A0A077YVP2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YVP2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 165 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	44.4	Very low	44.9	Very low	140 Å²	140	90.7 Å²	90.7	69%	0.69	46%	0.456	S	S	*	.				0	126.3	0	-136.7	162.3	78	0	0	107.4	V5 Q6	M1-V5 HydrophobicContact CE-CG1 4.42Å; M1-V5 HydrophobicContact CG-CB 4.34Å; M1-V5 HydrophobicContact CG-CG1 4.17Å; M1-Q6 HydrophobicContact CE-CG 3.44Å; M1-Q6 VanDerWaalsContact CE-CG 3.44Å
2	N	47.2	Very low	45	Very low	118 Å²	118	85.7 Å²	85.7	63%	0.631	43%	0.431	S	S	*	.			trans	-67	142.1	-177	-152.6	-12.7	0	0	0	109.7	H4 V5 Q6	N2-H4 PolarHBondContact O-N 3.29Å; N2-H4 VanDerWaalsContact O-N 3.13Å; N2-V5 HydrophobicContact CB-CG2 4.27Å; N2-V5 WeakPolarHBondContact O-CB 3.29Å; N2-V5 PolarHBondContact O-N 3.33Å; N2-Q6 PolarHBondContact O-N 3.09Å
3	S	49.4	Very low	44.8	Very low	72 Å²	72	82.9 Å²	82.9	50%	0.503	43%	0.425	S	S	.	.	H	α-helix	trans	-54.6	-36.2	-173.7	54.9	0	0	0	0	112.7	V5 Q6 E7	S3-V5 VanDerWaalsContact C-N 3.29Å; S3-V5 PolarHBondContact O-N 3.35Å; S3-Q6 PolarHBondContact O-N 3.19Å; S3-E7 PolarHBondContact O-N 3.13Å; S3-E7 VanDerWaalsContact O-N 3.14Å
4	H	41.5	Very low	44.7	Very low	119 Å²	119	79.8 Å²	79.8	55%	0.551	41%	0.414	S	S	*	.	H	α-helix	trans	-63.4	-28.4	174.6	-75.8	-31.4	0	0	0	114.5	N2 E7 K8	N2-H4 PolarHBondContact O-N 3.29Å; N2-H4 VanDerWaalsContact O-N 3.13Å; H4-E7 IonicContact ND1-OE2 3.54Å; H4-K8 WeakPolarHBondContact O-CB 3.46Å; H4-K8 WeakPolarHBondContact O-CG 3.36Å; H4-K8 PolarHBondContact O-N 3.04Å
5	V	44.8	Very low	44.4	Very low	40 Å²	40	79.8 Å²	79.8	24%	0.242	42%	0.422	C	S	.	.	H	α-helix	trans	-73.4	-37.9	175.6	-178	0	0	0	0	110	M1 N2 S3 K8 V9 V136	M1-V5 HydrophobicContact CE-CG1 4.42Å; M1-V5 HydrophobicContact CG-CB 4.34Å; M1-V5 HydrophobicContact CG-CG1 4.17Å; N2-V5 HydrophobicContact CB-CG2 4.27Å; N2-V5 WeakPolarHBondContact O-CB 3.29Å; N2-V5 PolarHBondContact O-N 3.33Å; S3-V5 VanDerWaalsContact C-N 3.29Å; S3-V5 PolarHBondContact O-N 3.35Å; V5-K8 PolarHBondContact O-N 3.03Å; V5-V9 HydrophobicContact CG1-CG2 4.39Å; V5-V9 WeakPolarHBondContact O-CB 3.29Å; V5-V9 WeakPolarHBondContact O-CG2 3.47Å; V5-V9 PolarHBondContact O-N 3.34Å; V5-V136 HydrophobicContact CG1-CG2 4.13Å
6	Q	45.4	Very low	44.1	Very low	108 Å²	108	86.5 Å²	86.5	51%	0.505	44%	0.442	S	S	.	.	H	α-helix	trans	-64	-47.2	175.8	-82.8	179.9	-42.4	0	0	112.4	M1 N2 S3 K8 V9 Q10	M1-Q6 HydrophobicContact CE-CG 3.44Å; M1-Q6 VanDerWaalsContact CE-CG 3.44Å; N2-Q6 PolarHBondContact O-N 3.09Å; S3-Q6 PolarHBondContact O-N 3.19Å; Q6-K8 VanDerWaalsContact C-N 3.33Å; Q6-K8 PolarHBondContact O-N 3.36Å; Q6-V9 PolarHBondContact O-N 3.45Å; Q6-Q10 WeakPolarHBondContact O-CG 3.42Å; Q6-Q10 PolarHBondContact O-N 2.89Å
7	E	44.1	Very low	43.9	Very low	120 Å²	120	86.9 Å²	86.9	56%	0.561	46%	0.461	S	S	*	.	H	α-helix	trans	-60.5	-41.9	176.7	-76.6	-178.3	147.4	0	0	112	S3 H4 V9 Q10	S3-E7 PolarHBondContact O-N 3.13Å; S3-E7 VanDerWaalsContact O-N 3.14Å; H4-E7 IonicContact ND1-OE2 3.54Å; E7-V9 VanDerWaalsContact C-N 3.33Å; E7-V9 PolarHBondContact O-N 3.42Å; E7-Q10 PolarHBondContact O-N 3.15Å
8	K	43.7	Very low	43.8	Very low	82 Å²	82	83.8 Å²	83.8	36%	0.357	45%	0.447	S	S	.	.	H	α-helix	trans	-64.4	-37.1	178.5	-75.2	178.2	173	-154.3	0	112.5	H4 V5 Q6 D132	H4-K8 WeakPolarHBondContact O-CB 3.46Å; H4-K8 WeakPolarHBondContact O-CG 3.36Å; H4-K8 PolarHBondContact O-N 3.04Å; V5-K8 PolarHBondContact O-N 3.03Å; Q6-K8 VanDerWaalsContact C-N 3.33Å; Q6-K8 PolarHBondContact O-N 3.36Å; K8-D132 WeakPolarHBondContact CD-OD2 3.16Å; K8-D132 WeakPolarHBondContact CE-OD2 3.46Å; K8-D132 IonicContact NZ-OD1 3.33Å; K8-D132 PolarHBondContact NZ-OD1 2.96Å; K8-D132 IonicContact NZ-OD2 2.73Å; K8-D132 PolarHBondContact NZ-OD2 2.92Å
9	V	44.9	Very low	43.6	Very low	17 Å²	17	88.6 Å²	88.6	10%	0.103	46%	0.464	C	S	.	.	H	α-helix	trans	-73.7	-35.5	179.3	170.1	0	0	0	0	111.9	V5 Q6 E7 L11 L12 S13 F46 V136	V5-V9 HydrophobicContact CG1-CG2 4.39Å; V5-V9 WeakPolarHBondContact O-CB 3.29Å; V5-V9 WeakPolarHBondContact O-CG2 3.47Å; V5-V9 PolarHBondContact O-N 3.34Å; Q6-V9 PolarHBondContact O-N 3.45Å; E7-V9 VanDerWaalsContact C-N 3.33Å; E7-V9 PolarHBondContact O-N 3.42Å; V9-L11 PolarHBondContact O-N 3.39Å; V9-L12 PolarHBondContact O-N 3.5Å; V9-L12 VanDerWaalsContact O-N 3.11Å; V9-S13 PolarHBondContact O-N 2.96Å; V9-F46 HydrophobicContact CG1-CE1 4.2Å; V9-V136 HydrophobicContact CG2-CG2 4.34Å
10	Q	43.4	Very low	43.6	Very low	134 Å²	134	87.4 Å²	87.4	63%	0.626	46%	0.46	S	S	*	.	H	α-helix	trans	-58.7	-33.6	177.9	-81	-179	-12.6	0	0	113	Q6 E7 L12 S13	Q6-Q10 WeakPolarHBondContact O-CG 3.42Å; Q6-Q10 PolarHBondContact O-N 2.89Å; E7-Q10 PolarHBondContact O-N 3.15Å; Q10-L12 VanDerWaalsContact C-N 3.28Å; Q10-L12 PolarHBondContact O-N 2.77Å; Q10-S13 WeakPolarHBondContact CA-OG 3.49Å; Q10-S13 PolarHBondContact O-N 3.06Å; Q10-S13 PolarHBondContact O-OG 2.99Å
11	L	44.5	Very low	43.7	Very low	48 Å²	48	84.8 Å²	84.8	25%	0.251	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-30.4	178.3	-76.8	162.6	0	0	0	113.1	V9 T20 V21 I24	V9-L11 PolarHBondContact O-N 3.39Å; L11-T20 HydrophobicContact CD2-CG2 4.26Å; L11-V21 WeakPolarHBondContact O-CG2 3.33Å; L11-I24 HydrophobicContact CD2-CD1 3.75Å
12	L	46.4	Very low	43.7	Very low	30 Å²	30	80.2 Å²	80.2	16%	0.157	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-21.2	-179.9	-73.1	155.3	0	0	0	113	V9 Q10 C14 L133	V9-L12 PolarHBondContact O-N 3.5Å; V9-L12 VanDerWaalsContact O-N 3.11Å; Q10-L12 VanDerWaalsContact C-N 3.28Å; Q10-L12 PolarHBondContact O-N 2.77Å; L12-C14 PolarHBondContact O-N 3.38Å; L12-C14 VanDerWaalsContact O-N 3.09Å; L12-L133 HydrophobicContact CD1-CB 4.13Å; L12-L133 HydrophobicContact CD1-CD1 3.71Å; L12-L133 HydrophobicContact CD1-CG 4.26Å; L12-L133 HydrophobicContact CD2-CD1 4.19Å; L12-L133 HydrophobicContact CG-CD1 4.5Å
13	S	42.9	Very low	43.5	Very low	50 Å²	50	78.7 Å²	78.7	35%	0.35	42%	0.421	S	S	.	.	S	Bend	trans	-70.6	0.4	-178.8	54.2	0	0	0	0	115	V9 Q10	V9-S13 PolarHBondContact O-N 2.96Å; Q10-S13 WeakPolarHBondContact CA-OG 3.49Å; Q10-S13 PolarHBondContact O-N 3.06Å; Q10-S13 PolarHBondContact O-OG 2.99Å
14	C	43.4	Very low	43.4	Very low	39 Å²	39	79 Å²	79	26%	0.264	42%	0.417	S	S	.	.			trans	-107.8	110.8	-175.3	-149	0	0	0	0	114.7	L12 C18	L12-C14 PolarHBondContact O-N 3.38Å; L12-C14 VanDerWaalsContact O-N 3.09Å; C14-C18 HydrophobicContact CB-CB 3.17Å; C14-C18 WeakPolarHBondContact CB-SG 3.45Å; C14-C18 WeakPolarHBondContact SG-CB 3.33Å; C14-C18 CovalentContact SG-SG 1.96Å; C14-C18 PolarHBondContact SG-SG 3.45Å
15	C	39.4	Very low	43.8	Very low	80 Å²	80	74.3 Å²	74.3	54%	0.541	40%	0.395	S	S	.	.			trans	-49.6	175.3	174.4	-52.6	0	0	0	0	113.7	A17 C18	C15-A17 PolarHBondContact O-N 3.35Å; C15-C18 PolarHBondContact O-N 3Å
16	Y	40.7	Very low	43.7	Very low	187 Å²	187	76.2 Å²	76.2	73%	0.733	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-37.6	-24.4	173.9	-158.8	-99.8	0	0	0	116.3
17	A	40.2	Very low	44	Very low	93 Å²	93	73.5 Å²	73.5	77%	0.769	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-27	176.4	0	0	0	0	0	115.1	C15 K19	C15-A17 PolarHBondContact O-N 3.35Å; A17-K19 PolarHBondContact O-N 3.16Å
18	C	42.1	Very low	44.1	Very low	31 Å²	31	74.3 Å²	74.3	21%	0.209	41%	0.413	C	S	.	.			trans	-81.3	109.7	177.6	-88.2	0	0	0	0	111.5	C14 C15 T20	C14-C18 HydrophobicContact CB-CB 3.17Å; C14-C18 WeakPolarHBondContact CB-SG 3.45Å; C14-C18 WeakPolarHBondContact SG-CB 3.33Å; C14-C18 CovalentContact SG-SG 1.96Å; C14-C18 PolarHBondContact SG-SG 3.45Å; C15-C18 PolarHBondContact O-N 3Å; C18-T20 WeakPolarHBondContact CB-OG1 3.44Å; C18-T20 PolarHBondContact O-N 2.96Å; C18-T20 PolarHBondContact SG-OG1 3.24Å
19	K	40.1	Very low	44.8	Very low	176 Å²	176	72.4 Å²	72.4	77%	0.765	41%	0.41	S	S	*	.	H	α-helix	trans	-53.4	-14.9	157.7	-65.9	179.9	178.1	178.1	0	112.6	A17 V21 Y22 S23	A17-K19 PolarHBondContact O-N 3.16Å; K19-V21 PolarHBondContact O-N 3.45Å; K19-Y22 CarbonylContact O-C 3.43Å; K19-Y22 PolarHBondContact O-N 3.22Å; K19-Y22 VanDerWaalsContact O-N 3.11Å; K19-S23 WeakPolarHBondContact O-CA 3.37Å; K19-S23 WeakPolarHBondContact O-CB 3.18Å; K19-S23 PolarHBondContact O-N 3.34Å; K19-S23 PolarHBondContact O-OG 3.01Å; K19-S23 VanDerWaalsContact O-OG 3.09Å
20	T	43.2	Very low	45.5	Very low	64 Å²	64	80.5 Å²	80.5	39%	0.393	44%	0.444	S	S	.	.	H	α-helix	trans	-60.7	-45.2	-170.4	-32.9	0	0	0	0	115.8	L11 C18 Y22 S23 I24	L11-T20 HydrophobicContact CD2-CG2 4.26Å; C18-T20 WeakPolarHBondContact CB-OG1 3.44Å; C18-T20 PolarHBondContact O-N 2.96Å; C18-T20 PolarHBondContact SG-OG1 3.24Å; T20-Y22 VanDerWaalsContact C-N 3.27Å; T20-Y22 PolarHBondContact O-N 3.2Å; T20-S23 WeakPolarHBondContact CA-OG 3.48Å; T20-S23 PolarHBondContact O-OG 3.15Å; T20-S23 VanDerWaalsContact O-OG 3.1Å; T20-I24 WeakPolarHBondContact O-CG1 3.48Å
21	V	45.9	Very low	46.4	Very low	32 Å²	32	75.5 Å²	75.5	19%	0.194	42%	0.421	C	S	.	.	H	α-helix	trans	-66.7	-36.5	175.4	177.3	0	0	0	0	110.3	L11 K19 I25	L11-V21 WeakPolarHBondContact O-CG2 3.33Å; K19-V21 PolarHBondContact O-N 3.45Å; V21-I25 HydrophobicContact CG1-CD1 4.34Å; V21-I25 WeakPolarHBondContact O-CD1 3.35Å; V21-I25 WeakPolarHBondContact O-CG1 3.48Å
22	Y	43.6	Very low	47.6	Very low	44 Å²	44	76 Å²	76	17%	0.173	42%	0.422	C	S	.	.	H	α-helix	trans	-86.5	-20.5	-174.4	-60.6	-70.4	0	0	0	113.9	K19 T20 I24 F32 K36	K19-Y22 CarbonylContact O-C 3.43Å; K19-Y22 PolarHBondContact O-N 3.22Å; K19-Y22 VanDerWaalsContact O-N 3.11Å; T20-Y22 VanDerWaalsContact C-N 3.27Å; T20-Y22 PolarHBondContact O-N 3.2Å; Y22-I24 VanDerWaalsContact C-N 3.33Å; Y22-F32 HydrophobicContact CD1-CE2 4.23Å; Y22-F32 HydrophobicContact CD1-CZ 4.05Å; Y22-K36 HydrophobicContact CD1-CD 4.09Å; Y22-K36 HydrophobicContact CD1-CG 4.33Å; Y22-K36 HydrophobicContact CE1-CB 3.68Å; Y22-K36 HydrophobicContact CE1-CD 3.63Å; Y22-K36 HydrophobicContact CE1-CG 3.4Å; Y22-K36 VanDerWaalsContact CE1-CG 3.4Å; Y22-K36 WeakPolarHBondContact OH-CG 3.38Å; Y22-K36 PolarHBondContact OH-O 3.5Å
23	S	44.3	Very low	48.9	Very low	86 Å²	86	81.3 Å²	81.3	60%	0.601	45%	0.445	S	S	*	.	H	α-helix	trans	-77.6	-24.2	178.7	58.1	0	0	0	0	111.8	K19 T20	K19-S23 WeakPolarHBondContact O-CA 3.37Å; K19-S23 WeakPolarHBondContact O-CB 3.18Å; K19-S23 PolarHBondContact O-N 3.34Å; K19-S23 PolarHBondContact O-OG 3.01Å; K19-S23 VanDerWaalsContact O-OG 3.09Å; T20-S23 WeakPolarHBondContact CA-OG 3.48Å; T20-S23 PolarHBondContact O-OG 3.15Å; T20-S23 VanDerWaalsContact O-OG 3.1Å
24	I	47	Very low	50.5	Low	79 Å²	79	83.7 Å²	83.7	41%	0.405	45%	0.446	S	S	.	.	S	Bend	trans	-85.5	-17.9	177	-59.1	170.4	0	0	0	111.4	L11 T20 Y22 P26 F125	L11-I24 HydrophobicContact CD2-CD1 3.75Å; T20-I24 WeakPolarHBondContact O-CG1 3.48Å; Y22-I24 VanDerWaalsContact C-N 3.33Å; I24-P26 WeakPolarHBondContact O-CD 3.4Å; I24-F125 HydrophobicContact CG2-CE2 4.41Å; I24-F125 HydrophobicContact CG2-CZ 3.97Å
25	I	49.5	Very low	52	Low	20 Å²	20	82.2 Å²	82.2	10%	0.103	44%	0.436	C	S	.	.			trans	-88.9	94.8	175.8	-62.3	162.1	0	0	0	107.1	V21 L39 M122	V21-I25 HydrophobicContact CG1-CD1 4.34Å; V21-I25 WeakPolarHBondContact O-CD1 3.35Å; V21-I25 WeakPolarHBondContact O-CG1 3.48Å; I25-L39 HydrophobicContact CD1-CD1 4.3Å; I25-M122 HydrophobicContact CB-CE 4.19Å; I25-M122 HydrophobicContact CB-SD 4.41Å; I25-M122 HydrophobicContact CD1-CE 3.58Å; I25-M122 HydrophobicContact CG1-CE 3.7Å; I25-M122 HydrophobicContact CG1-SD 4.06Å; I25-M122 HydrophobicContact CG2-CE 3.38Å; I25-M122 HydrophobicContact CG2-SD 3.61Å
26	P	43.3	Very low	53.7	Low	80 Å²	80	81.5 Å²	81.5	52%	0.519	42%	0.424	S	S	.	.			trans	-58.4	147	155.5	30	-32.9	0	0	0	105.9	I24	I24-P26 WeakPolarHBondContact O-CD 3.4Å
27	I	51.1	Low	55.6	Low	51 Å²	51	81 Å²	81	26%	0.262	42%	0.42	S	S	.	.			trans	139.9	120.9	150.2	-65.9	148	0	0	0	111.5	S29 D119 M122	I27-S29 PolarHBondContact O-N 3.47Å; I27-D119 HydrophobicContact CD1-CB 3.94Å; I27-D119 WeakPolarHBondContact CD1-OD2 3.47Å; I27-M122 HydrophobicContact CD1-CB 3.8Å; I27-M122 HydrophobicContact CD1-CG 4.36Å
28	P	46.7	Very low	57.7	Low	137 Å²	137	76.9 Å²	76.9	89%	0.89	39%	0.387	S	S	*	.			trans	-79.8	94	159	31.4	-26.4	0	0	0	108.9
29	S	57.9	Low	59.5	Low	43 Å²	43	76.6 Å²	76.6	30%	0.301	38%	0.383	S	S	.	.			trans	-106.5	147.3	168.2	72.5	0	0	0	0	109.7	I27 N31 F32	I27-S29 PolarHBondContact O-N 3.47Å; S29-N31 PolarHBondContact O-N 3.2Å; S29-F32 VanDerWaalsContact O-CB 3.29Å; S29-F32 WeakPolarHBondContact O-CB 3.4Å; S29-F32 PolarHBondContact O-N 3.31Å; S29-F32 PolarHBondContact OG-N 3.1Å
