9-N13 PolarHBondContact O-N 2.86Å; R10-N13 PolarHBondContact O-N 3.31Å; I11-N13 PolarHBondContact O-N 3.45Å; N13-E15 VanDerWaalsContact C-N 3.34Å; N13-E15 PolarHBondContact O-N 3.04Å; N13-I16 PolarHBondContact O-N 3Å; N13-V17 WeakPolarHBondContact O-CG2 3.47Å; N13-V17 PolarHBondContact O-N 3.22Å; N13-L61 WeakPolarHBondContact OD1-CD1 3.48Å; N13-L61 WeakPolarHBondContact OD1-CD2 3.37Å
14	Q	92.8	Very high	87.8	Confident	124 Å²	124	64.9 Å²	64.9	58%	0.579	32%	0.321	S	S	*	.	H	α-helix	trans	-63	-40.7	176.8	-76.2	179.7	-28	0	0	112.2	R10 I11 C12 V17 K18	R10-Q14 WeakPolarHBondContact O-CG 3.15Å; R10-Q14 PolarHBondContact O-N 3.36Å; I11-Q14 PolarHBondContact O-N 3.43Å; I11-Q14 VanDerWaalsContact O-N 3.17Å; C12-Q14 PolarHBondContact O-N 3.41Å; Q14-V17 PolarHBondContact O-N 3.18Å; Q14-K18 WeakPolarHBondContact O-CB 3.17Å; Q14-K18 PolarHBondContact O-N 3.5Å
15	E	93.2	Very high	89.4	Confident	55 Å²	55	62.5 Å²	62.5	26%	0.257	31%	0.31	S	S	.	.	H	α-helix	trans	-67.6	-39.7	176.5	-69.7	-178.7	145.2	0	0	112.1	I11 C12 N13 K18 F19 R57	I11-E15 WeakPolarHBondContact O-CG 3.49Å; I11-E15 PolarHBondContact O-N 2.99Å; C12-E15 PolarHBondContact O-N 3.39Å; N13-E15 VanDerWaalsContact C-N 3.34Å; N13-E15 PolarHBondContact O-N 3.04Å; E15-K18 WeakPolarHBondContact O-CB 3.34Å; E15-K18 PolarHBondContact O-N 3.14Å; E15-F19 HydrophobicContact CB-CE2 4.18Å; E15-F19 WeakPolarHBondContact O-CD2 3.45Å; E15-F19 WeakPolarHBondContact O-CG 3.39Å; E15-F19 PolarHBondContact O-N 3.37Å; E15-R57 HydrophobicContact CB-CG 4.29Å; E15-R57 IonicContact OE1-NH2 2.87Å; E15-R57 PolarHBondContact OE1-NH2 3.04Å; E15-R57 IonicContact OE2-CZ 3.85Å; E15-R57 IonicContact OE2-NE 2.86Å; E15-R57 PolarHBondContact OE2-NE 3.03Å; E15-R57 IonicContact OE2-NH2 2.98Å; E15-R57 PolarHBondContact OE2-NH2 3.47Å
16	I	92.8	Very high	90.7	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-58.1	-50.4	173.6	-70.1	168.3	0	0	0	110.4	C12 N13 K18 F19 D20 L54 R57 I58 L61 H84	C12-I16 VanDerWaalsContact O-CG1 3.31Å; C12-I16 WeakPolarHBondContact O-CG1 3.33Å; C12-I16 PolarHBondContact O-N 3.32Å; N13-I16 PolarHBondContact O-N 3Å; I16-K18 VanDerWaalsContact C-N 3.31Å; I16-K18 PolarHBondContact O-N 2.92Å; I16-F19 PolarHBondContact O-N 3.41Å; I16-D20 WeakPolarHBondContact O-CB 3.45Å; I16-D20 PolarHBondContact O-N 3.02Å; I16-L54 HydrophobicContact CB-CD1 4.31Å; I16-L54 HydrophobicContact CG2-CD1 3.7Å; I16-L54 WeakPolarHBondContact O-CD1 3.5Å; I16-R57 HydrophobicContact CD1-CB 4.34Å; I16-R57 HydrophobicContact CG1-CB 3.56Å; I16-I58 HydrophobicContact CD1-CG1 4.13Å; I16-I58 HydrophobicContact CG1-CG1 4.27Å; I16-I58 HydrophobicContact CG2-CG1 4.29Å; I16-L61 HydrophobicContact CD1-CB 3.98Å; I16-L61 HydrophobicContact CD1-CD2 3.68Å; I16-L61 HydrophobicContact CD1-CG 4.4Å; I16-H84 HydrophobicContact CG2-CB 4.04Å
17	V	94.7	Very high	91.4	Very high	70 Å²	70	55.5 Å²	55.5	42%	0.424	28%	0.275	S	S	.	.	H	α-helix	trans	-61.6	-41.2	178.6	172.8	0	0	0	0	111.1	N13 Q14 D20 L21	N13-V17 WeakPolarHBondContact O-CG2 3.47Å; N13-V17 PolarHBondContact O-N 3.22Å; Q14-V17 PolarHBondContact O-N 3.18Å; V17-D20 PolarHBondContact O-N 3.46Å; V17-L21 HydrophobicContact CG1-CD1 4.11Å; V17-L21 HydrophobicContact CG1-CG 4.49Å; V17-L21 VanDerWaalsContact O-CG 3.31Å; V17-L21 WeakPolarHBondContact O-CG 3.47Å; V17-L21 PolarHBondContact O-N 2.95Å
18	K	95.8	Very high	91.8	Very high	118 Å²	118	56.8 Å²	56.8	51%	0.513	28%	0.277	S	S	.	.	H	α-helix	trans	-58.9	-51	175.8	178.1	-175.8	171	-176.3	0	111.4	Q14 E15 I16 D20 L21 E22	Q14-K18 WeakPolarHBondContact O-CB 3.17Å; Q14-K18 PolarHBondContact O-N 3.5Å; E15-K18 WeakPolarHBondContact O-CB 3.34Å; E15-K18 PolarHBondContact O-N 3.14Å; I16-K18 VanDerWaalsContact C-N 3.31Å; I16-K18 PolarHBondContact O-N 2.92Å; K18-D20 VanDerWaalsContact C-N 3.35Å; K18-D20 PolarHBondContact O-N 2.97Å; K18-L21 PolarHBondContact O-N 2.97Å; K18-E22 WeakPolarHBondContact CE-OE1 3.31Å; K18-E22 WeakPolarHBondContact O-CG 3.33Å; K18-E22 PolarHBondContact O-N 2.94Å
19	F	93.6	Very high	92.1	Very high	22 Å²	22	55.1 Å²	55.1	10%	0.096	27%	0.272	C	S	.	.	H	α-helix	trans	-66.7	-35.8	-179.6	-65.2	-49.6	0	0	0	112.4	E15 I16 L21 E22 V23 K50 Q53 L54 R57	E15-F19 HydrophobicContact CB-CE2 4.18Å; E15-F19 WeakPolarHBondContact O-CD2 3.45Å; E15-F19 WeakPolarHBondContact O-CG 3.39Å; E15-F19 PolarHBondContact O-N 3.37Å; I16-F19 PolarHBondContact O-N 3.41Å; F19-L21 VanDerWaalsContact C-N 3.35Å; F19-L21 PolarHBondContact O-N 3.46Å; F19-E22 PolarHBondContact O-N 3.42Å; F19-V23 WeakPolarHBondContact O-CB 3.35Å; F19-V23 VanDerWaalsContact O-CG2 3.3Å; F19-V23 WeakPolarHBondContact O-CG2 3.45Å; F19-V23 PolarHBondContact O-N 3.29Å; F19-K50 HydrophobicContact CD1-CD 4.3Å; F19-Q53 HydrophobicContact CD1-CB 4.11Å; F19-Q53 HydrophobicContact CD2-CB 4.11Å; F19-Q53 HydrophobicContact CE1-CB 3.98Å; F19-Q53 HydrophobicContact CE1-CG 4.49Å; F19-Q53 HydrophobicContact CE2-CB 3.97Å; F19-Q53 HydrophobicContact CG-CB 4.19Å; F19-Q53 HydrophobicContact CZ-CB 3.9Å; F19-Q53 HydrophobicContact CZ-CG 4.46Å; F19-L54 HydrophobicContact CB-CB 3.92Å; F19-L54 HydrophobicContact CB-CD1 4.19Å; F19-R57 HydrophobicContact CD2-CG 4.09Å; F19-R57 HydrophobicContact CE2-CG 3.78Å
20	D	92.2	Very high	92	Very high	9 Å²	9	54.4 Å²	54.4	5%	0.048	27%	0.268	C	S	.	.	H	α-helix	trans	-60	-43.9	173.4	178.9	78.7	0	0	0	112	I16 V17 K18 V23 K24 N91	I16-D20 WeakPolarHBondContact O-CB 3.45Å; I16-D20 PolarHBondContact O-N 3.02Å; V17-D20 PolarHBondContact O-N 3.46Å; K18-D20 VanDerWaalsContact C-N 3.35Å; K18-D20 PolarHBondContact O-N 2.97Å; D20-V23 PolarHBondContact O-N 2.91Å; D20-K24 WeakPolarHBondContact O-CG 3.29Å; D20-K24 PolarHBondContact O-N 2.98Å; D20-K24 IonicContact OD1-NZ 2.8Å; D20-K24 VanDerWaalsContact OD2-CE 3.24Å; D20-K24 WeakPolarHBondContact OD2-CE 3.4Å; D20-K24 IonicContact OD2-NZ 3.25Å; D20-K24 PolarHBondContact OD2-NZ 3.42Å; D20-N91 PolarHBondContact OD1-ND2 3.26Å
21	L	95.1	Very high	91.8	Very high	104 Å²	104	53.2 Å²	53.2	55%	0.545	26%	0.264	S	S	.	.	H	α-helix	trans	-66.5	-42.8	176.1	-70.1	173.3	0	0	0	112.2	V17 K18 F19 V23 K24 A25	V17-L21 HydrophobicContact CG1-CD1 4.11Å; V17-L21 HydrophobicContact CG1-CG 4.49Å; V17-L21 VanDerWaalsContact O-CG 3.31Å; V17-L21 WeakPolarHBondContact O-CG 3.47Å; V17-L21 PolarHBondContact O-N 2.95Å; K18-L21 PolarHBondContact O-N 2.97Å; F19-L21 VanDerWaalsContact C-N 3.35Å; F19-L21 PolarHBondContact O-N 3.46Å; L21-V23 VanDerWaalsContact C-N 3.34Å; L21-V23 PolarHBondContact O-N 2.94Å; L21-K24 PolarHBondContact O-N 2.94Å; L21-A25 WeakPolarHBondContact O-CB 3.41Å; L21-A25 PolarHBondContact O-N 2.93Å
22	E	94.1	Very high	91.5	Very high	55 Å²	55	54.5 Å²	54.5	26%	0.257	27%	0.271	S	S	.	.	H	α-helix	trans	-61.7	-41.5	175.8	-73	177.1	-172.9	0	0	111.5	K18 F19 A25 L26 K50	K18-E22 WeakPolarHBondContact CE-OE1 3.31Å; K18-E22 WeakPolarHBondContact O-CG 3.33Å; K18-E22 PolarHBondContact O-N 2.94Å; F19-E22 PolarHBondContact O-N 3.42Å; E22-A25 PolarHBondContact O-N 3.08Å; E22-L26 WeakPolarHBondContact O-CG 3.25Å; E22-L26 PolarHBondContact O-N 3.07Å; E22-K50 VanDerWaalsContact OE2-CD 3.26Å; E22-K50 WeakPolarHBondContact OE2-CD 3.28Å; E22-K50 WeakPolarHBondContact OE2-CE 3.41Å; E22-K50 IonicContact OE2-NZ 2.68Å; E22-K50 PolarHBondContact OE2-NZ 2.92Å
23	V	91.9	Very high	90.9	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.9	-47	173.2	165.9	0	0	0	0	110.7	F19 D20 L21 A25 L26 I27 K50 F51 N91	F19-V23 WeakPolarHBondContact O-CB 3.35Å; F19-V23 VanDerWaalsContact O-CG2 3.3Å; F19-V23 WeakPolarHBondContact O-CG2 3.45Å; F19-V23 PolarHBondContact O-N 3.29Å; D20-V23 PolarHBondContact O-N 2.91Å; L21-V23 VanDerWaalsContact C-N 3.34Å; L21-V23 PolarHBondContact O-N 2.94Å; V23-A25 PolarHBondContact O-N 3.13Å; V23-L26 PolarHBondContact O-N 3.28Å; V23-I27 HydrophobicContact CG1-CD1 3.72Å; V23-I27 HydrophobicContact CG1-CG1 4.4Å; V23-I27 WeakPolarHBondContact O-CG1 3.37Å; V23-I27 PolarHBondContact O-N 2.88Å; V23-K50 HydrophobicContact CG2-CB 3.61Å; V23-F51 HydrophobicContact CG1-CD2 4.23Å; V23-F51 HydrophobicContact CG1-CE1 4.09Å; V23-F51 HydrophobicContact CG1-CE2 3.57Å; V23-F51 HydrophobicContact CG1-CZ 3.48Å; V23-F51 VanDerWaalsContact CG1-CZ 3.48Å; V23-F51 HydrophobicContact CG2-CD2 4.34Å; V23-F51 HydrophobicContact CG2-CE2 4.47Å; V23-F51 HydrophobicContact CG2-CG 4.4Å; V23-N91 HydrophobicContact CG1-CB 3.98Å
24	K	93.8	Very high	89.8	Confident	85 Å²	85	57.3 Å²	57.3	37%	0.37	29%	0.294	S	S	.	.	H	α-helix	trans	-62.8	-40.6	179	-75.7	168.8	177	163.6	0	112.5	D20 L21 I27 Q28 N91	D20-K24 WeakPolarHBondContact O-CG 3.29Å; D20-K24 PolarHBondContact O-N 2.98Å; D20-K24 IonicContact OD1-NZ 2.8Å; D20-K24 VanDerWaalsContact OD2-CE 3.24Å; D20-K24 WeakPolarHBondContact OD2-CE 3.4Å; D20-K24 IonicContact OD2-NZ 3.25Å; D20-K24 PolarHBondContact OD2-NZ 3.42Å; L21-K24 PolarHBondContact O-N 2.94Å; K24-I27 PolarHBondContact O-N 2.95Å; K24-Q28 PolarHBondContact O-N 2.9Å; K24-Q28 VanDerWaalsContact O-N 3.08Å; K24-N91 WeakPolarHBondContact CE-OD1 3.33Å
25	A	94.8	Very high	88.4	Confident	50 Å²	50	52.8 Å²	52.8	41%	0.413	28%	0.28	S	S	.	.	H	α-helix	trans	-61.3	-49.2	175.4	0	0	0	0	0	111	L21 E22 V23 I27 Q28 D29	L21-A25 WeakPolarHBondContact O-CB 3.41Å; L21-A25 PolarHBondContact O-N 2.93Å; E22-A25 PolarHBondContact O-N 3.08Å; V23-A25 PolarHBondContact O-N 3.13Å; A25-I27 VanDerWaalsContact C-N 3.3Å; A25-I27 PolarHBondContact O-N 2.91Å; A25-Q28 WeakPolarHBondContact O-CA 3.49Å; A25-Q28 WeakPolarHBondContact O-CB 2.96Å; A25-Q28 PolarHBondContact O-N 3.47Å; A25-D29 PolarHBondContact O-N 3.02Å
26	L	90.6	Very high	87.3	Confident	22 Å²	22	54.1 Å²	54.1	12%	0.115	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-33.6	177.9	-69.9	169.1	0	0	0	113	E22 V23 Q28 D29 I30 L43 K46 V47 K50	E22-L26 WeakPolarHBondContact O-CG 3.25Å; E22-L26 PolarHBondContact O-N 3.07Å; V23-L26 PolarHBondContact O-N 3.28Å; L26-Q28 VanDerWaalsContact C-N 3.27Å; L26-Q28 PolarHBondContact O-N 3.02Å; L26-D29 PolarHBondContact O-N 3.33Å; L26-I30 VanDerWaalsContact O-CG1 3.31Å; L26-I30 WeakPolarHBondContact O-CG1 3.2Å; L26-I30 PolarHBondContact O-N 3.08Å; L26-L43 HydrophobicContact CD2-CD2 4.18Å; L26-K46 HydrophobicContact CD1-CB 4.04Å; L26-K46 HydrophobicContact CD2-CB 4.21Å; L26-V47 HydrophobicContact CB-CG2 3.4Å; L26-V47 VanDerWaalsContact CB-CG2 3.4Å; L26-V47 HydrophobicContact CD1-CG2 4Å; L26-V47 HydrophobicContact CG-CG2 4.3Å; L26-K50 HydrophobicContact CD1-CG 3.84Å
27	I	88.4	Confident	86.3	Confident	8 Å²	8	56.7 Å²	56.7	4%	0.041	31%	0.308	C	S	.	.	H	α-helix	trans	-63.2	-38.2	172.4	-70.2	165.9	0	0	0	110.6	V23 K24 A25 I30 R31 N91 W95 A98	V23-I27 HydrophobicContact CG1-CD1 3.72Å; V23-I27 HydrophobicContact CG1-CG1 4.4Å; V23-I27 WeakPolarHBondContact O-CG1 3.37Å; V23-I27 PolarHBondContact O-N 2.88Å; K24-I27 PolarHBondContact O-N 2.95Å; A25-I27 VanDerWaalsContact C-N 3.3Å; A25-I27 PolarHBondContact O-N 2.91Å; I27-I30 PolarHBondContact O-N 3.35Å; I27-R31 WeakPolarHBondContact O-CG 3.34Å; I27-R31 PolarHBondContact O-N 2.93Å; I27-R31 VanDerWaalsContact O-N 3.12Å; I27-N91 HydrophobicContact CD1-CB 4.11Å; I27-N91 VanDerWaalsContact CD1-O 3.25Å; I27-N91 WeakPolarHBondContact CD1-O 3.37Å; I27-W95 HydrophobicContact CD1-CB 3.79Å; I27-W95 HydrophobicContact CG1-CB 3.74Å; I27-W95 HydrophobicContact CG1-CG 4.25Å; I27-A98 HydrophobicContact CG2-CB 3.96Å
28	Q	92.1	Very high	85.3	Confident	80 Å²	80	57.4 Å²	57.4	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-68.1	-43.8	176.1	-170.8	57.6	33.4	0	0	110.9	K24 A25 L26 I30 R31 D32	K24-Q28 PolarHBondContact O-N 2.9Å; K24-Q28 VanDerWaalsContact O-N 3.08Å; A25-Q28 WeakPolarHBondContact O-CA 3.49Å; A25-Q28 WeakPolarHBondContact O-CB 2.96Å; A25-Q28 PolarHBondContact O-N 3.47Å; L26-Q28 VanDerWaalsContact C-N 3.27Å; L26-Q28 PolarHBondContact O-N 3.02Å; Q28-I30 PolarHBondContact O-N 2.82Å; Q28-R31 WeakPolarHBondContact O-CA 3.26Å; Q28-R31 WeakPolarHBondContact O-CB 3.35Å; Q28-R31 PolarHBondContact O-N 2.91Å; Q28-D32 PolarHBondContact NE2-OD1 3.5Å; Q28-D32 PolarHBondContact NE2-OD2 3.32Å; Q28-D32 PolarHBondContact O-N 3.47Å
29	D	90.2	Very high	84.4	Confident	80 Å²	80	53.4 Å²	53.4	43%	0.428	31%	0.305	S	S	.	.	H	α-helix	trans	-57.2	-38.1	173.7	-62.1	-22.2	0	0	0	111.8	A25 L26 D32 C33 L43	A25-D29 PolarHBondContact O-N 3.02Å; L26-D29 PolarHBondContact O-N 3.33Å; D29-D32 PolarHBondContact O-N 3.36Å; D29-C33 WeakPolarHBondContact O-CB 3.44Å; D29-C33 PolarHBondContact O-N 2.93Å; D29-L43 HydrophobicContact CB-CD1 4.31Å; D29-L43 HydrophobicContact CB-CD2 4.06Å
30	I	84.2	Confident	83.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.2	-37.9	174	-72	169	0	0	0	111.6	L26 I27 Q28 D32 C33 L40 L43 V47 A98 C102	L26-I30 VanDerWaalsContact O-CG1 3.31Å; L26-I30 WeakPolarHBondContact O-CG1 3.2Å; L26-I30 PolarHBondContact O-N 3.08Å; I27-I30 PolarHBondContact O-N 3.35Å; Q28-I30 PolarHBondContact O-N 2.82Å; I30-D32 VanDerWaalsContact C-N 3.33Å; I30-C33 WeakPolarHBondContact O-CB 3.47Å; I30-C33 PolarHBondContact O-N 3Å; I30-L40 HydrophobicContact CG1-CD1 4.29Å; I30-L40 HydrophobicContact CG2-CD1 3.74Å; I30-L43 HydrophobicContact CD1-CB 4.21Å; I30-L43 HydrophobicContact CG1-CB 3.7Å; I30-L43 HydrophobicContact CG1-CD1 4.07Å; I30-L43 HydrophobicContact CG1-CG 4.46Å; I30-V47 HydrophobicContact CD1-CG2 3.75Å; I30-A98 HydrophobicContact CB-CB 4.44Å; I30-A98 HydrophobicContact CG2-CB 3.89Å; I30-C102 HydrophobicContact CG2-CB 4.29Å; I30-C102 VanDerWaalsContact O-CB 3.24Å; I30-C102 WeakPolarHBondContact O-CB 3.04Å; I30-C102 PolarHBondContact O-SG 3.28Å
31	R	83.9	Confident	82.8	Confident	112 Å²	112	55 Å²	55	42%	0.423	32%	0.316	S	S	.	.	H	α-helix	trans	-66.7	-38.2	177.7	-71.8	177.5	176.8	-179.6	0.3	112.1	I27 Q28 C33 A98	I27-R31 WeakPolarHBondContact O-CG 3.34Å; I27-R31 PolarHBondContact O-N 2.93Å; I27-R31 VanDerWaalsContact O-N 3.12Å; Q28-R31 WeakPolarHBondContact O-CA 3.26Å; Q28-R31 WeakPolarHBondContact O-CB 3.35Å; Q28-R31 PolarHBondContact O-N 2.91Å; R31-C33 VanDerWaalsContact C-N 3.32Å; R31-A98 HydrophobicContact CG-CB 3.46Å; R31-A98 VanDerWaalsContact CG-CB 3.46Å
32	D	85.3	Confident	82.1	Confident	103 Å²	103	55.3 Å²	55.3	55%	0.551	32%	0.315	S	S	*	.	H	α-helix	trans	-87.3	-8.3	-176.6	-59.2	-30.1	0	0	0	111.8	Q28 D29 I30 S34	Q28-D32 PolarHBondContact NE2-OD1 3.5Å; Q28-D32 PolarHBondContact NE2-OD2 3.32Å; Q28-D32 PolarHBondContact O-N 3.47Å; D29-D32 PolarHBondContact O-N 3.36Å; I30-D32 VanDerWaalsContact C-N 3.33Å; D32-S34 PolarHBondContact O-N 3.42Å; D32-S34 VanDerWaalsContact O-N 3.08Å; D32-S34 PolarHBondContact O-OG 3.32Å
33	C	78.4	Confident	81.5	Confident	15 Å²	15	54 Å²	54	10%	0.101	31%	0.31	C	S	.	.			trans	-64	110.7	175.4	-178	0	0	0	0	110.8	D29 I30 R31 L43 C102	D29-C33 WeakPolarHBondContact O-CB 3.44Å; D29-C33 PolarHBondContact O-N 2.93Å; I30-C33 WeakPolarHBondContact O-CB 3.47Å; I30-C33 PolarHBondContact O-N 3Å; R31-C33 VanDerWaalsContact C-N 3.32Å; C33-L43 HydrophobicContact CB-CD1 4.2Å; C33-C102 PolarHBondContact O-SG 3.15Å
34	S	67.5	Low	81	Confident	90 Å²	90	54.2 Å²	54.2	63%	0.629	31%	0.311	S	S	*	.			trans	-108.3	4	171.7	-53.4	0	0	0	0	112.3	D32	D32-S34 PolarHBondContact O-N 3.42Å; D32-S34 VanDerWaalsContact O-N 3.08Å; D32-S34 PolarHBondContact O-OG 3.32Å
