A0A5K4F6Y6_SCHMA Loading...

PRESAN domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F6Y6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 174 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	46.7	Very low	59.9	Low	210 Å²	210	117.4 Å²	117.4	100%	1.034	58%	0.583	S	S	*	*				0	-50.9	0	-102.8	166.9	66.6	0	0	113.2	K3 N4 T5	M1-K3 PolarHBondContact O-N 3.35Å; M1-N4 PolarHBondContact O-N 3.38Å; M1-T5 PolarHBondContact O-OG1 3.37Å
2	I	46.2	Very low	61	Low	132 Å²	132	111.7 Å²	111.7	68%	0.677	56%	0.56	S	S	*	*	H	α-helix	trans	-56.4	-37.8	-173.6	-63.9	165.2	0	0	0	114.6	N4 T5 I6	I2-N4 PolarHBondContact O-N 3.01Å; I2-T5 PolarHBondContact O-N 3.48Å; I2-I6 HydrophobicContact CG2-CD1 3.78Å; I2-I6 HydrophobicContact CG2-CG1 4.39Å; I2-I6 WeakPolarHBondContact O-CG1 3.39Å; I2-I6 PolarHBondContact O-N 3.47Å; I2-I6 VanDerWaalsContact O-N 3.15Å
3	K	48.9	Very low	61.8	Low	186 Å²	186	111.3 Å²	111.3	81%	0.809	56%	0.56	S	S	*	*	H	α-helix	trans	-64.6	-33.9	179.8	-83.7	-174.9	174.1	-179.5	0	114.3	M1 L7	M1-K3 PolarHBondContact O-N 3.35Å; K3-L7 PolarHBondContact O-N 3.26Å
4	N	52.6	Low	62.6	Low	112 Å²	112	110.8 Å²	110.8	60%	0.599	56%	0.559	S	S	*	*	H	α-helix	trans	-75.7	-32.1	177.2	-78.9	-5.7	0	0	0	111.7	M1 I2 F8	M1-N4 PolarHBondContact O-N 3.38Å; I2-N4 PolarHBondContact O-N 3.01Å; N4-F8 WeakPolarHBondContact O-CB 3.43Å; N4-F8 PolarHBondContact O-N 3.16Å
5	T	57.2	Low	63	Low	78 Å²	78	110 Å²	110	48%	0.479	55%	0.552	S	S	.	*	H	α-helix	trans	-69.6	-42.8	179	-43.7	0	0	0	0	111.8	M1 I2 L7 F8 L9	M1-T5 PolarHBondContact O-OG1 3.37Å; I2-T5 PolarHBondContact O-N 3.48Å; T5-L7 VanDerWaalsContact C-N 3.33Å; T5-L7 PolarHBondContact O-N 3.06Å; T5-F8 PolarHBondContact O-N 3Å; T5-L9 HydrophobicContact CG2-CD1 4.31Å; T5-L9 WeakPolarHBondContact O-CB 3.47Å; T5-L9 WeakPolarHBondContact O-CG 3.42Å; T5-L9 PolarHBondContact O-N 3.41Å
6	I	65.6	Low	63.2	Low	94 Å²	94	109.8 Å²	109.8	48%	0.482	55%	0.552	S	S	.	*	H	α-helix	trans	-64.7	-40.2	176.5	-65	170.3	0	0	0	110.7	I2 L9 L10	I2-I6 HydrophobicContact CG2-CD1 3.78Å; I2-I6 HydrophobicContact CG2-CG1 4.39Å; I2-I6 WeakPolarHBondContact O-CG1 3.39Å; I2-I6 PolarHBondContact O-N 3.47Å; I2-I6 VanDerWaalsContact O-N 3.15Å; I6-L9 PolarHBondContact O-N 3.48Å; I6-L10 HydrophobicContact CG2-CD1 4.08Å; I6-L10 WeakPolarHBondContact O-CB 3.36Å; I6-L10 WeakPolarHBondContact O-CG 3.43Å; I6-L10 PolarHBondContact O-N 2.94Å
7	L	58.9	Low	63.2	Low	77 Å²	77	112.1 Å²	112.1	40%	0.403	56%	0.559	S	S	.	*	H	α-helix	trans	-68.2	-39.4	178.6	-145.1	86.3	0	0	0	112.1	K3 T5 L10 F11 M48	K3-L7 PolarHBondContact O-N 3.26Å; T5-L7 VanDerWaalsContact C-N 3.33Å; T5-L7 PolarHBondContact O-N 3.06Å; L7-L10 PolarHBondContact O-N 2.76Å; L7-F11 WeakPolarHBondContact O-CB 3.42Å; L7-F11 PolarHBondContact O-N 2.56Å; L7-M48 HydrophobicContact CD2-SD 3.96Å
8	F	70.4	Confident	63.3	Low	145 Å²	145	107.7 Å²	107.7	64%	0.636	54%	0.538	S	S	*	.	H	α-helix	trans	-62.5	-45.9	174.4	-173	-96.3	0	0	0	110.9	N4 T5 L10 F11 T12	N4-F8 WeakPolarHBondContact O-CB 3.43Å; N4-F8 PolarHBondContact O-N 3.16Å; T5-F8 PolarHBondContact O-N 3Å; F8-L10 PolarHBondContact O-N 2.83Å; F8-F11 WeakPolarHBondContact O-CB 3.39Å; F8-F11 PolarHBondContact O-N 3.36Å; F8-F11 VanDerWaalsContact O-N 3.12Å; F8-T12 PolarHBondContact O-N 3.13Å; F8-T12 PolarHBondContact O-OG1 3.01Å
9	L	69.1	Low	63.4	Low	97 Å²	97	111 Å²	111	51%	0.508	55%	0.545	S	S	.	.	H	α-helix	trans	-62	-43	177	-77.4	165	0	0	0	112.7	T5 I6 F11 T12 L13	T5-L9 HydrophobicContact CG2-CD1 4.31Å; T5-L9 WeakPolarHBondContact O-CB 3.47Å; T5-L9 WeakPolarHBondContact O-CG 3.42Å; T5-L9 PolarHBondContact O-N 3.41Å; I6-L9 PolarHBondContact O-N 3.48Å; L9-F11 VanDerWaalsContact C-N 3.27Å; L9-F11 PolarHBondContact O-N 2.79Å; L9-T12 PolarHBondContact O-N 2.9Å; L9-L13 WeakPolarHBondContact O-CB 3.35Å; L9-L13 WeakPolarHBondContact O-CG 3.39Å; L9-L13 PolarHBondContact O-N 2.96Å
10	L	72.8	Confident	63.2	Low	101 Å²	101	112.6 Å²	112.6	53%	0.529	55%	0.551	S	S	.	*	H	α-helix	trans	-61.1	-39.4	173.7	-78.2	167.8	0	0	0	111.4	I6 L7 F8 L14	I6-L10 HydrophobicContact CG2-CD1 4.08Å; I6-L10 WeakPolarHBondContact O-CB 3.36Å; I6-L10 WeakPolarHBondContact O-CG 3.43Å; I6-L10 PolarHBondContact O-N 2.94Å; L7-L10 PolarHBondContact O-N 2.76Å; F8-L10 PolarHBondContact O-N 2.83Å; L10-L14 WeakPolarHBondContact O-CB 3.42Å; L10-L14 PolarHBondContact O-N 3.27Å
11	F	70.4	Confident	63	Low	59 Å²	59	113.6 Å²	113.6	26%	0.259	55%	0.553	S	S	.	*	H	α-helix	trans	-66.1	-43.1	177.1	-160.8	-94.9	0	0	0	112.1	L7 F8 L9 L14 Q15 Q41 L44	L7-F11 WeakPolarHBondContact O-CB 3.42Å; L7-F11 PolarHBondContact O-N 2.56Å; F8-F11 WeakPolarHBondContact O-CB 3.39Å; F8-F11 PolarHBondContact O-N 3.36Å; F8-F11 VanDerWaalsContact O-N 3.12Å; L9-F11 VanDerWaalsContact C-N 3.27Å; L9-F11 PolarHBondContact O-N 2.79Å; F11-L14 PolarHBondContact O-N 3.3Å; F11-Q15 HydrophobicContact CD1-CG 4.49Å; F11-Q15 HydrophobicContact CE1-CG 4.26Å; F11-Q15 WeakPolarHBondContact O-CG 3.46Å; F11-Q15 PolarHBondContact O-N 3.33Å; F11-Q15 VanDerWaalsContact O-N 3.11Å; F11-Q41 HydrophobicContact CE2-CB 4.23Å; F11-Q41 HydrophobicContact CE2-CG 3.86Å; F11-Q41 HydrophobicContact CZ-CB 4.12Å; F11-Q41 HydrophobicContact CZ-CG 3.52Å; F11-L44 HydrophobicContact CD2-CD2 4.39Å
12	T	73.6	Confident	63.4	Low	49 Å²	49	104.8 Å²	104.8	30%	0.301	51%	0.51	S	S	.	.	H	α-helix	trans	-67.1	-40.6	177	-37.6	0	0	0	0	111.8	F8 L9 Q15 L16	F8-T12 PolarHBondContact O-N 3.13Å; F8-T12 PolarHBondContact O-OG1 3.01Å; L9-T12 PolarHBondContact O-N 2.9Å; T12-Q15 PolarHBondContact O-N 2.82Å; T12-L16 WeakPolarHBondContact O-CG 3.5Å; T12-L16 PolarHBondContact O-N 3.5Å
13	L	71.2	Confident	64	Low	107 Å²	107	105.2 Å²	105.2	56%	0.56	51%	0.509	S	S	*	.	H	α-helix	trans	-63.9	-41.4	176.1	-80.9	163.9	0	0	0	111.8	L9 Q15 L16 F17	L9-L13 WeakPolarHBondContact O-CB 3.35Å; L9-L13 WeakPolarHBondContact O-CG 3.39Å; L9-L13 PolarHBondContact O-N 2.96Å; L13-Q15 VanDerWaalsContact C-N 3.31Å; L13-Q15 PolarHBondContact O-N 2.75Å; L13-L16 PolarHBondContact O-N 3.05Å; L13-F17 WeakPolarHBondContact O-CB 3.45Å; L13-F17 PolarHBondContact O-N 3.4Å
14	L	73	Confident	64.5	Low	104 Å²	104	104.2 Å²	104.2	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-62.7	-39.9	175.9	-136.4	114.4	0	0	0	111.3	L10 F11 V18	L10-L14 WeakPolarHBondContact O-CB 3.42Å; L10-L14 PolarHBondContact O-N 3.27Å; F11-L14 PolarHBondContact O-N 3.3Å; L14-V18 VanDerWaalsContact O-CB 3.29Å; L14-V18 WeakPolarHBondContact O-CB 3.19Å; L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 3.41Å
15	Q	68.4	Low	64.8	Low	99 Å²	99	101 Å²	101	46%	0.463	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-41.4	176.3	-74.5	-175.5	-34.7	0	0	112.7	F11 T12 L13 Y19	F11-Q15 HydrophobicContact CD1-CG 4.49Å; F11-Q15 HydrophobicContact CE1-CG 4.26Å; F11-Q15 WeakPolarHBondContact O-CG 3.46Å; F11-Q15 PolarHBondContact O-N 3.33Å; F11-Q15 VanDerWaalsContact O-N 3.11Å; T12-Q15 PolarHBondContact O-N 2.82Å; L13-Q15 VanDerWaalsContact C-N 3.31Å; L13-Q15 PolarHBondContact O-N 2.75Å; Q15-Y19 WeakPolarHBondContact O-CB 3.12Å; Q15-Y19 PolarHBondContact O-N 3.45Å
16	L	65.5	Low	65.1	Low	106 Å²	106	99.6 Å²	99.6	56%	0.555	49%	0.488	S	S	*	.	H	α-helix	trans	-66.5	-44.9	177.9	-74.1	166	0	0	0	111.8	T12 L13 V18 Y19 E20	T12-L16 WeakPolarHBondContact O-CG 3.5Å; T12-L16 PolarHBondContact O-N 3.5Å; L13-L16 PolarHBondContact O-N 3.05Å; L16-V18 VanDerWaalsContact C-N 3.29Å; L16-V18 PolarHBondContact O-N 3.42Å; L16-Y19 WeakPolarHBondContact O-CB 3.4Å; L16-Y19 PolarHBondContact O-N 3.31Å; L16-Y19 VanDerWaalsContact O-N 3.13Å; L16-E20 PolarHBondContact O-N 3.01Å; L16-E20 VanDerWaalsContact O-N 3.16Å
17	F	64.4	Low	65.7	Low	150 Å²	150	101.5 Å²	101.5	66%	0.658	50%	0.5	S	S	*	.	H	α-helix	trans	-64.8	-36.9	-179.9	-149.6	-91.2	0	0	0	112.1	L13 F21	L13-F17 WeakPolarHBondContact O-CB 3.45Å; L13-F17 PolarHBondContact O-N 3.4Å; F17-F21 WeakPolarHBondContact O-CB 3.49Å; F17-F21 PolarHBondContact O-N 3.36Å; F17-F21 VanDerWaalsContact O-N 3.15Å
18	V	64.5	Low	66.4	Low	32 Å²	32	105.7 Å²	105.7	19%	0.194	51%	0.51	C	S	.	.	H	α-helix	trans	-66.2	-40.3	174.1	163.6	0	0	0	0	111	L14 L16 F21 I22 I33 I37	L14-V18 VanDerWaalsContact O-CB 3.29Å; L14-V18 WeakPolarHBondContact O-CB 3.19Å; L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 3.41Å; L16-V18 VanDerWaalsContact C-N 3.29Å; L16-V18 PolarHBondContact O-N 3.42Å; V18-F21 PolarHBondContact O-N 3.36Å; V18-I22 HydrophobicContact CG1-CD1 3.41Å; V18-I22 VanDerWaalsContact CG1-CD1 3.41Å; V18-I22 HydrophobicContact CG1-CG1 4.17Å; V18-I22 WeakPolarHBondContact O-CB 3.42Å; V18-I22 WeakPolarHBondContact O-CG1 3.36Å; V18-I22 PolarHBondContact O-N 2.77Å; V18-I33 HydrophobicContact CG1-CG2 4.48Å; V18-I37 HydrophobicContact CB-CD1 3.86Å; V18-I37 HydrophobicContact CG1-CD1 3.24Å; V18-I37 HydrophobicContact CG2-CD1 3.33Å; V18-I37 HydrophobicContact CG2-CG1 4.41Å
19	Y	64.4	Low	66.5	Low	171 Å²	171	104.6 Å²	104.6	67%	0.671	50%	0.502	S	S	*	.	H	α-helix	trans	-62.3	-44.9	179.9	-168.5	-94.8	0	0	0	111.8	Q15 L16 I22	Q15-Y19 WeakPolarHBondContact O-CB 3.12Å; Q15-Y19 PolarHBondContact O-N 3.45Å; L16-Y19 WeakPolarHBondContact O-CB 3.4Å; L16-Y19 PolarHBondContact O-N 3.31Å; L16-Y19 VanDerWaalsContact O-N 3.13Å; Y19-I22 PolarHBondContact O-N 2.72Å
20	E	59.7	Low	66.5	Low	142 Å²	142	102 Å²	102	66%	0.664	49%	0.487	S	S	*	.	H	α-helix	trans	-65.2	-42.9	176.3	-77	-176.2	161	0	0	112.7	L16 I22 E23	L16-E20 PolarHBondContact O-N 3.01Å; L16-E20 VanDerWaalsContact O-N 3.16Å; E20-I22 VanDerWaalsContact C-N 3.28Å; E20-I22 PolarHBondContact O-N 3.08Å; E20-E23 PolarHBondContact O-N 3.14Å
21	F	59.6	Low	66.7	Low	135 Å²	135	101.6 Å²	101.6	59%	0.592	48%	0.482	S	S	*	.	H	α-helix	trans	-66.9	-32.9	179.7	-163.9	-94.4	0	0	0	112.4	F17 V18 E23 I33	F17-F21 WeakPolarHBondContact O-CB 3.49Å; F17-F21 PolarHBondContact O-N 3.36Å; F17-F21 VanDerWaalsContact O-N 3.15Å; V18-F21 PolarHBondContact O-N 3.36Å; F21-E23 VanDerWaalsContact C-N 3.33Å; F21-E23 PolarHBondContact O-N 2.83Å; F21-I33 HydrophobicContact CD1-CD1 4.41Å; F21-I33 HydrophobicContact CE1-CD1 4.46Å
22	I	55.2	Low	67.1	Low	25 Å²	25	103.5 Å²	103.5	13%	0.128	49%	0.493	C	S	.	.	H	α-helix	trans	-70.6	-24.8	-178.2	-80	178.7	0	0	0	112	V18 Y19 E20 N24 K30 I33 I34	V18-I22 HydrophobicContact CG1-CD1 3.41Å; V18-I22 VanDerWaalsContact CG1-CD1 3.41Å; V18-I22 HydrophobicContact CG1-CG1 4.17Å; V18-I22 WeakPolarHBondContact O-CB 3.42Å; V18-I22 WeakPolarHBondContact O-CG1 3.36Å; V18-I22 PolarHBondContact O-N 2.77Å; Y19-I22 PolarHBondContact O-N 2.72Å; E20-I22 VanDerWaalsContact C-N 3.28Å; E20-I22 PolarHBondContact O-N 3.08Å; I22-N24 VanDerWaalsContact C-N 3.28Å; I22-N24 PolarHBondContact O-N 2.81Å; I22-K30 HydrophobicContact CB-CG 4.46Å; I22-K30 HydrophobicContact CG2-CB 3.94Å; I22-K30 HydrophobicContact CG2-CD 3.59Å; I22-K30 HydrophobicContact CG2-CG 3.69Å; I22-K30 WeakPolarHBondContact O-CD 3.37Å; I22-K30 WeakPolarHBondContact O-CE 3.24Å; I22-K30 WeakPolarHBondContact O-CG 3.21Å; I22-K30 PolarHBondContact O-NZ 2.87Å; I22-I33 HydrophobicContact CD1-CG2 4.41Å; I22-I34 HydrophobicContact CD1-CD1 4.18Å; I22-I34 HydrophobicContact CD1-CG1 3.78Å
23	E	58.2	Low	67.4	Low	141 Å²	141	103.3 Å²	103.3	66%	0.659	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-31.2	-172.1	-144.5	173.2	-172.4	0	0	113.4	E20 F21 K30	E20-E23 PolarHBondContact O-N 3.14Å; F21-E23 VanDerWaalsContact C-N 3.33Å; F21-E23 PolarHBondContact O-N 2.83Å; E23-K30 PolarHBondContact O-NZ 3.44Å
24	N	59.6	Low	67.8	Low	165 Å²	165	100.7 Å²	100.7	88%	0.882	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-3.2	-172.9	-96.1	-19.5	0	0	0	117.1	I22	I22-N24 VanDerWaalsContact C-N 3.28Å; I22-N24 PolarHBondContact O-N 2.81Å
25	D	60	Low	68.3	Low	45 Å²	45	99.8 Å²	99.8	24%	0.241	47%	0.471	C	S	.	.	S	Bend	trans	-104.5	162.5	-171.5	-147.3	-11.8	0	0	0	113.8	R29 K30	D25-R29 HydrophobicContact CB-CB 4.48Å; D25-R29 VanDerWaalsContact CG-CD 3.48Å; D25-R29 WeakPolarHBondContact OD1-CD 3.24Å; D25-R29 IonicContact OD1-NH1 2.84Å; D25-R29 PolarHBondContact OD1-NH1 2.94Å; D25-R29 WeakPolarHBondContact OD2-CB 3.26Å; D25-R29 WeakPolarHBondContact OD2-CD 3.41Å; D25-R29 IonicContact OD2-NH1 3.26Å; D25-K30 HydrophobicContact CB-CG 4.5Å; D25-K30 WeakPolarHBondContact O-CE 3.45Å
26	S	63.3	Low	69	Low	47 Å²	47	100.1 Å²	100.1	33%	0.329	47%	0.473	S	S	.	.			trans	-61.9	143.1	176.9	62.5	0	0	0	0	112	W28 R29 K30	S26-W28 PolarHBondContact O-N 3.45Å; S26-W28 VanDerWaalsContact OG-CD1 3.25Å; S26-W28 PolarHBondContact OG-NE1 3.35Å; S26-R29 PolarHBondContact O-N 3.34Å; S26-K30 PolarHBondContact O-N 3.47Å
27	N	76.8	Confident	69.7	Low	135 Å²	135	96.6 Å²	96.6	72%	0.722	45%	0.454	S	S	*	.	H	α-helix	trans	-54.7	-30.5	-169.4	-150.5	21.3	0	0	0	114.1	Q31	N27-Q31 PolarHBondContact O-N 2.84Å; N27-Q31 VanDerWaalsContact O-N 3.17Å
28	W	74.5	Confident	70.5	Confident	165 Å²	165	94.5 Å²	94.5	63%	0.625	45%	0.445	S	S	*	.	H	α-helix	trans	-72.1	-37.2	177.1	72.1	-93.6	0	0	0	113.2	S26 Q31 M32	S26-W28 PolarHBondContact O-N 3.45Å; S26-W28 VanDerWaalsContact OG-CD1 3.25Å; S26-W28 PolarHBondContact OG-NE1 3.35Å; W28-Q31 PolarHBondContact O-N 3.43Å; W28-M32 HydrophobicContact CZ3-SD 4.48Å; W28-M32 PolarHBondContact O-N 3.48Å
29	R	71.8	Confident	71.6	Confident	122 Å²	122	94.5 Å²	94.5	46%	0.46	45%	0.451	S	S	.	.	H	α-helix	trans	-67.6	-41.6	174.9	-75	178.9	178.2	176.7	-2.9	111.2	D25 S26 Q31 M32 I33	D25-R29 HydrophobicContact CB-CB 4.48Å; D25-R29 VanDerWaalsContact CG-CD 3.48Å; D25-R29 WeakPolarHBondContact OD1-CD 3.24Å; D25-R29 IonicContact OD1-NH1 2.84Å; D25-R29 PolarHBondContact OD1-NH1 2.94Å; D25-R29 WeakPolarHBondContact OD2-CB 3.26Å; D25-R29 WeakPolarHBondContact OD2-CD 3.41Å; D25-R29 IonicContact OD2-NH1 3.26Å; S26-R29 PolarHBondContact O-N 3.34Å; R29-Q31 VanDerWaalsContact C-N 3.27Å; R29-Q31 PolarHBondContact O-N 2.87Å; R29-M32 PolarHBondContact O-N 3.21Å; R29-I33 WeakPolarHBondContact O-CG1 3.26Å; R29-I33 PolarHBondContact O-N 3.1Å