30	K	59.3	Low	61.5	Low	187 Å²	187	70.8 Å²	70.8	81%	0.813	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-20.6	173	-71.4	-174.3	175.3	-174	0	112.9
31	N	62.1	Low	63.6	Low	28 Å²	28	70.8 Å²	70.8	15%	0.15	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	6.1	-178.5	-56.3	-38.5	0	0	0	113.7	S29 H33 R34 V35 I113 Y118	S29-N31 PolarHBondContact O-N 3.2Å; N31-H33 PolarHBondContact O-N 3.21Å; N31-H33 VanDerWaalsContact O-N 3.14Å; N31-R34 PolarHBondContact O-N 3.4Å; N31-V35 HydrophobicContact CB-CG2 4.47Å; N31-V35 PolarHBondContact O-N 3.36Å; N31-I113 VanDerWaalsContact CG-CD1 3.44Å; N31-I113 WeakPolarHBondContact ND2-CD1 3.37Å; N31-I113 WeakPolarHBondContact OD1-CD1 3.41Å; N31-Y118 HydrophobicContact CB-CE1 3.94Å; N31-Y118 WeakPolarHBondContact CB-OH 3.2Å; N31-Y118 VanDerWaalsContact CG-OH 3.27Å; N31-Y118 VanDerWaalsContact ND2-CZ 3.31Å; N31-Y118 PolarHBondContact ND2-OH 3.46Å
32	F	70.4	Confident	65.5	Low	60 Å²	60	69.4 Å²	69.4	26%	0.263	35%	0.345	S	S	.	.	H	α-helix	trans	-48.1	-46.4	179.8	173.7	-100.9	0	0	0	110.8	Y22 S29 R34 K36	Y22-F32 HydrophobicContact CD1-CE2 4.23Å; Y22-F32 HydrophobicContact CD1-CZ 4.05Å; S29-F32 VanDerWaalsContact O-CB 3.29Å; S29-F32 WeakPolarHBondContact O-CB 3.4Å; S29-F32 PolarHBondContact O-N 3.31Å; S29-F32 PolarHBondContact OG-N 3.1Å; F32-R34 PolarHBondContact O-N 3.38Å; F32-K36 HydrophobicContact CD1-CD 4.48Å; F32-K36 HydrophobicContact CE1-CD 3.75Å; F32-K36 HydrophobicContact CZ-CD 4Å; F32-K36 WeakPolarHBondContact O-CA 3.36Å; F32-K36 WeakPolarHBondContact O-CB 3.41Å; F32-K36 PolarHBondContact O-N 2.93Å
33	H	74.3	Confident	67.4	Low	141 Å²	141	67.9 Å²	67.9	65%	0.653	34%	0.342	S	S	*	.	H	α-helix	trans	-64.5	-36.7	178.6	-66.3	-68.5	0	0	0	114.2	N31 R37	N31-H33 PolarHBondContact O-N 3.21Å; N31-H33 VanDerWaalsContact O-N 3.14Å; H33-R37 WeakPolarHBondContact O-CB 3.22Å; H33-R37 PolarHBondContact O-N 3.3Å
34	R	75.9	Confident	69.4	Low	100 Å²	100	66.6 Å²	66.6	38%	0.377	33%	0.33	S	S	.	.	H	α-helix	trans	-71.5	-49.6	179.2	-179	177.9	174	179.8	-3.6	111.2	N31 F32 K36 R37 A38 S108 E111	N31-R34 PolarHBondContact O-N 3.4Å; F32-R34 PolarHBondContact O-N 3.38Å; R34-K36 VanDerWaalsContact C-N 3.31Å; R34-K36 PolarHBondContact O-N 3.1Å; R34-R37 PolarHBondContact O-N 3.44Å; R34-A38 PolarHBondContact O-N 2.66Å; R34-S108 PolarHBondContact NE-OG 2.88Å; R34-E111 IonicContact CZ-OE1 2.95Å; R34-E111 IonicContact CZ-OE2 2.8Å; R34-E111 IonicContact NH1-OE1 2.69Å; R34-E111 IonicContact NH1-OE2 3.32Å; R34-E111 PolarHBondContact NH1-OE2 2.79Å; R34-E111 VanDerWaalsContact NH2-CD 3.28Å; R34-E111 IonicContact NH2-OE1 2.62Å; R34-E111 PolarHBondContact NH2-OE1 2.91Å; R34-E111 IonicContact NH2-OE2 3.56Å; R34-E111 PolarHBondContact NH2-OE2 2.97Å
35	V	75.3	Confident	71.5	Confident	7 Å²	7	64.1 Å²	64.1	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-62.1	-43.1	176.6	177.5	0	0	0	0	109.9	N31 R37 A38 L39 M109 Y118 M122	N31-V35 HydrophobicContact CB-CG2 4.47Å; N31-V35 PolarHBondContact O-N 3.36Å; V35-R37 PolarHBondContact O-N 2.98Å; V35-A38 PolarHBondContact O-N 3.1Å; V35-L39 HydrophobicContact CG1-CD1 3.85Å; V35-L39 HydrophobicContact CG1-CG 4.26Å; V35-L39 WeakPolarHBondContact O-CB 3.5Å; V35-L39 WeakPolarHBondContact O-CG 3.36Å; V35-L39 PolarHBondContact O-N 3.19Å; V35-M109 HydrophobicContact CB-SD 4.25Å; V35-M109 HydrophobicContact CG1-SD 3.64Å; V35-M109 HydrophobicContact CG2-SD 3.52Å; V35-M109 VanDerWaalsContact CG2-SD 3.52Å; V35-Y118 HydrophobicContact CG2-CE1 4.27Å; V35-M122 HydrophobicContact CG1-CE 4.26Å
36	K	74.8	Confident	73.3	Confident	66 Å²	66	63.3 Å²	63.3	29%	0.287	31%	0.313	S	S	.	.	H	α-helix	trans	-54.8	-49.2	173	167.1	159.2	-170.7	-175.4	0	112.2	Y22 F32 R34 L39 H40	Y22-K36 HydrophobicContact CD1-CD 4.09Å; Y22-K36 HydrophobicContact CD1-CG 4.33Å; Y22-K36 HydrophobicContact CE1-CB 3.68Å; Y22-K36 HydrophobicContact CE1-CD 3.63Å; Y22-K36 HydrophobicContact CE1-CG 3.4Å; Y22-K36 VanDerWaalsContact CE1-CG 3.4Å; Y22-K36 WeakPolarHBondContact OH-CG 3.38Å; Y22-K36 PolarHBondContact OH-O 3.5Å; F32-K36 HydrophobicContact CD1-CD 4.48Å; F32-K36 HydrophobicContact CE1-CD 3.75Å; F32-K36 HydrophobicContact CZ-CD 4Å; F32-K36 WeakPolarHBondContact O-CA 3.36Å; F32-K36 WeakPolarHBondContact O-CB 3.41Å; F32-K36 PolarHBondContact O-N 2.93Å; R34-K36 VanDerWaalsContact C-N 3.31Å; R34-K36 PolarHBondContact O-N 3.1Å; K36-L39 PolarHBondContact O-N 3.07Å; K36-H40 VanDerWaalsContact O-CB 3.31Å; K36-H40 WeakPolarHBondContact O-CB 3.29Å; K36-H40 PolarHBondContact O-N 3.31Å
37	R	81.7	Confident	75.4	Confident	175 Å²	175	62 Å²	62	66%	0.66	30%	0.304	S	S	*	.	H	α-helix	trans	-62.1	-46.9	178.1	-174.5	-179	-66	173.2	-1.8	111.4	H33 R34 V35 L39 H40 E41	H33-R37 WeakPolarHBondContact O-CB 3.22Å; H33-R37 PolarHBondContact O-N 3.3Å; R34-R37 PolarHBondContact O-N 3.44Å; V35-R37 PolarHBondContact O-N 2.98Å; R37-L39 PolarHBondContact O-N 2.86Å; R37-H40 WeakPolarHBondContact O-CB 3.24Å; R37-H40 PolarHBondContact O-N 3.23Å; R37-E41 WeakPolarHBondContact CG-OE1 3.22Å; R37-E41 WeakPolarHBondContact O-CG 3.41Å; R37-E41 PolarHBondContact O-N 2.87Å
38	A	82.4	Confident	77.3	Confident	8 Å²	8	63 Å²	63	7%	0.066	31%	0.307	C	S	.	.	H	α-helix	trans	-62.9	-42.1	179.7	0	0	0	0	0	112.5	R34 V35 H40 E41 L42 V105	R34-A38 PolarHBondContact O-N 2.66Å; V35-A38 PolarHBondContact O-N 3.1Å; A38-H40 VanDerWaalsContact C-N 3.35Å; A38-E41 PolarHBondContact O-N 3.37Å; A38-L42 WeakPolarHBondContact O-CB 3.41Å; A38-L42 PolarHBondContact O-N 3.46Å; A38-V105 HydrophobicContact CB-CG2 3.69Å; A38-V105 WeakPolarHBondContact O-CG2 3.33Å
39	L	80.9	Confident	79.4	Confident	24 Å²	24	56.5 Å²	56.5	13%	0.126	27%	0.265	C	S	.	.	H	α-helix	trans	-65.2	-38.5	174.7	-73.9	172.9	0	0	0	112	I25 V35 K36 R37 L42 A43 V105 V126	I25-L39 HydrophobicContact CD1-CD1 4.3Å; V35-L39 HydrophobicContact CG1-CD1 3.85Å; V35-L39 HydrophobicContact CG1-CG 4.26Å; V35-L39 WeakPolarHBondContact O-CB 3.5Å; V35-L39 WeakPolarHBondContact O-CG 3.36Å; V35-L39 PolarHBondContact O-N 3.19Å; K36-L39 PolarHBondContact O-N 3.07Å; R37-L39 PolarHBondContact O-N 2.86Å; L39-L42 PolarHBondContact O-N 2.92Å; L39-A43 PolarHBondContact O-N 3.11Å; L39-V105 HydrophobicContact CD2-CG1 3.89Å; L39-V105 HydrophobicContact CD2-CG2 4.27Å; L39-V126 HydrophobicContact CD2-CG1 4.23Å
40	H	81.3	Confident	80.9	Confident	55 Å²	55	60.1 Å²	60.1	26%	0.255	27%	0.272	S	S	.	.	H	α-helix	trans	-64.5	-47.3	175.7	178.6	63.5	0	0	0	111.9	K36 R37 A38 L42 A43 V44	K36-H40 VanDerWaalsContact O-CB 3.31Å; K36-H40 WeakPolarHBondContact O-CB 3.29Å; K36-H40 PolarHBondContact O-N 3.31Å; R37-H40 WeakPolarHBondContact O-CB 3.24Å; R37-H40 PolarHBondContact O-N 3.23Å; A38-H40 VanDerWaalsContact C-N 3.35Å; H40-L42 VanDerWaalsContact C-N 3.29Å; H40-L42 PolarHBondContact O-N 2.95Å; H40-A43 PolarHBondContact O-N 2.89Å; H40-A43 VanDerWaalsContact O-N 3.15Å; H40-V44 WeakPolarHBondContact O-CG2 3.25Å; H40-V44 PolarHBondContact O-N 3.14Å
41	E	87.1	Confident	82.4	Confident	64 Å²	64	54.9 Å²	54.9	30%	0.299	25%	0.253	S	S	.	.	H	α-helix	trans	-57.6	-43.9	174.3	-72.9	171.9	-161.3	0	0	111.2	R37 A38 A43 V44 Q45 R104	R37-E41 WeakPolarHBondContact CG-OE1 3.22Å; R37-E41 WeakPolarHBondContact O-CG 3.41Å; R37-E41 PolarHBondContact O-N 2.87Å; A38-E41 PolarHBondContact O-N 3.37Å; E41-A43 VanDerWaalsContact C-N 3.34Å; E41-A43 PolarHBondContact O-N 3.01Å; E41-V44 PolarHBondContact O-N 3.43Å; E41-Q45 VanDerWaalsContact O-CG 3.3Å; E41-Q45 WeakPolarHBondContact O-CG 3.38Å; E41-Q45 PolarHBondContact O-N 3.26Å; E41-R104 IonicContact OE2-CZ 3.98Å; E41-R104 IonicContact OE2-NE 3.44Å; E41-R104 IonicContact OE2-NH2 3.52Å; E41-R104 PolarHBondContact OE2-NH2 3.11Å
42	L	87	Confident	83.9	Confident	2 Å²	2	54 Å²	54	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-58.8	-43.3	175.2	178.3	59.6	0	0	0	112.2	A38 L39 H40 Q45 F46 V98 C101 A102 V105 V130 L133	A38-L42 WeakPolarHBondContact O-CB 3.41Å; A38-L42 PolarHBondContact O-N 3.46Å; L39-L42 PolarHBondContact O-N 2.92Å; H40-L42 VanDerWaalsContact C-N 3.29Å; H40-L42 PolarHBondContact O-N 2.95Å; L42-Q45 PolarHBondContact O-N 3.16Å; L42-F46 VanDerWaalsContact O-CB 3.31Å; L42-F46 WeakPolarHBondContact O-CB 3.47Å; L42-F46 PolarHBondContact O-N 3.46Å; L42-V98 HydrophobicContact CD1-CG1 4.15Å; L42-C101 HydrophobicContact CB-CB 4.1Å; L42-C101 HydrophobicContact CD1-CB 3.89Å; L42-A102 HydrophobicContact CD1-CB 4.24Å; L42-V105 HydrophobicContact CB-CG2 4.26Å; L42-V105 HydrophobicContact CD2-CG2 4.1Å; L42-V130 HydrophobicContact CD2-CG2 4.17Å; L42-L133 HydrophobicContact CD1-CD1 3.98Å; L42-L133 HydrophobicContact CD1-CD2 4.29Å; L42-L133 HydrophobicContact CD2-CD1 4.07Å; L42-L133 HydrophobicContact CG-CD1 3.91Å
43	A	83.1	Confident	84.9	Confident	13 Å²	13	51.5 Å²	51.5	11%	0.107	24%	0.239	C	C	.	.	H	α-helix	trans	-64.6	-40.9	177.9	0	0	0	0	0	112.7	L39 H40 E41 F46 T47	L39-A43 PolarHBondContact O-N 3.11Å; H40-A43 PolarHBondContact O-N 2.89Å; H40-A43 VanDerWaalsContact O-N 3.15Å; E41-A43 VanDerWaalsContact C-N 3.34Å; E41-A43 PolarHBondContact O-N 3.01Å; A43-F46 PolarHBondContact O-N 3.35Å; A43-T47 PolarHBondContact O-N 3.26Å; A43-T47 PolarHBondContact O-OG1 2.9Å
44	V	86.9	Confident	85.8	Confident	58 Å²	58	49.9 Å²	49.9	35%	0.352	23%	0.232	S	C	.	.	H	α-helix	trans	-62.1	-48.8	174.5	173.4	0	0	0	0	110.2	H40 E41 F46 T47 E48	H40-V44 WeakPolarHBondContact O-CG2 3.25Å; H40-V44 PolarHBondContact O-N 3.14Å; E41-V44 PolarHBondContact O-N 3.43Å; V44-F46 VanDerWaalsContact C-N 3.32Å; V44-F46 PolarHBondContact O-N 3.35Å; V44-T47 WeakPolarHBondContact O-CB 3.17Å; V44-T47 PolarHBondContact O-N 3.44Å; V44-T47 VanDerWaalsContact O-N 3.08Å; V44-E48 PolarHBondContact O-N 3.21Å
45	Q	90.1	Very high	86.6	Confident	28 Å²	28	50.2 Å²	50.2	13%	0.131	24%	0.237	C	C	.	.	H	α-helix	trans	-65.4	-35.3	179.7	-65.3	-45.5	-53.5	0	0	112.7	E41 L42 T47 E48 F49 K97 V98 C101	E41-Q45 VanDerWaalsContact O-CG 3.3Å; E41-Q45 WeakPolarHBondContact O-CG 3.38Å; E41-Q45 PolarHBondContact O-N 3.26Å; L42-Q45 PolarHBondContact O-N 3.16Å; Q45-T47 VanDerWaalsContact C-N 3.29Å; Q45-T47 PolarHBondContact O-N 3.44Å; Q45-E48 PolarHBondContact NE2-OE1 3.31Å; Q45-E48 PolarHBondContact O-N 3.4Å; Q45-E48 PolarHBondContact OE1-OE1 3.45Å; Q45-E48 PolarHBondContact OE1-OE2 2.91Å; Q45-F49 PolarHBondContact O-N 3.31Å; Q45-K97 HydrophobicContact CB-CB 4.48Å; Q45-K97 HydrophobicContact CG-CB 4.2Å; Q45-V98 VanDerWaalsContact C-CG2 3.47Å; Q45-V98 HydrophobicContact CB-CG2 3.95Å; Q45-V98 VanDerWaalsContact O-CG2 3.28Å; Q45-V98 WeakPolarHBondContact O-CG2 3.41Å; Q45-C101 WeakPolarHBondContact CG-SG 3.35Å
46	F	88.4	Confident	87.4	Confident	3 Å²	3	49.9 Å²	49.9	1%	0.013	24%	0.236	C	C	.	.	H	α-helix	trans	-67.1	-32.6	174.1	-173.6	-107.1	0	0	0	112.1	V9 L42 A43 V44 F49 R50 L133 V136 V137	V9-F46 HydrophobicContact CG1-CE1 4.2Å; L42-F46 VanDerWaalsContact O-CB 3.31Å; L42-F46 WeakPolarHBondContact O-CB 3.47Å; L42-F46 PolarHBondContact O-N 3.46Å; A43-F46 PolarHBondContact O-N 3.35Å; V44-F46 VanDerWaalsContact C-N 3.32Å; V44-F46 PolarHBondContact O-N 3.35Å; F46-F49 HydrophobicContact CD2-CD1 4.11Å; F46-F49 HydrophobicContact CE2-CD1 4.01Å; F46-F49 HydrophobicContact CE2-CE1 4.32Å; F46-F49 PolarHBondContact O-N 3.28Å; F46-R50 HydrophobicContact CD1-CG 4.45Å; F46-R50 HydrophobicContact CE1-CG 4.11Å; F46-R50 HydrophobicContact CZ-CG 4.33Å; F46-R50 WeakPolarHBondContact O-CG 3.28Å; F46-R50 PolarHBondContact O-N 2.85Å; F46-L133 HydrophobicContact CB-CD1 4.2Å; F46-L133 HydrophobicContact CD2-CD1 3.9Å; F46-L133 HydrophobicContact CD2-CD2 3.86Å; F46-L133 HydrophobicContact CD2-CG 3.69Å; F46-L133 HydrophobicContact CE2-CD1 4.47Å; F46-L133 HydrophobicContact CE2-CD2 4.26Å; F46-L133 HydrophobicContact CE2-CG 3.88Å; F46-L133 HydrophobicContact CG-CD1 4.01Å; F46-L133 HydrophobicContact CG-CG 4.29Å; F46-V136 HydrophobicContact CE2-CG1 4.35Å; F46-V136 HydrophobicContact CZ-CG1 4.08Å; F46-V137 HydrophobicContact CD2-CG2 4.15Å; F46-V137 HydrophobicContact CE2-CG2 3.96Å
47	T	87.5	Confident	88.1	Confident	52 Å²	52	50.8 Å²	50.8	32%	0.319	24%	0.239	S	C	.	.	H	α-helix	trans	-67.5	-44.8	172.7	-55.1	0	0	0	0	111	A43 V44 Q45 F49 R50 N51	A43-T47 PolarHBondContact O-N 3.26Å; A43-T47 PolarHBondContact O-OG1 2.9Å; V44-T47 WeakPolarHBondContact O-CB 3.17Å; V44-T47 PolarHBondContact O-N 3.44Å; V44-T47 VanDerWaalsContact O-N 3.08Å; Q45-T47 VanDerWaalsContact C-N 3.29Å; Q45-T47 PolarHBondContact O-N 3.44Å; T47-F49 VanDerWaalsContact C-N 3.3Å; T47-F49 PolarHBondContact O-N 2.84Å; T47-R50 PolarHBondContact O-N 3.49Å; T47-N51 PolarHBondContact O-N 3.06Å
