A0A5K4F2T6_SCHMA Loading...

Phosphatidylinositol-glycan biosynthesis class F protein

AlphaFold DB , UniProt , Accession A0A5K4F2T6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 157 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	53.1	Low	80.8	Confident	210 Å²	210	107.7 Å²	107.7	100%	1.034	56%	0.562	S	S	*	*				0	107	0	-159.1	173	-160.8	0	0	107	K3	M1-K3 PolarHBondContact O-N 3.34Å
2	A	62.6	Low	82	Confident	92 Å²	92	100.5 Å²	100.5	76%	0.76	52%	0.523	S	S	*	.			trans	-60.8	123.4	175.2	0	0	0	0	0	107.3	A4	A2-A4 PolarHBondContact O-N 3.35Å
3	K	65.8	Low	83.1	Confident	193 Å²	193	94.8 Å²	94.8	84%	0.839	50%	0.499	S	S	*	.			trans	-59.9	134.4	175.4	-70.4	-173.4	178.8	-175.1	0	107.3	M1	M1-K3 PolarHBondContact O-N 3.34Å
4	A	72.6	Confident	84.1	Confident	9 Å²	9	93.6 Å²	93.6	7%	0.074	50%	0.497	C	S	.	.			trans	-44.1	146.7	170	0	0	0	0	0	110.4	A2 L6 Q9 E58	A2-A4 PolarHBondContact O-N 3.35Å; A4-L6 PolarHBondContact O-N 2.94Å; A4-Q9 HydrophobicContact CB-CG 4.11Å; A4-E58 HydrophobicContact CB-CB 4.2Å; A4-E58 HydrophobicContact CB-CG 4.21Å
5	P	85.1	Confident	84.9	Confident	73 Å²	73	92.7 Å²	92.7	47%	0.474	50%	0.5	S	S	.	.			trans	-56.1	132.2	174.9	23.5	-32.4	0	0	0	109	T7 R8 Q9	P5-T7 PolarHBondContact O-N 2.87Å; P5-R8 HydrophobicContact CG-CB 3.87Å; P5-R8 WeakPolarHBondContact O-CB 3.31Å; P5-R8 PolarHBondContact O-N 3.14Å; P5-Q9 PolarHBondContact O-N 2.91Å
6	L	88.4	Confident	85.6	Confident	135 Å²	135	87.9 Å²	87.9	71%	0.707	48%	0.476	S	S	*	.	H	α-helix	trans	-51.9	-34.5	-178.3	178.3	62.8	0	0	0	111.7	A4 R8 Q9 L10	A4-L6 PolarHBondContact O-N 2.94Å; L6-R8 VanDerWaalsContact C-N 3.32Å; L6-R8 PolarHBondContact O-N 3.35Å; L6-Q9 PolarHBondContact O-N 3.21Å; L6-L10 WeakPolarHBondContact O-CB 3.25Å; L6-L10 PolarHBondContact O-N 3.22Å
7	T	89.9	Confident	86.4	Confident	94 Å²	94	86.6 Å²	86.6	58%	0.577	47%	0.465	S	S	*	.	H	α-helix	trans	-60.5	-36.4	175.9	55.3	0	0	0	0	113.2	P5 K11	P5-T7 PolarHBondContact O-N 2.87Å; T7-K11 WeakPolarHBondContact O-CB 3.05Å; T7-K11 VanDerWaalsContact O-CG 3.25Å; T7-K11 WeakPolarHBondContact O-CG 3.31Å; T7-K11 PolarHBondContact O-N 2.91Å
8	R	90.6	Very high	86.9	Confident	76 Å²	76	85.2 Å²	85.2	29%	0.287	46%	0.462	S	S	.	.	H	α-helix	trans	-71.1	-43	176.2	179.9	170.9	58.8	162.9	-0.4	111.2	P5 L6 L10 K11 F12 E58	P5-R8 HydrophobicContact CG-CB 3.87Å; P5-R8 WeakPolarHBondContact O-CB 3.31Å; P5-R8 PolarHBondContact O-N 3.14Å; L6-R8 VanDerWaalsContact C-N 3.32Å; L6-R8 PolarHBondContact O-N 3.35Å; R8-L10 VanDerWaalsContact C-N 3.34Å; R8-L10 PolarHBondContact O-N 3.33Å; R8-K11 PolarHBondContact O-N 3.3Å; R8-F12 PolarHBondContact O-N 3.31Å; R8-E58 IonicContact CZ-OE1 3.14Å; R8-E58 IonicContact CZ-OE2 2.84Å; R8-E58 IonicContact NH1-OE2 3.74Å; R8-E58 PolarHBondContact NH1-OE2 3.13Å; R8-E58 IonicContact NH2-OE1 2.78Å; R8-E58 PolarHBondContact NH2-OE1 3.02Å; R8-E58 IonicContact NH2-OE2 2.8Å; R8-E58 PolarHBondContact NH2-OE2 3.25Å
9	Q	92.9	Very high	87.5	Confident	42 Å²	42	85.1 Å²	85.1	20%	0.196	47%	0.465	C	S	.	.	H	α-helix	trans	-62.1	-42.8	175.7	-65	-175.4	-19.3	0	0	111.4	A4 P5 L6 F12 A13 L54	A4-Q9 HydrophobicContact CB-CG 4.11Å; P5-Q9 PolarHBondContact O-N 2.91Å; L6-Q9 PolarHBondContact O-N 3.21Å; Q9-F12 PolarHBondContact O-N 3.5Å; Q9-A13 PolarHBondContact O-N 2.9Å; Q9-L54 HydrophobicContact CB-CD2 4.35Å; Q9-L54 HydrophobicContact CG-CD2 4.33Å
10	L	93.5	Very high	87.9	Confident	111 Å²	111	83.3 Å²	83.3	58%	0.581	45%	0.451	S	S	*	.	H	α-helix	trans	-63.2	-45.3	176.8	-177.2	61.6	0	0	0	111.8	L6 R8 F12 A13 V14	L6-L10 WeakPolarHBondContact O-CB 3.25Å; L6-L10 PolarHBondContact O-N 3.22Å; R8-L10 VanDerWaalsContact C-N 3.34Å; R8-L10 PolarHBondContact O-N 3.33Å; L10-F12 VanDerWaalsContact C-N 3.32Å; L10-F12 PolarHBondContact O-N 3.42Å; L10-A13 PolarHBondContact O-N 3.12Å; L10-V14 HydrophobicContact CD1-CG2 4.39Å; L10-V14 WeakPolarHBondContact O-CG2 3.3Å; L10-V14 PolarHBondContact O-N 3.12Å
11	K	94.4	Very high	88.3	Confident	150 Å²	150	82 Å²	82	65%	0.652	44%	0.441	S	S	*	.	H	α-helix	trans	-57	-46.1	175.1	-77.2	175.3	-179.1	-173.6	0	111.6	T7 R8 A13 V14 C15	T7-K11 WeakPolarHBondContact O-CB 3.05Å; T7-K11 VanDerWaalsContact O-CG 3.25Å; T7-K11 WeakPolarHBondContact O-CG 3.31Å; T7-K11 PolarHBondContact O-N 2.91Å; R8-K11 PolarHBondContact O-N 3.3Å; K11-A13 PolarHBondContact O-N 3.24Å; K11-V14 PolarHBondContact O-N 3.3Å; K11-C15 PolarHBondContact O-N 3.25Å; K11-C15 PolarHBondContact O-SG 3.45Å
12	F	95.2	Very high	90.4	Very high	21 Å²	21	76.6 Å²	76.6	9%	0.092	42%	0.416	C	S	.	.	H	α-helix	trans	-60.4	-45.5	176.9	-178.6	-90	0	0	0	112.1	R8 Q9 L10 V14 C15 S16 F53 L54 G59 L61 L64	R8-F12 PolarHBondContact O-N 3.31Å; Q9-F12 PolarHBondContact O-N 3.5Å; L10-F12 VanDerWaalsContact C-N 3.32Å; L10-F12 PolarHBondContact O-N 3.42Å; F12-V14 PolarHBondContact O-N 3.49Å; F12-C15 PolarHBondContact O-N 2.91Å; F12-S16 WeakPolarHBondContact O-CB 3.07Å; F12-S16 PolarHBondContact O-N 3.3Å; F12-F53 HydrophobicContact CD1-CE1 4.45Å; F12-F53 AromaticContact CE1-CD1 3.72Å; F12-F53 HydrophobicContact CE1-CD1 3.72Å; F12-F53 AromaticContact CE1-CE1 3.64Å; F12-F53 HydrophobicContact CE1-CE1 3.64Å; F12-F53 HydrophobicContact CE2-CE1 4.15Å; F12-F53 AromaticContact CZ-CD1 3.95Å; F12-F53 HydrophobicContact CZ-CD1 3.95Å; F12-F53 AromaticContact CZ-CE1 3.45Å; F12-F53 HydrophobicContact CZ-CE1 3.45Å; F12-F53 VanDerWaalsContact CZ-CE1 3.45Å; F12-F53 HydrophobicContact CZ-CZ 4.15Å; F12-L54 HydrophobicContact CD1-CD2 3.83Å; F12-L54 HydrophobicContact CD1-CG 4.46Å; F12-L54 HydrophobicContact CE1-CD2 4.34Å; F12-L54 HydrophobicContact CG-CD2 4.47Å; F12-G59 VanDerWaalsContact CD2-C 3.48Å; F12-L61 HydrophobicContact CE2-CD2 4.22Å; F12-L64 HydrophobicContact CE2-CD2 4.44Å; F12-L64 HydrophobicContact CZ-CD2 4.01Å
13	A	95.9	Very high	92	Very high	26 Å²	26	75.3 Å²	75.3	22%	0.215	40%	0.398	C	S	.	.	H	α-helix	trans	-62.2	-41.1	178	0	0	0	0	0	112.4	Q9 L10 K11 S16 F17 T46 L54	Q9-A13 PolarHBondContact O-N 2.9Å; L10-A13 PolarHBondContact O-N 3.12Å; K11-A13 PolarHBondContact O-N 3.24Å; A13-S16 PolarHBondContact O-N 3.04Å; A13-F17 PolarHBondContact O-N 2.92Å; A13-T46 WeakPolarHBondContact O-CG2 3.37Å; A13-L54 HydrophobicContact CB-CD1 4.45Å
14	V	96.9	Very high	93.3	Very high	78 Å²	78	66.6 Å²	66.6	47%	0.473	36%	0.361	S	S	.	.	H	α-helix	trans	-64.9	-45.6	175.7	173.1	0	0	0	0	111.3	L10 K11 F12 S16 F17 C18	L10-V14 HydrophobicContact CD1-CG2 4.39Å; L10-V14 WeakPolarHBondContact O-CG2 3.3Å; L10-V14 PolarHBondContact O-N 3.12Å; K11-V14 PolarHBondContact O-N 3.3Å; F12-V14 PolarHBondContact O-N 3.49Å; V14-S16 VanDerWaalsContact C-N 3.29Å; V14-S16 PolarHBondContact O-N 2.81Å; V14-F17 WeakPolarHBondContact O-CB 3.48Å; V14-F17 PolarHBondContact O-N 3.48Å; V14-C18 PolarHBondContact O-N 3.34Å; V14-C18 PolarHBondContact O-SG 3.39Å; V14-C18 VanDerWaalsContact O-SG 3.35Å
15	C	96.7	Very high	94.3	Very high	80 Å²	80	68.2 Å²	68.2	54%	0.541	37%	0.368	S	S	.	.	H	α-helix	trans	-60.5	-39.7	176	-69.9	0	0	0	0	112.1	K11 F12 C18 T19	K11-C15 PolarHBondContact O-N 3.25Å; K11-C15 PolarHBondContact O-SG 3.45Å; F12-C15 PolarHBondContact O-N 2.91Å; C15-C18 PolarHBondContact O-N 3.34Å; C15-T19 WeakPolarHBondContact O-CB 3.42Å; C15-T19 PolarHBondContact O-N 3.38Å; C15-T19 PolarHBondContact O-OG1 2.91Å
16	S	96.6	Very high	94.8	Very high	16 Å²	16	71 Å²	71	11%	0.112	38%	0.378	C	S	.	.	H	α-helix	trans	-66.5	-42.7	176.5	176.1	0	0	0	0	111.9	F12 A13 V14 C18 T19 Y20 N50	F12-S16 WeakPolarHBondContact O-CB 3.07Å; F12-S16 PolarHBondContact O-N 3.3Å; A13-S16 PolarHBondContact O-N 3.04Å; V14-S16 VanDerWaalsContact C-N 3.29Å; V14-S16 PolarHBondContact O-N 2.81Å; S16-C18 PolarHBondContact O-N 2.75Å; S16-T19 WeakPolarHBondContact O-CB 3.47Å; S16-T19 PolarHBondContact O-N 3.47Å; S16-Y20 WeakPolarHBondContact O-CD2 3.43Å; S16-Y20 PolarHBondContact O-N 3.17Å; S16-Y20 VanDerWaalsContact OG-CE2 3.25Å; S16-Y20 WeakPolarHBondContact OG-CE2 3.46Å; S16-N50 WeakPolarHBondContact CB-ND2 3.29Å; S16-N50 PolarHBondContact OG-ND2 3.43Å; S16-N50 PolarHBondContact OG-OD1 3.37Å
17	F	97.8	Very high	95	Very high	67 Å²	67	70.5 Å²	70.5	29%	0.294	38%	0.375	S	S	.	.	H	α-helix	trans	-56.4	-48.7	172.7	172.6	-94.2	0	0	0	112.1	A13 V14 T19 Y20 F21 G39 L43 T46	A13-F17 PolarHBondContact O-N 2.92Å; V14-F17 WeakPolarHBondContact O-CB 3.48Å; V14-F17 PolarHBondContact O-N 3.48Å; F17-T19 VanDerWaalsContact C-N 3.31Å; F17-T19 PolarHBondContact O-N 3Å; F17-Y20 PolarHBondContact O-N 2.81Å; F17-F21 WeakPolarHBondContact O-CB 3.4Å; F17-F21 PolarHBondContact O-N 2.88Å; F17-G39 WeakPolarHBondContact CE2-O 3.15Å; F17-L43 HydrophobicContact CD2-CB 4.3Å; F17-L43 HydrophobicContact CD2-CD1 4.48Å; F17-L43 HydrophobicContact CE2-CB 4.02Å; F17-T46 WeakPolarHBondContact CA-OG1 3.42Å; F17-T46 HydrophobicContact CB-CG2 4.18Å
18	C	97	Very high	95.1	Very high	61 Å²	61	69.1 Å²	69.1	41%	0.412	38%	0.38	S	S	.	.	H	α-helix	trans	-61.5	-40.8	176.7	-65.1	0	0	0	0	112	V14 C15 S16 F21 I22	V14-C18 PolarHBondContact O-N 3.34Å; V14-C18 PolarHBondContact O-SG 3.39Å; V14-C18 VanDerWaalsContact O-SG 3.35Å; C15-C18 PolarHBondContact O-N 3.34Å; S16-C18 PolarHBondContact O-N 2.75Å; C18-F21 PolarHBondContact O-N 3.34Å; C18-I22 VanDerWaalsContact O-CG1 3.31Å; C18-I22 WeakPolarHBondContact O-CG1 3.42Å; C18-I22 PolarHBondContact O-N 3.42Å
19	T	96.6	Very high	95	Very high	83 Å²	83	65.9 Å²	65.9	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-61.5	-49.1	177	-56.8	0	0	0	0	111.1	C15 S16 F17 F21 I22 V23	C15-T19 WeakPolarHBondContact O-CB 3.42Å; C15-T19 PolarHBondContact O-N 3.38Å; C15-T19 PolarHBondContact O-OG1 2.91Å; S16-T19 WeakPolarHBondContact O-CB 3.47Å; S16-T19 PolarHBondContact O-N 3.47Å; F17-T19 VanDerWaalsContact C-N 3.31Å; F17-T19 PolarHBondContact O-N 3Å; T19-F21 VanDerWaalsContact C-N 3.32Å; T19-F21 PolarHBondContact O-N 3.18Å; T19-I22 PolarHBondContact O-N 3.46Å; T19-V23 HydrophobicContact CG2-CG2 4.4Å; T19-V23 VanDerWaalsContact O-CG2 3.29Å; T19-V23 WeakPolarHBondContact O-CG2 3.48Å; T19-V23 PolarHBondContact O-N 3Å
20	Y	97	Very high	94.6	Very high	49 Å²	49	65.9 Å²	65.9	19%	0.192	37%	0.373	C	S	.	.	H	α-helix	trans	-63	-39	177.8	-75.9	-56.4	0	0	0	112.3	S16 F17 I22 V23 C24 L45 T49	S16-Y20 WeakPolarHBondContact O-CD2 3.43Å; S16-Y20 PolarHBondContact O-N 3.17Å; S16-Y20 VanDerWaalsContact OG-CE2 3.25Å; S16-Y20 WeakPolarHBondContact OG-CE2 3.46Å; F17-Y20 PolarHBondContact O-N 2.81Å; Y20-I22 VanDerWaalsContact C-N 3.35Å; Y20-I22 PolarHBondContact O-N 3.44Å; Y20-V23 PolarHBondContact O-N 2.87Å; Y20-C24 WeakPolarHBondContact O-CB 3.49Å; Y20-C24 PolarHBondContact O-N 3.35Å; Y20-C24 PolarHBondContact O-SG 2.78Å; Y20-C24 VanDerWaalsContact O-SG 3.34Å; Y20-L45 HydrophobicContact CD1-CB 4.13Å; Y20-L45 HydrophobicContact CD1-CD1 3.86Å; Y20-L45 HydrophobicContact CD2-CB 4.04Å; Y20-L45 HydrophobicContact CE1-CB 4.33Å; Y20-L45 HydrophobicContact CE1-CD1 4.41Å; Y20-L45 HydrophobicContact CE2-CB 4.2Å; Y20-L45 HydrophobicContact CG-CB 3.99Å; Y20-L45 HydrophobicContact CG-CD1 4.23Å; Y20-T49 WeakPolarHBondContact CE2-OG1 3.47Å; Y20-T49 WeakPolarHBondContact OH-CB 3.47Å; Y20-T49 VanDerWaalsContact OH-CG2 3.29Å; Y20-T49 WeakPolarHBondContact OH-CG2 3.04Å; Y20-T49 PolarHBondContact OH-OG1 3.01Å
21	F	96.1	Very high	93.8	Very high	55 Å²	55	65.2 Å²	65.2	24%	0.241	37%	0.369	C	S	.	.	H	α-helix	trans	-59.3	-46	176.1	-169.7	-94.7	0	0	0	112	F17 C18 T19 C24 I25 T38 S42	F17-F21 WeakPolarHBondContact O-CB 3.4Å; F17-F21 PolarHBondContact O-N 2.88Å; C18-F21 PolarHBondContact O-N 3.34Å; T19-F21 VanDerWaalsContact C-N 3.32Å; T19-F21 PolarHBondContact O-N 3.18Å; F21-C24 PolarHBondContact O-N 3.33Å; F21-I25 HydrophobicContact CD1-CD1 3.73Å; F21-I25 HydrophobicContact CE1-CD1 3.4Å; F21-I25 HydrophobicContact CE1-CG1 4.5Å; F21-I25 HydrophobicContact CZ-CD1 4.09Å; F21-I25 WeakPolarHBondContact O-CG1 3.47Å; F21-I25 PolarHBondContact O-N 3.25Å; F21-I25 VanDerWaalsContact O-N 3.12Å; F21-T38 HydrophobicContact CD2-CG2 3.97Å; F21-T38 HydrophobicContact CE2-CG2 3.8Å; F21-T38 HydrophobicContact CZ-CG2 4.4Å; F21-S42 WeakPolarHBondContact CA-OG 3.49Å; F21-S42 PolarHBondContact N-OG 2.94Å
