B5XAP2_SALSA Loading...

Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit DAD1

Subunit of the oligosaccharyl transferase (OST) complex that catalyzes the initial transfer of a defined glycan (Glc(3)Man(9)GlcNAc(2) in eukaryotes) from the lipid carrier dolichol-pyrophosphate to an asparagine residue within an Asn-X-Ser/Thr consensus motif in nascent polypeptide chains, the first step in protein N-glycosylation. N-glycosylation occurs cotranslationally and the complex associates with the Sec61 complex at the channel-forming translocon complex that mediates protein translocation across the endoplasmic reticulum (ER). All subunits are required for a maximal enzyme activity.

AlphaFold DB , UniProt , Accession B5XAP2, Species SALSA (Salmo salar, Atlantic salmon), Gene DAD1, Length 113 aa.

						>B5XAP2_SALSA|B5XAP2|DAD1
MSNSVISVISRFLEEYRTKTSNKLKVVDAYLFYILLTGALQFLYCLLVGTFPFNSFLAGFISCVGAFILGVCLRIQINPDNKGDFLSISQERAFADFLLAHTVLHLVVINFIG
					

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	52.4	Low	83.5	Confident	228 Å²	228	113.8 Å²	113.8	100%	1.123	63%	0.625	S	S	*	*				0	112.6	0	-70.2	-169.3	-94.7	0	0	106.9	N3	M1-N3 PolarHBondContact O-N 3.4Å
2	S	55	Low	84.5	Confident	118 Å²	118	116.3 Å²	116.3	83%	0.825	63%	0.626	S	S	*	*			trans	-69.5	117	175.1	60.1	0	0	0	0	107.7	S4	S2-S4 VanDerWaalsContact C-N 3.27Å; S2-S4 PolarHBondContact O-N 2.78Å
3	N	66.8	Low	85.3	Confident	136 Å²	136	115.2 Å²	115.2	73%	0.727	62%	0.619	S	S	*	*			trans	-69.4	92.5	172.5	-68	-26	0	0	0	107.2	M1	M1-N3 PolarHBondContact O-N 3.4Å
4	S	87.9	Confident	86.1	Confident	57 Å²	57	116.7 Å²	116.7	40%	0.399	62%	0.62	S	S	.	*			trans	-63.5	140.3	171	175.1	0	0	0	0	108.8	S2 I6 S7 V8	S2-S4 VanDerWaalsContact C-N 3.27Å; S2-S4 PolarHBondContact O-N 2.78Å; S4-I6 PolarHBondContact O-N 3.26Å; S4-I6 VanDerWaalsContact O-N 3.08Å; S4-S7 PolarHBondContact N-OG 2.96Å; S4-S7 WeakPolarHBondContact O-CA 3.36Å; S4-S7 WeakPolarHBondContact O-CB 3.49Å; S4-S7 PolarHBondContact O-N 3.39Å; S4-S7 PolarHBondContact O-OG 2.98Å; S4-V8 PolarHBondContact O-N 3.23Å
5	V	91.9	Very high	86.7	Confident	107 Å²	107	114.3 Å²	114.3	65%	0.648	60%	0.604	S	S	*	*	H	α-helix	trans	-52.3	-35.4	177.1	178.7	0	0	0	0	111	S7 V8 I9	V5-S7 VanDerWaalsContact C-N 3.32Å; V5-S7 PolarHBondContact O-N 3.43Å; V5-V8 PolarHBondContact O-N 3.44Å; V5-I9 HydrophobicContact CG1-CD1 3.93Å; V5-I9 HydrophobicContact CG1-CG1 4.45Å; V5-I9 WeakPolarHBondContact O-CG1 3.4Å; V5-I9 PolarHBondContact O-N 3.03Å