48	E	90	Very high	88.7	Confident	71 Å²	71	47.6 Å²	47.6	33%	0.332	23%	0.232	S	C	.	.	H	α-helix	trans	-56.3	-44.8	172.2	-72.2	-179.1	-144.8	0	0	111.4	V44 Q45 R50 N51 A52 K97	V44-E48 PolarHBondContact O-N 3.21Å; Q45-E48 PolarHBondContact NE2-OE1 3.31Å; Q45-E48 PolarHBondContact O-N 3.4Å; Q45-E48 PolarHBondContact OE1-OE1 3.45Å; Q45-E48 PolarHBondContact OE1-OE2 2.91Å; E48-R50 PolarHBondContact O-N 3.4Å; E48-N51 PolarHBondContact O-N 3.32Å; E48-A52 PolarHBondContact O-N 3.46Å; E48-K97 IonicContact OE2-NZ 2.79Å; E48-K97 PolarHBondContact OE2-NZ 3.04Å
49	F	91.2	Very high	89.1	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.009	23%	0.234	C	C	.	.	H	α-helix	trans	-58.9	-45.8	174.6	167.3	-102.2	0	0	0	112.6	Q45 F46 T47 N51 A52 V53 L91 A94 V95 V98 V137 E140	Q45-F49 PolarHBondContact O-N 3.31Å; F46-F49 HydrophobicContact CD2-CD1 4.11Å; F46-F49 HydrophobicContact CE2-CD1 4.01Å; F46-F49 HydrophobicContact CE2-CE1 4.32Å; F46-F49 PolarHBondContact O-N 3.28Å; T47-F49 VanDerWaalsContact C-N 3.3Å; T47-F49 PolarHBondContact O-N 2.84Å; F49-N51 VanDerWaalsContact C-N 3.31Å; F49-N51 PolarHBondContact O-N 3.45Å; F49-A52 PolarHBondContact O-N 3.5Å; F49-V53 HydrophobicContact CD1-CG2 4.37Å; F49-V53 HydrophobicContact CD2-CG2 4.13Å; F49-V53 HydrophobicContact CE1-CG2 3.9Å; F49-V53 HydrophobicContact CE2-CG2 3.63Å; F49-V53 HydrophobicContact CG-CG2 4.48Å; F49-V53 HydrophobicContact CZ-CG2 3.51Å; F49-V53 VanDerWaalsContact O-CG2 3.31Å; F49-V53 WeakPolarHBondContact O-CG2 3.37Å; F49-V53 PolarHBondContact O-N 3.16Å; F49-L91 HydrophobicContact CD2-CD1 4.13Å; F49-L91 HydrophobicContact CE2-CD1 3.82Å; F49-A94 HydrophobicContact CB-CB 4.22Å; F49-V95 HydrophobicContact CD2-CG2 3.76Å; F49-V95 HydrophobicContact CE2-CG2 3.57Å; F49-V98 HydrophobicContact CB-CG2 3.83Å; F49-V137 HydrophobicContact CD1-CG2 4.11Å; F49-V137 HydrophobicContact CE1-CB 4.3Å; F49-V137 HydrophobicContact CE1-CG1 4.47Å; F49-V137 HydrophobicContact CE1-CG2 3.9Å; F49-V137 HydrophobicContact CE2-CG1 3.99Å; F49-V137 HydrophobicContact CZ-CB 4.17Å; F49-V137 HydrophobicContact CZ-CG1 3.96Å; F49-V137 HydrophobicContact CZ-CG2 4.22Å; F49-E140 HydrophobicContact CE1-CB 4.23Å; F49-E140 HydrophobicContact CZ-CB 3.82Å
50	R	89.9	Confident	89.5	Confident	118 Å²	118	47.4 Å²	47.4	45%	0.445	23%	0.23	S	C	.	.	H	α-helix	trans	-61.8	-39.6	177.5	-75.9	-175	65.8	-175.3	-1.6	112.3	F46 T47 E48 V53 Q54	F46-R50 HydrophobicContact CD1-CG 4.45Å; F46-R50 HydrophobicContact CE1-CG 4.11Å; F46-R50 HydrophobicContact CZ-CG 4.33Å; F46-R50 WeakPolarHBondContact O-CG 3.28Å; F46-R50 PolarHBondContact O-N 2.85Å; T47-R50 PolarHBondContact O-N 3.49Å; E48-R50 PolarHBondContact O-N 3.4Å; R50-V53 PolarHBondContact O-N 3.3Å; R50-Q54 WeakPolarHBondContact O-CB 3.45Å; R50-Q54 PolarHBondContact O-N 3.34Å
51	N	91	Very high	89.8	Confident	78 Å²	78	50.5 Å²	50.5	42%	0.417	25%	0.248	S	C	.	.	H	α-helix	trans	-63.9	-46.7	175.6	-67.4	-9.9	0	0	0	110.5	T47 E48 F49 V53 Q54 E55	T47-N51 PolarHBondContact O-N 3.06Å; E48-N51 PolarHBondContact O-N 3.32Å; F49-N51 VanDerWaalsContact C-N 3.31Å; F49-N51 PolarHBondContact O-N 3.45Å; N51-V53 VanDerWaalsContact C-N 3.3Å; N51-V53 PolarHBondContact O-N 3.15Å; N51-Q54 PolarHBondContact O-N 2.97Å; N51-Q54 VanDerWaalsContact O-N 3.08Å; N51-E55 WeakPolarHBondContact O-CB 3.49Å; N51-E55 WeakPolarHBondContact O-CG 3.39Å; N51-E55 PolarHBondContact O-N 3.34Å
52	A	93.1	Very high	90	Very high	8 Å²	8	49.8 Å²	49.8	7%	0.066	25%	0.249	C	C	.	.	H	α-helix	trans	-59	-40.1	175.7	0	0	0	0	0	112.3	E48 F49 S56 L91 A94	E48-A52 PolarHBondContact O-N 3.46Å; F49-A52 PolarHBondContact O-N 3.5Å; A52-S56 WeakPolarHBondContact O-CB 3.49Å; A52-S56 PolarHBondContact O-N 2.8Å; A52-S56 PolarHBondContact O-OG 3.27Å; A52-L91 HydrophobicContact CB-CD1 4.45Å; A52-A94 HydrophobicContact CB-CB 4.11Å
53	V	91.4	Very high	90.1	Very high	8 Å²	8	49.9 Å²	49.9	5%	0.048	25%	0.25	C	C	.	.	H	α-helix	trans	-63.7	-43.1	174.5	168	0	0	0	0	111.5	F49 R50 N51 S56 K57 L91 E140 L144	F49-V53 HydrophobicContact CD1-CG2 4.37Å; F49-V53 HydrophobicContact CD2-CG2 4.13Å; F49-V53 HydrophobicContact CE1-CG2 3.9Å; F49-V53 HydrophobicContact CE2-CG2 3.63Å; F49-V53 HydrophobicContact CG-CG2 4.48Å; F49-V53 HydrophobicContact CZ-CG2 3.51Å; F49-V53 VanDerWaalsContact O-CG2 3.31Å; F49-V53 WeakPolarHBondContact O-CG2 3.37Å; F49-V53 PolarHBondContact O-N 3.16Å; R50-V53 PolarHBondContact O-N 3.3Å; N51-V53 VanDerWaalsContact C-N 3.3Å; N51-V53 PolarHBondContact O-N 3.15Å; V53-S56 WeakPolarHBondContact O-CB 3.42Å; V53-S56 PolarHBondContact O-N 2.99Å; V53-K57 HydrophobicContact CG1-CD 4.21Å; V53-K57 WeakPolarHBondContact O-CG 3.48Å; V53-K57 PolarHBondContact O-N 3.41Å; V53-L91 HydrophobicContact CG2-CD1 3.83Å; V53-E140 HydrophobicContact CG2-CB 4.33Å; V53-L144 HydrophobicContact CB-CD1 4.13Å; V53-L144 HydrophobicContact CG1-CD1 4.1Å; V53-L144 HydrophobicContact CG2-CD1 3.83Å
54	Q	92	Very high	90.3	Very high	108 Å²	108	52.6 Å²	52.6	51%	0.505	26%	0.262	S	S	.	.	H	α-helix	trans	-66.5	-45.9	179.1	-178.9	175.1	-22.9	0	0	111.6	R50 N51 S56 K57 Q58	R50-Q54 WeakPolarHBondContact O-CB 3.45Å; R50-Q54 PolarHBondContact O-N 3.34Å; N51-Q54 PolarHBondContact O-N 2.97Å; N51-Q54 VanDerWaalsContact O-N 3.08Å; Q54-S56 VanDerWaalsContact C-N 3.27Å; Q54-S56 PolarHBondContact O-N 3.13Å; Q54-K57 PolarHBondContact O-N 3.37Å; Q54-Q58 WeakPolarHBondContact O-CB 3.4Å; Q54-Q58 WeakPolarHBondContact O-CG 3.08Å; Q54-Q58 PolarHBondContact O-N 2.97Å
55	E	92.6	Very high	90.3	Very high	106 Å²	106	53.3 Å²	53.3	50%	0.495	27%	0.267	S	S	.	.	H	α-helix	trans	-57.2	-42.7	173.8	-72.9	169.4	-165.3	0	0	110.7	N51 K57 Q58 F59	N51-E55 WeakPolarHBondContact O-CB 3.49Å; N51-E55 WeakPolarHBondContact O-CG 3.39Å; N51-E55 PolarHBondContact O-N 3.34Å; E55-K57 PolarHBondContact O-N 3.37Å; E55-Q58 PolarHBondContact O-N 2.92Å; E55-F59 WeakPolarHBondContact O-CB 3.45Å; E55-F59 PolarHBondContact O-N 3.17Å
56	S	92.7	Very high	90.3	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.007	28%	0.278	C	S	.	.	H	α-helix	trans	-61.5	-44.3	176.8	-56	0	0	0	0	112.7	A52 V53 Q54 A60 V87	A52-S56 WeakPolarHBondContact O-CB 3.49Å; A52-S56 PolarHBondContact O-N 2.8Å; A52-S56 PolarHBondContact O-OG 3.27Å; V53-S56 WeakPolarHBondContact O-CB 3.42Å; V53-S56 PolarHBondContact O-N 2.99Å; Q54-S56 VanDerWaalsContact C-N 3.27Å; Q54-S56 PolarHBondContact O-N 3.13Å; S56-A60 PolarHBondContact O-N 3.31Å; S56-V87 WeakPolarHBondContact OG-CG1 3.31Å
57	K	90.7	Very high	90.2	Very high	84 Å²	84	56.9 Å²	56.9	37%	0.365	29%	0.286	S	S	.	.	H	α-helix	trans	-65.7	-42.2	177	-71.9	173.2	-175.8	171	0	111.5	V53 Q54 E55 A60 L61 E140 L144	V53-K57 HydrophobicContact CG1-CD 4.21Å; V53-K57 WeakPolarHBondContact O-CG 3.48Å; V53-K57 PolarHBondContact O-N 3.41Å; Q54-K57 PolarHBondContact O-N 3.37Å; E55-K57 PolarHBondContact O-N 3.37Å; K57-A60 PolarHBondContact O-N 3Å; K57-L61 WeakPolarHBondContact O-CG 3.4Å; K57-L61 PolarHBondContact O-N 3.36Å; K57-E140 IonicContact NZ-OE1 2.74Å; K57-E140 IonicContact NZ-OE2 3.51Å; K57-E140 PolarHBondContact NZ-OE2 3.15Å; K57-L144 HydrophobicContact CG-CD2 3.89Å
58	Q	92.5	Very high	90.2	Very high	109 Å²	109	62 Å²	62	51%	0.509	30%	0.304	S	S	.	.	H	α-helix	trans	-62.9	-46.1	177.7	-75.5	178	-16.3	0	0	111.2	Q54 E55 A60 L61 S62	Q54-Q58 WeakPolarHBondContact O-CB 3.4Å; Q54-Q58 WeakPolarHBondContact O-CG 3.08Å; Q54-Q58 PolarHBondContact O-N 2.97Å; E55-Q58 PolarHBondContact O-N 2.92Å; Q58-A60 PolarHBondContact O-N 3.28Å; Q58-L61 PolarHBondContact O-N 2.86Å; Q58-S62 WeakPolarHBondContact O-CB 3.35Å; Q58-S62 PolarHBondContact O-N 3.31Å; Q58-S62 PolarHBondContact O-OG 2.94Å
59	F	92.4	Very high	90.2	Very high	22 Å²	22	65.9 Å²	65.9	10%	0.096	32%	0.322	C	S	.	.	H	α-helix	trans	-57.3	-48.1	174.8	168.3	-103.1	0	0	0	111.9	E55 L61 S62 Y63 G80 R83 V87 F148 L151	E55-F59 WeakPolarHBondContact O-CB 3.45Å; E55-F59 PolarHBondContact O-N 3.17Å; F59-L61 VanDerWaalsContact C-N 3.33Å; F59-L61 PolarHBondContact O-N 3.39Å; F59-S62 PolarHBondContact O-N 3.48Å; F59-S62 PolarHBondContact O-OG 3.34Å; F59-Y63 HydrophobicContact CZ-CD2 4.49Å; F59-Y63 WeakPolarHBondContact O-CB 3.37Å; F59-Y63 PolarHBondContact O-N 3.04Å; F59-G80 WeakPolarHBondContact CZ-O 3.48Å; F59-R83 HydrophobicContact CD2-CB 4.19Å; F59-R83 HydrophobicContact CE2-CB 3.39Å; F59-R83 HydrophobicContact CE2-CG 4.32Å; F59-R83 HydrophobicContact CZ-CB 3.72Å; F59-V87 HydrophobicContact CB-CG2 4.31Å; F59-V87 HydrophobicContact CD1-CG2 4.24Å; F59-V87 HydrophobicContact CG-CG2 4.14Å; F59-F148 HydrophobicContact CD1-CE1 4.06Å; F59-F148 HydrophobicContact CD1-CZ 4.47Å; F59-F148 HydrophobicContact CE1-CE1 4.06Å; F59-L151 HydrophobicContact CE1-CD1 4.08Å
60	A	88.5	Confident	90.1	Very high	5 Å²	5	67.1 Å²	67.1	4%	0.041	33%	0.333	C	S	.	.	H	α-helix	trans	-61.6	-41.4	-179.9	0	0	0	0	0	112.5	S56 K57 Q58 I64 V147	S56-A60 PolarHBondContact O-N 3.31Å; K57-A60 PolarHBondContact O-N 3Å; Q58-A60 PolarHBondContact O-N 3.28Å; A60-I64 WeakPolarHBondContact O-CD1 3.3Å; A60-I64 VanDerWaalsContact O-CG1 3.28Å; A60-I64 WeakPolarHBondContact O-CG1 3.5Å; A60-I64 PolarHBondContact O-N 3.47Å; A60-I64 VanDerWaalsContact O-N 3.17Å; A60-V147 HydrophobicContact CB-CG1 3.32Å
61	L	88.1	Confident	90.2	Very high	121 Å²	121	66.9 Å²	66.9	63%	0.634	36%	0.356	S	S	*	.	H	α-helix	trans	-68.5	-41.7	177.8	-70.9	172.1	0	0	0	112.4	K57 Q58 F59 T65	K57-L61 WeakPolarHBondContact O-CG 3.4Å; K57-L61 PolarHBondContact O-N 3.36Å; Q58-L61 PolarHBondContact O-N 2.86Å; F59-L61 VanDerWaalsContact C-N 3.33Å; F59-L61 PolarHBondContact O-N 3.39Å; L61-T65 PolarHBondContact O-N 2.86Å; L61-T65 PolarHBondContact O-OG1 3.33Å
62	S	91	Very high	90.1	Very high	48 Å²	48	67.5 Å²	67.5	34%	0.336	36%	0.359	S	S	.	.	H	α-helix	trans	-66.2	-46.4	177.3	69.2	0	0	0	0	110.2	Q58 F59 I64 T65 D66	Q58-S62 WeakPolarHBondContact O-CB 3.35Å; Q58-S62 PolarHBondContact O-N 3.31Å; Q58-S62 PolarHBondContact O-OG 2.94Å; F59-S62 PolarHBondContact O-N 3.48Å; F59-S62 PolarHBondContact O-OG 3.34Å; S62-I64 VanDerWaalsContact C-N 3.34Å; S62-I64 PolarHBondContact O-N 3.4Å; S62-T65 CarbonylContact O-C 3.6Å; S62-T65 WeakPolarHBondContact O-CA 3.48Å; S62-T65 WeakPolarHBondContact O-CB 3.38Å; S62-T65 PolarHBondContact O-N 2.83Å; S62-D66 WeakPolarHBondContact O-CB 3.33Å; S62-D66 PolarHBondContact O-N 3.34Å
63	Y	89.7	Confident	89.8	Confident	5 Å²	5	70.1 Å²	70.1	2%	0.02	38%	0.375	C	S	.	.	H	α-helix	trans	-56.3	-45.4	179.1	173.7	-92.4	0	0	0	112.6	F59 T65 D66 L67 M76 I77 L151	F59-Y63 HydrophobicContact CZ-CD2 4.49Å; F59-Y63 WeakPolarHBondContact O-CB 3.37Å; F59-Y63 PolarHBondContact O-N 3.04Å; Y63-T65 VanDerWaalsContact C-N 3.26Å; Y63-T65 PolarHBondContact O-N 3.01Å; Y63-D66 PolarHBondContact O-N 2.89Å; Y63-L67 HydrophobicContact CE1-CD2 3.92Å; Y63-L67 VanDerWaalsContact O-CB 3.22Å; Y63-L67 WeakPolarHBondContact O-CB 3.34Å; Y63-L67 PolarHBondContact O-N 3.39Å; Y63-M76 HydrophobicContact CD2-CE 3.67Å; Y63-M76 HydrophobicContact CE2-CE 4.1Å; Y63-I77 WeakPolarHBondContact OH-CG1 3.48Å; Y63-L151 HydrophobicContact CD1-CD2 3.12Å; Y63-L151 HydrophobicContact CE1-CD2 3.13Å; Y63-L151 HydrophobicContact CG-CD2 4.11Å
64	I	85.6	Confident	89.6	Confident	69 Å²	69	71.4 Å²	71.4	35%	0.354	39%	0.387	S	S	.	.	H	α-helix	trans	-61.8	-38.2	177.5	-69.6	165.2	0	0	0	111.3	A60 S62 K68	A60-I64 WeakPolarHBondContact O-CD1 3.3Å; A60-I64 VanDerWaalsContact O-CG1 3.28Å; A60-I64 WeakPolarHBondContact O-CG1 3.5Å; A60-I64 PolarHBondContact O-N 3.47Å; A60-I64 VanDerWaalsContact O-N 3.17Å; S62-I64 VanDerWaalsContact C-N 3.34Å; S62-I64 PolarHBondContact O-N 3.4Å; I64-K68 WeakPolarHBondContact O-CG 3.46Å; I64-K68 PolarHBondContact O-N 3.44Å
65	T	88	Confident	89.5	Confident	74 Å²	74	71 Å²	71	45%	0.454	39%	0.388	S	S	.	.	H	α-helix	trans	-71.1	-47	179.8	-54.8	0	0	0	0	110.6	L61 S62 Y63 L67 K68 H69	L61-T65 PolarHBondContact O-N 2.86Å; L61-T65 PolarHBondContact O-OG1 3.33Å; S62-T65 CarbonylContact O-C 3.6Å; S62-T65 WeakPolarHBondContact O-CA 3.48Å; S62-T65 WeakPolarHBondContact O-CB 3.38Å; S62-T65 PolarHBondContact O-N 2.83Å; Y63-T65 VanDerWaalsContact C-N 3.26Å; Y63-T65 PolarHBondContact O-N 3.01Å; T65-L67 PolarHBondContact O-N 3.32Å; T65-K68 WeakPolarHBondContact O-CB 3.36Å; T65-K68 PolarHBondContact O-N 2.96Å; T65-H69 PolarHBondContact O-CD2 3.33Å; T65-H69 PolarHBondContact O-N 3.43Å