22	I	96.4	Very high	93	Very high	98 Å²	98	65.4 Å²	65.4	50%	0.503	38%	0.376	S	S	.	.	H	α-helix	trans	-65	-43.9	176	-65.4	165.1	0	0	0	110.9	C18 T19 Y20 C24 I25 I26	C18-I22 VanDerWaalsContact O-CG1 3.31Å; C18-I22 WeakPolarHBondContact O-CG1 3.42Å; C18-I22 PolarHBondContact O-N 3.42Å; T19-I22 PolarHBondContact O-N 3.46Å; Y20-I22 VanDerWaalsContact C-N 3.35Å; Y20-I22 PolarHBondContact O-N 3.44Å; I22-C24 PolarHBondContact O-N 2.95Å; I22-I25 PolarHBondContact O-N 3.38Å; I22-I26 HydrophobicContact CG2-CD1 3.75Å; I22-I26 HydrophobicContact CG2-CG1 4.36Å; I22-I26 VanDerWaalsContact O-CG1 3.31Å; I22-I26 WeakPolarHBondContact O-CG1 3.34Å; I22-I26 PolarHBondContact O-N 2.73Å
23	V	95.6	Very high	92.3	Very high	64 Å²	64	73.1 Å²	73.1	39%	0.388	41%	0.413	S	S	.	.	H	α-helix	trans	-61.8	-44.1	178.4	169.4	0	0	0	0	111.3	T19 Y20 I25 I26 L27	T19-V23 HydrophobicContact CG2-CG2 4.4Å; T19-V23 VanDerWaalsContact O-CG2 3.29Å; T19-V23 WeakPolarHBondContact O-CG2 3.48Å; T19-V23 PolarHBondContact O-N 3Å; Y20-V23 PolarHBondContact O-N 2.87Å; V23-I25 VanDerWaalsContact C-N 3.32Å; V23-I25 PolarHBondContact O-N 3.31Å; V23-I26 PolarHBondContact O-N 3.47Å; V23-L27 HydrophobicContact CG1-CD1 3.89Å; V23-L27 HydrophobicContact CG1-CG 4.33Å; V23-L27 WeakPolarHBondContact O-CB 3.25Å; V23-L27 VanDerWaalsContact O-CG 3.3Å; V23-L27 WeakPolarHBondContact O-CG 3.36Å; V23-L27 PolarHBondContact O-N 3.35Å
24	C	94.5	Very high	91.7	Very high	10 Å²	10	75.6 Å²	75.6	7%	0.068	42%	0.42	C	S	.	.	H	α-helix	trans	-58.6	-44.7	175.5	-74.5	0	0	0	0	111.2	Y20 F21 I22 I26 L27 G28 A29 T38	Y20-C24 WeakPolarHBondContact O-CB 3.49Å; Y20-C24 PolarHBondContact O-N 3.35Å; Y20-C24 PolarHBondContact O-SG 2.78Å; Y20-C24 VanDerWaalsContact O-SG 3.34Å; F21-C24 PolarHBondContact O-N 3.33Å; I22-C24 PolarHBondContact O-N 2.95Å; C24-I26 PolarHBondContact O-N 3.19Å; C24-L27 CarbonylContact O-C 3.31Å; C24-L27 PolarHBondContact O-N 3.2Å; C24-G28 PolarHBondContact O-N 3.27Å; C24-A29 VanDerWaalsContact C-CB 3.46Å; C24-A29 HydrophobicContact CB-CB 3.94Å; C24-A29 WeakPolarHBondContact O-CB 3.41Å; C24-A29 PolarHBondContact O-N 2.98Å; C24-T38 HydrophobicContact CB-CG2 4.01Å
25	I	94.1	Very high	91.4	Very high	44 Å²	44	79 Å²	79	23%	0.226	42%	0.424	C	S	.	.	H	α-helix	trans	-60.7	-45.4	176	-71.4	171.6	0	0	0	111.3	F21 I22 V23 L27 G28 I31 T38	F21-I25 HydrophobicContact CD1-CD1 3.73Å; F21-I25 HydrophobicContact CE1-CD1 3.4Å; F21-I25 HydrophobicContact CE1-CG1 4.5Å; F21-I25 HydrophobicContact CZ-CD1 4.09Å; F21-I25 WeakPolarHBondContact O-CG1 3.47Å; F21-I25 PolarHBondContact O-N 3.25Å; F21-I25 VanDerWaalsContact O-N 3.12Å; I22-I25 PolarHBondContact O-N 3.38Å; V23-I25 VanDerWaalsContact C-N 3.32Å; V23-I25 PolarHBondContact O-N 3.31Å; I25-L27 PolarHBondContact O-N 3.31Å; I25-G28 PolarHBondContact O-N 3.32Å; I25-I31 HydrophobicContact CB-CG1 4.44Å; I25-I31 HydrophobicContact CD1-CG1 4.42Å; I25-I31 HydrophobicContact CD1-CG2 4.39Å; I25-I31 HydrophobicContact CG1-CG1 4.12Å; I25-I31 HydrophobicContact CG2-CD1 3.62Å; I25-I31 HydrophobicContact CG2-CG1 3.66Å; I25-T38 HydrophobicContact CG1-CG2 4.35Å
26	I	94.7	Very high	91.3	Very high	131 Å²	131	81.7 Å²	81.7	67%	0.672	43%	0.427	S	S	*	.	H	α-helix	trans	-61.4	-35.6	177.6	-69.3	168.6	0	0	0	111.2	I22 V23 C24 G28	I22-I26 HydrophobicContact CG2-CD1 3.75Å; I22-I26 HydrophobicContact CG2-CG1 4.36Å; I22-I26 VanDerWaalsContact O-CG1 3.31Å; I22-I26 WeakPolarHBondContact O-CG1 3.34Å; I22-I26 PolarHBondContact O-N 2.73Å; V23-I26 PolarHBondContact O-N 3.47Å; C24-I26 PolarHBondContact O-N 3.19Å; I26-G28 PolarHBondContact O-N 3.35Å
27	L	92.6	Very high	91.2	Very high	124 Å²	124	84 Å²	84	65%	0.649	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	2.6	176.6	-67.4	175.5	0	0	0	113.8	V23 C24 I25	V23-L27 HydrophobicContact CG1-CD1 3.89Å; V23-L27 HydrophobicContact CG1-CG 4.33Å; V23-L27 WeakPolarHBondContact O-CB 3.25Å; V23-L27 VanDerWaalsContact O-CG 3.3Å; V23-L27 WeakPolarHBondContact O-CG 3.36Å; V23-L27 PolarHBondContact O-N 3.35Å; C24-L27 CarbonylContact O-C 3.31Å; C24-L27 PolarHBondContact O-N 3.2Å; I25-L27 PolarHBondContact O-N 3.31Å
28	G	91.1	Very high	91.1	Very high	65 Å²	65	80.9 Å²	80.9	67%	0.67	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.6	14.2	175.7	0	0	0	0	0	115	C24 I25 I26	C24-G28 PolarHBondContact O-N 3.27Å; I25-G28 PolarHBondContact O-N 3.32Å; I26-G28 PolarHBondContact O-N 3.35Å
29	A	89.5	Confident	91	Very high	9 Å²	9	78.6 Å²	78.6	7%	0.074	41%	0.409	C	S	.	.			trans	-63.8	144.7	172.4	0	0	0	0	0	111.3	C24 I31 T38 W107	C24-A29 VanDerWaalsContact C-CB 3.46Å; C24-A29 HydrophobicContact CB-CB 3.94Å; C24-A29 WeakPolarHBondContact O-CB 3.41Å; C24-A29 PolarHBondContact O-N 2.98Å; A29-I31 PolarHBondContact O-N 3.09Å; A29-T38 HydrophobicContact CB-CG2 3.92Å; A29-W107 HydrophobicContact CB-CH2 4.05Å; A29-W107 HydrophobicContact CB-CZ2 3.52Å
30	P	84	Confident	91	Very high	41 Å²	41	78.7 Å²	78.7	27%	0.266	41%	0.406	S	S	.	.			trans	-62.6	128.1	179.3	25	-34.2	0	0	0	111.5	Q34 T38 W107	P30-Q34 HydrophobicContact CB-CB 4.01Å; P30-Q34 HydrophobicContact CG-CB 3.71Å; P30-T38 PolarHBondContact O-OG1 2.62Å; P30-W107 VanDerWaalsContact CG-CD1 3.46Å; P30-W107 HydrophobicContact CG-CG 4.2Å
31	I	77.3	Confident	91	Very high	98 Å²	98	76.6 Å²	76.6	50%	0.503	40%	0.398	S	S	.	.	S	Bend	trans	-87.7	-53.7	-174	-54.2	174	0	0	0	111.7	I25 A29	I25-I31 HydrophobicContact CB-CG1 4.44Å; I25-I31 HydrophobicContact CD1-CG1 4.42Å; I25-I31 HydrophobicContact CD1-CG2 4.39Å; I25-I31 HydrophobicContact CG1-CG1 4.12Å; I25-I31 HydrophobicContact CG2-CD1 3.62Å; I25-I31 HydrophobicContact CG2-CG1 3.66Å; A29-I31 PolarHBondContact O-N 3.09Å
32	L	78.2	Confident	91.1	Very high	154 Å²	154	74 Å²	74	81%	0.806	39%	0.386	S	S	*	.	S	Bend	trans	-99.1	-41.8	-166.6	-63.7	177.8	0	0	0	113
33	E	80.4	Confident	91.1	Very high	183 Å²	183	73.1 Å²	73.1	86%	0.855	38%	0.382	S	S	*	.	S	Bend	trans	-79.8	-32.8	-172.1	-63.1	-177.7	-176.3	0	0	112.8
34	Q	83.5	Confident	91.2	Very high	77 Å²	77	71.3 Å²	71.3	36%	0.36	37%	0.371	S	S	.	.			trans	-133	47.4	-173.1	-67.9	-178.6	-3.3	0	0	112	P30 K36 E37 T38	P30-Q34 HydrophobicContact CB-CB 4.01Å; P30-Q34 HydrophobicContact CG-CB 3.71Å; Q34-K36 PolarHBondContact O-N 2.82Å; Q34-E37 WeakPolarHBondContact CA-OE2 3.34Å; Q34-E37 HydrophobicContact CB-CB 4.12Å; Q34-E37 HydrophobicContact CB-CG 4.16Å; Q34-E37 VanDerWaalsContact CB-OE2 3.25Å; Q34-E37 WeakPolarHBondContact CB-OE2 3Å; Q34-E37 PolarHBondContact O-N 3.24Å; Q34-T38 PolarHBondContact O-N 3.28Å; Q34-T38 VanDerWaalsContact O-N 3.14Å; Q34-T38 PolarHBondContact O-OG1 3.32Å
35	W	90.7	Very high	91.4	Very high	151 Å²	151	71.3 Å²	71.3	57%	0.572	37%	0.371	S	S	*	.	H	α-helix	trans	-65.4	-27.1	-179.8	66	-95.3	0	0	0	112.7	G39	W35-G39 PolarHBondContact O-N 3.22Å
36	K	93.8	Very high	91.6	Very high	136 Å²	136	69.7 Å²	69.7	59%	0.591	36%	0.363	S	S	*	.	H	α-helix	trans	-68.7	-40	178.6	-67.3	178.9	-177.5	172.8	0	110.9	Q34 G39 L40	Q34-K36 PolarHBondContact O-N 2.82Å; K36-G39 PolarHBondContact O-N 2.95Å; K36-L40 WeakPolarHBondContact O-CB 3.23Å; K36-L40 PolarHBondContact O-N 2.89Å
37	E	94.7	Very high	91.7	Very high	65 Å²	65	68 Å²	68	30%	0.304	35%	0.354	S	S	.	.	H	α-helix	trans	-67.1	-48.4	177.8	-67.9	71.3	-159.9	0	0	110.3	Q34 G39 L40 M41 P108	Q34-E37 WeakPolarHBondContact CA-OE2 3.34Å; Q34-E37 HydrophobicContact CB-CB 4.12Å; Q34-E37 HydrophobicContact CB-CG 4.16Å; Q34-E37 VanDerWaalsContact CB-OE2 3.25Å; Q34-E37 WeakPolarHBondContact CB-OE2 3Å; Q34-E37 PolarHBondContact O-N 3.24Å; E37-G39 VanDerWaalsContact C-N 3.28Å; E37-G39 PolarHBondContact O-N 3.4Å; E37-L40 WeakPolarHBondContact O-CB 3.2Å; E37-L40 PolarHBondContact O-N 2.96Å; E37-L40 VanDerWaalsContact O-N 3.17Å; E37-M41 PolarHBondContact O-N 3.21Å; E37-P108 HydrophobicContact CB-CG 4.12Å; E37-P108 WeakPolarHBondContact O-CG 3.39Å
38	T	95.5	Very high	91.9	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-37.8	174	-57.7	0	0	0	0	111.5	F21 C24 I25 A29 P30 Q34 M41 S42 W107	F21-T38 HydrophobicContact CD2-CG2 3.97Å; F21-T38 HydrophobicContact CE2-CG2 3.8Å; F21-T38 HydrophobicContact CZ-CG2 4.4Å; C24-T38 HydrophobicContact CB-CG2 4.01Å; I25-T38 HydrophobicContact CG1-CG2 4.35Å; A29-T38 HydrophobicContact CB-CG2 3.92Å; P30-T38 PolarHBondContact O-OG1 2.62Å; Q34-T38 PolarHBondContact O-N 3.28Å; Q34-T38 VanDerWaalsContact O-N 3.14Å; Q34-T38 PolarHBondContact O-OG1 3.32Å; T38-M41 PolarHBondContact O-N 2.87Å; T38-S42 WeakPolarHBondContact O-CB 3.2Å; T38-S42 PolarHBondContact O-N 3.48Å; T38-S42 PolarHBondContact O-OG 2.91Å; T38-W107 PolarHBondContact OG1-NE1 2.85Å; T38-W107 VanDerWaalsContact OG1-NE1 3.12Å
39	G	95.6	Very high	92.2	Very high	13 Å²	13	60.7 Å²	60.7	13%	0.134	30%	0.302	C	S	.	.	H	α-helix	trans	-62.4	-44.9	172	0	0	0	0	0	112.7	F17 W35 K36 E37 S42 L43	F17-G39 WeakPolarHBondContact CE2-O 3.15Å; W35-G39 PolarHBondContact O-N 3.22Å; K36-G39 PolarHBondContact O-N 2.95Å; E37-G39 VanDerWaalsContact C-N 3.28Å; E37-G39 PolarHBondContact O-N 3.4Å; G39-S42 PolarHBondContact O-N 3.27Å; G39-L43 WeakPolarHBondContact O-CB 3.38Å; G39-L43 PolarHBondContact O-N 3.23Å
40	L	96.6	Very high	92.5	Very high	85 Å²	85	60.8 Å²	60.8	45%	0.445	30%	0.302	S	S	.	.	H	α-helix	trans	-62.2	-44.2	176.8	-178.9	63.8	0	0	0	111.4	K36 E37 S42 L43 V44 I112	K36-L40 WeakPolarHBondContact O-CB 3.23Å; K36-L40 PolarHBondContact O-N 2.89Å; E37-L40 WeakPolarHBondContact O-CB 3.2Å; E37-L40 PolarHBondContact O-N 2.96Å; E37-L40 VanDerWaalsContact O-N 3.17Å; L40-S42 PolarHBondContact O-N 2.93Å; L40-L43 WeakPolarHBondContact O-CB 3.44Å; L40-L43 PolarHBondContact O-N 3.38Å; L40-V44 WeakPolarHBondContact O-CG2 3.12Å; L40-V44 PolarHBondContact O-N 2.92Å; L40-I112 HydrophobicContact CD2-CD1 3.83Å; L40-I112 HydrophobicContact CG-CD1 3.88Å
41	M	96.6	Very high	93	Very high	5 Å²	5	65.4 Å²	65.4	3%	0.025	32%	0.318	C	S	.	.	H	α-helix	trans	-59.4	-47.3	175.7	-176.9	57	-169	0	0	111.6	E37 T38 L43 V44 L45 A89 W107 P108 C111 I112	E37-M41 PolarHBondContact O-N 3.21Å; T38-M41 PolarHBondContact O-N 2.87Å; M41-L43 VanDerWaalsContact C-N 3.29Å; M41-L43 PolarHBondContact O-N 3.43Å; M41-V44 PolarHBondContact O-N 2.86Å; M41-L45 HydrophobicContact CE-CD1 3.89Å; M41-L45 HydrophobicContact CE-CD2 3.92Å; M41-L45 HydrophobicContact CE-CG 3.8Å; M41-L45 WeakPolarHBondContact O-CG 3.42Å; M41-L45 PolarHBondContact O-N 2.64Å; M41-A89 HydrophobicContact CE-CB 3.59Å; M41-W107 HydrophobicContact CB-CH2 4.33Å; M41-W107 HydrophobicContact CB-CZ2 3.99Å; M41-W107 HydrophobicContact CG-CH2 3.83Å; M41-W107 HydrophobicContact CG-CZ2 3.99Å; M41-P108 HydrophobicContact CB-CB 3.84Å; M41-P108 HydrophobicContact CG-CB 4.41Å; M41-P108 HydrophobicContact SD-CB 4.48Å; M41-C111 HydrophobicContact CE-CB 3.6Å; M41-C111 HydrophobicContact SD-CB 3.7Å; M41-I112 HydrophobicContact SD-CG1 3.89Å
42	S	97.5	Very high	93.8	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62.6	-38.5	178.7	-55.1	0	0	0	0	111.7	F21 T38 G39 L40 T46	F21-S42 WeakPolarHBondContact CA-OG 3.49Å; F21-S42 PolarHBondContact N-OG 2.94Å; T38-S42 WeakPolarHBondContact O-CB 3.2Å; T38-S42 PolarHBondContact O-N 3.48Å; T38-S42 PolarHBondContact O-OG 2.91Å; G39-S42 PolarHBondContact O-N 3.27Å; L40-S42 PolarHBondContact O-N 2.93Å; S42-T46 VanDerWaalsContact O-CB 3.31Å; S42-T46 WeakPolarHBondContact O-CB 3.25Å; S42-T46 PolarHBondContact O-N 2.91Å; S42-T46 PolarHBondContact O-OG1 3.37Å
43	L	97.5	Very high	94.6	Very high	81 Å²	81	54.3 Å²	54.3	42%	0.424	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-45.4	175.3	-176.8	63.7	0	0	0	111.4	F17 G39 L40 M41 T46 I47	F17-L43 HydrophobicContact CD2-CB 4.3Å; F17-L43 HydrophobicContact CD2-CD1 4.48Å; F17-L43 HydrophobicContact CE2-CB 4.02Å; G39-L43 WeakPolarHBondContact O-CB 3.38Å; G39-L43 PolarHBondContact O-N 3.23Å; L40-L43 WeakPolarHBondContact O-CB 3.44Å; L40-L43 PolarHBondContact O-N 3.38Å; M41-L43 VanDerWaalsContact C-N 3.29Å; M41-L43 PolarHBondContact O-N 3.43Å; L43-T46 WeakPolarHBondContact O-CB 3.49Å; L43-T46 PolarHBondContact O-N 2.94Å; L43-I47 HydrophobicContact CD1-CD1 4.04Å; L43-I47 HydrophobicContact CD1-CG1 4.35Å; L43-I47 HydrophobicContact CG-CD1 3.86Å; L43-I47 VanDerWaalsContact O-CG1 3.28Å; L43-I47 WeakPolarHBondContact O-CG1 3.4Å; L43-I47 PolarHBondContact O-N 3.49Å