30	K	69	Low	72.3	Confident	42 Å²	42	92 Å²	92	18%	0.183	45%	0.448	C	S	.	.	H	α-helix	trans	-52.3	-49.1	171.6	-60	-173.7	-169.6	-142.3	0	110.6	I22 E23 D25 S26 M32 I33 I34	I22-K30 HydrophobicContact CB-CG 4.46Å; I22-K30 HydrophobicContact CG2-CB 3.94Å; I22-K30 HydrophobicContact CG2-CD 3.59Å; I22-K30 HydrophobicContact CG2-CG 3.69Å; I22-K30 WeakPolarHBondContact O-CD 3.37Å; I22-K30 WeakPolarHBondContact O-CE 3.24Å; I22-K30 WeakPolarHBondContact O-CG 3.21Å; I22-K30 PolarHBondContact O-NZ 2.87Å; E23-K30 PolarHBondContact O-NZ 3.44Å; D25-K30 HydrophobicContact CB-CG 4.5Å; D25-K30 WeakPolarHBondContact O-CE 3.45Å; S26-K30 PolarHBondContact O-N 3.47Å; K30-M32 PolarHBondContact O-N 3.18Å; K30-I33 PolarHBondContact O-N 3.3Å; K30-I34 WeakPolarHBondContact O-CB 3.24Å; K30-I34 WeakPolarHBondContact O-CD1 3.37Å; K30-I34 VanDerWaalsContact O-CG1 3.23Å; K30-I34 WeakPolarHBondContact O-CG1 3.41Å; K30-I34 PolarHBondContact O-N 3.3Å
31	Q	77.1	Confident	73.2	Confident	93 Å²	93	88.7 Å²	88.7	44%	0.435	43%	0.433	S	S	.	.	H	α-helix	trans	-66.4	-38.3	-179.5	-166.7	62.3	35.6	0	0	113	N27 W28 R29 I34 N35	N27-Q31 PolarHBondContact O-N 2.84Å; N27-Q31 VanDerWaalsContact O-N 3.17Å; W28-Q31 PolarHBondContact O-N 3.43Å; R29-Q31 VanDerWaalsContact C-N 3.27Å; R29-Q31 PolarHBondContact O-N 2.87Å; Q31-I34 PolarHBondContact O-N 2.97Å; Q31-N35 PolarHBondContact NE2-OD1 3.07Å; Q31-N35 WeakPolarHBondContact O-CB 3.42Å; Q31-N35 PolarHBondContact O-N 3.06Å; Q31-N35 PolarHBondContact O-ND2 2.98Å
32	M	80.1	Confident	74.3	Confident	99 Å²	99	89.9 Å²	89.9	49%	0.488	43%	0.434	S	S	.	.	H	α-helix	trans	-60.8	-50.2	175.3	-178.1	179.6	161.1	0	0	111.2	W28 R29 K30 I34 N35 E36	W28-M32 HydrophobicContact CZ3-SD 4.48Å; W28-M32 PolarHBondContact O-N 3.48Å; R29-M32 PolarHBondContact O-N 3.21Å; K30-M32 PolarHBondContact O-N 3.18Å; M32-I34 PolarHBondContact O-N 3.29Å; M32-N35 WeakPolarHBondContact O-CB 3.48Å; M32-N35 PolarHBondContact O-N 3.15Å; M32-N35 VanDerWaalsContact O-N 3.13Å; M32-E36 VanDerWaalsContact CE-OE1 3.3Å; M32-E36 WeakPolarHBondContact CE-OE1 3.23Å; M32-E36 PolarHBondContact O-N 3.32Å
33	I	78.1	Confident	75.6	Confident	44 Å²	44	91.5 Å²	91.5	23%	0.226	45%	0.447	C	S	.	.	H	α-helix	trans	-60.8	-44.8	177.9	-66.2	170.2	0	0	0	110.7	V18 F21 I22 R29 K30 N35 E36 I37	V18-I33 HydrophobicContact CG1-CG2 4.48Å; F21-I33 HydrophobicContact CD1-CD1 4.41Å; F21-I33 HydrophobicContact CE1-CD1 4.46Å; I22-I33 HydrophobicContact CD1-CG2 4.41Å; R29-I33 WeakPolarHBondContact O-CG1 3.26Å; R29-I33 PolarHBondContact O-N 3.1Å; K30-I33 PolarHBondContact O-N 3.3Å; I33-N35 VanDerWaalsContact C-N 3.28Å; I33-N35 PolarHBondContact O-N 3.4Å; I33-E36 PolarHBondContact O-N 3.16Å; I33-I37 HydrophobicContact CG2-CD1 3.68Å; I33-I37 HydrophobicContact CG2-CG1 4.39Å; I33-I37 VanDerWaalsContact O-CG1 3.29Å; I33-I37 WeakPolarHBondContact O-CG1 3.45Å; I33-I37 PolarHBondContact O-N 2.86Å
34	I	80	Confident	76.7	Confident	52 Å²	52	88.2 Å²	88.2	27%	0.267	43%	0.434	S	S	.	.	H	α-helix	trans	-58.3	-41.8	175.9	-71.8	166.4	0	0	0	111.2	I22 K30 Q31 M32 I37 K38	I22-I34 HydrophobicContact CD1-CD1 4.18Å; I22-I34 HydrophobicContact CD1-CG1 3.78Å; K30-I34 WeakPolarHBondContact O-CB 3.24Å; K30-I34 WeakPolarHBondContact O-CD1 3.37Å; K30-I34 VanDerWaalsContact O-CG1 3.23Å; K30-I34 WeakPolarHBondContact O-CG1 3.41Å; K30-I34 PolarHBondContact O-N 3.3Å; Q31-I34 PolarHBondContact O-N 2.97Å; M32-I34 PolarHBondContact O-N 3.29Å; I34-I37 PolarHBondContact O-N 2.84Å; I34-K38 HydrophobicContact CG2-CD 4.12Å; I34-K38 WeakPolarHBondContact O-CB 3.07Å; I34-K38 VanDerWaalsContact O-CG 3.31Å; I34-K38 WeakPolarHBondContact O-CG 3.24Å; I34-K38 PolarHBondContact O-N 3.34Å
35	N	83.6	Confident	77.7	Confident	85 Å²	85	85.5 Å²	85.5	46%	0.455	42%	0.416	S	S	.	.	H	α-helix	trans	-67.1	-40.5	178.9	-73.2	-19.4	0	0	0	112	Q31 M32 I33 K38 G39	Q31-N35 PolarHBondContact NE2-OD1 3.07Å; Q31-N35 WeakPolarHBondContact O-CB 3.42Å; Q31-N35 PolarHBondContact O-N 3.06Å; Q31-N35 PolarHBondContact O-ND2 2.98Å; M32-N35 WeakPolarHBondContact O-CB 3.48Å; M32-N35 PolarHBondContact O-N 3.15Å; M32-N35 VanDerWaalsContact O-N 3.13Å; I33-N35 VanDerWaalsContact C-N 3.28Å; I33-N35 PolarHBondContact O-N 3.4Å; N35-K38 PolarHBondContact O-N 3.02Å; N35-G39 PolarHBondContact O-N 3.49Å
36	E	83.6	Confident	78.8	Confident	106 Å²	106	90.4 Å²	90.4	50%	0.495	44%	0.435	S	S	.	.	H	α-helix	trans	-62.3	-45.8	174.2	-74.8	-177.5	174.8	0	0	111.6	M32 I33 K38 G39 L40	M32-E36 VanDerWaalsContact CE-OE1 3.3Å; M32-E36 WeakPolarHBondContact CE-OE1 3.23Å; M32-E36 PolarHBondContact O-N 3.32Å; I33-E36 PolarHBondContact O-N 3.16Å; E36-K38 PolarHBondContact O-N 3.4Å; E36-G39 CarbonylContact O-C 3.54Å; E36-G39 WeakPolarHBondContact O-CA 3.35Å; E36-G39 PolarHBondContact O-N 3.05Å; E36-L40 WeakPolarHBondContact O-CG 3.43Å; E36-L40 PolarHBondContact O-N 2.91Å
37	I	79.8	Confident	79.4	Confident	33 Å²	33	92.3 Å²	92.3	17%	0.169	44%	0.441	C	S	.	.	H	α-helix	trans	-61.7	-43.9	177.3	-68.5	165.3	0	0	0	111	V18 I33 I34 G39 L40 Q41	V18-I37 HydrophobicContact CB-CD1 3.86Å; V18-I37 HydrophobicContact CG1-CD1 3.24Å; V18-I37 HydrophobicContact CG2-CD1 3.33Å; V18-I37 HydrophobicContact CG2-CG1 4.41Å; I33-I37 HydrophobicContact CG2-CD1 3.68Å; I33-I37 HydrophobicContact CG2-CG1 4.39Å; I33-I37 VanDerWaalsContact O-CG1 3.29Å; I33-I37 WeakPolarHBondContact O-CG1 3.45Å; I33-I37 PolarHBondContact O-N 2.86Å; I34-I37 PolarHBondContact O-N 2.84Å; I37-G39 PolarHBondContact O-N 3.22Å; I37-L40 PolarHBondContact O-N 2.94Å; I37-Q41 WeakPolarHBondContact O-CB 3.12Å; I37-Q41 PolarHBondContact O-N 2.86Å
38	K	81.9	Confident	79.4	Confident	106 Å²	106	88.6 Å²	88.6	46%	0.461	42%	0.42	S	S	.	.	H	α-helix	trans	-62.5	-33.1	173.5	-74.7	176.9	-179.7	178.6	0	112	I34 N35 E36 R42	I34-K38 HydrophobicContact CG2-CD 4.12Å; I34-K38 WeakPolarHBondContact O-CB 3.07Å; I34-K38 VanDerWaalsContact O-CG 3.31Å; I34-K38 WeakPolarHBondContact O-CG 3.24Å; I34-K38 PolarHBondContact O-N 3.34Å; N35-K38 PolarHBondContact O-N 3.02Å; E36-K38 PolarHBondContact O-N 3.4Å; K38-R42 WeakPolarHBondContact O-CB 3.45Å; K38-R42 WeakPolarHBondContact O-CG 3.38Å; K38-R42 PolarHBondContact O-N 3.37Å; K38-R42 PolarHBondContact O-NE 2.97Å; K38-R42 VanDerWaalsContact O-NE 3.16Å
39	G	86.5	Confident	79.6	Confident	31 Å²	31	85.8 Å²	85.8	32%	0.32	41%	0.414	S	S	.	.	H	α-helix	trans	-64.7	-50.6	172.7	0	0	0	0	0	111.9	N35 E36 I37 Q41 R42 S43	N35-G39 PolarHBondContact O-N 3.49Å; E36-G39 CarbonylContact O-C 3.54Å; E36-G39 WeakPolarHBondContact O-CA 3.35Å; E36-G39 PolarHBondContact O-N 3.05Å; I37-G39 PolarHBondContact O-N 3.22Å; G39-Q41 PolarHBondContact O-N 2.88Å; G39-R42 PolarHBondContact O-N 2.71Å; G39-S43 PolarHBondContact O-N 3.29Å
40	L	79.4	Confident	79.9	Confident	118 Å²	118	84.3 Å²	84.3	62%	0.618	42%	0.415	S	S	*	.	H	α-helix	trans	-61.1	-43.2	177.5	-71.1	170.7	0	0	0	111.9	E36 I37 R42 S43 L44	E36-L40 WeakPolarHBondContact O-CG 3.43Å; E36-L40 PolarHBondContact O-N 2.91Å; I37-L40 PolarHBondContact O-N 2.94Å; L40-R42 PolarHBondContact O-N 2.94Å; L40-S43 WeakPolarHBondContact O-CB 3.39Å; L40-S43 PolarHBondContact O-N 3.34Å; L40-L44 WeakPolarHBondContact O-CB 3.46Å; L40-L44 PolarHBondContact O-N 3.06Å
41	Q	78.3	Confident	80	Confident	74 Å²	74	87.7 Å²	87.7	35%	0.346	43%	0.434	S	S	.	.	H	α-helix	trans	-60.8	-44.7	177	-177	177.1	-0.4	0	0	111.7	F11 I37 G39 L44 Q45	F11-Q41 HydrophobicContact CE2-CB 4.23Å; F11-Q41 HydrophobicContact CE2-CG 3.86Å; F11-Q41 HydrophobicContact CZ-CB 4.12Å; F11-Q41 HydrophobicContact CZ-CG 3.52Å; I37-Q41 WeakPolarHBondContact O-CB 3.12Å; I37-Q41 PolarHBondContact O-N 2.86Å; G39-Q41 PolarHBondContact O-N 2.88Å; Q41-L44 PolarHBondContact O-N 3.42Å; Q41-Q45 WeakPolarHBondContact O-CB 3.48Å; Q41-Q45 PolarHBondContact O-N 3.14Å
42	R	83.9	Confident	79.7	Confident	160 Å²	160	89.3 Å²	89.3	60%	0.604	44%	0.436	S	S	*	.	H	α-helix	trans	-64.4	-40	176	-76.2	-177	-77.4	-175.3	-2.3	112	K38 G39 L40 Q45 K46	K38-R42 WeakPolarHBondContact O-CB 3.45Å; K38-R42 WeakPolarHBondContact O-CG 3.38Å; K38-R42 PolarHBondContact O-N 3.37Å; K38-R42 PolarHBondContact O-NE 2.97Å; K38-R42 VanDerWaalsContact O-NE 3.16Å; G39-R42 PolarHBondContact O-N 2.71Å; L40-R42 PolarHBondContact O-N 2.94Å; R42-Q45 PolarHBondContact O-N 3.5Å; R42-K46 WeakPolarHBondContact O-CG 3.08Å; R42-K46 PolarHBondContact O-N 3.32Å; R42-K46 VanDerWaalsContact O-N 3.1Å
43	S	81.7	Confident	79.5	Confident	59 Å²	59	87 Å²	87	41%	0.413	43%	0.43	S	S	.	.	H	α-helix	trans	-63.4	-45.6	175.7	-171.5	0	0	0	0	111.7	G39 L40 Q45 K46 N47	G39-S43 PolarHBondContact O-N 3.29Å; L40-S43 WeakPolarHBondContact O-CB 3.39Å; L40-S43 PolarHBondContact O-N 3.34Å; S43-Q45 PolarHBondContact O-N 3.38Å; S43-K46 PolarHBondContact O-N 3.21Å; S43-N47 PolarHBondContact O-N 2.92Å
44	L	81.2	Confident	79	Confident	72 Å²	72	90.8 Å²	90.8	38%	0.377	44%	0.442	S	S	.	.	H	α-helix	trans	-61	-44	177.3	-177.1	63.9	0	0	0	111.6	F11 L40 Q41 N47 M48	F11-L44 HydrophobicContact CD2-CD2 4.39Å; L40-L44 WeakPolarHBondContact O-CB 3.46Å; L40-L44 PolarHBondContact O-N 3.06Å; Q41-L44 PolarHBondContact O-N 3.42Å; L44-N47 PolarHBondContact O-N 3.44Å; L44-M48 WeakPolarHBondContact O-CG 3.28Å; L44-M48 PolarHBondContact O-N 3.42Å
45	Q	81.3	Confident	78.5	Confident	108 Å²	108	92.1 Å²	92.1	51%	0.505	45%	0.45	S	S	.	.	H	α-helix	trans	-62	-44.6	178.2	-171.2	171.8	-9.3	0	0	111.8	Q41 R42 S43 N47 M48 E49	Q41-Q45 WeakPolarHBondContact O-CB 3.48Å; Q41-Q45 PolarHBondContact O-N 3.14Å; R42-Q45 PolarHBondContact O-N 3.5Å; S43-Q45 PolarHBondContact O-N 3.38Å; Q45-N47 PolarHBondContact O-N 3.01Å; Q45-M48 WeakPolarHBondContact O-CB 3.31Å; Q45-M48 PolarHBondContact O-N 3.44Å; Q45-E49 PolarHBondContact O-N 2.99Å
46	K	83.7	Confident	78	Confident	148 Å²	148	96.4 Å²	96.4	64%	0.643	46%	0.46	S	S	*	.	H	α-helix	trans	-59.9	-44.5	173.9	-75.7	-179.9	176.9	-174.7	0	112.2	R42 S43 M48 E49 L50	R42-K46 WeakPolarHBondContact O-CG 3.08Å; R42-K46 PolarHBondContact O-N 3.32Å; R42-K46 VanDerWaalsContact O-N 3.1Å; S43-K46 PolarHBondContact O-N 3.21Å; K46-M48 VanDerWaalsContact C-N 3.32Å; K46-M48 PolarHBondContact O-N 3.49Å; K46-E49 PolarHBondContact O-N 3.41Å; K46-L50 PolarHBondContact O-N 3.09Å
47	N	75.2	Confident	77.3	Confident	86 Å²	86	98.7 Å²	98.7	46%	0.46	46%	0.463	S	S	.	.	H	α-helix	trans	-64.9	-36.6	178.3	-72.9	-17.3	0	0	0	112	S43 L44 Q45 L50 I51	S43-N47 PolarHBondContact O-N 2.92Å; L44-N47 PolarHBondContact O-N 3.44Å; Q45-N47 PolarHBondContact O-N 3.01Å; N47-L50 WeakPolarHBondContact O-CB 3.26Å; N47-L50 PolarHBondContact O-N 3.2Å; N47-I51 VanDerWaalsContact O-CG1 3.31Å; N47-I51 WeakPolarHBondContact O-CG1 3.45Å; N47-I51 PolarHBondContact O-N 3.47Å
48	M	75.9	Confident	76.8	Confident	57 Å²	57	101.7 Å²	101.7	28%	0.281	48%	0.479	S	S	.	.	H	α-helix	trans	-64	-40.9	174.1	-77.4	180	55.1	0	0	112.5	L7 L44 Q45 K46 L50 I51 R52	L7-M48 HydrophobicContact CD2-SD 3.96Å; L44-M48 WeakPolarHBondContact O-CG 3.28Å; L44-M48 PolarHBondContact O-N 3.42Å; Q45-M48 WeakPolarHBondContact O-CB 3.31Å; Q45-M48 PolarHBondContact O-N 3.44Å; K46-M48 VanDerWaalsContact C-N 3.32Å; K46-M48 PolarHBondContact O-N 3.49Å; M48-L50 VanDerWaalsContact C-N 3.33Å; M48-I51 PolarHBondContact O-N 3.35Å; M48-R52 WeakPolarHBondContact O-CG 3.46Å; M48-R52 PolarHBondContact O-N 2.98Å
49	E	79.5	Confident	76.4	Confident	106 Å²	106	101.5 Å²	101.5	50%	0.495	48%	0.478	S	S	.	.	H	α-helix	trans	-62.9	-41.7	174.3	-72.3	170	-175.9	0	0	111.3	Q45 K46 R52 S53	Q45-E49 PolarHBondContact O-N 2.99Å; K46-E49 PolarHBondContact O-N 3.41Å; E49-R52 PolarHBondContact O-N 2.93Å; E49-S53 PolarHBondContact O-N 3.32Å
50	L	77.3	Confident	75.6	Confident	91 Å²	91	103.6 Å²	103.6	48%	0.476	48%	0.481	S	S	.	.	H	α-helix	trans	-60.5	-46.4	174.9	-155.5	89.1	0	0	0	111.8	K46 N47 M48 R52 S53 Y54	K46-L50 PolarHBondContact O-N 3.09Å; N47-L50 WeakPolarHBondContact O-CB 3.26Å; N47-L50 PolarHBondContact O-N 3.2Å; M48-L50 VanDerWaalsContact C-N 3.33Å; L50-R52 VanDerWaalsContact C-N 3.34Å; L50-R52 PolarHBondContact O-N 3.12Å; L50-S53 WeakPolarHBondContact O-CB 3.33Å; L50-S53 PolarHBondContact O-N 3.42Å; L50-S53 VanDerWaalsContact O-N 3.14Å; L50-Y54 HydrophobicContact CD2-CD2 4.43Å; L50-Y54 HydrophobicContact CD2-CE2 3.59Å; L50-Y54 HydrophobicContact CG-CD2 4.32Å; L50-Y54 HydrophobicContact CG-CE2 3.77Å; L50-Y54 VanDerWaalsContact O-CD2 3.31Å; L50-Y54 WeakPolarHBondContact O-CD2 3.47Å; L50-Y54 PolarHBondContact O-N 3.46Å
51	I	71	Confident	75.2	Confident	113 Å²	113	103.6 Å²	103.6	58%	0.579	48%	0.482	S	S	*	.	H	α-helix	trans	-61.1	-43	176.9	-70.4	166	0	0	0	111	N47 M48 S53 Y54 D55	N47-I51 VanDerWaalsContact O-CG1 3.31Å; N47-I51 WeakPolarHBondContact O-CG1 3.45Å; N47-I51 PolarHBondContact O-N 3.47Å; M48-I51 PolarHBondContact O-N 3.35Å; I51-S53 VanDerWaalsContact C-N 3.29Å; I51-S53 PolarHBondContact O-N 3.18Å; I51-Y54 PolarHBondContact O-N 3.33Å; I51-D55 PolarHBondContact O-N 3Å
52	R	72.2	Confident	74.9	Confident	128 Å²	128	104.8 Å²	104.8	48%	0.483	49%	0.489	S	S	.	.	H	α-helix	trans	-63.2	-35.5	175.7	-73.2	176.5	-174.2	167.5	1.9	112.2	M48 E49 L50 R56	M48-R52 WeakPolarHBondContact O-CG 3.46Å; M48-R52 PolarHBondContact O-N 2.98Å; E49-R52 PolarHBondContact O-N 2.93Å; L50-R52 VanDerWaalsContact C-N 3.34Å; L50-R52 PolarHBondContact O-N 3.12Å; R52-R56 WeakPolarHBondContact O-CG 3.29Å; R52-R56 PolarHBondContact O-N 3.32Å
53	S	75.2	Confident	74.3	Confident	51 Å²	51	98 Å²	98	36%	0.357	47%	0.465	S	S	.	.	H	α-helix	trans	-64.1	-45.1	174.1	-177.1	0	0	0	0	111.2	E49 L50 I51 R56 R57	E49-S53 PolarHBondContact O-N 3.32Å; L50-S53 WeakPolarHBondContact O-CB 3.33Å; L50-S53 PolarHBondContact O-N 3.42Å; L50-S53 VanDerWaalsContact O-N 3.14Å; I51-S53 VanDerWaalsContact C-N 3.29Å; I51-S53 PolarHBondContact O-N 3.18Å; S53-R56 PolarHBondContact O-N 2.89Å; S53-R57 WeakPolarHBondContact O-CG 3.48Å; S53-R57 PolarHBondContact O-N 2.93Å