6	I	92.6	Very high	87.2	Confident	129 Å²	129	111.8 Å²	111.8	66%	0.662	58%	0.584	S	S	*	*	H	α-helix	trans	-60.7	-41.8	176.6	-60.2	170.5	0	0	0	111.3	S4 V8 I9 S10	S4-I6 PolarHBondContact O-N 3.26Å; S4-I6 VanDerWaalsContact O-N 3.08Å; I6-V8 VanDerWaalsContact C-N 3.3Å; I6-V8 PolarHBondContact O-N 2.93Å; I6-I9 PolarHBondContact O-N 3.05Å; I6-S10 WeakPolarHBondContact O-CB 3.49Å; I6-S10 PolarHBondContact O-N 2.95Å; I6-S10 PolarHBondContact O-OG 3.45Å
7	S	92.8	Very high	87.6	Confident	52 Å²	52	116.6 Å²	116.6	36%	0.364	59%	0.593	S	S	.	*	H	α-helix	trans	-68	-30	179.3	71.9	0	0	0	0	112.9	S4 V5 S10 R11	S4-S7 PolarHBondContact N-OG 2.96Å; S4-S7 WeakPolarHBondContact O-CA 3.36Å; S4-S7 WeakPolarHBondContact O-CB 3.49Å; S4-S7 PolarHBondContact O-N 3.39Å; S4-S7 PolarHBondContact O-OG 2.98Å; V5-S7 VanDerWaalsContact C-N 3.32Å; V5-S7 PolarHBondContact O-N 3.43Å; S7-S10 WeakPolarHBondContact CA-OG 3.4Å; S7-S10 PolarHBondContact O-OG 3.3Å; S7-R11 WeakPolarHBondContact O-CB 3.5Å; S7-R11 PolarHBondContact O-N 2.95Å
8	V	94.9	Very high	88	Confident	84 Å²	84	115.9 Å²	115.9	51%	0.509	60%	0.596	S	S	.	*	H	α-helix	trans	-72.8	-46	175.6	179.1	0	0	0	0	110	S4 V5 I6 R11 F12	S4-V8 PolarHBondContact O-N 3.23Å; V5-V8 PolarHBondContact O-N 3.44Å; I6-V8 VanDerWaalsContact C-N 3.3Å; I6-V8 PolarHBondContact O-N 2.93Å; V8-R11 PolarHBondContact O-N 3.05Å; V8-F12 WeakPolarHBondContact O-CB 3.35Å; V8-F12 PolarHBondContact O-N 3.46Å
9	I	94.9	Very high	88.3	Confident	93 Å²	93	118.1 Å²	118.1	48%	0.477	60%	0.6	S	S	.	*	H	α-helix	trans	-61.7	-46.2	178	-66.7	169	0	0	0	110.8	V5 I6 R11 F12 L13	V5-I9 HydrophobicContact CG1-CD1 3.93Å; V5-I9 HydrophobicContact CG1-CG1 4.45Å; V5-I9 WeakPolarHBondContact O-CG1 3.4Å; V5-I9 PolarHBondContact O-N 3.03Å; I6-I9 PolarHBondContact O-N 3.05Å; I9-R11 VanDerWaalsContact C-N 3.34Å; I9-R11 PolarHBondContact O-N 2.87Å; I9-F12 PolarHBondContact O-N 3.38Å; I9-L13 HydrophobicContact CG2-CD1 3.9Å; I9-L13 HydrophobicContact CG2-CG 4.4Å; I9-L13 WeakPolarHBondContact O-CB 3.3Å; I9-L13 WeakPolarHBondContact O-CG 3.47Å; I9-L13 PolarHBondContact O-N 3.42Å
10	S	94.4	Very high	88.6	Confident	65 Å²	65	113.2 Å²	113.2	46%	0.455	58%	0.576	S	S	.	*	H	α-helix	trans	-61.1	-44.3	-179.9	62.8	0	0	0	0	111.7	I6 S7 L13 E14	I6-S10 WeakPolarHBondContact O-CB 3.49Å; I6-S10 PolarHBondContact O-N 2.95Å; I6-S10 PolarHBondContact O-OG 3.45Å; S7-S10 WeakPolarHBondContact CA-OG 3.4Å; S7-S10 PolarHBondContact O-OG 3.3Å; S10-L13 PolarHBondContact O-N 2.98Å; S10-E14 WeakPolarHBondContact O-CB 3.38Å; S10-E14 PolarHBondContact O-N 2.84Å