44	V	98.1	Very high	95.2	Very high	25 Å²	25	47 Å²	47	15%	0.152	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-48.6	177.1	169.5	0	0	0	0	110.8	L40 M41 T46 I47 C48 I112 A115	L40-V44 WeakPolarHBondContact O-CG2 3.12Å; L40-V44 PolarHBondContact O-N 2.92Å; M41-V44 PolarHBondContact O-N 2.86Å; V44-T46 VanDerWaalsContact C-N 3.34Å; V44-T46 PolarHBondContact O-N 3.02Å; V44-I47 PolarHBondContact O-N 3.49Å; V44-C48 WeakPolarHBondContact O-CB 3.49Å; V44-C48 PolarHBondContact O-N 2.97Å; V44-C48 PolarHBondContact O-SG 3.46Å; V44-I112 HydrophobicContact CB-CG1 4.47Å; V44-I112 HydrophobicContact CG1-CG2 4.38Å; V44-I112 HydrophobicContact CG2-CD1 4.19Å; V44-I112 HydrophobicContact CG2-CG1 4.17Å; V44-I112 HydrophobicContact CG2-CG2 4.36Å; V44-A115 HydrophobicContact CG1-CB 4.18Å
45	L	98.1	Very high	95.6	Very high	11 Å²	11	49.8 Å²	49.8	6%	0.058	24%	0.242	C	C	.	.	H	α-helix	trans	-57.5	-47.8	175.4	-71.6	175.6	0	0	0	111.3	Y20 M41 I47 C48 T49 A89 A115	Y20-L45 HydrophobicContact CD1-CB 4.13Å; Y20-L45 HydrophobicContact CD1-CD1 3.86Å; Y20-L45 HydrophobicContact CD2-CB 4.04Å; Y20-L45 HydrophobicContact CE1-CB 4.33Å; Y20-L45 HydrophobicContact CE1-CD1 4.41Å; Y20-L45 HydrophobicContact CE2-CB 4.2Å; Y20-L45 HydrophobicContact CG-CB 3.99Å; Y20-L45 HydrophobicContact CG-CD1 4.23Å; M41-L45 HydrophobicContact CE-CD1 3.89Å; M41-L45 HydrophobicContact CE-CD2 3.92Å; M41-L45 HydrophobicContact CE-CG 3.8Å; M41-L45 WeakPolarHBondContact O-CG 3.42Å; M41-L45 PolarHBondContact O-N 2.64Å; L45-I47 VanDerWaalsContact C-N 3.33Å; L45-I47 PolarHBondContact O-N 3.23Å; L45-C48 PolarHBondContact O-N 3.42Å; L45-T49 WeakPolarHBondContact O-CG2 3.49Å; L45-T49 PolarHBondContact O-N 3.34Å; L45-T49 PolarHBondContact O-OG1 2.89Å; L45-T49 VanDerWaalsContact O-OG1 3.06Å; L45-A89 HydrophobicContact CD2-CB 4.05Å; L45-A115 HydrophobicContact CD2-CB 4.47Å
46	T	97.9	Very high	95.6	Very high	10 Å²	10	47 Å²	47	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-57.1	-46.4	178.3	-57.6	0	0	0	0	111.3	A13 F17 S42 L43 V44 N50	A13-T46 WeakPolarHBondContact O-CG2 3.37Å; F17-T46 WeakPolarHBondContact CA-OG1 3.42Å; F17-T46 HydrophobicContact CB-CG2 4.18Å; S42-T46 VanDerWaalsContact O-CB 3.31Å; S42-T46 WeakPolarHBondContact O-CB 3.25Å; S42-T46 PolarHBondContact O-N 2.91Å; S42-T46 PolarHBondContact O-OG1 3.37Å; L43-T46 WeakPolarHBondContact O-CB 3.49Å; L43-T46 PolarHBondContact O-N 2.94Å; V44-T46 VanDerWaalsContact C-N 3.34Å; V44-T46 PolarHBondContact O-N 3.02Å; T46-N50 VanDerWaalsContact CG2-ND2 3.32Å; T46-N50 WeakPolarHBondContact CG2-ND2 3.21Å; T46-N50 WeakPolarHBondContact O-CA 3.32Å; T46-N50 WeakPolarHBondContact O-CB 3.41Å; T46-N50 VanDerWaalsContact O-CG 3.29Å; T46-N50 PolarHBondContact O-N 3.27Å
47	I	97.5	Very high	95.5	Very high	95 Å²	95	42.1 Å²	42.1	49%	0.487	21%	0.213	S	C	.	.	H	α-helix	trans	-65.8	-52.2	179.8	-69.1	167.6	0	0	0	110	L43 V44 L45 T49 F51	L43-I47 HydrophobicContact CD1-CD1 4.04Å; L43-I47 HydrophobicContact CD1-CG1 4.35Å; L43-I47 HydrophobicContact CG-CD1 3.86Å; L43-I47 VanDerWaalsContact O-CG1 3.28Å; L43-I47 WeakPolarHBondContact O-CG1 3.4Å; L43-I47 PolarHBondContact O-N 3.49Å; V44-I47 PolarHBondContact O-N 3.49Å; L45-I47 VanDerWaalsContact C-N 3.33Å; L45-I47 PolarHBondContact O-N 3.23Å; I47-T49 VanDerWaalsContact C-N 3.34Å; I47-T49 PolarHBondContact O-N 3.34Å; I47-F51 WeakPolarHBondContact O-CB 3.34Å; I47-F51 PolarHBondContact O-N 3.36Å
48	C	96.9	Very high	95.4	Very high	23 Å²	23	42.3 Å²	42.3	16%	0.155	21%	0.214	C	C	.	.	H	α-helix	trans	-61.4	-38.3	-176.6	-73.9	0	0	0	0	112.9	V44 L45 P52 C85	V44-C48 WeakPolarHBondContact O-CB 3.49Å; V44-C48 PolarHBondContact O-N 2.97Å; V44-C48 PolarHBondContact O-SG 3.46Å; L45-C48 PolarHBondContact O-N 3.42Å; C48-P52 WeakPolarHBondContact O-CD 3.31Å; C48-P52 WeakPolarHBondContact O-CG 3.22Å; C48-C85 HydrophobicContact CB-CB 4.26Å; C48-C85 WeakPolarHBondContact CB-SG 3.46Å
49	T	96.9	Very high	95.1	Very high	12 Å²	12	42.6 Å²	42.6	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-85.6	-42.4	179.4	67.7	0	0	0	0	113	Y20 L45 I47 P52 F53 C85 V86	Y20-T49 WeakPolarHBondContact CE2-OG1 3.47Å; Y20-T49 WeakPolarHBondContact OH-CB 3.47Å; Y20-T49 VanDerWaalsContact OH-CG2 3.29Å; Y20-T49 WeakPolarHBondContact OH-CG2 3.04Å; Y20-T49 PolarHBondContact OH-OG1 3.01Å; L45-T49 WeakPolarHBondContact O-CG2 3.49Å; L45-T49 PolarHBondContact O-N 3.34Å; L45-T49 PolarHBondContact O-OG1 2.89Å; L45-T49 VanDerWaalsContact O-OG1 3.06Å; I47-T49 VanDerWaalsContact C-N 3.34Å; I47-T49 PolarHBondContact O-N 3.34Å; T49-P52 WeakPolarHBondContact O-CD 3.35Å; T49-P52 WeakPolarHBondContact O-CG 3.48Å; T49-F53 WeakPolarHBondContact O-CB 3.39Å; T49-C85 HydrophobicContact CG2-CB 4.34Å; T49-V86 HydrophobicContact CG2-CG2 4.35Å
50	N	95.6	Very high	94.8	Very high	12 Å²	12	44.7 Å²	44.7	6%	0.064	23%	0.225	C	C	.	.	H	α-helix	trans	-85.5	-28.4	-171.6	-60.7	-13.2	0	0	0	113.2	S16 T46 F53 L54	S16-N50 WeakPolarHBondContact CB-ND2 3.29Å; S16-N50 PolarHBondContact OG-ND2 3.43Å; S16-N50 PolarHBondContact OG-OD1 3.37Å; T46-N50 VanDerWaalsContact CG2-ND2 3.32Å; T46-N50 WeakPolarHBondContact CG2-ND2 3.21Å; T46-N50 WeakPolarHBondContact O-CA 3.32Å; T46-N50 WeakPolarHBondContact O-CB 3.41Å; T46-N50 VanDerWaalsContact O-CG 3.29Å; T46-N50 PolarHBondContact O-N 3.27Å; N50-F53 PolarHBondContact O-N 3.06Å; N50-L54 HydrophobicContact CB-CD1 4.09Å; N50-L54 HydrophobicContact CB-CG 4.37Å; N50-L54 VanDerWaalsContact O-CB 3.28Å; N50-L54 WeakPolarHBondContact O-CB 3.42Å; N50-L54 VanDerWaalsContact O-CG 3.24Å; N50-L54 WeakPolarHBondContact O-CG 3.38Å; N50-L54 PolarHBondContact O-N 3Å
51	F	94.6	Very high	94.5	Very high	138 Å²	138	46.4 Å²	46.4	61%	0.605	23%	0.234	S	C	*	.	H	α-helix	trans	-56.7	-53.5	177.4	-176.9	-99.2	0	0	0	112.4	I47 M55	I47-F51 WeakPolarHBondContact O-CB 3.34Å; I47-F51 PolarHBondContact O-N 3.36Å; F51-M55 WeakPolarHBondContact O-CG 3.23Å; F51-M55 PolarHBondContact O-N 3.38Å
52	P	93.5	Very high	94.1	Very high	13 Å²	13	52 Å²	52	8%	0.084	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-39.1	175.1	27.5	-35.6	0	0	0	111.8	C48 T49 M55 F56 F77 V78 I81	C48-P52 WeakPolarHBondContact O-CD 3.31Å; C48-P52 WeakPolarHBondContact O-CG 3.22Å; T49-P52 WeakPolarHBondContact O-CD 3.35Å; T49-P52 WeakPolarHBondContact O-CG 3.48Å; P52-M55 PolarHBondContact O-N 2.85Å; P52-F56 VanDerWaalsContact O-CD2 3.31Å; P52-F56 WeakPolarHBondContact O-CD2 3.39Å; P52-F77 HydrophobicContact CB-CE1 4.13Å; P52-V78 HydrophobicContact CB-CG2 4.4Å; P52-I81 HydrophobicContact CB-CD1 4.42Å; P52-I81 HydrophobicContact CG-CG2 3.94Å
53	F	94.9	Very high	93.8	Very high	5 Å²	5	54.3 Å²	54.3	2%	0.022	28%	0.276	C	S	.	.	H	α-helix	trans	-60.7	-49.3	-180	178.5	-97.5	0	0	0	112.6	F12 T49 N50 M55 F56 F57 N63 L64 V67 V78	F12-F53 HydrophobicContact CD1-CE1 4.45Å; F12-F53 AromaticContact CE1-CD1 3.72Å; F12-F53 HydrophobicContact CE1-CD1 3.72Å; F12-F53 AromaticContact CE1-CE1 3.64Å; F12-F53 HydrophobicContact CE1-CE1 3.64Å; F12-F53 HydrophobicContact CE2-CE1 4.15Å; F12-F53 AromaticContact CZ-CD1 3.95Å; F12-F53 HydrophobicContact CZ-CD1 3.95Å; F12-F53 AromaticContact CZ-CE1 3.45Å; F12-F53 HydrophobicContact CZ-CE1 3.45Å; F12-F53 VanDerWaalsContact CZ-CE1 3.45Å; F12-F53 HydrophobicContact CZ-CZ 4.15Å; T49-F53 WeakPolarHBondContact O-CB 3.39Å; N50-F53 PolarHBondContact O-N 3.06Å; F53-M55 PolarHBondContact O-N 3.13Å; F53-F56 PolarHBondContact O-N 3.22Å; F53-F57 HydrophobicContact CD2-CB 4.32Å; F53-F57 AromaticContact CD2-CD2 3.77Å; F53-F57 HydrophobicContact CD2-CD2 3.77Å; F53-F57 HydrophobicContact CD2-CG 4.4Å; F53-F57 HydrophobicContact CE1-CB 4.32Å; F53-F57 HydrophobicContact CE2-CB 3.99Å; F53-F57 AromaticContact CE2-CD2 3.94Å; F53-F57 HydrophobicContact CE2-CD2 3.94Å; F53-F57 HydrophobicContact CE2-CG 4.17Å; F53-F57 HydrophobicContact CG-CD2 4.45Å; F53-F57 HydrophobicContact CZ-CB 4.01Å; F53-F57 PolarHBondContact O-N 3.29Å; F53-N63 HydrophobicContact CE2-CB 4.28Å; F53-N63 HydrophobicContact CZ-CB 3.75Å; F53-L64 HydrophobicContact CE2-CD2 4.49Å; F53-L64 HydrophobicContact CZ-CD2 4.3Å; F53-V67 HydrophobicContact CD2-CG2 3.54Å; F53-V67 HydrophobicContact CE2-CG2 3.66Å; F53-V78 HydrophobicContact CB-CG1 3.75Å; F53-V78 HydrophobicContact CD2-CG1 3.96Å; F53-V78 HydrophobicContact CG-CG1 4.36Å
54	L	93.6	Very high	93.4	Very high	31 Å²	31	53.5 Å²	53.5	16%	0.162	27%	0.272	C	S	.	.	H	α-helix	trans	-72	-13.6	-177.3	-66	174.3	0	0	0	113.6	Q9 F12 A13 N50	Q9-L54 HydrophobicContact CB-CD2 4.35Å; Q9-L54 HydrophobicContact CG-CD2 4.33Å; F12-L54 HydrophobicContact CD1-CD2 3.83Å; F12-L54 HydrophobicContact CD1-CG 4.46Å; F12-L54 HydrophobicContact CE1-CD2 4.34Å; F12-L54 HydrophobicContact CG-CD2 4.47Å; A13-L54 HydrophobicContact CB-CD1 4.45Å; N50-L54 HydrophobicContact CB-CD1 4.09Å; N50-L54 HydrophobicContact CB-CG 4.37Å; N50-L54 VanDerWaalsContact O-CB 3.28Å; N50-L54 WeakPolarHBondContact O-CB 3.42Å; N50-L54 VanDerWaalsContact O-CG 3.24Å; N50-L54 WeakPolarHBondContact O-CG 3.38Å; N50-L54 PolarHBondContact O-N 3Å
55	M	91.6	Very high	93.1	Very high	134 Å²	134	61.6 Å²	61.6	66%	0.66	30%	0.3	S	S	*	.	H	α-helix	trans	-76.8	-30.6	172.6	-73.3	-78.1	-88.7	0	0	112.4	F51 P52 F53	F51-M55 WeakPolarHBondContact O-CG 3.23Å; F51-M55 PolarHBondContact O-N 3.38Å; P52-M55 PolarHBondContact O-N 2.85Å; F53-M55 PolarHBondContact O-N 3.13Å
56	F	91	Very high	92.6	Very high	92 Å²	92	61.5 Å²	61.5	40%	0.404	30%	0.3	S	S	.	.	H	α-helix	trans	-106.3	-31.8	-178.6	-68.1	-77.7	0	0	0	113.6	P52 F53 E74 F77 V78	P52-F56 VanDerWaalsContact O-CD2 3.31Å; P52-F56 WeakPolarHBondContact O-CD2 3.39Å; F53-F56 PolarHBondContact O-N 3.22Å; F56-E74 HydrophobicContact CD1-CB 3.93Å; F56-E74 HydrophobicContact CD1-CG 3.88Å; F56-E74 HydrophobicContact CE1-CB 4.36Å; F56-E74 HydrophobicContact CE1-CG 4.05Å; F56-E74 HydrophobicContact CG-CB 4.27Å; F56-F77 HydrophobicContact CD2-CD1 4.29Å; F56-F77 HydrophobicContact CD2-CE1 4.5Å; F56-F77 AromaticContact CE2-CD1 3.62Å; F56-F77 HydrophobicContact CE2-CD1 3.62Å; F56-F77 AromaticContact CE2-CE1 3.63Å; F56-F77 HydrophobicContact CE2-CE1 3.63Å; F56-F77 HydrophobicContact CZ-CD1 4.27Å; F56-F77 HydrophobicContact CZ-CE1 4.35Å; F56-V78 HydrophobicContact CD2-CG2 3.81Å
57	F	92.1	Very high	92.2	Very high	35 Å²	35	62.3 Å²	62.3	15%	0.154	31%	0.305	C	S	.	.	S	Bend	trans	-122.3	155.6	-172.6	-55.5	-73	0	0	0	111.8	F53 N63 E74 E75 V78	F53-F57 HydrophobicContact CD2-CB 4.32Å; F53-F57 AromaticContact CD2-CD2 3.77Å; F53-F57 HydrophobicContact CD2-CD2 3.77Å; F53-F57 HydrophobicContact CD2-CG 4.4Å; F53-F57 HydrophobicContact CE1-CB 4.32Å; F53-F57 HydrophobicContact CE2-CB 3.99Å; F53-F57 AromaticContact CE2-CD2 3.94Å; F53-F57 HydrophobicContact CE2-CD2 3.94Å; F53-F57 HydrophobicContact CE2-CG 4.17Å; F53-F57 HydrophobicContact CG-CD2 4.45Å; F53-F57 HydrophobicContact CZ-CB 4.01Å; F53-F57 PolarHBondContact O-N 3.29Å; F57-N63 HydrophobicContact CB-CB 4.26Å; F57-E74 HydrophobicContact CZ-CB 4.48Å; F57-E75 HydrophobicContact CE1-CG 4.07Å; F57-E75 HydrophobicContact CZ-CB 4.34Å; F57-E75 HydrophobicContact CZ-CG 3.56Å; F57-V78 HydrophobicContact CD2-CG2 4.38Å; F57-V78 HydrophobicContact CE2-CB 4.32Å; F57-V78 HydrophobicContact CE2-CG2 3.9Å
58	E	91	Very high	91.9	Very high	68 Å²	68	63.9 Å²	63.9	32%	0.318	31%	0.314	S	S	.	.			trans	-72.1	144.7	170.3	-49.4	-167	136.3	0	0	110	A4 R8 N60 N63	A4-E58 HydrophobicContact CB-CB 4.2Å; A4-E58 HydrophobicContact CB-CG 4.21Å; R8-E58 IonicContact CZ-OE1 3.14Å; R8-E58 IonicContact CZ-OE2 2.84Å; R8-E58 IonicContact NH1-OE2 3.74Å; R8-E58 PolarHBondContact NH1-OE2 3.13Å; R8-E58 IonicContact NH2-OE1 2.78Å; R8-E58 PolarHBondContact NH2-OE1 3.02Å; R8-E58 IonicContact NH2-OE2 2.8Å; R8-E58 PolarHBondContact NH2-OE2 3.25Å; E58-N60 PolarHBondContact O-N 3.39Å; E58-N63 PolarHBondContact N-ND2 2.92Å; E58-N63 PolarHBondContact O-ND2 3.41Å
59	G	89.7	Confident	91.7	Very high	7 Å²	7	65.8 Å²	65.8	7%	0.072	33%	0.331	C	S	.	.	S	Bend	trans	-68.7	72	174.2	0	0	0	0	0	112.4	F12	F12-G59 VanDerWaalsContact CD2-C 3.48Å