54	Y	67.4	Low	73.8	Confident	123 Å²	123	97.5 Å²	97.5	48%	0.482	46%	0.459	S	S	.	.	H	α-helix	trans	-64.3	-40.7	175.4	-70.2	-51.9	0	0	0	113.2	L50 I51 R56 R57 I58	L50-Y54 HydrophobicContact CD2-CD2 4.43Å; L50-Y54 HydrophobicContact CD2-CE2 3.59Å; L50-Y54 HydrophobicContact CG-CD2 4.32Å; L50-Y54 HydrophobicContact CG-CE2 3.77Å; L50-Y54 VanDerWaalsContact O-CD2 3.31Å; L50-Y54 WeakPolarHBondContact O-CD2 3.47Å; L50-Y54 PolarHBondContact O-N 3.46Å; I51-Y54 PolarHBondContact O-N 3.33Å; Y54-R56 VanDerWaalsContact C-N 3.3Å; Y54-R56 PolarHBondContact O-N 2.88Å; Y54-R57 PolarHBondContact O-N 2.88Å; Y54-I58 WeakPolarHBondContact O-CG1 3.34Å; Y54-I58 PolarHBondContact O-N 3.19Å
55	D	70.4	Confident	73.6	Confident	79 Å²	79	99 Å²	99	42%	0.422	47%	0.465	S	S	.	.	H	α-helix	trans	-58	-42.9	175.5	-177.3	70.5	0	0	0	111.7	I51 I58 K59	I51-D55 PolarHBondContact O-N 3Å; D55-I58 PolarHBondContact O-N 3.17Å; D55-K59 WeakPolarHBondContact O-CG 3.48Å; D55-K59 PolarHBondContact O-N 3.44Å; D55-K59 VanDerWaalsContact O-N 3.09Å; D55-K59 WeakPolarHBondContact OD2-CE 3.39Å; D55-K59 IonicContact OD2-NZ 3.47Å; D55-K59 PolarHBondContact OD2-NZ 3.47Å
56	R	72.4	Confident	73.4	Confident	176 Å²	176	94.1 Å²	94.1	66%	0.664	44%	0.442	S	S	*	.	H	α-helix	trans	-64.3	-43.1	175	-70.6	-174.5	-132.4	-173.4	1.9	112.4	R52 S53 Y54 I58 K59 L60	R52-R56 WeakPolarHBondContact O-CG 3.29Å; R52-R56 PolarHBondContact O-N 3.32Å; S53-R56 PolarHBondContact O-N 2.89Å; Y54-R56 VanDerWaalsContact C-N 3.3Å; Y54-R56 PolarHBondContact O-N 2.88Å; R56-I58 VanDerWaalsContact C-N 3.35Å; R56-K59 PolarHBondContact O-N 3.17Å; R56-L60 PolarHBondContact O-N 2.76Å
57	R	70	Confident	73	Confident	153 Å²	153	88.1 Å²	88.1	58%	0.577	42%	0.417	S	S	*	.	H	α-helix	trans	-63.3	-39.6	177.5	-73.7	179.3	175.6	-169.5	-1.9	112.2	S53 Y54 L60 L61	S53-R57 WeakPolarHBondContact O-CG 3.48Å; S53-R57 PolarHBondContact O-N 2.93Å; Y54-R57 PolarHBondContact O-N 2.88Å; R57-L60 PolarHBondContact O-N 3Å; R57-L61 WeakPolarHBondContact O-CG 3.38Å; R57-L61 PolarHBondContact O-N 2.92Å
58	I	69.4	Low	73.1	Confident	96 Å²	96	87 Å²	87	49%	0.492	41%	0.413	S	S	.	.	H	α-helix	trans	-64.4	-43.6	176.8	-70.5	167.5	0	0	0	110.6	Y54 D55 R56 L61 I62	Y54-I58 WeakPolarHBondContact O-CG1 3.34Å; Y54-I58 PolarHBondContact O-N 3.19Å; D55-I58 PolarHBondContact O-N 3.17Å; R56-I58 VanDerWaalsContact C-N 3.35Å; I58-L61 PolarHBondContact O-N 3Å; I58-I62 HydrophobicContact CG2-CD1 3.94Å; I58-I62 WeakPolarHBondContact O-CG1 3.35Å; I58-I62 PolarHBondContact O-N 3.46Å
59	K	71.5	Confident	73.4	Confident	102 Å²	102	86.4 Å²	86.4	44%	0.443	41%	0.411	S	S	.	.	H	α-helix	trans	-58.9	-48.6	175	-74.2	169.7	177.6	158.8	0	111.7	D55 R56 L61 I62 D63	D55-K59 WeakPolarHBondContact O-CG 3.48Å; D55-K59 PolarHBondContact O-N 3.44Å; D55-K59 VanDerWaalsContact O-N 3.09Å; D55-K59 WeakPolarHBondContact OD2-CE 3.39Å; D55-K59 IonicContact OD2-NZ 3.47Å; D55-K59 PolarHBondContact OD2-NZ 3.47Å; R56-K59 PolarHBondContact O-N 3.17Å; K59-L61 VanDerWaalsContact C-N 3.28Å; K59-L61 PolarHBondContact O-N 2.9Å; K59-I62 PolarHBondContact O-N 3.05Å; K59-I62 VanDerWaalsContact O-N 3.11Å; K59-D63 WeakPolarHBondContact O-CB 3.48Å; K59-D63 VanDerWaalsContact O-CG 3.25Å; K59-D63 PolarHBondContact O-N 2.98Å
60	L	70	Confident	73.5	Confident	75 Å²	75	82.3 Å²	82.3	39%	0.393	39%	0.392	S	S	.	.	H	α-helix	trans	-54.6	-44.3	175.6	-172.8	82.6	0	0	0	111.9	R56 R57 D63 V64 Y133	R56-L60 PolarHBondContact O-N 2.76Å; R57-L60 PolarHBondContact O-N 3Å; L60-D63 PolarHBondContact O-N 3.29Å; L60-V64 HydrophobicContact CG-CG2 4.44Å; L60-V64 WeakPolarHBondContact O-CB 3.25Å; L60-V64 VanDerWaalsContact O-CG2 3.29Å; L60-V64 WeakPolarHBondContact O-CG2 3.2Å; L60-V64 PolarHBondContact O-N 3.45Å; L60-Y133 HydrophobicContact CB-CE1 4.29Å; L60-Y133 HydrophobicContact CD1-CD1 3.42Å; L60-Y133 VanDerWaalsContact CD1-CD1 3.42Å; L60-Y133 HydrophobicContact CD1-CE1 3.43Å; L60-Y133 VanDerWaalsContact CD1-CE1 3.43Å; L60-Y133 HydrophobicContact CD1-CG 4.11Å; L60-Y133 HydrophobicContact CG-CE1 4.49Å
61	L	70.8	Confident	73.5	Confident	119 Å²	119	78.8 Å²	78.8	62%	0.623	37%	0.374	S	S	*	.	H	α-helix	trans	-64.1	-41.6	178.4	-74.5	170.4	0	0	0	112.8	R57 I58 K59 D63 Q65	R57-L61 WeakPolarHBondContact O-CG 3.38Å; R57-L61 PolarHBondContact O-N 2.92Å; I58-L61 PolarHBondContact O-N 3Å; K59-L61 VanDerWaalsContact C-N 3.28Å; K59-L61 PolarHBondContact O-N 2.9Å; L61-D63 VanDerWaalsContact C-N 3.29Å; L61-D63 PolarHBondContact O-N 3.18Å; L61-Q65 WeakPolarHBondContact O-CB 3.43Å; L61-Q65 PolarHBondContact O-N 2.88Å
62	I	73	Confident	74.2	Confident	98 Å²	98	79 Å²	79	50%	0.503	37%	0.368	S	S	.	.	H	α-helix	trans	-61.9	-43.2	176.2	-68.8	166.3	0	0	0	110.1	I58 K59 Q65 C66	I58-I62 HydrophobicContact CG2-CD1 3.94Å; I58-I62 WeakPolarHBondContact O-CG1 3.35Å; I58-I62 PolarHBondContact O-N 3.46Å; K59-I62 PolarHBondContact O-N 3.05Å; K59-I62 VanDerWaalsContact O-N 3.11Å; I62-Q65 PolarHBondContact O-N 3.21Å; I62-C66 PolarHBondContact O-N 2.91Å
63	D	71.9	Confident	74.9	Confident	17 Å²	17	73.4 Å²	73.4	9%	0.091	35%	0.348	C	S	.	.	H	α-helix	trans	-69.4	-45	-177.9	-67.8	-23.2	0	0	0	111.1	K59 L60 L61 Q65 C66 L67 L130 Y133	K59-D63 WeakPolarHBondContact O-CB 3.48Å; K59-D63 VanDerWaalsContact O-CG 3.25Å; K59-D63 PolarHBondContact O-N 2.98Å; L60-D63 PolarHBondContact O-N 3.29Å; L61-D63 VanDerWaalsContact C-N 3.29Å; L61-D63 PolarHBondContact O-N 3.18Å; D63-Q65 VanDerWaalsContact C-N 3.29Å; D63-Q65 PolarHBondContact O-N 3.07Å; D63-C66 WeakPolarHBondContact O-CA 3.26Å; D63-C66 VanDerWaalsContact O-CB 3.29Å; D63-C66 WeakPolarHBondContact O-CB 3.29Å; D63-C66 PolarHBondContact O-N 2.84Å; D63-L67 PolarHBondContact O-N 3.17Å; D63-L130 HydrophobicContact CB-CD2 3.51Å; D63-L130 HydrophobicContact CB-CG 3.8Å; D63-L130 WeakPolarHBondContact O-CD1 3.36Å; D63-Y133 HydrophobicContact CB-CE2 4.49Å; D63-Y133 WeakPolarHBondContact OD2-CE2 3.44Å; D63-Y133 PolarHBondContact OD2-OH 3.08Å
64	V	71.5	Confident	75.4	Confident	49 Å²	49	74.3 Å²	74.3	30%	0.297	35%	0.346	S	S	.	.	H	α-helix	trans	-58.3	-40.9	172.4	169.8	0	0	0	0	111.4	L60 C66 L67 V68 L141	L60-V64 HydrophobicContact CG-CG2 4.44Å; L60-V64 WeakPolarHBondContact O-CB 3.25Å; L60-V64 VanDerWaalsContact O-CG2 3.29Å; L60-V64 WeakPolarHBondContact O-CG2 3.2Å; L60-V64 PolarHBondContact O-N 3.45Å; V64-C66 VanDerWaalsContact C-N 3.31Å; V64-C66 PolarHBondContact O-N 3.27Å; V64-L67 PolarHBondContact O-N 2.99Å; V64-V68 HydrophobicContact CG1-CG2 4.39Å; V64-V68 WeakPolarHBondContact O-CG2 3.42Å; V64-V68 PolarHBondContact O-N 3.36Å; V64-L141 HydrophobicContact CG1-CD2 4.19Å
65	Q	76.7	Confident	76.4	Confident	105 Å²	105	69.4 Å²	69.4	49%	0.491	33%	0.327	S	S	.	.	H	α-helix	trans	-63.3	-37.3	175.9	-173.6	64.6	51.7	0	0	112	L61 I62 D63 N69	L61-Q65 WeakPolarHBondContact O-CB 3.43Å; L61-Q65 PolarHBondContact O-N 2.88Å; I62-Q65 PolarHBondContact O-N 3.21Å; D63-Q65 VanDerWaalsContact C-N 3.29Å; D63-Q65 PolarHBondContact O-N 3.07Å; Q65-N69 PolarHBondContact NE2-OD1 3.34Å; Q65-N69 VanDerWaalsContact NE2-OD1 3.14Å; Q65-N69 WeakPolarHBondContact O-CB 3.18Å; Q65-N69 VanDerWaalsContact O-CG 3.26Å; Q65-N69 PolarHBondContact O-N 3.26Å; Q65-N69 PolarHBondContact O-ND2 3.44Å
66	C	76.7	Confident	77.2	Confident	5 Å²	5	66.3 Å²	66.3	3%	0.034	31%	0.31	C	S	.	.	H	α-helix	trans	-59.8	-49.7	172.8	-176.6	0	0	0	0	110.7	I62 D63 V64 V68 N69 M70 I126 C127	I62-C66 PolarHBondContact O-N 2.91Å; D63-C66 WeakPolarHBondContact O-CA 3.26Å; D63-C66 VanDerWaalsContact O-CB 3.29Å; D63-C66 WeakPolarHBondContact O-CB 3.29Å; D63-C66 PolarHBondContact O-N 2.84Å; V64-C66 VanDerWaalsContact C-N 3.31Å; V64-C66 PolarHBondContact O-N 3.27Å; C66-V68 PolarHBondContact O-N 3.03Å; C66-N69 PolarHBondContact O-N 2.85Å; C66-M70 WeakPolarHBondContact O-CB 3.48Å; C66-M70 PolarHBondContact O-N 3.04Å; C66-I126 HydrophobicContact CB-CB 4.45Å; C66-I126 HydrophobicContact CB-CG2 3.77Å; C66-I126 VanDerWaalsContact SG-CB 3.54Å; C66-I126 VanDerWaalsContact SG-CG2 3.53Å; C66-C127 HydrophobicContact CB-CB 4.44Å; C66-C127 WeakPolarHBondContact CB-SG 3.39Å; C66-C127 PolarHBondContact O-SG 3.44Å; C66-C127 VanDerWaalsContact O-SG 3.4Å; C66-C127 WeakPolarHBondContact SG-CA 3.47Å; C66-C127 WeakPolarHBondContact SG-CB 3.36Å; C66-C127 PolarHBondContact SG-N 3.24Å; C66-C127 CovalentContact SG-SG 2.06Å; C66-C127 PolarHBondContact SG-SG 2.89Å
67	L	74.2	Confident	78.2	Confident	22 Å²	22	59.3 Å²	59.3	12%	0.115	29%	0.285	C	S	.	.	H	α-helix	trans	-60	-45.8	-178.9	-174.3	64.6	0	0	0	111.6	D63 V64 N69 M70 L71 L130 L141	D63-L67 PolarHBondContact O-N 3.17Å; V64-L67 PolarHBondContact O-N 2.99Å; L67-N69 VanDerWaalsContact C-N 3.33Å; L67-N69 PolarHBondContact O-N 3.45Å; L67-M70 HydrophobicContact CD1-CE 3.71Å; L67-M70 PolarHBondContact O-N 2.89Å; L67-L71 HydrophobicContact CD1-CD1 4.21Å; L67-L71 HydrophobicContact CD1-CG 4.33Å; L67-L71 HydrophobicContact CG-CD1 3.9Å; L67-L71 HydrophobicContact CG-CG 4.4Å; L67-L71 WeakPolarHBondContact O-CB 3.45Å; L67-L71 VanDerWaalsContact O-CG 3.29Å; L67-L71 WeakPolarHBondContact O-CG 3.46Å; L67-L71 PolarHBondContact O-N 3.02Å; L67-L130 HydrophobicContact CB-CD1 3.77Å; L67-L130 HydrophobicContact CD1-CD1 4.36Å; L67-L130 HydrophobicContact CG-CD1 4.49Å; L67-L141 HydrophobicContact CD2-CD2 3.81Å
68	V	77.6	Confident	79.2	Confident	61 Å²	61	55.4 Å²	55.4	37%	0.37	28%	0.276	S	S	.	.	H	α-helix	trans	-59.8	-43.7	177.4	169.7	0	0	0	0	111.1	V64 C66 L71 Y72	V64-V68 HydrophobicContact CG1-CG2 4.39Å; V64-V68 WeakPolarHBondContact O-CG2 3.42Å; V64-V68 PolarHBondContact O-N 3.36Å; C66-V68 PolarHBondContact O-N 3.03Å; V68-L71 PolarHBondContact O-N 2.9Å; V68-Y72 VanDerWaalsContact O-CB 3.27Å; V68-Y72 WeakPolarHBondContact O-CB 3.3Å; V68-Y72 PolarHBondContact O-N 2.94Å
69	N	81.7	Confident	80.2	Confident	46 Å²	46	51.4 Å²	51.4	25%	0.246	26%	0.255	C	S	.	.	H	α-helix	trans	-65.8	-40.8	178.1	-73	-13.6	0	0	0	112.1	Q65 C66 L67 Y72 N73 Y122	Q65-N69 PolarHBondContact NE2-OD1 3.34Å; Q65-N69 VanDerWaalsContact NE2-OD1 3.14Å; Q65-N69 WeakPolarHBondContact O-CB 3.18Å; Q65-N69 VanDerWaalsContact O-CG 3.26Å; Q65-N69 PolarHBondContact O-N 3.26Å; Q65-N69 PolarHBondContact O-ND2 3.44Å; C66-N69 PolarHBondContact O-N 2.85Å; L67-N69 VanDerWaalsContact C-N 3.33Å; L67-N69 PolarHBondContact O-N 3.45Å; N69-Y72 PolarHBondContact O-N 2.94Å; N69-N73 VanDerWaalsContact O-CG 3.22Å; N69-N73 PolarHBondContact O-N 2.95Å; N69-N73 PolarHBondContact O-ND2 3Å; N69-Y122 HydrophobicContact CB-CD1 4.43Å; N69-Y122 HydrophobicContact CB-CE1 4.16Å
70	M	81.8	Confident	81.3	Confident	20 Å²	20	47.8 Å²	47.8	10%	0.099	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-51.3	176.4	-176.7	-164.5	83.9	0	0	110.8	C66 L67 Y72 N73 E74 T119 N123 C127	C66-M70 WeakPolarHBondContact O-CB 3.48Å; C66-M70 PolarHBondContact O-N 3.04Å; L67-M70 HydrophobicContact CD1-CE 3.71Å; L67-M70 PolarHBondContact O-N 2.89Å; M70-Y72 VanDerWaalsContact C-N 3.33Å; M70-Y72 PolarHBondContact O-N 3.34Å; M70-N73 PolarHBondContact O-N 3.38Å; M70-N73 VanDerWaalsContact O-N 3.11Å; M70-E74 PolarHBondContact O-N 3.07Å; M70-T119 HydrophobicContact CG-CG2 4.33Å; M70-N123 PolarHBondContact SD-OD1 2.93Å; M70-C127 HydrophobicContact SD-CB 4.5Å
71	L	78.5	Confident	82.5	Confident	16 Å²	16	49.8 Å²	49.8	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-41.7	178.3	-69.7	174.8	0	0	0	111	L67 V68 N73 E74 Y75 T145 H149	L67-L71 HydrophobicContact CD1-CD1 4.21Å; L67-L71 HydrophobicContact CD1-CG 4.33Å; L67-L71 HydrophobicContact CG-CD1 3.9Å; L67-L71 HydrophobicContact CG-CG 4.4Å; L67-L71 WeakPolarHBondContact O-CB 3.45Å; L67-L71 VanDerWaalsContact O-CG 3.29Å; L67-L71 WeakPolarHBondContact O-CG 3.46Å; L67-L71 PolarHBondContact O-N 3.02Å; V68-L71 PolarHBondContact O-N 2.9Å; L71-N73 VanDerWaalsContact C-N 3.32Å; L71-N73 PolarHBondContact O-N 3.37Å; L71-E74 PolarHBondContact O-N 3.31Å; L71-Y75 WeakPolarHBondContact O-CB 3.5Å; L71-Y75 PolarHBondContact O-N 3.11Å; L71-T145 HydrophobicContact CB-CG2 3.88Å; L71-T145 HydrophobicContact CD1-CG2 3.58Å; L71-T145 HydrophobicContact CG-CG2 4.3Å; L71-H149 VanDerWaalsContact C-CE1 3.47Å; L71-H149 PolarHBondContact O-CE1 3.33Å
72	Y	84.4	Confident	83.6	Confident	117 Å²	117	47.5 Å²	47.5	46%	0.459	23%	0.229	S	C	.	.	H	α-helix	trans	-58.9	-42.1	174.1	172.2	-93.4	0	0	0	112.3	V68 N69 M70 Y75 N76 Y115	V68-Y72 VanDerWaalsContact O-CB 3.27Å; V68-Y72 WeakPolarHBondContact O-CB 3.3Å; V68-Y72 PolarHBondContact O-N 2.94Å; N69-Y72 PolarHBondContact O-N 2.94Å; M70-Y72 VanDerWaalsContact C-N 3.33Å; M70-Y72 PolarHBondContact O-N 3.34Å; Y72-Y75 PolarHBondContact O-N 2.99Å; Y72-N76 WeakPolarHBondContact CD2-ND2 3.27Å; Y72-N76 VanDerWaalsContact CE1-ND2 3.3Å; Y72-N76 WeakPolarHBondContact CE1-ND2 3.47Å; Y72-N76 WeakPolarHBondContact CE2-ND2 3.07Å; Y72-N76 PolarHBondContact O-N 3.45Å; Y72-N76 PolarHBondContact O-ND2 3.33Å; Y72-Y115 HydrophobicContact CE1-CE1 4.3Å
73	N	87.6	Confident	84.6	Confident	12 Å²	12	43.4 Å²	43.4	6%	0.064	21%	0.208	C	C	.	.	H	α-helix	trans	-68.5	-40.8	177.9	-68.7	-38.9	0	0	0	111.6	N69 M70 L71 N76 H77 Y115 L118 T119 Y122	N69-N73 VanDerWaalsContact O-CG 3.22Å; N69-N73 PolarHBondContact O-N 2.95Å; N69-N73 PolarHBondContact O-ND2 3Å; M70-N73 PolarHBondContact O-N 3.38Å; M70-N73 VanDerWaalsContact O-N 3.11Å; L71-N73 VanDerWaalsContact C-N 3.32Å; L71-N73 PolarHBondContact O-N 3.37Å; N73-N76 PolarHBondContact O-N 2.87Å; N73-H77 WeakPolarHBondContact O-CB 3.4Å; N73-H77 PolarHBondContact O-N 2.9Å; N73-Y115 HydrophobicContact CB-CD1 4.44Å; N73-L118 HydrophobicContact CB-CB 4.39Å; N73-T119 WeakPolarHBondContact CB-OG1 3.28Å; N73-Y122 WeakPolarHBondContact ND2-CD2 3.38Å