11	R	95.2	Very high	88.9	Confident	183 Å²	183	110.4 Å²	110.4	69%	0.691	57%	0.567	S	S	*	*	H	α-helix	trans	-64.8	-43	178	-174.1	174.5	177.4	175.4	0.3	112	S7 V8 I9 E14 E15	S7-R11 WeakPolarHBondContact O-CB 3.5Å; S7-R11 PolarHBondContact O-N 2.95Å; V8-R11 PolarHBondContact O-N 3.05Å; I9-R11 VanDerWaalsContact C-N 3.34Å; I9-R11 PolarHBondContact O-N 2.87Å; R11-E14 PolarHBondContact O-N 3.05Å; R11-E15 WeakPolarHBondContact O-CB 3.15Å; R11-E15 PolarHBondContact O-N 3.32Å
12	F	95.6	Very high	90.8	Very high	143 Å²	143	105.5 Å²	105.5	63%	0.627	55%	0.545	S	S	*	.	H	α-helix	trans	-62.7	-42.3	177.8	-177.4	-96.6	0	0	0	112.1	V8 I9 E15 Y16	V8-F12 WeakPolarHBondContact O-CB 3.35Å; V8-F12 PolarHBondContact O-N 3.46Å; I9-F12 PolarHBondContact O-N 3.38Å; F12-E15 PolarHBondContact O-N 3.33Å; F12-Y16 WeakPolarHBondContact O-CB 3.39Å; F12-Y16 PolarHBondContact O-N 3.03Å
13	L	94.8	Very high	92.7	Very high	103 Å²	103	106.9 Å²	106.9	54%	0.539	54%	0.537	S	S	.	.	H	α-helix	trans	-65.1	-41.3	177.3	-75.7	172.6	0	0	0	112.4	I9 S10 R17	I9-L13 HydrophobicContact CG2-CD1 3.9Å; I9-L13 HydrophobicContact CG2-CG 4.4Å; I9-L13 WeakPolarHBondContact O-CB 3.3Å; I9-L13 WeakPolarHBondContact O-CG 3.47Å; I9-L13 PolarHBondContact O-N 3.42Å; S10-L13 PolarHBondContact O-N 2.98Å; L13-R17 VanDerWaalsContact O-CB 3.3Å; L13-R17 WeakPolarHBondContact O-CB 3.45Å; L13-R17 PolarHBondContact O-N 3.17Å
14	E	96.1	Very high	94	Very high	136 Å²	136	100.9 Å²	100.9	64%	0.636	51%	0.505	S	S	*	.	H	α-helix	trans	-64.7	-44	177.1	-172.8	171.3	-168.6	0	0	111.6	S10 R11 R17 T18	S10-E14 WeakPolarHBondContact O-CB 3.38Å; S10-E14 PolarHBondContact O-N 2.84Å; R11-E14 PolarHBondContact O-N 3.05Å; E14-R17 PolarHBondContact O-N 3.3Å; E14-T18 WeakPolarHBondContact O-CG2 3.39Å; E14-T18 PolarHBondContact O-N 3.08Å; E14-T18 PolarHBondContact O-OG1 2.86Å
15	E	95.1	Very high	94.4	Very high	81 Å²	81	100.8 Å²	100.8	38%	0.379	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-43.3	177.4	-171.7	163.7	-173.7	0	0	112	R11 F12 R17 T18 K19	R11-E15 WeakPolarHBondContact O-CB 3.15Å; R11-E15 PolarHBondContact O-N 3.32Å; F12-E15 PolarHBondContact O-N 3.33Å; E15-R17 VanDerWaalsContact C-N 3.34Å; E15-R17 PolarHBondContact O-N 2.88Å; E15-T18 WeakPolarHBondContact CA-OG1 3.39Å; E15-T18 PolarHBondContact O-N 2.61Å; E15-T18 PolarHBondContact O-OG1 3.41Å; E15-T18 VanDerWaalsContact O-OG1 3.05Å; E15-K19 HydrophobicContact CG-CD 3.84Å; E15-K19 HydrophobicContact CG-CG 4.37Å; E15-K19 WeakPolarHBondContact O-CB 3.12Å; E15-K19 PolarHBondContact O-N 3.29Å; E15-K19 WeakPolarHBondContact OE1-CE 3.41Å; E15-K19 IonicContact OE1-NZ 3.09Å; E15-K19 PolarHBondContact OE1-NZ 3.09Å