60	N	90.1	Very high	91.5	Very high	56 Å²	56	67 Å²	67	30%	0.299	34%	0.339	S	S	.	.			trans	-132.8	144.7	176	-172.1	3.6	0	0	0	109.1	E58 D62 N63	E58-N60 PolarHBondContact O-N 3.39Å; N60-D62 PolarHBondContact ND2-OD2 3.43Å; N60-D62 PolarHBondContact O-N 3.1Å; N60-D62 PolarHBondContact OD1-N 2.85Å; N60-N63 PolarHBondContact O-N 3.27Å
61	L	89.2	Confident	91.3	Very high	122 Å²	122	70.2 Å²	70.2	64%	0.639	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-63.7	-30	177.1	-62.8	177.2	0	0	0	112.1	F12 N63 L64	F12-L61 HydrophobicContact CE2-CD2 4.22Å; L61-N63 PolarHBondContact O-N 2.9Å; L61-L64 HydrophobicContact CB-CD1 4.39Å; L61-L64 HydrophobicContact CD2-CD1 3.59Å; L61-L64 HydrophobicContact CD2-CG 4.48Å; L61-L64 VanDerWaalsContact O-CB 3.23Å; L61-L64 WeakPolarHBondContact O-CB 3.32Å; L61-L64 WeakPolarHBondContact O-CG 3.37Å; L61-L64 PolarHBondContact O-N 3.29Å
62	D	89.6	Confident	91.3	Very high	123 Å²	123	68 Å²	68	66%	0.658	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-59.1	-31.3	176.6	-59.8	-38.1	0	0	0	112.3	N60 L64	N60-D62 PolarHBondContact ND2-OD2 3.43Å; N60-D62 PolarHBondContact O-N 3.1Å; N60-D62 PolarHBondContact OD1-N 2.85Å; D62-L64 VanDerWaalsContact C-N 3.28Å; D62-L64 PolarHBondContact O-N 2.93Å
63	N	90.8	Very high	91.3	Very high	47 Å²	47	71.2 Å²	71.2	25%	0.251	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-78.3	-10	178	-67.3	-26.8	0	0	0	112.6	F53 F57 E58 N60 L61 R65 S66	F53-N63 HydrophobicContact CE2-CB 4.28Å; F53-N63 HydrophobicContact CZ-CB 3.75Å; F57-N63 HydrophobicContact CB-CB 4.26Å; E58-N63 PolarHBondContact N-ND2 2.92Å; E58-N63 PolarHBondContact O-ND2 3.41Å; N60-N63 PolarHBondContact O-N 3.27Å; L61-N63 PolarHBondContact O-N 2.9Å; N63-R65 PolarHBondContact O-N 3.28Å; N63-S66 WeakPolarHBondContact O-CB 3.34Å; N63-S66 PolarHBondContact O-N 2.82Å; N63-S66 PolarHBondContact O-OG 3.5Å
64	L	89.1	Confident	91.2	Very high	65 Å²	65	75.1 Å²	75.1	34%	0.34	40%	0.396	S	S	.	.	H	α-helix	trans	-64.1	-24.3	176.4	-69.1	177.4	0	0	0	112.5	F12 F53 L61 D62 S66 V67 L68	F12-L64 HydrophobicContact CE2-CD2 4.44Å; F12-L64 HydrophobicContact CZ-CD2 4.01Å; F53-L64 HydrophobicContact CE2-CD2 4.49Å; F53-L64 HydrophobicContact CZ-CD2 4.3Å; L61-L64 HydrophobicContact CB-CD1 4.39Å; L61-L64 HydrophobicContact CD2-CD1 3.59Å; L61-L64 HydrophobicContact CD2-CG 4.48Å; L61-L64 VanDerWaalsContact O-CB 3.23Å; L61-L64 WeakPolarHBondContact O-CB 3.32Å; L61-L64 WeakPolarHBondContact O-CG 3.37Å; L61-L64 PolarHBondContact O-N 3.29Å; D62-L64 VanDerWaalsContact C-N 3.28Å; D62-L64 PolarHBondContact O-N 2.93Å; L64-S66 PolarHBondContact O-N 3.06Å; L64-V67 WeakPolarHBondContact O-CB 3.21Å; L64-V67 PolarHBondContact O-N 3.34Å; L64-L68 WeakPolarHBondContact O-CG 3.27Å; L64-L68 PolarHBondContact O-N 2.83Å
65	R	90.6	Very high	91.3	Very high	195 Å²	195	74.9 Å²	74.9	74%	0.736	39%	0.394	S	S	*	.	H	α-helix	trans	-54.2	-35.6	170.6	178.1	179.4	175.2	141.2	1.4	111.8	N63 V67 L68 A69	N63-R65 PolarHBondContact O-N 3.28Å; R65-V67 PolarHBondContact O-N 3.2Å; R65-L68 PolarHBondContact O-N 2.72Å; R65-A69 PolarHBondContact O-N 3.22Å
66	S	87.8	Confident	91.5	Very high	9 Å²	9	72.6 Å²	72.6	6%	0.063	38%	0.38	C	S	.	.	H	α-helix	trans	-63.8	-29.8	-179.8	91.9	0	0	0	0	111.7	N63 L64 P70 E75	N63-S66 WeakPolarHBondContact O-CB 3.34Å; N63-S66 PolarHBondContact O-N 2.82Å; N63-S66 PolarHBondContact O-OG 3.5Å; L64-S66 PolarHBondContact O-N 3.06Å; S66-P70 VanDerWaalsContact O-CA 3.31Å; S66-P70 WeakPolarHBondContact O-CA 3.32Å; S66-P70 WeakPolarHBondContact O-CB 3.39Å; S66-E75 WeakPolarHBondContact CB-OE1 3.43Å; S66-E75 WeakPolarHBondContact O-CB 3.34Å
67	V	89.7	Confident	91.8	Very high	26 Å²	26	70.4 Å²	70.4	16%	0.158	37%	0.371	C	S	.	.	H	α-helix	trans	-82.4	-42.8	175.5	-176.5	0	0	0	0	111.1	F53 L64 R65 V78 A79 Y83	F53-V67 HydrophobicContact CD2-CG2 3.54Å; F53-V67 HydrophobicContact CE2-CG2 3.66Å; L64-V67 WeakPolarHBondContact O-CB 3.21Å; L64-V67 PolarHBondContact O-N 3.34Å; R65-V67 PolarHBondContact O-N 3.2Å; V67-V78 HydrophobicContact CG2-CG1 4.1Å; V67-A79 HydrophobicContact CG1-CB 4.37Å; V67-A79 WeakPolarHBondContact O-CB 3.46Å; V67-Y83 PolarHBondContact O-OH 3.38Å
68	L	91.5	Very high	92	Very high	128 Å²	128	68.9 Å²	68.9	67%	0.67	36%	0.364	S	S	*	.	H	α-helix	trans	-70.6	-39.3	-176.6	-66.2	175.6	0	0	0	113.3	L64 R65 Y83	L64-L68 WeakPolarHBondContact O-CG 3.27Å; L64-L68 PolarHBondContact O-N 2.83Å; R65-L68 PolarHBondContact O-N 2.72Å; L68-Y83 WeakPolarHBondContact CA-OH 3.23Å
69	A	93.1	Very high	92.2	Very high	63 Å²	63	65.7 Å²	65.7	52%	0.521	35%	0.349	S	S	.	.	S	Bend	trans	-131	69.3	-178.8	0	0	0	0	0	110.7	R65 S71	R65-A69 PolarHBondContact O-N 3.22Å; A69-S71 PolarHBondContact O-N 2.92Å
70	P	92.7	Very high	92.6	Very high	38 Å²	38	68.2 Å²	68.2	25%	0.247	36%	0.359	C	S	.	.			trans	-73.6	122.7	-170.3	30.3	-35.9	0	0	0	112.2	S66 E75 K76 A79	S66-P70 VanDerWaalsContact O-CA 3.31Å; S66-P70 WeakPolarHBondContact O-CA 3.32Å; S66-P70 WeakPolarHBondContact O-CB 3.39Å; P70-E75 HydrophobicContact CB-CB 3.77Å; P70-K76 HydrophobicContact CB-CB 4.47Å; P70-K76 HydrophobicContact CB-CG 3.84Å; P70-K76 HydrophobicContact CG-CG 4.29Å; P70-K76 WeakPolarHBondContact O-CE 3.46Å; P70-A79 HydrophobicContact CB-CB 4Å; P70-A79 HydrophobicContact CG-CB 3.81Å
71	S	91.9	Very high	93	Very high	80 Å²	80	66.1 Å²	66.1	56%	0.559	35%	0.347	S	S	*	.			trans	-108.6	-46.8	-178.8	67.1	0	0	0	0	111.9	A69 E75 K76	A69-S71 PolarHBondContact O-N 2.92Å; S71-E75 WeakPolarHBondContact CA-OE2 3.48Å; S71-E75 PolarHBondContact N-OE2 3.06Å; S71-E75 PolarHBondContact OG-OE2 3.35Å; S71-K76 WeakPolarHBondContact O-CE 3.29Å; S71-K76 PolarHBondContact O-NZ 2.91Å
72	L	93.5	Very high	93.4	Very high	91 Å²	91	60.8 Å²	60.8	48%	0.476	32%	0.321	S	S	.	.	S	Bend	trans	-80.8	157.7	-178.7	-61.2	171	0	0	0	111.6	E74 E75 K76	L72-E74 VanDerWaalsContact C-N 3.3Å; L72-E74 PolarHBondContact O-N 2.88Å; L72-E75 HydrophobicContact CB-CB 4.3Å; L72-E75 HydrophobicContact CB-CG 3.91Å; L72-E75 HydrophobicContact CD1-CG 4.48Å; L72-E75 PolarHBondContact N-OE2 3.26Å; L72-E75 WeakPolarHBondContact O-CB 3.49Å; L72-E75 PolarHBondContact O-N 3.38Å; L72-K76 WeakPolarHBondContact O-CG 3.23Å; L72-K76 PolarHBondContact O-N 2.87Å
73	P	93.5	Very high	93.7	Very high	80 Å²	80	59.3 Å²	59.3	52%	0.519	31%	0.308	S	S	.	.	H	α-helix	trans	-58	-38.1	177.7	-25	35.7	0	0	0	113.9	K76 F77 F126	P73-K76 PolarHBondContact O-N 3.43Å; P73-F77 PolarHBondContact O-N 3.43Å; P73-F126 WeakPolarHBondContact O-CE2 3.32Å; P73-F126 WeakPolarHBondContact O-CZ 3.45Å
74	E	93.3	Very high	94.1	Very high	87 Å²	87	57.8 Å²	57.8	41%	0.407	30%	0.302	S	S	.	.	H	α-helix	trans	-69.8	-41.5	179	-54.8	79.1	-169.5	0	0	111.3	F56 F57 L72 K76 F77 V78	F56-E74 HydrophobicContact CD1-CB 3.93Å; F56-E74 HydrophobicContact CD1-CG 3.88Å; F56-E74 HydrophobicContact CE1-CB 4.36Å; F56-E74 HydrophobicContact CE1-CG 4.05Å; F56-E74 HydrophobicContact CG-CB 4.27Å; F57-E74 HydrophobicContact CZ-CB 4.48Å; L72-E74 VanDerWaalsContact C-N 3.3Å; L72-E74 PolarHBondContact O-N 2.88Å; E74-K76 VanDerWaalsContact C-N 3.33Å; E74-K76 PolarHBondContact O-N 3.29Å; E74-F77 WeakPolarHBondContact O-CB 3.41Å; E74-F77 PolarHBondContact O-N 3.44Å; E74-V78 WeakPolarHBondContact O-CG2 3.49Å; E74-V78 PolarHBondContact O-N 2.93Å
75	E	95.2	Very high	94.5	Very high	26 Å²	26	54.7 Å²	54.7	12%	0.121	29%	0.286	C	S	.	.	H	α-helix	trans	-58.6	-46.8	174.1	-66.6	-176.8	157.4	0	0	110.9	F57 S66 P70 S71 L72 V78 A79	F57-E75 HydrophobicContact CE1-CG 4.07Å; F57-E75 HydrophobicContact CZ-CB 4.34Å; F57-E75 HydrophobicContact CZ-CG 3.56Å; S66-E75 WeakPolarHBondContact CB-OE1 3.43Å; S66-E75 WeakPolarHBondContact O-CB 3.34Å; P70-E75 HydrophobicContact CB-CB 3.77Å; S71-E75 WeakPolarHBondContact CA-OE2 3.48Å; S71-E75 PolarHBondContact N-OE2 3.06Å; S71-E75 PolarHBondContact OG-OE2 3.35Å; L72-E75 HydrophobicContact CB-CB 4.3Å; L72-E75 HydrophobicContact CB-CG 3.91Å; L72-E75 HydrophobicContact CD1-CG 4.48Å; L72-E75 PolarHBondContact N-OE2 3.26Å; L72-E75 WeakPolarHBondContact O-CB 3.49Å; L72-E75 PolarHBondContact O-N 3.38Å; E75-V78 PolarHBondContact O-N 3.19Å; E75-A79 VanDerWaalsContact O-CB 3.25Å; E75-A79 WeakPolarHBondContact O-CB 3.38Å; E75-A79 PolarHBondContact O-N 3.38Å
76	K	96.1	Very high	94.9	Very high	87 Å²	87	48.4 Å²	48.4	38%	0.378	27%	0.27	S	S	.	.	H	α-helix	trans	-61.1	-47	175.9	-72.1	172.6	-178	164.9	0	111	P70 S71 L72 P73 E74 V78 A79 F80 F126	P70-K76 HydrophobicContact CB-CB 4.47Å; P70-K76 HydrophobicContact CB-CG 3.84Å; P70-K76 HydrophobicContact CG-CG 4.29Å; P70-K76 WeakPolarHBondContact O-CE 3.46Å; S71-K76 WeakPolarHBondContact O-CE 3.29Å; S71-K76 PolarHBondContact O-NZ 2.91Å; L72-K76 WeakPolarHBondContact O-CG 3.23Å; L72-K76 PolarHBondContact O-N 2.87Å; P73-K76 PolarHBondContact O-N 3.43Å; E74-K76 VanDerWaalsContact C-N 3.33Å; E74-K76 PolarHBondContact O-N 3.29Å; K76-V78 VanDerWaalsContact C-N 3.34Å; K76-V78 PolarHBondContact O-N 3.21Å; K76-A79 PolarHBondContact O-N 3.44Å; K76-F80 HydrophobicContact CB-CD2 4.28Å; K76-F80 HydrophobicContact CB-CE2 4.44Å; K76-F80 WeakPolarHBondContact O-CB 3.28Å; K76-F80 WeakPolarHBondContact O-CD2 3.45Å; K76-F80 PolarHBondContact O-N 2.75Å; K76-F126 HydrophobicContact CB-CD2 4.05Å; K76-F126 HydrophobicContact CB-CE2 3.81Å
77	F	96.6	Very high	95.4	Very high	45 Å²	45	52.4 Å²	52.4	20%	0.197	29%	0.289	C	S	.	.	H	α-helix	trans	-53.8	-50.8	178.1	171.6	-99.7	0	0	0	111.8	P52 F56 P73 E74 I81 W123 F126	P52-F77 HydrophobicContact CB-CE1 4.13Å; F56-F77 HydrophobicContact CD2-CD1 4.29Å; F56-F77 HydrophobicContact CD2-CE1 4.5Å; F56-F77 AromaticContact CE2-CD1 3.62Å; F56-F77 HydrophobicContact CE2-CD1 3.62Å; F56-F77 AromaticContact CE2-CE1 3.63Å; F56-F77 HydrophobicContact CE2-CE1 3.63Å; F56-F77 HydrophobicContact CZ-CD1 4.27Å; F56-F77 HydrophobicContact CZ-CE1 4.35Å; P73-F77 PolarHBondContact O-N 3.43Å; E74-F77 WeakPolarHBondContact O-CB 3.41Å; E74-F77 PolarHBondContact O-N 3.44Å; F77-I81 HydrophobicContact CD1-CD1 4.15Å; F77-I81 HydrophobicContact CD2-CD1 4Å; F77-I81 HydrophobicContact CE1-CD1 3.58Å; F77-I81 HydrophobicContact CE2-CD1 3.46Å; F77-I81 VanDerWaalsContact CE2-CD1 3.46Å; F77-I81 HydrophobicContact CG-CD1 4.34Å; F77-I81 HydrophobicContact CZ-CD1 3.22Å; F77-I81 WeakPolarHBondContact O-CG1 3.45Å; F77-I81 PolarHBondContact O-N 2.9Å; F77-I81 VanDerWaalsContact O-N 3.17Å; F77-W123 AromaticContact CE2-CD1 3.55Å; F77-W123 AromaticContact CE2-NE1 3.96Å; F77-F126 HydrophobicContact CB-CD1 4.15Å; F77-F126 HydrophobicContact CB-CD2 4.26Å; F77-F126 HydrophobicContact CB-CE1 3.81Å; F77-F126 HydrophobicContact CB-CE2 3.93Å; F77-F126 HydrophobicContact CB-CG 4.35Å; F77-F126 HydrophobicContact CB-CZ 3.69Å; F77-F126 AromaticContact CD2-CD1 3.61Å; F77-F126 HydrophobicContact CD2-CD1 3.61Å; F77-F126 AromaticContact CD2-CE1 3.66Å; F77-F126 HydrophobicContact CD2-CE1 3.66Å; F77-F126 HydrophobicContact CD2-CG 4.31Å; F77-F126 HydrophobicContact CD2-CZ 4.42Å; F77-F126 HydrophobicContact CG-CD1 4.37Å; F77-F126 HydrophobicContact CG-CE1 4.2Å
78	V	96.5	Very high	95.8	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.018	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-43.7	179.6	176.7	0	0	0	0	111.4	P52 F53 F56 F57 V67 E74 E75 K76 I81 G82	P52-V78 HydrophobicContact CB-CG2 4.4Å; F53-V78 HydrophobicContact CB-CG1 3.75Å; F53-V78 HydrophobicContact CD2-CG1 3.96Å; F53-V78 HydrophobicContact CG-CG1 4.36Å; F56-V78 HydrophobicContact CD2-CG2 3.81Å; F57-V78 HydrophobicContact CD2-CG2 4.38Å; F57-V78 HydrophobicContact CE2-CB 4.32Å; F57-V78 HydrophobicContact CE2-CG2 3.9Å; V67-V78 HydrophobicContact CG2-CG1 4.1Å; E74-V78 WeakPolarHBondContact O-CG2 3.49Å; E74-V78 PolarHBondContact O-N 2.93Å; E75-V78 PolarHBondContact O-N 3.19Å; K76-V78 VanDerWaalsContact C-N 3.34Å; K76-V78 PolarHBondContact O-N 3.21Å; V78-I81 PolarHBondContact O-N 2.78Å; V78-G82 PolarHBondContact O-N 2.82Å