35	G	64.9	Low	80.3	Confident	29 Å²	29	53.4 Å²	53.4	30%	0.299	31%	0.313	S	S	.	.	S	Bend	trans	-86.2	-178.1	-174.2	0	0	0	0	0	114.1	I106	G35-I106 WeakPolarHBondContact O-CD1 3.41Å; G35-I106 VanDerWaalsContact O-CG1 3.31Å; G35-I106 WeakPolarHBondContact O-CG1 3.37Å
36	P	69.1	Low	79.9	Confident	84 Å²	84	55.1 Å²	55.1	55%	0.545	31%	0.311	S	S	.	.			trans	-63.5	156.3	-176.3	26.7	-34.4	0	0	0	112.1	S38 A39	P36-S38 PolarHBondContact O-N 3.03Å; P36-A39 PolarHBondContact O-N 3.45Å
37	L	72.3	Confident	79.5	Confident	55 Å²	55	54 Å²	54	29%	0.288	31%	0.306	S	S	.	.	H	α-helix	trans	-51.3	-26.5	-177.7	-174.5	64.1	0	0	0	114.3	L40 T41	L37-L40 HydrophobicContact CD1-CD2 4.2Å; L37-L40 PolarHBondContact O-N 3.07Å; L37-T41 WeakPolarHBondContact O-CB 3.32Å; L37-T41 PolarHBondContact O-N 3.46Å; L37-T41 PolarHBondContact O-OG1 2.79Å
38	S	72.4	Confident	79.2	Confident	84 Å²	84	55.6 Å²	55.6	59%	0.587	31%	0.312	S	S	*	.	H	α-helix	trans	-62.6	-43	175.4	54.6	0	0	0	0	113	P36 T41 E42	P36-S38 PolarHBondContact O-N 3.03Å; S38-T41 WeakPolarHBondContact O-CB 3.48Å; S38-T41 PolarHBondContact O-N 3.07Å; S38-E42 PolarHBondContact O-N 3.45Å
39	A	77.5	Confident	78.9	Confident	35 Å²	35	56.3 Å²	56.3	29%	0.289	32%	0.316	S	S	.	.	H	α-helix	trans	-66.7	-41.1	177.8	0	0	0	0	0	111.2	P36 T41 E42 L43	P36-A39 PolarHBondContact O-N 3.45Å; A39-T41 VanDerWaalsContact C-N 3.3Å; A39-T41 PolarHBondContact O-N 3.12Å; A39-E42 PolarHBondContact O-N 2.86Å; A39-L43 WeakPolarHBondContact O-CG 3.35Å; A39-L43 PolarHBondContact O-N 3.38Å
40	L	76.8	Confident	78.8	Confident	2 Å²	2	55 Å²	55	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-60.1	-41.6	172.7	-179.9	59.1	0	0	0	111.2	I30 L37 L43 N44 N99 C102 K103 I106	I30-L40 HydrophobicContact CG1-CD1 4.29Å; I30-L40 HydrophobicContact CG2-CD1 3.74Å; L37-L40 HydrophobicContact CD1-CD2 4.2Å; L37-L40 PolarHBondContact O-N 3.07Å; L40-L43 PolarHBondContact O-N 2.67Å; L40-N44 WeakPolarHBondContact O-CB 3.42Å; L40-N44 PolarHBondContact O-N 2.96Å; L40-N44 PolarHBondContact O-ND2 2.92Å; L40-N99 WeakPolarHBondContact CD1-OD1 3.45Å; L40-C102 HydrophobicContact CD1-CB 4.26Å; L40-C102 HydrophobicContact CD2-CB 4.46Å; L40-K103 HydrophobicContact CD2-CB 4.46Å; L40-I106 HydrophobicContact CB-CD1 4.24Å; L40-I106 HydrophobicContact CD2-CD1 3.98Å
41	T	74.8	Confident	78.9	Confident	61 Å²	61	55.3 Å²	55.3	37%	0.374	31%	0.307	S	S	.	.	H	α-helix	trans	-65.1	-40.8	179	-57.3	0	0	0	0	111.9	L37 S38 A39 N44 T45	L37-T41 WeakPolarHBondContact O-CB 3.32Å; L37-T41 PolarHBondContact O-N 3.46Å; L37-T41 PolarHBondContact O-OG1 2.79Å; S38-T41 WeakPolarHBondContact O-CB 3.48Å; S38-T41 PolarHBondContact O-N 3.07Å; A39-T41 VanDerWaalsContact C-N 3.3Å; A39-T41 PolarHBondContact O-N 3.12Å; T41-N44 PolarHBondContact O-N 3.36Å; T41-T45 PolarHBondContact O-N 2.74Å; T41-T45 VanDerWaalsContact O-N 3.07Å; T41-T45 PolarHBondContact O-OG1 3.3Å; T41-T45 VanDerWaalsContact O-OG1 3.12Å
42	E	80.3	Confident	79	Confident	111 Å²	111	56.6 Å²	56.6	52%	0.519	32%	0.318	S	S	.	.	H	α-helix	trans	-64	-46.7	175.8	-168.2	-168.8	146.8	0	0	112	S38 A39 N44 T45 K46	S38-E42 PolarHBondContact O-N 3.45Å; A39-E42 PolarHBondContact O-N 2.86Å; E42-N44 VanDerWaalsContact C-N 3.28Å; E42-N44 PolarHBondContact O-N 3.37Å; E42-T45 WeakPolarHBondContact O-CB 3.31Å; E42-T45 PolarHBondContact O-N 2.87Å; E42-T45 VanDerWaalsContact O-N 3.14Å; E42-K46 PolarHBondContact O-N 3.18Å; E42-K46 WeakPolarHBondContact OE1-CE 3.24Å; E42-K46 IonicContact OE1-NZ 3.88Å; E42-K46 PolarHBondContact OE1-NZ 2.97Å
43	L	82.8	Confident	79.2	Confident	28 Å²	28	55.3 Å²	55.3	15%	0.147	31%	0.309	C	S	.	.	H	α-helix	trans	-59	-40.5	175.5	-73.6	171.9	0	0	0	111.5	L26 D29 I30 C33 A39 L40 T45 K46 V47	L26-L43 HydrophobicContact CD2-CD2 4.18Å; D29-L43 HydrophobicContact CB-CD1 4.31Å; D29-L43 HydrophobicContact CB-CD2 4.06Å; I30-L43 HydrophobicContact CD1-CB 4.21Å; I30-L43 HydrophobicContact CG1-CB 3.7Å; I30-L43 HydrophobicContact CG1-CD1 4.07Å; I30-L43 HydrophobicContact CG1-CG 4.46Å; C33-L43 HydrophobicContact CB-CD1 4.2Å; A39-L43 WeakPolarHBondContact O-CG 3.35Å; A39-L43 PolarHBondContact O-N 3.38Å; L40-L43 PolarHBondContact O-N 2.67Å; L43-T45 VanDerWaalsContact C-N 3.35Å; L43-T45 PolarHBondContact O-N 2.97Å; L43-K46 PolarHBondContact O-N 3.48Å; L43-V47 WeakPolarHBondContact O-CG2 3.32Å; L43-V47 PolarHBondContact O-N 3.45Å
44	N	81.1	Confident	79.7	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-62.4	-39.7	175.5	-86.1	-67.8	0	0	0	113.2	L40 T41 E42 V47 K48 W95 N99 M149	L40-N44 WeakPolarHBondContact O-CB 3.42Å; L40-N44 PolarHBondContact O-N 2.96Å; L40-N44 PolarHBondContact O-ND2 2.92Å; T41-N44 PolarHBondContact O-N 3.36Å; E42-N44 VanDerWaalsContact C-N 3.28Å; E42-N44 PolarHBondContact O-N 3.37Å; N44-V47 PolarHBondContact O-N 2.67Å; N44-K48 WeakPolarHBondContact O-CG 3.23Å; N44-K48 PolarHBondContact O-N 3.4Å; N44-W95 HydrophobicContact CB-CZ2 4.42Å; N44-W95 VanDerWaalsContact OD1-CE2 3.28Å; N44-W95 WeakPolarHBondContact OD1-CZ2 3.44Å; N44-W95 PolarHBondContact OD1-NE1 2.91Å; N44-N99 VanDerWaalsContact CG-OD1 3.27Å; N44-N99 PolarHBondContact ND2-OD1 2.76Å; N44-N99 VanDerWaalsContact OD1-CG 3.25Å; N44-N99 PolarHBondContact OD1-ND2 3.48Å; N44-N99 PolarHBondContact OD1-OD1 2.95Å; N44-M149 HydrophobicContact CB-CE 4.41Å
45	T	79.9	Confident	80.6	Confident	69 Å²	69	52.9 Å²	52.9	42%	0.423	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-46.3	175.6	-58	0	0	0	0	110.7	T41 E42 L43 V47 K48 E49	T41-T45 PolarHBondContact O-N 2.74Å; T41-T45 VanDerWaalsContact O-N 3.07Å; T41-T45 PolarHBondContact O-OG1 3.3Å; T41-T45 VanDerWaalsContact O-OG1 3.12Å; E42-T45 WeakPolarHBondContact O-CB 3.31Å; E42-T45 PolarHBondContact O-N 2.87Å; E42-T45 VanDerWaalsContact O-N 3.14Å; L43-T45 VanDerWaalsContact C-N 3.35Å; L43-T45 PolarHBondContact O-N 2.97Å; T45-V47 PolarHBondContact O-N 2.99Å; T45-K48 WeakPolarHBondContact O-CB 3.4Å; T45-K48 PolarHBondContact O-N 2.97Å; T45-K48 VanDerWaalsContact O-N 3.15Å; T45-E49 PolarHBondContact O-N 3.36Å
46	K	84.6	Confident	81.7	Confident	85 Å²	85	56.2 Å²	56.2	37%	0.37	29%	0.292	S	S	.	.	H	α-helix	trans	-58.8	-44.9	175.8	-71.4	171.5	173.1	166.5	0	112	L26 E42 L43 K48 E49 K50	L26-K46 HydrophobicContact CD1-CB 4.04Å; L26-K46 HydrophobicContact CD2-CB 4.21Å; E42-K46 PolarHBondContact O-N 3.18Å; E42-K46 WeakPolarHBondContact OE1-CE 3.24Å; E42-K46 IonicContact OE1-NZ 3.88Å; E42-K46 PolarHBondContact OE1-NZ 2.97Å; L43-K46 PolarHBondContact O-N 3.48Å; K46-K48 VanDerWaalsContact C-N 3.31Å; K46-K48 PolarHBondContact O-N 3.48Å; K46-E49 PolarHBondContact O-N 3.39Å; K46-K50 WeakPolarHBondContact O-CG 3.45Å; K46-K50 PolarHBondContact O-N 2.99Å
47	V	82.5	Confident	82.7	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.4	-43.2	176.5	172.2	0	0	0	0	111.3	L26 I30 L43 N44 T45 K50 F51 W95	L26-V47 HydrophobicContact CB-CG2 3.4Å; L26-V47 VanDerWaalsContact CB-CG2 3.4Å; L26-V47 HydrophobicContact CD1-CG2 4Å; L26-V47 HydrophobicContact CG-CG2 4.3Å; I30-V47 HydrophobicContact CD1-CG2 3.75Å; L43-V47 WeakPolarHBondContact O-CG2 3.32Å; L43-V47 PolarHBondContact O-N 3.45Å; N44-V47 PolarHBondContact O-N 2.67Å; T45-V47 PolarHBondContact O-N 2.99Å; V47-K50 PolarHBondContact O-N 3.22Å; V47-F51 HydrophobicContact CG1-CD2 3.47Å; V47-F51 VanDerWaalsContact CG1-CD2 3.47Å; V47-F51 HydrophobicContact CG1-CE2 3.48Å; V47-F51 VanDerWaalsContact CG1-CE2 3.48Å; V47-F51 WeakPolarHBondContact O-CD2 3.37Å; V47-F51 PolarHBondContact O-N 3.33Å; V47-W95 HydrophobicContact CB-CZ2 4.46Å; V47-W95 HydrophobicContact CG1-CD2 3.81Å; V47-W95 HydrophobicContact CG1-CG 3.86Å; V47-W95 HydrophobicContact CG1-CZ2 4.18Å
48	K	81.8	Confident	83.5	Confident	40 Å²	40	53 Å²	53	17%	0.174	27%	0.265	C	S	.	.	H	α-helix	trans	-61.8	-46	178.2	-73.4	174.8	-177.1	-177.9	0	112.2	N44 T45 K46 K50 F51 Q52 W95	N44-K48 WeakPolarHBondContact O-CG 3.23Å; N44-K48 PolarHBondContact O-N 3.4Å; T45-K48 WeakPolarHBondContact O-CB 3.4Å; T45-K48 PolarHBondContact O-N 2.97Å; T45-K48 VanDerWaalsContact O-N 3.15Å; K46-K48 VanDerWaalsContact C-N 3.31Å; K46-K48 PolarHBondContact O-N 3.48Å; K48-K50 VanDerWaalsContact C-N 3.3Å; K48-K50 PolarHBondContact O-N 2.88Å; K48-F51 PolarHBondContact O-N 2.89Å; K48-Q52 WeakPolarHBondContact O-CG 3.41Å; K48-Q52 PolarHBondContact O-N 3.37Å; K48-W95 HydrophobicContact CG-CH2 3.94Å; K48-W95 HydrophobicContact CG-CZ2 4.2Å
49	E	86.3	Confident	84.3	Confident	96 Å²	96	52.8 Å²	52.8	45%	0.449	25%	0.254	S	S	.	.	H	α-helix	trans	-58.2	-44.1	176.6	-70.8	173.7	-177.8	0	0	111.2	T45 K46 Q52 Q53	T45-E49 PolarHBondContact O-N 3.36Å; K46-E49 PolarHBondContact O-N 3.39Å; E49-Q52 WeakPolarHBondContact O-CB 3.46Å; E49-Q52 PolarHBondContact O-N 3.49Å; E49-Q53 WeakPolarHBondContact O-CG 3.39Å; E49-Q53 PolarHBondContact O-N 3.35Å
50	K	89.1	Confident	84.9	Confident	51 Å²	51	53 Å²	53	22%	0.222	25%	0.25	C	S	.	.	H	α-helix	trans	-67.1	-38.4	177.6	-62.8	-55.2	-179.4	170	0	113.1	F19 E22 V23 L26 K46 V47 K48 Q52 Q53 L54	F19-K50 HydrophobicContact CD1-CD 4.3Å; E22-K50 VanDerWaalsContact OE2-CD 3.26Å; E22-K50 WeakPolarHBondContact OE2-CD 3.28Å; E22-K50 WeakPolarHBondContact OE2-CE 3.41Å; E22-K50 IonicContact OE2-NZ 2.68Å; E22-K50 PolarHBondContact OE2-NZ 2.92Å; V23-K50 HydrophobicContact CG2-CB 3.61Å; L26-K50 HydrophobicContact CD1-CG 3.84Å; K46-K50 WeakPolarHBondContact O-CG 3.45Å; K46-K50 PolarHBondContact O-N 2.99Å; V47-K50 PolarHBondContact O-N 3.22Å; K48-K50 VanDerWaalsContact C-N 3.3Å; K48-K50 PolarHBondContact O-N 2.88Å; K50-Q52 VanDerWaalsContact C-N 3.33Å; K50-Q52 PolarHBondContact O-N 3.38Å; K50-Q53 PolarHBondContact O-N 3.47Å; K50-L54 VanDerWaalsContact O-CB 3.31Å; K50-L54 WeakPolarHBondContact O-CB 3.42Å; K50-L54 PolarHBondContact O-N 3.26Å
51	F	85.5	Confident	85.5	Confident	8 Å²	8	52.9 Å²	52.9	4%	0.035	25%	0.25	C	C	.	.	H	α-helix	trans	-62.4	-38.9	171.5	-92.1	-67.3	0	0	0	112.6	V23 V47 K48 R55 M88 N91 Q92 W95	V23-F51 HydrophobicContact CG1-CD2 4.23Å; V23-F51 HydrophobicContact CG1-CE1 4.09Å; V23-F51 HydrophobicContact CG1-CE2 3.57Å; V23-F51 HydrophobicContact CG1-CZ 3.48Å; V23-F51 VanDerWaalsContact CG1-CZ 3.48Å; V23-F51 HydrophobicContact CG2-CD2 4.34Å; V23-F51 HydrophobicContact CG2-CE2 4.47Å; V23-F51 HydrophobicContact CG2-CG 4.4Å; V47-F51 HydrophobicContact CG1-CD2 3.47Å; V47-F51 VanDerWaalsContact CG1-CD2 3.47Å; V47-F51 HydrophobicContact CG1-CE2 3.48Å; V47-F51 VanDerWaalsContact CG1-CE2 3.48Å; V47-F51 WeakPolarHBondContact O-CD2 3.37Å; V47-F51 PolarHBondContact O-N 3.33Å; K48-F51 PolarHBondContact O-N 2.89Å; F51-R55 WeakPolarHBondContact O-CB 3.44Å; F51-R55 PolarHBondContact O-N 3.42Å; F51-M88 HydrophobicContact CD1-CG 3.68Å; F51-M88 HydrophobicContact CD1-SD 4.31Å; F51-M88 HydrophobicContact CE1-CG 3.64Å; F51-M88 WeakPolarHBondContact CE1-O 3.47Å; F51-N91 HydrophobicContact CE1-CB 4.23Å; F51-N91 HydrophobicContact CZ-CB 3.86Å; F51-Q92 HydrophobicContact CE1-CB 4.44Å; F51-Q92 HydrophobicContact CZ-CB 4.18Å; F51-W95 HydrophobicContact CE2-CD2 4.47Å; F51-W95 HydrophobicContact CE2-CE3 4.37Å
52	Q	86.3	Confident	86.1	Confident	138 Å²	138	50.8 Å²	50.8	65%	0.645	24%	0.236	S	C	*	.	H	α-helix	trans	-65.1	-43.1	175.9	-73.4	178.9	-18.8	0	0	111.7	K48 E49 K50 R55 H56	K48-Q52 WeakPolarHBondContact O-CG 3.41Å; K48-Q52 PolarHBondContact O-N 3.37Å; E49-Q52 WeakPolarHBondContact O-CB 3.46Å; E49-Q52 PolarHBondContact O-N 3.49Å; K50-Q52 VanDerWaalsContact C-N 3.33Å; K50-Q52 PolarHBondContact O-N 3.38Å; Q52-R55 WeakPolarHBondContact O-CB 3.41Å; Q52-R55 PolarHBondContact O-N 2.97Å; Q52-H56 PolarHBondContact O-N 2.99Å
53	Q	89.2	Confident	86.5	Confident	77 Å²	77	51 Å²	51	36%	0.36	24%	0.237	S	C	.	.	H	α-helix	trans	-62.5	-47.4	175.4	-70.9	173.3	-0.4	0	0	111.6	F19 E49 K50 R55 H56 R57	F19-Q53 HydrophobicContact CD1-CB 4.11Å; F19-Q53 HydrophobicContact CD2-CB 4.11Å; F19-Q53 HydrophobicContact CE1-CB 3.98Å; F19-Q53 HydrophobicContact CE1-CG 4.49Å; F19-Q53 HydrophobicContact CE2-CB 3.97Å; F19-Q53 HydrophobicContact CG-CB 4.19Å; F19-Q53 HydrophobicContact CZ-CB 3.9Å; F19-Q53 HydrophobicContact CZ-CG 4.46Å; E49-Q53 WeakPolarHBondContact O-CG 3.39Å; E49-Q53 PolarHBondContact O-N 3.35Å; K50-Q53 PolarHBondContact O-N 3.47Å; Q53-R55 VanDerWaalsContact C-N 3.33Å; Q53-R55 PolarHBondContact O-N 3.42Å; Q53-H56 PolarHBondContact O-N 3.35Å; Q53-R57 PolarHBondContact O-N 2.98Å
54	L	89.3	Confident	86.6	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-57	-47.1	175.6	177.7	58	0	0	0	111.5	I16 F19 K50 H56 R57 I58 M88	I16-L54 HydrophobicContact CB-CD1 4.31Å; I16-L54 HydrophobicContact CG2-CD1 3.7Å; I16-L54 WeakPolarHBondContact O-CD1 3.5Å; F19-L54 HydrophobicContact CB-CB 3.92Å; F19-L54 HydrophobicContact CB-CD1 4.19Å; K50-L54 VanDerWaalsContact O-CB 3.31Å; K50-L54 WeakPolarHBondContact O-CB 3.42Å; K50-L54 PolarHBondContact O-N 3.26Å; L54-H56 PolarHBondContact O-N 3.35Å; L54-R57 PolarHBondContact O-N 3.08Å; L54-I58 HydrophobicContact CD1-CD1 4Å; L54-I58 HydrophobicContact CD1-CG1 4.34Å; L54-I58 HydrophobicContact CG-CD1 3.97Å; L54-I58 VanDerWaalsContact O-CG1 3.3Å; L54-I58 WeakPolarHBondContact O-CG1 3.41Å; L54-I58 PolarHBondContact O-N 2.9Å; L54-M88 HydrophobicContact CD2-CB 4.13Å; L54-M88 HydrophobicContact CD2-CG 3.83Å; L54-M88 HydrophobicContact CD2-SD 4.17Å; L54-M88 HydrophobicContact CG-CG 4.42Å; L54-M88 HydrophobicContact CG-SD 4.12Å
55	R	86.9	Confident	86.8	Confident	51 Å²	51	51.4 Å²	51.4	19%	0.192	24%	0.239	C	C	.	.	H	α-helix	trans	-57.8	-48.6	177.3	179.7	-172.1	174.2	133.1	8.4	111.9	F51 Q52 Q53 R57 I58 Q59 M88 A159 L163	F51-R55 WeakPolarHBondContact O-CB 3.44Å; F51-R55 PolarHBondContact O-N 3.42Å; Q52-R55 WeakPolarHBondContact O-CB 3.41Å; Q52-R55 PolarHBondContact O-N 2.97Å; Q53-R55 VanDerWaalsContact C-N 3.33Å; Q53-R55 PolarHBondContact O-N 3.42Å; R55-R57 VanDerWaalsContact C-N 3.33Å; R55-R57 PolarHBondContact O-N 2.93Å; R55-I58 PolarHBondContact O-N 2.9Å; R55-Q59 WeakPolarHBondContact O-CG 3.32Å; R55-Q59 PolarHBondContact O-N 3.45Å; R55-M88 HydrophobicContact CB-SD 4.29Å; R55-A159 VanDerWaalsContact CZ-O 3.22Å; R55-A159 PolarHBondContact NH1-O 3.33Å; R55-A159 PolarHBondContact NH2-O 3.47Å; R55-L163 HydrophobicContact CG-CD1 3.31Å
56	H	88.3	Confident	86.9	Confident	100 Å²	100	53.9 Å²	53.9	46%	0.463	24%	0.244	S	C	.	.	H	α-helix	trans	-61	-44.2	-178.8	-175.3	47.8	0	0	0	110.8	Q52 Q53 L54 I58 Q59 D60	Q52-H56 PolarHBondContact O-N 2.99Å; Q53-H56 PolarHBondContact O-N 3.35Å; L54-H56 PolarHBondContact O-N 3.35Å; H56-I58 PolarHBondContact O-N 3.41Å; H56-Q59 WeakPolarHBondContact O-CB 3.35Å; H56-Q59 PolarHBondContact O-N 3.44Å; H56-Q59 VanDerWaalsContact O-N 3.09Å; H56-D60 IonicContact CD2-OD2 3.48Å; H56-D60 IonicContact CE1-OD1 3.9Å; H56-D60 PolarHBondContact CE1-OD1 3.13Å; H56-D60 IonicContact ND1-OD1 3.88Å; H56-D60 IonicContact NE2-OD1 2.66Å; H56-D60 IonicContact NE2-OD2 2.66Å; H56-D60 PolarHBondContact O-N 2.91Å