16	Y	95.3	Very high	94.7	Very high	73 Å²	73	100.7 Å²	100.7	29%	0.286	50%	0.496	S	S	.	.	H	α-helix	trans	-59.1	-45.4	173.2	172.4	-99.4	0	0	0	111.7	F12 T18 T20 K25 D28	F12-Y16 WeakPolarHBondContact O-CB 3.39Å; F12-Y16 PolarHBondContact O-N 3.03Å; Y16-T18 VanDerWaalsContact C-N 3.32Å; Y16-T18 PolarHBondContact O-N 3.37Å; Y16-T20 VanDerWaalsContact CD2-OG1 3.28Å; Y16-T20 WeakPolarHBondContact CD2-OG1 3.47Å; Y16-T20 HydrophobicContact CE2-CG2 3.97Å; Y16-T20 WeakPolarHBondContact CE2-OG1 3.36Å; Y16-T20 WeakPolarHBondContact O-CB 3.33Å; Y16-T20 PolarHBondContact O-N 3.32Å; Y16-T20 PolarHBondContact O-OG1 3.02Å; Y16-K25 HydrophobicContact CE1-CG 4.4Å; Y16-D28 WeakPolarHBondContact CE2-OD2 3.49Å; Y16-D28 WeakPolarHBondContact OH-CB 3.4Å; Y16-D28 PolarHBondContact OH-OD2 3.34Å
17	R	94.1	Very high	94.9	Very high	194 Å²	194	95.4 Å²	95.4	73%	0.732	47%	0.47	S	S	*	.	H	α-helix	trans	-64.9	-36.2	-177.9	-175.2	179	177.8	-174.9	-0.3	112.1	L13 E14 E15 K25	L13-R17 VanDerWaalsContact O-CB 3.3Å; L13-R17 WeakPolarHBondContact O-CB 3.45Å; L13-R17 PolarHBondContact O-N 3.17Å; E14-R17 PolarHBondContact O-N 3.3Å; E15-R17 VanDerWaalsContact C-N 3.34Å; E15-R17 PolarHBondContact O-N 2.88Å; R17-K25 PolarHBondContact O-NZ 3.23Å
18	T	94.1	Very high	95.1	Very high	105 Å²	105	93.9 Å²	93.9	64%	0.644	46%	0.458	S	S	*	.	H	α-helix	trans	-82.7	-42.5	-177	49.7	0	0	0	0	112.7	E14 E15 Y16	E14-T18 WeakPolarHBondContact O-CG2 3.39Å; E14-T18 PolarHBondContact O-N 3.08Å; E14-T18 PolarHBondContact O-OG1 2.86Å; E15-T18 WeakPolarHBondContact CA-OG1 3.39Å; E15-T18 PolarHBondContact O-N 2.61Å; E15-T18 PolarHBondContact O-OG1 3.41Å; E15-T18 VanDerWaalsContact O-OG1 3.05Å; Y16-T18 VanDerWaalsContact C-N 3.32Å; Y16-T18 PolarHBondContact O-N 3.37Å
19	K	93.4	Very high	95.3	Very high	156 Å²	156	92.8 Å²	92.8	68%	0.678	46%	0.457	S	S	*	.	H	α-helix	trans	-81	-29.9	-177.4	-68.9	-174.1	173.2	176.8	0	114	E15	E15-K19 HydrophobicContact CG-CD 3.84Å; E15-K19 HydrophobicContact CG-CG 4.37Å; E15-K19 WeakPolarHBondContact O-CB 3.12Å; E15-K19 PolarHBondContact O-N 3.29Å; E15-K19 WeakPolarHBondContact OE1-CE 3.41Å; E15-K19 IonicContact OE1-NZ 3.09Å; E15-K19 PolarHBondContact OE1-NZ 3.09Å