79	A	96.8	Very high	96.1	Very high	1 Å²	1	46 Å²	46	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-61.7	-47.6	178.8	0	0	0	0	0	112.4	V67 P70 E75 K76 I81 G82 Y83	V67-A79 HydrophobicContact CG1-CB 4.37Å; V67-A79 WeakPolarHBondContact O-CB 3.46Å; P70-A79 HydrophobicContact CB-CB 4Å; P70-A79 HydrophobicContact CG-CB 3.81Å; E75-A79 VanDerWaalsContact O-CB 3.25Å; E75-A79 WeakPolarHBondContact O-CB 3.38Å; E75-A79 PolarHBondContact O-N 3.38Å; K76-A79 PolarHBondContact O-N 3.44Å; A79-I81 VanDerWaalsContact C-N 3.34Å; A79-I81 PolarHBondContact O-N 2.86Å; A79-G82 PolarHBondContact O-N 2.78Å; A79-Y83 HydrophobicContact CB-CD2 4.24Å; A79-Y83 HydrophobicContact CB-CE2 3.87Å; A79-Y83 WeakPolarHBondContact O-CB 3.43Å; A79-Y83 WeakPolarHBondContact O-CD2 3.2Å; A79-Y83 PolarHBondContact O-N 2.84Å
80	F	97.6	Very high	96.2	Very high	61 Å²	61	51.2 Å²	51.2	27%	0.268	27%	0.265	S	S	.	.	H	α-helix	trans	-62.5	-39.8	179	-88	-78.6	0	0	0	112.3	K76 G84 G122 I125 F126 I129	K76-F80 HydrophobicContact CB-CD2 4.28Å; K76-F80 HydrophobicContact CB-CE2 4.44Å; K76-F80 WeakPolarHBondContact O-CB 3.28Å; K76-F80 WeakPolarHBondContact O-CD2 3.45Å; K76-F80 PolarHBondContact O-N 2.75Å; F80-G84 PolarHBondContact O-N 3.4Å; F80-G122 WeakPolarHBondContact O-CA 3.37Å; F80-I125 HydrophobicContact CD1-CB 4.36Å; F80-I125 HydrophobicContact CD1-CG2 3.79Å; F80-I125 HydrophobicContact CE1-CG2 3.57Å; F80-F126 HydrophobicContact CB-CB 3.89Å; F80-F126 HydrophobicContact CD2-CB 4.18Å; F80-F126 HydrophobicContact CD2-CD2 4.08Å; F80-F126 HydrophobicContact CG-CB 4.06Å; F80-I129 HydrophobicContact CE1-CD1 3.78Å; F80-I129 HydrophobicContact CE2-CD1 4.2Å; F80-I129 HydrophobicContact CZ-CD1 3.44Å; F80-I129 VanDerWaalsContact CZ-CD1 3.44Å
81	I	97.6	Very high	96.4	Very high	12 Å²	12	54.7 Å²	54.7	6%	0.062	28%	0.281	C	S	.	.	H	α-helix	trans	-65.9	-48.4	174.8	-70.9	175.3	0	0	0	111	P52 F77 V78 A79 G84 C85 T119 W123	P52-I81 HydrophobicContact CB-CD1 4.42Å; P52-I81 HydrophobicContact CG-CG2 3.94Å; F77-I81 HydrophobicContact CD1-CD1 4.15Å; F77-I81 HydrophobicContact CD2-CD1 4Å; F77-I81 HydrophobicContact CE1-CD1 3.58Å; F77-I81 HydrophobicContact CE2-CD1 3.46Å; F77-I81 VanDerWaalsContact CE2-CD1 3.46Å; F77-I81 HydrophobicContact CG-CD1 4.34Å; F77-I81 HydrophobicContact CZ-CD1 3.22Å; F77-I81 WeakPolarHBondContact O-CG1 3.45Å; F77-I81 PolarHBondContact O-N 2.9Å; F77-I81 VanDerWaalsContact O-N 3.17Å; V78-I81 PolarHBondContact O-N 2.78Å; A79-I81 VanDerWaalsContact C-N 3.34Å; A79-I81 PolarHBondContact O-N 2.86Å; I81-G84 PolarHBondContact O-N 2.78Å; I81-C85 WeakPolarHBondContact O-CB 3.07Å; I81-C85 PolarHBondContact O-N 3.41Å; I81-T119 HydrophobicContact CG2-CG2 3.61Å; I81-W123 HydrophobicContact CD1-CB 4.36Å; I81-W123 HydrophobicContact CG1-CB 4.14Å
82	G	97.3	Very high	96.6	Very high	9 Å²	9	51.3 Å²	51.3	9%	0.093	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-48.2	-179.1	0	0	0	0	0	112.7	V78 A79 C85 V86	V78-G82 PolarHBondContact O-N 2.82Å; A79-G82 PolarHBondContact O-N 2.78Å; G82-C85 WeakPolarHBondContact O-CB 3.29Å; G82-C85 PolarHBondContact O-N 2.88Å; G82-V86 WeakPolarHBondContact O-CG2 3.11Å; G82-V86 PolarHBondContact O-N 3.48Å
83	Y	97.6	Very high	96.6	Very high	93 Å²	93	48.4 Å²	48.4	37%	0.365	25%	0.247	S	C	.	.	H	α-helix	trans	-63.8	-43.5	175.8	-63.5	-34	0	0	0	112.1	V67 L68 A79 C85 V86 I87	V67-Y83 PolarHBondContact O-OH 3.38Å; L68-Y83 WeakPolarHBondContact CA-OH 3.23Å; A79-Y83 HydrophobicContact CB-CD2 4.24Å; A79-Y83 HydrophobicContact CB-CE2 3.87Å; A79-Y83 WeakPolarHBondContact O-CB 3.43Å; A79-Y83 WeakPolarHBondContact O-CD2 3.2Å; A79-Y83 PolarHBondContact O-N 2.84Å; Y83-C85 VanDerWaalsContact C-N 3.3Å; Y83-C85 PolarHBondContact O-N 3.22Å; Y83-V86 PolarHBondContact O-N 2.86Å; Y83-I87 VanDerWaalsContact O-CB 3.23Å; Y83-I87 WeakPolarHBondContact O-CB 3.34Å; Y83-I87 WeakPolarHBondContact O-CG1 3.42Å; Y83-I87 PolarHBondContact O-N 2.92Å
84	G	98.2	Very high	96.6	Very high	14 Å²	14	46.8 Å²	46.8	14%	0.144	24%	0.244	C	C	.	.	H	α-helix	trans	-55.8	-47.2	174.8	0	0	0	0	0	111.6	F80 I81 G88 G118	F80-G84 PolarHBondContact O-N 3.4Å; I81-G84 PolarHBondContact O-N 2.78Å; G84-G88 PolarHBondContact O-N 3.33Å; G84-G118 CarbonylContact C-O 3.27Å; G84-G118 VanDerWaalsContact C-O 3.27Å; G84-G118 VanDerWaalsContact CA-O 3.26Å; G84-G118 WeakPolarHBondContact CA-O 3.35Å; G84-G118 CarbonylContact O-C 3.37Å; G84-G118 VanDerWaalsContact O-C 3.31Å; G84-G118 WeakPolarHBondContact O-CA 3.39Å
85	C	98.4	Very high	96.5	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.8	-54.7	177	-177.1	0	0	0	0	112.4	C48 T49 I81 G82 Y83 G88 A89 T119	C48-C85 HydrophobicContact CB-CB 4.26Å; C48-C85 WeakPolarHBondContact CB-SG 3.46Å; T49-C85 HydrophobicContact CG2-CB 4.34Å; I81-C85 WeakPolarHBondContact O-CB 3.07Å; I81-C85 PolarHBondContact O-N 3.41Å; G82-C85 WeakPolarHBondContact O-CB 3.29Å; G82-C85 PolarHBondContact O-N 2.88Å; Y83-C85 VanDerWaalsContact C-N 3.3Å; Y83-C85 PolarHBondContact O-N 3.22Å; C85-G88 PolarHBondContact O-N 2.78Å; C85-A89 WeakPolarHBondContact O-CB 3.34Å; C85-A89 PolarHBondContact O-N 3.03Å; C85-T119 VanDerWaalsContact CB-OG1 3.3Å; C85-T119 WeakPolarHBondContact CB-OG1 3.48Å
86	V	97.6	Very high	96.3	Very high	64 Å²	64	48.6 Å²	48.6	39%	0.388	25%	0.253	S	S	.	.	H	α-helix	trans	-66.8	-43.8	-176.1	174.8	0	0	0	0	111.6	T49 G82 Y83 A89 W90	T49-V86 HydrophobicContact CG2-CG2 4.35Å; G82-V86 WeakPolarHBondContact O-CG2 3.11Å; G82-V86 PolarHBondContact O-N 3.48Å; Y83-V86 PolarHBondContact O-N 2.86Å; V86-A89 PolarHBondContact O-N 3.22Å; V86-W90 WeakPolarHBondContact O-CB 3.43Å; V86-W90 PolarHBondContact O-N 3.45Å
87	I	98.1	Very high	96	Very high	92 Å²	92	50.5 Å²	50.5	47%	0.472	27%	0.272	S	S	.	.	H	α-helix	trans	-65.4	-42.9	178	-66.4	168.3	0	0	0	110.2	Y83 W90 L91	Y83-I87 VanDerWaalsContact O-CB 3.23Å; Y83-I87 WeakPolarHBondContact O-CB 3.34Å; Y83-I87 WeakPolarHBondContact O-CG1 3.42Å; Y83-I87 PolarHBondContact O-N 2.92Å; I87-W90 PolarHBondContact O-N 2.91Å; I87-L91 HydrophobicContact CG2-CD1 3.79Å; I87-L91 HydrophobicContact CG2-CG 4.14Å; I87-L91 WeakPolarHBondContact O-CB 3.39Å; I87-L91 VanDerWaalsContact O-CG 3.29Å; I87-L91 WeakPolarHBondContact O-CG 3.3Å; I87-L91 PolarHBondContact O-N 3.38Å
88	G	98.3	Very high	95.6	Very high	13 Å²	13	51.4 Å²	51.4	13%	0.134	28%	0.279	C	S	.	.	H	α-helix	trans	-62.6	-43.2	177.1	0	0	0	0	0	112.6	G84 C85 W90 S92 G114	G84-G88 PolarHBondContact O-N 3.33Å; C85-G88 PolarHBondContact O-N 2.78Å; G88-W90 VanDerWaalsContact C-N 3.35Å; G88-S92 WeakPolarHBondContact O-CB 3.37Å; G88-S92 PolarHBondContact O-N 2.95Å; G88-S92 VanDerWaalsContact O-N 3.1Å; G88-S92 PolarHBondContact O-OG 2.66Å; G88-G114 VanDerWaalsContact C-C 3.42Å; G88-G114 CarbonylContact C-O 3.6Å; G88-G114 WeakPolarHBondContact CA-O 3.42Å; G88-G114 WeakPolarHBondContact O-CA 3.37Å
89	A	97.8	Very high	94.8	Very high	8 Å²	8	57.5 Å²	57.5	7%	0.066	31%	0.311	C	S	.	.	H	α-helix	trans	-60.3	-43	173.3	0	0	0	0	0	112.4	M41 L45 C85 V86 S92 A93 A115	M41-A89 HydrophobicContact CE-CB 3.59Å; L45-A89 HydrophobicContact CD2-CB 4.05Å; C85-A89 WeakPolarHBondContact O-CB 3.34Å; C85-A89 PolarHBondContact O-N 3.03Å; V86-A89 PolarHBondContact O-N 3.22Å; A89-S92 WeakPolarHBondContact CA-OG 3.15Å; A89-S92 PolarHBondContact O-OG 3.32Å; A89-A93 PolarHBondContact O-N 2.9Å; A89-A115 HydrophobicContact CB-CB 4.06Å
90	W	95.6	Very high	94.2	Very high	171 Å²	171	64.2 Å²	64.2	65%	0.648	34%	0.336	S	S	*	.	H	α-helix	trans	-70.5	-44.8	-179.4	-178.4	67.8	0	0	0	112.6	V86 I87 G88 S92 A93	V86-W90 WeakPolarHBondContact O-CB 3.43Å; V86-W90 PolarHBondContact O-N 3.45Å; I87-W90 PolarHBondContact O-N 2.91Å; G88-W90 VanDerWaalsContact C-N 3.35Å; W90-S92 VanDerWaalsContact C-N 3.3Å; W90-S92 PolarHBondContact O-N 2.83Å; W90-A93 VanDerWaalsContact O-CB 3.23Å; W90-A93 WeakPolarHBondContact O-CB 3.35Å; W90-A93 PolarHBondContact O-N 3.01Å; W90-A93 VanDerWaalsContact O-N 3.13Å
91	L	97.1	Very high	93.6	Very high	112 Å²	112	67.9 Å²	67.9	59%	0.586	36%	0.359	S	S	*	.	H	α-helix	trans	-62.3	-38.9	177.3	-72	175.5	0	0	0	112	I87 A93 G94	I87-L91 HydrophobicContact CG2-CD1 3.79Å; I87-L91 HydrophobicContact CG2-CG 4.14Å; I87-L91 WeakPolarHBondContact O-CB 3.39Å; I87-L91 VanDerWaalsContact O-CG 3.29Å; I87-L91 WeakPolarHBondContact O-CG 3.3Å; I87-L91 PolarHBondContact O-N 3.38Å; L91-A93 VanDerWaalsContact C-N 3.26Å; L91-A93 PolarHBondContact O-N 2.86Å; L91-G94 PolarHBondContact O-N 3.29Å; L91-G94 VanDerWaalsContact O-N 3.13Å
92	S	96.4	Very high	93.3	Very high	8 Å²	8	74.5 Å²	74.5	6%	0.056	38%	0.383	C	S	.	.	H	α-helix	trans	-71.8	-18.1	177.7	52.2	0	0	0	0	113.7	G88 A89 W90 G94 F95 P110 C111	G88-S92 WeakPolarHBondContact O-CB 3.37Å; G88-S92 PolarHBondContact O-N 2.95Å; G88-S92 VanDerWaalsContact O-N 3.1Å; G88-S92 PolarHBondContact O-OG 2.66Å; A89-S92 WeakPolarHBondContact CA-OG 3.15Å; A89-S92 PolarHBondContact O-OG 3.32Å; W90-S92 VanDerWaalsContact C-N 3.3Å; W90-S92 PolarHBondContact O-N 2.83Å; S92-G94 PolarHBondContact O-N 3.04Å; S92-F95 WeakPolarHBondContact O-CB 3.37Å; S92-F95 PolarHBondContact O-N 3.32Å; S92-P110 VanDerWaalsContact CB-O 3.23Å; S92-P110 WeakPolarHBondContact CB-O 3.39Å; S92-P110 PolarHBondContact OG-O 3.41Å; S92-C111 WeakPolarHBondContact OG-CA 3.38Å
93	A	93.7	Very high	93.1	Very high	30 Å²	30	79.2 Å²	79.2	25%	0.248	41%	0.412	C	S	.	.	H	α-helix	trans	-61.3	-23.5	168.8	0	0	0	0	0	112	A89 W90 L91 F95 L96	A89-A93 PolarHBondContact O-N 2.9Å; W90-A93 VanDerWaalsContact O-CB 3.23Å; W90-A93 WeakPolarHBondContact O-CB 3.35Å; W90-A93 PolarHBondContact O-N 3.01Å; W90-A93 VanDerWaalsContact O-N 3.13Å; L91-A93 VanDerWaalsContact C-N 3.26Å; L91-A93 PolarHBondContact O-N 2.86Å; A93-F95 PolarHBondContact O-N 3.01Å; A93-L96 HydrophobicContact CB-CD1 4.13Å; A93-L96 WeakPolarHBondContact O-CB 3.43Å; A93-L96 WeakPolarHBondContact O-CG 3.48Å; A93-L96 PolarHBondContact O-N 3.21Å
94	G	92.6	Very high	92.8	Very high	46 Å²	46	79.8 Å²	79.8	47%	0.474	41%	0.413	S	S	.	.	H	α-helix	trans	-59.5	-30.6	171.3	0	0	0	0	0	113.3	L91 S92 L96 V97	L91-G94 PolarHBondContact O-N 3.29Å; L91-G94 VanDerWaalsContact O-N 3.13Å; S92-G94 PolarHBondContact O-N 3.04Å; G94-L96 PolarHBondContact O-N 2.9Å; G94-V97 PolarHBondContact O-N 2.86Å
95	F	92.2	Very high	92.6	Very high	92 Å²	92	80 Å²	80	40%	0.404	41%	0.411	S	S	.	.	H	α-helix	trans	-66.5	-23.7	174.3	-68.9	-66.5	0	0	0	112.4	S92 A93 V97 L98 W104 Q105 P110	S92-F95 WeakPolarHBondContact O-CB 3.37Å; S92-F95 PolarHBondContact O-N 3.32Å; A93-F95 PolarHBondContact O-N 3.01Å; F95-V97 PolarHBondContact O-N 2.99Å; F95-L98 HydrophobicContact CD1-CD2 4.29Å; F95-L98 PolarHBondContact O-N 3.28Å; F95-W104 HydrophobicContact CB-CZ3 4.31Å; F95-W104 HydrophobicContact CD1-CH2 4.26Å; F95-W104 HydrophobicContact CD1-CZ3 4.42Å; F95-W104 HydrophobicContact CG-CZ3 4.35Å; F95-Q105 WeakPolarHBondContact O-CG 3.28Å; F95-Q105 PolarHBondContact O-NE2 3.33Å; F95-P110 HydrophobicContact CB-CB 4.12Å; F95-P110 HydrophobicContact CB-CG 4.46Å
96	L	90.9	Very high	92.4	Very high	59 Å²	59	82.4 Å²	82.4	31%	0.309	43%	0.431	S	S	.	.	H	α-helix	trans	-64.1	-31.2	176	-57.5	170.3	0	0	0	111.7	A93 G94 Q105 W107 P110	A93-L96 HydrophobicContact CB-CD1 4.13Å; A93-L96 WeakPolarHBondContact O-CB 3.43Å; A93-L96 WeakPolarHBondContact O-CG 3.48Å; A93-L96 PolarHBondContact O-N 3.21Å; G94-L96 PolarHBondContact O-N 2.9Å; L96-Q105 WeakPolarHBondContact CD2-O 3.47Å; L96-Q105 PolarHBondContact O-NE2 3.36Å; L96-W107 HydrophobicContact CD1-CE3 3.76Å; L96-W107 HydrophobicContact CD1-CZ3 4.16Å; L96-P110 HydrophobicContact CD2-CG 4.06Å
97	V	88.4	Confident	92.2	Very high	127 Å²	127	81.5 Å²	81.5	77%	0.77	42%	0.42	S	S	*	.	H	α-helix	trans	-84	-19	-177.1	-176	0	0	0	0	112.3	G94 F95 D99	G94-V97 PolarHBondContact O-N 2.86Å; F95-V97 PolarHBondContact O-N 2.99Å; V97-D99 PolarHBondContact O-N 2.8Å
98	L	89.6	Confident	92.1	Very high	65 Å²	65	77.5 Å²	77.5	34%	0.34	40%	0.4	S	S	.	.	S	Bend	trans	-74.4	116.2	-176	-174.4	57	0	0	0	110.2	F95 W100 Q105	F95-L98 HydrophobicContact CD1-CD2 4.29Å; F95-L98 PolarHBondContact O-N 3.28Å; L98-W100 HydrophobicContact CD2-CD2 3.52Å; L98-W100 HydrophobicContact CD2-CE3 3.64Å; L98-W100 HydrophobicContact CD2-CG 4.25Å; L98-W100 HydrophobicContact CD2-CH2 3.63Å; L98-W100 HydrophobicContact CD2-CZ2 3.48Å; L98-W100 VanDerWaalsContact CD2-CZ2 3.48Å; L98-W100 HydrophobicContact CD2-CZ3 3.7Å; L98-W100 HydrophobicContact CG-CD2 3.76Å; L98-W100 HydrophobicContact CG-CE3 4.29Å; L98-W100 HydrophobicContact CG-CG 3.95Å; L98-W100 HydrophobicContact CG-CZ2 4.27Å; L98-W100 PolarHBondContact O-N 3.37Å; L98-Q105 PolarHBondContact O-NE2 3.22Å; L98-Q105 PolarHBondContact O-OE1 3.07Å; L98-Q105 VanDerWaalsContact O-OE1 3.09Å