57	R	89.6	Confident	86.9	Confident	71 Å²	71	54.3 Å²	54.3	27%	0.268	25%	0.247	S	C	.	.	H	α-helix	trans	-65.3	-36.7	176.5	-65.7	-46.7	-162.1	-169.8	7.9	114	C12 E15 I16 F19 Q53 L54 R55 Q59 D60 L61	C12-R57 PolarHBondContact SG-O 3.16Å; E15-R57 HydrophobicContact CB-CG 4.29Å; E15-R57 IonicContact OE1-NH2 2.87Å; E15-R57 PolarHBondContact OE1-NH2 3.04Å; E15-R57 IonicContact OE2-CZ 3.85Å; E15-R57 IonicContact OE2-NE 2.86Å; E15-R57 PolarHBondContact OE2-NE 3.03Å; E15-R57 IonicContact OE2-NH2 2.98Å; E15-R57 PolarHBondContact OE2-NH2 3.47Å; I16-R57 HydrophobicContact CD1-CB 4.34Å; I16-R57 HydrophobicContact CG1-CB 3.56Å; F19-R57 HydrophobicContact CD2-CG 4.09Å; F19-R57 HydrophobicContact CE2-CG 3.78Å; Q53-R57 PolarHBondContact O-N 2.98Å; L54-R57 PolarHBondContact O-N 3.08Å; R55-R57 VanDerWaalsContact C-N 3.33Å; R55-R57 PolarHBondContact O-N 2.93Å; R57-Q59 VanDerWaalsContact C-N 3.26Å; R57-Q59 PolarHBondContact O-N 3.31Å; R57-D60 WeakPolarHBondContact CD-OD2 3.32Å; R57-D60 IonicContact CZ-OD2 2.67Å; R57-D60 IonicContact NH1-OD2 3.17Å; R57-D60 PolarHBondContact NH1-OD2 3.19Å; R57-D60 PolarHBondContact O-N 3.49Å; R57-L61 WeakPolarHBondContact O-CB 3.43Å; R57-L61 PolarHBondContact O-N 3.12Å
58	I	89.2	Confident	86.7	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-62	-37.8	172.9	-70.1	169.3	0	0	0	110.8	I16 L54 R55 H56 E62 V81 H84 K85 M88	I16-I58 HydrophobicContact CD1-CG1 4.13Å; I16-I58 HydrophobicContact CG1-CG1 4.27Å; I16-I58 HydrophobicContact CG2-CG1 4.29Å; L54-I58 HydrophobicContact CD1-CD1 4Å; L54-I58 HydrophobicContact CD1-CG1 4.34Å; L54-I58 HydrophobicContact CG-CD1 3.97Å; L54-I58 VanDerWaalsContact O-CG1 3.3Å; L54-I58 WeakPolarHBondContact O-CG1 3.41Å; L54-I58 PolarHBondContact O-N 2.9Å; R55-I58 PolarHBondContact O-N 2.9Å; H56-I58 PolarHBondContact O-N 3.41Å; I58-E62 PolarHBondContact O-N 2.66Å; I58-V81 HydrophobicContact CG2-CG1 4.11Å; I58-H84 HydrophobicContact CD1-CB 4Å; I58-H84 HydrophobicContact CG1-CB 4.03Å; I58-K85 HydrophobicContact CG2-CD 4.29Å; I58-K85 HydrophobicContact CG2-CG 3.62Å; I58-M88 HydrophobicContact CD1-CB 4.44Å; I58-M88 HydrophobicContact CD1-CE 4.39Å; I58-M88 HydrophobicContact CD1-SD 3.99Å
59	Q	88.8	Confident	86.5	Confident	78 Å²	78	61.1 Å²	61.1	36%	0.364	29%	0.285	S	S	.	.	H	α-helix	trans	-68.4	-41.6	175.2	-69.1	175.7	-39.4	0	0	112	R55 H56 R57 L61 E62 Q63 L163	R55-Q59 WeakPolarHBondContact O-CG 3.32Å; R55-Q59 PolarHBondContact O-N 3.45Å; H56-Q59 WeakPolarHBondContact O-CB 3.35Å; H56-Q59 PolarHBondContact O-N 3.44Å; H56-Q59 VanDerWaalsContact O-N 3.09Å; R57-Q59 VanDerWaalsContact C-N 3.26Å; R57-Q59 PolarHBondContact O-N 3.31Å; Q59-L61 VanDerWaalsContact C-N 3.33Å; Q59-L61 PolarHBondContact O-N 3.32Å; Q59-E62 WeakPolarHBondContact O-CB 3.38Å; Q59-E62 PolarHBondContact O-N 2.87Å; Q59-Q63 PolarHBondContact O-N 3.35Å; Q59-L163 HydrophobicContact CG-CD2 4.16Å
60	D	89.8	Confident	86.3	Confident	39 Å²	39	62.3 Å²	62.3	21%	0.209	29%	0.288	C	S	.	.	H	α-helix	trans	-58.5	-45.8	174.2	-65	-15.3	0	0	0	110.6	H56 R57 E62 Q63 L64	H56-D60 IonicContact CD2-OD2 3.48Å; H56-D60 IonicContact CE1-OD1 3.9Å; H56-D60 PolarHBondContact CE1-OD1 3.13Å; H56-D60 IonicContact ND1-OD1 3.88Å; H56-D60 IonicContact NE2-OD1 2.66Å; H56-D60 IonicContact NE2-OD2 2.66Å; H56-D60 PolarHBondContact O-N 2.91Å; R57-D60 WeakPolarHBondContact CD-OD2 3.32Å; R57-D60 IonicContact CZ-OD2 2.67Å; R57-D60 IonicContact NH1-OD2 3.17Å; R57-D60 PolarHBondContact NH1-OD2 3.19Å; R57-D60 PolarHBondContact O-N 3.49Å; D60-E62 VanDerWaalsContact C-N 3.32Å; D60-E62 PolarHBondContact O-N 2.87Å; D60-Q63 PolarHBondContact O-N 3.17Å; D60-L64 WeakPolarHBondContact O-CG 3.3Å; D60-L64 PolarHBondContact O-N 2.94Å
61	L	88.8	Confident	85.8	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-39.1	176.7	-174.2	68.5	0	0	0	112	V9 C12 N13 I16 R57 Q59 Q63 L64 A65 V81	V9-L61 HydrophobicContact CG1-CD1 4.15Å; C12-L61 HydrophobicContact CB-CD1 4.37Å; N13-L61 WeakPolarHBondContact OD1-CD1 3.48Å; N13-L61 WeakPolarHBondContact OD1-CD2 3.37Å; I16-L61 HydrophobicContact CD1-CB 3.98Å; I16-L61 HydrophobicContact CD1-CD2 3.68Å; I16-L61 HydrophobicContact CD1-CG 4.4Å; R57-L61 WeakPolarHBondContact O-CB 3.43Å; R57-L61 PolarHBondContact O-N 3.12Å; Q59-L61 VanDerWaalsContact C-N 3.33Å; Q59-L61 PolarHBondContact O-N 3.32Å; L61-Q63 VanDerWaalsContact C-N 3.33Å; L61-L64 PolarHBondContact O-N 3.48Å; L61-A65 WeakPolarHBondContact O-CB 3.48Å; L61-A65 PolarHBondContact O-N 2.86Å; L61-V81 HydrophobicContact CB-CG2 4.05Å; L61-V81 HydrophobicContact CD2-CG2 3.58Å; L61-V81 HydrophobicContact CG-CG2 3.6Å
62	E	88.4	Confident	85.5	Confident	18 Å²	18	67.1 Å²	67.1	8%	0.084	32%	0.32	C	S	.	.	H	α-helix	trans	-64.7	-37.7	175.6	-165.4	-173.7	138.9	0	0	112	I58 Q59 D60 A65 K66 L78 V81 K85 I170	I58-E62 PolarHBondContact O-N 2.66Å; Q59-E62 WeakPolarHBondContact O-CB 3.38Å; Q59-E62 PolarHBondContact O-N 2.87Å; D60-E62 VanDerWaalsContact C-N 3.32Å; D60-E62 PolarHBondContact O-N 2.87Å; E62-A65 PolarHBondContact O-N 3.35Å; E62-K66 WeakPolarHBondContact O-CG 3.07Å; E62-K66 PolarHBondContact O-N 3.41Å; E62-K66 VanDerWaalsContact O-N 3.16Å; E62-K66 WeakPolarHBondContact OE1-CE 3.42Å; E62-K66 IonicContact OE1-NZ 3.53Å; E62-K66 PolarHBondContact OE1-NZ 3.26Å; E62-L78 HydrophobicContact CG-CD2 4.27Å; E62-V81 HydrophobicContact CB-CG1 4.04Å; E62-V81 HydrophobicContact CB-CG2 4.24Å; E62-V81 HydrophobicContact CG-CG1 4.19Å; E62-K85 IonicContact OE2-NZ 3.67Å; E62-K85 PolarHBondContact OE2-NZ 3.38Å; E62-I170 VanDerWaalsContact OE1-CD1 3.28Å; E62-I170 WeakPolarHBondContact OE1-CD1 3.31Å
63	Q	87.4	Confident	85.2	Confident	115 Å²	115	63.6 Å²	63.6	54%	0.537	30%	0.304	S	S	.	.	H	α-helix	trans	-66.8	-47	174.3	-176.8	177.5	-21.5	0	0	111.2	Q59 D60 L61 A65 K66 E67	Q59-Q63 PolarHBondContact O-N 3.35Å; D60-Q63 PolarHBondContact O-N 3.17Å; L61-Q63 VanDerWaalsContact C-N 3.33Å; Q63-A65 PolarHBondContact O-N 2.98Å; Q63-K66 WeakPolarHBondContact O-CB 3.13Å; Q63-K66 PolarHBondContact O-N 3.05Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.4Å; Q63-E67 PolarHBondContact NE2-OE1 3.24Å; Q63-E67 WeakPolarHBondContact O-CG 3.35Å; Q63-E67 PolarHBondContact O-N 2.92Å
64	L	85.7	Confident	84.9	Confident	40 Å²	40	62.4 Å²	62.4	21%	0.209	30%	0.298	C	S	.	.	H	α-helix	trans	-58	-37.6	175.4	-68.9	172.1	0	0	0	111.7	V9 C12 D60 L61 K66 E67 Q68	V9-L64 HydrophobicContact CG2-CB 4.29Å; V9-L64 HydrophobicContact CG2-CD1 4.34Å; C12-L64 HydrophobicContact CB-CD1 4.26Å; D60-L64 WeakPolarHBondContact O-CG 3.3Å; D60-L64 PolarHBondContact O-N 2.94Å; L61-L64 PolarHBondContact O-N 3.48Å; L64-K66 VanDerWaalsContact C-N 3.34Å; L64-K66 PolarHBondContact O-N 3.31Å; L64-E67 PolarHBondContact O-N 3.11Å; L64-Q68 PolarHBondContact O-N 2.96Å
65	A	84.8	Confident	84.5	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.7	-37.9	174.7	0	0	0	0	0	112.5	L61 E62 Q63 E67 Q68 K74 L77 L78	L61-A65 WeakPolarHBondContact O-CB 3.48Å; L61-A65 PolarHBondContact O-N 2.86Å; E62-A65 PolarHBondContact O-N 3.35Å; Q63-A65 PolarHBondContact O-N 2.98Å; A65-E67 VanDerWaalsContact C-N 3.35Å; A65-Q68 WeakPolarHBondContact O-CB 3.47Å; A65-Q68 PolarHBondContact O-N 3.45Å; A65-K74 WeakPolarHBondContact O-CG 3.33Å; A65-L77 HydrophobicContact CB-CB 3.61Å; A65-L77 HydrophobicContact CB-CD1 4.44Å; A65-L78 HydrophobicContact CB-CD2 3.85Å; A65-L78 HydrophobicContact CB-CG 4.04Å
66	K	82	Confident	84.3	Confident	121 Å²	121	67.7 Å²	67.7	53%	0.526	33%	0.328	S	S	.	.	H	α-helix	trans	-71.7	-28.2	178.2	-72	170.1	-173.4	165.5	0	113	E62 Q63 L64 Q68	E62-K66 WeakPolarHBondContact O-CG 3.07Å; E62-K66 PolarHBondContact O-N 3.41Å; E62-K66 VanDerWaalsContact O-N 3.16Å; E62-K66 WeakPolarHBondContact OE1-CE 3.42Å; E62-K66 IonicContact OE1-NZ 3.53Å; E62-K66 PolarHBondContact OE1-NZ 3.26Å; Q63-K66 WeakPolarHBondContact O-CB 3.13Å; Q63-K66 PolarHBondContact O-N 3.05Å; L64-K66 VanDerWaalsContact C-N 3.34Å; L64-K66 PolarHBondContact O-N 3.31Å; K66-Q68 VanDerWaalsContact C-N 3.25Å; K66-Q68 PolarHBondContact O-N 3.32Å
67	E	84.6	Confident	84.2	Confident	94 Å²	94	64.2 Å²	64.2	44%	0.439	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-5.5	177.5	-68.3	172	-172.1	0	0	113.1	Q63 L64 A65 D69	Q63-E67 WeakPolarHBondContact CG-OE1 3.4Å; Q63-E67 PolarHBondContact NE2-OE1 3.24Å; Q63-E67 WeakPolarHBondContact O-CG 3.35Å; Q63-E67 PolarHBondContact O-N 2.92Å; L64-E67 PolarHBondContact O-N 3.11Å; A65-E67 VanDerWaalsContact C-N 3.35Å; E67-D69 PolarHBondContact O-N 3.46Å
68	Q	79.4	Confident	84	Confident	33 Å²	33	62 Å²	62	15%	0.154	31%	0.305	C	S	.	.			trans	-77.7	121.9	-177.2	-164.2	64.8	14.7	0	0	112.5	L64 A65 K66 K70 E73 K74	L64-Q68 PolarHBondContact O-N 2.96Å; A65-Q68 WeakPolarHBondContact O-CB 3.47Å; A65-Q68 PolarHBondContact O-N 3.45Å; K66-Q68 VanDerWaalsContact C-N 3.25Å; K66-Q68 PolarHBondContact O-N 3.32Å; Q68-K70 PolarHBondContact O-N 2.97Å; Q68-E73 HydrophobicContact CG-CB 3.82Å; Q68-E73 PolarHBondContact NE2-OE2 3.44Å; Q68-K74 HydrophobicContact CB-CB 4.13Å
69	D	76.7	Confident	83.8	Confident	151 Å²	151	67.1 Å²	67.1	81%	0.807	33%	0.329	S	S	*	.	S	Bend	trans	-68.3	-31.9	-177.7	-67.1	-43.2	0	0	0	113.8	E67	E67-D69 PolarHBondContact O-N 3.46Å
70	K	81.9	Confident	83.8	Confident	120 Å²	120	66.9 Å²	66.9	52%	0.522	33%	0.328	S	S	.	.			trans	-88.3	113.2	179.6	-71.1	175.6	-170.5	169.6	0	110.3	Q68 S72 E73 K74	Q68-K70 PolarHBondContact O-N 2.97Å; K70-S72 PolarHBondContact O-N 3.44Å; K70-S72 VanDerWaalsContact O-N 3.13Å; K70-E73 HydrophobicContact CB-CB 4.2Å; K70-E73 HydrophobicContact CB-CG 4.24Å; K70-E73 VanDerWaalsContact CD-CD 3.42Å; K70-E73 HydrophobicContact CD-CG 4.28Å; K70-E73 WeakPolarHBondContact CD-OE1 3.21Å; K70-E73 WeakPolarHBondContact CD-OE2 3.41Å; K70-E73 IonicContact NZ-OE1 3.91Å; K70-E73 PolarHBondContact NZ-OE1 3.36Å; K70-E73 IonicContact NZ-OE2 2.92Å; K70-E73 PolarHBondContact O-N 3.43Å; K70-K74 PolarHBondContact O-N 3.28Å
71	E	79.2	Confident	83.7	Confident	81 Å²	81	65 Å²	65	38%	0.379	32%	0.319	S	S	.	.	H	α-helix	trans	-55.4	-34.1	179.9	-173.2	57.5	-148	0	0	113.3	K74 Q75	E71-K74 IonicContact OE1-NZ 3.67Å; E71-K74 IonicContact OE2-NZ 2.68Å; E71-K74 PolarHBondContact OE2-NZ 2.93Å; E71-Q75 VanDerWaalsContact O-CG 3.32Å; E71-Q75 WeakPolarHBondContact O-CG 3.31Å; E71-Q75 PolarHBondContact O-N 2.96Å; E71-Q75 PolarHBondContact OE1-NE2 2.91Å
72	S	79.4	Confident	83.6	Confident	79 Å²	79	65.8 Å²	65.8	55%	0.552	32%	0.322	S	S	*	.	H	α-helix	trans	-66.7	-39.7	175.9	55.9	0	0	0	0	113.4	K70 L76	K70-S72 PolarHBondContact O-N 3.44Å; K70-S72 VanDerWaalsContact O-N 3.13Å; S72-L76 WeakPolarHBondContact O-CG 3.38Å; S72-L76 PolarHBondContact O-N 2.9Å
73	E	79.1	Confident	83.5	Confident	65 Å²	65	67.8 Å²	67.8	30%	0.304	33%	0.333	S	S	.	.	H	α-helix	trans	-75.7	-39.2	179.8	-69.6	171.9	-168.2	0	0	110.3	Q68 K70 Q75 L76 L77	Q68-E73 HydrophobicContact CG-CB 3.82Å; Q68-E73 PolarHBondContact NE2-OE2 3.44Å; K70-E73 HydrophobicContact CB-CB 4.2Å; K70-E73 HydrophobicContact CB-CG 4.24Å; K70-E73 VanDerWaalsContact CD-CD 3.42Å; K70-E73 HydrophobicContact CD-CG 4.28Å; K70-E73 WeakPolarHBondContact CD-OE1 3.21Å; K70-E73 WeakPolarHBondContact CD-OE2 3.41Å; K70-E73 IonicContact NZ-OE1 3.91Å; K70-E73 PolarHBondContact NZ-OE1 3.36Å; K70-E73 IonicContact NZ-OE2 2.92Å; K70-E73 PolarHBondContact O-N 3.43Å; E73-Q75 PolarHBondContact O-N 3.17Å; E73-L76 PolarHBondContact O-N 2.99Å; E73-L77 WeakPolarHBondContact O-CG 3.25Å; E73-L77 PolarHBondContact O-N 2.94Å
74	K	83.4	Confident	83.7	Confident	51 Å²	51	62.7 Å²	62.7	22%	0.222	31%	0.31	C	S	.	.	H	α-helix	trans	-53.8	-48.8	170.3	171.8	170.3	161.5	-147.4	0	112.4	A65 Q68 K70 E71 L76 L77 L78	A65-K74 WeakPolarHBondContact O-CG 3.33Å; Q68-K74 HydrophobicContact CB-CB 4.13Å; K70-K74 PolarHBondContact O-N 3.28Å; E71-K74 IonicContact OE1-NZ 3.67Å; E71-K74 IonicContact OE2-NZ 2.68Å; E71-K74 PolarHBondContact OE2-NZ 2.93Å; K74-L76 VanDerWaalsContact C-N 3.34Å; K74-L76 PolarHBondContact O-N 2.88Å; K74-L77 PolarHBondContact O-N 2.79Å; K74-L78 HydrophobicContact CG-CD1 4.02Å; K74-L78 WeakPolarHBondContact O-CB 3.46Å; K74-L78 WeakPolarHBondContact O-CG 3.15Å; K74-L78 PolarHBondContact O-N 3.1Å
75	Q	80.3	Confident	83.7	Confident	52 Å²	52	61.3 Å²	61.3	24%	0.243	30%	0.302	C	S	.	.	H	α-helix	trans	-63.7	-38.6	179.8	-75.5	-177.8	7.5	0	0	112.8	E71 E73 Q79	E71-Q75 VanDerWaalsContact O-CG 3.32Å; E71-Q75 WeakPolarHBondContact O-CG 3.31Å; E71-Q75 PolarHBondContact O-N 2.96Å; E71-Q75 PolarHBondContact OE1-NE2 2.91Å; E73-Q75 PolarHBondContact O-N 3.17Å; Q75-Q79 WeakPolarHBondContact O-CB 3.36Å; Q75-Q79 PolarHBondContact O-N 2.93Å
76	L	84.5	Confident	83.7	Confident	113 Å²	113	67.1 Å²	67.1	59%	0.592	33%	0.327	S	S	*	.	H	α-helix	trans	-64	-44.9	175.6	-70.6	171	0	0	0	111.5	S72 E73 K74 Q79 E80	S72-L76 WeakPolarHBondContact O-CG 3.38Å; S72-L76 PolarHBondContact O-N 2.9Å; E73-L76 PolarHBondContact O-N 2.99Å; K74-L76 VanDerWaalsContact C-N 3.34Å; K74-L76 PolarHBondContact O-N 2.88Å; L76-Q79 WeakPolarHBondContact O-CB 3.28Å; L76-Q79 PolarHBondContact O-N 2.89Å; L76-E80 PolarHBondContact O-N 2.91Å
77	L	85.3	Confident	83.9	Confident	27 Å²	27	65.4 Å²	65.4	14%	0.141	32%	0.321	C	S	.	.	H	α-helix	trans	-66.4	-41	178.5	-67.4	176.2	0	0	0	112.4	V9 A65 E73 K74 Q79 E80 V81	V9-L77 HydrophobicContact CG1-CD1 4.42Å; V9-L77 HydrophobicContact CG1-CD2 3.5Å; V9-L77 HydrophobicContact CG2-CD1 4.18Å; A65-L77 HydrophobicContact CB-CB 3.61Å; A65-L77 HydrophobicContact CB-CD1 4.44Å; E73-L77 WeakPolarHBondContact O-CG 3.25Å; E73-L77 PolarHBondContact O-N 2.94Å; K74-L77 PolarHBondContact O-N 2.79Å; L77-Q79 VanDerWaalsContact C-N 3.29Å; L77-Q79 PolarHBondContact O-N 3.03Å; L77-E80 PolarHBondContact O-N 2.93Å; L77-E80 VanDerWaalsContact O-N 3.14Å; L77-V81 WeakPolarHBondContact O-CG2 3.48Å; L77-V81 PolarHBondContact O-N 3.49Å
78	L	85.1	Confident	84	Confident	23 Å²	23	61.2 Å²	61.2	12%	0.12	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-37.4	174.3	-71.8	175.2	0	0	0	111.9	E62 A65 K74 E80 V81 E82	E62-L78 HydrophobicContact CG-CD2 4.27Å; A65-L78 HydrophobicContact CB-CD2 3.85Å; A65-L78 HydrophobicContact CB-CG 4.04Å; K74-L78 HydrophobicContact CG-CD1 4.02Å; K74-L78 WeakPolarHBondContact O-CB 3.46Å; K74-L78 WeakPolarHBondContact O-CG 3.15Å; K74-L78 PolarHBondContact O-N 3.1Å; L78-E80 VanDerWaalsContact C-N 3.32Å; L78-V81 PolarHBondContact O-N 3.01Å; L78-E82 WeakPolarHBondContact O-CG 3.24Å; L78-E82 PolarHBondContact O-N 3.05Å
79	Q	85.6	Confident	84	Confident	109 Å²	109	62.3 Å²	62.3	51%	0.509	31%	0.308	S	S	.	.	H	α-helix	trans	-64.1	-38.5	173.6	-175.2	177.6	-0.7	0	0	112	Q75 L76 L77 E82 N83	Q75-Q79 WeakPolarHBondContact O-CB 3.36Å; Q75-Q79 PolarHBondContact O-N 2.93Å; L76-Q79 WeakPolarHBondContact O-CB 3.28Å; L76-Q79 PolarHBondContact O-N 2.89Å; L77-Q79 VanDerWaalsContact C-N 3.29Å; L77-Q79 PolarHBondContact O-N 3.03Å; Q79-E82 WeakPolarHBondContact O-CB 3.36Å; Q79-E82 PolarHBondContact O-N 2.9Å; Q79-N83 PolarHBondContact O-N 3.29Å
80	E	87.9	Confident	84.2	Confident	73 Å²	73	58.4 Å²	58.4	34%	0.341	29%	0.293	S	S	.	.	H	α-helix	trans	-67.8	-42	177.1	-166	61.2	-165.7	0	0	112	L76 L77 L78 E82 N83 H84	L76-E80 PolarHBondContact O-N 2.91Å; L77-E80 PolarHBondContact O-N 2.93Å; L77-E80 VanDerWaalsContact O-N 3.14Å; L78-E80 VanDerWaalsContact C-N 3.32Å; E80-E82 VanDerWaalsContact C-N 3.26Å; E80-E82 PolarHBondContact O-N 3.41Å; E80-N83 WeakPolarHBondContact O-CB 3.34Å; E80-N83 PolarHBondContact O-N 3.47Å; E80-N83 VanDerWaalsContact O-N 3.09Å; E80-N83 PolarHBondContact OE2-ND2 3.47Å; E80-H84 PolarHBondContact O-CD2 3.28Å; E80-H84 PolarHBondContact O-N 3Å; E80-H84 IonicContact OE1-CE1 3.98Å; E80-H84 IonicContact OE1-NE2 3.85Å