74	E	86.2	Confident	85.8	Confident	70 Å²	70	43.8 Å²	43.8	33%	0.327	21%	0.211	S	C	.	.	H	α-helix	trans	-59.6	-46.1	173.7	-74	-180	174.4	0	0	111.9	M70 L71 N76 H77 D78 T119	M70-E74 PolarHBondContact O-N 3.07Å; L71-E74 PolarHBondContact O-N 3.31Å; E74-N76 PolarHBondContact O-N 3.49Å; E74-H77 WeakPolarHBondContact O-CB 3.48Å; E74-H77 PolarHBondContact O-N 2.94Å; E74-D78 PolarHBondContact O-N 3.42Å; E74-T119 HydrophobicContact CG-CG2 3.47Å; E74-T119 VanDerWaalsContact CG-CG2 3.47Å; E74-T119 PolarHBondContact N-OG1 3.12Å
75	Y	87.5	Confident	86.9	Confident	20 Å²	20	44.4 Å²	44.4	8%	0.078	21%	0.213	C	C	.	.	H	α-helix	trans	-55	-51.9	174.9	166.2	-96.9	0	0	0	111.9	L71 Y72 H77 D78 L79 H149 I152 S153 N156	L71-Y75 WeakPolarHBondContact O-CB 3.5Å; L71-Y75 PolarHBondContact O-N 3.11Å; Y72-Y75 PolarHBondContact O-N 2.99Å; Y75-H77 VanDerWaalsContact C-N 3.31Å; Y75-H77 PolarHBondContact O-N 3.26Å; Y75-D78 PolarHBondContact O-N 3.19Å; Y75-L79 HydrophobicContact CE1-CD2 4.02Å; Y75-L79 WeakPolarHBondContact O-CB 3.27Å; Y75-L79 PolarHBondContact O-N 3.06Å; Y75-H149 HydrophobicContact CD2-CB 3.72Å; Y75-H149 AromaticContact CD2-CD2 3.69Å; Y75-H149 AromaticContact CD2-CG 3.68Å; Y75-H149 HydrophobicContact CE2-CB 4.41Å; Y75-H149 WeakPolarHBondContact CE2-O 3.41Å; Y75-H149 AromaticContact CG-CD2 3.78Å; Y75-I152 HydrophobicContact CE2-CB 4.26Å; Y75-I152 HydrophobicContact CE2-CG2 4.36Å; Y75-I152 VanDerWaalsContact OH-CG2 3.29Å; Y75-I152 WeakPolarHBondContact OH-CG2 3.33Å; Y75-I152 PolarHBondContact OH-O 3.42Å; Y75-S153 WeakPolarHBondContact CE2-OG 3.2Å; Y75-S153 PolarHBondContact OH-N 3.42Å; Y75-N156 PolarHBondContact OH-ND2 2.91Å
76	N	88.8	Confident	87.7	Confident	13 Å²	13	40.3 Å²	40.3	7%	0.07	19%	0.194	C	C	.	.	H	α-helix	trans	-70.3	-31.1	-177.7	-76.3	-79.1	0	0	0	112.1	Y72 N73 E74 M80 Y115	Y72-N76 WeakPolarHBondContact CD2-ND2 3.27Å; Y72-N76 VanDerWaalsContact CE1-ND2 3.3Å; Y72-N76 WeakPolarHBondContact CE1-ND2 3.47Å; Y72-N76 WeakPolarHBondContact CE2-ND2 3.07Å; Y72-N76 PolarHBondContact O-N 3.45Å; Y72-N76 PolarHBondContact O-ND2 3.33Å; N73-N76 PolarHBondContact O-N 2.87Å; E74-N76 PolarHBondContact O-N 3.49Å; N76-M80 WeakPolarHBondContact O-CB 3.39Å; N76-M80 WeakPolarHBondContact O-CG 3.32Å; N76-M80 PolarHBondContact O-N 3.49Å; N76-Y115 HydrophobicContact CB-CD1 3.62Å; N76-Y115 HydrophobicContact CB-CD2 3.58Å; N76-Y115 HydrophobicContact CB-CE1 3.51Å; N76-Y115 HydrophobicContact CB-CE2 3.5Å; N76-Y115 HydrophobicContact CB-CG 3.66Å; N76-Y115 VanDerWaalsContact CB-CZ 3.45Å
77	H	92.6	Very high	88.5	Confident	30 Å²	30	40 Å²	40	14%	0.139	19%	0.193	C	C	.	.	H	α-helix	trans	-56.8	-51.5	170.8	165.7	-87.8	0	0	0	110.9	N73 E74 Y75 R81 T112	N73-H77 WeakPolarHBondContact O-CB 3.4Å; N73-H77 PolarHBondContact O-N 2.9Å; E74-H77 WeakPolarHBondContact O-CB 3.48Å; E74-H77 PolarHBondContact O-N 2.94Å; Y75-H77 VanDerWaalsContact C-N 3.31Å; Y75-H77 PolarHBondContact O-N 3.26Å; H77-R81 PolarHBondContact O-N 2.9Å; H77-T112 PolarHBondContact CD2-O 3.42Å
78	D	90.7	Very high	89.6	Confident	71 Å²	71	42 Å²	42	38%	0.38	20%	0.203	S	C	.	.	H	α-helix	trans	-68.4	-42.1	-177.9	-74.7	-19.7	0	0	0	111.9	E74 Y75 M80 R81 E82	E74-D78 PolarHBondContact O-N 3.42Å; Y75-D78 PolarHBondContact O-N 3.19Å; D78-M80 PolarHBondContact O-N 2.89Å; D78-R81 PolarHBondContact O-N 3.3Å; D78-R81 IonicContact OD1-CZ 2.86Å; D78-R81 IonicContact OD1-NH1 2.72Å; D78-R81 IonicContact OD1-NH2 2.71Å; D78-R81 PolarHBondContact OD1-NH2 3.41Å; D78-E82 WeakPolarHBondContact O-CB 3.48Å; D78-E82 PolarHBondContact O-N 2.85Å
79	L	91.6	Very high	90.4	Very high	11 Å²	11	43.6 Å²	43.6	6%	0.058	21%	0.21	C	C	.	.	H	α-helix	trans	-58.2	-48.5	176.1	177.9	65.6	0	0	0	111.6	Y75 R81 E82 L83 N156 L157	Y75-L79 HydrophobicContact CE1-CD2 4.02Å; Y75-L79 WeakPolarHBondContact O-CB 3.27Å; Y75-L79 PolarHBondContact O-N 3.06Å; L79-R81 VanDerWaalsContact C-N 3.31Å; L79-R81 PolarHBondContact O-N 2.79Å; L79-E82 PolarHBondContact O-N 3.28Å; L79-L83 HydrophobicContact CD1-CD1 4.33Å; L79-L83 HydrophobicContact CD1-CG 4.22Å; L79-L83 HydrophobicContact CG-CD1 4.05Å; L79-L83 HydrophobicContact CG-CG 4.37Å; L79-L83 VanDerWaalsContact O-CG 3.29Å; L79-L83 WeakPolarHBondContact O-CG 3.42Å; L79-L83 PolarHBondContact O-N 3.46Å; L79-N156 HydrophobicContact CD1-CB 3.95Å; L79-N156 HydrophobicContact CD2-CB 4.29Å; L79-L157 HydrophobicContact CD1-CD2 3.98Å; L79-L157 HydrophobicContact CD1-CG 4.18Å
80	M	94.5	Very high	90.9	Very high	26 Å²	26	41.8 Å²	41.8	13%	0.128	20%	0.2	C	C	.	.	H	α-helix	trans	-64.7	-37.8	-178.1	-65.6	-66.7	141.3	0	0	111.6	N76 D78 L83 F108 K111 T112 Y115	N76-M80 WeakPolarHBondContact O-CB 3.39Å; N76-M80 WeakPolarHBondContact O-CG 3.32Å; N76-M80 PolarHBondContact O-N 3.49Å; D78-M80 PolarHBondContact O-N 2.89Å; M80-L83 HydrophobicContact CE-CD1 4.39Å; M80-L83 HydrophobicContact SD-CD1 4.31Å; M80-F108 HydrophobicContact SD-CD1 3.83Å; M80-K111 HydrophobicContact CB-CB 4.36Å; M80-K111 HydrophobicContact CG-CB 3.76Å; M80-K111 HydrophobicContact SD-CB 3.86Å; M80-K111 HydrophobicContact SD-CG 4.38Å; M80-T112 VanDerWaalsContact CB-OG1 3.24Å; M80-T112 WeakPolarHBondContact CB-OG1 3.44Å; M80-Y115 HydrophobicContact CG-CD2 4.09Å; M80-Y115 HydrophobicContact CG-CE2 4.04Å
81	R	94.5	Very high	91.5	Very high	117 Å²	117	41.8 Å²	41.8	44%	0.442	20%	0.2	S	C	.	.	H	α-helix	trans	-61.7	-46.5	172.6	-176.4	-177.4	64.2	-148.5	-15.7	111	H77 D78 L79 L83 V84 N85 T112	H77-R81 PolarHBondContact O-N 2.9Å; D78-R81 PolarHBondContact O-N 3.3Å; D78-R81 IonicContact OD1-CZ 2.86Å; D78-R81 IonicContact OD1-NH1 2.72Å; D78-R81 IonicContact OD1-NH2 2.71Å; D78-R81 PolarHBondContact OD1-NH2 3.41Å; L79-R81 VanDerWaalsContact C-N 3.31Å; L79-R81 PolarHBondContact O-N 2.79Å; R81-L83 VanDerWaalsContact C-N 3.35Å; R81-L83 PolarHBondContact O-N 3.11Å; R81-V84 WeakPolarHBondContact O-CB 3.29Å; R81-V84 PolarHBondContact O-N 3.38Å; R81-N85 PolarHBondContact O-N 3.16Å; R81-T112 HydrophobicContact CB-CG2 4.29Å; R81-T112 PolarHBondContact N-OG1 3.28Å
82	E	94.2	Very high	92.3	Very high	72 Å²	72	48.4 Å²	48.4	34%	0.336	23%	0.23	S	C	.	.	H	α-helix	trans	-69.6	-32.2	-176.3	-163.5	60.5	-159.6	0	0	112.8	D78 L79 V84 N85 V86 L157	D78-E82 WeakPolarHBondContact O-CB 3.48Å; D78-E82 PolarHBondContact O-N 2.85Å; L79-E82 PolarHBondContact O-N 3.28Å; E82-V84 PolarHBondContact O-N 3.45Å; E82-N85 WeakPolarHBondContact O-CB 3.47Å; E82-N85 PolarHBondContact O-N 3.03Å; E82-N85 VanDerWaalsContact O-N 3.09Å; E82-N85 PolarHBondContact OE2-ND2 3.1Å; E82-V86 WeakPolarHBondContact O-CG2 3.06Å; E82-V86 PolarHBondContact O-N 3.14Å; E82-L157 HydrophobicContact CB-CD1 4.48Å; E82-L157 HydrophobicContact CB-CD2 3.94Å; E82-L157 HydrophobicContact CG-CD1 3.71Å; E82-L157 HydrophobicContact CG-CD2 3.74Å; E82-L157 HydrophobicContact CG-CG 4.4Å
83	L	93.9	Very high	92.8	Very high	12 Å²	12	50.2 Å²	50.2	6%	0.063	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-30.6	173.5	-72.1	171.2	0	0	0	112.8	L79 M80 R81 V87 F108 L157 F160	L79-L83 HydrophobicContact CD1-CD1 4.33Å; L79-L83 HydrophobicContact CD1-CG 4.22Å; L79-L83 HydrophobicContact CG-CD1 4.05Å; L79-L83 HydrophobicContact CG-CG 4.37Å; L79-L83 VanDerWaalsContact O-CG 3.29Å; L79-L83 WeakPolarHBondContact O-CG 3.42Å; L79-L83 PolarHBondContact O-N 3.46Å; M80-L83 HydrophobicContact CE-CD1 4.39Å; M80-L83 HydrophobicContact SD-CD1 4.31Å; R81-L83 VanDerWaalsContact C-N 3.35Å; R81-L83 PolarHBondContact O-N 3.11Å; L83-V87 WeakPolarHBondContact O-CG2 3.22Å; L83-V87 PolarHBondContact O-N 3.44Å; L83-V87 VanDerWaalsContact O-N 3.15Å; L83-F108 HydrophobicContact CB-CD1 4.48Å; L83-F108 HydrophobicContact CB-CD2 3.68Å; L83-F108 HydrophobicContact CB-CE2 3.73Å; L83-F108 HydrophobicContact CB-CG 4.09Å; L83-F108 HydrophobicContact CB-CZ 4.16Å; L83-F108 HydrophobicContact CD1-CD1 4.2Å; L83-F108 HydrophobicContact CD1-CE1 3.92Å; L83-F108 HydrophobicContact CD1-CE2 4.47Å; L83-F108 HydrophobicContact CD1-CZ 4.06Å; L83-L157 HydrophobicContact CD2-CD2 3.86Å; L83-L157 HydrophobicContact CG-CD2 4.17Å; L83-F160 HydrophobicContact CD2-CB 3.59Å; L83-F160 HydrophobicContact CD2-CD1 3.44Å; L83-F160 VanDerWaalsContact CD2-CD1 3.44Å; L83-F160 HydrophobicContact CD2-CD2 4.27Å; L83-F160 HydrophobicContact CD2-CE1 4.17Å; L83-F160 HydrophobicContact CD2-CG 3.49Å; L83-F160 VanDerWaalsContact CD2-CG 3.49Å
84	V	96	Very high	93	Very high	24 Å²	24	55.1 Å²	55.1	15%	0.145	26%	0.259	C	S	.	.	H	α-helix	trans	-65.9	-46.8	171.3	178.3	0	0	0	0	110.1	R81 E82 V86 V87 D88 K105 F108	R81-V84 WeakPolarHBondContact O-CB 3.29Å; R81-V84 PolarHBondContact O-N 3.38Å; E82-V84 PolarHBondContact O-N 3.45Å; V84-V86 VanDerWaalsContact C-N 3.32Å; V84-V86 PolarHBondContact O-N 3.39Å; V84-V87 WeakPolarHBondContact O-CB 3.29Å; V84-V87 PolarHBondContact O-N 3.49Å; V84-D88 PolarHBondContact O-N 3.39Å; V84-K105 HydrophobicContact CG1-CD 4.18Å; V84-K105 HydrophobicContact CG1-CG 4.22Å; V84-F108 HydrophobicContact CG2-CB 3.61Å; V84-F108 HydrophobicContact CG2-CD2 4.33Å; V84-F108 HydrophobicContact CG2-CG 4.5Å
85	N	95.1	Very high	93.3	Very high	63 Å²	63	59.1 Å²	59.1	34%	0.337	28%	0.283	S	S	.	.	H	α-helix	trans	-59	-43.6	177.2	-62	-20.6	0	0	0	111.3	R81 E82 V87 D88 D89	R81-N85 PolarHBondContact O-N 3.16Å; E82-N85 WeakPolarHBondContact O-CB 3.47Å; E82-N85 PolarHBondContact O-N 3.03Å; E82-N85 VanDerWaalsContact O-N 3.09Å; E82-N85 PolarHBondContact OE2-ND2 3.1Å; N85-V87 VanDerWaalsContact C-N 3.27Å; N85-V87 PolarHBondContact O-N 3.41Å; N85-D88 PolarHBondContact O-N 3.34Å; N85-D89 WeakPolarHBondContact O-CB 3.49Å; N85-D89 VanDerWaalsContact O-CG 3.29Å; N85-D89 PolarHBondContact O-N 2.94Å
86	V	93.2	Very high	93.4	Very high	18 Å²	18	61 Å²	61	11%	0.109	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-39.1	175.8	171.7	0	0	0	0	111.6	E82 V84 I90 L157 F160 K161	E82-V86 WeakPolarHBondContact O-CG2 3.06Å; E82-V86 PolarHBondContact O-N 3.14Å; V84-V86 VanDerWaalsContact C-N 3.32Å; V84-V86 PolarHBondContact O-N 3.39Å; V86-I90 HydrophobicContact CG1-CD1 3.9Å; V86-I90 WeakPolarHBondContact O-CD1 3.11Å; V86-I90 VanDerWaalsContact O-CG1 3.26Å; V86-I90 WeakPolarHBondContact O-CG1 3.47Å; V86-I90 PolarHBondContact O-N 3.23Å; V86-I90 VanDerWaalsContact O-N 3.16Å; V86-L157 HydrophobicContact CG2-CD2 4Å; V86-F160 HydrophobicContact CB-CD1 4.39Å; V86-F160 HydrophobicContact CB-CE1 4.5Å; V86-F160 HydrophobicContact CG1-CD1 3.86Å; V86-F160 HydrophobicContact CG1-CE1 4.11Å; V86-K161 HydrophobicContact CG1-CB 4.21Å
87	V	94.6	Very high	93.4	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.2	-51.2	175.3	166.7	0	0	0	0	110.6	L83 V84 N85 D89 I90 E91 K105 F160 F164	L83-V87 WeakPolarHBondContact O-CG2 3.22Å; L83-V87 PolarHBondContact O-N 3.44Å; L83-V87 VanDerWaalsContact O-N 3.15Å; V84-V87 WeakPolarHBondContact O-CB 3.29Å; V84-V87 PolarHBondContact O-N 3.49Å; N85-V87 VanDerWaalsContact C-N 3.27Å; N85-V87 PolarHBondContact O-N 3.41Å; V87-D89 VanDerWaalsContact C-N 3.33Å; V87-D89 PolarHBondContact O-N 3.35Å; V87-I90 PolarHBondContact O-N 2.73Å; V87-E91 HydrophobicContact CG1-CG 4.37Å; V87-E91 WeakPolarHBondContact O-CG 3.4Å; V87-E91 PolarHBondContact O-N 3.04Å; V87-K105 HydrophobicContact CB-CD 4.12Å; V87-K105 HydrophobicContact CB-CG 4Å; V87-K105 HydrophobicContact CG1-CD 3.54Å; V87-K105 HydrophobicContact CG1-CG 3.67Å; V87-K105 HydrophobicContact CG2-CG 4.32Å; V87-F160 HydrophobicContact CG2-CE1 3.67Å; V87-F160 HydrophobicContact CG2-CZ 3.67Å; V87-F164 HydrophobicContact CB-CE2 3.97Å; V87-F164 HydrophobicContact CG1-CE2 3.79Å; V87-F164 HydrophobicContact CG1-CZ 4.4Å; V87-F164 HydrophobicContact CG2-CD2 4.01Å; V87-F164 HydrophobicContact CG2-CE2 3.8Å
88	D	95.6	Very high	93.2	Very high	63 Å²	63	66 Å²	66	34%	0.337	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-41.2	-177	-69	-23.8	0	0	0	111.5	V84 N85 I90 E91 Q92 K105	V84-D88 PolarHBondContact O-N 3.39Å; N85-D88 PolarHBondContact O-N 3.34Å; D88-I90 PolarHBondContact O-N 3.3Å; D88-E91 PolarHBondContact O-N 2.06Å; D88-Q92 VanDerWaalsContact O-CB 3.24Å; D88-Q92 WeakPolarHBondContact O-CB 3.43Å; D88-Q92 PolarHBondContact O-N 3.34Å; D88-K105 VanDerWaalsContact OD1-CD 3.24Å; D88-K105 WeakPolarHBondContact OD1-CD 3.29Å; D88-K105 IonicContact OD1-NZ 2.74Å; D88-K105 PolarHBondContact OD1-NZ 3.4Å
89	D	95.2	Very high	93.1	Very high	95 Å²	95	67.6 Å²	67.6	51%	0.508	34%	0.339	S	S	.	.	H	α-helix	trans	-62.3	-42.7	176.9	-77.8	-9.2	0	0	0	112.3	N85 V87 K93	N85-D89 WeakPolarHBondContact O-CB 3.49Å; N85-D89 VanDerWaalsContact O-CG 3.29Å; N85-D89 PolarHBondContact O-N 2.94Å; V87-D89 VanDerWaalsContact C-N 3.33Å; V87-D89 PolarHBondContact O-N 3.35Å; D89-K93 WeakPolarHBondContact O-CB 3.49Å; D89-K93 PolarHBondContact O-N 3.01Å
90	I	93.2	Very high	93	Very high	8 Å²	8	71.2 Å²	71.2	4%	0.041	35%	0.354	C	S	.	.	H	α-helix	trans	-66.6	-47.8	176.8	-69	168.8	0	0	0	109.8	V86 V87 D88 Q92 K93 Y94 K161 F164 L165 L168	V86-I90 HydrophobicContact CG1-CD1 3.9Å; V86-I90 WeakPolarHBondContact O-CD1 3.11Å; V86-I90 VanDerWaalsContact O-CG1 3.26Å; V86-I90 WeakPolarHBondContact O-CG1 3.47Å; V86-I90 PolarHBondContact O-N 3.23Å; V86-I90 VanDerWaalsContact O-N 3.16Å; V87-I90 PolarHBondContact O-N 2.73Å; D88-I90 PolarHBondContact O-N 3.3Å; I90-Q92 VanDerWaalsContact C-N 3.34Å; I90-Q92 PolarHBondContact O-N 3.26Å; I90-K93 PolarHBondContact O-N 3.02Å; I90-Y94 HydrophobicContact CG2-CD2 3.89Å; I90-Y94 HydrophobicContact CG2-CE2 4.19Å; I90-Y94 VanDerWaalsContact O-CD2 3.26Å; I90-Y94 WeakPolarHBondContact O-CD2 3.37Å; I90-Y94 PolarHBondContact O-N 3.43Å; I90-Y94 VanDerWaalsContact O-N 3.07Å; I90-K161 HydrophobicContact CD1-CG 4.14Å; I90-F164 HydrophobicContact CB-CD2 4.44Å; I90-F164 HydrophobicContact CB-CE2 4.21Å; I90-F164 HydrophobicContact CD1-CB 4.19Å; I90-F164 HydrophobicContact CD1-CD2 3.7Å; I90-F164 HydrophobicContact CD1-CE2 4.31Å; I90-F164 HydrophobicContact CD1-CG 4.13Å; I90-F164 HydrophobicContact CG2-CD2 4.4Å; I90-F164 HydrophobicContact CG2-CE2 4.18Å; I90-F164 HydrophobicContact CG2-CZ 4.26Å; I90-L165 HydrophobicContact CD1-CD2 4.47Å; I90-L165 HydrophobicContact CD1-CG 4.43Å; I90-L165 HydrophobicContact CG2-CD2 3.98Å; I90-L168 HydrophobicContact CG2-CD1 3.76Å