99	D	78.7	Confident	92	Very high	131 Å²	131	80.3 Å²	80.3	70%	0.701	41%	0.411	S	S	*	.	S	Bend	trans	-73.9	59.7	-172.7	-166.9	31.4	0	0	0	113.7	V97	V97-D99 PolarHBondContact O-N 2.8Å
100	W	84.8	Confident	91.9	Very high	141 Å²	141	80.1 Å²	80.1	53%	0.534	41%	0.41	S	S	.	.			trans	-98.3	-9.7	175.1	-69.2	-8.8	0	0	0	112.7	L98 R102 W104	L98-W100 HydrophobicContact CD2-CD2 3.52Å; L98-W100 HydrophobicContact CD2-CE3 3.64Å; L98-W100 HydrophobicContact CD2-CG 4.25Å; L98-W100 HydrophobicContact CD2-CH2 3.63Å; L98-W100 HydrophobicContact CD2-CZ2 3.48Å; L98-W100 VanDerWaalsContact CD2-CZ2 3.48Å; L98-W100 HydrophobicContact CD2-CZ3 3.7Å; L98-W100 HydrophobicContact CG-CD2 3.76Å; L98-W100 HydrophobicContact CG-CE3 4.29Å; L98-W100 HydrophobicContact CG-CG 3.95Å; L98-W100 HydrophobicContact CG-CZ2 4.27Å; L98-W100 PolarHBondContact O-N 3.37Å; W100-R102 VanDerWaalsContact C-N 3.28Å; W100-R102 HydrophobicContact CB-CG 4.17Å; W100-R102 WeakPolarHBondContact O-CD 3.43Å; W100-R102 WeakPolarHBondContact O-CG 3.5Å; W100-R102 PolarHBondContact O-N 2.96Å; W100-R102 PolarHBondContact O-NE 3.43Å; W100-W104 AromaticContact CE3-CH2 3.93Å; W100-W104 HydrophobicContact CE3-CH2 3.93Å; W100-W104 AromaticContact CE3-CZ2 3.69Å; W100-W104 HydrophobicContact CE3-CZ2 3.69Å; W100-W104 AromaticContact CZ3-CH2 4Å; W100-W104 HydrophobicContact CZ3-CH2 4Å; W100-W104 AromaticContact CZ3-CZ2 3.96Å; W100-W104 HydrophobicContact CZ3-CZ2 3.96Å
101	D	84	Confident	92	Very high	138 Å²	138	72.1 Å²	72.1	74%	0.738	38%	0.38	S	S	*	.			trans	45.2	46.9	178.1	-78.4	-30.7	0	0	0	113.7
102	R	92.3	Very high	92	Very high	152 Å²	152	68.2 Å²	68.2	57%	0.574	36%	0.359	S	S	*	.			trans	-100.5	145.5	179.7	-60.6	-51.8	-176.3	169.1	-2	112.3	W100 W104 Q105	W100-R102 VanDerWaalsContact C-N 3.28Å; W100-R102 HydrophobicContact CB-CG 4.17Å; W100-R102 WeakPolarHBondContact O-CD 3.43Å; W100-R102 WeakPolarHBondContact O-CG 3.5Å; W100-R102 PolarHBondContact O-N 2.96Å; W100-R102 PolarHBondContact O-NE 3.43Å; R102-W104 VanDerWaalsContact C-N 3.25Å; R102-W104 VanDerWaalsContact CB-CD1 3.49Å; R102-W104 HydrophobicContact CB-CD2 4.38Å; R102-W104 HydrophobicContact CB-CG 4.18Å; R102-W104 PolarHBondContact O-N 2.82Å; R102-Q105 HydrophobicContact CB-CB 4.43Å; R102-Q105 WeakPolarHBondContact O-CA 3.41Å; R102-Q105 WeakPolarHBondContact O-CB 3.17Å; R102-Q105 PolarHBondContact O-N 3.2Å
103	P	92.5	Very high	92.1	Very high	107 Å²	107	71.9 Å²	71.9	70%	0.695	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-61.7	-32	-179.9	24.4	-34.8	0	0	0	113.1	Q105 A106 I109	P103-Q105 PolarHBondContact O-N 3.27Å; P103-A106 WeakPolarHBondContact O-CB 3.24Å; P103-A106 PolarHBondContact O-N 3.43Å; P103-I109 WeakPolarHBondContact O-CD1 3.2Å
104	W	92.6	Very high	92.3	Very high	106 Å²	106	70.8 Å²	70.8	40%	0.402	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-68.3	-17.5	175.1	65.6	-100.9	0	0	0	113.1	F95 W100 R102 A106 I109 P110	F95-W104 HydrophobicContact CB-CZ3 4.31Å; F95-W104 HydrophobicContact CD1-CH2 4.26Å; F95-W104 HydrophobicContact CD1-CZ3 4.42Å; F95-W104 HydrophobicContact CG-CZ3 4.35Å; W100-W104 AromaticContact CE3-CH2 3.93Å; W100-W104 HydrophobicContact CE3-CH2 3.93Å; W100-W104 AromaticContact CE3-CZ2 3.69Å; W100-W104 HydrophobicContact CE3-CZ2 3.69Å; W100-W104 AromaticContact CZ3-CH2 4Å; W100-W104 HydrophobicContact CZ3-CH2 4Å; W100-W104 AromaticContact CZ3-CZ2 3.96Å; W100-W104 HydrophobicContact CZ3-CZ2 3.96Å; R102-W104 VanDerWaalsContact C-N 3.25Å; R102-W104 VanDerWaalsContact CB-CD1 3.49Å; R102-W104 HydrophobicContact CB-CD2 4.38Å; R102-W104 HydrophobicContact CB-CG 4.18Å; R102-W104 PolarHBondContact O-N 2.82Å; W104-A106 VanDerWaalsContact C-N 3.35Å; W104-I109 WeakPolarHBondContact O-CB 3.38Å; W104-I109 WeakPolarHBondContact O-CG2 3.16Å; W104-P110 VanDerWaalsContact O-CD 3.32Å; W104-P110 WeakPolarHBondContact O-CD 3.26Å; W104-P110 WeakPolarHBondContact O-CG 3.34Å
105	Q	94.1	Very high	92.6	Very high	18 Å²	18	68.6 Å²	68.6	8%	0.084	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-85.1	-10.7	178.6	-155.7	-169.4	-49.3	0	0	112.3	F95 L96 L98 R102 P103	F95-Q105 WeakPolarHBondContact O-CG 3.28Å; F95-Q105 PolarHBondContact O-NE2 3.33Å; L96-Q105 WeakPolarHBondContact CD2-O 3.47Å; L96-Q105 PolarHBondContact O-NE2 3.36Å; L98-Q105 PolarHBondContact O-NE2 3.22Å; L98-Q105 PolarHBondContact O-OE1 3.07Å; L98-Q105 VanDerWaalsContact O-OE1 3.09Å; R102-Q105 HydrophobicContact CB-CB 4.43Å; R102-Q105 WeakPolarHBondContact O-CA 3.41Å; R102-Q105 WeakPolarHBondContact O-CB 3.17Å; R102-Q105 PolarHBondContact O-N 3.2Å; P103-Q105 PolarHBondContact O-N 3.27Å
106	A	93.1	Very high	92.8	Very high	51 Å²	51	68.8 Å²	68.8	42%	0.421	35%	0.35	S	S	.	.	S	Bend	trans	-64.5	142.5	180	0	0	0	0	0	111.8	P103 W104 I109 P110	P103-A106 WeakPolarHBondContact O-CB 3.24Å; P103-A106 PolarHBondContact O-N 3.43Å; W104-A106 VanDerWaalsContact C-N 3.35Å; A106-I109 HydrophobicContact CB-CD1 4.49Å; A106-I109 WeakPolarHBondContact O-CB 3.02Å; A106-I109 PolarHBondContact O-N 3.29Å; A106-P110 WeakPolarHBondContact O-CD 3.45Å
107	W	93.8	Very high	93.2	Very high	45 Å²	45	70.9 Å²	70.9	17%	0.17	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	133.1	172.6	176.3	-103.5	0	0	0	110.5	A29 P30 T38 M41 L96 C111	A29-W107 HydrophobicContact CB-CH2 4.05Å; A29-W107 HydrophobicContact CB-CZ2 3.52Å; P30-W107 VanDerWaalsContact CG-CD1 3.46Å; P30-W107 HydrophobicContact CG-CG 4.2Å; T38-W107 PolarHBondContact OG1-NE1 2.85Å; T38-W107 VanDerWaalsContact OG1-NE1 3.12Å; M41-W107 HydrophobicContact CB-CH2 4.33Å; M41-W107 HydrophobicContact CB-CZ2 3.99Å; M41-W107 HydrophobicContact CG-CH2 3.83Å; M41-W107 HydrophobicContact CG-CZ2 3.99Å; L96-W107 HydrophobicContact CD1-CE3 3.76Å; L96-W107 HydrophobicContact CD1-CZ3 4.16Å; W107-C111 HydrophobicContact CZ3-CB 4.13Å
108	P	95.6	Very high	93.7	Very high	8 Å²	8	65.2 Å²	65.2	5%	0.052	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	cis	-104.8	19.1	4	39.5	-28.6	0	0	0	113.1	E37 M41 C111 I112	E37-P108 HydrophobicContact CB-CG 4.12Å; E37-P108 WeakPolarHBondContact O-CG 3.39Å; M41-P108 HydrophobicContact CB-CB 3.84Å; M41-P108 HydrophobicContact CG-CB 4.41Å; M41-P108 HydrophobicContact SD-CB 4.48Å; P108-C111 PolarHBondContact O-N 3.3Å; P108-I112 HydrophobicContact CB-CD1 4.27Å; P108-I112 HydrophobicContact CB-CG1 4.41Å; P108-I112 HydrophobicContact CG-CD1 3.73Å; P108-I112 HydrophobicContact CG-CG1 4.39Å; P108-I112 WeakPolarHBondContact O-CG1 3.43Å; P108-I112 PolarHBondContact O-N 2.85Å
109	I	95.6	Very high	94.1	Very high	72 Å²	72	63.6 Å²	63.6	37%	0.369	32%	0.322	S	S	.	.	H	α-helix	trans	-59.4	-50.5	-165.3	-59	165.9	0	0	0	112.5	P103 W104 A106 C111 I112 I113	P103-I109 WeakPolarHBondContact O-CD1 3.2Å; W104-I109 WeakPolarHBondContact O-CB 3.38Å; W104-I109 WeakPolarHBondContact O-CG2 3.16Å; A106-I109 HydrophobicContact CB-CD1 4.49Å; A106-I109 WeakPolarHBondContact O-CB 3.02Å; A106-I109 PolarHBondContact O-N 3.29Å; I109-C111 VanDerWaalsContact C-N 3.29Å; I109-C111 PolarHBondContact O-N 3.17Å; I109-I112 PolarHBondContact O-N 3.47Å; I109-I113 HydrophobicContact CG2-CD1 3.9Å; I109-I113 WeakPolarHBondContact O-CG1 3.44Å; I109-I113 PolarHBondContact O-N 3.39Å
110	P	96.4	Very high	95	Very high	4 Å²	4	62.7 Å²	62.7	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-59.1	-42.1	178.3	-25.8	36.6	0	0	0	112.2	S92 F95 L96 W104 A106 I113 G114	S92-P110 VanDerWaalsContact CB-O 3.23Å; S92-P110 WeakPolarHBondContact CB-O 3.39Å; S92-P110 PolarHBondContact OG-O 3.41Å; F95-P110 HydrophobicContact CB-CB 4.12Å; F95-P110 HydrophobicContact CB-CG 4.46Å; L96-P110 HydrophobicContact CD2-CG 4.06Å; W104-P110 VanDerWaalsContact O-CD 3.32Å; W104-P110 WeakPolarHBondContact O-CD 3.26Å; W104-P110 WeakPolarHBondContact O-CG 3.34Å; A106-P110 WeakPolarHBondContact O-CD 3.45Å; P110-I113 PolarHBondContact O-N 3.47Å; P110-G114 PolarHBondContact O-N 3.41Å
111	C	97	Very high	95.7	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.02	31%	0.308	C	S	.	.	H	α-helix	trans	-66.3	-37.5	-178.9	-66.9	0	0	0	0	112.8	M41 S92 W107 P108 I109 G114 A115	M41-C111 HydrophobicContact CE-CB 3.6Å; M41-C111 HydrophobicContact SD-CB 3.7Å; S92-C111 WeakPolarHBondContact OG-CA 3.38Å; W107-C111 HydrophobicContact CZ3-CB 4.13Å; P108-C111 PolarHBondContact O-N 3.3Å; I109-C111 VanDerWaalsContact C-N 3.29Å; I109-C111 PolarHBondContact O-N 3.17Å; C111-G114 PolarHBondContact O-N 3.42Å; C111-A115 VanDerWaalsContact O-CB 3.27Å; C111-A115 WeakPolarHBondContact O-CB 3.31Å; C111-A115 PolarHBondContact O-N 2.84Å
112	I	98	Very high	96.4	Very high	30 Å²	30	53 Å²	53	15%	0.154	27%	0.273	C	S	.	.	H	α-helix	trans	-65.4	-46.5	173.2	-70.3	175.9	0	0	0	110.7	L40 M41 V44 P108 I109 G114 A115 I116	L40-I112 HydrophobicContact CD2-CD1 3.83Å; L40-I112 HydrophobicContact CG-CD1 3.88Å; M41-I112 HydrophobicContact SD-CG1 3.89Å; V44-I112 HydrophobicContact CB-CG1 4.47Å; V44-I112 HydrophobicContact CG1-CG2 4.38Å; V44-I112 HydrophobicContact CG2-CD1 4.19Å; V44-I112 HydrophobicContact CG2-CG1 4.17Å; V44-I112 HydrophobicContact CG2-CG2 4.36Å; P108-I112 HydrophobicContact CB-CD1 4.27Å; P108-I112 HydrophobicContact CB-CG1 4.41Å; P108-I112 HydrophobicContact CG-CD1 3.73Å; P108-I112 HydrophobicContact CG-CG1 4.39Å; P108-I112 WeakPolarHBondContact O-CG1 3.43Å; P108-I112 PolarHBondContact O-N 2.85Å; I109-I112 PolarHBondContact O-N 3.47Å; I112-G114 VanDerWaalsContact C-N 3.32Å; I112-G114 PolarHBondContact O-N 3.27Å; I112-A115 WeakPolarHBondContact O-CB 3.31Å; I112-A115 PolarHBondContact O-N 2.74Å; I112-I116 HydrophobicContact CG2-CD1 3.91Å; I112-I116 WeakPolarHBondContact O-CG1 3.28Å; I112-I116 PolarHBondContact O-N 3.38Å
113	I	97.9	Very high	96.6	Very high	84 Å²	84	50.7 Å²	50.7	43%	0.431	27%	0.265	S	S	.	.	H	α-helix	trans	-59.9	-46.4	177.5	-66	169.2	0	0	0	109.8	I109 P110 A115 I116 L117	I109-I113 HydrophobicContact CG2-CD1 3.9Å; I109-I113 WeakPolarHBondContact O-CG1 3.44Å; I109-I113 PolarHBondContact O-N 3.39Å; P110-I113 PolarHBondContact O-N 3.47Å; I113-A115 PolarHBondContact O-N 3.26Å; I113-I116 PolarHBondContact O-N 3.01Å; I113-L117 HydrophobicContact CG2-CD1 3.81Å; I113-L117 HydrophobicContact CG2-CG 4.3Å; I113-L117 WeakPolarHBondContact O-CB 3.42Å; I113-L117 WeakPolarHBondContact O-CG 3.25Å; I113-L117 PolarHBondContact O-N 3.06Å
114	G	98.2	Very high	96.9	Very high	8 Å²	8	49.1 Å²	49.1	8%	0.082	25%	0.249	C	C	.	.	H	α-helix	trans	-62.4	-39	176	0	0	0	0	0	113.3	G88 P110 C111 I112 G118	G88-G114 VanDerWaalsContact C-C 3.42Å; G88-G114 CarbonylContact C-O 3.6Å; G88-G114 WeakPolarHBondContact CA-O 3.42Å; G88-G114 WeakPolarHBondContact O-CA 3.37Å; P110-G114 PolarHBondContact O-N 3.41Å; C111-G114 PolarHBondContact O-N 3.42Å; I112-G114 VanDerWaalsContact C-N 3.32Å; I112-G114 PolarHBondContact O-N 3.27Å; G114-G118 WeakPolarHBondContact O-CA 3.46Å; G114-G118 PolarHBondContact O-N 3.4Å
115	A	98.5	Very high	97.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62	-44.9	175.7	0	0	0	0	0	111.7	V44 L45 A89 C111 I112 I113 T119	V44-A115 HydrophobicContact CG1-CB 4.18Å; L45-A115 HydrophobicContact CD2-CB 4.47Å; A89-A115 HydrophobicContact CB-CB 4.06Å; C111-A115 VanDerWaalsContact O-CB 3.27Å; C111-A115 WeakPolarHBondContact O-CB 3.31Å; C111-A115 PolarHBondContact O-N 2.84Å; I112-A115 WeakPolarHBondContact O-CB 3.31Å; I112-A115 PolarHBondContact O-N 2.74Å; I113-A115 PolarHBondContact O-N 3.26Å; A115-T119 WeakPolarHBondContact O-CB 3.2Å; A115-T119 PolarHBondContact O-N 2.89Å; A115-T119 PolarHBondContact O-OG1 2.74Å
116	I	98.3	Very high	97.3	Very high	95 Å²	95	47.9 Å²	47.9	49%	0.487	25%	0.249	S	C	.	.	H	α-helix	trans	-68.2	-49.8	179.8	-66.1	167.9	0	0	0	110.6	I112 I113 G118 T119 F120	I112-I116 HydrophobicContact CG2-CD1 3.91Å; I112-I116 WeakPolarHBondContact O-CG1 3.28Å; I112-I116 PolarHBondContact O-N 3.38Å; I113-I116 PolarHBondContact O-N 3.01Å; I116-G118 VanDerWaalsContact C-N 3.3Å; I116-G118 PolarHBondContact O-N 3.49Å; I116-T119 WeakPolarHBondContact O-CB 3.4Å; I116-T119 PolarHBondContact O-N 3.48Å; I116-F120 PolarHBondContact O-N 2.94Å