81	V	88.6	Confident	84.1	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-53.8	-45.6	170.9	169.1	0	0	0	0	110.7	I58 L61 E62 L77 L78 N83 H84 K85	I58-V81 HydrophobicContact CG2-CG1 4.11Å; L61-V81 HydrophobicContact CB-CG2 4.05Å; L61-V81 HydrophobicContact CD2-CG2 3.58Å; L61-V81 HydrophobicContact CG-CG2 3.6Å; E62-V81 HydrophobicContact CB-CG1 4.04Å; E62-V81 HydrophobicContact CB-CG2 4.24Å; E62-V81 HydrophobicContact CG-CG1 4.19Å; L77-V81 WeakPolarHBondContact O-CG2 3.48Å; L77-V81 PolarHBondContact O-N 3.49Å; L78-V81 PolarHBondContact O-N 3.01Å; V81-N83 PolarHBondContact O-N 3.41Å; V81-H84 PolarHBondContact O-N 3.48Å; V81-K85 HydrophobicContact CG1-CD 4.17Å; V81-K85 WeakPolarHBondContact O-CG 3.43Å; V81-K85 PolarHBondContact O-N 2.79Å
82	E	85.8	Confident	84	Confident	16 Å²	16	49.8 Å²	49.8	8%	0.075	25%	0.254	C	S	.	.	H	α-helix	trans	-63.5	-39.1	177.5	-74	-58.7	123.1	0	0	112.7	L78 Q79 E80 K85 K86 S167 L171	L78-E82 WeakPolarHBondContact O-CG 3.24Å; L78-E82 PolarHBondContact O-N 3.05Å; Q79-E82 WeakPolarHBondContact O-CB 3.36Å; Q79-E82 PolarHBondContact O-N 2.9Å; E80-E82 VanDerWaalsContact C-N 3.26Å; E80-E82 PolarHBondContact O-N 3.41Å; E82-K85 PolarHBondContact O-N 3.01Å; E82-K85 IonicContact OE1-NZ 3.78Å; E82-K86 WeakPolarHBondContact O-CG 3.38Å; E82-K86 PolarHBondContact O-N 3.48Å; E82-S167 WeakPolarHBondContact OE1-CB 3.45Å; E82-S167 PolarHBondContact OE1-OG 3.14Å; E82-S167 PolarHBondContact OE2-OG 3.36Å; E82-L171 HydrophobicContact CG-CD2 4.29Å
83	N	87.9	Confident	83.7	Confident	60 Å²	60	50.2 Å²	50.2	32%	0.321	25%	0.254	S	S	.	.	H	α-helix	trans	-62.2	-46.4	175.2	-71.4	-20.4	0	0	0	111.3	Q79 E80 V81 K85 K86 Q87	Q79-N83 PolarHBondContact O-N 3.29Å; E80-N83 WeakPolarHBondContact O-CB 3.34Å; E80-N83 PolarHBondContact O-N 3.47Å; E80-N83 VanDerWaalsContact O-N 3.09Å; E80-N83 PolarHBondContact OE2-ND2 3.47Å; V81-N83 PolarHBondContact O-N 3.41Å; N83-K85 PolarHBondContact O-N 3.34Å; N83-K86 PolarHBondContact O-N 2.66Å; N83-Q87 WeakPolarHBondContact O-CG 3.21Å; N83-Q87 PolarHBondContact O-N 3Å
84	H	90.3	Very high	83.6	Confident	8 Å²	8	48.9 Å²	48.9	4%	0.037	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-40	177.7	-70.1	-45.8	0	0	0	112.6	I16 I58 E80 V81 K86 Q87 M88	I16-H84 HydrophobicContact CG2-CB 4.04Å; I58-H84 HydrophobicContact CD1-CB 4Å; I58-H84 HydrophobicContact CG1-CB 4.03Å; E80-H84 PolarHBondContact O-CD2 3.28Å; E80-H84 PolarHBondContact O-N 3Å; E80-H84 IonicContact OE1-CE1 3.98Å; E80-H84 IonicContact OE1-NE2 3.85Å; V81-H84 PolarHBondContact O-N 3.48Å; H84-K86 PolarHBondContact O-N 3.4Å; H84-Q87 PolarHBondContact O-N 2.94Å; H84-M88 WeakPolarHBondContact O-CB 3.49Å; H84-M88 PolarHBondContact O-N 3.36Å
85	K	85.8	Confident	83.5	Confident	10 Å²	10	46.6 Å²	46.6	4%	0.043	24%	0.242	C	C	.	.	H	α-helix	trans	-60.6	-43.6	173.9	-72.7	176.9	-177.6	171	0	111.9	I58 E62 V81 E82 N83 M88 L89 S167	I58-K85 HydrophobicContact CG2-CD 4.29Å; I58-K85 HydrophobicContact CG2-CG 3.62Å; E62-K85 IonicContact OE2-NZ 3.67Å; E62-K85 PolarHBondContact OE2-NZ 3.38Å; V81-K85 HydrophobicContact CG1-CD 4.17Å; V81-K85 WeakPolarHBondContact O-CG 3.43Å; V81-K85 PolarHBondContact O-N 2.79Å; E82-K85 PolarHBondContact O-N 3.01Å; E82-K85 IonicContact OE1-NZ 3.78Å; N83-K85 PolarHBondContact O-N 3.34Å; K85-M88 PolarHBondContact O-N 2.89Å; K85-L89 WeakPolarHBondContact O-CG 3.39Å; K85-L89 PolarHBondContact O-N 3.2Å; K85-L89 VanDerWaalsContact O-N 3.11Å; K85-S167 WeakPolarHBondContact CD-OG 3.36Å; K85-S167 WeakPolarHBondContact CE-OG 3.32Å; K85-S167 PolarHBondContact NZ-OG 2.97Å
86	K	85.9	Confident	83	Confident	123 Å²	123	47.8 Å²	47.8	54%	0.535	24%	0.244	S	C	.	.	H	α-helix	trans	-62.3	-42.3	175.7	-72.6	171.7	-175.5	171.8	0	112.2	E82 N83 H84 L89 S90	E82-K86 WeakPolarHBondContact O-CG 3.38Å; E82-K86 PolarHBondContact O-N 3.48Å; N83-K86 PolarHBondContact O-N 2.66Å; H84-K86 PolarHBondContact O-N 3.4Å; K86-L89 PolarHBondContact O-N 3.34Å; K86-S90 PolarHBondContact O-N 3.06Å
87	Q	86.3	Confident	82.5	Confident	85 Å²	85	49.3 Å²	49.3	40%	0.397	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-44.9	176	-73.1	179.3	-20.3	0	0	111.6	N83 H84 L89 S90 N91	N83-Q87 WeakPolarHBondContact O-CG 3.21Å; N83-Q87 PolarHBondContact O-N 3Å; H84-Q87 PolarHBondContact O-N 2.94Å; Q87-L89 VanDerWaalsContact C-N 3.32Å; Q87-L89 PolarHBondContact O-N 2.93Å; Q87-S90 WeakPolarHBondContact O-CB 3.48Å; Q87-S90 PolarHBondContact O-N 3.13Å; Q87-S90 VanDerWaalsContact O-N 3.15Å; Q87-N91 PolarHBondContact O-N 3.03Å; Q87-N91 PolarHBondContact O-OD1 3.48Å
88	M	84.9	Confident	81.8	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.025	24%	0.24	C	C	.	.	H	α-helix	trans	-57.2	-42.8	176.5	-172	175.9	65.7	0	0	112	F51 L54 R55 I58 H84 K85 N91 Q92 M160	F51-M88 HydrophobicContact CD1-CG 3.68Å; F51-M88 HydrophobicContact CD1-SD 4.31Å; F51-M88 HydrophobicContact CE1-CG 3.64Å; F51-M88 WeakPolarHBondContact CE1-O 3.47Å; L54-M88 HydrophobicContact CD2-CB 4.13Å; L54-M88 HydrophobicContact CD2-CG 3.83Å; L54-M88 HydrophobicContact CD2-SD 4.17Å; L54-M88 HydrophobicContact CG-CG 4.42Å; L54-M88 HydrophobicContact CG-SD 4.12Å; R55-M88 HydrophobicContact CB-SD 4.29Å; I58-M88 HydrophobicContact CD1-CB 4.44Å; I58-M88 HydrophobicContact CD1-CE 4.39Å; I58-M88 HydrophobicContact CD1-SD 3.99Å; H84-M88 WeakPolarHBondContact O-CB 3.49Å; H84-M88 PolarHBondContact O-N 3.36Å; K85-M88 PolarHBondContact O-N 2.89Å; M88-N91 PolarHBondContact O-N 3.09Å; M88-Q92 PolarHBondContact O-N 2.98Å; M88-M160 HydrophobicContact CE-SD 3.73Å; M88-M160 HydrophobicContact CG-SD 4.31Å; M88-M160 HydrophobicContact SD-SD 4.01Å
89	L	80.8	Confident	81.2	Confident	56 Å²	56	48 Å²	48	29%	0.293	24%	0.24	S	C	.	.	H	α-helix	trans	-66	-40.1	176.1	-67.5	171.2	0	0	0	113.1	K85 K86 Q87 N91 Q92 T93 V164	K85-L89 WeakPolarHBondContact O-CG 3.39Å; K85-L89 PolarHBondContact O-N 3.2Å; K85-L89 VanDerWaalsContact O-N 3.11Å; K86-L89 PolarHBondContact O-N 3.34Å; Q87-L89 VanDerWaalsContact C-N 3.32Å; Q87-L89 PolarHBondContact O-N 2.93Å; L89-N91 VanDerWaalsContact C-N 3.34Å; L89-Q92 WeakPolarHBondContact O-CB 3.29Å; L89-Q92 PolarHBondContact O-N 3.47Å; L89-T93 PolarHBondContact O-N 3.43Å; L89-T93 PolarHBondContact O-OG1 3.47Å; L89-T93 VanDerWaalsContact O-OG1 3.08Å; L89-V164 HydrophobicContact CD1-CG2 3.75Å; L89-V164 HydrophobicContact CD2-CG2 3.73Å; L89-V164 HydrophobicContact CG-CG2 4.21Å
90	S	80.7	Confident	80.5	Confident	70 Å²	70	48 Å²	48	49%	0.49	24%	0.243	S	C	.	.	H	α-helix	trans	-62.3	-43.8	175.3	-174.8	0	0	0	0	111.4	K86 Q87 Q92 T93 S94	K86-S90 PolarHBondContact O-N 3.06Å; Q87-S90 WeakPolarHBondContact O-CB 3.48Å; Q87-S90 PolarHBondContact O-N 3.13Å; Q87-S90 VanDerWaalsContact O-N 3.15Å; S90-Q92 VanDerWaalsContact C-N 3.33Å; S90-Q92 PolarHBondContact O-N 3.05Å; S90-T93 PolarHBondContact O-N 3.4Å; S90-S94 PolarHBondContact O-N 2.91Å; S90-S94 PolarHBondContact O-OG 3.37Å; S90-S94 VanDerWaalsContact O-OG 3.07Å
91	N	79.4	Confident	79.8	Confident	9 Å²	9	48.5 Å²	48.5	5%	0.048	25%	0.25	C	S	.	.	H	α-helix	trans	-62.9	-39.7	175.4	-67.7	-7.1	0	0	0	111.5	D20 V23 K24 I27 F51 Q87 M88 L89 T93 S94 W95	D20-N91 PolarHBondContact OD1-ND2 3.26Å; V23-N91 HydrophobicContact CG1-CB 3.98Å; K24-N91 WeakPolarHBondContact CE-OD1 3.33Å; I27-N91 HydrophobicContact CD1-CB 4.11Å; I27-N91 VanDerWaalsContact CD1-O 3.25Å; I27-N91 WeakPolarHBondContact CD1-O 3.37Å; F51-N91 HydrophobicContact CE1-CB 4.23Å; F51-N91 HydrophobicContact CZ-CB 3.86Å; Q87-N91 PolarHBondContact O-N 3.03Å; Q87-N91 PolarHBondContact O-OD1 3.48Å; M88-N91 PolarHBondContact O-N 3.09Å; L89-N91 VanDerWaalsContact C-N 3.34Å; N91-T93 VanDerWaalsContact C-N 3.34Å; N91-T93 PolarHBondContact O-N 3.36Å; N91-S94 CarbonylContact O-C 3.59Å; N91-S94 WeakPolarHBondContact O-CB 3.28Å; N91-S94 PolarHBondContact O-N 3.43Å; N91-W95 WeakPolarHBondContact O-CB 3.43Å; N91-W95 PolarHBondContact O-N 3.08Å
92	Q	77.1	Confident	79.1	Confident	10 Å²	10	48.5 Å²	48.5	5%	0.047	25%	0.251	C	S	.	.	H	α-helix	trans	-60.9	-44.4	176.3	-175.1	-169.6	16.9	0	0	111.7	F51 M88 L89 S90 S94 W95 R96 M160	F51-Q92 HydrophobicContact CE1-CB 4.44Å; F51-Q92 HydrophobicContact CZ-CB 4.18Å; M88-Q92 PolarHBondContact O-N 2.98Å; L89-Q92 WeakPolarHBondContact O-CB 3.29Å; L89-Q92 PolarHBondContact O-N 3.47Å; S90-Q92 VanDerWaalsContact C-N 3.33Å; S90-Q92 PolarHBondContact O-N 3.05Å; Q92-S94 VanDerWaalsContact C-N 3.29Å; Q92-S94 PolarHBondContact O-N 3.28Å; Q92-W95 WeakPolarHBondContact O-CB 3.49Å; Q92-W95 PolarHBondContact O-N 2.86Å; Q92-R96 WeakPolarHBondContact O-CG 3.3Å; Q92-R96 PolarHBondContact O-N 3.36Å; Q92-M160 HydrophobicContact CB-CE 4.06Å; Q92-M160 HydrophobicContact CG-CE 3.8Å; Q92-M160 VanDerWaalsContact NE2-CE 3.26Å
93	T	73.9	Confident	78.3	Confident	88 Å²	88	49.7 Å²	49.7	54%	0.54	26%	0.256	S	S	.	.	H	α-helix	trans	-61.7	-42.1	176.5	-55.8	0	0	0	0	110.7	L89 S90 N91 R96 K97	L89-T93 PolarHBondContact O-N 3.43Å; L89-T93 PolarHBondContact O-OG1 3.47Å; L89-T93 VanDerWaalsContact O-OG1 3.08Å; S90-T93 PolarHBondContact O-N 3.4Å; N91-T93 VanDerWaalsContact C-N 3.34Å; N91-T93 PolarHBondContact O-N 3.36Å; T93-R96 PolarHBondContact O-N 3.25Å; T93-K97 PolarHBondContact O-N 3.38Å; T93-K97 VanDerWaalsContact O-N 3.1Å
94	S	76.4	Confident	77.5	Confident	38 Å²	38	50.9 Å²	50.9	27%	0.266	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-39.7	176.6	-63.1	0	0	0	0	112.7	S90 N91 Q92 K97 A98	S90-S94 PolarHBondContact O-N 2.91Å; S90-S94 PolarHBondContact O-OG 3.37Å; S90-S94 VanDerWaalsContact O-OG 3.07Å; N91-S94 CarbonylContact O-C 3.59Å; N91-S94 WeakPolarHBondContact O-CB 3.28Å; N91-S94 PolarHBondContact O-N 3.43Å; Q92-S94 VanDerWaalsContact C-N 3.29Å; Q92-S94 PolarHBondContact O-N 3.28Å; S94-K97 PolarHBondContact O-N 3.39Å; S94-A98 WeakPolarHBondContact O-CB 3.45Å; S94-A98 PolarHBondContact O-N 3.33Å
95	W	80.3	Confident	76.7	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.008	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-43.4	175.5	176.3	52.7	0	0	0	112.2	I27 N44 V47 K48 F51 N91 Q92 A98 N99 V153	I27-W95 HydrophobicContact CD1-CB 3.79Å; I27-W95 HydrophobicContact CG1-CB 3.74Å; I27-W95 HydrophobicContact CG1-CG 4.25Å; N44-W95 HydrophobicContact CB-CZ2 4.42Å; N44-W95 VanDerWaalsContact OD1-CE2 3.28Å; N44-W95 WeakPolarHBondContact OD1-CZ2 3.44Å; N44-W95 PolarHBondContact OD1-NE1 2.91Å; V47-W95 HydrophobicContact CB-CZ2 4.46Å; V47-W95 HydrophobicContact CG1-CD2 3.81Å; V47-W95 HydrophobicContact CG1-CG 3.86Å; V47-W95 HydrophobicContact CG1-CZ2 4.18Å; K48-W95 HydrophobicContact CG-CH2 3.94Å; K48-W95 HydrophobicContact CG-CZ2 4.2Å; F51-W95 HydrophobicContact CE2-CD2 4.47Å; F51-W95 HydrophobicContact CE2-CE3 4.37Å; N91-W95 WeakPolarHBondContact O-CB 3.43Å; N91-W95 PolarHBondContact O-N 3.08Å; Q92-W95 WeakPolarHBondContact O-CB 3.49Å; Q92-W95 PolarHBondContact O-N 2.86Å; W95-A98 PolarHBondContact O-N 3.27Å; W95-N99 VanDerWaalsContact CE2-ND2 3.33Å; W95-N99 PolarHBondContact NE1-ND2 3.42Å; W95-N99 WeakPolarHBondContact O-CB 3.31Å; W95-N99 PolarHBondContact O-N 3.37Å; W95-N99 PolarHBondContact O-ND2 3.12Å; W95-N99 VanDerWaalsContact O-ND2 3.1Å; W95-V153 HydrophobicContact CH2-CG2 4.2Å; W95-V153 HydrophobicContact CZ3-CG1 4.41Å
96	R	71.1	Confident	76.1	Confident	77 Å²	77	52.2 Å²	52.2	29%	0.291	28%	0.275	S	S	.	.	H	α-helix	trans	-60.6	-46.9	174.9	-73.5	177	178.8	165.3	0.6	112.1	Q92 T93 N99 L100 V153 E157	Q92-R96 WeakPolarHBondContact O-CG 3.3Å; Q92-R96 PolarHBondContact O-N 3.36Å; T93-R96 PolarHBondContact O-N 3.25Å; R96-N99 PolarHBondContact O-N 3.31Å; R96-L100 PolarHBondContact O-N 3.28Å; R96-V153 HydrophobicContact CG-CG1 4.34Å; R96-E157 IonicContact CZ-OE1 3.68Å; R96-E157 VanDerWaalsContact CZ-OE1 3.25Å; R96-E157 IonicContact CZ-OE2 2.82Å; R96-E157 IonicContact NH1-OE1 2.78Å; R96-E157 PolarHBondContact NH1-OE1 3.43Å; R96-E157 IonicContact NH1-OE2 2.75Å; R96-E157 VanDerWaalsContact NH2-CG 3.35Å; R96-E157 IonicContact NH2-OE1 3.95Å; R96-E157 PolarHBondContact NH2-OE1 3Å; R96-E157 IonicContact NH2-OE2 2.74Å; R96-E157 PolarHBondContact NH2-OE2 2.91Å
97	K	73.6	Confident	75.3	Confident	146 Å²	146	49.1 Å²	49.1	64%	0.635	26%	0.264	S	S	*	.	H	α-helix	trans	-61.4	-46.6	178.6	-172.5	177.5	179.8	-179.6	0	111	T93 S94 N99 L100 T101	T93-K97 PolarHBondContact O-N 3.38Å; T93-K97 VanDerWaalsContact O-N 3.1Å; S94-K97 PolarHBondContact O-N 3.39Å; K97-N99 PolarHBondContact O-N 3Å; K97-L100 PolarHBondContact O-N 3.31Å; K97-T101 PolarHBondContact O-N 3.3Å; K97-T101 PolarHBondContact O-OG1 3.32Å; K97-T101 VanDerWaalsContact O-OG1 3.13Å
98	A	71.3	Confident	74.7	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-58	-47.5	177	0	0	0	0	0	112	I27 I30 R31 S94 W95 L100 T101 C102	I27-A98 HydrophobicContact CG2-CB 3.96Å; I30-A98 HydrophobicContact CB-CB 4.44Å; I30-A98 HydrophobicContact CG2-CB 3.89Å; R31-A98 HydrophobicContact CG-CB 3.46Å; R31-A98 VanDerWaalsContact CG-CB 3.46Å; S94-A98 WeakPolarHBondContact O-CB 3.45Å; S94-A98 PolarHBondContact O-N 3.33Å; W95-A98 PolarHBondContact O-N 3.27Å; A98-L100 PolarHBondContact O-N 2.93Å; A98-T101 PolarHBondContact O-N 3.13Å; A98-C102 WeakPolarHBondContact O-CB 3.14Å; A98-C102 PolarHBondContact O-N 2.98Å
99	N	72	Confident	74.3	Confident	22 Å²	22	53.3 Å²	53.3	12%	0.118	29%	0.288	C	S	.	.	H	α-helix	trans	-58.8	-46	177	-94.7	-61.8	0	0	0	113.4	L40 N44 W95 R96 K97 K103	L40-N99 WeakPolarHBondContact CD1-OD1 3.45Å; N44-N99 VanDerWaalsContact CG-OD1 3.27Å; N44-N99 PolarHBondContact ND2-OD1 2.76Å; N44-N99 VanDerWaalsContact OD1-CG 3.25Å; N44-N99 PolarHBondContact OD1-ND2 3.48Å; N44-N99 PolarHBondContact OD1-OD1 2.95Å; W95-N99 VanDerWaalsContact CE2-ND2 3.33Å; W95-N99 PolarHBondContact NE1-ND2 3.42Å; W95-N99 WeakPolarHBondContact O-CB 3.31Å; W95-N99 PolarHBondContact O-N 3.37Å; W95-N99 PolarHBondContact O-ND2 3.12Å; W95-N99 VanDerWaalsContact O-ND2 3.1Å; R96-N99 PolarHBondContact O-N 3.31Å; K97-N99 PolarHBondContact O-N 3Å; N99-K103 VanDerWaalsContact O-CB 3.23Å; N99-K103 WeakPolarHBondContact O-CB 3.48Å; N99-K103 PolarHBondContact O-N 3.22Å
100	L	70.4	Confident	73.8	Confident	109 Å²	109	54.6 Å²	54.6	57%	0.571	29%	0.293	S	S	*	.	H	α-helix	trans	-63.3	-44.9	179.8	-178	62.5	0	0	0	110.9	R96 K97 A98 K103 I104	R96-L100 PolarHBondContact O-N 3.28Å; K97-L100 PolarHBondContact O-N 3.31Å; A98-L100 PolarHBondContact O-N 2.93Å; L100-K103 PolarHBondContact O-N 3.41Å; L100-I104 HydrophobicContact CD1-CD1 4.11Å; L100-I104 HydrophobicContact CD1-CG1 4.45Å; L100-I104 HydrophobicContact CG-CD1 3.97Å; L100-I104 VanDerWaalsContact O-CG1 3.28Å; L100-I104 WeakPolarHBondContact O-CG1 3.46Å; L100-I104 PolarHBondContact O-N 3.5Å
101	T	72.6	Confident	73.4	Confident	82 Å²	82	57.5 Å²	57.5	50%	0.503	30%	0.297	S	S	.	.	H	α-helix	trans	-62.4	-48.5	178.1	-61.2	0	0	0	0	111.9	K97 A98 K103 I104 A105	K97-T101 PolarHBondContact O-N 3.3Å; K97-T101 PolarHBondContact O-OG1 3.32Å; K97-T101 VanDerWaalsContact O-OG1 3.13Å; A98-T101 PolarHBondContact O-N 3.13Å; T101-K103 VanDerWaalsContact C-N 3.33Å; T101-K103 PolarHBondContact O-N 2.88Å; T101-I104 PolarHBondContact O-N 2.96Å; T101-A105 PolarHBondContact O-N 3.34Å