91	E	94.2	Very high	92.9	Very high	19 Å²	19	70.1 Å²	70.1	9%	0.089	35%	0.348	C	S	.	.	H	α-helix	trans	-59.3	-45.3	179.1	-73.6	-167.8	142.2	0	0	111.7	V87 D88 N95 I96 Y98 S101 K105 F164	V87-E91 HydrophobicContact CG1-CG 4.37Å; V87-E91 WeakPolarHBondContact O-CG 3.4Å; V87-E91 PolarHBondContact O-N 3.04Å; D88-E91 PolarHBondContact O-N 2.06Å; E91-N95 WeakPolarHBondContact O-CA 3.29Å; E91-N95 PolarHBondContact O-N 3.43Å; E91-I96 WeakPolarHBondContact CB-O 3.37Å; E91-I96 PolarHBondContact O-N 3.05Å; E91-Y98 PolarHBondContact OE1-N 2.95Å; E91-S101 VanDerWaalsContact CD-OG 3.31Å; E91-S101 WeakPolarHBondContact OE1-CB 3.49Å; E91-S101 PolarHBondContact OE1-OG 2.9Å; E91-K105 IonicContact OE2-NZ 3.38Å; E91-K105 PolarHBondContact OE2-NZ 3.03Å; E91-F164 HydrophobicContact CG-CZ 4.22Å
92	Q	95.6	Very high	92.9	Very high	156 Å²	156	72.7 Å²	72.7	73%	0.729	36%	0.358	S	S	*	.	H	α-helix	trans	-65.1	-46.6	176.7	-174.6	178.7	3.8	0	0	111.7	D88 I90 Y94 N95	D88-Q92 VanDerWaalsContact O-CB 3.24Å; D88-Q92 WeakPolarHBondContact O-CB 3.43Å; D88-Q92 PolarHBondContact O-N 3.34Å; I90-Q92 VanDerWaalsContact C-N 3.34Å; I90-Q92 PolarHBondContact O-N 3.26Å; Q92-Y94 VanDerWaalsContact C-N 3.31Å; Q92-Y94 PolarHBondContact O-N 3.09Å; Q92-N95 PolarHBondContact O-N 3.43Å
93	K	94.2	Very high	92.9	Very high	154 Å²	154	73.5 Å²	73.5	67%	0.67	37%	0.368	S	S	*	.	H	α-helix	trans	-59.8	-40.5	-177.9	178.3	176.5	-179.1	179.2	0	112.5	D89 I90	D89-K93 WeakPolarHBondContact O-CB 3.49Å; D89-K93 PolarHBondContact O-N 3.01Å; I90-K93 PolarHBondContact O-N 3.02Å
94	Y	90.7	Very high	92.8	Very high	116 Å²	116	75 Å²	75	46%	0.455	37%	0.373	S	S	.	.	H	α-helix	trans	-95.6	-0.4	-178.9	-65.1	-74.1	0	0	0	113.3	I90 Q92 I96 L165	I90-Y94 HydrophobicContact CG2-CD2 3.89Å; I90-Y94 HydrophobicContact CG2-CE2 4.19Å; I90-Y94 VanDerWaalsContact O-CD2 3.26Å; I90-Y94 WeakPolarHBondContact O-CD2 3.37Å; I90-Y94 PolarHBondContact O-N 3.43Å; I90-Y94 VanDerWaalsContact O-N 3.07Å; Q92-Y94 VanDerWaalsContact C-N 3.31Å; Q92-Y94 PolarHBondContact O-N 3.09Å; Y94-I96 VanDerWaalsContact C-N 3.29Å; Y94-I96 WeakPolarHBondContact O-CG2 3.26Å; Y94-I96 PolarHBondContact O-N 3.4Å; Y94-L165 HydrophobicContact CD2-CD2 4.43Å; Y94-L165 HydrophobicContact CE2-CD2 3.62Å
95	N	93.7	Very high	92.8	Very high	154 Å²	154	76 Å²	76	82%	0.824	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	49.3	-175	-167.5	39.9	0	0	0	112.4	E91 Q92	E91-N95 WeakPolarHBondContact O-CA 3.29Å; E91-N95 PolarHBondContact O-N 3.43Å; Q92-N95 PolarHBondContact O-N 3.43Å
96	I	89.8	Confident	92.8	Very high	60 Å²	60	78.1 Å²	78.1	31%	0.308	38%	0.383	S	S	.	.			trans	-121.9	161.7	179.7	62.5	172	0	0	0	110.5	E91 Y94 L168	E91-I96 WeakPolarHBondContact CB-O 3.37Å; E91-I96 PolarHBondContact O-N 3.05Å; Y94-I96 VanDerWaalsContact C-N 3.29Å; Y94-I96 WeakPolarHBondContact O-CG2 3.26Å; Y94-I96 PolarHBondContact O-N 3.4Å; I96-L168 HydrophobicContact CD1-CD1 3.46Å; I96-L168 VanDerWaalsContact CD1-CD1 3.46Å; I96-L168 HydrophobicContact CD1-CD2 3.43Å; I96-L168 VanDerWaalsContact CD1-CD2 3.43Å; I96-L168 HydrophobicContact CD1-CG 4.06Å
97	T	88.3	Confident	93	Very high	125 Å²	125	80.3 Å²	80.3	77%	0.767	40%	0.399	S	S	*	.			trans	-125.1	117.3	163.8	-57	0	0	0	0	107.6	P99	T97-P99 WeakPolarHBondContact O-CD 3.38Å
98	Y	87.9	Confident	93	Very high	23 Å²	23	81.6 Å²	81.6	9%	0.09	40%	0.404	C	S	.	.			trans	-99.8	110.3	-178.5	178.4	-140.8	0	0	0	110	E91 K100 S101 W104 F164 E167 L168 I171	E91-Y98 PolarHBondContact OE1-N 2.95Å; Y98-K100 HydrophobicContact CD1-CB 4.1Å; Y98-K100 HydrophobicContact CD2-CB 4.39Å; Y98-K100 HydrophobicContact CE1-CB 3.59Å; Y98-K100 HydrophobicContact CE1-CD 4.05Å; Y98-K100 HydrophobicContact CE1-CG 4.32Å; Y98-K100 HydrophobicContact CE2-CB 3.82Å; Y98-K100 VanDerWaalsContact CZ-CB 3.45Å; Y98-K100 PolarHBondContact O-N 3.28Å; Y98-K100 WeakPolarHBondContact OH-CD 3.23Å; Y98-S101 WeakPolarHBondContact O-CA 3.2Å; Y98-S101 WeakPolarHBondContact O-CB 3.26Å; Y98-S101 PolarHBondContact O-N 3.22Å; Y98-S101 PolarHBondContact O-OG 3.06Å; Y98-W104 HydrophobicContact CE1-CH2 4.36Å; Y98-W104 HydrophobicContact CE1-CZ3 4.47Å; Y98-F164 HydrophobicContact CD1-CD1 4Å; Y98-F164 AromaticContact CD1-CE1 3.27Å; Y98-F164 HydrophobicContact CD1-CE1 3.27Å; Y98-F164 AromaticContact CD1-CZ 3.91Å; Y98-F164 HydrophobicContact CD1-CZ 3.91Å; Y98-F164 HydrophobicContact CE1-CD1 4.27Å; Y98-F164 AromaticContact CE1-CE1 3.98Å; Y98-F164 HydrophobicContact CE1-CE1 3.98Å; Y98-F164 HydrophobicContact CG-CE1 4.01Å; Y98-E167 HydrophobicContact CE1-CB 4.49Å; Y98-L168 HydrophobicContact CD1-CD2 4.23Å; Y98-L168 HydrophobicContact CD2-CD2 4.25Å; Y98-L168 HydrophobicContact CG-CD2 3.92Å; Y98-I171 HydrophobicContact CD2-CD1 3.86Å; Y98-I171 HydrophobicContact CE2-CD1 3.13Å
99	P	89.6	Confident	93.1	Very high	104 Å²	104	81.5 Å²	81.5	68%	0.675	41%	0.406	S	S	*	.	H	α-helix	trans	-54.4	-34.3	-172.6	-29.5	36.2	0	0	0	114.9	T97 S101 R102	T97-P99 WeakPolarHBondContact O-CD 3.38Å; P99-S101 VanDerWaalsContact C-N 3.33Å; P99-R102 WeakPolarHBondContact O-CB 3.42Å; P99-R102 PolarHBondContact O-N 3.13Å
100	K	89.7	Confident	93.2	Very high	87 Å²	87	84 Å²	84	38%	0.378	41%	0.41	S	S	.	.	H	α-helix	trans	-70.9	-27.3	177.2	-165.1	-175.6	-172.8	173.1	0	112.7	Y98 R102 T103 W104 E167	Y98-K100 HydrophobicContact CD1-CB 4.1Å; Y98-K100 HydrophobicContact CD2-CB 4.39Å; Y98-K100 HydrophobicContact CE1-CB 3.59Å; Y98-K100 HydrophobicContact CE1-CD 4.05Å; Y98-K100 HydrophobicContact CE1-CG 4.32Å; Y98-K100 HydrophobicContact CE2-CB 3.82Å; Y98-K100 VanDerWaalsContact CZ-CB 3.45Å; Y98-K100 PolarHBondContact O-N 3.28Å; Y98-K100 WeakPolarHBondContact OH-CD 3.23Å; K100-R102 PolarHBondContact O-N 3.43Å; K100-T103 PolarHBondContact O-N 2.98Å; K100-W104 HydrophobicContact CD-CZ2 3.94Å; K100-W104 HydrophobicContact CG-CZ2 4.28Å; K100-W104 PolarHBondContact O-N 2.97Å; K100-E167 IonicContact NZ-OE2 2.76Å; K100-E167 PolarHBondContact NZ-OE2 3.37Å
101	S	92.7	Very high	93.3	Very high	2 Å²	2	87.6 Å²	87.6	1%	0.014	43%	0.425	C	S	.	.	H	α-helix	trans	-61.9	-32	175.9	86.1	0	0	0	0	111.2	E91 Y98 P99 T103 W104 K105	E91-S101 VanDerWaalsContact CD-OG 3.31Å; E91-S101 WeakPolarHBondContact OE1-CB 3.49Å; E91-S101 PolarHBondContact OE1-OG 2.9Å; Y98-S101 WeakPolarHBondContact O-CA 3.2Å; Y98-S101 WeakPolarHBondContact O-CB 3.26Å; Y98-S101 PolarHBondContact O-N 3.22Å; Y98-S101 PolarHBondContact O-OG 3.06Å; P99-S101 VanDerWaalsContact C-N 3.33Å; S101-T103 PolarHBondContact O-N 3.49Å; S101-W104 WeakPolarHBondContact O-CB 3.45Å; S101-W104 PolarHBondContact O-N 3.34Å; S101-W104 VanDerWaalsContact O-N 3.13Å; S101-K105 WeakPolarHBondContact O-CG 3.49Å; S101-K105 PolarHBondContact O-N 3.25Å
102	R	92.9	Very high	93.4	Very high	172 Å²	172	87.7 Å²	87.7	65%	0.649	43%	0.427	S	S	*	.	H	α-helix	trans	-59.5	-48.4	177	-171.4	-180	-178.4	153.6	6.7	111.4	P99 K100 W104 K105 E106	P99-R102 WeakPolarHBondContact O-CB 3.42Å; P99-R102 PolarHBondContact O-N 3.13Å; K100-R102 PolarHBondContact O-N 3.43Å; R102-W104 VanDerWaalsContact C-N 3.26Å; R102-W104 PolarHBondContact O-N 3.49Å; R102-K105 PolarHBondContact O-N 3.32Å; R102-E106 IonicContact NE-OE1 2.73Å; R102-E106 PolarHBondContact NE-OE1 2.86Å; R102-E106 WeakPolarHBondContact O-CG 3.46Å; R102-E106 PolarHBondContact O-N 3.3Å
103	T	93.9	Very high	93.4	Very high	89 Å²	89	87.2 Å²	87.2	55%	0.546	42%	0.422	S	S	.	.	H	α-helix	trans	-61.5	-36.9	176.2	-46.2	0	0	0	0	111.5	K100 S101 C107	K100-T103 PolarHBondContact O-N 2.98Å; S101-T103 PolarHBondContact O-N 3.49Å; T103-C107 WeakPolarHBondContact O-CB 3.46Å; T103-C107 PolarHBondContact O-N 3.42Å
104	W	92.4	Very high	93.4	Very high	42 Å²	42	82.3 Å²	82.3	16%	0.159	40%	0.403	C	S	.	.	H	α-helix	trans	-65.9	-48	175.5	-63.8	-9.1	0	0	0	111.9	Y98 K100 S101 R102 E106 C107 F108 F160 F164 E167	Y98-W104 HydrophobicContact CE1-CH2 4.36Å; Y98-W104 HydrophobicContact CE1-CZ3 4.47Å; K100-W104 HydrophobicContact CD-CZ2 3.94Å; K100-W104 HydrophobicContact CG-CZ2 4.28Å; K100-W104 PolarHBondContact O-N 2.97Å; S101-W104 WeakPolarHBondContact O-CB 3.45Å; S101-W104 PolarHBondContact O-N 3.34Å; S101-W104 VanDerWaalsContact O-N 3.13Å; R102-W104 VanDerWaalsContact C-N 3.26Å; R102-W104 PolarHBondContact O-N 3.49Å; W104-E106 VanDerWaalsContact C-N 3.33Å; W104-E106 PolarHBondContact O-N 3.03Å; W104-C107 WeakPolarHBondContact O-CB 3.29Å; W104-C107 PolarHBondContact O-N 3.48Å; W104-C107 VanDerWaalsContact O-N 3.16Å; W104-F108 HydrophobicContact CB-CD2 4.47Å; W104-F108 HydrophobicContact CB-CE2 3.93Å; W104-F108 HydrophobicContact CB-CZ 4.27Å; W104-F108 VanDerWaalsContact O-CD2 3.24Å; W104-F108 WeakPolarHBondContact O-CD2 3.4Å; W104-F108 WeakPolarHBondContact O-CG 3.39Å; W104-F108 PolarHBondContact O-N 3.22Å; W104-F160 HydrophobicContact CD2-CE2 4.39Å; W104-F160 AromaticContact CE3-CE2 3.77Å; W104-F160 HydrophobicContact CE3-CE2 3.77Å; W104-F160 AromaticContact CE3-CZ 3.65Å; W104-F160 HydrophobicContact CE3-CZ 3.65Å; W104-F160 AromaticContact CZ3-CE2 3.95Å; W104-F160 HydrophobicContact CZ3-CE2 3.95Å; W104-F160 HydrophobicContact CZ3-CZ 4.01Å; W104-F164 HydrophobicContact CZ3-CB 4.03Å; W104-F164 AromaticContact CZ3-CD1 3.98Å; W104-F164 HydrophobicContact CZ3-CD1 3.98Å; W104-F164 HydrophobicContact CZ3-CD2 4.24Å; W104-F164 AromaticContact CZ3-CG 3.82Å; W104-F164 HydrophobicContact CZ3-CG 3.82Å; W104-E167 HydrophobicContact CH2-CG 4.38Å
105	K	95.8	Very high	93.6	Very high	45 Å²	45	78.3 Å²	78.3	20%	0.196	39%	0.387	C	S	.	.	H	α-helix	trans	-59.5	-42.4	177.1	-73.7	-169.1	-82.5	-163.9	0	112.5	V84 V87 D88 E91 S101 R102 F108 T109	V84-K105 HydrophobicContact CG1-CD 4.18Å; V84-K105 HydrophobicContact CG1-CG 4.22Å; V87-K105 HydrophobicContact CB-CD 4.12Å; V87-K105 HydrophobicContact CB-CG 4Å; V87-K105 HydrophobicContact CG1-CD 3.54Å; V87-K105 HydrophobicContact CG1-CG 3.67Å; V87-K105 HydrophobicContact CG2-CG 4.32Å; D88-K105 VanDerWaalsContact OD1-CD 3.24Å; D88-K105 WeakPolarHBondContact OD1-CD 3.29Å; D88-K105 IonicContact OD1-NZ 2.74Å; D88-K105 PolarHBondContact OD1-NZ 3.4Å; E91-K105 IonicContact OE2-NZ 3.38Å; E91-K105 PolarHBondContact OE2-NZ 3.03Å; S101-K105 WeakPolarHBondContact O-CG 3.49Å; S101-K105 PolarHBondContact O-N 3.25Å; R102-K105 PolarHBondContact O-N 3.32Å; K105-F108 PolarHBondContact O-N 3.15Å; K105-T109 VanDerWaalsContact O-CB 3.26Å; K105-T109 WeakPolarHBondContact O-CB 3.49Å; K105-T109 PolarHBondContact O-N 3.41Å; K105-T109 PolarHBondContact O-OG1 3.2Å
106	E	96.3	Very high	93.5	Very high	108 Å²	108	79.1 Å²	79.1	51%	0.505	38%	0.379	S	S	.	.	H	α-helix	trans	-61.3	-45.2	175.5	-74.2	170.6	-174.6	0	0	111.1	R102 W104 Y110	R102-E106 IonicContact NE-OE1 2.73Å; R102-E106 PolarHBondContact NE-OE1 2.86Å; R102-E106 WeakPolarHBondContact O-CG 3.46Å; R102-E106 PolarHBondContact O-N 3.3Å; W104-E106 VanDerWaalsContact C-N 3.33Å; W104-E106 PolarHBondContact O-N 3.03Å; E106-Y110 WeakPolarHBondContact O-CB 3.46Å; E106-Y110 PolarHBondContact O-N 2.92Å
107	C	95.8	Very high	93.6	Very high	64 Å²	64	82.8 Å²	82.8	43%	0.432	39%	0.389	S	S	.	.	H	α-helix	trans	-60.9	-49.2	176.1	-176	0	0	0	0	112.1	T103 W104 Y110 K111	T103-C107 WeakPolarHBondContact O-CB 3.46Å; T103-C107 PolarHBondContact O-N 3.42Å; W104-C107 WeakPolarHBondContact O-CB 3.29Å; W104-C107 PolarHBondContact O-N 3.48Å; W104-C107 VanDerWaalsContact O-N 3.16Å; C107-Y110 PolarHBondContact O-N 2.74Å; C107-K111 WeakPolarHBondContact O-CG 3.43Å; C107-K111 PolarHBondContact O-N 3.5Å
108	F	96.1	Very high	93.6	Very high	27 Å²	27	79.3 Å²	79.3	12%	0.118	37%	0.366	C	S	.	.	H	α-helix	trans	-62.9	-46.2	179.7	-60.9	-31.2	0	0	0	111.5	M80 L83 V84 W104 K105 Y110 K111 T112 F160	M80-F108 HydrophobicContact SD-CD1 3.83Å; L83-F108 HydrophobicContact CB-CD1 4.48Å; L83-F108 HydrophobicContact CB-CD2 3.68Å; L83-F108 HydrophobicContact CB-CE2 3.73Å; L83-F108 HydrophobicContact CB-CG 4.09Å; L83-F108 HydrophobicContact CB-CZ 4.16Å; L83-F108 HydrophobicContact CD1-CD1 4.2Å; L83-F108 HydrophobicContact CD1-CE1 3.92Å; L83-F108 HydrophobicContact CD1-CE2 4.47Å; L83-F108 HydrophobicContact CD1-CZ 4.06Å; V84-F108 HydrophobicContact CG2-CB 3.61Å; V84-F108 HydrophobicContact CG2-CD2 4.33Å; V84-F108 HydrophobicContact CG2-CG 4.5Å; W104-F108 HydrophobicContact CB-CD2 4.47Å; W104-F108 HydrophobicContact CB-CE2 3.93Å; W104-F108 HydrophobicContact CB-CZ 4.27Å; W104-F108 VanDerWaalsContact O-CD2 3.24Å; W104-F108 WeakPolarHBondContact O-CD2 3.4Å; W104-F108 WeakPolarHBondContact O-CG 3.39Å; W104-F108 PolarHBondContact O-N 3.22Å; K105-F108 PolarHBondContact O-N 3.15Å; F108-Y110 VanDerWaalsContact C-N 3.29Å; F108-Y110 PolarHBondContact O-N 3.44Å; F108-K111 PolarHBondContact O-N 2.85Å; F108-K111 VanDerWaalsContact O-N 3.1Å; F108-T112 PolarHBondContact O-N 3.28Å; F108-T112 PolarHBondContact O-OG1 2.92Å; F108-F160 HydrophobicContact CE2-CE1 4.26Å; F108-F160 AromaticContact CE2-CE2 3.99Å; F108-F160 HydrophobicContact CE2-CE2 3.99Å; F108-F160 AromaticContact CE2-CZ 3.66Å; F108-F160 HydrophobicContact CE2-CZ 3.66Å; F108-F160 HydrophobicContact CZ-CD2 4.37Å; F108-F160 AromaticContact CZ-CE2 3.75Å; F108-F160 HydrophobicContact CZ-CE2 3.75Å; F108-F160 AromaticContact CZ-CZ 3.94Å; F108-F160 HydrophobicContact CZ-CZ 3.94Å
109	T	97	Very high	93.5	Very high	61 Å²	61	78.9 Å²	78.9	37%	0.374	37%	0.366	S	S	.	.	H	α-helix	trans	-58.1	-41.6	176.7	-60	0	0	0	0	111.9	K105 K113	K105-T109 VanDerWaalsContact O-CB 3.26Å; K105-T109 WeakPolarHBondContact O-CB 3.49Å; K105-T109 PolarHBondContact O-N 3.41Å; K105-T109 PolarHBondContact O-OG1 3.2Å; T109-K113 PolarHBondContact O-N 3.31Å