117	L	98.3	Very high	97.5	Very high	103 Å²	103	51 Å²	51	54%	0.539	25%	0.253	S	S	.	.	H	α-helix	trans	-62.2	-40.3	177.4	-70.1	178.3	0	0	0	111.4	I113 F120 T121	I113-L117 HydrophobicContact CG2-CD1 3.81Å; I113-L117 HydrophobicContact CG2-CG 4.3Å; I113-L117 WeakPolarHBondContact O-CB 3.42Å; I113-L117 WeakPolarHBondContact O-CG 3.25Å; I113-L117 PolarHBondContact O-N 3.06Å; L117-F120 PolarHBondContact O-N 3.4Å; L117-T121 WeakPolarHBondContact O-CB 3.43Å; L117-T121 PolarHBondContact O-N 3.04Å; L117-T121 PolarHBondContact O-OG1 3.01Å; L117-T121 VanDerWaalsContact O-OG1 3.07Å
118	G	98.5	Very high	97.7	Very high	9 Å²	9	53.8 Å²	53.8	9%	0.093	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-43.7	175.5	0	0	0	0	0	112.7	G84 G114 I116 F120 T121 G122	G84-G118 CarbonylContact C-O 3.27Å; G84-G118 VanDerWaalsContact C-O 3.27Å; G84-G118 VanDerWaalsContact CA-O 3.26Å; G84-G118 WeakPolarHBondContact CA-O 3.35Å; G84-G118 CarbonylContact O-C 3.37Å; G84-G118 VanDerWaalsContact O-C 3.31Å; G84-G118 WeakPolarHBondContact O-CA 3.39Å; G114-G118 WeakPolarHBondContact O-CA 3.46Å; G114-G118 PolarHBondContact O-N 3.4Å; I116-G118 VanDerWaalsContact C-N 3.3Å; I116-G118 PolarHBondContact O-N 3.49Å; G118-F120 VanDerWaalsContact C-N 3.34Å; G118-F120 PolarHBondContact O-N 3.34Å; G118-T121 PolarHBondContact O-N 3.38Å; G118-G122 PolarHBondContact O-N 3.5Å
119	T	98.3	Very high	97.7	Very high	30 Å²	30	56.8 Å²	56.8	18%	0.184	29%	0.286	C	S	.	.	H	α-helix	trans	-57.1	-48	173.3	-58.9	0	0	0	0	110.6	I81 C85 A115 I116 G122 W123	I81-T119 HydrophobicContact CG2-CG2 3.61Å; C85-T119 VanDerWaalsContact CB-OG1 3.3Å; C85-T119 WeakPolarHBondContact CB-OG1 3.48Å; A115-T119 WeakPolarHBondContact O-CB 3.2Å; A115-T119 PolarHBondContact O-N 2.89Å; A115-T119 PolarHBondContact O-OG1 2.74Å; I116-T119 WeakPolarHBondContact O-CB 3.4Å; I116-T119 PolarHBondContact O-N 3.48Å; T119-G122 PolarHBondContact O-N 3.4Å; T119-W123 PolarHBondContact O-N 2.98Å
120	F	98.2	Very high	97.7	Very high	113 Å²	113	54.8 Å²	54.8	50%	0.496	28%	0.278	S	S	.	.	H	α-helix	trans	-63.9	-46.4	178.9	178	-102	0	0	0	112.4	I116 L117 G118 G122 W123 M124	I116-F120 PolarHBondContact O-N 2.94Å; L117-F120 PolarHBondContact O-N 3.4Å; G118-F120 VanDerWaalsContact C-N 3.34Å; G118-F120 PolarHBondContact O-N 3.34Å; F120-G122 VanDerWaalsContact C-N 3.34Å; F120-G122 PolarHBondContact O-N 2.87Å; F120-W123 AromaticContact CD2-CE3 3.98Å; F120-W123 HydrophobicContact CD2-CE3 3.98Å; F120-W123 HydrophobicContact CD2-CZ3 4.29Å; F120-W123 AromaticContact CE2-CE3 3.98Å; F120-W123 HydrophobicContact CE2-CE3 3.98Å; F120-W123 AromaticContact CE2-CZ3 3.9Å; F120-W123 HydrophobicContact CE2-CZ3 3.9Å; F120-W123 WeakPolarHBondContact O-CB 3.45Å; F120-W123 PolarHBondContact O-N 3Å; F120-M124 HydrophobicContact CD1-CG 4.33Å; F120-M124 HydrophobicContact CE1-CG 3.9Å; F120-M124 HydrophobicContact CE2-CE 4.07Å; F120-M124 HydrophobicContact CE2-CG 4.46Å; F120-M124 HydrophobicContact CZ-CE 4.18Å; F120-M124 HydrophobicContact CZ-CG 3.97Å; F120-M124 HydrophobicContact CZ-SD 4.25Å; F120-M124 WeakPolarHBondContact O-CG 3.47Å; F120-M124 PolarHBondContact O-N 3.2Å
121	T	98.3	Very high	97.7	Very high	72 Å²	72	58.4 Å²	58.4	44%	0.442	30%	0.303	S	S	.	.	H	α-helix	trans	-63.2	-40.2	177.1	-63.2	0	0	0	0	111.6	L117 G118 W123 M124 I125	L117-T121 WeakPolarHBondContact O-CB 3.43Å; L117-T121 PolarHBondContact O-N 3.04Å; L117-T121 PolarHBondContact O-OG1 3.01Å; L117-T121 VanDerWaalsContact O-OG1 3.07Å; G118-T121 PolarHBondContact O-N 3.38Å; T121-W123 VanDerWaalsContact C-N 3.33Å; T121-W123 PolarHBondContact O-N 3.44Å; T121-M124 PolarHBondContact O-N 2.96Å; T121-I125 HydrophobicContact CG2-CD1 3.79Å; T121-I125 HydrophobicContact CG2-CG1 4.29Å; T121-I125 VanDerWaalsContact O-CG1 3.28Å; T121-I125 WeakPolarHBondContact O-CG1 3.42Å; T121-I125 PolarHBondContact O-N 3.21Å
122	G	98.3	Very high	97.7	Very high	2 Å²	2	63.2 Å²	63.2	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-58.1	-45.3	173.9	0	0	0	0	0	112.1	F80 G118 T119 F120 I125 F126	F80-G122 WeakPolarHBondContact O-CA 3.37Å; G118-G122 PolarHBondContact O-N 3.5Å; T119-G122 PolarHBondContact O-N 3.4Å; F120-G122 VanDerWaalsContact C-N 3.34Å; F120-G122 PolarHBondContact O-N 2.87Å; G122-I125 PolarHBondContact O-N 3.36Å; G122-F126 PolarHBondContact O-N 3.32Å
123	W	97.6	Very high	97.5	Very high	104 Å²	104	64 Å²	64	39%	0.394	34%	0.336	S	S	.	.	H	α-helix	trans	-60.9	-44.6	173.6	176.5	49.1	0	0	0	112.8	F77 I81 T119 F120 T121 F126 K127	F77-W123 AromaticContact CE2-CD1 3.55Å; F77-W123 AromaticContact CE2-NE1 3.96Å; I81-W123 HydrophobicContact CD1-CB 4.36Å; I81-W123 HydrophobicContact CG1-CB 4.14Å; T119-W123 PolarHBondContact O-N 2.98Å; F120-W123 AromaticContact CD2-CE3 3.98Å; F120-W123 HydrophobicContact CD2-CE3 3.98Å; F120-W123 HydrophobicContact CD2-CZ3 4.29Å; F120-W123 AromaticContact CE2-CE3 3.98Å; F120-W123 HydrophobicContact CE2-CE3 3.98Å; F120-W123 AromaticContact CE2-CZ3 3.9Å; F120-W123 HydrophobicContact CE2-CZ3 3.9Å; F120-W123 WeakPolarHBondContact O-CB 3.45Å; F120-W123 PolarHBondContact O-N 3Å; T121-W123 VanDerWaalsContact C-N 3.33Å; T121-W123 PolarHBondContact O-N 3.44Å; W123-F126 PolarHBondContact O-N 2.96Å; W123-K127 WeakPolarHBondContact O-CG 3.38Å; W123-K127 PolarHBondContact O-N 3.24Å
124	M	98.3	Very high	97.4	Very high	75 Å²	75	69 Å²	69	37%	0.369	35%	0.349	S	S	.	.	H	α-helix	trans	-60.7	-45.4	176.6	-74.1	-62.1	109.6	0	0	112.3	F120 T121 F126 K127 L128	F120-M124 HydrophobicContact CD1-CG 4.33Å; F120-M124 HydrophobicContact CE1-CG 3.9Å; F120-M124 HydrophobicContact CE2-CE 4.07Å; F120-M124 HydrophobicContact CE2-CG 4.46Å; F120-M124 HydrophobicContact CZ-CE 4.18Å; F120-M124 HydrophobicContact CZ-CG 3.97Å; F120-M124 HydrophobicContact CZ-SD 4.25Å; F120-M124 WeakPolarHBondContact O-CG 3.47Å; F120-M124 PolarHBondContact O-N 3.2Å; T121-M124 PolarHBondContact O-N 2.96Å; M124-F126 PolarHBondContact O-N 3.26Å; M124-K127 PolarHBondContact O-N 3.36Å; M124-L128 WeakPolarHBondContact O-CB 3.41Å; M124-L128 PolarHBondContact O-N 2.92Å
125	I	98.2	Very high	97.3	Very high	73 Å²	73	76.4 Å²	76.4	37%	0.374	38%	0.376	S	S	.	.	H	α-helix	trans	-61.8	-46	178.2	-68.7	167.5	0	0	0	110.4	F80 T121 G122 K127 L128 I129	F80-I125 HydrophobicContact CD1-CB 4.36Å; F80-I125 HydrophobicContact CD1-CG2 3.79Å; F80-I125 HydrophobicContact CE1-CG2 3.57Å; T121-I125 HydrophobicContact CG2-CD1 3.79Å; T121-I125 HydrophobicContact CG2-CG1 4.29Å; T121-I125 VanDerWaalsContact O-CG1 3.28Å; T121-I125 WeakPolarHBondContact O-CG1 3.42Å; T121-I125 PolarHBondContact O-N 3.21Å; G122-I125 PolarHBondContact O-N 3.36Å; I125-K127 VanDerWaalsContact C-N 3.33Å; I125-K127 PolarHBondContact O-N 3.44Å; I125-L128 PolarHBondContact O-N 3.46Å; I125-I129 HydrophobicContact CG2-CD1 3.68Å; I125-I129 HydrophobicContact CG2-CG1 4.35Å; I125-I129 WeakPolarHBondContact O-CG1 3.26Å; I125-I129 PolarHBondContact O-N 2.91Å
126	F	97.3	Very high	97.2	Very high	25 Å²	25	85 Å²	85	11%	0.11	41%	0.408	C	S	.	.	H	α-helix	trans	-58.4	-45	176.1	169.5	-99.6	0	0	0	112.2	P73 K76 F77 F80 G122 W123 M124 I129 S130	P73-F126 WeakPolarHBondContact O-CE2 3.32Å; P73-F126 WeakPolarHBondContact O-CZ 3.45Å; K76-F126 HydrophobicContact CB-CD2 4.05Å; K76-F126 HydrophobicContact CB-CE2 3.81Å; F77-F126 HydrophobicContact CB-CD1 4.15Å; F77-F126 HydrophobicContact CB-CD2 4.26Å; F77-F126 HydrophobicContact CB-CE1 3.81Å; F77-F126 HydrophobicContact CB-CE2 3.93Å; F77-F126 HydrophobicContact CB-CG 4.35Å; F77-F126 HydrophobicContact CB-CZ 3.69Å; F77-F126 AromaticContact CD2-CD1 3.61Å; F77-F126 HydrophobicContact CD2-CD1 3.61Å; F77-F126 AromaticContact CD2-CE1 3.66Å; F77-F126 HydrophobicContact CD2-CE1 3.66Å; F77-F126 HydrophobicContact CD2-CG 4.31Å; F77-F126 HydrophobicContact CD2-CZ 4.42Å; F77-F126 HydrophobicContact CG-CD1 4.37Å; F77-F126 HydrophobicContact CG-CE1 4.2Å; F80-F126 HydrophobicContact CB-CB 3.89Å; F80-F126 HydrophobicContact CD2-CB 4.18Å; F80-F126 HydrophobicContact CD2-CD2 4.08Å; F80-F126 HydrophobicContact CG-CB 4.06Å; G122-F126 PolarHBondContact O-N 3.32Å; W123-F126 PolarHBondContact O-N 2.96Å; M124-F126 PolarHBondContact O-N 3.26Å; F126-I129 PolarHBondContact O-N 3.25Å; F126-S130 WeakPolarHBondContact CZ-OG 3.34Å; F126-S130 VanDerWaalsContact O-CB 3.26Å; F126-S130 WeakPolarHBondContact O-CB 3.44Å; F126-S130 PolarHBondContact O-N 2.88Å; F126-S130 PolarHBondContact O-OG 2.76Å
127	K	97.4	Very high	97	Very high	116 Å²	116	85.9 Å²	85.9	50%	0.504	41%	0.413	S	S	.	.	H	α-helix	trans	-62.9	-42.1	177.9	-75.6	-69.6	-62.3	-170.3	0	111.6	W123 M124 I125 S130 C131	W123-K127 WeakPolarHBondContact O-CG 3.38Å; W123-K127 PolarHBondContact O-N 3.24Å; M124-K127 PolarHBondContact O-N 3.36Å; I125-K127 VanDerWaalsContact C-N 3.33Å; I125-K127 PolarHBondContact O-N 3.44Å; K127-S130 PolarHBondContact O-N 3.4Å; K127-C131 VanDerWaalsContact O-CB 3.3Å; K127-C131 WeakPolarHBondContact O-CB 3.3Å; K127-C131 PolarHBondContact O-N 2.91Å
128	L	97.7	Very high	96.8	Very high	104 Å²	104	84.2 Å²	84.2	55%	0.545	41%	0.41	S	S	.	.	H	α-helix	trans	-61.5	-51.5	176.5	179.7	61.6	0	0	0	111.3	M124 I125 S130 C131 L132	M124-L128 WeakPolarHBondContact O-CB 3.41Å; M124-L128 PolarHBondContact O-N 2.92Å; I125-L128 PolarHBondContact O-N 3.46Å; L128-S130 VanDerWaalsContact C-N 3.3Å; L128-S130 PolarHBondContact O-N 3.26Å; L128-C131 WeakPolarHBondContact O-CB 3.34Å; L128-C131 PolarHBondContact O-N 2.82Å; L128-C131 VanDerWaalsContact O-N 3.15Å; L128-L132 HydrophobicContact CD1-CD1 4.18Å; L128-L132 HydrophobicContact CD1-CG 4.27Å; L128-L132 HydrophobicContact CG-CD1 4.12Å; L128-L132 WeakPolarHBondContact O-CG 3.49Å; L128-L132 PolarHBondContact O-N 3.47Å
129	I	96.3	Very high	96.6	Very high	71 Å²	71	85.3 Å²	85.3	36%	0.364	42%	0.416	S	S	.	.	H	α-helix	trans	-60.2	-41.8	178.6	-67.7	169.5	0	0	0	111	F80 I125 F126 S133	F80-I129 HydrophobicContact CE1-CD1 3.78Å; F80-I129 HydrophobicContact CE2-CD1 4.2Å; F80-I129 HydrophobicContact CZ-CD1 3.44Å; F80-I129 VanDerWaalsContact CZ-CD1 3.44Å; I125-I129 HydrophobicContact CG2-CD1 3.68Å; I125-I129 HydrophobicContact CG2-CG1 4.35Å; I125-I129 WeakPolarHBondContact O-CG1 3.26Å; I125-I129 PolarHBondContact O-N 2.91Å; F126-I129 PolarHBondContact O-N 3.25Å; I129-S133 VanDerWaalsContact O-CB 3.3Å; I129-S133 WeakPolarHBondContact O-CB 3.3Å; I129-S133 PolarHBondContact O-N 2.88Å; I129-S133 PolarHBondContact O-OG 3.15Å
130	S	95.7	Very high	96.5	Very high	29 Å²	29	86.6 Å²	86.6	20%	0.203	43%	0.43	C	S	.	.	H	α-helix	trans	-64.8	-39.8	177.1	-63.1	0	0	0	0	112.2	F126 K127 L128 R134	F126-S130 WeakPolarHBondContact CZ-OG 3.34Å; F126-S130 VanDerWaalsContact O-CB 3.26Å; F126-S130 WeakPolarHBondContact O-CB 3.44Å; F126-S130 PolarHBondContact O-N 2.88Å; F126-S130 PolarHBondContact O-OG 2.76Å; K127-S130 PolarHBondContact O-N 3.4Å; L128-S130 VanDerWaalsContact C-N 3.3Å; L128-S130 PolarHBondContact O-N 3.26Å; S130-R134 WeakPolarHBondContact O-CG 3.32Å; S130-R134 PolarHBondContact O-N 3.05Å
131	C	96.3	Very high	96.3	Very high	81 Å²	81	84 Å²	84	55%	0.547	43%	0.426	S	S	.	.	H	α-helix	trans	-64.3	-50.3	176.2	-173.6	0	0	0	0	111.2	K127 L128 S133 R134 Y135	K127-C131 VanDerWaalsContact O-CB 3.3Å; K127-C131 WeakPolarHBondContact O-CB 3.3Å; K127-C131 PolarHBondContact O-N 2.91Å; L128-C131 WeakPolarHBondContact O-CB 3.34Å; L128-C131 PolarHBondContact O-N 2.82Å; L128-C131 VanDerWaalsContact O-N 3.15Å; C131-S133 VanDerWaalsContact C-N 3.3Å; C131-S133 PolarHBondContact O-N 2.88Å; C131-R134 PolarHBondContact O-N 3.21Å; C131-Y135 WeakPolarHBondContact O-CB 3.33Å; C131-Y135 PolarHBondContact O-N 3.36Å
132	L	96	Very high	96.1	Very high	103 Å²	103	83.5 Å²	83.5	54%	0.539	43%	0.425	S	S	.	.	H	α-helix	trans	-60.8	-39.4	178	-67	174.3	0	0	0	111.9	L128 Y135 R136	L128-L132 HydrophobicContact CD1-CD1 4.18Å; L128-L132 HydrophobicContact CD1-CG 4.27Å; L128-L132 HydrophobicContact CG-CD1 4.12Å; L128-L132 WeakPolarHBondContact O-CG 3.49Å; L128-L132 PolarHBondContact O-N 3.47Å; L132-Y135 PolarHBondContact O-N 2.96Å; L132-R136 WeakPolarHBondContact O-CB 3.39Å; L132-R136 PolarHBondContact O-N 2.91Å