20	T	94.3	Very high	95.4	Very high	21 Å²	21	91.8 Å²	91.8	13%	0.129	45%	0.448	C	S	.	.	S	Bend	trans	-86.8	125.5	-173.2	-48.9	0	0	0	0	112	Y16 L24 K25	Y16-T20 VanDerWaalsContact CD2-OG1 3.28Å; Y16-T20 WeakPolarHBondContact CD2-OG1 3.47Å; Y16-T20 HydrophobicContact CE2-CG2 3.97Å; Y16-T20 WeakPolarHBondContact CE2-OG1 3.36Å; Y16-T20 WeakPolarHBondContact O-CB 3.33Å; Y16-T20 PolarHBondContact O-N 3.32Å; Y16-T20 PolarHBondContact O-OG1 3.02Å; T20-L24 HydrophobicContact CG2-CB 3.54Å; T20-L24 HydrophobicContact CG2-CD1 4.26Å; T20-K25 HydrophobicContact CG2-CG 3.95Å; T20-K25 WeakPolarHBondContact O-CE 3.46Å; T20-K25 PolarHBondContact O-NZ 2.95Å
21	S	94.3	Very high	95.6	Very high	54 Å²	54	89.2 Å²	89.2	38%	0.378	43%	0.429	S	S	.	.			trans	-66.2	155.9	176.3	74.2	0	0	0	0	112.7	K23 L24 K25	S21-K23 VanDerWaalsContact C-N 3.27Å; S21-K23 PolarHBondContact O-N 3.37Å; S21-L24 PolarHBondContact O-N 3.44Å; S21-K25 PolarHBondContact O-N 3.03Å
22	N	94.3	Very high	95.8	Very high	125 Å²	125	86.5 Å²	86.5	67%	0.668	42%	0.423	S	S	*	.	H	α-helix	trans	-60.8	-34.7	179.8	-71.1	-21.5	0	0	0	112.9	K25 V26	N22-K25 PolarHBondContact O-N 3.21Å; N22-V26 WeakPolarHBondContact O-CG2 3.28Å; N22-V26 PolarHBondContact O-N 2.89Å; N22-V26 VanDerWaalsContact O-N 3.09Å
23	K	93.3	Very high	95.9	Very high	148 Å²	148	86.7 Å²	86.7	64%	0.643	42%	0.42	S	S	*	.	H	α-helix	trans	-60.8	-45.9	175.7	-68	-176.2	178.4	-177.6	0	111.3	S21 V26 V27	S21-K23 VanDerWaalsContact C-N 3.27Å; S21-K23 PolarHBondContact O-N 3.37Å; K23-V26 PolarHBondContact O-N 3.32Å; K23-V27 PolarHBondContact O-N 2.81Å
24	L	95.2	Very high	96	Very high	10 Å²	10	82.3 Å²	82.3	5%	0.052	40%	0.397	C	S	.	.	H	α-helix	trans	-66.5	-38.9	177.2	-71.8	172.2	0	0	0	111.8	T20 S21 V26 V27 D28 R74 I77	T20-L24 HydrophobicContact CG2-CB 3.54Å; T20-L24 HydrophobicContact CG2-CD1 4.26Å; S21-L24 PolarHBondContact O-N 3.44Å; L24-V26 VanDerWaalsContact C-N 3.27Å; L24-V26 PolarHBondContact O-N 2.66Å; L24-V27 PolarHBondContact O-N 3.34Å; L24-V27 VanDerWaalsContact O-N 3.13Å; L24-D28 PolarHBondContact O-N 3.09Å; L24-D28 VanDerWaalsContact O-OD1 3.09Å; L24-R74 HydrophobicContact CD2-CG 4.05Å; L24-I77 HydrophobicContact CD2-CD1 4.03Å; L24-I77 HydrophobicContact CD2-CG1 3.71Å
25	K	96.6	Very high	96.1	Very high	54 Å²	54	80.5 Å²	80.5	24%	0.235	39%	0.391	C	S	.	.	H	α-helix	trans	-60.4	-35	175.4	-71.8	172.1	179.1	152.4	0	113.1	Y16 R17 T20 S21 N22 D28 A29	Y16-K25 HydrophobicContact CE1-CG 4.4Å; R17-K25 PolarHBondContact O-NZ 3.23Å; T20-K25 HydrophobicContact CG2-CG 3.95Å; T20-K25 WeakPolarHBondContact O-CE 3.46Å; T20-K25 PolarHBondContact O-NZ 2.95Å; S21-K25 PolarHBondContact O-N 3.03Å; N22-K25 PolarHBondContact O-N 3.21Å; K25-D28 PolarHBondContact O-N 3.27Å; K25-A29 WeakPolarHBondContact O-CB 3.48Å; K25-A29 PolarHBondContact O-N 2.94Å