110	Y	97.7	Very high	93.3	Very high	149 Å²	149	77.2 Å²	77.2	58%	0.584	35%	0.354	S	S	*	.	H	α-helix	trans	-64.5	-45.9	175.6	177.1	-109.9	0	0	0	111.8	E106 C107 F108 T112 K113 I114	E106-Y110 WeakPolarHBondContact O-CB 3.46Å; E106-Y110 PolarHBondContact O-N 2.92Å; C107-Y110 PolarHBondContact O-N 2.74Å; F108-Y110 VanDerWaalsContact C-N 3.29Å; F108-Y110 PolarHBondContact O-N 3.44Å; Y110-T112 PolarHBondContact O-N 3.32Å; Y110-K113 PolarHBondContact O-N 3.37Å; Y110-I114 HydrophobicContact CD1-CD1 3.88Å; Y110-I114 HydrophobicContact CE1-CD1 3.29Å; Y110-I114 HydrophobicContact CE1-CG1 4.29Å; Y110-I114 HydrophobicContact CE2-CD1 4.32Å; Y110-I114 PolarHBondContact O-N 2.93Å
111	K	95	Very high	92.7	Very high	82 Å²	82	75.8 Å²	75.8	36%	0.357	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-39.9	177.7	-72.3	-69.6	-173.9	176.7	0	112.5	M80 C107 F108 K113 I114 Y115	M80-K111 HydrophobicContact CB-CB 4.36Å; M80-K111 HydrophobicContact CG-CB 3.76Å; M80-K111 HydrophobicContact SD-CB 3.86Å; M80-K111 HydrophobicContact SD-CG 4.38Å; C107-K111 WeakPolarHBondContact O-CG 3.43Å; C107-K111 PolarHBondContact O-N 3.5Å; F108-K111 PolarHBondContact O-N 2.85Å; F108-K111 VanDerWaalsContact O-N 3.1Å; K111-K113 VanDerWaalsContact C-N 3.28Å; K111-K113 PolarHBondContact O-N 3.31Å; K111-I114 PolarHBondContact O-N 2.97Å; K111-I114 VanDerWaalsContact O-N 3.12Å; K111-Y115 HydrophobicContact CB-CD2 4.29Å; K111-Y115 HydrophobicContact CB-CE2 4.1Å; K111-Y115 HydrophobicContact CD-CE2 4.33Å; K111-Y115 WeakPolarHBondContact O-CD2 3.34Å; K111-Y115 PolarHBondContact O-N 3.49Å
112	T	95.8	Very high	91.7	Very high	21 Å²	21	79.3 Å²	79.3	13%	0.129	36%	0.362	C	S	.	.	H	α-helix	trans	-54	-45.5	173.7	-55.9	0	0	0	0	111.2	H77 M80 R81 F108 Y110 I114 Y115 R116	H77-T112 PolarHBondContact CD2-O 3.42Å; M80-T112 VanDerWaalsContact CB-OG1 3.24Å; M80-T112 WeakPolarHBondContact CB-OG1 3.44Å; R81-T112 HydrophobicContact CB-CG2 4.29Å; R81-T112 PolarHBondContact N-OG1 3.28Å; F108-T112 PolarHBondContact O-N 3.28Å; F108-T112 PolarHBondContact O-OG1 2.92Å; Y110-T112 PolarHBondContact O-N 3.32Å; T112-I114 PolarHBondContact O-N 3.02Å; T112-Y115 PolarHBondContact O-N 3.11Å; T112-R116 WeakPolarHBondContact O-CB 3.4Å; T112-R116 PolarHBondContact O-N 2.88Å
113	K	96	Very high	90.6	Very high	146 Å²	146	74.2 Å²	74.2	64%	0.635	35%	0.348	S	S	*	.	H	α-helix	trans	-63.5	-42.1	178	-66.2	175.8	-175.3	178.7	0	112.2	T109 Y110 K111 R116 Y117	T109-K113 PolarHBondContact O-N 3.31Å; Y110-K113 PolarHBondContact O-N 3.37Å; K111-K113 VanDerWaalsContact C-N 3.28Å; K111-K113 PolarHBondContact O-N 3.31Å; K113-R116 PolarHBondContact O-N 3.35Å; K113-Y117 PolarHBondContact O-N 3.18Å
114	I	95.3	Very high	89.3	Confident	51 Å²	51	76.1 Å²	76.1	26%	0.262	35%	0.354	S	S	.	.	H	α-helix	trans	-60.6	-52.1	176.8	-69.2	176.7	0	0	0	110.6	Y110 K111 T112 R116 Y117 L118	Y110-I114 HydrophobicContact CD1-CD1 3.88Å; Y110-I114 HydrophobicContact CE1-CD1 3.29Å; Y110-I114 HydrophobicContact CE1-CG1 4.29Å; Y110-I114 HydrophobicContact CE2-CD1 4.32Å; Y110-I114 PolarHBondContact O-N 2.93Å; K111-I114 PolarHBondContact O-N 2.97Å; K111-I114 VanDerWaalsContact O-N 3.12Å; T112-I114 PolarHBondContact O-N 3.02Å; I114-R116 VanDerWaalsContact C-N 3.3Å; I114-R116 PolarHBondContact O-N 2.94Å; I114-Y117 WeakPolarHBondContact O-CB 3.44Å; I114-Y117 PolarHBondContact O-N 2.92Å; I114-Y117 VanDerWaalsContact O-N 3.14Å; I114-L118 HydrophobicContact CG2-CD1 3.85Å; I114-L118 HydrophobicContact CG2-CG 4.29Å; I114-L118 WeakPolarHBondContact O-CG 3.33Å; I114-L118 PolarHBondContact O-N 3.03Å
115	Y	93.1	Very high	87.9	Confident	32 Å²	32	81.3 Å²	81.3	13%	0.125	38%	0.377	C	S	.	.	H	α-helix	trans	-63.6	-38.1	-177	-72.9	-61.7	0	0	0	111.9	Y72 N73 N76 M80 K111 T112 Y117 L118 T119	Y72-Y115 HydrophobicContact CE1-CE1 4.3Å; N73-Y115 HydrophobicContact CB-CD1 4.44Å; N76-Y115 HydrophobicContact CB-CD1 3.62Å; N76-Y115 HydrophobicContact CB-CD2 3.58Å; N76-Y115 HydrophobicContact CB-CE1 3.51Å; N76-Y115 HydrophobicContact CB-CE2 3.5Å; N76-Y115 HydrophobicContact CB-CG 3.66Å; N76-Y115 VanDerWaalsContact CB-CZ 3.45Å; M80-Y115 HydrophobicContact CG-CD2 4.09Å; M80-Y115 HydrophobicContact CG-CE2 4.04Å; K111-Y115 HydrophobicContact CB-CD2 4.29Å; K111-Y115 HydrophobicContact CB-CE2 4.1Å; K111-Y115 HydrophobicContact CD-CE2 4.33Å; K111-Y115 WeakPolarHBondContact O-CD2 3.34Å; K111-Y115 PolarHBondContact O-N 3.49Å; T112-Y115 PolarHBondContact O-N 3.11Å; Y115-Y117 VanDerWaalsContact C-N 3.34Å; Y115-Y117 PolarHBondContact O-N 2.99Å; Y115-L118 HydrophobicContact CD1-CD1 4.45Å; Y115-L118 PolarHBondContact O-N 3.25Å; Y115-T119 PolarHBondContact O-N 3.26Å; Y115-T119 PolarHBondContact O-OG1 3.24Å; Y115-T119 VanDerWaalsContact O-OG1 3.08Å
116	R	92.9	Very high	86.2	Confident	172 Å²	172	82.7 Å²	82.7	65%	0.649	39%	0.386	S	S	*	.	H	α-helix	trans	-59.6	-44.4	172.9	-168.9	170.6	178.3	175.6	0.1	112.5	T112 K113 I114 T120	T112-R116 WeakPolarHBondContact O-CB 3.4Å; T112-R116 PolarHBondContact O-N 2.88Å; K113-R116 PolarHBondContact O-N 3.35Å; I114-R116 VanDerWaalsContact C-N 3.3Å; I114-R116 PolarHBondContact O-N 2.94Å; R116-T120 PolarHBondContact O-N 3.33Å; R116-T120 PolarHBondContact O-OG1 3.46Å
117	Y	92.6	Very high	84.6	Confident	136 Å²	136	78 Å²	78	53%	0.533	37%	0.365	S	S	.	.	H	α-helix	trans	-62.3	-47.2	177.4	171.7	-93	0	0	0	110.9	K113 I114 Y115 T120 E121	K113-Y117 PolarHBondContact O-N 3.18Å; I114-Y117 WeakPolarHBondContact O-CB 3.44Å; I114-Y117 PolarHBondContact O-N 2.92Å; I114-Y117 VanDerWaalsContact O-N 3.14Å; Y115-Y117 VanDerWaalsContact C-N 3.34Å; Y115-Y117 PolarHBondContact O-N 2.99Å; Y117-T120 WeakPolarHBondContact O-CB 3.5Å; Y117-T120 PolarHBondContact O-N 3.09Å; Y117-E121 HydrophobicContact CD1-CG 4.41Å; Y117-E121 HydrophobicContact CE1-CG 3.77Å; Y117-E121 VanDerWaalsContact CE1-OE2 3.23Å; Y117-E121 WeakPolarHBondContact CE1-OE2 3.47Å; Y117-E121 HydrophobicContact CE2-CG 4.06Å; Y117-E121 VanDerWaalsContact CZ-CD 3.48Å; Y117-E121 PolarHBondContact O-N 3.01Å; Y117-E121 PolarHBondContact OH-OE1 2.98Å; Y117-E121 PolarHBondContact OH-OE2 3.49Å
118	L	88.4	Confident	82.8	Confident	53 Å²	53	79.4 Å²	79.4	28%	0.277	37%	0.368	S	S	.	.	H	α-helix	trans	-61	-48.1	178.4	-69	174.2	0	0	0	111.7	N73 I114 Y115 T120 E121 Y122	N73-L118 HydrophobicContact CB-CB 4.39Å; I114-L118 HydrophobicContact CG2-CD1 3.85Å; I114-L118 HydrophobicContact CG2-CG 4.29Å; I114-L118 WeakPolarHBondContact O-CG 3.33Å; I114-L118 PolarHBondContact O-N 3.03Å; Y115-L118 HydrophobicContact CD1-CD1 4.45Å; Y115-L118 PolarHBondContact O-N 3.25Å; L118-T120 PolarHBondContact O-N 3.02Å; L118-E121 PolarHBondContact O-N 3.43Å; L118-Y122 VanDerWaalsContact O-CD2 3.25Å; L118-Y122 WeakPolarHBondContact O-CD2 3.4Å; L118-Y122 PolarHBondContact O-N 2.97Å
119	T	85.6	Confident	81.1	Confident	13 Å²	13	85 Å²	85	8%	0.08	39%	0.393	C	S	.	.	H	α-helix	trans	-53.6	-45	174.5	-61.9	0	0	0	0	111.4	M70 N73 E74 Y115 Y122 N123	M70-T119 HydrophobicContact CG-CG2 4.33Å; N73-T119 WeakPolarHBondContact CB-OG1 3.28Å; E74-T119 HydrophobicContact CG-CG2 3.47Å; E74-T119 VanDerWaalsContact CG-CG2 3.47Å; E74-T119 PolarHBondContact N-OG1 3.12Å; Y115-T119 PolarHBondContact O-N 3.26Å; Y115-T119 PolarHBondContact O-OG1 3.24Å; Y115-T119 VanDerWaalsContact O-OG1 3.08Å; T119-Y122 PolarHBondContact O-N 3.34Å; T119-N123 WeakPolarHBondContact O-CB 3.46Å; T119-N123 PolarHBondContact O-N 3.45Å
120	T	83.8	Confident	79.1	Confident	70 Å²	70	82.9 Å²	82.9	43%	0.429	38%	0.379	S	S	.	.	H	α-helix	trans	-64.7	-44.9	179.9	-51.2	0	0	0	0	111.8	R116 Y117 L118 N123 L124	R116-T120 PolarHBondContact O-N 3.33Å; R116-T120 PolarHBondContact O-OG1 3.46Å; Y117-T120 WeakPolarHBondContact O-CB 3.5Å; Y117-T120 PolarHBondContact O-N 3.09Å; L118-T120 PolarHBondContact O-N 3.02Å; T120-N123 PolarHBondContact O-N 2.95Å; T120-L124 HydrophobicContact CG2-CD1 3.91Å; T120-L124 WeakPolarHBondContact O-CB 3.4Å; T120-L124 WeakPolarHBondContact O-CG 3.48Å; T120-L124 PolarHBondContact O-N 2.96Å
121	E	78.6	Confident	77	Confident	57 Å²	57	83.9 Å²	83.9	27%	0.266	39%	0.387	S	S	.	.	H	α-helix	trans	-63.1	-43.1	176.8	-80.8	-137.7	101.8	0	0	112.7	Y117 L118 L124 K125	Y117-E121 HydrophobicContact CD1-CG 4.41Å; Y117-E121 HydrophobicContact CE1-CG 3.77Å; Y117-E121 VanDerWaalsContact CE1-OE2 3.23Å; Y117-E121 WeakPolarHBondContact CE1-OE2 3.47Å; Y117-E121 HydrophobicContact CE2-CG 4.06Å; Y117-E121 VanDerWaalsContact CZ-CD 3.48Å; Y117-E121 PolarHBondContact O-N 3.01Å; Y117-E121 PolarHBondContact OH-OE1 2.98Å; Y117-E121 PolarHBondContact OH-OE2 3.49Å; L118-E121 PolarHBondContact O-N 3.43Å; E121-L124 PolarHBondContact O-N 3.35Å; E121-K125 WeakPolarHBondContact O-CB 3.38Å; E121-K125 PolarHBondContact O-N 3.24Å; E121-K125 IonicContact OE1-NZ 3.92Å; E121-K125 PolarHBondContact OE1-NZ 3.39Å
122	Y	70.7	Confident	75.1	Confident	76 Å²	76	88.2 Å²	88.2	30%	0.298	41%	0.408	S	S	.	.	H	α-helix	trans	-66	-40.1	179.1	-86.7	-76.8	0	0	0	112.2	N69 N73 L118 T119 I126 C127	N69-Y122 HydrophobicContact CB-CD1 4.43Å; N69-Y122 HydrophobicContact CB-CE1 4.16Å; N73-Y122 WeakPolarHBondContact ND2-CD2 3.38Å; L118-Y122 VanDerWaalsContact O-CD2 3.25Å; L118-Y122 WeakPolarHBondContact O-CD2 3.4Å; L118-Y122 PolarHBondContact O-N 2.97Å; T119-Y122 PolarHBondContact O-N 3.34Å; Y122-I126 PolarHBondContact O-N 2.91Å; Y122-C127 PolarHBondContact O-N 3.15Å
123	N	70.5	Confident	73.3	Confident	64 Å²	64	90.6 Å²	90.6	34%	0.342	42%	0.415	S	S	.	.	H	α-helix	trans	-58.6	-50.2	172.8	-97.3	-33.7	0	0	0	111.6	M70 T119 T120	M70-N123 PolarHBondContact SD-OD1 2.93Å; T119-N123 WeakPolarHBondContact O-CB 3.46Å; T119-N123 PolarHBondContact O-N 3.45Å; T120-N123 PolarHBondContact O-N 2.95Å
124	L	65.5	Low	71.4	Confident	130 Å²	130	89.7 Å²	89.7	68%	0.681	42%	0.417	S	S	*	.	H	α-helix	trans	-71.9	-33.5	-174.2	-72.8	170.1	0	0	0	114.1	T120 E121	T120-L124 HydrophobicContact CG2-CD1 3.91Å; T120-L124 WeakPolarHBondContact O-CB 3.4Å; T120-L124 WeakPolarHBondContact O-CG 3.48Å; T120-L124 PolarHBondContact O-N 2.96Å; E121-L124 PolarHBondContact O-N 3.35Å
125	K	64.2	Low	69.6	Low	150 Å²	150	94.6 Å²	94.6	65%	0.652	44%	0.439	S	S	*	.	H	α-helix	trans	-95.7	-27.4	-168.8	-77.6	-179.8	172.8	162	0	115.2	E121	E121-K125 WeakPolarHBondContact O-CB 3.38Å; E121-K125 PolarHBondContact O-N 3.24Å; E121-K125 IonicContact OE1-NZ 3.92Å; E121-K125 PolarHBondContact OE1-NZ 3.39Å
126	I	60.4	Low	68.2	Low	74 Å²	74	99.2 Å²	99.2	38%	0.379	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.6	-44.1	-163.1	-55.8	179.4	0	0	0	112.8	C66 Y122 D128	C66-I126 HydrophobicContact CB-CB 4.45Å; C66-I126 HydrophobicContact CB-CG2 3.77Å; C66-I126 VanDerWaalsContact SG-CB 3.54Å; C66-I126 VanDerWaalsContact SG-CG2 3.53Å; Y122-I126 PolarHBondContact O-N 2.91Å; I126-D128 PolarHBondContact O-N 3.18Å
127	C	62.2	Low	66.7	Low	10 Å²	10	96.8 Å²	96.8	7%	0.068	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-77.4	-17.8	-168.3	-77.5	0	0	0	0	114.2	C66 M70 Y122 K129 L130	C66-C127 HydrophobicContact CB-CB 4.44Å; C66-C127 WeakPolarHBondContact CB-SG 3.39Å; C66-C127 PolarHBondContact O-SG 3.44Å; C66-C127 VanDerWaalsContact O-SG 3.4Å; C66-C127 WeakPolarHBondContact SG-CA 3.47Å; C66-C127 WeakPolarHBondContact SG-CB 3.36Å; C66-C127 PolarHBondContact SG-N 3.24Å; C66-C127 CovalentContact SG-SG 2.06Å; C66-C127 PolarHBondContact SG-SG 2.89Å; M70-C127 HydrophobicContact SD-CB 4.5Å; Y122-C127 PolarHBondContact O-N 3.15Å; C127-K129 PolarHBondContact O-N 3.39Å; C127-L130 HydrophobicContact CB-CD1 4.15Å; C127-L130 VanDerWaalsContact O-CB 3.29Å; C127-L130 WeakPolarHBondContact O-CB 3.37Å; C127-L130 PolarHBondContact O-N 3.42Å
128	D	58.1	Low	65.2	Low	93 Å²	93	92.1 Å²	92.1	50%	0.497	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-60	-19.2	177.2	-104.7	-20	0	0	0	113.6	I126 L130 K131	I126-D128 PolarHBondContact O-N 3.18Å; D128-L130 VanDerWaalsContact C-N 3.3Å; D128-L130 PolarHBondContact O-N 3.04Å; D128-K131 WeakPolarHBondContact OD1-CE 3.37Å; D128-K131 IonicContact OD1-NZ 3.67Å; D128-K131 PolarHBondContact OD1-NZ 2.84Å
129	K	58.9	Low	64.2	Low	144 Å²	144	94 Å²	94	63%	0.626	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-75.4	-15.2	174.5	-65	-171.8	179.7	-179.6	0	114	C127 K131 E132	C127-K129 PolarHBondContact O-N 3.39Å; K129-K131 PolarHBondContact O-N 3.19Å; K129-E132 PolarHBondContact O-N 3.41Å
130	L	56.5	Low	63.4	Low	18 Å²	18	97.1 Å²	97.1	9%	0.094	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-65.8	-22.1	174	-81.3	155.4	0	0	0	113	D63 L67 C127 D128 E132 Y133	D63-L130 HydrophobicContact CB-CD2 3.51Å; D63-L130 HydrophobicContact CB-CG 3.8Å; D63-L130 WeakPolarHBondContact O-CD1 3.36Å; L67-L130 HydrophobicContact CB-CD1 3.77Å; L67-L130 HydrophobicContact CD1-CD1 4.36Å; L67-L130 HydrophobicContact CG-CD1 4.49Å; C127-L130 HydrophobicContact CB-CD1 4.15Å; C127-L130 VanDerWaalsContact O-CB 3.29Å; C127-L130 WeakPolarHBondContact O-CB 3.37Å; C127-L130 PolarHBondContact O-N 3.42Å; D128-L130 VanDerWaalsContact C-N 3.3Å; D128-L130 PolarHBondContact O-N 3.04Å; L130-E132 PolarHBondContact O-N 2.88Å; L130-Y133 HydrophobicContact CD2-CD2 4.44Å; L130-Y133 PolarHBondContact O-N 3.34Å
131	K	53.3	Low	62.6	Low	170 Å²	170	96.3 Å²	96.3	74%	0.739	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-62.2	-10.8	177	-68.4	177.5	177.6	154	0	113.4	D128 K129	D128-K131 WeakPolarHBondContact OD1-CE 3.37Å; D128-K131 IonicContact OD1-NZ 3.67Å; D128-K131 PolarHBondContact OD1-NZ 2.84Å; K129-K131 PolarHBondContact O-N 3.19Å
132	E	55.6	Low	62	Low	173 Å²	173	95.8 Å²	95.8	81%	0.808	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-88.1	-5.1	175.7	-64.9	-176.4	-179.7	0	0	113.8	K129 L130	K129-E132 PolarHBondContact O-N 3.41Å; L130-E132 PolarHBondContact O-N 2.88Å