133	S	94.8	Very high	96	Very high	47 Å²	47	92 Å²	92	33%	0.329	46%	0.458	S	S	.	.	H	α-helix	trans	-64.4	-42.9	176.7	-61.4	0	0	0	0	112	I129 C131 I137	I129-S133 VanDerWaalsContact O-CB 3.3Å; I129-S133 WeakPolarHBondContact O-CB 3.3Å; I129-S133 PolarHBondContact O-N 2.88Å; I129-S133 PolarHBondContact O-OG 3.15Å; C131-S133 VanDerWaalsContact C-N 3.3Å; C131-S133 PolarHBondContact O-N 2.88Å; S133-I137 WeakPolarHBondContact O-CG1 3.43Å; S133-I137 PolarHBondContact O-N 3.19Å
134	R	94.6	Very high	95.9	Very high	189 Å²	189	95.5 Å²	95.5	71%	0.713	47%	0.471	S	S	*	.	H	α-helix	trans	-64.8	-47.3	175.9	-74.3	175.7	-172.4	-98.9	0.6	111.4	S130 C131 R136 I137 S138	S130-R134 WeakPolarHBondContact O-CG 3.32Å; S130-R134 PolarHBondContact O-N 3.05Å; C131-R134 PolarHBondContact O-N 3.21Å; R134-R136 VanDerWaalsContact C-N 3.34Å; R134-R136 PolarHBondContact O-N 3.41Å; R134-I137 PolarHBondContact O-N 2.92Å; R134-S138 PolarHBondContact O-N 2.92Å; R134-S138 PolarHBondContact O-OG 3.07Å
135	Y	96.3	Very high	95.7	Very high	164 Å²	164	95.1 Å²	95.1	64%	0.643	48%	0.476	S	S	*	.	H	α-helix	trans	-56.3	-47.5	177.2	179.5	-102.1	0	0	0	111.6	C131 L132 I137 S138 S139	C131-Y135 WeakPolarHBondContact O-CB 3.33Å; C131-Y135 PolarHBondContact O-N 3.36Å; L132-Y135 PolarHBondContact O-N 2.96Å; Y135-I137 VanDerWaalsContact C-N 3.34Å; Y135-I137 PolarHBondContact O-N 3.21Å; Y135-S138 PolarHBondContact O-N 3.36Å; Y135-S139 PolarHBondContact O-N 3.22Å; Y135-S139 PolarHBondContact O-OG 3.03Å; Y135-S139 VanDerWaalsContact O-OG 3.11Å
136	R	96	Very high	95.6	Very high	179 Å²	179	100.1 Å²	100.1	68%	0.675	49%	0.491	S	S	*	.	H	α-helix	trans	-58.7	-41.9	178.3	-174.8	176.4	66.8	160.6	0.6	113	L132 R134 A140	L132-R136 WeakPolarHBondContact O-CB 3.39Å; L132-R136 PolarHBondContact O-N 2.91Å; R134-R136 VanDerWaalsContact C-N 3.34Å; R134-R136 PolarHBondContact O-N 3.41Å; R136-A140 WeakPolarHBondContact O-CB 3.43Å; R136-A140 PolarHBondContact O-N 3.11Å
137	I	94.7	Very high	95.4	Very high	114 Å²	114	101.9 Å²	101.9	59%	0.585	51%	0.507	S	S	*	.	H	α-helix	trans	-66.2	-45.2	178.1	-67	165.5	0	0	0	110.3	S133 R134 Y135 S139 A140 S141	S133-I137 WeakPolarHBondContact O-CG1 3.43Å; S133-I137 PolarHBondContact O-N 3.19Å; R134-I137 PolarHBondContact O-N 2.92Å; Y135-I137 VanDerWaalsContact C-N 3.34Å; Y135-I137 PolarHBondContact O-N 3.21Å; I137-S139 PolarHBondContact O-N 3.25Å; I137-A140 PolarHBondContact O-N 3.46Å; I137-S141 PolarHBondContact O-N 3.02Å; I137-S141 PolarHBondContact O-OG 3.23Å
138	S	94.8	Very high	95.2	Very high	68 Å²	68	101.6 Å²	101.6	48%	0.476	51%	0.507	S	S	.	.	H	α-helix	trans	-60.5	-42.6	177	-64.6	0	0	0	0	112.4	R134 Y135 S141 S142	R134-S138 PolarHBondContact O-N 2.92Å; R134-S138 PolarHBondContact O-OG 3.07Å; Y135-S138 PolarHBondContact O-N 3.36Å; S138-S141 WeakPolarHBondContact CA-OG 3.13Å; S138-S141 PolarHBondContact O-N 3.04Å; S138-S141 PolarHBondContact O-OG 2.79Å; S138-S142 PolarHBondContact O-N 3.06Å; S138-S142 PolarHBondContact O-OG 3.29Å; S138-S142 VanDerWaalsContact O-OG 3.06Å
139	S	93.9	Very high	95	Very high	32 Å²	32	100.6 Å²	100.6	22%	0.224	51%	0.505	C	S	.	.	H	α-helix	trans	-61.4	-48.3	174.5	-57.3	0	0	0	0	111.2	Y135 I137 S141 S142 Y143	Y135-S139 PolarHBondContact O-N 3.22Å; Y135-S139 PolarHBondContact O-OG 3.03Å; Y135-S139 VanDerWaalsContact O-OG 3.11Å; I137-S139 PolarHBondContact O-N 3.25Å; S139-S141 VanDerWaalsContact C-N 3.33Å; S139-S141 PolarHBondContact O-N 3.19Å; S139-S142 PolarHBondContact O-N 2.96Å; S139-Y143 WeakPolarHBondContact O-CD2 3.4Å; S139-Y143 PolarHBondContact O-N 3.38Å
140	A	95	Very high	94.8	Very high	57 Å²	57	100.5 Å²	100.5	47%	0.471	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-38.2	180	0	0	0	0	0	112.9	R136 I137 R144	R136-A140 WeakPolarHBondContact O-CB 3.43Å; R136-A140 PolarHBondContact O-N 3.11Å; I137-A140 PolarHBondContact O-N 3.46Å; A140-R144 WeakPolarHBondContact O-CB 3.46Å; A140-R144 PolarHBondContact O-N 3.45Å
141	S	95	Very high	94.7	Very high	60 Å²	60	102.4 Å²	102.4	42%	0.42	52%	0.524	S	S	.	.	H	α-helix	trans	-65.6	-43.5	174	53	0	0	0	0	112.1	I137 S138 S139 R144 S145	I137-S141 PolarHBondContact O-N 3.02Å; I137-S141 PolarHBondContact O-OG 3.23Å; S138-S141 WeakPolarHBondContact CA-OG 3.13Å; S138-S141 PolarHBondContact O-N 3.04Å; S138-S141 PolarHBondContact O-OG 2.79Å; S139-S141 VanDerWaalsContact C-N 3.33Å; S139-S141 PolarHBondContact O-N 3.19Å; S141-R144 PolarHBondContact O-N 3.35Å; S141-S145 PolarHBondContact O-N 2.99Å; S141-S145 PolarHBondContact O-OG 2.98Å
142	S	94.2	Very high	94.6	Very high	61 Å²	61	101.8 Å²	101.8	43%	0.427	52%	0.515	S	S	.	.	H	α-helix	trans	-61.4	-48.1	178	-62	0	0	0	0	111.1	S138 S139 R144 S145 Y146	S138-S142 PolarHBondContact O-N 3.06Å; S138-S142 PolarHBondContact O-OG 3.29Å; S138-S142 VanDerWaalsContact O-OG 3.06Å; S139-S142 PolarHBondContact O-N 2.96Å; S142-R144 VanDerWaalsContact C-N 3.31Å; S142-R144 PolarHBondContact O-N 3.24Å; S142-S145 PolarHBondContact O-N 3.46Å; S142-Y146 WeakPolarHBondContact O-CD2 3.5Å; S142-Y146 PolarHBondContact O-N 3.23Å
143	Y	95.7	Very high	94.4	Very high	181 Å²	181	103.4 Å²	103.4	71%	0.71	52%	0.518	S	S	*	.	H	α-helix	trans	-57.5	-42.1	175.6	-81	-71	0	0	0	112.4	S139 Y146 S147	S139-Y143 WeakPolarHBondContact O-CD2 3.4Å; S139-Y143 PolarHBondContact O-N 3.38Å; Y143-Y146 PolarHBondContact O-N 2.69Å; Y143-S147 WeakPolarHBondContact O-CB 3.49Å; Y143-S147 PolarHBondContact O-N 3.44Å; Y143-S147 PolarHBondContact O-OG 2.96Å
144	R	96.2	Very high	94.3	Very high	177 Å²	177	105.5 Å²	105.5	67%	0.668	53%	0.532	S	S	*	.	H	α-helix	trans	-61.5	-47.4	176.4	-172.8	179.2	-66.3	-178.1	-1.8	111.5	A140 S141 S142 Y146 S147 Q148	A140-R144 WeakPolarHBondContact O-CB 3.46Å; A140-R144 PolarHBondContact O-N 3.45Å; S141-R144 PolarHBondContact O-N 3.35Å; S142-R144 VanDerWaalsContact C-N 3.31Å; S142-R144 PolarHBondContact O-N 3.24Å; R144-Y146 PolarHBondContact O-N 2.95Å; R144-S147 WeakPolarHBondContact CA-OG 3.42Å; R144-S147 PolarHBondContact O-N 3.03Å; R144-S147 PolarHBondContact O-OG 3.38Å; R144-Q148 WeakPolarHBondContact O-CG 3.14Å; R144-Q148 PolarHBondContact O-N 3.41Å
145	S	94.7	Very high	94.2	Very high	66 Å²	66	104.4 Å²	104.4	46%	0.462	53%	0.527	S	S	.	.	H	α-helix	trans	-60.7	-43.3	177.7	-62.3	0	0	0	0	112.4	S141 S142 S147 Q148 V149	S141-S145 PolarHBondContact O-N 2.99Å; S141-S145 PolarHBondContact O-OG 2.98Å; S142-S145 PolarHBondContact O-N 3.46Å; S145-S147 PolarHBondContact O-N 3.49Å; S145-Q148 PolarHBondContact O-N 3.45Å; S145-V149 WeakPolarHBondContact O-CG2 3.35Å; S145-V149 PolarHBondContact O-N 3.35Å
146	Y	94.5	Very high	93.9	Very high	179 Å²	179	105.8 Å²	105.8	70%	0.702	53%	0.533	S	S	*	.	H	α-helix	trans	-61.8	-42.7	174.4	-80.5	-72.9	0	0	0	112.4	S142 Y143 R144 Q148 V149 S150	S142-Y146 WeakPolarHBondContact O-CD2 3.5Å; S142-Y146 PolarHBondContact O-N 3.23Å; Y143-Y146 PolarHBondContact O-N 2.69Å; R144-Y146 PolarHBondContact O-N 2.95Å; Y146-Q148 VanDerWaalsContact C-N 3.33Å; Y146-Q148 PolarHBondContact O-N 3.21Å; Y146-V149 PolarHBondContact O-N 2.96Å; Y146-S150 PolarHBondContact O-N 2.78Å
147	S	93.1	Very high	93.3	Very high	62 Å²	62	106.4 Å²	106.4	43%	0.434	55%	0.55	S	S	.	.	H	α-helix	trans	-64.4	-36.1	178.4	71.3	0	0	0	0	113.1	Y143 R144 S145 S151	Y143-S147 WeakPolarHBondContact O-CB 3.49Å; Y143-S147 PolarHBondContact O-N 3.44Å; Y143-S147 PolarHBondContact O-OG 2.96Å; R144-S147 WeakPolarHBondContact CA-OG 3.42Å; R144-S147 PolarHBondContact O-N 3.03Å; R144-S147 PolarHBondContact O-OG 3.38Å; S145-S147 PolarHBondContact O-N 3.49Å; S147-S151 WeakPolarHBondContact O-CB 3.39Å; S147-S151 PolarHBondContact O-N 3.21Å; S147-S151 PolarHBondContact O-OG 3.38Å
148	Q	94.1	Very high	93.3	Very high	110 Å²	110	106.1 Å²	106.1	51%	0.514	55%	0.548	S	S	.	.	H	α-helix	trans	-66.3	-49.2	175.1	-72.5	177	-53.5	0	0	110.7	R144 S145 Y146 S150 S151 D152	R144-Q148 WeakPolarHBondContact O-CG 3.14Å; R144-Q148 PolarHBondContact O-N 3.41Å; S145-Q148 PolarHBondContact O-N 3.45Å; Y146-Q148 VanDerWaalsContact C-N 3.33Å; Y146-Q148 PolarHBondContact O-N 3.21Å; Q148-S150 VanDerWaalsContact C-N 3.32Å; Q148-S150 PolarHBondContact O-N 3.06Å; Q148-S151 PolarHBondContact O-N 2.8Å; Q148-S151 VanDerWaalsContact O-N 3.16Å; Q148-D152 PolarHBondContact O-N 3.16Å
149	V	93.4	Very high	93.2	Very high	82 Å²	82	108.1 Å²	108.1	50%	0.497	55%	0.552	S	S	.	*	H	α-helix	trans	-59.6	-40.7	177.4	172.8	0	0	0	0	112.1	S145 Y146 D152 K153	S145-V149 WeakPolarHBondContact O-CG2 3.35Å; S145-V149 PolarHBondContact O-N 3.35Å; Y146-V149 PolarHBondContact O-N 2.96Å; V149-D152 PolarHBondContact O-N 3.2Å; V149-K153 WeakPolarHBondContact O-CG 3.02Å; V149-K153 PolarHBondContact O-N 3.1Å; V149-K153 VanDerWaalsContact O-N 3.1Å
150	S	92.2	Very high	93.1	Very high	69 Å²	69	112.3 Å²	112.3	48%	0.483	57%	0.57	S	S	.	*	H	α-helix	trans	-67.1	-39.6	176.8	-167.3	0	0	0	0	112.5	Y146 Q148 D152 K153 C154	Y146-S150 PolarHBondContact O-N 2.78Å; Q148-S150 VanDerWaalsContact C-N 3.32Å; Q148-S150 PolarHBondContact O-N 3.06Å; S150-D152 VanDerWaalsContact C-N 3.33Å; S150-K153 PolarHBondContact O-N 2.93Å; S150-C154 PolarHBondContact O-N 3.37Å
151	S	92.7	Very high	93	Very high	69 Å²	69	115.5 Å²	115.5	48%	0.483	58%	0.576	S	S	.	*	H	α-helix	trans	-66.7	-36.3	177.6	-58.1	0	0	0	0	111.8	S147 Q148 R155	S147-S151 WeakPolarHBondContact O-CB 3.39Å; S147-S151 PolarHBondContact O-N 3.21Å; S147-S151 PolarHBondContact O-OG 3.38Å; Q148-S151 PolarHBondContact O-N 2.8Å; Q148-S151 VanDerWaalsContact O-N 3.16Å; S151-R155 PolarHBondContact O-N 3.29Å
152	D	95	Very high	92.9	Very high	68 Å²	68	119 Å²	119	36%	0.364	59%	0.585	S	S	.	*	H	α-helix	trans	-68.3	-39.8	175.6	-69.8	-29.2	0	0	0	111.2	Q148 V149 S150 R155 Y156	Q148-D152 PolarHBondContact O-N 3.16Å; V149-D152 PolarHBondContact O-N 3.2Å; S150-D152 VanDerWaalsContact C-N 3.33Å; D152-R155 WeakPolarHBondContact O-CB 3.5Å; D152-R155 PolarHBondContact O-N 3.11Å; D152-R155 VanDerWaalsContact O-N 3.1Å; D152-R155 IonicContact OD1-CZ 2.82Å; D152-R155 IonicContact OD1-NH1 3.88Å; D152-R155 PolarHBondContact OD1-NH1 3.48Å; D152-Y156 WeakPolarHBondContact O-CD2 3.42Å
153	K	92.6	Very high	92.8	Very high	138 Å²	138	122.9 Å²	122.9	60%	0.6	60%	0.596	S	S	*	*	H	α-helix	trans	-58.2	-49.5	173.7	-74.8	-177.7	179.2	-175.5	0	112.6	V149 S150 R155 Y156 D157	V149-K153 WeakPolarHBondContact O-CG 3.02Å; V149-K153 PolarHBondContact O-N 3.1Å; V149-K153 VanDerWaalsContact O-N 3.1Å; S150-K153 PolarHBondContact O-N 2.93Å; K153-R155 PolarHBondContact O-N 3.1Å; K153-R155 VanDerWaalsContact O-N 3.11Å; K153-Y156 PolarHBondContact O-N 3.34Å; K153-Y156 VanDerWaalsContact O-N 3.07Å; K153-D157 PolarHBondContact O-N 3.07Å
154	C	91.9	Very high	92.6	Very high	91 Å²	91	118.7 Å²	118.7	62%	0.615	59%	0.588	S	S	*	*	H	α-helix	trans	-64.9	-12.3	176.4	-69.1	0	0	0	0	114.5	S150	S150-C154 PolarHBondContact O-N 3.37Å
155	R	92.3	Very high	92.3	Very high	166 Å²	166	114.2 Å²	114.2	63%	0.626	58%	0.582	S	S	*	*	H	α-helix	trans	-83.5	-22.4	174.6	-169.9	-179.9	-65.8	127.3	5.6	112.3	S151 D152 K153	S151-R155 PolarHBondContact O-N 3.29Å; D152-R155 WeakPolarHBondContact O-CB 3.5Å; D152-R155 PolarHBondContact O-N 3.11Å; D152-R155 VanDerWaalsContact O-N 3.1Å; D152-R155 IonicContact OD1-CZ 2.82Å; D152-R155 IonicContact OD1-NH1 3.88Å; D152-R155 PolarHBondContact OD1-NH1 3.48Å; K153-R155 PolarHBondContact O-N 3.1Å; K153-R155 VanDerWaalsContact O-N 3.11Å
156	Y	89.9	Confident	92.1	Very high	193 Å²	193	118.3 Å²	118.3	76%	0.757	59%	0.592	S	S	*	*	H	α-helix	trans	-101.6	-13.1	-177.7	-65.6	-69.9	0	0	0	114.1	D152 K153	D152-Y156 WeakPolarHBondContact O-CD2 3.42Å; K153-Y156 PolarHBondContact O-N 3.34Å; K153-Y156 VanDerWaalsContact O-N 3.07Å
157	D	84	Confident	91.9	Very high	192 Å²	192	112.7 Å²	112.7	100%	1.027	58%	0.582	S	S	*	*			trans	-88.1	0	170.2	-63.4	-30.5	0	0	0	110.9	K153	K153-D157 PolarHBondContact O-N 3.07Å

Retrieved 157 of 157 residues in 52 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).