26	V	97.2	Very high	96.3	Very high	105 Å²	105	80.5 Å²	80.5	64%	0.636	39%	0.394	S	S	*	.	H	α-helix	trans	-66.1	-43.9	174.7	171.7	0	0	0	0	110.8	N22 K23 L24 D28 A29 Y30	N22-V26 WeakPolarHBondContact O-CG2 3.28Å; N22-V26 PolarHBondContact O-N 2.89Å; N22-V26 VanDerWaalsContact O-N 3.09Å; K23-V26 PolarHBondContact O-N 3.32Å; L24-V26 VanDerWaalsContact C-N 3.27Å; L24-V26 PolarHBondContact O-N 2.66Å; V26-D28 VanDerWaalsContact C-N 3.29Å; V26-D28 PolarHBondContact O-N 3.01Å; V26-A29 PolarHBondContact O-N 3.36Å; V26-Y30 PolarHBondContact O-N 2.87Å
27	V	97.1	Very high	96.4	Very high	18 Å²	18	79.2 Å²	79.2	11%	0.109	39%	0.393	C	S	.	.	H	α-helix	trans	-62.1	-39.5	174.5	179.3	0	0	0	0	110.9	K23 L24 Y30 L31 R74 I77	K23-V27 PolarHBondContact O-N 2.81Å; L24-V27 PolarHBondContact O-N 3.34Å; L24-V27 VanDerWaalsContact O-N 3.13Å; V27-Y30 WeakPolarHBondContact O-CB 3.43Å; V27-Y30 PolarHBondContact O-N 2.88Å; V27-L31 HydrophobicContact CG1-CD1 4.27Å; V27-L31 HydrophobicContact CG1-CG 4.47Å; V27-L31 WeakPolarHBondContact O-CG 3.35Å; V27-L31 PolarHBondContact O-N 2.61Å; V27-R74 HydrophobicContact CG1-CB 3.94Å; V27-R74 HydrophobicContact CG1-CG 4.43Å; V27-I77 HydrophobicContact CG2-CD1 3.96Å
28	D	97.7	Very high	96.6	Very high	21 Å²	21	70.3 Å²	70.3	11%	0.112	36%	0.362	C	S	.	.	H	α-helix	trans	-66	-40.1	178.3	-66.7	2.5	0	0	0	112.2	Y16 L24 K25 V26 Y30 L31 F32 R74	Y16-D28 WeakPolarHBondContact CE2-OD2 3.49Å; Y16-D28 WeakPolarHBondContact OH-CB 3.4Å; Y16-D28 PolarHBondContact OH-OD2 3.34Å; L24-D28 PolarHBondContact O-N 3.09Å; L24-D28 VanDerWaalsContact O-OD1 3.09Å; K25-D28 PolarHBondContact O-N 3.27Å; V26-D28 VanDerWaalsContact C-N 3.29Å; V26-D28 PolarHBondContact O-N 3.01Å; D28-Y30 VanDerWaalsContact C-N 3.35Å; D28-L31 PolarHBondContact O-N 2.98Å; D28-F32 WeakPolarHBondContact O-CB 3.41Å; D28-F32 PolarHBondContact O-N 3.39Å; D28-R74 IonicContact OD1-CZ 3.34Å; D28-R74 IonicContact OD1-NE 2.63Å; D28-R74 IonicContact OD1-NH1 3.29Å; D28-R74 PolarHBondContact OD1-NH1 2.96Å; D28-R74 IonicContact OD1-NH2 2.81Å; D28-R74 PolarHBondContact OD1-NH2 3.27Å; D28-R74 IonicContact OD2-CZ 3.75Å; D28-R74 VanDerWaalsContact OD2-CZ 3.29Å; D28-R74 IonicContact OD2-NH1 3.02Å; D28-R74 PolarHBondContact OD2-NH1 2.93Å; D28-R74 VanDerWaalsContact OD2-NH1 3.09Å; D28-R74 IonicContact OD2-NH2 2.66Å; D28-R74 PolarHBondContact OD2-NH2 3.48Å