102	C	74.1	Confident	73.1	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.014	31%	0.314	C	S	.	.	H	α-helix	trans	-59.1	-44.8	177.2	179.2	0	0	0	0	111.3	I30 C33 L40 A98 I104 A105 I106	I30-C102 HydrophobicContact CG2-CB 4.29Å; I30-C102 VanDerWaalsContact O-CB 3.24Å; I30-C102 WeakPolarHBondContact O-CB 3.04Å; I30-C102 PolarHBondContact O-SG 3.28Å; C33-C102 PolarHBondContact O-SG 3.15Å; L40-C102 HydrophobicContact CD1-CB 4.26Å; L40-C102 HydrophobicContact CD2-CB 4.46Å; A98-C102 WeakPolarHBondContact O-CB 3.14Å; A98-C102 PolarHBondContact O-N 2.98Å; C102-I104 PolarHBondContact O-N 2.68Å; C102-A105 WeakPolarHBondContact O-CB 3.35Å; C102-A105 PolarHBondContact O-N 2.91Å; C102-A105 VanDerWaalsContact O-N 3.13Å; C102-I106 WeakPolarHBondContact O-CG1 3.45Å; C102-I106 PolarHBondContact O-N 2.93Å
103	K	69.3	Low	72.9	Confident	41 Å²	41	65.3 Å²	65.3	18%	0.178	34%	0.341	C	S	.	.	H	α-helix	trans	-61.3	-46.3	178.3	-171.9	173.2	-175.5	173.8	0	112.7	L40 N99 L100 T101 A105 I106 D107 S146	L40-K103 HydrophobicContact CD2-CB 4.46Å; N99-K103 VanDerWaalsContact O-CB 3.23Å; N99-K103 WeakPolarHBondContact O-CB 3.48Å; N99-K103 PolarHBondContact O-N 3.22Å; L100-K103 PolarHBondContact O-N 3.41Å; T101-K103 VanDerWaalsContact C-N 3.33Å; T101-K103 PolarHBondContact O-N 2.88Å; K103-A105 PolarHBondContact O-N 3.2Å; K103-I106 PolarHBondContact O-N 3.35Å; K103-D107 WeakPolarHBondContact O-CB 3.45Å; K103-D107 PolarHBondContact O-N 3.49Å; K103-S146 PolarHBondContact NZ-OG 3.28Å
104	I	71.3	Confident	72.6	Confident	84 Å²	84	67.6 Å²	67.6	43%	0.431	35%	0.35	S	S	.	.	H	α-helix	trans	-60.1	-38.5	175.8	-68.8	165.6	0	0	0	110.7	L100 T101 C102 N108	L100-I104 HydrophobicContact CD1-CD1 4.11Å; L100-I104 HydrophobicContact CD1-CG1 4.45Å; L100-I104 HydrophobicContact CG-CD1 3.97Å; L100-I104 VanDerWaalsContact O-CG1 3.28Å; L100-I104 WeakPolarHBondContact O-CG1 3.46Å; L100-I104 PolarHBondContact O-N 3.5Å; T101-I104 PolarHBondContact O-N 2.96Å; C102-I104 PolarHBondContact O-N 2.68Å; I104-N108 WeakPolarHBondContact O-CB 3.47Å; I104-N108 PolarHBondContact O-N 2.92Å; I104-N108 PolarHBondContact O-ND2 3.28Å
105	A	73.7	Confident	72.2	Confident	42 Å²	42	72.3 Å²	72.3	35%	0.347	37%	0.371	S	S	.	.	H	α-helix	trans	-65.7	-46.4	177.7	0	0	0	0	0	112	T101 C102 K103 N108 L109	T101-A105 PolarHBondContact O-N 3.34Å; C102-A105 WeakPolarHBondContact O-CB 3.35Å; C102-A105 PolarHBondContact O-N 2.91Å; C102-A105 VanDerWaalsContact O-N 3.13Å; K103-A105 PolarHBondContact O-N 3.2Å; A105-N108 PolarHBondContact O-N 3.45Å; A105-L109 PolarHBondContact O-N 2.97Å
106	I	72.8	Confident	71.3	Confident	5 Å²	5	79.7 Å²	79.7	3%	0.026	41%	0.406	C	S	.	.	H	α-helix	trans	-60.3	-49.1	175.8	-65.2	169.6	0	0	0	110.4	G35 L40 C102 K103 N108 L109 E110	G35-I106 WeakPolarHBondContact O-CD1 3.41Å; G35-I106 VanDerWaalsContact O-CG1 3.31Å; G35-I106 WeakPolarHBondContact O-CG1 3.37Å; L40-I106 HydrophobicContact CB-CD1 4.24Å; L40-I106 HydrophobicContact CD2-CD1 3.98Å; C102-I106 WeakPolarHBondContact O-CG1 3.45Å; C102-I106 PolarHBondContact O-N 2.93Å; K103-I106 PolarHBondContact O-N 3.35Å; I106-N108 VanDerWaalsContact C-N 3.27Å; I106-N108 PolarHBondContact O-N 3.04Å; I106-L109 WeakPolarHBondContact O-CB 3.43Å; I106-L109 PolarHBondContact O-N 3.29Å; I106-L109 VanDerWaalsContact O-N 3.13Å; I106-E110 HydrophobicContact CG2-CG 4.47Å; I106-E110 PolarHBondContact O-N 3.1Å
107	D	68.5	Low	70.5	Confident	57 Å²	57	77.9 Å²	77.9	31%	0.305	41%	0.411	S	S	.	.	H	α-helix	trans	-60	-37.4	179.9	-70.2	-10.1	0	0	0	111.9	K103 K111	K103-D107 WeakPolarHBondContact O-CB 3.45Å; K103-D107 PolarHBondContact O-N 3.49Å; D107-K111 WeakPolarHBondContact O-CB 3.44Å; D107-K111 VanDerWaalsContact O-CG 3.29Å; D107-K111 WeakPolarHBondContact O-CG 3.36Å; D107-K111 PolarHBondContact O-N 3.15Å; D107-K111 VanDerWaalsContact O-N 3.08Å
108	N	73.8	Confident	69.6	Low	93 Å²	93	72.9 Å²	72.9	50%	0.497	40%	0.401	S	S	.	.	H	α-helix	trans	-72.5	-36.9	177.5	-75.2	-23.4	0	0	0	112.4	I104 A105 I106 A112	I104-N108 WeakPolarHBondContact O-CB 3.47Å; I104-N108 PolarHBondContact O-N 2.92Å; I104-N108 PolarHBondContact O-ND2 3.28Å; A105-N108 PolarHBondContact O-N 3.45Å; I106-N108 VanDerWaalsContact C-N 3.27Å; I106-N108 PolarHBondContact O-N 3.04Å; N108-A112 WeakPolarHBondContact O-CB 3.4Å; N108-A112 PolarHBondContact O-N 3.43Å
109	L	76.7	Confident	68.7	Low	85 Å²	85	79.5 Å²	79.5	45%	0.445	44%	0.437	S	S	.	.	H	α-helix	trans	-62.8	-50.3	173.7	-94.2	151.6	0	0	0	111	A105 I106 K111 A112 E113	A105-L109 PolarHBondContact O-N 2.97Å; I106-L109 WeakPolarHBondContact O-CB 3.43Å; I106-L109 PolarHBondContact O-N 3.29Å; I106-L109 VanDerWaalsContact O-N 3.13Å; L109-K111 VanDerWaalsContact C-N 3.33Å; L109-K111 PolarHBondContact O-N 3.45Å; L109-A112 WeakPolarHBondContact O-CB 3.49Å; L109-A112 PolarHBondContact O-N 3.2Å; L109-A112 VanDerWaalsContact O-N 3.11Å; L109-E113 PolarHBondContact O-N 3.39Å
110	E	71	Confident	67.7	Low	84 Å²	84	85.9 Å²	85.9	39%	0.393	47%	0.47	S	S	.	.	H	α-helix	trans	-60.6	-41.6	178	-70.5	-178.1	176.5	0	0	111.8	I106 E113 L114	I106-E110 HydrophobicContact CG2-CG 4.47Å; I106-E110 PolarHBondContact O-N 3.1Å; E110-E113 PolarHBondContact O-N 3.41Å; E110-L114 VanDerWaalsContact O-CG 3.3Å; E110-L114 WeakPolarHBondContact O-CG 3.4Å; E110-L114 PolarHBondContact O-N 3.07Å
111	K	72	Confident	66.7	Low	130 Å²	130	87.1 Å²	87.1	57%	0.565	48%	0.476	S	S	*	.	H	α-helix	trans	-62.6	-41.9	173.7	-78.9	177	-177.2	175.5	0	112.5	D107 L109 E113 L114 L115	D107-K111 WeakPolarHBondContact O-CB 3.44Å; D107-K111 VanDerWaalsContact O-CG 3.29Å; D107-K111 WeakPolarHBondContact O-CG 3.36Å; D107-K111 PolarHBondContact O-N 3.15Å; D107-K111 VanDerWaalsContact O-N 3.08Å; L109-K111 VanDerWaalsContact C-N 3.33Å; L109-K111 PolarHBondContact O-N 3.45Å; K111-E113 VanDerWaalsContact C-N 3.35Å; K111-L114 PolarHBondContact O-N 2.97Å; K111-L115 WeakPolarHBondContact O-CB 3.34Å; K111-L115 VanDerWaalsContact O-CG 3.25Å; K111-L115 WeakPolarHBondContact O-CG 3.21Å; K111-L115 PolarHBondContact O-N 2.91Å
112	A	73.9	Confident	65.5	Low	49 Å²	49	94.6 Å²	94.6	41%	0.405	50%	0.495	S	S	.	.	H	α-helix	trans	-64.5	-40.2	179.2	0	0	0	0	0	111.7	N108 L109 L115 Q116	N108-A112 WeakPolarHBondContact O-CB 3.4Å; N108-A112 PolarHBondContact O-N 3.43Å; L109-A112 WeakPolarHBondContact O-CB 3.49Å; L109-A112 PolarHBondContact O-N 3.2Å; L109-A112 VanDerWaalsContact O-N 3.11Å; A112-L115 PolarHBondContact O-N 2.92Å; A112-Q116 PolarHBondContact O-N 3.4Å
113	E	72.1	Confident	64.2	Low	134 Å²	134	102.9 Å²	102.9	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-64.3	-44.1	175.1	-71.9	-176.6	169.7	0	0	112.1	L109 E110 K111 L115 Q116 G117	L109-E113 PolarHBondContact O-N 3.39Å; E110-E113 PolarHBondContact O-N 3.41Å; K111-E113 VanDerWaalsContact C-N 3.35Å; E113-L115 VanDerWaalsContact C-N 3.34Å; E113-L115 PolarHBondContact O-N 2.97Å; E113-Q116 PolarHBondContact O-N 3.44Å; E113-G117 PolarHBondContact O-N 3.19Å; E113-G117 VanDerWaalsContact O-N 3.08Å
114	L	67.4	Low	62.9	Low	137 Å²	137	111.9 Å²	111.9	72%	0.717	57%	0.567	S	S	*	*	H	α-helix	trans	-64.1	-37.2	176.2	-70.9	171.8	0	0	0	112.7	E110 K111 G117 G118	E110-L114 VanDerWaalsContact O-CG 3.3Å; E110-L114 WeakPolarHBondContact O-CG 3.4Å; E110-L114 PolarHBondContact O-N 3.07Å; K111-L114 PolarHBondContact O-N 2.97Å; L114-G117 PolarHBondContact O-N 3.43Å; L114-G118 PolarHBondContact O-N 3.28Å
115	L	69.1	Low	61.8	Low	136 Å²	136	117.5 Å²	117.5	71%	0.712	59%	0.588	S	S	*	*	H	α-helix	trans	-71.9	-36	177.7	-72.2	171.5	0	0	0	112.3	K111 A112 E113 G117 G118	K111-L115 WeakPolarHBondContact O-CB 3.34Å; K111-L115 VanDerWaalsContact O-CG 3.25Å; K111-L115 WeakPolarHBondContact O-CG 3.21Å; K111-L115 PolarHBondContact O-N 2.91Å; A112-L115 PolarHBondContact O-N 2.92Å; E113-L115 VanDerWaalsContact C-N 3.34Å; E113-L115 PolarHBondContact O-N 2.97Å; L115-G117 VanDerWaalsContact C-N 3.31Å; L115-G118 PolarHBondContact O-N 3.2Å; L115-G118 VanDerWaalsContact O-N 3.14Å
116	Q	60.2	Low	60.5	Low	157 Å²	157	121.5 Å²	121.5	73%	0.734	61%	0.608	S	S	*	*	H	α-helix	trans	-65.8	-32.9	171.6	-81	-176.7	14.1	0	0	112.5	A112 E113 G118	A112-Q116 PolarHBondContact O-N 3.4Å; E113-Q116 PolarHBondContact O-N 3.44Å; Q116-G118 PolarHBondContact O-N 3.47Å
117	G	55.6	Low	59.3	Low	40 Å²	40	126 Å²	126	41%	0.412	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.8	-15.4	171.9	0	0	0	0	0	114.6	E113 L114 L115	E113-G117 PolarHBondContact O-N 3.19Å; E113-G117 VanDerWaalsContact O-N 3.08Å; L114-G117 PolarHBondContact O-N 3.43Å; L115-G117 VanDerWaalsContact C-N 3.31Å
118	G	54.4	Low	58.4	Low	41 Å²	41	132.5 Å²	132.5	42%	0.423	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.4	-21.5	-179	0	0	0	0	0	115.3	L114 L115 Q116 L120 L121	L114-G118 PolarHBondContact O-N 3.28Å; L115-G118 PolarHBondContact O-N 3.2Å; L115-G118 VanDerWaalsContact O-N 3.14Å; Q116-G118 PolarHBondContact O-N 3.47Å; G118-L120 VanDerWaalsContact C-N 3.31Å; G118-L120 PolarHBondContact O-N 2.95Å; G118-L121 PolarHBondContact O-N 3.42Å
119	D	51.8	Low	57.3	Low	140 Å²	140	136 Å²	136	75%	0.749	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-20.2	-177.5	-95.3	-23.9	0	0	0	113.4
120	L	50.6	Low	55.8	Low	155 Å²	155	135.8 Å²	135.8	81%	0.812	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-12.7	176.1	-66.7	173.3	0	0	0	113.5	G118	G118-L120 VanDerWaalsContact C-N 3.31Å; G118-L120 PolarHBondContact O-N 2.95Å
121	L	49.6	Very low	54.8	Low	136 Å²	136	137.4 Å²	137.4	71%	0.712	69%	0.691	S	S	*	*			trans	-110	12.7	-172.2	-69.5	172.7	0	0	0	114.4	G118 Q123	G118-L121 PolarHBondContact O-N 3.42Å; L121-Q123 PolarHBondContact O-N 2.81Å
122	R	47.8	Very low	54	Low	239 Å²	239	134.1 Å²	134.1	90%	0.902	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	25.7	165.2	-163.9	173.1	151.8	-178.9	-6.7	112.6
123	Q	46.6	Very low	52.8	Low	176 Å²	176	138.4 Å²	138.4	82%	0.822	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.2	41.1	177.9	-148.1	-179.7	25.8	0	0	113	L121	L121-Q123 PolarHBondContact O-N 2.81Å
124	R	42.4	Very low	51.8	Low	230 Å²	230	135.3 Å²	135.3	87%	0.868	69%	0.69	S	S	*	*			trans	-164	100.4	147.7	-114.4	168.3	-168.6	177.4	3.8	113.2	T126	R124-T126 PolarHBondContact O-N 2.78Å
125	K	47.5	Very low	50.8	Low	201 Å²	201	132 Å²	132	87%	0.874	68%	0.678	S	S	*	*			trans	-72.3	97	169.5	-172	-176.1	-171	-175.6	0	108
126	T	47.5	Very low	49.8	Very low	126 Å²	126	129.2 Å²	129.2	77%	0.773	67%	0.671	S	S	*	*			trans	173.2	44.2	160.7	33.3	0	0	0	0	114.8	R124	R124-T126 PolarHBondContact O-N 2.78Å
127	T	46.9	Very low	49.2	Very low	99 Å²	99	125.4 Å²	125.4	61%	0.607	66%	0.658	S	S	*	*			trans	-155.4	67.5	165.3	-35.6	0	0	0	0	111.7
128	K	49.5	Very low	49	Very low	195 Å²	195	128.3 Å²	128.3	85%	0.848	66%	0.663	S	S	*	*	H	α-helix	trans	-88.8	-19.7	-173.5	-85.8	-172.3	172.2	-172.2	0	115.5
129	E	50.2	Low	49	Very low	166 Å²	166	130.5 Å²	130.5	78%	0.776	67%	0.668	S	S	*	*	H	α-helix	trans	-94.7	-39.6	-178.4	-80.8	170.7	147.6	0	0	113.4	L131 Q133	E129-L131 VanDerWaalsContact C-N 3.33Å; E129-L131 PolarHBondContact O-N 2.96Å; E129-Q133 PolarHBondContact O-N 3.36Å
130	S	45.6	Very low	48.9	Very low	80 Å²	80	130.7 Å²	130.7	56%	0.559	67%	0.665	S	S	*	*	H	α-helix	trans	-65.1	-34.7	179.3	-173.7	0	0	0	0	113	T134	S130-T134 PolarHBondContact O-N 3.42Å; S130-T134 VanDerWaalsContact O-N 3.16Å; S130-T134 PolarHBondContact O-OG1 3.31Å
131	L	50.5	Low	48.6	Very low	119 Å²	119	126.5 Å²	126.5	62%	0.623	65%	0.648	S	S	*	*	H	α-helix	trans	-75.1	-41.7	-175.3	-161.8	71.7	0	0	0	112	E129 Q133 T134 S135	E129-L131 VanDerWaalsContact C-N 3.33Å; E129-L131 PolarHBondContact O-N 2.96Å; L131-Q133 VanDerWaalsContact C-N 3.28Å; L131-Q133 PolarHBondContact O-N 3.43Å; L131-T134 WeakPolarHBondContact CA-OG1 3.48Å; L131-T134 PolarHBondContact O-N 2.98Å; L131-T134 PolarHBondContact O-OG1 3.02Å; L131-S135 PolarHBondContact O-N 2.9Å; L131-S135 PolarHBondContact O-OG 2.82Å
132	A	53.9	Low	48.6	Very low	60 Å²	60	124 Å²	124	50%	0.496	64%	0.635	S	S	.	*	H	α-helix	trans	-63.3	-36.1	176.3	0	0	0	0	0	111.7	S135 S136	A132-S135 PolarHBondContact O-N 2.8Å; A132-S136 WeakPolarHBondContact O-CB 3.42Å; A132-S136 PolarHBondContact O-N 3.36Å
133	Q	48.8	Very low	48.8	Very low	140 Å²	140	119 Å²	119	65%	0.654	62%	0.623	S	S	*	*	H	α-helix	trans	-71.4	-42.9	178	-159.1	141.5	-0.6	0	0	112	E129 L131 S135 S136 T137	E129-Q133 PolarHBondContact O-N 3.36Å; L131-Q133 VanDerWaalsContact C-N 3.28Å; L131-Q133 PolarHBondContact O-N 3.43Å; Q133-S135 PolarHBondContact O-N 2.76Å; Q133-S136 PolarHBondContact O-N 2.95Å; Q133-T137 PolarHBondContact O-N 3.09Å; Q133-T137 PolarHBondContact O-OG1 2.97Å
134	T	51.7	Low	48.8	Very low	69 Å²	69	112.1 Å²	112.1	42%	0.423	60%	0.6	S	S	.	*	H	α-helix	trans	-62.8	-40.1	171.1	30.7	0	0	0	0	112.9	S130 L131 T137 I138	S130-T134 PolarHBondContact O-N 3.42Å; S130-T134 VanDerWaalsContact O-N 3.16Å; S130-T134 PolarHBondContact O-OG1 3.31Å; L131-T134 WeakPolarHBondContact CA-OG1 3.48Å; L131-T134 PolarHBondContact O-N 2.98Å; L131-T134 PolarHBondContact O-OG1 3.02Å; T134-T137 PolarHBondContact O-N 3.33Å; T134-I138 WeakPolarHBondContact O-CB 3.34Å; T134-I138 WeakPolarHBondContact O-CD1 3.42Å; T134-I138 WeakPolarHBondContact O-CG1 3.42Å; T134-I138 PolarHBondContact O-N 2.91Å
135	S	45.8	Very low	49.1	Very low	66 Å²	66	105.4 Å²	105.4	46%	0.462	58%	0.58	S	S	.	*	H	α-helix	trans	-64.8	-38.3	175.6	-66.1	0	0	0	0	112.3	L131 A132 Q133 T139	L131-S135 PolarHBondContact O-N 2.9Å; L131-S135 PolarHBondContact O-OG 2.82Å; A132-S135 PolarHBondContact O-N 2.8Å; Q133-S135 PolarHBondContact O-N 2.76Å; S135-T139 WeakPolarHBondContact O-CB 3.45Å; S135-T139 PolarHBondContact O-N 3.43Å; S135-T139 PolarHBondContact O-OG1 3.28Å
136	S	49.8	Very low	49	Very low	79 Å²	79	98.2 Å²	98.2	55%	0.552	56%	0.555	S	S	*	*	H	α-helix	trans	-67.9	-46	174	-87.3	0	0	0	0	112.7	A132 Q133 I138 T139 E140	A132-S136 WeakPolarHBondContact O-CB 3.42Å; A132-S136 PolarHBondContact O-N 3.36Å; Q133-S136 PolarHBondContact O-N 2.95Å; S136-I138 VanDerWaalsContact C-N 3.3Å; S136-I138 PolarHBondContact O-N 2.96Å; S136-T139 PolarHBondContact O-N 3.48Å; S136-E140 WeakPolarHBondContact O-CB 3.39Å; S136-E140 PolarHBondContact O-N 3.47Å
137	T	47.4	Very low	49.3	Very low	77 Å²	77	101.2 Å²	101.2	47%	0.472	55%	0.553	S	S	.	*	H	α-helix	trans	-65	-33.5	179.1	-51.4	0	0	0	0	112.2	Q133 T134 S141	Q133-T137 PolarHBondContact O-N 3.09Å; Q133-T137 PolarHBondContact O-OG1 2.97Å; T134-T137 PolarHBondContact O-N 3.33Å; T137-S141 WeakPolarHBondContact O-CB 3.47Å; T137-S141 PolarHBondContact O-N 3.03Å; T137-S141 PolarHBondContact O-OG 3.5Å
138	I	50.9	Low	49.4	Very low	101 Å²	101	102.5 Å²	102.5	52%	0.518	55%	0.553	S	S	.	*	H	α-helix	trans	-70.8	-43.1	172.8	-67.7	166.4	0	0	0	110.6	T134 S136 E140 S141 L142	T134-I138 WeakPolarHBondContact O-CB 3.34Å; T134-I138 WeakPolarHBondContact O-CD1 3.42Å; T134-I138 WeakPolarHBondContact O-CG1 3.42Å; T134-I138 PolarHBondContact O-N 2.91Å; S136-I138 VanDerWaalsContact C-N 3.3Å; S136-I138 PolarHBondContact O-N 2.96Å; I138-E140 VanDerWaalsContact C-N 3.28Å; I138-E140 PolarHBondContact O-N 3.33Å; I138-S141 PolarHBondContact O-N 3.25Å; I138-L142 HydrophobicContact CG2-CD1 3.85Å; I138-L142 HydrophobicContact CG2-CG 4.34Å; I138-L142 WeakPolarHBondContact O-CB 3.45Å; I138-L142 WeakPolarHBondContact O-CG 3.39Å; I138-L142 PolarHBondContact O-N 2.99Å