133	Y	56.5	Low	62.1	Low	70 Å²	70	97.9 Å²	97.9	28%	0.275	49%	0.487	S	S	.	.	S	Bend	trans	-97.7	157	178.1	-68.2	-87.5	0	0	0	111.8	L60 D63 L130 E135	L60-Y133 HydrophobicContact CB-CE1 4.29Å; L60-Y133 HydrophobicContact CD1-CD1 3.42Å; L60-Y133 VanDerWaalsContact CD1-CD1 3.42Å; L60-Y133 HydrophobicContact CD1-CE1 3.43Å; L60-Y133 VanDerWaalsContact CD1-CE1 3.43Å; L60-Y133 HydrophobicContact CD1-CG 4.11Å; L60-Y133 HydrophobicContact CG-CE1 4.49Å; D63-Y133 HydrophobicContact CB-CE2 4.49Å; D63-Y133 WeakPolarHBondContact OD2-CE2 3.44Å; D63-Y133 PolarHBondContact OD2-OH 3.08Å; L130-Y133 HydrophobicContact CD2-CD2 4.44Å; L130-Y133 PolarHBondContact O-N 3.34Å; Y133-E135 PolarHBondContact O-N 2.99Å
134	D	55.9	Low	62.2	Low	127 Å²	127	102.2 Å²	102.2	68%	0.679	50%	0.499	S	S	*	.			trans	-53.6	122.9	-176.3	-152.1	-25.4	0	0	0	111.1	H136 D137 T138	D134-H136 PolarHBondContact O-N 3.12Å; D134-H136 VanDerWaalsContact O-N 3.12Å; D134-D137 PolarHBondContact O-N 3.49Å; D134-T138 PolarHBondContact O-OG1 3.44Å
135	E	58.1	Low	62.4	Low	155 Å²	155	96.7 Å²	96.7	72%	0.724	47%	0.47	S	S	*	.	H	α-helix	trans	-56.8	-31.1	-172.4	-89	177.9	159.2	0	0	111.9	Y133 T138 D139	Y133-E135 PolarHBondContact O-N 2.99Å; E135-T138 WeakPolarHBondContact CA-OG1 3.4Å; E135-T138 PolarHBondContact O-OG1 3.47Å; E135-D139 WeakPolarHBondContact O-CB 3.49Å; E135-D139 PolarHBondContact O-N 2.99Å
136	H	63.3	Low	62.8	Low	129 Å²	129	98.5 Å²	98.5	60%	0.597	47%	0.473	S	S	*	.	H	α-helix	trans	-68.4	-46.5	-174.2	-167.8	60.4	0	0	0	113.7	D134 T138 D139 V140	D134-H136 PolarHBondContact O-N 3.12Å; D134-H136 VanDerWaalsContact O-N 3.12Å; H136-T138 VanDerWaalsContact C-N 3.3Å; H136-T138 PolarHBondContact O-N 3.43Å; H136-D139 PolarHBondContact O-N 3.4Å; H136-V140 WeakPolarHBondContact O-CG2 3.31Å; H136-V140 PolarHBondContact O-N 2.89Å
137	D	61.1	Low	63.5	Low	121 Å²	121	97.5 Å²	97.5	65%	0.647	47%	0.472	S	S	*	.	H	α-helix	trans	-68.5	-35.3	-178.1	-78.1	-18.2	0	0	0	111.1	D134 L141	D134-D137 PolarHBondContact O-N 3.49Å; D137-L141 WeakPolarHBondContact O-CB 3.44Å; D137-L141 PolarHBondContact O-N 3.33Å; D137-L141 VanDerWaalsContact O-N 3.15Å
138	T	62	Low	64	Low	37 Å²	37	100.4 Å²	100.4	23%	0.227	49%	0.485	C	S	.	.	H	α-helix	trans	-69.2	-38.9	175.7	44.6	0	0	0	0	111.7	D134 E135 H136 S142	D134-T138 PolarHBondContact O-OG1 3.44Å; E135-T138 WeakPolarHBondContact CA-OG1 3.4Å; E135-T138 PolarHBondContact O-OG1 3.47Å; H136-T138 VanDerWaalsContact C-N 3.3Å; H136-T138 PolarHBondContact O-N 3.43Å; T138-S142 VanDerWaalsContact O-CB 3.26Å; T138-S142 WeakPolarHBondContact O-CB 3.33Å; T138-S142 PolarHBondContact O-N 2.97Å
139	D	66.3	Low	64.9	Low	94 Å²	94	97.8 Å²	97.8	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-63.8	-46.4	174.1	-84.6	-14.4	0	0	0	112.8	E135 H136 L141 S142 I143	E135-D139 WeakPolarHBondContact O-CB 3.49Å; E135-D139 PolarHBondContact O-N 2.99Å; H136-D139 PolarHBondContact O-N 3.4Å; D139-L141 VanDerWaalsContact C-N 3.33Å; D139-L141 PolarHBondContact O-N 3.26Å; D139-S142 WeakPolarHBondContact O-CB 3.43Å; D139-S142 PolarHBondContact O-N 3.44Å; D139-I143 WeakPolarHBondContact O-CB 3.31Å; D139-I143 VanDerWaalsContact O-CG1 3.28Å; D139-I143 WeakPolarHBondContact O-CG1 3.44Å; D139-I143 PolarHBondContact O-N 2.9Å
140	V	69.8	Low	65.7	Low	78 Å²	78	94.2 Å²	94.2	47%	0.473	46%	0.46	S	S	.	.	H	α-helix	trans	-60.5	-45.1	178.6	171.7	0	0	0	0	110.9	H136 I143 W144	H136-V140 WeakPolarHBondContact O-CG2 3.31Å; H136-V140 PolarHBondContact O-N 2.89Å; V140-I143 PolarHBondContact O-N 2.99Å; V140-W144 WeakPolarHBondContact O-CB 3.48Å; V140-W144 PolarHBondContact O-N 2.95Å
141	L	66.2	Low	66.5	Low	53 Å²	53	99 Å²	99	28%	0.277	48%	0.482	S	S	.	.	H	α-helix	trans	-62.7	-44.8	177.3	-168	74.8	0	0	0	110.8	V64 L67 D137 D139 I143 W144 T145	V64-L141 HydrophobicContact CG1-CD2 4.19Å; L67-L141 HydrophobicContact CD2-CD2 3.81Å; D137-L141 WeakPolarHBondContact O-CB 3.44Å; D137-L141 PolarHBondContact O-N 3.33Å; D137-L141 VanDerWaalsContact O-N 3.15Å; D139-L141 VanDerWaalsContact C-N 3.33Å; D139-L141 PolarHBondContact O-N 3.26Å; L141-I143 PolarHBondContact O-N 3.14Å; L141-W144 PolarHBondContact O-N 3.44Å; L141-T145 WeakPolarHBondContact O-CB 3.41Å; L141-T145 PolarHBondContact O-N 2.92Å; L141-T145 PolarHBondContact O-OG1 3.4Å
142	S	67.4	Low	67.5	Low	46 Å²	46	94.6 Å²	94.6	32%	0.322	47%	0.465	S	S	.	.	H	α-helix	trans	-58.2	-47.7	176.7	-177.7	0	0	0	0	112.1	T138 D139 T145 R146	T138-S142 VanDerWaalsContact O-CB 3.26Å; T138-S142 WeakPolarHBondContact O-CB 3.33Å; T138-S142 PolarHBondContact O-N 2.97Å; D139-S142 WeakPolarHBondContact O-CB 3.43Å; D139-S142 PolarHBondContact O-N 3.44Å; S142-T145 PolarHBondContact O-N 2.99Å; S142-R146 VanDerWaalsContact O-CB 3.26Å; S142-R146 WeakPolarHBondContact O-CB 3.46Å; S142-R146 PolarHBondContact O-N 3.32Å
143	I	73	Confident	68.6	Low	120 Å²	120	87.5 Å²	87.5	62%	0.615	44%	0.435	S	S	*	.	H	α-helix	trans	-62.2	-48.2	177.8	-69.5	166.6	0	0	0	110.8	D139 V140 L141 R146 S147	D139-I143 WeakPolarHBondContact O-CB 3.31Å; D139-I143 VanDerWaalsContact O-CG1 3.28Å; D139-I143 WeakPolarHBondContact O-CG1 3.44Å; D139-I143 PolarHBondContact O-N 2.9Å; V140-I143 PolarHBondContact O-N 2.99Å; L141-I143 PolarHBondContact O-N 3.14Å; I143-R146 PolarHBondContact O-N 3.01Å; I143-S147 PolarHBondContact O-N 3.11Å
144	W	72.8	Confident	69.8	Low	155 Å²	155	89.2 Å²	89.2	59%	0.587	45%	0.445	S	S	*	.	H	α-helix	trans	-61.4	-48.5	-179.9	178.8	84.9	0	0	0	111.3	V140 L141 R146 S147 Q148	V140-W144 WeakPolarHBondContact O-CB 3.48Å; V140-W144 PolarHBondContact O-N 2.95Å; L141-W144 PolarHBondContact O-N 3.44Å; W144-R146 VanDerWaalsContact C-N 3.29Å; W144-R146 PolarHBondContact O-N 3.05Å; W144-S147 WeakPolarHBondContact O-CB 3.48Å; W144-S147 PolarHBondContact O-N 2.97Å; W144-Q148 HydrophobicContact CD2-CG 4.08Å; W144-Q148 HydrophobicContact CE3-CG 4.36Å; W144-Q148 HydrophobicContact CH2-CG 4.04Å; W144-Q148 HydrophobicContact CZ2-CG 3.72Å; W144-Q148 HydrophobicContact CZ3-CG 4.35Å; W144-Q148 WeakPolarHBondContact O-CG 3.42Å; W144-Q148 PolarHBondContact O-N 3.3Å
145	T	68.5	Low	71	Confident	14 Å²	14	89.5 Å²	89.5	9%	0.086	44%	0.441	C	S	.	.	H	α-helix	trans	-61	-40.6	178.3	-58.4	0	0	0	0	111.2	L71 L141 S142 S147 Q148 H149	L71-T145 HydrophobicContact CB-CG2 3.88Å; L71-T145 HydrophobicContact CD1-CG2 3.58Å; L71-T145 HydrophobicContact CG-CG2 4.3Å; L141-T145 WeakPolarHBondContact O-CB 3.41Å; L141-T145 PolarHBondContact O-N 2.92Å; L141-T145 PolarHBondContact O-OG1 3.4Å; S142-T145 PolarHBondContact O-N 2.99Å; T145-S147 PolarHBondContact O-N 3.32Å; T145-Q148 PolarHBondContact O-N 3.16Å; T145-H149 WeakPolarHBondContact O-CB 3.04Å; T145-H149 VanDerWaalsContact O-CG 3.23Å; T145-H149 PolarHBondContact O-N 3.13Å
146	R	72.6	Confident	72.1	Confident	188 Å²	188	84.6 Å²	84.6	71%	0.709	42%	0.42	S	S	*	.	H	α-helix	trans	-64.2	-39.9	176.4	-163	174.8	-166	161.9	5	112.6	S142 I143 W144 H149 T150	S142-R146 VanDerWaalsContact O-CB 3.26Å; S142-R146 WeakPolarHBondContact O-CB 3.46Å; S142-R146 PolarHBondContact O-N 3.32Å; I143-R146 PolarHBondContact O-N 3.01Å; W144-R146 VanDerWaalsContact C-N 3.29Å; W144-R146 PolarHBondContact O-N 3.05Å; R146-H149 WeakPolarHBondContact O-CB 3.29Å; R146-H149 PolarHBondContact O-N 3.45Å; R146-T150 PolarHBondContact O-N 3.15Å; R146-T150 VanDerWaalsContact O-N 3.09Å; R146-T150 PolarHBondContact O-OG1 3.28Å
147	S	75.3	Confident	73.2	Confident	52 Å²	52	79.7 Å²	79.7	36%	0.364	40%	0.398	S	S	.	.	H	α-helix	trans	-62.2	-47.4	174.4	170.9	0	0	0	0	111.5	I143 W144 T145 H149 T150 H151	I143-S147 PolarHBondContact O-N 3.11Å; W144-S147 WeakPolarHBondContact O-CB 3.48Å; W144-S147 PolarHBondContact O-N 2.97Å; T145-S147 PolarHBondContact O-N 3.32Å; S147-H149 VanDerWaalsContact C-N 3.3Å; S147-H149 PolarHBondContact O-N 2.97Å; S147-T150 PolarHBondContact O-N 3.07Å; S147-H151 PolarHBondContact O-CD2 3.44Å; S147-H151 PolarHBondContact O-N 3.49Å
148	Q	72.5	Confident	74.4	Confident	71 Å²	71	78.1 Å²	78.1	33%	0.332	39%	0.389	S	S	.	.	H	α-helix	trans	-60.6	-41.5	176.3	-64.5	-51.6	-54.8	0	0	111.7	W144 T145 T150 H151 I152	W144-Q148 HydrophobicContact CD2-CG 4.08Å; W144-Q148 HydrophobicContact CE3-CG 4.36Å; W144-Q148 HydrophobicContact CH2-CG 4.04Å; W144-Q148 HydrophobicContact CZ2-CG 3.72Å; W144-Q148 HydrophobicContact CZ3-CG 4.35Å; W144-Q148 WeakPolarHBondContact O-CG 3.42Å; W144-Q148 PolarHBondContact O-N 3.3Å; T145-Q148 PolarHBondContact O-N 3.16Å; Q148-T150 PolarHBondContact O-N 3.27Å; Q148-H151 PolarHBondContact O-N 3.39Å; Q148-I152 VanDerWaalsContact O-CG1 3.23Å; Q148-I152 WeakPolarHBondContact O-CG1 3.33Å; Q148-I152 PolarHBondContact O-N 3.06Å
149	H	76.3	Confident	75.6	Confident	38 Å²	38	80.9 Å²	80.9	18%	0.176	40%	0.402	C	S	.	.	H	α-helix	trans	-58.1	-45.1	176.2	-77.1	172.1	0	0	0	113	L71 Y75 T145 R146 S147 H151 I152 S153	L71-H149 VanDerWaalsContact C-CE1 3.47Å; L71-H149 PolarHBondContact O-CE1 3.33Å; Y75-H149 HydrophobicContact CD2-CB 3.72Å; Y75-H149 AromaticContact CD2-CD2 3.69Å; Y75-H149 AromaticContact CD2-CG 3.68Å; Y75-H149 HydrophobicContact CE2-CB 4.41Å; Y75-H149 WeakPolarHBondContact CE2-O 3.41Å; Y75-H149 AromaticContact CG-CD2 3.78Å; T145-H149 WeakPolarHBondContact O-CB 3.04Å; T145-H149 VanDerWaalsContact O-CG 3.23Å; T145-H149 PolarHBondContact O-N 3.13Å; R146-H149 WeakPolarHBondContact O-CB 3.29Å; R146-H149 PolarHBondContact O-N 3.45Å; S147-H149 VanDerWaalsContact C-N 3.3Å; S147-H149 PolarHBondContact O-N 2.97Å; H149-H151 VanDerWaalsContact C-N 3.33Å; H149-H151 PolarHBondContact O-N 3.26Å; H149-I152 PolarHBondContact O-N 3.1Å; H149-S153 VanDerWaalsContact O-CB 3.32Å; H149-S153 WeakPolarHBondContact O-CB 3.49Å; H149-S153 PolarHBondContact O-N 3.31Å; H149-S153 PolarHBondContact O-OG 3.47Å
150	T	76.5	Confident	76.7	Confident	69 Å²	69	77.6 Å²	77.6	42%	0.423	38%	0.383	S	S	.	.	H	α-helix	trans	-58.8	-45.9	177.1	-59.7	0	0	0	0	111.6	R146 S147 Q148 S153 H154	R146-T150 PolarHBondContact O-N 3.15Å; R146-T150 VanDerWaalsContact O-N 3.09Å; R146-T150 PolarHBondContact O-OG1 3.28Å; S147-T150 PolarHBondContact O-N 3.07Å; Q148-T150 PolarHBondContact O-N 3.27Å; T150-S153 PolarHBondContact O-N 2.83Å; T150-H154 PolarHBondContact O-N 2.95Å; T150-H154 PolarHBondContact O-ND1 3.23Å
151	H	73.7	Confident	77.7	Confident	119 Å²	119	78.5 Å²	78.5	55%	0.551	38%	0.381	S	S	*	.	H	α-helix	trans	-64.1	-45.4	179.6	-71.2	-63.3	0	0	0	112.7	S147 Q148 H149 S153 H154 F155	S147-H151 PolarHBondContact O-CD2 3.44Å; S147-H151 PolarHBondContact O-N 3.49Å; Q148-H151 PolarHBondContact O-N 3.39Å; H149-H151 VanDerWaalsContact C-N 3.33Å; H149-H151 PolarHBondContact O-N 3.26Å; H151-S153 VanDerWaalsContact C-N 3.34Å; H151-H154 PolarHBondContact O-N 3.46Å; H151-F155 PolarHBondContact O-N 3.41Å; H151-F155 VanDerWaalsContact O-N 3.1Å
152	I	74.5	Confident	78.8	Confident	77 Å²	77	84 Å²	84	40%	0.395	40%	0.399	S	S	.	.	H	α-helix	trans	-69.1	-35.4	-179.4	-59.6	167.9	0	0	0	110.4	Y75 Q148 H149 N156	Y75-I152 HydrophobicContact CE2-CB 4.26Å; Y75-I152 HydrophobicContact CE2-CG2 4.36Å; Y75-I152 VanDerWaalsContact OH-CG2 3.29Å; Y75-I152 WeakPolarHBondContact OH-CG2 3.33Å; Y75-I152 PolarHBondContact OH-O 3.42Å; Q148-I152 VanDerWaalsContact O-CG1 3.23Å; Q148-I152 WeakPolarHBondContact O-CG1 3.33Å; Q148-I152 PolarHBondContact O-N 3.06Å; H149-I152 PolarHBondContact O-N 3.1Å; I152-N156 WeakPolarHBondContact CG2-ND2 3.29Å; I152-N156 WeakPolarHBondContact O-CB 3.11Å; I152-N156 PolarHBondContact O-N 3.44Å; I152-N156 PolarHBondContact O-ND2 2.82Å
153	S	78.1	Confident	79.9	Confident	24 Å²	24	89.7 Å²	89.7	17%	0.168	41%	0.413	C	S	.	.	H	α-helix	trans	-59.5	-54.6	172.5	-82.6	0	0	0	0	111.4	Y75 H149 T150 H151 F155 N156 L157	Y75-S153 WeakPolarHBondContact CE2-OG 3.2Å; Y75-S153 PolarHBondContact OH-N 3.42Å; H149-S153 VanDerWaalsContact O-CB 3.32Å; H149-S153 WeakPolarHBondContact O-CB 3.49Å; H149-S153 PolarHBondContact O-N 3.31Å; H149-S153 PolarHBondContact O-OG 3.47Å; T150-S153 PolarHBondContact O-N 2.83Å; H151-S153 VanDerWaalsContact C-N 3.34Å; S153-F155 VanDerWaalsContact C-N 3.31Å; S153-F155 PolarHBondContact O-N 3.39Å; S153-N156 PolarHBondContact O-N 3Å; S153-N156 VanDerWaalsContact O-N 3.16Å; S153-L157 WeakPolarHBondContact O-CB 3.34Å; S153-L157 VanDerWaalsContact O-CG 3.26Å; S153-L157 WeakPolarHBondContact O-CG 3.5Å; S153-L157 PolarHBondContact O-N 3.48Å
154	H	81.1	Confident	80.6	Confident	107 Å²	107	84 Å²	84	50%	0.495	38%	0.384	S	S	.	.	H	α-helix	trans	-57.3	-45.4	-179.7	-67.8	156.9	0	0	0	111.9	T150 H151 N156 L157 D158	T150-H154 PolarHBondContact O-N 2.95Å; T150-H154 PolarHBondContact O-ND1 3.23Å; H151-H154 PolarHBondContact O-N 3.46Å; H154-N156 PolarHBondContact O-N 3.43Å; H154-L157 PolarHBondContact O-N 3.26Å; H154-D158 WeakPolarHBondContact O-CB 3.45Å; H154-D158 PolarHBondContact O-N 3.36Å
155	F	82.9	Confident	81.4	Confident	132 Å²	132	78.9 Å²	78.9	58%	0.579	37%	0.368	S	S	*	.	H	α-helix	trans	-57.5	-47.1	176.6	177.2	-95.7	0	0	0	112.6	H151 S153 L159	H151-F155 PolarHBondContact O-N 3.41Å; H151-F155 VanDerWaalsContact O-N 3.1Å; S153-F155 VanDerWaalsContact C-N 3.31Å; S153-F155 PolarHBondContact O-N 3.39Å; F155-L159 HydrophobicContact CE1-CD2 4.19Å; F155-L159 VanDerWaalsContact O-CB 3.27Å; F155-L159 WeakPolarHBondContact O-CB 3.31Å; F155-L159 PolarHBondContact O-N 2.9Å
156	N	79.6	Confident	82.5	Confident	53 Å²	53	81 Å²	81	28%	0.283	38%	0.384	S	S	.	.	H	α-helix	trans	-68.2	-38	-179.5	-80.8	-53.9	0	0	0	112.8	Y75 L79 I152 S153 H154 F160	Y75-N156 PolarHBondContact OH-ND2 2.91Å; L79-N156 HydrophobicContact CD1-CB 3.95Å; L79-N156 HydrophobicContact CD2-CB 4.29Å; I152-N156 WeakPolarHBondContact CG2-ND2 3.29Å; I152-N156 WeakPolarHBondContact O-CB 3.11Å; I152-N156 PolarHBondContact O-N 3.44Å; I152-N156 PolarHBondContact O-ND2 2.82Å; S153-N156 PolarHBondContact O-N 3Å; S153-N156 VanDerWaalsContact O-N 3.16Å; H154-N156 PolarHBondContact O-N 3.43Å; N156-F160 VanDerWaalsContact O-CB 3.31Å; N156-F160 WeakPolarHBondContact O-CB 2.76Å; N156-F160 PolarHBondContact O-N 3.48Å