66	D	90.4	Very high	89.3	Confident	71 Å²	71	67.7 Å²	67.7	38%	0.38	37%	0.373	S	S	.	.	H	α-helix	trans	-63.1	-43	179.8	-64.2	-18.9	0	0	0	110.8	S62 Y63 K68 H69 A70 M76	S62-D66 WeakPolarHBondContact O-CB 3.33Å; S62-D66 PolarHBondContact O-N 3.34Å; Y63-D66 PolarHBondContact O-N 2.89Å; D66-K68 VanDerWaalsContact C-N 3.31Å; D66-K68 PolarHBondContact O-N 2.72Å; D66-H69 CarbonylContact O-C 3.43Å; D66-H69 PolarHBondContact O-N 2.98Å; D66-A70 PolarHBondContact O-N 3.39Å; D66-M76 HydrophobicContact CB-CE 3.27Å; D66-M76 HydrophobicContact CB-SD 4.03Å
67	L	86.6	Confident	89.1	Confident	34 Å²	34	68.3 Å²	68.3	18%	0.178	38%	0.376	C	S	.	.	H	α-helix	trans	-60.7	-37.5	176.9	-175.7	62.6	0	0	0	112.6	Y63 T65 H69 A70 P73 M76 I77	Y63-L67 HydrophobicContact CE1-CD2 3.92Å; Y63-L67 VanDerWaalsContact O-CB 3.22Å; Y63-L67 WeakPolarHBondContact O-CB 3.34Å; Y63-L67 PolarHBondContact O-N 3.39Å; T65-L67 PolarHBondContact O-N 3.32Å; L67-H69 PolarHBondContact O-N 3.06Å; L67-A70 PolarHBondContact O-N 2.92Å; L67-P73 HydrophobicContact CD1-CB 4.3Å; L67-M76 HydrophobicContact CB-CG 4.37Å; L67-M76 HydrophobicContact CD1-CB 4.19Å; L67-M76 HydrophobicContact CD1-CG 4.02Å; L67-I77 HydrophobicContact CD1-CD1 4.12Å; L67-I77 HydrophobicContact CD1-CG1 3.75Å; L67-I77 HydrophobicContact CD2-CG1 4.46Å
68	K	86.6	Confident	88.8	Confident	160 Å²	160	67.6 Å²	67.6	70%	0.696	38%	0.382	S	S	*	.	H	α-helix	trans	-66.2	-23	176.6	-76.6	175.2	179.2	-176.8	0	113.6	I64 T65 D66	I64-K68 WeakPolarHBondContact O-CG 3.46Å; I64-K68 PolarHBondContact O-N 3.44Å; T65-K68 WeakPolarHBondContact O-CB 3.36Å; T65-K68 PolarHBondContact O-N 2.96Å; D66-K68 VanDerWaalsContact C-N 3.31Å; D66-K68 PolarHBondContact O-N 2.72Å
69	H	90.4	Very high	88.6	Confident	153 Å²	153	64.8 Å²	64.8	71%	0.708	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	7.5	-176.6	-61.5	-56	0	0	0	112.5	T65 D66 L67 A71	T65-H69 PolarHBondContact O-CD2 3.33Å; T65-H69 PolarHBondContact O-N 3.43Å; D66-H69 CarbonylContact O-C 3.43Å; D66-H69 PolarHBondContact O-N 2.98Å; L67-H69 PolarHBondContact O-N 3.06Å; H69-A71 PolarHBondContact O-N 2.93Å
70	A	88.5	Confident	88.5	Confident	28 Å²	28	63.9 Å²	63.9	23%	0.231	37%	0.369	C	S	.	.			trans	-69.7	128.6	-178.8	0	0	0	0	0	110.4	D66 L67 D72 M76	D66-A70 PolarHBondContact O-N 3.39Å; L67-A70 PolarHBondContact O-N 2.92Å; A70-D72 VanDerWaalsContact C-N 3.26Å; A70-M76 HydrophobicContact CB-CB 3.83Å; A70-M76 HydrophobicContact CB-CG 4.07Å
71	A	91.8	Very high	88.4	Confident	113 Å²	113	66.3 Å²	66.3	93%	0.934	39%	0.386	S	S	*	.	S	Bend	trans	-69.1	-29.9	169.8	0	0	0	0	0	111.6	H69	H69-A71 PolarHBondContact O-N 2.93Å
72	D	90.3	Very high	88.4	Confident	90 Å²	90	65.3 Å²	65.3	48%	0.481	38%	0.381	S	S	.	.	S	Bend	trans	-126.2	97.2	172.8	-174.5	-17.6	0	0	0	109.1	A70 A74 D75 M76	A70-D72 VanDerWaalsContact C-N 3.26Å; D72-A74 VanDerWaalsContact C-N 3.26Å; D72-A74 PolarHBondContact O-N 3.45Å; D72-A74 WeakPolarHBondContact OD1-CB 3.5Å; D72-A74 PolarHBondContact OD1-N 3.45Å; D72-D75 HydrophobicContact CB-CB 4.13Å; D72-D75 PolarHBondContact OD1-N 3.21Å; D72-D75 VanDerWaalsContact OD1-N 3.15Å; D72-M76 WeakPolarHBondContact O-CB 3.39Å; D72-M76 PolarHBondContact O-N 2.63Å
73	P	87	Confident	88.3	Confident	63 Å²	63	69.5 Å²	69.5	41%	0.409	39%	0.389	S	S	.	.	H	α-helix	trans	-61.5	-31.5	178	-25.3	35.4	0	0	0	113.7	L67 M76 I77	L67-P73 HydrophobicContact CD1-CB 4.3Å; P73-M76 PolarHBondContact O-N 3.36Å; P73-I77 WeakPolarHBondContact O-CB 3.35Å; P73-I77 WeakPolarHBondContact O-CD1 3.37Å; P73-I77 WeakPolarHBondContact O-CG1 3.37Å; P73-I77 PolarHBondContact O-N 3.01Å
74	A	86.2	Confident	88.3	Confident	35 Å²	35	70.3 Å²	70.3	29%	0.289	40%	0.395	S	S	.	.	H	α-helix	trans	-70.7	-46.8	-176.5	0	0	0	0	0	111.2	D72 M76 I77 S78 L158	D72-A74 VanDerWaalsContact C-N 3.26Å; D72-A74 PolarHBondContact O-N 3.45Å; D72-A74 WeakPolarHBondContact OD1-CB 3.5Å; D72-A74 PolarHBondContact OD1-N 3.45Å; A74-M76 VanDerWaalsContact C-N 3.31Å; A74-M76 PolarHBondContact O-N 3.35Å; A74-I77 PolarHBondContact O-N 2.68Å; A74-S78 PolarHBondContact O-N 3.35Å; A74-L158 HydrophobicContact CB-CD1 4.33Å; A74-L158 HydrophobicContact CB-CD2 4.03Å
75	D	89.5	Confident	88.4	Confident	101 Å²	101	72.2 Å²	72.2	54%	0.54	40%	0.403	S	S	.	.	H	α-helix	trans	-60.3	-42.1	174	-178.2	64.3	0	0	0	111.8	D72 I77 S78 T79	D72-D75 HydrophobicContact CB-CB 4.13Å; D72-D75 PolarHBondContact OD1-N 3.21Å; D72-D75 VanDerWaalsContact OD1-N 3.15Å; D75-I77 VanDerWaalsContact C-N 3.35Å; D75-I77 PolarHBondContact O-N 3.02Å; D75-S78 PolarHBondContact O-N 3.17Å; D75-T79 WeakPolarHBondContact O-CB 3.36Å; D75-T79 PolarHBondContact O-N 2.82Å; D75-T79 PolarHBondContact O-OG1 2.92Å
76	M	89.2	Confident	88.6	Confident	35 Å²	35	74.4 Å²	74.4	17%	0.172	41%	0.409	C	S	.	.	H	α-helix	trans	-63.2	-39.8	176.9	-174.5	64.1	-156.9	0	0	112.2	Y63 D66 L67 A70 D72 P73 A74 G80	Y63-M76 HydrophobicContact CD2-CE 3.67Å; Y63-M76 HydrophobicContact CE2-CE 4.1Å; D66-M76 HydrophobicContact CB-CE 3.27Å; D66-M76 HydrophobicContact CB-SD 4.03Å; L67-M76 HydrophobicContact CB-CG 4.37Å; L67-M76 HydrophobicContact CD1-CB 4.19Å; L67-M76 HydrophobicContact CD1-CG 4.02Å; A70-M76 HydrophobicContact CB-CB 3.83Å; A70-M76 HydrophobicContact CB-CG 4.07Å; D72-M76 WeakPolarHBondContact O-CB 3.39Å; D72-M76 PolarHBondContact O-N 2.63Å; P73-M76 PolarHBondContact O-N 3.36Å; A74-M76 VanDerWaalsContact C-N 3.31Å; A74-M76 PolarHBondContact O-N 3.35Å; M76-G80 PolarHBondContact O-N 3.44Å
77	I	87.5	Confident	88.6	Confident	14 Å²	14	72.1 Å²	72.1	7%	0.072	40%	0.398	C	S	.	.	H	α-helix	trans	-66.2	-45.1	176.7	-74.5	161.6	0	0	0	111	Y63 L67 P73 A74 D75 G80 C81 V155 L158	Y63-I77 WeakPolarHBondContact OH-CG1 3.48Å; L67-I77 HydrophobicContact CD1-CD1 4.12Å; L67-I77 HydrophobicContact CD1-CG1 3.75Å; L67-I77 HydrophobicContact CD2-CG1 4.46Å; P73-I77 WeakPolarHBondContact O-CB 3.35Å; P73-I77 WeakPolarHBondContact O-CD1 3.37Å; P73-I77 WeakPolarHBondContact O-CG1 3.37Å; P73-I77 PolarHBondContact O-N 3.01Å; A74-I77 PolarHBondContact O-N 2.68Å; D75-I77 VanDerWaalsContact C-N 3.35Å; D75-I77 PolarHBondContact O-N 3.02Å; I77-G80 PolarHBondContact O-N 3.49Å; I77-C81 PolarHBondContact O-N 3.12Å; I77-V155 HydrophobicContact CG2-CB 4.38Å; I77-V155 HydrophobicContact CG2-CG2 3.77Å; I77-L158 HydrophobicContact CB-CD2 4.05Å; I77-L158 HydrophobicContact CD1-CB 3.9Å; I77-L158 HydrophobicContact CD1-CD1 3.74Å; I77-L158 HydrophobicContact CD1-CD2 3.79Å; I77-L158 HydrophobicContact CD1-CG 4.01Å; I77-L158 HydrophobicContact CG2-CD2 3.94Å
78	S	85.5	Confident	88.8	Confident	69 Å²	69	73.4 Å²	73.4	48%	0.483	41%	0.407	S	S	.	.	H	α-helix	trans	-58.3	-52.2	176.4	-176.1	0	0	0	0	111.6	A74 D75 G80 C81 D82	A74-S78 PolarHBondContact O-N 3.35Å; D75-S78 PolarHBondContact O-N 3.17Å; S78-G80 VanDerWaalsContact C-N 3.27Å; S78-G80 PolarHBondContact O-N 2.95Å; S78-C81 WeakPolarHBondContact O-CB 3.49Å; S78-C81 PolarHBondContact O-N 3.37Å; S78-D82 PolarHBondContact O-N 3.38Å
79	T	88.7	Confident	89	Confident	50 Å²	50	70.6 Å²	70.6	31%	0.307	40%	0.396	S	S	.	.	H	α-helix	trans	-60.4	-38.1	176.4	-63	0	0	0	0	112.1	D75 R83	D75-T79 WeakPolarHBondContact O-CB 3.36Å; D75-T79 PolarHBondContact O-N 2.82Å; D75-T79 PolarHBondContact O-OG1 2.92Å; T79-R83 WeakPolarHBondContact O-CG 3.35Å; T79-R83 PolarHBondContact O-N 3.42Å; T79-R83 VanDerWaalsContact O-N 3.16Å
80	G	89.4	Confident	89.2	Confident	4 Å²	4	65.8 Å²	65.8	4%	0.041	38%	0.376	C	S	.	.	H	α-helix	trans	-63.4	-39.9	174.6	0	0	0	0	0	113.1	F59 M76 I77 S78 R83 S84	F59-G80 WeakPolarHBondContact CZ-O 3.48Å; M76-G80 PolarHBondContact O-N 3.44Å; I77-G80 PolarHBondContact O-N 3.49Å; S78-G80 VanDerWaalsContact C-N 3.27Å; S78-G80 PolarHBondContact O-N 2.95Å; G80-R83 PolarHBondContact O-N 2.87Å; G80-S84 VanDerWaalsContact O-CB 3.24Å; G80-S84 WeakPolarHBondContact O-CB 3.49Å; G80-S84 PolarHBondContact O-N 2.93Å; G80-S84 PolarHBondContact O-OG 3.22Å
81	C	85.9	Confident	89.4	Confident	56 Å²	56	64.9 Å²	64.9	38%	0.378	37%	0.367	S	S	.	.	H	α-helix	trans	-61.3	-51.7	177.4	-171.7	0	0	0	0	110.9	I77 S78 R83 S84 Q85	I77-C81 PolarHBondContact O-N 3.12Å; S78-C81 WeakPolarHBondContact O-CB 3.49Å; S78-C81 PolarHBondContact O-N 3.37Å; C81-R83 PolarHBondContact O-N 2.67Å; C81-S84 WeakPolarHBondContact O-CB 3.38Å; C81-S84 PolarHBondContact O-N 3.02Å; C81-S84 VanDerWaalsContact O-N 3.1Å; C81-S84 PolarHBondContact O-OG 3.39Å; C81-Q85 PolarHBondContact O-N 3.33Å
82	D	88.1	Confident	89.4	Confident	99 Å²	99	67.4 Å²	67.4	53%	0.529	35%	0.354	S	S	.	.	H	α-helix	trans	-57.5	-46.9	178.5	-73.7	-12.8	0	0	0	112.1	S78 S84 Q85 M86	S78-D82 PolarHBondContact O-N 3.38Å; D82-S84 VanDerWaalsContact C-N 3.33Å; D82-S84 PolarHBondContact O-N 3.31Å; D82-Q85 PolarHBondContact O-N 3.4Å; D82-M86 PolarHBondContact O-N 2.79Å; D82-M86 VanDerWaalsContact O-N 3.15Å
83	R	90.5	Very high	89.7	Confident	137 Å²	137	69.6 Å²	69.6	52%	0.517	36%	0.355	S	S	.	.	H	α-helix	trans	-64.5	-39.1	177.2	-72.5	-177.1	178.5	-172.3	3.1	111.9	F59 T79 G80 C81 Q85 M86 V87	F59-R83 HydrophobicContact CD2-CB 4.19Å; F59-R83 HydrophobicContact CE2-CB 3.39Å; F59-R83 HydrophobicContact CE2-CG 4.32Å; F59-R83 HydrophobicContact CZ-CB 3.72Å; T79-R83 WeakPolarHBondContact O-CG 3.35Å; T79-R83 PolarHBondContact O-N 3.42Å; T79-R83 VanDerWaalsContact O-N 3.16Å; G80-R83 PolarHBondContact O-N 2.87Å; C81-R83 PolarHBondContact O-N 2.67Å; R83-Q85 VanDerWaalsContact C-N 3.31Å; R83-Q85 PolarHBondContact O-N 3.39Å; R83-M86 PolarHBondContact O-N 2.65Å; R83-V87 VanDerWaalsContact O-CG2 3.25Å; R83-V87 WeakPolarHBondContact O-CG2 3.48Å; R83-V87 PolarHBondContact O-N 2.89Å
84	S	88.6	Confident	90	Very high	21 Å²	21	66.9 Å²	66.9	15%	0.147	34%	0.338	C	S	.	.	H	α-helix	trans	-62.5	-40	177.9	78.2	0	0	0	0	111.5	G80 C81 D82 V87 V88	G80-S84 VanDerWaalsContact O-CB 3.24Å; G80-S84 WeakPolarHBondContact O-CB 3.49Å; G80-S84 PolarHBondContact O-N 2.93Å; G80-S84 PolarHBondContact O-OG 3.22Å; C81-S84 WeakPolarHBondContact O-CB 3.38Å; C81-S84 PolarHBondContact O-N 3.02Å; C81-S84 VanDerWaalsContact O-N 3.1Å; C81-S84 PolarHBondContact O-OG 3.39Å; D82-S84 VanDerWaalsContact C-N 3.33Å; D82-S84 PolarHBondContact O-N 3.31Å; S84-V87 PolarHBondContact O-N 2.89Å; S84-V88 VanDerWaalsContact O-CG2 3.29Å; S84-V88 WeakPolarHBondContact O-CG2 3.46Å; S84-V88 PolarHBondContact O-N 3.47Å
85	Q	87.5	Confident	90.4	Very high	110 Å²	110	66.3 Å²	66.3	51%	0.514	33%	0.331	S	S	.	.	H	α-helix	trans	-61.2	-48.4	175.2	-177.5	179.3	-17.1	0	0	111.1	C81 D82 R83 V87 V88 E89	C81-Q85 PolarHBondContact O-N 3.33Å; D82-Q85 PolarHBondContact O-N 3.4Å; R83-Q85 VanDerWaalsContact C-N 3.31Å; R83-Q85 PolarHBondContact O-N 3.39Å; Q85-V87 VanDerWaalsContact C-N 3.28Å; Q85-V87 PolarHBondContact O-N 3.03Å; Q85-V88 PolarHBondContact O-N 3.4Å; Q85-E89 HydrophobicContact CG-CG 4.47Å; Q85-E89 WeakPolarHBondContact CG-OE1 3.41Å; Q85-E89 PolarHBondContact NE2-OE1 2.83Å; Q85-E89 WeakPolarHBondContact O-CG 3.47Å; Q85-E89 PolarHBondContact O-N 3.01Å
86	M	91.5	Very high	90.6	Very high	119 Å²	119	63.4 Å²	63.4	59%	0.586	32%	0.317	S	S	*	.	H	α-helix	trans	-58.3	-40.9	177.2	-67.7	-178.6	68.2	0	0	112.4	D82 R83 N90	D82-M86 PolarHBondContact O-N 2.79Å; D82-M86 VanDerWaalsContact O-N 3.15Å; R83-M86 PolarHBondContact O-N 2.65Å; M86-N90 WeakPolarHBondContact O-CB 3.41Å; M86-N90 VanDerWaalsContact O-CG 3.22Å; M86-N90 PolarHBondContact O-N 2.88Å; M86-N90 PolarHBondContact O-ND2 3.47Å
87	V	91.5	Very high	90.8	Very high	24 Å²	24	65 Å²	65	15%	0.145	32%	0.323	C	S	.	.	H	α-helix	trans	-66.7	-43.3	178.8	171.8	0	0	0	0	111.2	S56 F59 R83 S84 Q85 N90 L91 F148	S56-V87 WeakPolarHBondContact OG-CG1 3.31Å; F59-V87 HydrophobicContact CB-CG2 4.31Å; F59-V87 HydrophobicContact CD1-CG2 4.24Å; F59-V87 HydrophobicContact CG-CG2 4.14Å; R83-V87 VanDerWaalsContact O-CG2 3.25Å; R83-V87 WeakPolarHBondContact O-CG2 3.48Å; R83-V87 PolarHBondContact O-N 2.89Å; S84-V87 PolarHBondContact O-N 2.89Å; Q85-V87 VanDerWaalsContact C-N 3.28Å; Q85-V87 PolarHBondContact O-N 3.03Å; V87-N90 PolarHBondContact O-N 3.37Å; V87-L91 WeakPolarHBondContact O-CB 3.33Å; V87-L91 PolarHBondContact O-N 3.36Å; V87-F148 HydrophobicContact CB-CZ 4.23Å; V87-F148 HydrophobicContact CG1-CE1 4.33Å; V87-F148 HydrophobicContact CG1-CE2 4.33Å; V87-F148 HydrophobicContact CG1-CZ 3.54Å