139	T	53.8	Low	49.5	Very low	87 Å²	87	95.2 Å²	95.2	53%	0.534	52%	0.523	S	S	.	.	H	α-helix	trans	-60.6	-38.2	175.2	-55.6	0	0	0	0	111.7	S135 S136 L142 M143	S135-T139 WeakPolarHBondContact O-CB 3.45Å; S135-T139 PolarHBondContact O-N 3.43Å; S135-T139 PolarHBondContact O-OG1 3.28Å; S136-T139 PolarHBondContact O-N 3.48Å; T139-L142 PolarHBondContact O-N 3.49Å; T139-M143 WeakPolarHBondContact O-CB 3.41Å; T139-M143 PolarHBondContact O-N 3.36Å
140	E	50.9	Low	49.8	Very low	144 Å²	144	89.8 Å²	89.8	67%	0.673	51%	0.507	S	S	*	.	H	α-helix	trans	-71.5	-40	177.7	-169.7	161.4	-150.9	0	0	112.3	S136 I138 L142 M143 G144	S136-E140 WeakPolarHBondContact O-CB 3.39Å; S136-E140 PolarHBondContact O-N 3.47Å; I138-E140 VanDerWaalsContact C-N 3.28Å; I138-E140 PolarHBondContact O-N 3.33Å; E140-L142 VanDerWaalsContact C-N 3.34Å; E140-L142 PolarHBondContact O-N 3.48Å; E140-M143 PolarHBondContact O-N 3.11Å; E140-G144 PolarHBondContact O-N 3.36Å
141	S	43.5	Very low	50.1	Low	66 Å²	66	91.9 Å²	91.9	46%	0.462	51%	0.507	S	S	.	.	H	α-helix	trans	-63.4	-39.6	172.1	-59	0	0	0	0	111.7	T137 I138 G144 I145	T137-S141 WeakPolarHBondContact O-CB 3.47Å; T137-S141 PolarHBondContact O-N 3.03Å; T137-S141 PolarHBondContact O-OG 3.5Å; I138-S141 PolarHBondContact O-N 3.25Å; S141-G144 PolarHBondContact O-N 3.06Å; S141-I145 VanDerWaalsContact O-CG1 3.28Å; S141-I145 WeakPolarHBondContact O-CG1 3.26Å; S141-I145 PolarHBondContact O-N 3.08Å
142	L	49	Very low	50.1	Low	85 Å²	85	91.2 Å²	91.2	45%	0.445	50%	0.501	S	S	.	.	H	α-helix	trans	-66.2	-41.6	175.1	-74.5	167.2	0	0	0	112.3	I138 T139 E140 G144 I145 S146	I138-L142 HydrophobicContact CG2-CD1 3.85Å; I138-L142 HydrophobicContact CG2-CG 4.34Å; I138-L142 WeakPolarHBondContact O-CB 3.45Å; I138-L142 WeakPolarHBondContact O-CG 3.39Å; I138-L142 PolarHBondContact O-N 2.99Å; T139-L142 PolarHBondContact O-N 3.49Å; E140-L142 VanDerWaalsContact C-N 3.34Å; E140-L142 PolarHBondContact O-N 3.48Å; L142-G144 VanDerWaalsContact C-N 3.32Å; L142-I145 PolarHBondContact O-N 2.99Å; L142-S146 WeakPolarHBondContact O-CB 3.44Å; L142-S146 PolarHBondContact O-N 3.16Å
143	M	52.8	Low	50.2	Low	132 Å²	132	89.8 Å²	89.8	65%	0.65	49%	0.486	S	S	*	.	H	α-helix	trans	-66.3	-37.1	175.5	-148.9	177.5	-172	0	0	111	T139 E140 R147	T139-M143 WeakPolarHBondContact O-CB 3.41Å; T139-M143 PolarHBondContact O-N 3.36Å; E140-M143 PolarHBondContact O-N 3.11Å; M143-R147 WeakPolarHBondContact O-CB 3.28Å; M143-R147 PolarHBondContact O-N 3.45Å
144	G	47.3	Very low	50.5	Low	32 Å²	32	88.2 Å²	88.2	33%	0.33	48%	0.479	S	S	.	.	H	α-helix	trans	-63.6	-45.3	173.4	0	0	0	0	0	113.4	E140 S141 L142 R147 M148	E140-G144 PolarHBondContact O-N 3.36Å; S141-G144 PolarHBondContact O-N 3.06Å; L142-G144 VanDerWaalsContact C-N 3.32Å; G144-R147 PolarHBondContact O-N 3.07Å; G144-M148 WeakPolarHBondContact O-CB 3.43Å; G144-M148 PolarHBondContact O-N 3Å
145	I	48.8	Very low	50.4	Low	89 Å²	89	90.4 Å²	90.4	46%	0.456	48%	0.484	S	S	.	.	H	α-helix	trans	-67.8	-40.3	176.8	-67.3	164.4	0	0	0	110.9	S141 L142 R147 M148 M149	S141-I145 VanDerWaalsContact O-CG1 3.28Å; S141-I145 WeakPolarHBondContact O-CG1 3.26Å; S141-I145 PolarHBondContact O-N 3.08Å; L142-I145 PolarHBondContact O-N 2.99Å; I145-R147 VanDerWaalsContact C-N 3.32Å; I145-R147 PolarHBondContact O-N 2.74Å; I145-M148 PolarHBondContact O-N 3.19Å; I145-M149 WeakPolarHBondContact O-CB 3.34Å; I145-M149 PolarHBondContact O-N 3.49Å
146	S	45.2	Very low	50.6	Low	50 Å²	50	88.9 Å²	88.9	35%	0.35	47%	0.473	S	S	.	.	H	α-helix	trans	-59.5	-42.3	173.2	-164.6	0	0	0	0	112.2	K103 L142 A150	K103-S146 PolarHBondContact NZ-OG 3.28Å; L142-S146 WeakPolarHBondContact O-CB 3.44Å; L142-S146 PolarHBondContact O-N 3.16Å; S146-A150 WeakPolarHBondContact O-CB 3.4Å; S146-A150 PolarHBondContact O-N 3.48Å
147	R	53.4	Low	50.8	Low	190 Å²	190	87.3 Å²	87.3	72%	0.717	46%	0.457	S	S	*	.	H	α-helix	trans	-65	-45	174.9	-114.3	176.4	172.8	152.3	-2.3	112.5	M143 G144 I145 M149 A150 Q151	M143-R147 WeakPolarHBondContact O-CB 3.28Å; M143-R147 PolarHBondContact O-N 3.45Å; G144-R147 PolarHBondContact O-N 3.07Å; I145-R147 VanDerWaalsContact C-N 3.32Å; I145-R147 PolarHBondContact O-N 2.74Å; R147-M149 VanDerWaalsContact C-N 3.32Å; R147-M149 PolarHBondContact O-N 3.11Å; R147-A150 PolarHBondContact O-N 3.4Å; R147-Q151 WeakPolarHBondContact O-CB 2.97Å; R147-Q151 PolarHBondContact O-N 3.32Å
148	M	49.5	Very low	51.2	Low	125 Å²	125	89.6 Å²	89.6	62%	0.616	46%	0.463	S	S	*	.	H	α-helix	trans	-64.5	-37.8	-179.4	-160.5	-175.1	-50.7	0	0	111.6	G144 I145 Q151 Q152	G144-M148 WeakPolarHBondContact O-CB 3.43Å; G144-M148 PolarHBondContact O-N 3Å; I145-M148 PolarHBondContact O-N 3.19Å; M148-Q151 WeakPolarHBondContact O-CB 3.33Å; M148-Q151 PolarHBondContact O-N 3.04Å; M148-Q152 PolarHBondContact O-N 3.36Å
149	M	50.8	Low	51.3	Low	42 Å²	42	87 Å²	87	21%	0.207	46%	0.456	C	S	.	.	H	α-helix	trans	-75.1	-37.6	176.7	-157.7	-176.5	-155.7	0	0	112.5	N44 I145 R147 Q151 Q152 V153	N44-M149 HydrophobicContact CB-CE 4.41Å; I145-M149 WeakPolarHBondContact O-CB 3.34Å; I145-M149 PolarHBondContact O-N 3.49Å; R147-M149 VanDerWaalsContact C-N 3.32Å; R147-M149 PolarHBondContact O-N 3.11Å; M149-Q151 VanDerWaalsContact C-N 3.28Å; M149-Q151 PolarHBondContact O-N 3.39Å; M149-Q152 PolarHBondContact O-N 2.79Å; M149-Q152 VanDerWaalsContact O-N 3.11Å; M149-V153 PolarHBondContact O-N 2.9Å
150	A	55.7	Low	51.3	Low	53 Å²	53	83.3 Å²	83.3	44%	0.438	43%	0.433	S	S	.	.	H	α-helix	trans	-58.1	-44.1	170.2	0	0	0	0	0	110.7	S146 R147 Q152 V153 Q154	S146-A150 WeakPolarHBondContact O-CB 3.4Å; S146-A150 PolarHBondContact O-N 3.48Å; R147-A150 PolarHBondContact O-N 3.4Å; A150-Q152 VanDerWaalsContact C-N 3.29Å; A150-Q152 PolarHBondContact O-N 3.42Å; A150-V153 PolarHBondContact O-N 2.88Å; A150-Q154 VanDerWaalsContact O-CB 3.28Å; A150-Q154 WeakPolarHBondContact O-CB 3.47Å; A150-Q154 PolarHBondContact O-N 2.54Å
151	Q	53.2	Low	51.5	Low	123 Å²	123	81.6 Å²	81.6	58%	0.575	43%	0.425	S	S	*	.	H	α-helix	trans	-61.7	-35.4	174.4	-170.6	177.2	-15.1	0	0	112.3	R147 M148 M149 Q154 Q155	R147-Q151 WeakPolarHBondContact O-CB 2.97Å; R147-Q151 PolarHBondContact O-N 3.32Å; M148-Q151 WeakPolarHBondContact O-CB 3.33Å; M148-Q151 PolarHBondContact O-N 3.04Å; M149-Q151 VanDerWaalsContact C-N 3.28Å; M149-Q151 PolarHBondContact O-N 3.39Å; Q151-Q154 WeakPolarHBondContact O-CB 3.35Å; Q151-Q154 PolarHBondContact O-N 2.7Å; Q151-Q155 PolarHBondContact O-N 3.49Å
152	Q	50.5	Low	52.3	Low	105 Å²	105	81.9 Å²	81.9	49%	0.491	43%	0.427	S	S	.	.	H	α-helix	trans	-76.3	-28.7	178	-137.4	170.5	10.5	0	0	113.7	M148 M149 A150	M148-Q152 PolarHBondContact O-N 3.36Å; M149-Q152 PolarHBondContact O-N 2.79Å; M149-Q152 VanDerWaalsContact O-N 3.11Å; A150-Q152 VanDerWaalsContact C-N 3.29Å; A150-Q152 PolarHBondContact O-N 3.42Å
153	V	56.4	Low	52.9	Low	30 Å²	30	78.5 Å²	78.5	18%	0.182	41%	0.409	C	S	.	.	H	α-helix	trans	-72.9	-35.8	168	171.6	0	0	0	0	110.5	W95 R96 M149 A150 S156 E157	W95-V153 HydrophobicContact CH2-CG2 4.2Å; W95-V153 HydrophobicContact CZ3-CG1 4.41Å; R96-V153 HydrophobicContact CG-CG1 4.34Å; M149-V153 PolarHBondContact O-N 2.9Å; A150-V153 PolarHBondContact O-N 2.88Å; V153-S156 WeakPolarHBondContact O-CB 3.35Å; V153-S156 PolarHBondContact O-N 2.75Å; V153-E157 PolarHBondContact O-N 3.46Å; V153-E157 VanDerWaalsContact O-N 3.08Å
154	Q	54.4	Low	53.1	Low	107 Å²	107	74.3 Å²	74.3	50%	0.5	39%	0.391	S	S	.	.	H	α-helix	trans	-68.6	-40.8	177.7	-162.8	121.5	10.5	0	0	112.4	A150 Q151 S156 E157 E158	A150-Q154 VanDerWaalsContact O-CB 3.28Å; A150-Q154 WeakPolarHBondContact O-CB 3.47Å; A150-Q154 PolarHBondContact O-N 2.54Å; Q151-Q154 WeakPolarHBondContact O-CB 3.35Å; Q151-Q154 PolarHBondContact O-N 2.7Å; Q154-S156 VanDerWaalsContact C-N 3.29Å; Q154-S156 PolarHBondContact O-N 2.96Å; Q154-E157 WeakPolarHBondContact O-CA 3.46Å; Q154-E157 WeakPolarHBondContact O-CB 3.48Å; Q154-E157 PolarHBondContact O-N 3Å; Q154-E158 PolarHBondContact O-N 3.31Å
155	Q	48.6	Very low	53.6	Low	115 Å²	115	76.8 Å²	76.8	54%	0.537	40%	0.4	S	S	.	.	H	α-helix	trans	-62.1	-36.6	172.6	-82.1	-175.1	-13.9	0	0	112.5	Q151 E157 A159	Q151-Q155 PolarHBondContact O-N 3.49Å; Q155-E157 PolarHBondContact O-N 2.78Å; Q155-A159 PolarHBondContact O-N 3.04Å
156	S	50.1	Low	54	Low	34 Å²	34	75.5 Å²	75.5	24%	0.238	40%	0.399	C	S	.	.	H	α-helix	trans	-67.4	-27	172.7	-172	0	0	0	0	112.3	V153 Q154 M160	V153-S156 WeakPolarHBondContact O-CB 3.35Å; V153-S156 PolarHBondContact O-N 2.75Å; Q154-S156 VanDerWaalsContact C-N 3.29Å; Q154-S156 PolarHBondContact O-N 2.96Å; S156-M160 WeakPolarHBondContact O-CG 3.48Å
157	E	54.8	Low	54.3	Low	46 Å²	46	73.5 Å²	73.5	22%	0.215	39%	0.385	C	S	.	.	H	α-helix	trans	-73	-48.8	175.3	-179.3	167.4	-134	0	0	111.7	R96 V153 Q154 Q155 A159 M160 Q161	R96-E157 IonicContact CZ-OE1 3.68Å; R96-E157 VanDerWaalsContact CZ-OE1 3.25Å; R96-E157 IonicContact CZ-OE2 2.82Å; R96-E157 IonicContact NH1-OE1 2.78Å; R96-E157 PolarHBondContact NH1-OE1 3.43Å; R96-E157 IonicContact NH1-OE2 2.75Å; R96-E157 VanDerWaalsContact NH2-CG 3.35Å; R96-E157 IonicContact NH2-OE1 3.95Å; R96-E157 PolarHBondContact NH2-OE1 3Å; R96-E157 IonicContact NH2-OE2 2.74Å; R96-E157 PolarHBondContact NH2-OE2 2.91Å; V153-E157 PolarHBondContact O-N 3.46Å; V153-E157 VanDerWaalsContact O-N 3.08Å; Q154-E157 WeakPolarHBondContact O-CA 3.46Å; Q154-E157 WeakPolarHBondContact O-CB 3.48Å; Q154-E157 PolarHBondContact O-N 3Å; Q155-E157 PolarHBondContact O-N 2.78Å; E157-A159 VanDerWaalsContact C-N 3.32Å; E157-A159 PolarHBondContact O-N 3.28Å; E157-M160 CarbonylContact O-C 3.53Å; E157-M160 WeakPolarHBondContact O-CA 3.39Å; E157-M160 PolarHBondContact O-N 3.45Å; E157-Q161 WeakPolarHBondContact O-CB 3.15Å; E157-Q161 PolarHBondContact O-N 3.26Å
158	E	54.8	Low	54.5	Low	125 Å²	125	72.9 Å²	72.9	58%	0.584	38%	0.383	S	S	*	.	H	α-helix	trans	-56.1	-45.5	-178.8	-73.5	175	179.1	0	0	112.1	Q154 M160 Q161 S162	Q154-E158 PolarHBondContact O-N 3.31Å; E158-M160 VanDerWaalsContact C-N 3.29Å; E158-M160 PolarHBondContact O-N 2.91Å; E158-Q161 PolarHBondContact O-N 3.14Å; E158-S162 PolarHBondContact O-N 3.04Å; E158-S162 VanDerWaalsContact O-N 3.11Å
159	A	54.5	Low	55	Low	46 Å²	46	71.3 Å²	71.3	38%	0.38	38%	0.38	S	S	.	.	H	α-helix	trans	-62.6	-37	176.9	0	0	0	0	0	111.7	R55 Q155 E157	R55-A159 VanDerWaalsContact CZ-O 3.22Å; R55-A159 PolarHBondContact NH1-O 3.33Å; R55-A159 PolarHBondContact NH2-O 3.47Å; Q155-A159 PolarHBondContact O-N 3.04Å; E157-A159 VanDerWaalsContact C-N 3.32Å; E157-A159 PolarHBondContact O-N 3.28Å
160	M	52.6	Low	55.3	Low	10 Å²	10	71 Å²	71	5%	0.049	38%	0.379	C	S	.	.	H	α-helix	trans	-78.5	-31.7	178.8	-72.3	-144.2	-58.6	0	0	112.6	M88 Q92 S156 E157 E158 S162 L163 V164	M88-M160 HydrophobicContact CE-SD 3.73Å; M88-M160 HydrophobicContact CG-SD 4.31Å; M88-M160 HydrophobicContact SD-SD 4.01Å; Q92-M160 HydrophobicContact CB-CE 4.06Å; Q92-M160 HydrophobicContact CG-CE 3.8Å; Q92-M160 VanDerWaalsContact NE2-CE 3.26Å; S156-M160 WeakPolarHBondContact O-CG 3.48Å; E157-M160 CarbonylContact O-C 3.53Å; E157-M160 WeakPolarHBondContact O-CA 3.39Å; E157-M160 PolarHBondContact O-N 3.45Å; E158-M160 VanDerWaalsContact C-N 3.29Å; E158-M160 PolarHBondContact O-N 2.91Å; M160-S162 PolarHBondContact O-N 3.32Å; M160-L163 WeakPolarHBondContact O-CA 3.36Å; M160-L163 VanDerWaalsContact O-CB 3.26Å; M160-L163 WeakPolarHBondContact O-CB 3.48Å; M160-L163 PolarHBondContact O-N 3.1Å; M160-V164 WeakPolarHBondContact O-CG2 3.34Å; M160-V164 PolarHBondContact O-N 3.34Å
161	Q	55.7	Low	55.3	Low	109 Å²	109	71.9 Å²	71.9	51%	0.509	38%	0.376	S	S	.	.	H	α-helix	trans	-66.4	-30.9	176.3	-152.7	152.9	2	0	0	111.4	E157 E158 V164 T165	E157-Q161 WeakPolarHBondContact O-CB 3.15Å; E157-Q161 PolarHBondContact O-N 3.26Å; E158-Q161 PolarHBondContact O-N 3.14Å; Q161-V164 PolarHBondContact O-N 3.42Å; Q161-T165 WeakPolarHBondContact O-CB 3.4Å; Q161-T165 PolarHBondContact O-N 3.01Å; Q161-T165 PolarHBondContact O-OG1 3.06Å
162	S	60.4	Low	55.6	Low	71 Å²	71	70.8 Å²	70.8	50%	0.497	37%	0.374	S	S	.	.	H	α-helix	trans	-59.3	-45.2	166.2	175.8	0	0	0	0	112.1	E158 M160 V164 T165 S166	E158-S162 PolarHBondContact O-N 3.04Å; E158-S162 VanDerWaalsContact O-N 3.11Å; M160-S162 PolarHBondContact O-N 3.32Å; S162-V164 PolarHBondContact O-N 3.48Å; S162-T165 PolarHBondContact O-N 3.4Å; S162-S166 PolarHBondContact O-N 3.44Å; S162-S166 PolarHBondContact O-OG 2.93Å
163	L	61.2	Low	56	Low	14 Å²	14	67.4 Å²	67.4	7%	0.073	36%	0.364	C	S	.	.	H	α-helix	trans	-63.7	-40.3	175.3	-101.8	172.4	0	0	0	113.2	R55 Q59 M160 S166 S167	R55-L163 HydrophobicContact CG-CD1 3.31Å; Q59-L163 HydrophobicContact CG-CD2 4.16Å; M160-L163 WeakPolarHBondContact O-CA 3.36Å; M160-L163 VanDerWaalsContact O-CB 3.26Å; M160-L163 WeakPolarHBondContact O-CB 3.48Å; M160-L163 PolarHBondContact O-N 3.1Å; L163-S166 PolarHBondContact O-N 3.4Å; L163-S167 PolarHBondContact O-N 3.08Å
164	V	58	Low	55.9	Low	45 Å²	45	67.5 Å²	67.5	27%	0.273	36%	0.363	S	S	.	.	H	α-helix	trans	-66.6	-40.5	177.5	175.1	0	0	0	0	111.3	L89 M160 Q161 S162 S166 S167 R168	L89-V164 HydrophobicContact CD1-CG2 3.75Å; L89-V164 HydrophobicContact CD2-CG2 3.73Å; L89-V164 HydrophobicContact CG-CG2 4.21Å; M160-V164 WeakPolarHBondContact O-CG2 3.34Å; M160-V164 PolarHBondContact O-N 3.34Å; Q161-V164 PolarHBondContact O-N 3.42Å; S162-V164 PolarHBondContact O-N 3.48Å; V164-S166 VanDerWaalsContact C-N 3.34Å; V164-S167 WeakPolarHBondContact O-CB 3.48Å; V164-S167 PolarHBondContact O-N 3.25Å; V164-S167 VanDerWaalsContact O-N 3.14Å; V164-R168 PolarHBondContact O-N 2.99Å
165	T	57.6	Low	56.1	Low	84 Å²	84	69.1 Å²	69.1	52%	0.515	37%	0.371	S	S	.	.	H	α-helix	trans	-61.4	-45	175.6	-57.4	0	0	0	0	110.5	Q161 S162 S167 R168 T169	Q161-T165 WeakPolarHBondContact O-CB 3.4Å; Q161-T165 PolarHBondContact O-N 3.01Å; Q161-T165 PolarHBondContact O-OG1 3.06Å; S162-T165 PolarHBondContact O-N 3.4Å; T165-S167 VanDerWaalsContact C-N 3.28Å; T165-S167 PolarHBondContact O-N 3Å; T165-R168 PolarHBondContact O-N 3.32Å; T165-T169 PolarHBondContact O-N 3.3Å; T165-T169 PolarHBondContact O-OG1 3.03Å
166	S	56.5	Low	56.7	Low	62 Å²	62	70.4 Å²	70.4	43%	0.434	38%	0.377	S	S	.	.	H	α-helix	trans	-61.2	-33.8	173.2	-59.5	0	0	0	0	113.1	S162 L163 V164 I170	S162-S166 PolarHBondContact O-N 3.44Å; S162-S166 PolarHBondContact O-OG 2.93Å; L163-S166 PolarHBondContact O-N 3.4Å; V164-S166 VanDerWaalsContact C-N 3.34Å; S166-I170 WeakPolarHBondContact O-CG1 3.47Å; S166-I170 PolarHBondContact O-N 3.44Å
167	S	52.2	Low	57	Low	7 Å²	7	73.8 Å²	73.8	5%	0.049	39%	0.387	C	S	.	.	H	α-helix	trans	-67.2	-41	173.8	-97.6	0	0	0	0	113.9	E82 K85 L163 V164 T165 T169 I170 L171	E82-S167 WeakPolarHBondContact OE1-CB 3.45Å; E82-S167 PolarHBondContact OE1-OG 3.14Å; E82-S167 PolarHBondContact OE2-OG 3.36Å; K85-S167 WeakPolarHBondContact CD-OG 3.36Å; K85-S167 WeakPolarHBondContact CE-OG 3.32Å; K85-S167 PolarHBondContact NZ-OG 2.97Å; L163-S167 PolarHBondContact O-N 3.08Å; V164-S167 WeakPolarHBondContact O-CB 3.48Å; V164-S167 PolarHBondContact O-N 3.25Å; V164-S167 VanDerWaalsContact O-N 3.14Å; T165-S167 VanDerWaalsContact C-N 3.28Å; T165-S167 PolarHBondContact O-N 3Å; S167-T169 VanDerWaalsContact C-N 3.29Å; S167-T169 PolarHBondContact O-N 3.36Å; S167-I170 WeakPolarHBondContact O-CB 3.49Å; S167-I170 PolarHBondContact O-N 3.16Å; S167-I170 VanDerWaalsContact O-N 3.08Å; S167-L171 PolarHBondContact O-N 3.33Å