157	L	86.5	Confident	83.3	Confident	26 Å²	26	73.9 Å²	73.9	14%	0.136	36%	0.358	C	S	.	.	H	α-helix	trans	-64.7	-46.5	176.7	-67.8	172.9	0	0	0	111.1	L79 E82 L83 V86 S153 H154 F160 K161	L79-L157 HydrophobicContact CD1-CD2 3.98Å; L79-L157 HydrophobicContact CD1-CG 4.18Å; E82-L157 HydrophobicContact CB-CD1 4.48Å; E82-L157 HydrophobicContact CB-CD2 3.94Å; E82-L157 HydrophobicContact CG-CD1 3.71Å; E82-L157 HydrophobicContact CG-CD2 3.74Å; E82-L157 HydrophobicContact CG-CG 4.4Å; L83-L157 HydrophobicContact CD2-CD2 3.86Å; L83-L157 HydrophobicContact CG-CD2 4.17Å; V86-L157 HydrophobicContact CG2-CD2 4Å; S153-L157 WeakPolarHBondContact O-CB 3.34Å; S153-L157 VanDerWaalsContact O-CG 3.26Å; S153-L157 WeakPolarHBondContact O-CG 3.5Å; S153-L157 PolarHBondContact O-N 3.48Å; H154-L157 PolarHBondContact O-N 3.26Å; L157-F160 PolarHBondContact O-N 2.81Å; L157-K161 WeakPolarHBondContact O-CB 2.76Å; L157-K161 PolarHBondContact O-N 3.19Å
158	D	86.2	Confident	83.9	Confident	87 Å²	87	72.4 Å²	72.4	47%	0.465	35%	0.346	S	S	.	.	H	α-helix	trans	-62.1	-48.3	176.9	-77.2	-23.1	0	0	0	111	H154 F160 K161 Y162	H154-D158 WeakPolarHBondContact O-CB 3.45Å; H154-D158 PolarHBondContact O-N 3.36Å; D158-F160 VanDerWaalsContact C-N 3.29Å; D158-F160 PolarHBondContact O-N 3Å; D158-K161 WeakPolarHBondContact O-CB 3.18Å; D158-K161 PolarHBondContact O-N 3.42Å; D158-Y162 HydrophobicContact CB-CE2 4.42Å; D158-Y162 WeakPolarHBondContact O-CD2 3.44Å; D158-Y162 PolarHBondContact O-N 3.44Å
159	L	87.3	Confident	84.6	Confident	96 Å²	96	71.2 Å²	71.2	50%	0.503	35%	0.349	S	S	.	.	H	α-helix	trans	-57.1	-44	177.8	-177	66.3	0	0	0	111.6	F155 R163	F155-L159 HydrophobicContact CE1-CD2 4.19Å; F155-L159 VanDerWaalsContact O-CB 3.27Å; F155-L159 WeakPolarHBondContact O-CB 3.31Å; F155-L159 PolarHBondContact O-N 2.9Å; L159-R163 WeakPolarHBondContact O-CB 3.49Å; L159-R163 PolarHBondContact O-N 2.96Å
160	F	90.2	Very high	85.2	Confident	25 Å²	25	74.8 Å²	74.8	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-44.1	177.8	177.6	-105.1	0	0	0	112	L83 V86 V87 W104 F108 N156 L157 D158 Y162 R163 F164	L83-F160 HydrophobicContact CD2-CB 3.59Å; L83-F160 HydrophobicContact CD2-CD1 3.44Å; L83-F160 VanDerWaalsContact CD2-CD1 3.44Å; L83-F160 HydrophobicContact CD2-CD2 4.27Å; L83-F160 HydrophobicContact CD2-CE1 4.17Å; L83-F160 HydrophobicContact CD2-CG 3.49Å; L83-F160 VanDerWaalsContact CD2-CG 3.49Å; V86-F160 HydrophobicContact CB-CD1 4.39Å; V86-F160 HydrophobicContact CB-CE1 4.5Å; V86-F160 HydrophobicContact CG1-CD1 3.86Å; V86-F160 HydrophobicContact CG1-CE1 4.11Å; V87-F160 HydrophobicContact CG2-CE1 3.67Å; V87-F160 HydrophobicContact CG2-CZ 3.67Å; W104-F160 HydrophobicContact CD2-CE2 4.39Å; W104-F160 AromaticContact CE3-CE2 3.77Å; W104-F160 HydrophobicContact CE3-CE2 3.77Å; W104-F160 AromaticContact CE3-CZ 3.65Å; W104-F160 HydrophobicContact CE3-CZ 3.65Å; W104-F160 AromaticContact CZ3-CE2 3.95Å; W104-F160 HydrophobicContact CZ3-CE2 3.95Å; W104-F160 HydrophobicContact CZ3-CZ 4.01Å; F108-F160 HydrophobicContact CE2-CE1 4.26Å; F108-F160 AromaticContact CE2-CE2 3.99Å; F108-F160 HydrophobicContact CE2-CE2 3.99Å; F108-F160 AromaticContact CE2-CZ 3.66Å; F108-F160 HydrophobicContact CE2-CZ 3.66Å; F108-F160 HydrophobicContact CZ-CD2 4.37Å; F108-F160 AromaticContact CZ-CE2 3.75Å; F108-F160 HydrophobicContact CZ-CE2 3.75Å; F108-F160 AromaticContact CZ-CZ 3.94Å; F108-F160 HydrophobicContact CZ-CZ 3.94Å; N156-F160 VanDerWaalsContact O-CB 3.31Å; N156-F160 WeakPolarHBondContact O-CB 2.76Å; N156-F160 PolarHBondContact O-N 3.48Å; L157-F160 PolarHBondContact O-N 2.81Å; D158-F160 VanDerWaalsContact C-N 3.29Å; D158-F160 PolarHBondContact O-N 3Å; F160-Y162 VanDerWaalsContact C-N 3.35Å; F160-Y162 PolarHBondContact O-N 3.16Å; F160-R163 PolarHBondContact O-N 2.96Å; F160-R163 VanDerWaalsContact O-N 3.17Å; F160-F164 HydrophobicContact CE1-CD2 4.28Å; F160-F164 HydrophobicContact CZ-CD2 4.34Å; F160-F164 PolarHBondContact O-N 2.7Å
161	K	90.4	Very high	85.5	Confident	96 Å²	96	75.6 Å²	75.6	42%	0.417	37%	0.365	S	S	.	.	H	α-helix	trans	-56.8	-47.9	175.6	177.8	173.7	-177.3	178.8	0	111.4	V86 I90 L157 D158 R163 F164 L165	V86-K161 HydrophobicContact CG1-CB 4.21Å; I90-K161 HydrophobicContact CD1-CG 4.14Å; L157-K161 WeakPolarHBondContact O-CB 2.76Å; L157-K161 PolarHBondContact O-N 3.19Å; D158-K161 WeakPolarHBondContact O-CB 3.18Å; D158-K161 PolarHBondContact O-N 3.42Å; K161-R163 VanDerWaalsContact C-N 3.35Å; K161-R163 PolarHBondContact O-N 3.29Å; K161-F164 PolarHBondContact O-N 3.45Å; K161-L165 HydrophobicContact CG-CD1 3.98Å; K161-L165 WeakPolarHBondContact O-CB 3.23Å; K161-L165 VanDerWaalsContact O-CG 3.28Å; K161-L165 WeakPolarHBondContact O-CG 3.44Å; K161-L165 PolarHBondContact O-N 3.5Å
162	Y	90	Very high	85.7	Confident	168 Å²	168	75.6 Å²	75.6	66%	0.659	37%	0.373	S	S	*	.	H	α-helix	trans	-60.1	-44	175.6	-78.8	-65.3	0	0	0	112.1	D158 F160 S166	D158-Y162 HydrophobicContact CB-CE2 4.42Å; D158-Y162 WeakPolarHBondContact O-CD2 3.44Å; D158-Y162 PolarHBondContact O-N 3.44Å; F160-Y162 VanDerWaalsContact C-N 3.35Å; F160-Y162 PolarHBondContact O-N 3.16Å; Y162-S166 VanDerWaalsContact O-CB 3.29Å; Y162-S166 WeakPolarHBondContact O-CB 3.44Å; Y162-S166 PolarHBondContact O-N 2.97Å
163	R	89.2	Confident	85.7	Confident	166 Å²	166	78.4 Å²	78.4	63%	0.626	39%	0.388	S	S	*	.	H	α-helix	trans	-61.9	-45.1	177.5	-177.3	175.6	-177.1	176.7	2	111.9	L159 F160 K161 S166 E167	L159-R163 WeakPolarHBondContact O-CB 3.49Å; L159-R163 PolarHBondContact O-N 2.96Å; F160-R163 PolarHBondContact O-N 2.96Å; F160-R163 VanDerWaalsContact O-N 3.17Å; K161-R163 VanDerWaalsContact C-N 3.35Å; K161-R163 PolarHBondContact O-N 3.29Å; R163-S166 PolarHBondContact O-N 3.22Å; R163-E167 WeakPolarHBondContact O-CG 3.18Å; R163-E167 PolarHBondContact O-N 2.88Å
164	F	89.4	Confident	84.5	Confident	0 Å²	0	86.7 Å²	86.7	0%	0	43%	0.431	C	S	.	.	H	α-helix	trans	-64.1	-51.1	179.2	-169.9	-6.1	0	0	0	110.3	V87 I90 E91 Y98 W104 F160 K161 S166 E167 L168	V87-F164 HydrophobicContact CB-CE2 3.97Å; V87-F164 HydrophobicContact CG1-CE2 3.79Å; V87-F164 HydrophobicContact CG1-CZ 4.4Å; V87-F164 HydrophobicContact CG2-CD2 4.01Å; V87-F164 HydrophobicContact CG2-CE2 3.8Å; I90-F164 HydrophobicContact CB-CD2 4.44Å; I90-F164 HydrophobicContact CB-CE2 4.21Å; I90-F164 HydrophobicContact CD1-CB 4.19Å; I90-F164 HydrophobicContact CD1-CD2 3.7Å; I90-F164 HydrophobicContact CD1-CE2 4.31Å; I90-F164 HydrophobicContact CD1-CG 4.13Å; I90-F164 HydrophobicContact CG2-CD2 4.4Å; I90-F164 HydrophobicContact CG2-CE2 4.18Å; I90-F164 HydrophobicContact CG2-CZ 4.26Å; E91-F164 HydrophobicContact CG-CZ 4.22Å; Y98-F164 HydrophobicContact CD1-CD1 4Å; Y98-F164 AromaticContact CD1-CE1 3.27Å; Y98-F164 HydrophobicContact CD1-CE1 3.27Å; Y98-F164 AromaticContact CD1-CZ 3.91Å; Y98-F164 HydrophobicContact CD1-CZ 3.91Å; Y98-F164 HydrophobicContact CE1-CD1 4.27Å; Y98-F164 AromaticContact CE1-CE1 3.98Å; Y98-F164 HydrophobicContact CE1-CE1 3.98Å; Y98-F164 HydrophobicContact CG-CE1 4.01Å; W104-F164 HydrophobicContact CZ3-CB 4.03Å; W104-F164 AromaticContact CZ3-CD1 3.98Å; W104-F164 HydrophobicContact CZ3-CD1 3.98Å; W104-F164 HydrophobicContact CZ3-CD2 4.24Å; W104-F164 AromaticContact CZ3-CG 3.82Å; W104-F164 HydrophobicContact CZ3-CG 3.82Å; F160-F164 HydrophobicContact CE1-CD2 4.28Å; F160-F164 HydrophobicContact CZ-CD2 4.34Å; F160-F164 PolarHBondContact O-N 2.7Å; K161-F164 PolarHBondContact O-N 3.45Å; F164-S166 PolarHBondContact O-N 2.96Å; F164-E167 PolarHBondContact O-N 3.34Å; F164-L168 HydrophobicContact CD1-CD1 3.85Å; F164-L168 HydrophobicContact CD1-CD2 4.44Å; F164-L168 HydrophobicContact CD1-CG 3.79Å; F164-L168 HydrophobicContact CE1-CD1 3.58Å; F164-L168 HydrophobicContact CE1-CD2 3.81Å; F164-L168 HydrophobicContact CE1-CG 3.59Å; F164-L168 HydrophobicContact CZ-CD1 4.35Å; F164-L168 PolarHBondContact O-N 3.45Å
165	L	89.7	Confident	84.7	Confident	49 Å²	49	85.7 Å²	85.7	26%	0.257	43%	0.428	S	S	.	.	H	α-helix	trans	-57.8	-37.6	177.5	-67.2	172.5	0	0	0	112.6	I90 Y94 K161 L168 A169	I90-L165 HydrophobicContact CD1-CD2 4.47Å; I90-L165 HydrophobicContact CD1-CG 4.43Å; I90-L165 HydrophobicContact CG2-CD2 3.98Å; Y94-L165 HydrophobicContact CD2-CD2 4.43Å; Y94-L165 HydrophobicContact CE2-CD2 3.62Å; K161-L165 HydrophobicContact CG-CD1 3.98Å; K161-L165 WeakPolarHBondContact O-CB 3.23Å; K161-L165 VanDerWaalsContact O-CG 3.28Å; K161-L165 WeakPolarHBondContact O-CG 3.44Å; K161-L165 PolarHBondContact O-N 3.5Å; L165-L168 HydrophobicContact CD2-CD1 4.49Å; L165-L168 PolarHBondContact O-N 3.21Å; L165-A169 WeakPolarHBondContact O-CB 3.47Å; L165-A169 PolarHBondContact O-N 3.43Å
166	S	90.7	Very high	84.8	Confident	59 Å²	59	83.3 Å²	83.3	41%	0.413	42%	0.42	S	S	.	.	H	α-helix	trans	-64.3	-42.8	174.9	-178	0	0	0	0	112.6	Y162 R163 F164 L168 A169 K170	Y162-S166 VanDerWaalsContact O-CB 3.29Å; Y162-S166 WeakPolarHBondContact O-CB 3.44Å; Y162-S166 PolarHBondContact O-N 2.97Å; R163-S166 PolarHBondContact O-N 3.22Å; F164-S166 PolarHBondContact O-N 2.96Å; S166-L168 VanDerWaalsContact C-N 3.32Å; S166-L168 PolarHBondContact O-N 3.17Å; S166-A169 PolarHBondContact O-N 2.96Å; S166-K170 WeakPolarHBondContact O-CG 3.48Å; S166-K170 PolarHBondContact O-N 3.26Å; S166-K170 VanDerWaalsContact O-N 3.14Å
167	E	89.1	Confident	85.1	Confident	37 Å²	37	84.9 Å²	84.9	17%	0.173	43%	0.428	C	S	.	.	H	α-helix	trans	-65	-37	176.2	-69.5	-79.3	114.2	0	0	111.7	Y98 K100 W104 R163 F164 K170 I171	Y98-E167 HydrophobicContact CE1-CB 4.49Å; K100-E167 IonicContact NZ-OE2 2.76Å; K100-E167 PolarHBondContact NZ-OE2 3.37Å; W104-E167 HydrophobicContact CH2-CG 4.38Å; R163-E167 WeakPolarHBondContact O-CG 3.18Å; R163-E167 PolarHBondContact O-N 2.88Å; F164-E167 PolarHBondContact O-N 3.34Å; E167-K170 PolarHBondContact O-N 3.13Å; E167-K170 IonicContact OE1-NZ 2.75Å; E167-K170 PolarHBondContact OE1-NZ 3.33Å; E167-I171 WeakPolarHBondContact O-CD1 3.15Å; E167-I171 WeakPolarHBondContact O-CG1 3.48Å; E167-I171 PolarHBondContact O-N 3.46Å
168	L	88.1	Confident	85	Confident	21 Å²	21	88.4 Å²	88.4	11%	0.11	45%	0.445	C	S	.	.	H	α-helix	trans	-64.3	-45.8	173.3	-70.9	174.4	0	0	0	112	I90 I96 Y98 F164 L165 S166 K170 I171 V172	I90-L168 HydrophobicContact CG2-CD1 3.76Å; I96-L168 HydrophobicContact CD1-CD1 3.46Å; I96-L168 VanDerWaalsContact CD1-CD1 3.46Å; I96-L168 HydrophobicContact CD1-CD2 3.43Å; I96-L168 VanDerWaalsContact CD1-CD2 3.43Å; I96-L168 HydrophobicContact CD1-CG 4.06Å; Y98-L168 HydrophobicContact CD1-CD2 4.23Å; Y98-L168 HydrophobicContact CD2-CD2 4.25Å; Y98-L168 HydrophobicContact CG-CD2 3.92Å; F164-L168 HydrophobicContact CD1-CD1 3.85Å; F164-L168 HydrophobicContact CD1-CD2 4.44Å; F164-L168 HydrophobicContact CD1-CG 3.79Å; F164-L168 HydrophobicContact CE1-CD1 3.58Å; F164-L168 HydrophobicContact CE1-CD2 3.81Å; F164-L168 HydrophobicContact CE1-CG 3.59Å; F164-L168 HydrophobicContact CZ-CD1 4.35Å; F164-L168 PolarHBondContact O-N 3.45Å; L165-L168 HydrophobicContact CD2-CD1 4.49Å; L165-L168 PolarHBondContact O-N 3.21Å; S166-L168 VanDerWaalsContact C-N 3.32Å; S166-L168 PolarHBondContact O-N 3.17Å; L168-K170 VanDerWaalsContact C-N 3.27Å; L168-K170 PolarHBondContact O-N 2.97Å; L168-I171 WeakPolarHBondContact O-CB 3.43Å; L168-I171 PolarHBondContact O-N 3.23Å; L168-V172 WeakPolarHBondContact O-CG2 3.3Å; L168-V172 PolarHBondContact O-N 3.35Å
169	A	88.2	Confident	84.9	Confident	47 Å²	47	88.5 Å²	88.5	39%	0.388	44%	0.443	S	S	.	.	H	α-helix	trans	-59.5	-37.7	179.4	0	0	0	0	0	112.3	L165 S166 I171 V172 N173	L165-A169 WeakPolarHBondContact O-CB 3.47Å; L165-A169 PolarHBondContact O-N 3.43Å; S166-A169 PolarHBondContact O-N 2.96Å; A169-I171 PolarHBondContact O-N 3.17Å; A169-V172 PolarHBondContact O-N 2.93Å; A169-N173 WeakPolarHBondContact O-CB 3.42Å; A169-N173 PolarHBondContact O-N 2.99Å; A169-N173 VanDerWaalsContact O-N 3.08Å; A169-N173 PolarHBondContact O-ND2 2.98Å
170	K	87.5	Confident	84.8	Confident	112 Å²	112	88 Å²	88	49%	0.487	44%	0.439	S	S	.	.	H	α-helix	trans	-62.7	-31	174.9	-70.6	172.7	-169.4	170.2	0	113.2	S166 E167 L168 N174	S166-K170 WeakPolarHBondContact O-CG 3.48Å; S166-K170 PolarHBondContact O-N 3.26Å; S166-K170 VanDerWaalsContact O-N 3.14Å; E167-K170 PolarHBondContact O-N 3.13Å; E167-K170 IonicContact OE1-NZ 2.75Å; E167-K170 PolarHBondContact OE1-NZ 3.33Å; L168-K170 VanDerWaalsContact C-N 3.27Å; L168-K170 PolarHBondContact O-N 2.97Å; K170-N174 PolarHBondContact O-ND2 2.95Å
171	I	83.2	Confident	84.4	Confident	87 Å²	87	92.5 Å²	92.5	45%	0.446	46%	0.463	S	S	.	.	H	α-helix	trans	-80.5	-40.1	-179.3	-65.1	163.4	0	0	0	110.3	Y98 E167 L168 A169 N173 N174	Y98-I171 HydrophobicContact CD2-CD1 3.86Å; Y98-I171 HydrophobicContact CE2-CD1 3.13Å; E167-I171 WeakPolarHBondContact O-CD1 3.15Å; E167-I171 WeakPolarHBondContact O-CG1 3.48Å; E167-I171 PolarHBondContact O-N 3.46Å; L168-I171 WeakPolarHBondContact O-CB 3.43Å; L168-I171 PolarHBondContact O-N 3.23Å; A169-I171 PolarHBondContact O-N 3.17Å; I171-N173 VanDerWaalsContact C-N 3.3Å; I171-N173 PolarHBondContact O-N 3.35Å; I171-N174 PolarHBondContact O-N 3.41Å
172	V	78.4	Confident	83.9	Confident	118 Å²	118	92.2 Å²	92.2	72%	0.715	47%	0.467	S	S	*	.	H	α-helix	trans	-69.8	-29.2	179.3	178.2	0	0	0	0	112	L168 A169	L168-V172 WeakPolarHBondContact O-CG2 3.3Å; L168-V172 PolarHBondContact O-N 3.35Å; A169-V172 PolarHBondContact O-N 2.93Å
173	N	73.6	Confident	83.4	Confident	136 Å²	136	85.9 Å²	85.9	73%	0.727	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-0.7	-179.8	-72.3	-17.2	0	0	0	114.7	A169 I171	A169-N173 WeakPolarHBondContact O-CB 3.42Å; A169-N173 PolarHBondContact O-N 2.99Å; A169-N173 VanDerWaalsContact O-N 3.08Å; A169-N173 PolarHBondContact O-ND2 2.98Å; I171-N173 VanDerWaalsContact C-N 3.3Å; I171-N173 PolarHBondContact O-N 3.35Å
174	N	53.7	Low	82.9	Confident	199 Å²	199	78.6 Å²	78.6	100%	1.064	44%	0.435	S	S	*	.			trans	-108.5	0	175.6	-80.7	-15.5	0	0	0	110.4	K170 I171	K170-N174 PolarHBondContact O-ND2 2.95Å; I171-N174 PolarHBondContact O-N 3.41Å

Retrieved 174 of 174 residues in 223.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).