88	V	89.7	Confident	91	Very high	60 Å²	60	64.3 Å²	64.3	36%	0.364	32%	0.319	S	S	.	.	H	α-helix	trans	-63.1	-43.6	176.2	170	0	0	0	0	111.2	S84 Q85 N90 L91 Y92 F148	S84-V88 VanDerWaalsContact O-CG2 3.29Å; S84-V88 WeakPolarHBondContact O-CG2 3.46Å; S84-V88 PolarHBondContact O-N 3.47Å; Q85-V88 PolarHBondContact O-N 3.4Å; V88-N90 PolarHBondContact O-N 3Å; V88-L91 PolarHBondContact O-N 3.37Å; V88-Y92 WeakPolarHBondContact O-CB 3.49Å; V88-Y92 PolarHBondContact O-N 2.97Å; V88-F148 HydrophobicContact CG2-CD1 4.11Å; V88-F148 HydrophobicContact CG2-CD2 3.96Å; V88-F148 HydrophobicContact CG2-CE1 4.27Å; V88-F148 HydrophobicContact CG2-CE2 4.1Å; V88-F148 HydrophobicContact CG2-CG 4.01Å; V88-F148 HydrophobicContact CG2-CZ 4.28Å
89	E	91.6	Very high	91.3	Very high	102 Å²	102	64.7 Å²	64.7	48%	0.477	32%	0.315	S	S	.	.	H	α-helix	trans	-61.3	-42.9	175.8	-73.5	175.4	-173.2	0	0	111.9	Q85 Y92 R93	Q85-E89 HydrophobicContact CG-CG 4.47Å; Q85-E89 WeakPolarHBondContact CG-OE1 3.41Å; Q85-E89 PolarHBondContact NE2-OE1 2.83Å; Q85-E89 WeakPolarHBondContact O-CG 3.47Å; Q85-E89 PolarHBondContact O-N 3.01Å; E89-Y92 PolarHBondContact O-N 2.74Å; E89-R93 WeakPolarHBondContact O-CB 3.37Å; E89-R93 PolarHBondContact O-N 3.48Å
90	N	94	Very high	91.5	Very high	51 Å²	51	67.3 Å²	67.3	27%	0.273	32%	0.324	S	S	.	.	H	α-helix	trans	-62.7	-44	176	-76.6	-24.2	0	0	0	111.9	M86 V87 V88 R93 A94	M86-N90 WeakPolarHBondContact O-CB 3.41Å; M86-N90 VanDerWaalsContact O-CG 3.22Å; M86-N90 PolarHBondContact O-N 2.88Å; M86-N90 PolarHBondContact O-ND2 3.47Å; V87-N90 PolarHBondContact O-N 3.37Å; V88-N90 PolarHBondContact O-N 3Å; N90-R93 PolarHBondContact O-N 2.9Å; N90-R93 PolarHBondContact OD1-NH1 3.41Å; N90-R93 PolarHBondContact OD1-NH2 3.18Å; N90-A94 PolarHBondContact O-N 3.4Å
91	L	92.8	Very high	91.5	Very high	10 Å²	10	67.3 Å²	67.3	5%	0.052	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-48.3	175.5	-179.2	68.8	0	0	0	111	F49 A52 V53 V87 V88 R93 A94 V95 L144	F49-L91 HydrophobicContact CD2-CD1 4.13Å; F49-L91 HydrophobicContact CE2-CD1 3.82Å; A52-L91 HydrophobicContact CB-CD1 4.45Å; V53-L91 HydrophobicContact CG2-CD1 3.83Å; V87-L91 WeakPolarHBondContact O-CB 3.33Å; V87-L91 PolarHBondContact O-N 3.36Å; V88-L91 PolarHBondContact O-N 3.37Å; L91-R93 VanDerWaalsContact C-N 3.3Å; L91-R93 PolarHBondContact O-N 2.94Å; L91-A94 PolarHBondContact O-N 2.95Å; L91-A94 VanDerWaalsContact O-N 3.12Å; L91-V95 HydrophobicContact CD1-CG2 4.4Å; L91-V95 HydrophobicContact CG-CG2 4.39Å; L91-V95 WeakPolarHBondContact O-CG2 3.45Å; L91-V95 PolarHBondContact O-N 2.9Å; L91-L144 HydrophobicContact CD1-CD1 3.78Å; L91-L144 HydrophobicContact CD2-CB 4.12Å; L91-L144 HydrophobicContact CD2-CD1 3.5Å; L91-L144 VanDerWaalsContact CD2-CD1 3.5Å; L91-L144 HydrophobicContact CD2-CG 4.48Å; L91-L144 HydrophobicContact CG-CD1 4.28Å
92	Y	92.3	Very high	91.6	Very high	166 Å²	166	64.8 Å²	64.8	65%	0.651	31%	0.307	S	S	*	.	H	α-helix	trans	-56.9	-44.5	178.2	176.3	-99.2	0	0	0	111.8	V88 E89 V95 T96	V88-Y92 WeakPolarHBondContact O-CB 3.49Å; V88-Y92 PolarHBondContact O-N 2.97Å; E89-Y92 PolarHBondContact O-N 2.74Å; Y92-V95 PolarHBondContact O-N 3.23Å; Y92-T96 WeakPolarHBondContact O-CB 3.39Å; Y92-T96 PolarHBondContact O-N 3.41Å; Y92-T96 PolarHBondContact O-OG1 3.44Å
93	R	95.8	Very high	91.6	Very high	136 Å²	136	69.1 Å²	69.1	51%	0.513	32%	0.315	S	S	.	.	H	α-helix	trans	-60.3	-46.9	175	-177.1	178	64.3	-140.5	-5.7	111.3	E89 N90 L91 T96 K97	E89-R93 WeakPolarHBondContact O-CB 3.37Å; E89-R93 PolarHBondContact O-N 3.48Å; N90-R93 PolarHBondContact O-N 2.9Å; N90-R93 PolarHBondContact OD1-NH1 3.41Å; N90-R93 PolarHBondContact OD1-NH2 3.18Å; L91-R93 VanDerWaalsContact C-N 3.3Å; L91-R93 PolarHBondContact O-N 2.94Å; R93-T96 PolarHBondContact O-N 3.08Å; R93-K97 WeakPolarHBondContact O-CG 3.47Å; R93-K97 PolarHBondContact O-N 3.26Å
94	A	94.2	Very high	91.4	Very high	5 Å²	5	68.1 Å²	68.1	4%	0.041	31%	0.312	C	S	.	.	H	α-helix	trans	-63.7	-43.4	179.8	0	0	0	0	0	112.2	F49 A52 N90 L91 T96 K97 V98	F49-A94 HydrophobicContact CB-CB 4.22Å; A52-A94 HydrophobicContact CB-CB 4.11Å; N90-A94 PolarHBondContact O-N 3.4Å; L91-A94 PolarHBondContact O-N 2.95Å; L91-A94 VanDerWaalsContact O-N 3.12Å; A94-T96 PolarHBondContact O-N 2.93Å; A94-K97 PolarHBondContact O-N 2.94Å; A94-V98 WeakPolarHBondContact O-CG2 3.47Å; A94-V98 PolarHBondContact O-N 3.46Å
95	V	93.6	Very high	91.1	Very high	23 Å²	23	67.1 Å²	67.1	14%	0.139	31%	0.305	C	S	.	.	H	α-helix	trans	-59.1	-47.9	174.6	171	0	0	0	0	110.6	F49 L91 Y92 K97 V98 L99 V137	F49-V95 HydrophobicContact CD2-CG2 3.76Å; F49-V95 HydrophobicContact CE2-CG2 3.57Å; L91-V95 HydrophobicContact CD1-CG2 4.4Å; L91-V95 HydrophobicContact CG-CG2 4.39Å; L91-V95 WeakPolarHBondContact O-CG2 3.45Å; L91-V95 PolarHBondContact O-N 2.9Å; Y92-V95 PolarHBondContact O-N 3.23Å; V95-K97 PolarHBondContact O-N 2.85Å; V95-V98 PolarHBondContact O-N 3.36Å; V95-L99 HydrophobicContact CG1-CD1 3.91Å; V95-L99 HydrophobicContact CG1-CG 4.32Å; V95-L99 WeakPolarHBondContact O-CG 3.28Å; V95-L99 PolarHBondContact O-N 3.25Å; V95-V137 HydrophobicContact CG1-CG1 4.07Å; V95-V137 HydrophobicContact CG2-CG1 4.09Å
96	T	94.6	Very high	90.9	Very high	41 Å²	41	65.9 Å²	65.9	25%	0.252	30%	0.3	S	S	.	.	H	α-helix	trans	-58.1	-47.7	179.7	-59.5	0	0	0	0	111.2	Y92 R93 A94 V98 L99 E100	Y92-T96 WeakPolarHBondContact O-CB 3.39Å; Y92-T96 PolarHBondContact O-N 3.41Å; Y92-T96 PolarHBondContact O-OG1 3.44Å; R93-T96 PolarHBondContact O-N 3.08Å; A94-T96 PolarHBondContact O-N 2.93Å; T96-V98 VanDerWaalsContact C-N 3.34Å; T96-V98 PolarHBondContact O-N 2.91Å; T96-L99 PolarHBondContact O-N 3.49Å; T96-E100 HydrophobicContact CG2-CG 4.47Å; T96-E100 WeakPolarHBondContact O-CG 3.47Å; T96-E100 PolarHBondContact O-N 3.4Å
97	K	94	Very high	90.4	Very high	67 Å²	67	63.1 Å²	63.1	29%	0.291	29%	0.29	S	S	.	.	H	α-helix	trans	-61	-40.6	177	-68	-174.2	-167.2	178.7	0	112.7	Q45 E48 R93 A94 V95 E100 C101	Q45-K97 HydrophobicContact CB-CB 4.48Å; Q45-K97 HydrophobicContact CG-CB 4.2Å; E48-K97 IonicContact OE2-NZ 2.79Å; E48-K97 PolarHBondContact OE2-NZ 3.04Å; R93-K97 WeakPolarHBondContact O-CG 3.47Å; R93-K97 PolarHBondContact O-N 3.26Å; A94-K97 PolarHBondContact O-N 2.94Å; V95-K97 PolarHBondContact O-N 2.85Å; K97-E100 PolarHBondContact O-N 3.45Å; K97-C101 WeakPolarHBondContact O-CB 3.3Å; K97-C101 PolarHBondContact O-N 3.28Å; K97-C101 PolarHBondContact O-SG 2.98Å
98	V	91	Very high	89.8	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.5	-45.5	176.4	170.7	0	0	0	0	111	L42 Q45 F49 A94 V95 T96 C101 A102 L133 V137	L42-V98 HydrophobicContact CD1-CG1 4.15Å; Q45-V98 VanDerWaalsContact C-CG2 3.47Å; Q45-V98 HydrophobicContact CB-CG2 3.95Å; Q45-V98 VanDerWaalsContact O-CG2 3.28Å; Q45-V98 WeakPolarHBondContact O-CG2 3.41Å; F49-V98 HydrophobicContact CB-CG2 3.83Å; A94-V98 WeakPolarHBondContact O-CG2 3.47Å; A94-V98 PolarHBondContact O-N 3.46Å; V95-V98 PolarHBondContact O-N 3.36Å; T96-V98 VanDerWaalsContact C-N 3.34Å; T96-V98 PolarHBondContact O-N 2.91Å; V98-C101 PolarHBondContact O-N 2.91Å; V98-A102 WeakPolarHBondContact O-CB 3.29Å; V98-A102 PolarHBondContact O-N 3.33Å; V98-L133 HydrophobicContact CG1-CD2 3.49Å; V98-L133 VanDerWaalsContact CG1-CD2 3.49Å; V98-V137 HydrophobicContact CG1-CG2 3.91Å
99	L	91.6	Very high	89	Confident	77 Å²	77	60.1 Å²	60.1	40%	0.403	27%	0.271	S	S	.	.	H	α-helix	trans	-65.9	-40.2	179.2	-67.1	176.8	0	0	0	112.1	V95 T96 A102 R103 I134	V95-L99 HydrophobicContact CG1-CD1 3.91Å; V95-L99 HydrophobicContact CG1-CG 4.32Å; V95-L99 WeakPolarHBondContact O-CG 3.28Å; V95-L99 PolarHBondContact O-N 3.25Å; T96-L99 PolarHBondContact O-N 3.49Å; L99-A102 PolarHBondContact O-N 3.17Å; L99-R103 WeakPolarHBondContact O-CB 3.36Å; L99-R103 PolarHBondContact O-N 2.97Å; L99-I134 HydrophobicContact CD2-CG1 4.28Å; L99-I134 HydrophobicContact CD2-CG2 4.42Å
100	E	92.3	Very high	88	Confident	105 Å²	105	59.3 Å²	59.3	49%	0.491	28%	0.277	S	S	.	.	H	α-helix	trans	-61.7	-46.9	173.3	-74.5	178.8	176.4	0	0	111.7	T96 K97 R103 R104	T96-E100 HydrophobicContact CG2-CG 4.47Å; T96-E100 WeakPolarHBondContact O-CG 3.47Å; T96-E100 PolarHBondContact O-N 3.4Å; K97-E100 PolarHBondContact O-N 3.45Å; E100-R103 WeakPolarHBondContact O-CB 3.41Å; E100-R103 PolarHBondContact O-N 3.49Å; E100-R104 WeakPolarHBondContact O-CG 3.42Å; E100-R104 PolarHBondContact O-N 2.94Å
101	C	90.2	Very high	86.6	Confident	4 Å²	4	60 Å²	60	3%	0.027	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-44.7	175.4	-79.8	0	0	0	0	112	L42 Q45 K97 V98 R103 R104 V105	L42-C101 HydrophobicContact CB-CB 4.1Å; L42-C101 HydrophobicContact CD1-CB 3.89Å; Q45-C101 WeakPolarHBondContact CG-SG 3.35Å; K97-C101 WeakPolarHBondContact O-CB 3.3Å; K97-C101 PolarHBondContact O-N 3.28Å; K97-C101 PolarHBondContact O-SG 2.98Å; V98-C101 PolarHBondContact O-N 2.91Å; C101-R103 VanDerWaalsContact C-N 3.31Å; C101-R103 PolarHBondContact O-N 2.96Å; C101-R104 PolarHBondContact O-N 3.48Å; C101-R104 VanDerWaalsContact O-N 3.13Å; C101-R104 PolarHBondContact SG-NH2 2.99Å; C101-V105 WeakPolarHBondContact O-CG2 3.47Å; C101-V105 PolarHBondContact O-N 3.1Å
102	A	88	Confident	84.9	Confident	3 Å²	3	68 Å²	68	3%	0.025	31%	0.308	C	S	.	.	H	α-helix	trans	-58.6	-45	176.3	0	0	0	0	0	111	L42 V98 L99 R104 V105 M106 V130 I134	L42-A102 HydrophobicContact CD1-CB 4.24Å; V98-A102 WeakPolarHBondContact O-CB 3.29Å; V98-A102 PolarHBondContact O-N 3.33Å; L99-A102 PolarHBondContact O-N 3.17Å; A102-R104 PolarHBondContact O-N 2.73Å; A102-V105 PolarHBondContact O-N 3.21Å; A102-M106 WeakPolarHBondContact O-CG 3.45Å; A102-M106 PolarHBondContact O-N 3.36Å; A102-V130 HydrophobicContact CB-CG1 3.77Å; A102-I134 HydrophobicContact CB-CD1 4.22Å; A102-I134 HydrophobicContact CB-CG1 4.46Å
103	R	88.1	Confident	83	Confident	190 Å²	190	62.9 Å²	62.9	72%	0.717	29%	0.291	S	S	*	.	H	α-helix	trans	-59.7	-44.7	173.8	-176.1	179.9	177.9	177.4	0.2	111.7	L99 E100 C101 V105 M106 V107	L99-R103 WeakPolarHBondContact O-CB 3.36Å; L99-R103 PolarHBondContact O-N 2.97Å; E100-R103 WeakPolarHBondContact O-CB 3.41Å; E100-R103 PolarHBondContact O-N 3.49Å; C101-R103 VanDerWaalsContact C-N 3.31Å; C101-R103 PolarHBondContact O-N 2.96Å; R103-V105 VanDerWaalsContact C-N 3.33Å; R103-V105 PolarHBondContact O-N 2.82Å; R103-M106 PolarHBondContact O-N 3.35Å; R103-V107 HydrophobicContact CG-CG2 4.44Å; R103-V107 WeakPolarHBondContact O-CG2 3.42Å; R103-V107 PolarHBondContact O-N 3.31Å
104	R	85.6	Confident	81.1	Confident	116 Å²	116	63.2 Å²	63.2	44%	0.438	30%	0.303	S	S	.	.	H	α-helix	trans	-62	-38.4	177.3	-71.7	-163.5	-60.5	-126.7	9.7	112.7	E41 E100 C101 A102 S108	E41-R104 IonicContact OE2-CZ 3.98Å; E41-R104 IonicContact OE2-NE 3.44Å; E41-R104 IonicContact OE2-NH2 3.52Å; E41-R104 PolarHBondContact OE2-NH2 3.11Å; E100-R104 WeakPolarHBondContact O-CG 3.42Å; E100-R104 PolarHBondContact O-N 2.94Å; C101-R104 PolarHBondContact O-N 3.48Å; C101-R104 VanDerWaalsContact O-N 3.13Å; C101-R104 PolarHBondContact SG-NH2 2.99Å; A102-R104 PolarHBondContact O-N 2.73Å; R104-S108 WeakPolarHBondContact O-CB 3.33Å; R104-S108 PolarHBondContact O-N 3.3Å; R104-S108 PolarHBondContact O-OG 2.93Å
105	V	83.7	Confident	79.3	Confident	1 Å²	1	66 Å²	66	1%	0.006	33%	0.332	C	S	.	.	H	α-helix	trans	-61.2	-51.3	173.3	171.4	0	0	0	0	109.8	A38 L39 L42 C101 A102 R103 V107 S108 M109 V126 V130	A38-V105 HydrophobicContact CB-CG2 3.69Å; A38-V105 WeakPolarHBondContact O-CG2 3.33Å; L39-V105 HydrophobicContact CD2-CG1 3.89Å; L39-V105 HydrophobicContact CD2-CG2 4.27Å; L42-V105 HydrophobicContact CB-CG2 4.26Å; L42-V105 HydrophobicContact CD2-CG2 4.1Å; C101-V105 WeakPolarHBondContact O-CG2 3.47Å; C101-V105 PolarHBondContact O-N 3.1Å; A102-V105 PolarHBondContact O-N 3.21Å; R103-V105 VanDerWaalsContact C-N 3.33Å; R103-V105 PolarHBondContact O-N 2.82Å; V105-V107 PolarHBondContact O-N 3.4Å; V105-S108 PolarHBondContact O-N 2.82Å; V105-M109 WeakPolarHBondContact O-CG 3.45Å; V105-M109 PolarHBondContact O-N 3.24Å; V105-M109 VanDerWaalsContact O-N 3.08Å; V105-V126 HydrophobicContact CG1-CG1 3.4Å; V105-V130 HydrophobicContact CB-CG2 4.46Å; V105-V130 HydrophobicContact CG1-CG2 3.91Å
106	M	82.6	Confident	77.5	Confident	84 Å²	84	72.9 Å²	72.9	41%	0.414	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-42.7	-179.6	-66.7	-57.5	-69.2	0	0	112.7	A102 R103 M109 S110 V130	A102-M106 WeakPolarHBondContact O-CG 3.45Å; A102-M106 PolarHBondContact O-N 3.36Å; R103-M106 PolarHBondContact O-N 3.35Å; M106-M109 PolarHBondContact O-N 2.95Å; M106-S110 PolarHBondContact O-N 3.44Å; M106-S110 VanDerWaalsContact O-N 3.07Å; M106-V130 HydrophobicContact CG-CG1 4.17Å; M106-V130 HydrophobicContact SD-CB 4.19Å; M106-V130 HydrophobicContact SD-CG1 4.27Å; M106-V130 HydrophobicContact SD-CG2 4.27Å