168	R	57.5	Low	57.2	Low	178 Å²	178	77.9 Å²	77.9	67%	0.672	40%	0.404	S	S	*	.	H	α-helix	trans	-59.3	-43.4	177.4	-87.7	-176.5	172.4	164.2	-2.6	111.6	V164 T165 I170 L171 D172	V164-R168 PolarHBondContact O-N 2.99Å; T165-R168 PolarHBondContact O-N 3.32Å; R168-I170 PolarHBondContact O-N 2.92Å; R168-L171 WeakPolarHBondContact O-CB 3.47Å; R168-L171 PolarHBondContact O-N 3.43Å; R168-L171 VanDerWaalsContact O-N 3.1Å; R168-D172 PolarHBondContact O-N 3.13Å
169	T	60.1	Low	57.4	Low	91 Å²	91	75.9 Å²	75.9	56%	0.558	41%	0.405	S	S	*	.	H	α-helix	trans	-61.6	-33.7	176.4	-38.8	0	0	0	0	112.1	T165 S167 A173	T165-T169 PolarHBondContact O-N 3.3Å; T165-T169 PolarHBondContact O-OG1 3.03Å; S167-T169 VanDerWaalsContact C-N 3.29Å; S167-T169 PolarHBondContact O-N 3.36Å; T169-A173 WeakPolarHBondContact O-CB 3.39Å; T169-A173 PolarHBondContact O-N 3.11Å; T169-A173 VanDerWaalsContact O-N 3.11Å
170	I	57.3	Low	57.5	Low	37 Å²	37	79 Å²	79	19%	0.19	41%	0.412	C	S	.	.	H	α-helix	trans	-71.6	-37.8	174.3	-68.1	170.9	0	0	0	111.7	E62 S166 S167 R168 A173 N174	E62-I170 VanDerWaalsContact OE1-CD1 3.28Å; E62-I170 WeakPolarHBondContact OE1-CD1 3.31Å; S166-I170 WeakPolarHBondContact O-CG1 3.47Å; S166-I170 PolarHBondContact O-N 3.44Å; S167-I170 WeakPolarHBondContact O-CB 3.49Å; S167-I170 PolarHBondContact O-N 3.16Å; S167-I170 VanDerWaalsContact O-N 3.08Å; R168-I170 PolarHBondContact O-N 2.92Å; I170-A173 PolarHBondContact O-N 3.48Å; I170-N174 VanDerWaalsContact O-CB 3.25Å; I170-N174 WeakPolarHBondContact O-CB 2.96Å; I170-N174 PolarHBondContact O-N 2.9Å
171	L	55.4	Low	57.8	Low	71 Å²	71	81 Å²	81	37%	0.372	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-46.9	175.6	-74.4	172	0	0	0	111.5	E82 S167 R168 A173 N174 E175	E82-L171 HydrophobicContact CG-CD2 4.29Å; S167-L171 PolarHBondContact O-N 3.33Å; R168-L171 WeakPolarHBondContact O-CB 3.47Å; R168-L171 PolarHBondContact O-N 3.43Å; R168-L171 VanDerWaalsContact O-N 3.1Å; L171-A173 VanDerWaalsContact C-N 3.33Å; L171-A173 PolarHBondContact O-N 2.83Å; L171-N174 PolarHBondContact O-N 3.32Å; L171-N174 VanDerWaalsContact O-N 3.17Å; L171-E175 PolarHBondContact O-N 3.42Å
172	D	58.7	Low	58	Low	99 Å²	99	77.5 Å²	77.5	53%	0.529	42%	0.42	S	S	.	.	H	α-helix	trans	-60.7	-45.5	177.8	-64.1	-18.4	0	0	0	110.1	R168 N174 E175 E176	R168-D172 PolarHBondContact O-N 3.13Å; D172-N174 PolarHBondContact O-N 2.9Å; D172-E175 PolarHBondContact O-N 3.17Å; D172-E176 WeakPolarHBondContact O-CG 3.45Å; D172-E176 PolarHBondContact O-N 3.34Å
173	A	60.2	Low	58.1	Low	34 Å²	34	78.1 Å²	78.1	28%	0.281	42%	0.422	S	S	.	.	H	α-helix	trans	-62.2	-39.8	174.8	0	0	0	0	0	112.8	T169 I170 L171 E176 F177	T169-A173 WeakPolarHBondContact O-CB 3.39Å; T169-A173 PolarHBondContact O-N 3.11Å; T169-A173 VanDerWaalsContact O-N 3.11Å; I170-A173 PolarHBondContact O-N 3.48Å; L171-A173 VanDerWaalsContact C-N 3.33Å; L171-A173 PolarHBondContact O-N 2.83Å; A173-E176 WeakPolarHBondContact O-CB 3.25Å; A173-E176 PolarHBondContact O-N 3.02Å; A173-F177 HydrophobicContact CB-CE2 4.4Å; A173-F177 WeakPolarHBondContact O-CD2 3.47Å; A173-F177 PolarHBondContact O-N 3.03Å
174	N	53.5	Low	58.2	Low	32 Å²	32	81.8 Å²	81.8	17%	0.171	44%	0.44	C	S	.	.	H	α-helix	trans	-69.2	-34.7	179.1	-169.1	20.5	0	0	0	112.2	I170 L171 D172 F177 K178	I170-N174 VanDerWaalsContact O-CB 3.25Å; I170-N174 WeakPolarHBondContact O-CB 2.96Å; I170-N174 PolarHBondContact O-N 2.9Å; L171-N174 PolarHBondContact O-N 3.32Å; L171-N174 VanDerWaalsContact O-N 3.17Å; D172-N174 PolarHBondContact O-N 2.9Å; N174-F177 PolarHBondContact O-N 3.35Å; N174-K178 PolarHBondContact O-N 2.93Å
175	E	59.4	Low	58.3	Low	141 Å²	141	85.6 Å²	85.6	66%	0.659	46%	0.455	S	S	*	.	H	α-helix	trans	-65.3	-42.2	172.1	-169.9	169	-173.1	0	0	111.2	L171 D172 F177 K178 S179	L171-E175 PolarHBondContact O-N 3.42Å; D172-E175 PolarHBondContact O-N 3.17Å; E175-F177 VanDerWaalsContact C-N 3.35Å; E175-F177 PolarHBondContact O-N 3.49Å; E175-K178 PolarHBondContact O-N 2.94Å; E175-S179 PolarHBondContact O-N 2.86Å
176	E	60.2	Low	58.4	Low	142 Å²	142	86.4 Å²	86.4	66%	0.664	46%	0.456	S	S	*	.	H	α-helix	trans	-60.7	-40.4	171.6	-71.5	-178.1	177	0	0	112.3	D172 A173 S179 M180	D172-E176 WeakPolarHBondContact O-CG 3.45Å; D172-E176 PolarHBondContact O-N 3.34Å; A173-E176 WeakPolarHBondContact O-CB 3.25Å; A173-E176 PolarHBondContact O-N 3.02Å; E176-S179 WeakPolarHBondContact O-CB 3.47Å; E176-S179 PolarHBondContact O-N 3.32Å; E176-M180 WeakPolarHBondContact O-CB 3.48Å; E176-M180 PolarHBondContact O-N 3.27Å
177	F	57.2	Low	58.9	Low	105 Å²	105	84.9 Å²	84.9	46%	0.461	45%	0.45	S	S	.	.	H	α-helix	trans	-67.5	-36.7	175.2	-76.7	-61.5	0	0	0	113.2	A173 N174 E175 M180 S181	A173-F177 HydrophobicContact CB-CE2 4.4Å; A173-F177 WeakPolarHBondContact O-CD2 3.47Å; A173-F177 PolarHBondContact O-N 3.03Å; N174-F177 PolarHBondContact O-N 3.35Å; E175-F177 VanDerWaalsContact C-N 3.35Å; E175-F177 PolarHBondContact O-N 3.49Å; F177-M180 PolarHBondContact O-N 3.46Å; F177-S181 WeakPolarHBondContact O-CB 3.38Å; F177-S181 PolarHBondContact O-N 3.27Å
178	K	58.2	Low	59.1	Low	132 Å²	132	93.3 Å²	93.3	57%	0.574	48%	0.481	S	S	*	.	H	α-helix	trans	-64.5	-41.8	172.7	-80.4	-178.4	178	176.9	0	111.8	N174 E175 M180 S181 G182	N174-K178 PolarHBondContact O-N 2.93Å; E175-K178 PolarHBondContact O-N 2.94Å; K178-M180 VanDerWaalsContact C-N 3.33Å; K178-M180 PolarHBondContact O-N 3.35Å; K178-S181 PolarHBondContact O-N 3.47Å; K178-G182 PolarHBondContact O-N 3.31Å; K178-G182 VanDerWaalsContact O-N 3.08Å
179	S	59.6	Low	59.2	Low	84 Å²	84	91.4 Å²	91.4	59%	0.587	48%	0.477	S	S	*	.	H	α-helix	trans	-58.2	-44.4	172.4	168.8	0	0	0	0	111.7	E175 E176 G182 T183	E175-S179 PolarHBondContact O-N 2.86Å; E176-S179 WeakPolarHBondContact O-CB 3.47Å; E176-S179 PolarHBondContact O-N 3.32Å; S179-G182 PolarHBondContact O-N 3.49Å; S179-T183 PolarHBondContact O-N 3.04Å
180	M	56.4	Low	59.3	Low	110 Å²	110	92 Å²	92	54%	0.542	48%	0.476	S	S	.	.	H	α-helix	trans	-69	-34.5	177.3	-171.7	174	165	0	0	113.6	E176 F177 K178 G182 T183 I184	E176-M180 WeakPolarHBondContact O-CB 3.48Å; E176-M180 PolarHBondContact O-N 3.27Å; F177-M180 PolarHBondContact O-N 3.46Å; K178-M180 VanDerWaalsContact C-N 3.33Å; K178-M180 PolarHBondContact O-N 3.35Å; M180-G182 VanDerWaalsContact C-N 3.32Å; M180-G182 PolarHBondContact O-N 3.04Å; M180-T183 WeakPolarHBondContact CA-OG1 3.4Å; M180-T183 PolarHBondContact O-N 2.97Å; M180-T183 PolarHBondContact O-OG1 3.42Å; M180-I184 HydrophobicContact CG-CD1 4.5Å; M180-I184 WeakPolarHBondContact O-CG1 3.5Å; M180-I184 PolarHBondContact O-N 3Å
181	S	57.8	Low	59.7	Low	54 Å²	54	96 Å²	96	38%	0.378	50%	0.497	S	S	.	.	H	α-helix	trans	-65.2	-36.7	172.5	-172.3	0	0	0	0	111.8	F177 K178 T183 I184 Q185	F177-S181 WeakPolarHBondContact O-CB 3.38Å; F177-S181 PolarHBondContact O-N 3.27Å; K178-S181 PolarHBondContact O-N 3.47Å; S181-T183 PolarHBondContact O-N 3.08Å; S181-I184 PolarHBondContact O-N 3.28Å; S181-Q185 WeakPolarHBondContact O-CG 3.47Å; S181-Q185 PolarHBondContact O-N 2.83Å
182	G	61.5	Low	60	Low	34 Å²	34	97 Å²	97	35%	0.351	51%	0.506	S	S	.	.	H	α-helix	trans	-59.4	-42.2	172.4	0	0	0	0	0	113	K178 S179 M180 Q185 L186	K178-G182 PolarHBondContact O-N 3.31Å; K178-G182 VanDerWaalsContact O-N 3.08Å; S179-G182 PolarHBondContact O-N 3.49Å; M180-G182 VanDerWaalsContact C-N 3.32Å; M180-G182 PolarHBondContact O-N 3.04Å; G182-Q185 PolarHBondContact O-N 2.99Å; G182-L186 WeakPolarHBondContact O-CG 3.46Å; G182-L186 PolarHBondContact O-N 3.36Å
183	T	60.9	Low	60.3	Low	85 Å²	85	99.8 Å²	99.8	52%	0.521	51%	0.513	S	S	.	.	H	α-helix	trans	-71.5	-32.6	175.9	45.9	0	0	0	0	112.9	S179 M180 S181 L186 G187	S179-T183 PolarHBondContact O-N 3.04Å; M180-T183 WeakPolarHBondContact CA-OG1 3.4Å; M180-T183 PolarHBondContact O-N 2.97Å; M180-T183 PolarHBondContact O-OG1 3.42Å; S181-T183 PolarHBondContact O-N 3.08Å; T183-L186 WeakPolarHBondContact O-CB 3.4Å; T183-L186 PolarHBondContact O-N 3.45Å; T183-G187 PolarHBondContact O-N 3.48Å
184	I	64.2	Low	60.4	Low	91 Å²	91	106.1 Å²	106.1	47%	0.467	53%	0.531	S	S	.	.	H	α-helix	trans	-65.2	-38.6	172	-71.8	168.2	0	0	0	111.9	M180 S181 L186 G187 R188	M180-I184 HydrophobicContact CG-CD1 4.5Å; M180-I184 WeakPolarHBondContact O-CG1 3.5Å; M180-I184 PolarHBondContact O-N 3Å; S181-I184 PolarHBondContact O-N 3.28Å; I184-L186 VanDerWaalsContact C-N 3.31Å; I184-L186 PolarHBondContact O-N 2.95Å; I184-G187 PolarHBondContact O-N 2.69Å; I184-R188 PolarHBondContact O-N 3.2Å
185	Q	59.3	Low	60.5	Low	125 Å²	125	108.9 Å²	108.9	58%	0.584	55%	0.546	S	S	*	.	H	α-helix	trans	-65.1	-36.1	174.8	-71.7	-174.3	6.6	0	0	112.2	S181 G182 R188 K189	S181-Q185 WeakPolarHBondContact O-CG 3.47Å; S181-Q185 PolarHBondContact O-N 2.83Å; G182-Q185 PolarHBondContact O-N 2.99Å; Q185-R188 PolarHBondContact O-N 2.96Å; Q185-K189 PolarHBondContact O-N 2.96Å; Q185-K189 VanDerWaalsContact O-N 3.13Å
186	L	60.8	Low	60.9	Low	101 Å²	101	111.6 Å²	111.6	53%	0.529	55%	0.55	S	S	.	*	H	α-helix	trans	-64	-44.6	170.9	-66.8	172.2	0	0	0	110.8	G182 T183 I184 R188 K189 L190	G182-L186 WeakPolarHBondContact O-CG 3.46Å; G182-L186 PolarHBondContact O-N 3.36Å; T183-L186 WeakPolarHBondContact O-CB 3.4Å; T183-L186 PolarHBondContact O-N 3.45Å; I184-L186 VanDerWaalsContact C-N 3.31Å; I184-L186 PolarHBondContact O-N 2.95Å; L186-R188 VanDerWaalsContact C-N 3.34Å; L186-R188 PolarHBondContact O-N 3.26Å; L186-K189 WeakPolarHBondContact O-CB 3.5Å; L186-K189 PolarHBondContact O-N 3.48Å; L186-K189 VanDerWaalsContact O-N 3.09Å; L186-L190 WeakPolarHBondContact O-CD1 3.03Å; L186-L190 PolarHBondContact O-N 3.29Å
187	G	65.6	Low	61.3	Low	30 Å²	30	113.6 Å²	113.6	31%	0.309	55%	0.551	S	S	.	*	H	α-helix	trans	-55.3	-44.1	174	0	0	0	0	0	113.4	T183 I184 K189 L190 I191	T183-G187 PolarHBondContact O-N 3.48Å; I184-G187 PolarHBondContact O-N 2.69Å; G187-K189 PolarHBondContact O-N 3.23Å; G187-L190 PolarHBondContact O-N 3.42Å; G187-L190 VanDerWaalsContact O-N 3.15Å; G187-I191 WeakPolarHBondContact O-CG1 3.45Å; G187-I191 PolarHBondContact O-N 3.15Å
188	R	58	Low	62.1	Low	184 Å²	184	113.4 Å²	113.4	69%	0.694	55%	0.552	S	S	*	*	H	α-helix	trans	-63.1	-37.6	174.7	-79.9	-174.6	170.7	170.4	-1	113.4	I184 Q185 L186 L190 I191 T192	I184-R188 PolarHBondContact O-N 3.2Å; Q185-R188 PolarHBondContact O-N 2.96Å; L186-R188 VanDerWaalsContact C-N 3.34Å; L186-R188 PolarHBondContact O-N 3.26Å; R188-L190 VanDerWaalsContact C-N 3.3Å; R188-L190 PolarHBondContact O-N 3.13Å; R188-I191 PolarHBondContact O-N 2.98Å; R188-T192 WeakPolarHBondContact O-CB 3.4Å; R188-T192 PolarHBondContact O-N 3.16Å; R188-T192 PolarHBondContact O-OG1 3.43Å
189	K	58.8	Low	62.7	Low	138 Å²	138	112.1 Å²	112.1	60%	0.6	55%	0.551	S	S	*	*	H	α-helix	trans	-65.5	-31.8	173.8	-76.9	-178.3	180	176.5	0	112.3	Q185 L186 G187 T192 K193	Q185-K189 PolarHBondContact O-N 2.96Å; Q185-K189 VanDerWaalsContact O-N 3.13Å; L186-K189 WeakPolarHBondContact O-CB 3.5Å; L186-K189 PolarHBondContact O-N 3.48Å; L186-K189 VanDerWaalsContact O-N 3.09Å; G187-K189 PolarHBondContact O-N 3.23Å; K189-T192 WeakPolarHBondContact CA-OG1 3.33Å; K189-T192 PolarHBondContact O-OG1 3.09Å; K189-K193 WeakPolarHBondContact O-CG 3.41Å; K189-K193 PolarHBondContact O-N 3.26Å
190	L	61.8	Low	63.6	Low	104 Å²	104	111.8 Å²	111.8	55%	0.545	55%	0.545	S	S	.	.	H	α-helix	trans	-72.9	-46.2	173.2	-83	84.3	0	0	0	111.6	L186 G187 R188 T192 K193 Y194	L186-L190 WeakPolarHBondContact O-CD1 3.03Å; L186-L190 PolarHBondContact O-N 3.29Å; G187-L190 PolarHBondContact O-N 3.42Å; G187-L190 VanDerWaalsContact O-N 3.15Å; R188-L190 VanDerWaalsContact C-N 3.3Å; R188-L190 PolarHBondContact O-N 3.13Å; L190-T192 VanDerWaalsContact C-N 3.35Å; L190-T192 PolarHBondContact O-N 3.05Å; L190-K193 WeakPolarHBondContact O-CB 3.46Å; L190-K193 PolarHBondContact O-N 3.15Å; L190-K193 VanDerWaalsContact O-N 3.15Å; L190-Y194 WeakPolarHBondContact O-CD2 3.47Å; L190-Y194 PolarHBondContact O-N 3.41Å
191	I	65.9	Low	64.9	Low	120 Å²	120	111.1 Å²	111.1	62%	0.615	54%	0.544	S	S	*	.	H	α-helix	trans	-60	-44.3	179.1	-68.4	165.1	0	0	0	111.4	G187 R188 K193 Y194 N195	G187-I191 WeakPolarHBondContact O-CG1 3.45Å; G187-I191 PolarHBondContact O-N 3.15Å; R188-I191 PolarHBondContact O-N 2.98Å; I191-K193 VanDerWaalsContact C-N 3.33Å; I191-K193 PolarHBondContact O-N 3.45Å; I191-Y194 PolarHBondContact O-N 3.06Å; I191-Y194 VanDerWaalsContact O-N 3.16Å; I191-N195 PolarHBondContact O-N 3.35Å
192	T	61.3	Low	66.2	Low	91 Å²	91	114.3 Å²	114.3	56%	0.558	55%	0.551	S	S	*	*	H	α-helix	trans	-66.4	-31.8	177.2	42.6	0	0	0	0	113	R188 K189 L190 R196	R188-T192 WeakPolarHBondContact O-CB 3.4Å; R188-T192 PolarHBondContact O-N 3.16Å; R188-T192 PolarHBondContact O-OG1 3.43Å; K189-T192 WeakPolarHBondContact CA-OG1 3.33Å; K189-T192 PolarHBondContact O-OG1 3.09Å; L190-T192 VanDerWaalsContact C-N 3.35Å; L190-T192 PolarHBondContact O-N 3.05Å; T192-R196 PolarHBondContact O-N 3.29Å
193	K	65.2	Low	67.4	Low	159 Å²	159	118.1 Å²	118.1	69%	0.691	56%	0.563	S	S	*	*	H	α-helix	trans	-66.9	-36.3	170.9	-80.6	-179.4	179.8	-175.1	0	112.5	K189 L190 I191	K189-K193 WeakPolarHBondContact O-CG 3.41Å; K189-K193 PolarHBondContact O-N 3.26Å; L190-K193 WeakPolarHBondContact O-CB 3.46Å; L190-K193 PolarHBondContact O-N 3.15Å; L190-K193 VanDerWaalsContact O-N 3.15Å; I191-K193 VanDerWaalsContact C-N 3.33Å; I191-K193 PolarHBondContact O-N 3.45Å
194	Y	62.3	Low	68.6	Low	166 Å²	166	119 Å²	119	65%	0.651	56%	0.564	S	S	*	*	H	α-helix	trans	-71.4	-44.2	177.2	-92.7	-87.8	0	0	0	112.6	L190 I191 R196 R197 E198	L190-Y194 WeakPolarHBondContact O-CD2 3.47Å; L190-Y194 PolarHBondContact O-N 3.41Å; I191-Y194 PolarHBondContact O-N 3.06Å; I191-Y194 VanDerWaalsContact O-N 3.16Å; Y194-R196 VanDerWaalsContact C-N 3.26Å; Y194-R196 PolarHBondContact O-N 3.26Å; Y194-R197 PolarHBondContact O-N 3.35Å; Y194-R197 VanDerWaalsContact O-N 3.12Å; Y194-E198 PolarHBondContact O-N 3.33Å
195	N	56.4	Low	69.8	Low	91 Å²	91	119.5 Å²	119.5	49%	0.487	57%	0.566	S	S	.	*	H	α-helix	trans	-61.1	-33.7	179.4	-167.9	15.6	0	0	0	112.7	I191 E198 L199	I191-N195 PolarHBondContact O-N 3.35Å; N195-E198 PolarHBondContact O-N 3.4Å; N195-L199 PolarHBondContact O-N 3.06Å
196	R	66.5	Low	71.3	Confident	198 Å²	198	120.7 Å²	120.7	75%	0.747	57%	0.57	S	S	*	*	H	α-helix	trans	-68.3	-34.6	177.4	-162.5	176.3	178.4	-169.2	-0.6	112.8	T192 Y194 T200	T192-R196 PolarHBondContact O-N 3.29Å; Y194-R196 VanDerWaalsContact C-N 3.26Å; Y194-R196 PolarHBondContact O-N 3.26Å; R196-T200 PolarHBondContact O-N 3.02Å; R196-T200 PolarHBondContact O-OG1 2.68Å
197	R	69.9	Low	72.6	Confident	183 Å²	183	120.8 Å²	120.8	69%	0.691	57%	0.57	S	S	*	*	H	α-helix	trans	-68.7	-43	174	-76.5	-174	-166.7	171.4	3.4	111.2	Y194 L199 T200 D201	Y194-R197 PolarHBondContact O-N 3.35Å; Y194-R197 VanDerWaalsContact O-N 3.12Å; R197-L199 VanDerWaalsContact C-N 3.33Å; R197-L199 PolarHBondContact O-N 3.02Å; R197-T200 PolarHBondContact O-N 3.01Å; R197-D201 WeakPolarHBondContact O-CB 3.31Å; R197-D201 PolarHBondContact O-N 3.22Å