107	V	82.1	Confident	75.7	Confident	61 Å²	61	78.6 Å²	78.6	37%	0.37	38%	0.381	S	S	.	.	H	α-helix	trans	-60.6	-47.7	174.7	170.4	0	0	0	0	110.5	R103 V105 M109 S110 E111	R103-V107 HydrophobicContact CG-CG2 4.44Å; R103-V107 WeakPolarHBondContact O-CG2 3.42Å; R103-V107 PolarHBondContact O-N 3.31Å; V105-V107 PolarHBondContact O-N 3.4Å; V107-M109 PolarHBondContact O-N 3Å; V107-M109 VanDerWaalsContact O-N 3.15Å; V107-S110 WeakPolarHBondContact CA-OG 3.42Å; V107-S110 PolarHBondContact O-N 3.43Å; V107-S110 PolarHBondContact O-OG 3.28Å; V107-E111 PolarHBondContact O-N 3.47Å
108	S	77	Confident	74	Confident	8 Å²	8	76.8 Å²	76.8	6%	0.056	37%	0.373	C	S	.	.	H	α-helix	trans	-59.3	-29.1	179.8	-61	0	0	0	0	112.5	R34 R104 V105 Y118	R34-S108 PolarHBondContact NE-OG 2.88Å; R104-S108 WeakPolarHBondContact O-CB 3.33Å; R104-S108 PolarHBondContact O-N 3.3Å; R104-S108 PolarHBondContact O-OG 2.93Å; V105-S108 PolarHBondContact O-N 2.82Å; S108-Y118 WeakPolarHBondContact O-CE2 3.31Å; S108-Y118 PolarHBondContact O-OH 3.42Å
109	M	73.9	Confident	72.8	Confident	13 Å²	13	80.6 Å²	80.6	6%	0.064	39%	0.393	C	S	.	.	H	α-helix	trans	-83.5	-20.2	174.9	-64.4	-52.4	-65	0	0	114.3	V35 V105 M106 V107 Y118 M122 A123 V126	V35-M109 HydrophobicContact CB-SD 4.25Å; V35-M109 HydrophobicContact CG1-SD 3.64Å; V35-M109 HydrophobicContact CG2-SD 3.52Å; V35-M109 VanDerWaalsContact CG2-SD 3.52Å; V105-M109 WeakPolarHBondContact O-CG 3.45Å; V105-M109 PolarHBondContact O-N 3.24Å; V105-M109 VanDerWaalsContact O-N 3.08Å; M106-M109 PolarHBondContact O-N 2.95Å; V107-M109 PolarHBondContact O-N 3Å; V107-M109 VanDerWaalsContact O-N 3.15Å; M109-Y118 HydrophobicContact CE-CD1 4.11Å; M109-Y118 HydrophobicContact CE-CG 4.46Å; M109-Y118 WeakPolarHBondContact O-CD2 3.36Å; M109-Y118 HydrophobicContact SD-CE1 4.49Å; M109-M122 HydrophobicContact CE-CB 4.27Å; M109-M122 HydrophobicContact CE-CG 3.73Å; M109-A123 VanDerWaalsContact CE-CA 3.47Å; M109-A123 HydrophobicContact CE-CB 4.02Å; M109-V126 HydrophobicContact CE-CG2 4.38Å; M109-V126 HydrophobicContact CG-CB 4.35Å; M109-V126 HydrophobicContact CG-CG1 3.99Å; M109-V126 HydrophobicContact SD-CG2 4.47Å
110	S	69.6	Low	71.6	Confident	84 Å²	84	81.5 Å²	81.5	59%	0.587	40%	0.402	S	S	*	.	H	α-helix	trans	-89.8	-23.3	-177.7	70.9	0	0	0	0	113.8	M106 V107 R112	M106-S110 PolarHBondContact O-N 3.44Å; M106-S110 VanDerWaalsContact O-N 3.07Å; V107-S110 WeakPolarHBondContact CA-OG 3.42Å; V107-S110 PolarHBondContact O-N 3.43Å; V107-S110 PolarHBondContact O-OG 3.28Å; S110-R112 PolarHBondContact O-N 3.29Å
111	E	66	Low	70.5	Confident	65 Å²	65	83.6 Å²	83.6	30%	0.304	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-62.5	125.2	-176.7	-77.1	-179.3	-160.3	0	0	111.9	R34 V107 I113 Y118	R34-E111 IonicContact CZ-OE1 2.95Å; R34-E111 IonicContact CZ-OE2 2.8Å; R34-E111 IonicContact NH1-OE1 2.69Å; R34-E111 IonicContact NH1-OE2 3.32Å; R34-E111 PolarHBondContact NH1-OE2 2.79Å; R34-E111 VanDerWaalsContact NH2-CD 3.28Å; R34-E111 IonicContact NH2-OE1 2.62Å; R34-E111 PolarHBondContact NH2-OE1 2.91Å; R34-E111 IonicContact NH2-OE2 3.56Å; R34-E111 PolarHBondContact NH2-OE2 2.97Å; V107-E111 PolarHBondContact O-N 3.47Å; E111-I113 PolarHBondContact O-N 2.69Å; E111-Y118 WeakPolarHBondContact O-CD2 3.43Å; E111-Y118 WeakPolarHBondContact O-CE2 3.41Å
112	R	57.5	Low	69.4	Low	179 Å²	179	84.3 Å²	84.3	68%	0.675	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-77.2	118.7	168.1	-63.9	-174.6	-174.4	-171.8	3.3	108.3	S110	S110-R112 PolarHBondContact O-N 3.29Å
113	I	52.5	Low	68.6	Low	58 Å²	58	85.7 Å²	85.7	30%	0.297	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-103.4	119.9	170.6	-67.9	177.2	0	0	0	107.8	N31 E111 G115 K116	N31-I113 VanDerWaalsContact CG-CD1 3.44Å; N31-I113 WeakPolarHBondContact ND2-CD1 3.37Å; N31-I113 WeakPolarHBondContact OD1-CD1 3.41Å; E111-I113 PolarHBondContact O-N 2.69Å; I113-G115 VanDerWaalsContact C-N 3.27Å; I113-G115 PolarHBondContact O-N 3.13Å; I113-K116 PolarHBondContact O-N 2.97Å
114	N	54.2	Low	67.8	Low	144 Å²	144	79.8 Å²	79.8	77%	0.77	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	38	-176.9	-58.6	-8.8	0	0	0	113.9	K116	N114-K116 PolarHBondContact O-N 3.4Å; N114-K116 VanDerWaalsContact O-N 3.08Å
115	G	57.1	Low	67.2	Low	62 Å²	62	76.7 Å²	76.7	64%	0.639	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	-6.6	176.9	0	0	0	0	0	115.7	I113	I113-G115 VanDerWaalsContact C-N 3.27Å; I113-G115 PolarHBondContact O-N 3.13Å
116	K	56.8	Low	66.7	Low	168 Å²	168	76.9 Å²	76.9	73%	0.73	40%	0.397	S	S	*	.	B	Isolated β-bridge	trans	-85.9	131.9	175.1	-64.4	-172.1	179.2	-174.1	0	109.9	I113 N114	I113-K116 PolarHBondContact O-N 2.97Å; N114-K116 PolarHBondContact O-N 3.4Å; N114-K116 VanDerWaalsContact O-N 3.08Å
117	K	55.3	Low	66.4	Low	161 Å²	161	73.4 Å²	73.4	70%	0.7	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-65.6	149.9	167.4	-74.2	-175.9	177.5	-179.8	0	108.9
118	Y	58.4	Low	66.1	Low	29 Å²	29	77 Å²	77	11%	0.114	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-53.1	157.9	163.5	-88	-87.4	0	0	0	110.9	N31 V35 S108 M109 E111 T120	N31-Y118 HydrophobicContact CB-CE1 3.94Å; N31-Y118 WeakPolarHBondContact CB-OH 3.2Å; N31-Y118 VanDerWaalsContact CG-OH 3.27Å; N31-Y118 VanDerWaalsContact ND2-CZ 3.31Å; N31-Y118 PolarHBondContact ND2-OH 3.46Å; V35-Y118 HydrophobicContact CG2-CE1 4.27Å; S108-Y118 WeakPolarHBondContact O-CE2 3.31Å; S108-Y118 PolarHBondContact O-OH 3.42Å; M109-Y118 HydrophobicContact CE-CD1 4.11Å; M109-Y118 HydrophobicContact CE-CG 4.46Å; M109-Y118 WeakPolarHBondContact O-CD2 3.36Å; M109-Y118 HydrophobicContact SD-CE1 4.49Å; E111-Y118 WeakPolarHBondContact O-CD2 3.43Å; E111-Y118 WeakPolarHBondContact O-CE2 3.41Å; Y118-T120 PolarHBondContact O-N 3.41Å
119	D	65.5	Low	66.1	Low	81 Å²	81	80.2 Å²	80.2	43%	0.433	41%	0.405	S	S	.	.			trans	-52.1	115.2	164.2	-172.1	-22.9	0	0	0	107.9	I27 Y121 M122 A123	I27-D119 HydrophobicContact CD1-CB 3.94Å; I27-D119 WeakPolarHBondContact CD1-OD2 3.47Å; D119-Y121 PolarHBondContact O-N 3.4Å; D119-Y121 VanDerWaalsContact OD1-CB 3.26Å; D119-Y121 WeakPolarHBondContact OD1-CB 2.96Å; D119-Y121 PolarHBondContact OD1-N 3.45Å; D119-M122 HydrophobicContact CB-CB 4.17Å; D119-M122 PolarHBondContact O-N 2.84Å; D119-M122 VanDerWaalsContact O-N 3.1Å; D119-A123 PolarHBondContact O-N 3.15Å
120	T	68.3	Low	66.4	Low	95 Å²	95	79.8 Å²	79.8	58%	0.583	40%	0.403	S	S	*	.	H	α-helix	trans	-61.9	-29.8	-174.8	-57.7	0	0	0	0	110.2	Y118 T124	Y118-T120 PolarHBondContact O-N 3.41Å; T120-T124 VanDerWaalsContact O-CB 3.23Å; T120-T124 WeakPolarHBondContact O-CB 3.39Å; T120-T124 PolarHBondContact O-N 3.42Å; T120-T124 PolarHBondContact O-OG1 2.87Å
121	Y	67.3	Low	67	Low	149 Å²	149	79.8 Å²	79.8	58%	0.584	40%	0.399	S	S	*	.	H	α-helix	trans	-63.4	-49.1	174.6	-178.5	-97.4	0	0	0	111.4	D119 T124 F125	D119-Y121 PolarHBondContact O-N 3.4Å; D119-Y121 VanDerWaalsContact OD1-CB 3.26Å; D119-Y121 WeakPolarHBondContact OD1-CB 2.96Å; D119-Y121 PolarHBondContact OD1-N 3.45Å; Y121-T124 PolarHBondContact O-N 2.97Å; Y121-F125 WeakPolarHBondContact O-CB 3.39Å; Y121-F125 PolarHBondContact O-N 3.01Å
122	M	67.4	Low	67.7	Low	20 Å²	20	79 Å²	79	10%	0.099	40%	0.397	C	S	.	.	H	α-helix	trans	-65.6	-42.6	-179.3	-175.5	55.8	178.3	0	0	112.2	I25 I27 V35 M109 D119 T124 F125 V126	I25-M122 HydrophobicContact CB-CE 4.19Å; I25-M122 HydrophobicContact CB-SD 4.41Å; I25-M122 HydrophobicContact CD1-CE 3.58Å; I25-M122 HydrophobicContact CG1-CE 3.7Å; I25-M122 HydrophobicContact CG1-SD 4.06Å; I25-M122 HydrophobicContact CG2-CE 3.38Å; I25-M122 HydrophobicContact CG2-SD 3.61Å; I27-M122 HydrophobicContact CD1-CB 3.8Å; I27-M122 HydrophobicContact CD1-CG 4.36Å; V35-M122 HydrophobicContact CG1-CE 4.26Å; M109-M122 HydrophobicContact CE-CB 4.27Å; M109-M122 HydrophobicContact CE-CG 3.73Å; D119-M122 HydrophobicContact CB-CB 4.17Å; D119-M122 PolarHBondContact O-N 2.84Å; D119-M122 VanDerWaalsContact O-N 3.1Å; M122-T124 VanDerWaalsContact C-N 3.31Å; M122-T124 PolarHBondContact O-N 3.38Å; M122-F125 PolarHBondContact O-N 3.08Å; M122-V126 HydrophobicContact CE-CG2 3.6Å; M122-V126 HydrophobicContact CG-CG2 4.49Å; M122-V126 WeakPolarHBondContact O-CB 3.15Å; M122-V126 WeakPolarHBondContact O-CG2 3.07Å; M122-V126 PolarHBondContact O-N 2.9Å; M122-V126 HydrophobicContact SD-CG2 3.97Å
123	A	71	Confident	68.9	Low	31 Å²	31	70.6 Å²	70.6	26%	0.256	37%	0.366	S	S	.	.	H	α-helix	trans	-60.2	-42.8	175.2	0	0	0	0	0	111.8	M109 D119 G127	M109-A123 VanDerWaalsContact CE-CA 3.47Å; M109-A123 HydrophobicContact CE-CB 4.02Å; D119-A123 PolarHBondContact O-N 3.15Å; A123-G127 PolarHBondContact O-N 2.92Å
124	T	72.6	Confident	70.5	Confident	66 Å²	66	70.6 Å²	70.6	41%	0.405	37%	0.366	S	S	.	.	H	α-helix	trans	-65.8	-46.7	177.9	-59.2	0	0	0	0	111.5	T120 Y121 M122 G127 F128	T120-T124 VanDerWaalsContact O-CB 3.23Å; T120-T124 WeakPolarHBondContact O-CB 3.39Å; T120-T124 PolarHBondContact O-N 3.42Å; T120-T124 PolarHBondContact O-OG1 2.87Å; Y121-T124 PolarHBondContact O-N 2.97Å; M122-T124 VanDerWaalsContact C-N 3.31Å; M122-T124 PolarHBondContact O-N 3.38Å; T124-G127 PolarHBondContact O-N 3.29Å; T124-F128 HydrophobicContact CG2-CD2 3.69Å; T124-F128 HydrophobicContact CG2-CE2 3.27Å; T124-F128 HydrophobicContact CG2-CZ 4.22Å; T124-F128 WeakPolarHBondContact O-CD2 3.34Å; T124-F128 PolarHBondContact O-N 2.95Å
125	F	71.9	Confident	72.1	Confident	52 Å²	52	67.5 Å²	67.5	23%	0.228	35%	0.352	C	S	.	.	H	α-helix	trans	-60.6	-49.7	178.5	179.3	-95.7	0	0	0	112.2	I24 Y121 M122 G127 F128 R129	I24-F125 HydrophobicContact CG2-CE2 4.41Å; I24-F125 HydrophobicContact CG2-CZ 3.97Å; Y121-F125 WeakPolarHBondContact O-CB 3.39Å; Y121-F125 PolarHBondContact O-N 3.01Å; M122-F125 PolarHBondContact O-N 3.08Å; F125-G127 VanDerWaalsContact C-N 3.33Å; F125-G127 PolarHBondContact O-N 2.98Å; F125-F128 PolarHBondContact O-N 2.84Å; F125-R129 HydrophobicContact CE1-CG 4.24Å; F125-R129 HydrophobicContact CZ-CG 4.32Å; F125-R129 WeakPolarHBondContact O-CG 3.39Å; F125-R129 PolarHBondContact O-N 3.32Å
126	V	74	Confident	73.4	Confident	4 Å²	4	65.6 Å²	65.6	2%	0.024	33%	0.328	C	S	.	.	H	α-helix	trans	-62.3	-43.1	177.3	171.9	0	0	0	0	110.6	L39 V105 M109 M122 F128 R129 V130	L39-V126 HydrophobicContact CD2-CG1 4.23Å; V105-V126 HydrophobicContact CG1-CG1 3.4Å; M109-V126 HydrophobicContact CE-CG2 4.38Å; M109-V126 HydrophobicContact CG-CB 4.35Å; M109-V126 HydrophobicContact CG-CG1 3.99Å; M109-V126 HydrophobicContact SD-CG2 4.47Å; M122-V126 HydrophobicContact CE-CG2 3.6Å; M122-V126 HydrophobicContact CG-CG2 4.49Å; M122-V126 WeakPolarHBondContact O-CB 3.15Å; M122-V126 WeakPolarHBondContact O-CG2 3.07Å; M122-V126 PolarHBondContact O-N 2.9Å; M122-V126 HydrophobicContact SD-CG2 3.97Å; V126-F128 PolarHBondContact O-N 3.13Å; V126-R129 PolarHBondContact O-N 2.93Å; V126-V130 HydrophobicContact CG1-CG2 4.25Å; V126-V130 WeakPolarHBondContact O-CG2 3.47Å; V126-V130 PolarHBondContact O-N 3.39Å
127	G	77.1	Confident	74.9	Confident	12 Å²	12	57.8 Å²	57.8	12%	0.124	29%	0.294	C	S	.	.	H	α-helix	trans	-56.3	-49.7	177	0	0	0	0	0	112.7	A123 T124 F125 R129 V130 V131	A123-G127 PolarHBondContact O-N 2.92Å; T124-G127 PolarHBondContact O-N 3.29Å; F125-G127 VanDerWaalsContact C-N 3.33Å; F125-G127 PolarHBondContact O-N 2.98Å; G127-R129 VanDerWaalsContact C-N 3.3Å; G127-R129 PolarHBondContact O-N 3.48Å; G127-V130 PolarHBondContact O-N 3.01Å; G127-V131 WeakPolarHBondContact O-CG2 3.31Å; G127-V131 PolarHBondContact O-N 3.35Å
128	F	75.4	Confident	76.6	Confident	137 Å²	137	54.8 Å²	54.8	60%	0.601	28%	0.283	S	S	*	.	H	α-helix	trans	-58.3	-41.5	176.8	-77.6	-56.1	0	0	0	112.6	T124 F125 V126 V131 D132	T124-F128 HydrophobicContact CG2-CD2 3.69Å; T124-F128 HydrophobicContact CG2-CE2 3.27Å; T124-F128 HydrophobicContact CG2-CZ 4.22Å; T124-F128 WeakPolarHBondContact O-CD2 3.34Å; T124-F128 PolarHBondContact O-N 2.95Å; F125-F128 PolarHBondContact O-N 2.84Å; V126-F128 PolarHBondContact O-N 3.13Å; F128-V131 PolarHBondContact O-N 3.2Å; F128-D132 PolarHBondContact O-N 3.45Å
129	R	75.9	Confident	78.1	Confident	74 Å²	74	56.9 Å²	56.9	28%	0.279	30%	0.295	S	S	.	.	H	α-helix	trans	-68.8	-37.4	179.5	-65.6	-60.3	-175.4	174.4	1.2	113	F125 V126 G127 L133	F125-R129 HydrophobicContact CE1-CG 4.24Å; F125-R129 HydrophobicContact CZ-CG 4.32Å; F125-R129 WeakPolarHBondContact O-CG 3.39Å; F125-R129 PolarHBondContact O-N 3.32Å; V126-R129 PolarHBondContact O-N 2.93Å; G127-R129 VanDerWaalsContact C-N 3.3Å; G127-R129 PolarHBondContact O-N 3.48Å; R129-L133 WeakPolarHBondContact O-CB 3.4Å; R129-L133 PolarHBondContact O-N 3.41Å
130	V	81.5	Confident	79.2	Confident	5 Å²	5	54.2 Å²	54.2	3%	0.03	28%	0.279	C	S	.	.	H	α-helix	trans	-65.3	-42.5	175	171.8	0	0	0	0	110.5	L42 A102 V105 M106 V126 G127 L133 I134	L42-V130 HydrophobicContact CD2-CG2 4.17Å; A102-V130 HydrophobicContact CB-CG1 3.77Å; V105-V130 HydrophobicContact CB-CG2 4.46Å; V105-V130 HydrophobicContact CG1-CG2 3.91Å; M106-V130 HydrophobicContact CG-CG1 4.17Å; M106-V130 HydrophobicContact SD-CB 4.19Å; M106-V130 HydrophobicContact SD-CG1 4.27Å; M106-V130 HydrophobicContact SD-CG2 4.27Å; V126-V130 HydrophobicContact CG1-CG2 4.25Å; V126-V130 WeakPolarHBondContact O-CG2 3.47Å; V126-V130 PolarHBondContact O-N 3.39Å; G127-V130 PolarHBondContact O-N 3.01Å; V130-L133 PolarHBondContact O-N 3.26Å; V130-I134 HydrophobicContact CG1-CD1 3.76Å; V130-I134 HydrophobicContact CG1-CG1 4.4Å; V130-I134 VanDerWaalsContact O-CG1 3.29Å; V130-I134 WeakPolarHBondContact O-CG1 3.4Å; V130-I134 PolarHBondContact O-N 2.95Å
131	V	80.3	Confident	80.2	Confident	84 Å²	84	51.1 Å²	51.1	51%	0.509	26%	0.26	S	S	.	.	H	α-helix	trans	-63.3	-45.7	176.8	171.8	0	0	0	0	111.7	G127 F128 L133 I134 T135	G127-V131 WeakPolarHBondContact O-CG2 3.31Å; G127-V131 PolarHBondContact O-N 3.35Å; F128-V131 PolarHBondContact O-N 3.2Å; V131-L133 VanDerWaalsContact C-N 3.3Å; V131-L133 PolarHBondContact O-N 3.2Å; V131-I134 PolarHBondContact O-N 3.47Å; V131-T135 PolarHBondContact O-N 3.45Å; V131-T135 PolarHBondContact O-OG1 3.07Å
132	D	80.9	Confident	81.3	Confident	48 Å²	48	49.8 Å²	49.8	26%	0.257	26%	0.258	S	S	.	.	H	α-helix	trans	-57	-45	175.2	-82.4	-24.8	0	0	0	111	K8 F128 T135 V136	K8-D132 WeakPolarHBondContact CD-OD2 3.16Å; K8-D132 WeakPolarHBondContact CE-OD2 3.46Å; K8-D132 IonicContact NZ-OD1 3.33Å; K8-D132 PolarHBondContact NZ-OD1 2.96Å; K8-D132 IonicContact NZ-OD2 2.73Å; K8-D132 PolarHBondContact NZ-OD2 2.92Å; F128-D132 PolarHBondContact O-N 3.45Å; D132-T135 WeakPolarHBondContact O-CB 3.42Å; D132-T135 PolarHBondContact O-N 3.06Å; D132-V136 WeakPolarHBondContact O-CG2 3.35Å; D132-V136 PolarHBondContact O-N 2.94Å; D132-V136 VanDerWaalsContact O-N 3.1Å
133	L	83.4	Confident	82.3	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-62.6	-47.9	178.4	-178	160.8	0	0	0	111.5	L12 L42 F46 V98 R129 V130 V131 T135 V136 V137	L12-L133 HydrophobicContact CD1-CB 4.13Å; L12-L133 HydrophobicContact CD1-CD1 3.71Å; L12-L133 HydrophobicContact CD1-CG 4.26Å; L12-L133 HydrophobicContact CD2-CD1 4.19Å; L12-L133 HydrophobicContact CG-CD1 4.5Å; L42-L133 HydrophobicContact CD1-CD1 3.98Å; L42-L133 HydrophobicContact CD1-CD2 4.29Å; L42-L133 HydrophobicContact CD2-CD1 4.07Å; L42-L133 HydrophobicContact CG-CD1 3.91Å; F46-L133 HydrophobicContact CB-CD1 4.2Å; F46-L133 HydrophobicContact CD2-CD1 3.9Å; F46-L133 HydrophobicContact CD2-CD2 3.86Å; F46-L133 HydrophobicContact CD2-CG 3.69Å; F46-L133 HydrophobicContact CE2-CD1 4.47Å; F46-L133 HydrophobicContact CE2-CD2 4.26Å; F46-L133 HydrophobicContact CE2-CG 3.88Å; F46-L133 HydrophobicContact CG-CD1 4.01Å; F46-L133 HydrophobicContact CG-CG 4.29Å; V98-L133 HydrophobicContact CG1-CD2 3.49Å; V98-L133 VanDerWaalsContact CG1-CD2 3.49Å; R129-L133 WeakPolarHBondContact O-CB 3.4Å; R129-L133 PolarHBondContact O-N 3.41Å; V130-L133 PolarHBondContact O-N 3.26Å; V131-L133 VanDerWaalsContact C-N 3.3Å; V131-L133 PolarHBondContact O-N 3.2Å; L133-T135 VanDerWaalsContact C-N 3.26Å; L133-T135 PolarHBondContact O-N 3.18Å; L133-V136 WeakPolarHBondContact O-CB 3.37Å; L133-V136 PolarHBondContact O-N 3.23Å; L133-V136 VanDerWaalsContact O-N 3.11Å; L133-V137 HydrophobicContact CD2-CG2 3.88Å; L133-V137 WeakPolarHBondContact O-CG2 3.23Å; L133-V137 PolarHBondContact O-N 3.11Å
134	I	86	Confident	83	Confident	58 Å²	58	51.1 Å²	51.1	30%	0.297	26%	0.261	S	S	.	.	H	α-helix	trans	-59.9	-40.2	178.7	-69.3	167.6	0	0	0	110.5	L99 A102 V130 V131 V136 V137 E138	L99-I134 HydrophobicContact CD2-CG1 4.28Å; L99-I134 HydrophobicContact CD2-CG2 4.42Å; A102-I134 HydrophobicContact CB-CD1 4.22Å; A102-I134 HydrophobicContact CB-CG1 4.46Å; V130-I134 HydrophobicContact CG1-CD1 3.76Å; V130-I134 HydrophobicContact CG1-CG1 4.4Å; V130-I134 VanDerWaalsContact O-CG1 3.29Å; V130-I134 WeakPolarHBondContact O-CG1 3.4Å; V130-I134 PolarHBondContact O-N 2.95Å; V131-I134 PolarHBondContact O-N 3.47Å; I134-V136 VanDerWaalsContact C-N 3.32Å; I134-V136 PolarHBondContact O-N 2.97Å; I134-V137 WeakPolarHBondContact O-CB 3.38Å; I134-V137 PolarHBondContact O-N 3.03Å; I134-E138 WeakPolarHBondContact O-CB 3.48Å; I134-E138 PolarHBondContact O-N 3.25Å
135	T	87.1	Confident	83.6	Confident	78 Å²	78	52.9 Å²	52.9	48%	0.479	27%	0.267	S	S	.	.	H	α-helix	trans	-60.6	-41.2	176.3	-54.5	0	0	0	0	111.6	V131 D132 L133 E138 M139	V131-T135 PolarHBondContact O-N 3.45Å; V131-T135 PolarHBondContact O-OG1 3.07Å; D132-T135 WeakPolarHBondContact O-CB 3.42Å; D132-T135 PolarHBondContact O-N 3.06Å; L133-T135 VanDerWaalsContact C-N 3.26Å; L133-T135 PolarHBondContact O-N 3.18Å; T135-E138 PolarHBondContact O-N 3.3Å; T135-M139 WeakPolarHBondContact O-CB 3.34Å; T135-M139 PolarHBondContact O-N 2.62Å
136	V	85.6	Confident	84.2	Confident	23 Å²	23	53.5 Å²	53.5	14%	0.139	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-44.1	174.8	172.7	0	0	0	0	111.2	V5 V9 F46 D132 L133 I134 E138 M139 E140	V5-V136 HydrophobicContact CG1-CG2 4.13Å; V9-V136 HydrophobicContact CG2-CG2 4.34Å; F46-V136 HydrophobicContact CE2-CG1 4.35Å; F46-V136 HydrophobicContact CZ-CG1 4.08Å; D132-V136 WeakPolarHBondContact O-CG2 3.35Å; D132-V136 PolarHBondContact O-N 2.94Å; D132-V136 VanDerWaalsContact O-N 3.1Å; L133-V136 WeakPolarHBondContact O-CB 3.37Å; L133-V136 PolarHBondContact O-N 3.23Å; L133-V136 VanDerWaalsContact O-N 3.11Å; I134-V136 VanDerWaalsContact C-N 3.32Å; I134-V136 PolarHBondContact O-N 2.97Å; V136-E138 VanDerWaalsContact C-N 3.34Å; V136-E138 PolarHBondContact O-N 3.24Å; V136-M139 PolarHBondContact O-N 3.32Å; V136-E140 HydrophobicContact CG1-CG 4.36Å; V136-E140 WeakPolarHBondContact O-CB 3.44Å; V136-E140 WeakPolarHBondContact O-CG 3.14Å; V136-E140 PolarHBondContact O-N 3.18Å
137	V	88.4	Confident	84.6	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.024	29%	0.29	C	S	.	.	H	α-helix	trans	-59.2	-46.6	177.5	172.6	0	0	0	0	110.8	F46 F49 V95 V98 L133 I134 T141	F46-V137 HydrophobicContact CD2-CG2 4.15Å; F46-V137 HydrophobicContact CE2-CG2 3.96Å; F49-V137 HydrophobicContact CD1-CG2 4.11Å; F49-V137 HydrophobicContact CE1-CB 4.3Å; F49-V137 HydrophobicContact CE1-CG1 4.47Å; F49-V137 HydrophobicContact CE1-CG2 3.9Å; F49-V137 HydrophobicContact CE2-CG1 3.99Å; F49-V137 HydrophobicContact CZ-CB 4.17Å; F49-V137 HydrophobicContact CZ-CG1 3.96Å; F49-V137 HydrophobicContact CZ-CG2 4.22Å; V95-V137 HydrophobicContact CG1-CG1 4.07Å; V95-V137 HydrophobicContact CG2-CG1 4.09Å; V98-V137 HydrophobicContact CG1-CG2 3.91Å; L133-V137 HydrophobicContact CD2-CG2 3.88Å; L133-V137 WeakPolarHBondContact O-CG2 3.23Å; L133-V137 PolarHBondContact O-N 3.11Å; I134-V137 WeakPolarHBondContact O-CB 3.38Å; I134-V137 PolarHBondContact O-N 3.03Å; V137-T141 VanDerWaalsContact O-CB 3.3Å; V137-T141 WeakPolarHBondContact O-CB 3.38Å; V137-T141 PolarHBondContact O-N 3.08Å; V137-T141 PolarHBondContact O-OG1 2.67Å
138	E	90.1	Very high	84.8	Confident	98 Å²	98	55.7 Å²	55.7	46%	0.458	29%	0.288	S	S	.	.	H	α-helix	trans	-61.5	-47.4	178.4	-171.6	-173.8	164.9	0	0	111.7	I134 T135 V136 T141 K142	I134-E138 WeakPolarHBondContact O-CB 3.48Å; I134-E138 PolarHBondContact O-N 3.25Å; T135-E138 PolarHBondContact O-N 3.3Å; V136-E138 VanDerWaalsContact C-N 3.34Å; V136-E138 PolarHBondContact O-N 3.24Å; E138-T141 PolarHBondContact O-N 3.44Å; E138-K142 HydrophobicContact CG-CD 4.24Å; E138-K142 WeakPolarHBondContact O-CB 3.18Å; E138-K142 WeakPolarHBondContact O-CG 3.01Å; E138-K142 PolarHBondContact O-N 3.18Å; E138-K142 WeakPolarHBondContact OE1-CE 3.11Å; E138-K142 IonicContact OE1-NZ 2.65Å; E138-K142 PolarHBondContact OE1-NZ 3.09Å
139	M	89.9	Confident	85.1	Confident	73 Å²	73	51.8 Å²	51.8	36%	0.36	28%	0.281	S	S	.	.	H	α-helix	trans	-60.5	-48.6	178.9	-178.5	-171.1	66.1	0	0	112	T135 V136 K142 N143	T135-M139 WeakPolarHBondContact O-CB 3.34Å; T135-M139 PolarHBondContact O-N 2.62Å; V136-M139 PolarHBondContact O-N 3.32Å; M139-K142 PolarHBondContact O-N 3.47Å; M139-N143 VanDerWaalsContact O-CG 3.24Å; M139-N143 PolarHBondContact O-N 3.38Å; M139-N143 PolarHBondContact O-ND2 3.45Å
140	E	89.3	Confident	85.1	Confident	25 Å²	25	53 Å²	53	12%	0.117	29%	0.293	C	S	.	.	H	α-helix	trans	-66.4	-37.4	179.3	-72.7	-67.9	161.7	0	0	111.9	F49 V53 K57 V136 N143 L144	F49-E140 HydrophobicContact CE1-CB 4.23Å; F49-E140 HydrophobicContact CZ-CB 3.82Å; V53-E140 HydrophobicContact CG2-CB 4.33Å; K57-E140 IonicContact NZ-OE1 2.74Å; K57-E140 IonicContact NZ-OE2 3.51Å; K57-E140 PolarHBondContact NZ-OE2 3.15Å; V136-E140 HydrophobicContact CG1-CG 4.36Å; V136-E140 WeakPolarHBondContact O-CB 3.44Å; V136-E140 WeakPolarHBondContact O-CG 3.14Å; V136-E140 PolarHBondContact O-N 3.18Å; E140-N143 PolarHBondContact O-N 2.81Å; E140-L144 WeakPolarHBondContact O-CG 3.48Å; E140-L144 PolarHBondContact O-N 2.97Å
141	T	89.7	Confident	84.8	Confident	30 Å²	30	53.3 Å²	53.3	18%	0.184	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-45	175.8	-55	0	0	0	0	110.9	V137 E138 N143 L144 L145	V137-T141 VanDerWaalsContact O-CB 3.3Å; V137-T141 WeakPolarHBondContact O-CB 3.38Å; V137-T141 PolarHBondContact O-N 3.08Å; V137-T141 PolarHBondContact O-OG1 2.67Å; E138-T141 PolarHBondContact O-N 3.44Å; T141-N143 VanDerWaalsContact C-N 3.34Å; T141-N143 PolarHBondContact O-N 3.28Å; T141-L144 PolarHBondContact O-N 3.4Å; T141-L145 HydrophobicContact CG2-CD1 4.44Å; T141-L145 WeakPolarHBondContact O-CG 3.47Å; T141-L145 PolarHBondContact O-N 3.45Å
142	K	90	Very high	84.7	Confident	121 Å²	121	53.5 Å²	53.5	53%	0.526	30%	0.296	S	S	.	.	H	α-helix	trans	-60	-42.6	175.1	-77.2	174.1	171.1	171.8	0	112.3	E138 M139 L144 L145 S146	E138-K142 HydrophobicContact CG-CD 4.24Å; E138-K142 WeakPolarHBondContact O-CB 3.18Å; E138-K142 WeakPolarHBondContact O-CG 3.01Å; E138-K142 PolarHBondContact O-N 3.18Å; E138-K142 WeakPolarHBondContact OE1-CE 3.11Å; E138-K142 IonicContact OE1-NZ 2.65Å; E138-K142 PolarHBondContact OE1-NZ 3.09Å; M139-K142 PolarHBondContact O-N 3.47Å; K142-L144 VanDerWaalsContact C-N 3.33Å; K142-L144 PolarHBondContact O-N 3.48Å; K142-L145 PolarHBondContact O-N 2.87Å; K142-S146 PolarHBondContact O-N 2.94Å; K142-S146 VanDerWaalsContact O-N 3.13Å
143	N	87.7	Confident	84.6	Confident	77 Å²	77	56 Å²	56	41%	0.412	31%	0.308	S	S	.	.	H	α-helix	trans	-60.4	-43.5	176	-70.7	-20.4	0	0	0	111.3	M139 E140 T141 S146 V147	M139-N143 VanDerWaalsContact O-CG 3.24Å; M139-N143 PolarHBondContact O-N 3.38Å; M139-N143 PolarHBondContact O-ND2 3.45Å; E140-N143 PolarHBondContact O-N 2.81Å; T141-N143 VanDerWaalsContact C-N 3.34Å; T141-N143 PolarHBondContact O-N 3.28Å; N143-S146 PolarHBondContact O-N 2.95Å; N143-S146 PolarHBondContact O-OG 3.21Å; N143-V147 WeakPolarHBondContact O-CG2 3.13Å; N143-V147 PolarHBondContact O-N 2.92Å
144	L	86.7	Confident	84.3	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-67.5	-40.7	177.5	-73.5	176.1	0	0	0	112.9	V53 K57 L91 E140 T141 K142 S146 V147 F148	V53-L144 HydrophobicContact CB-CD1 4.13Å; V53-L144 HydrophobicContact CG1-CD1 4.1Å; V53-L144 HydrophobicContact CG2-CD1 3.83Å; K57-L144 HydrophobicContact CG-CD2 3.89Å; L91-L144 HydrophobicContact CD1-CD1 3.78Å; L91-L144 HydrophobicContact CD2-CB 4.12Å; L91-L144 HydrophobicContact CD2-CD1 3.5Å; L91-L144 VanDerWaalsContact CD2-CD1 3.5Å; L91-L144 HydrophobicContact CD2-CG 4.48Å; L91-L144 HydrophobicContact CG-CD1 4.28Å; E140-L144 WeakPolarHBondContact O-CG 3.48Å; E140-L144 PolarHBondContact O-N 2.97Å; T141-L144 PolarHBondContact O-N 3.4Å; K142-L144 VanDerWaalsContact C-N 3.33Å; K142-L144 PolarHBondContact O-N 3.48Å; L144-S146 PolarHBondContact O-N 3.48Å; L144-V147 WeakPolarHBondContact O-CA 2.95Å; L144-V147 WeakPolarHBondContact O-CB 2.93Å; L144-V147 PolarHBondContact O-N 3.14Å; L144-F148 HydrophobicContact CB-CD2 4.44Å; L144-F148 HydrophobicContact CB-CE2 4.33Å; L144-F148 WeakPolarHBondContact O-CD2 3.4Å; L144-F148 PolarHBondContact O-N 3.32Å