198	E	72.9	Confident	73.9	Confident	101 Å²	101	122.2 Å²	122.2	47%	0.472	58%	0.58	S	S	.	*	H	α-helix	trans	-63	-39.7	179.6	-153.9	-168.4	153.2	0	0	112	Y194 N195 K202	Y194-E198 PolarHBondContact O-N 3.33Å; N195-E198 PolarHBondContact O-N 3.4Å; E198-K202 WeakPolarHBondContact O-CB 3.41Å; E198-K202 VanDerWaalsContact O-CG 3.31Å; E198-K202 WeakPolarHBondContact O-CG 3.42Å; E198-K202 PolarHBondContact O-N 3.43Å; E198-K202 VanDerWaalsContact OE1-CE 3.27Å; E198-K202 WeakPolarHBondContact OE1-CE 3.4Å; E198-K202 IonicContact OE1-NZ 2.9Å; E198-K202 PolarHBondContact OE1-NZ 3.12Å
199	L	71.8	Confident	75.5	Confident	105 Å²	105	118.1 Å²	118.1	55%	0.55	57%	0.571	S	S	.	*	H	α-helix	trans	-65	-41.4	174.2	-94.7	170.1	0	0	0	113.1	N195 R197 L203	N195-L199 PolarHBondContact O-N 3.06Å; R197-L199 VanDerWaalsContact C-N 3.33Å; R197-L199 PolarHBondContact O-N 3.02Å; L199-L203 WeakPolarHBondContact O-CB 3.27Å; L199-L203 PolarHBondContact O-N 2.79Å
200	T	78.1	Confident	77.1	Confident	77 Å²	77	113.6 Å²	113.6	47%	0.472	56%	0.559	S	S	.	*	H	α-helix	trans	-68.3	-41	-179	-51.1	0	0	0	0	110.4	R196 R197 L203 L204	R196-T200 PolarHBondContact O-N 3.02Å; R196-T200 PolarHBondContact O-OG1 2.68Å; R197-T200 PolarHBondContact O-N 3.01Å; T200-L203 PolarHBondContact O-N 2.91Å; T200-L204 WeakPolarHBondContact O-CG 3.42Å; T200-L204 PolarHBondContact O-N 2.95Å
201	D	83.5	Confident	78.5	Confident	96 Å²	96	113.9 Å²	113.9	51%	0.513	56%	0.561	S	S	.	*	H	α-helix	trans	-66	-44.6	177.8	-165.5	44.3	0	0	0	111.9	R197 L203 L204 I205	R197-D201 WeakPolarHBondContact O-CB 3.31Å; R197-D201 PolarHBondContact O-N 3.22Å; D201-L203 VanDerWaalsContact C-N 3.3Å; D201-L203 PolarHBondContact O-N 3.02Å; D201-L204 PolarHBondContact O-N 3.21Å; D201-I205 WeakPolarHBondContact O-CG1 3.42Å; D201-I205 PolarHBondContact O-N 2.9Å
202	K	85.6	Confident	79.8	Confident	122 Å²	122	114.6 Å²	114.6	53%	0.53	56%	0.56	S	S	.	*	H	α-helix	trans	-61.4	-36.6	173.8	-74	-179.6	-176.4	171.6	0	112.8	E198 F206	E198-K202 WeakPolarHBondContact O-CB 3.41Å; E198-K202 VanDerWaalsContact O-CG 3.31Å; E198-K202 WeakPolarHBondContact O-CG 3.42Å; E198-K202 PolarHBondContact O-N 3.43Å; E198-K202 VanDerWaalsContact OE1-CE 3.27Å; E198-K202 WeakPolarHBondContact OE1-CE 3.4Å; E198-K202 IonicContact OE1-NZ 2.9Å; E198-K202 PolarHBondContact OE1-NZ 3.12Å; K202-F206 WeakPolarHBondContact O-CB 3.4Å; K202-F206 PolarHBondContact O-N 3.2Å
203	L	85.7	Confident	81.2	Confident	113 Å²	113	114.5 Å²	114.5	59%	0.592	56%	0.555	S	S	*	*	H	α-helix	trans	-66.3	-41.1	174.8	-101.1	165	0	0	0	112.4	L199 T200 D201 F206 L207	L199-L203 WeakPolarHBondContact O-CB 3.27Å; L199-L203 PolarHBondContact O-N 2.79Å; T200-L203 PolarHBondContact O-N 2.91Å; D201-L203 VanDerWaalsContact C-N 3.3Å; D201-L203 PolarHBondContact O-N 3.02Å; L203-F206 PolarHBondContact O-N 3.48Å; L203-L207 WeakPolarHBondContact O-CB 3.42Å; L203-L207 PolarHBondContact O-N 3.31Å
204	L	86.3	Confident	82.4	Confident	105 Å²	105	109.5 Å²	109.5	55%	0.55	54%	0.544	S	S	.	.	H	α-helix	trans	-64.5	-42.8	177.2	-72.4	176.1	0	0	0	111.7	T200 D201 L207 A208	T200-L204 WeakPolarHBondContact O-CG 3.42Å; T200-L204 PolarHBondContact O-N 2.95Å; D201-L204 PolarHBondContact O-N 3.21Å; L204-L207 PolarHBondContact O-N 3.34Å; L204-A208 WeakPolarHBondContact O-CB 3.4Å; L204-A208 PolarHBondContact O-N 3.4Å
205	I	89.6	Confident	83.7	Confident	100 Å²	100	105.1 Å²	105.1	51%	0.513	53%	0.534	S	S	.	.	H	α-helix	trans	-61.8	-44.4	174.8	-66.2	168.9	0	0	0	110.6	D201 L207 A208 L209	D201-I205 WeakPolarHBondContact O-CG1 3.42Å; D201-I205 PolarHBondContact O-N 2.9Å; I205-L207 PolarHBondContact O-N 3.33Å; I205-A208 PolarHBondContact O-N 3.03Å; I205-L209 WeakPolarHBondContact O-CB 3.33Å; I205-L209 PolarHBondContact O-N 3.49Å
206	F	90.7	Very high	85.4	Confident	150 Å²	150	103.5 Å²	103.5	66%	0.658	53%	0.527	S	S	*	.	H	α-helix	trans	-62.9	-42.5	178.2	-174.6	-96.7	0	0	0	112.5	K202 L203 L209 A210	K202-F206 WeakPolarHBondContact O-CB 3.4Å; K202-F206 PolarHBondContact O-N 3.2Å; L203-F206 PolarHBondContact O-N 3.48Å; F206-L209 PolarHBondContact O-N 3.03Å; F206-A210 WeakPolarHBondContact O-CB 3.43Å; F206-A210 PolarHBondContact O-N 2.89Å
207	L	89.4	Confident	86.4	Confident	103 Å²	103	99.6 Å²	99.6	54%	0.539	52%	0.521	S	S	.	.	H	α-helix	trans	-63.8	-43.1	177.8	-174.9	68.2	0	0	0	111.8	L203 L204 I205 L209 A210 L211	L203-L207 WeakPolarHBondContact O-CB 3.42Å; L203-L207 PolarHBondContact O-N 3.31Å; L204-L207 PolarHBondContact O-N 3.34Å; I205-L207 PolarHBondContact O-N 3.33Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L207-L209 PolarHBondContact O-N 3.19Å; L207-A210 PolarHBondContact O-N 2.88Å; L207-L211 WeakPolarHBondContact O-CG 3.42Å; L207-L211 PolarHBondContact O-N 3.41Å
208	A	91.8	Very high	87.3	Confident	61 Å²	61	97.7 Å²	97.7	50%	0.504	52%	0.515	S	S	.	.	H	α-helix	trans	-61.1	-43.2	175.9	0	0	0	0	0	111.6	L204 I205 L211 F212	L204-A208 WeakPolarHBondContact O-CB 3.4Å; L204-A208 PolarHBondContact O-N 3.4Å; I205-A208 PolarHBondContact O-N 3.03Å; A208-L211 PolarHBondContact O-N 3.34Å; A208-F212 WeakPolarHBondContact O-CB 3.35Å; A208-F212 PolarHBondContact O-N 2.88Å
209	L	92.6	Very high	88	Confident	97 Å²	97	97.5 Å²	97.5	51%	0.508	52%	0.516	S	S	.	.	H	α-helix	trans	-66.9	-40	178.7	-153.7	158.6	0	0	0	111.5	I205 F206 L207 F212 L213	I205-L209 WeakPolarHBondContact O-CB 3.33Å; I205-L209 PolarHBondContact O-N 3.49Å; F206-L209 PolarHBondContact O-N 3.03Å; L207-L209 VanDerWaalsContact C-N 3.33Å; L207-L209 PolarHBondContact O-N 3.19Å; L209-F212 PolarHBondContact O-N 3.46Å; L209-L213 HydrophobicContact CD2-CD1 3.55Å; L209-L213 HydrophobicContact CD2-CG 4.05Å; L209-L213 PolarHBondContact O-N 2.83Å
210	A	92.2	Very high	88.6	Confident	43 Å²	43	95.6 Å²	95.6	36%	0.355	51%	0.509	S	S	.	.	H	α-helix	trans	-62.4	-43.6	175	0	0	0	0	0	112.4	F206 L207 L213 A214	F206-A210 WeakPolarHBondContact O-CB 3.43Å; F206-A210 PolarHBondContact O-N 2.89Å; L207-A210 PolarHBondContact O-N 2.88Å; A210-L213 PolarHBondContact O-N 3.36Å; A210-A214 WeakPolarHBondContact O-CB 3.3Å; A210-A214 PolarHBondContact O-N 3.41Å
211	L	91	Very high	88.8	Confident	110 Å²	110	98.6 Å²	98.6	58%	0.576	52%	0.515	S	S	*	.	H	α-helix	trans	-64.8	-39.7	175	-73.5	174.7	0	0	0	111.9	L207 A208 A214 T215	L207-L211 WeakPolarHBondContact O-CG 3.42Å; L207-L211 PolarHBondContact O-N 3.41Å; A208-L211 PolarHBondContact O-N 3.34Å; L211-A214 PolarHBondContact O-N 3.01Å; L211-T215 WeakPolarHBondContact O-CG2 3.25Å; L211-T215 PolarHBondContact O-N 3.39Å; L211-T215 PolarHBondContact O-OG1 2.84Å
212	F	93.4	Very high	88.7	Confident	135 Å²	135	100.9 Å²	100.9	59%	0.592	52%	0.52	S	S	*	.	H	α-helix	trans	-60.9	-48.5	174.1	-179.6	-100.1	0	0	0	111.4	A208 L209 A214 T215 V216	A208-F212 WeakPolarHBondContact O-CB 3.35Å; A208-F212 PolarHBondContact O-N 2.88Å; L209-F212 PolarHBondContact O-N 3.46Å; F212-A214 VanDerWaalsContact C-N 3.34Å; F212-A214 PolarHBondContact O-N 3.36Å; F212-T215 PolarHBondContact O-N 3.01Å; F212-T215 PolarHBondContact O-OG1 3.27Å; F212-V216 HydrophobicContact CD1-CG2 4.3Å; F212-V216 HydrophobicContact CE1-CG2 3.9Å; F212-V216 HydrophobicContact CE2-CG2 4.34Å; F212-V216 HydrophobicContact CZ-CG2 3.93Å; F212-V216 WeakPolarHBondContact O-CG2 3.49Å; F212-V216 PolarHBondContact O-N 2.85Å
213	L	90.1	Very high	88.2	Confident	89 Å²	89	104.8 Å²	104.8	47%	0.466	53%	0.532	S	S	.	.	H	α-helix	trans	-62	-40.2	175.8	-76.3	170.1	0	0	0	112.4	L209 A210 T215 V216 L217	L209-L213 HydrophobicContact CD2-CD1 3.55Å; L209-L213 HydrophobicContact CD2-CG 4.05Å; L209-L213 PolarHBondContact O-N 2.83Å; A210-L213 PolarHBondContact O-N 3.36Å; L213-T215 VanDerWaalsContact C-N 3.34Å; L213-T215 PolarHBondContact O-N 3.46Å; L213-V216 PolarHBondContact O-N 2.84Å; L213-L217 WeakPolarHBondContact O-CB 3.29Å; L213-L217 WeakPolarHBondContact O-CG 3.37Å; L213-L217 PolarHBondContact O-N 3.39Å
214	A	90.7	Very high	87.3	Confident	55 Å²	55	105.6 Å²	105.6	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-61.9	-40.9	176.9	0	0	0	0	0	112.1	A210 L211 F212 Y218	A210-A214 WeakPolarHBondContact O-CB 3.3Å; A210-A214 PolarHBondContact O-N 3.41Å; L211-A214 PolarHBondContact O-N 3.01Å; F212-A214 VanDerWaalsContact C-N 3.34Å; F212-A214 PolarHBondContact O-N 3.36Å; A214-Y218 VanDerWaalsContact O-CB 3.3Å; A214-Y218 WeakPolarHBondContact O-CB 3.35Å; A214-Y218 PolarHBondContact O-N 3.02Å
215	T	90.4	Very high	86.1	Confident	74 Å²	74	107.1 Å²	107.1	45%	0.454	54%	0.538	S	S	.	.	H	α-helix	trans	-68.9	-41.9	176.2	54.5	0	0	0	0	112.1	L211 F212 L213 Y218 I219	L211-T215 WeakPolarHBondContact O-CG2 3.25Å; L211-T215 PolarHBondContact O-N 3.39Å; L211-T215 PolarHBondContact O-OG1 2.84Å; F212-T215 PolarHBondContact O-N 3.01Å; F212-T215 PolarHBondContact O-OG1 3.27Å; L213-T215 VanDerWaalsContact C-N 3.34Å; L213-T215 PolarHBondContact O-N 3.46Å; T215-Y218 PolarHBondContact O-N 3.48Å; T215-I219 VanDerWaalsContact O-CG1 3.28Å; T215-I219 WeakPolarHBondContact O-CG1 3.48Å; T215-I219 PolarHBondContact O-N 2.85Å
216	V	91.5	Very high	84.6	Confident	56 Å²	56	106.3 Å²	106.3	34%	0.339	54%	0.539	S	S	.	.	H	α-helix	trans	-60.5	-48.2	173.6	172.7	0	0	0	0	110.9	F212 L213 Y218 I219 V220	F212-V216 HydrophobicContact CD1-CG2 4.3Å; F212-V216 HydrophobicContact CE1-CG2 3.9Å; F212-V216 HydrophobicContact CE2-CG2 4.34Å; F212-V216 HydrophobicContact CZ-CG2 3.93Å; F212-V216 WeakPolarHBondContact O-CG2 3.49Å; F212-V216 PolarHBondContact O-N 2.85Å; L213-V216 PolarHBondContact O-N 2.84Å; V216-Y218 VanDerWaalsContact C-N 3.32Å; V216-Y218 PolarHBondContact O-N 3.26Å; V216-I219 PolarHBondContact O-N 3.2Å; V216-V220 HydrophobicContact CG1-CG2 4.29Å; V216-V220 WeakPolarHBondContact O-CB 3.33Å; V216-V220 VanDerWaalsContact O-CG2 3.26Å; V216-V220 WeakPolarHBondContact O-CG2 3.4Å; V216-V220 PolarHBondContact O-N 3.43Å
217	L	87.9	Confident	82.9	Confident	116 Å²	116	108.7 Å²	108.7	61%	0.607	55%	0.55	S	S	*	.	H	α-helix	trans	-61.9	-38.8	176.4	-75.6	172.7	0	0	0	112.2	L213 V220 K221	L213-L217 WeakPolarHBondContact O-CB 3.29Å; L213-L217 WeakPolarHBondContact O-CG 3.37Å; L213-L217 PolarHBondContact O-N 3.39Å; L217-V220 PolarHBondContact O-N 3.29Å; L217-K221 VanDerWaalsContact O-CB 3.25Å; L217-K221 WeakPolarHBondContact O-CB 3.26Å; L217-K221 PolarHBondContact O-N 3.47Å
218	Y	89.1	Confident	80.9	Confident	144 Å²	144	114.2 Å²	114.2	57%	0.565	58%	0.579	S	S	*	*	H	α-helix	trans	-61.5	-45.1	174.2	175	-97.5	0	0	0	111.5	A214 T215 V216 K221 K222	A214-Y218 VanDerWaalsContact O-CB 3.3Å; A214-Y218 WeakPolarHBondContact O-CB 3.35Å; A214-Y218 PolarHBondContact O-N 3.02Å; T215-Y218 PolarHBondContact O-N 3.48Å; V216-Y218 VanDerWaalsContact C-N 3.32Å; V216-Y218 PolarHBondContact O-N 3.26Å; Y218-K221 PolarHBondContact O-N 3.3Å; Y218-K222 HydrophobicContact CE1-CD 4.07Å; Y218-K222 VanDerWaalsContact O-CB 3.25Å; Y218-K222 WeakPolarHBondContact O-CB 3.17Å; Y218-K222 PolarHBondContact O-N 2.76Å
219	I	86.9	Confident	80.4	Confident	97 Å²	97	116.9 Å²	116.9	50%	0.497	58%	0.583	S	S	.	*	H	α-helix	trans	-64	-47.8	177.1	-67.1	164.2	0	0	0	110.5	T215 V216 K221 K222 R223	T215-I219 VanDerWaalsContact O-CG1 3.28Å; T215-I219 WeakPolarHBondContact O-CG1 3.48Å; T215-I219 PolarHBondContact O-N 2.85Å; V216-I219 PolarHBondContact O-N 3.2Å; I219-K221 PolarHBondContact O-N 2.97Å; I219-K222 PolarHBondContact O-N 2.94Å; I219-R223 WeakPolarHBondContact O-CB 3.49Å; I219-R223 PolarHBondContact O-N 3.21Å
220	V	84.9	Confident	79.7	Confident	65 Å²	65	117.9 Å²	117.9	39%	0.394	59%	0.587	S	S	.	*	H	α-helix	trans	-59.4	-46.8	178.3	170.9	0	0	0	0	110.4	V216 L217 R223 L224	V216-V220 HydrophobicContact CG1-CG2 4.29Å; V216-V220 WeakPolarHBondContact O-CB 3.33Å; V216-V220 VanDerWaalsContact O-CG2 3.26Å; V216-V220 WeakPolarHBondContact O-CG2 3.4Å; V216-V220 PolarHBondContact O-N 3.43Å; L217-V220 PolarHBondContact O-N 3.29Å; V220-R223 PolarHBondContact O-N 3.26Å; V220-L224 HydrophobicContact CG1-CD1 3.54Å; V220-L224 HydrophobicContact CG1-CG 4.47Å; V220-L224 WeakPolarHBondContact O-CB 3.28Å; V220-L224 PolarHBondContact O-N 2.97Å
221	K	81.6	Confident	79	Confident	140 Å²	140	122.1 Å²	122.1	61%	0.609	60%	0.6	S	S	*	*	H	α-helix	trans	-60.1	-49.1	175.6	-172.8	-177.4	177.2	175.5	0	111.1	L217 Y218 I219 R223 F225	L217-K221 VanDerWaalsContact O-CB 3.25Å; L217-K221 WeakPolarHBondContact O-CB 3.26Å; L217-K221 PolarHBondContact O-N 3.47Å; Y218-K221 PolarHBondContact O-N 3.3Å; I219-K221 PolarHBondContact O-N 2.97Å; K221-R223 PolarHBondContact O-N 2.96Å; K221-F225 HydrophobicContact CB-CD2 4.44Å; K221-F225 HydrophobicContact CG-CD2 3.72Å; K221-F225 HydrophobicContact CG-CE2 4.15Å; K221-F225 VanDerWaalsContact O-CB 3.29Å; K221-F225 WeakPolarHBondContact O-CB 3.41Å; K221-F225 WeakPolarHBondContact O-CD2 3.47Å; K221-F225 PolarHBondContact O-N 3.39Å
222	K	80.8	Confident	78.3	Confident	143 Å²	143	122.8 Å²	122.8	62%	0.622	60%	0.601	S	S	*	*	H	α-helix	trans	-63.7	-29.1	179.8	-171.9	173	-177.5	176.1	0	112.9	Y218 I219 P226	Y218-K222 HydrophobicContact CE1-CD 4.07Å; Y218-K222 VanDerWaalsContact O-CB 3.25Å; Y218-K222 WeakPolarHBondContact O-CB 3.17Å; Y218-K222 PolarHBondContact O-N 2.76Å; I219-K222 PolarHBondContact O-N 2.94Å; K222-P226 WeakPolarHBondContact O-CD 3.25Å
223	R	76.4	Confident	77.4	Confident	205 Å²	205	122.1 Å²	122.1	77%	0.774	60%	0.601	S	S	*	*	H	α-helix	trans	-94.1	-27.3	-175.7	-155.5	177.1	-166.3	-173.9	3.6	114	I219 V220 K221 P226	I219-R223 WeakPolarHBondContact O-CB 3.49Å; I219-R223 PolarHBondContact O-N 3.21Å; V220-R223 PolarHBondContact O-N 3.26Å; K221-R223 PolarHBondContact O-N 2.96Å; R223-P226 WeakPolarHBondContact O-CD 3.18Å; R223-P226 WeakPolarHBondContact O-CG 3.46Å
224	L	66	Low	76.5	Confident	129 Å²	129	124.3 Å²	124.3	68%	0.675	61%	0.611	S	S	*	*	H	α-helix	trans	-95	-24.6	177	-75.5	168.5	0	0	0	114	V220	V220-L224 HydrophobicContact CG1-CD1 3.54Å; V220-L224 HydrophobicContact CG1-CG 4.47Å; V220-L224 WeakPolarHBondContact O-CB 3.28Å; V220-L224 PolarHBondContact O-N 2.97Å
225	F	60.7	Low	75.5	Confident	138 Å²	138	129.2 Å²	129.2	61%	0.605	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-90.2	10.8	174.4	-74.4	-89.1	0	0	0	118.2	K221 F227	K221-F225 HydrophobicContact CB-CD2 4.44Å; K221-F225 HydrophobicContact CG-CD2 3.72Å; K221-F225 HydrophobicContact CG-CE2 4.15Å; K221-F225 VanDerWaalsContact O-CB 3.29Å; K221-F225 WeakPolarHBondContact O-CB 3.41Å; K221-F225 WeakPolarHBondContact O-CD2 3.47Å; K221-F225 PolarHBondContact O-N 3.39Å; F225-F227 PolarHBondContact O-N 2.87Å
226	P	57.9	Low	74.4	Confident	82 Å²	82	133.5 Å²	133.5	53%	0.532	64%	0.635	S	S	.	*	G	3₁₀ helix	trans	-81.1	7.8	169	30	-26.2	0	0	0	113.6	K222 R223	K222-P226 WeakPolarHBondContact O-CD 3.25Å; R223-P226 WeakPolarHBondContact O-CD 3.18Å; R223-P226 WeakPolarHBondContact O-CG 3.46Å
227	F	54.9	Low	72.9	Confident	200 Å²	200	139.9 Å²	139.9	88%	0.877	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-131.7	18.2	-174.5	-93.6	-79.9	0	0	0	115.3	F225	F225-F227 PolarHBondContact O-N 2.87Å
228	L	48.1	Very low	71.6	Confident	220 Å²	220	142.1 Å²	142.1	100%	1.152	66%	0.664	S	S	*	*			trans	-124.9	0	166.3	-152.8	80	0	0	0	110.8

Retrieved 228 of 228 residues in 539.9 ms (Link to these results)

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