145	L	85.2	Confident	83.8	Confident	103 Å²	103	57.7 Å²	57.7	54%	0.539	32%	0.317	S	S	.	.	H	α-helix	trans	-56.8	-38.6	174.9	-72.3	173.2	0	0	0	111.7	T141 K142 V147 F148 A149	T141-L145 HydrophobicContact CG2-CD1 4.44Å; T141-L145 WeakPolarHBondContact O-CG 3.47Å; T141-L145 PolarHBondContact O-N 3.45Å; K142-L145 PolarHBondContact O-N 2.87Å; L145-V147 VanDerWaalsContact C-N 3.28Å; L145-V147 PolarHBondContact O-N 2.8Å; L145-F148 PolarHBondContact O-N 3.25Å; L145-A149 WeakPolarHBondContact O-CB 3.26Å; L145-A149 PolarHBondContact O-N 3.29Å
146	S	84.9	Confident	83.5	Confident	66 Å²	66	56.8 Å²	56.8	46%	0.462	31%	0.312	S	S	.	.	H	α-helix	trans	-63.7	-34.5	175.5	79.5	0	0	0	0	112.9	K142 N143 L144 N150	K142-S146 PolarHBondContact O-N 2.94Å; K142-S146 VanDerWaalsContact O-N 3.13Å; N143-S146 PolarHBondContact O-N 2.95Å; N143-S146 PolarHBondContact O-OG 3.21Å; L144-S146 PolarHBondContact O-N 3.48Å; S146-N150 PolarHBondContact O-N 3.45Å; S146-N150 PolarHBondContact O-ND2 3.19Å
147	V	81.4	Confident	83.2	Confident	46 Å²	46	61 Å²	61	28%	0.279	33%	0.331	S	S	.	.	H	α-helix	trans	-70.2	-45.3	176.7	175	0	0	0	0	110.7	A60 N143 L144 L145 N150 L151	A60-V147 HydrophobicContact CB-CG1 3.32Å; N143-V147 WeakPolarHBondContact O-CG2 3.13Å; N143-V147 PolarHBondContact O-N 2.92Å; L144-V147 WeakPolarHBondContact O-CA 2.95Å; L144-V147 WeakPolarHBondContact O-CB 2.93Å; L144-V147 PolarHBondContact O-N 3.14Å; L145-V147 VanDerWaalsContact C-N 3.28Å; L145-V147 PolarHBondContact O-N 2.8Å; V147-N150 PolarHBondContact O-N 3Å; V147-L151 PolarHBondContact O-N 3.43Å
148	F	82	Confident	82.5	Confident	15 Å²	15	62.7 Å²	62.7	7%	0.066	34%	0.34	C	S	.	.	H	α-helix	trans	-71.1	-28.7	178.6	-71.3	-70.4	0	0	0	113.4	F59 V87 V88 L144 L145 N150 L151 T152	F59-F148 HydrophobicContact CD1-CE1 4.06Å; F59-F148 HydrophobicContact CD1-CZ 4.47Å; F59-F148 HydrophobicContact CE1-CE1 4.06Å; V87-F148 HydrophobicContact CB-CZ 4.23Å; V87-F148 HydrophobicContact CG1-CE1 4.33Å; V87-F148 HydrophobicContact CG1-CE2 4.33Å; V87-F148 HydrophobicContact CG1-CZ 3.54Å; V88-F148 HydrophobicContact CG2-CD1 4.11Å; V88-F148 HydrophobicContact CG2-CD2 3.96Å; V88-F148 HydrophobicContact CG2-CE1 4.27Å; V88-F148 HydrophobicContact CG2-CE2 4.1Å; V88-F148 HydrophobicContact CG2-CG 4.01Å; V88-F148 HydrophobicContact CG2-CZ 4.28Å; L144-F148 HydrophobicContact CB-CD2 4.44Å; L144-F148 HydrophobicContact CB-CE2 4.33Å; L144-F148 WeakPolarHBondContact O-CD2 3.4Å; L144-F148 PolarHBondContact O-N 3.32Å; L145-F148 PolarHBondContact O-N 3.25Å; F148-N150 VanDerWaalsContact C-N 3.29Å; F148-N150 PolarHBondContact O-N 2.67Å; F148-L151 HydrophobicContact CD1-CD1 3.63Å; F148-L151 HydrophobicContact CE1-CD1 3.98Å; F148-L151 WeakPolarHBondContact O-CB 2.75Å; F148-L151 PolarHBondContact O-N 2.85Å; F148-L151 VanDerWaalsContact O-N 3.14Å; F148-T152 PolarHBondContact O-N 3.41Å; F148-T152 PolarHBondContact O-OG1 3.27Å; F148-T152 VanDerWaalsContact O-OG1 3.11Å
149	A	81.6	Confident	81.9	Confident	55 Å²	55	63 Å²	63	46%	0.455	34%	0.341	S	S	.	.	H	α-helix	trans	-61.1	-39.4	172	0	0	0	0	0	111.7	L145 L151 T152 L153	L145-A149 WeakPolarHBondContact O-CB 3.26Å; L145-A149 PolarHBondContact O-N 3.29Å; A149-L151 VanDerWaalsContact C-N 3.3Å; A149-L151 PolarHBondContact O-N 3.14Å; A149-T152 WeakPolarHBondContact O-CB 2.85Å; A149-T152 PolarHBondContact O-N 3.04Å; A149-L153 PolarHBondContact O-N 2.95Å; A149-L153 VanDerWaalsContact O-N 3.1Å
150	N	75.3	Confident	81.4	Confident	100 Å²	100	63.6 Å²	63.6	54%	0.535	35%	0.345	S	S	.	.	H	α-helix	trans	-65.5	-33.4	174.7	-67.1	-27.9	0	0	0	112.3	S146 V147 F148 L153 H154	S146-N150 PolarHBondContact O-N 3.45Å; S146-N150 PolarHBondContact O-ND2 3.19Å; V147-N150 PolarHBondContact O-N 3Å; F148-N150 VanDerWaalsContact C-N 3.29Å; F148-N150 PolarHBondContact O-N 2.67Å; N150-L153 WeakPolarHBondContact O-CB 3.33Å; N150-L153 PolarHBondContact O-N 3.05Å; N150-H154 PolarHBondContact O-N 3.42Å
151	L	75.7	Confident	80.9	Confident	12 Å²	12	66 Å²	66	6%	0.063	36%	0.361	C	S	.	.	H	α-helix	trans	-66.9	-41	173.9	-66.3	175.1	0	0	0	111.9	F59 Y63 V147 F148 A149 L153 H154 V155	F59-L151 HydrophobicContact CE1-CD1 4.08Å; Y63-L151 HydrophobicContact CD1-CD2 3.12Å; Y63-L151 HydrophobicContact CE1-CD2 3.13Å; Y63-L151 HydrophobicContact CG-CD2 4.11Å; V147-L151 PolarHBondContact O-N 3.43Å; F148-L151 HydrophobicContact CD1-CD1 3.63Å; F148-L151 HydrophobicContact CE1-CD1 3.98Å; F148-L151 WeakPolarHBondContact O-CB 2.75Å; F148-L151 PolarHBondContact O-N 2.85Å; F148-L151 VanDerWaalsContact O-N 3.14Å; A149-L151 VanDerWaalsContact C-N 3.3Å; A149-L151 PolarHBondContact O-N 3.14Å; L151-L153 PolarHBondContact O-N 3.36Å; L151-H154 WeakPolarHBondContact O-CB 3.44Å; L151-H154 PolarHBondContact O-N 3.08Å; L151-H154 VanDerWaalsContact O-N 3.1Å; L151-V155 PolarHBondContact O-N 3.3Å
152	T	78.4	Confident	80.2	Confident	88 Å²	88	69.9 Å²	69.9	54%	0.54	38%	0.379	S	S	.	.	H	α-helix	trans	-59.6	-39.7	175.5	-53.1	0	0	0	0	110.9	F148 A149 H154 V155 T156	F148-T152 PolarHBondContact O-N 3.41Å; F148-T152 PolarHBondContact O-OG1 3.27Å; F148-T152 VanDerWaalsContact O-OG1 3.11Å; A149-T152 WeakPolarHBondContact O-CB 2.85Å; A149-T152 PolarHBondContact O-N 3.04Å; T152-H154 VanDerWaalsContact C-N 3.32Å; T152-H154 PolarHBondContact O-N 3.31Å; T152-V155 WeakPolarHBondContact O-CB 3.48Å; T152-V155 PolarHBondContact O-N 2.96Å; T152-T156 PolarHBondContact O-N 3.14Å; T152-T156 PolarHBondContact O-OG1 3.03Å
153	L	78.6	Confident	79.6	Confident	100 Å²	100	71.8 Å²	71.8	52%	0.524	39%	0.389	S	S	.	.	H	α-helix	trans	-58.8	-41.9	175.1	-169.8	79.9	0	0	0	112.2	A149 N150 L151 V155 T156 M157	A149-L153 PolarHBondContact O-N 2.95Å; A149-L153 VanDerWaalsContact O-N 3.1Å; N150-L153 WeakPolarHBondContact O-CB 3.33Å; N150-L153 PolarHBondContact O-N 3.05Å; L151-L153 PolarHBondContact O-N 3.36Å; L153-V155 VanDerWaalsContact C-N 3.33Å; L153-V155 PolarHBondContact O-N 3.18Å; L153-T156 PolarHBondContact O-N 2.97Å; L153-M157 HydrophobicContact CD2-SD 4.5Å; L153-M157 HydrophobicContact CG-SD 4.38Å; L153-M157 WeakPolarHBondContact O-CG 3.39Å; L153-M157 PolarHBondContact O-N 1.96Å
154	H	75.8	Confident	79.1	Confident	64 Å²	64	75.7 Å²	75.7	30%	0.296	41%	0.405	S	S	.	.	H	α-helix	trans	-62.6	-40.5	177.1	-63.9	171.2	0	0	0	112.1	N150 L151 T152 M157 L158	N150-H154 PolarHBondContact O-N 3.42Å; L151-H154 WeakPolarHBondContact O-CB 3.44Å; L151-H154 PolarHBondContact O-N 3.08Å; L151-H154 VanDerWaalsContact O-N 3.1Å; T152-H154 VanDerWaalsContact C-N 3.32Å; T152-H154 PolarHBondContact O-N 3.31Å; H154-M157 PolarHBondContact O-N 2.81Å; H154-L158 PolarHBondContact O-N 2.92Å
155	V	76.3	Confident	77.7	Confident	32 Å²	32	86 Å²	86	19%	0.194	45%	0.454	C	S	.	.	H	α-helix	trans	-60.8	-50.4	175.3	177.6	0	0	0	0	110	I77 L151 T152 L153 M157 L158 E159	I77-V155 HydrophobicContact CG2-CB 4.38Å; I77-V155 HydrophobicContact CG2-CG2 3.77Å; L151-V155 PolarHBondContact O-N 3.3Å; T152-V155 WeakPolarHBondContact O-CB 3.48Å; T152-V155 PolarHBondContact O-N 2.96Å; L153-V155 VanDerWaalsContact C-N 3.33Å; L153-V155 PolarHBondContact O-N 3.18Å; V155-M157 VanDerWaalsContact C-N 3.32Å; V155-M157 PolarHBondContact O-N 2.76Å; V155-L158 WeakPolarHBondContact O-CB 3.46Å; V155-L158 PolarHBondContact O-N 2.95Å; V155-L158 VanDerWaalsContact O-N 3.15Å; V155-E159 HydrophobicContact CG1-CG 4.45Å; V155-E159 WeakPolarHBondContact O-CG 3.16Å; V155-E159 PolarHBondContact O-N 2.92Å
156	T	81.1	Confident	77.3	Confident	60 Å²	60	85.2 Å²	85.2	37%	0.368	45%	0.449	S	S	.	.	H	α-helix	trans	-61.3	-39.5	179.4	-55.6	0	0	0	0	112.5	T152 L153 L158 E159 I160	T152-T156 PolarHBondContact O-N 3.14Å; T152-T156 PolarHBondContact O-OG1 3.03Å; L153-T156 PolarHBondContact O-N 2.97Å; T156-L158 VanDerWaalsContact C-N 3.34Å; T156-L158 PolarHBondContact O-N 2.82Å; T156-E159 PolarHBondContact O-N 3.45Å; T156-I160 HydrophobicContact CG2-CD1 4.08Å; T156-I160 VanDerWaalsContact O-CG1 3.29Å; T156-I160 WeakPolarHBondContact O-CG1 3.21Å; T156-I160 PolarHBondContact O-N 2.97Å
157	M	78.5	Confident	76.9	Confident	111 Å²	111	86.2 Å²	86.2	55%	0.547	45%	0.449	S	S	.	.	H	α-helix	trans	-63.9	-39.6	176.3	-74.4	-179.3	64.5	0	0	112.2	L153 H154 V155 T161	L153-M157 HydrophobicContact CD2-SD 4.5Å; L153-M157 HydrophobicContact CG-SD 4.38Å; L153-M157 WeakPolarHBondContact O-CG 3.39Å; L153-M157 PolarHBondContact O-N 1.96Å; H154-M157 PolarHBondContact O-N 2.81Å; V155-M157 VanDerWaalsContact C-N 3.32Å; V155-M157 PolarHBondContact O-N 2.76Å; M157-T161 PolarHBondContact O-N 3.11Å; M157-T161 PolarHBondContact O-OG1 3.1Å
158	L	75	Confident	76.7	Confident	39 Å²	39	88.4 Å²	88.4	20%	0.204	46%	0.458	C	S	.	.	H	α-helix	trans	-64.7	-46.7	175.2	-173.5	83.2	0	0	0	111.1	A74 I77 H154 V155 T156 I160 T161 M162	A74-L158 HydrophobicContact CB-CD1 4.33Å; A74-L158 HydrophobicContact CB-CD2 4.03Å; I77-L158 HydrophobicContact CB-CD2 4.05Å; I77-L158 HydrophobicContact CD1-CB 3.9Å; I77-L158 HydrophobicContact CD1-CD1 3.74Å; I77-L158 HydrophobicContact CD1-CD2 3.79Å; I77-L158 HydrophobicContact CD1-CG 4.01Å; I77-L158 HydrophobicContact CG2-CD2 3.94Å; H154-L158 PolarHBondContact O-N 2.92Å; V155-L158 WeakPolarHBondContact O-CB 3.46Å; V155-L158 PolarHBondContact O-N 2.95Å; V155-L158 VanDerWaalsContact O-N 3.15Å; T156-L158 VanDerWaalsContact C-N 3.34Å; T156-L158 PolarHBondContact O-N 2.82Å; L158-I160 VanDerWaalsContact C-N 3.28Å; L158-I160 PolarHBondContact O-N 3.1Å; L158-T161 PolarHBondContact O-N 3.49Å; L158-T161 VanDerWaalsContact O-N 3.13Å; L158-M162 HydrophobicContact CD2-SD 4.08Å; L158-M162 HydrophobicContact CG-CG 4.38Å; L158-M162 HydrophobicContact CG-SD 4.03Å; L158-M162 WeakPolarHBondContact O-CG 3.29Å; L158-M162 PolarHBondContact O-N 3.46Å
159	E	77.1	Confident	76.3	Confident	105 Å²	105	92.8 Å²	92.8	49%	0.491	48%	0.481	S	S	.	.	H	α-helix	trans	-57	-41.6	177.8	-71.7	174.7	156.9	0	0	112.1	V155 T156 Q163	V155-E159 HydrophobicContact CG1-CG 4.45Å; V155-E159 WeakPolarHBondContact O-CG 3.16Å; V155-E159 PolarHBondContact O-N 2.92Å; T156-E159 PolarHBondContact O-N 3.45Å; E159-Q163 VanDerWaalsContact O-CG 3.29Å; E159-Q163 WeakPolarHBondContact O-CG 3.48Å; E159-Q163 PolarHBondContact O-N 3.22Å
160	I	79.6	Confident	76	Confident	85 Å²	85	95.1 Å²	95.1	44%	0.436	48%	0.483	S	S	.	.	H	α-helix	trans	-64.5	-47.6	175.5	-67.9	166.1	0	0	0	110.4	T156 L158 M162 Q163 E164	T156-I160 HydrophobicContact CG2-CD1 4.08Å; T156-I160 VanDerWaalsContact O-CG1 3.29Å; T156-I160 WeakPolarHBondContact O-CG1 3.21Å; T156-I160 PolarHBondContact O-N 2.97Å; L158-I160 VanDerWaalsContact C-N 3.28Å; L158-I160 PolarHBondContact O-N 3.1Å; I160-M162 VanDerWaalsContact C-N 3.29Å; I160-M162 PolarHBondContact O-N 2.66Å; I160-Q163 PolarHBondContact O-N 3.46Å; I160-Q163 VanDerWaalsContact O-N 3.09Å; I160-E164 PolarHBondContact O-N 3.21Å
161	T	77.1	Confident	76.1	Confident	76 Å²	76	94.8 Å²	94.8	47%	0.466	48%	0.48	S	S	.	.	H	α-helix	trans	-61.1	-39.5	-179	-49.7	0	0	0	0	111.3	M157 L158 Q163 E164	M157-T161 PolarHBondContact O-N 3.11Å; M157-T161 PolarHBondContact O-OG1 3.1Å; L158-T161 PolarHBondContact O-N 3.49Å; L158-T161 VanDerWaalsContact O-N 3.13Å; T161-Q163 VanDerWaalsContact C-N 3.32Å; T161-Q163 PolarHBondContact O-N 3.28Å; T161-E164 PolarHBondContact O-N 3.09Å
162	M	76.9	Confident	76.1	Confident	112 Å²	112	100.7 Å²	100.7	55%	0.552	51%	0.509	S	S	*	.	H	α-helix	trans	-72.3	-19.6	177.5	-69.3	-178.9	69.2	0	0	114.1	L158 I160	L158-M162 HydrophobicContact CD2-SD 4.08Å; L158-M162 HydrophobicContact CG-CG 4.38Å; L158-M162 HydrophobicContact CG-SD 4.03Å; L158-M162 WeakPolarHBondContact O-CG 3.29Å; L158-M162 PolarHBondContact O-N 3.46Å; I160-M162 VanDerWaalsContact C-N 3.29Å; I160-M162 PolarHBondContact O-N 2.66Å
163	Q	77.4	Confident	75.9	Confident	160 Å²	160	101.7 Å²	101.7	75%	0.748	51%	0.507	S	S	*	.	H	α-helix	trans	-83.6	-19.2	174.2	-74.7	173.6	11.3	0	0	112.8	E159 I160 T161	E159-Q163 VanDerWaalsContact O-CG 3.29Å; E159-Q163 WeakPolarHBondContact O-CG 3.48Å; E159-Q163 PolarHBondContact O-N 3.22Å; I160-Q163 PolarHBondContact O-N 3.46Å; I160-Q163 VanDerWaalsContact O-N 3.09Å; T161-Q163 VanDerWaalsContact C-N 3.32Å; T161-Q163 PolarHBondContact O-N 3.28Å
164	E	75.8	Confident	75.7	Confident	160 Å²	160	101.8 Å²	101.8	75%	0.748	51%	0.506	S	S	*	.			trans	-86	-12.9	178.8	-69.2	-178.7	174.8	0	0	113.1	I160 T161	I160-E164 PolarHBondContact O-N 3.21Å; T161-E164 PolarHBondContact O-N 3.09Å
165	E	57.3	Low	75.7	Confident	218 Å²	218	105.3 Å²	105.3	100%	1.019	53%	0.525	S	S	*	.			trans	-87.8	0	172.7	-66.7	-175.2	167.3	0	0	112.8

Retrieved 165 of 165 residues in 82.9 ms (Link to these results)

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