29	A	97.9	Very high	96.8	Very high	60 Å²	60	68 Å²	68	50%	0.496	35%	0.354	S	S	.	.	H	α-helix	trans	-63.9	-40.6	173.7	0	0	0	0	0	111.8	K25 V26 F32 Y33	K25-A29 WeakPolarHBondContact O-CB 3.48Å; K25-A29 PolarHBondContact O-N 2.94Å; V26-A29 PolarHBondContact O-N 3.36Å; A29-F32 PolarHBondContact O-N 3.44Å; A29-Y33 PolarHBondContact O-N 3.38Å
30	Y	97.9	Very high	97	Very high	72 Å²	72	66 Å²	66	28%	0.282	35%	0.35	S	S	.	.	H	α-helix	trans	-61.7	-45.5	173.1	165.9	-102.2	0	0	0	112.3	V26 V27 D28 F32 Y33 I34 F97 H101	V26-Y30 PolarHBondContact O-N 2.87Å; V27-Y30 WeakPolarHBondContact O-CB 3.43Å; V27-Y30 PolarHBondContact O-N 2.88Å; D28-Y30 VanDerWaalsContact C-N 3.35Å; Y30-F32 VanDerWaalsContact C-N 3.32Å; Y30-F32 PolarHBondContact O-N 3.13Å; Y30-Y33 WeakPolarHBondContact O-CB 3.36Å; Y30-Y33 PolarHBondContact O-N 3.29Å; Y30-I34 HydrophobicContact CD1-CD1 4.06Å; Y30-I34 HydrophobicContact CD2-CD1 4.05Å; Y30-I34 HydrophobicContact CE1-CD1 3.44Å; Y30-I34 VanDerWaalsContact CE1-CD1 3.44Å; Y30-I34 HydrophobicContact CE2-CD1 3.43Å; Y30-I34 VanDerWaalsContact CE2-CD1 3.43Å; Y30-I34 HydrophobicContact CE2-CG1 4.21Å; Y30-I34 HydrophobicContact CG-CD1 4.35Å; Y30-I34 PolarHBondContact O-N 3.19Å; Y30-I34 VanDerWaalsContact OH-CD1 3.25Å; Y30-I34 WeakPolarHBondContact OH-CD1 3.33Å; Y30-F97 HydrophobicContact CE1-CZ 4.2Å; Y30-H101 PolarHBondContact OH-NE2 3.3Å
31	L	98.3	Very high	97.1	Very high	12 Å²	12	67.1 Å²	67.1	6%	0.063	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-42	175.9	-74.5	173.1	0	0	0	111.9	V27 D28 I34 L35 F67 V71	V27-L31 HydrophobicContact CG1-CD1 4.27Å; V27-L31 HydrophobicContact CG1-CG 4.47Å; V27-L31 WeakPolarHBondContact O-CG 3.35Å; V27-L31 PolarHBondContact O-N 2.61Å; D28-L31 PolarHBondContact O-N 2.98Å; L31-I34 PolarHBondContact O-N 3.22Å; L31-L35 WeakPolarHBondContact O-CB 3.46Å; L31-L35 PolarHBondContact O-N 3.03Å; L31-F67 HydrophobicContact CB-CD2 4.31Å; L31-F67 HydrophobicContact CB-CE2 3.96Å; L31-F67 HydrophobicContact CD2-CD2 3.73Å; L31-F67 HydrophobicContact CD2-CE2 3.92Å; L31-F67 HydrophobicContact CD2-CG 4.13Å; L31-F67 HydrophobicContact CD2-CZ 4.47Å; L31-F67 WeakPolarHBondContact CD2-O 3.35Å; L31-V71 HydrophobicContact CD1-CG2 4Å; L31-V71 HydrophobicContact CD2-CG2 3.87Å
32	F	98.4	Very high	97.2	Very high	126 Å²	126	69.2 Å²	69.2	55%	0.553	36%	0.356	S	S	*	.	H	α-helix	trans	-64.1	-43.3	176.7	-177.5	-110.5	0	0	0	112.1	D28 A29 Y30 I34 L35 L36	D28-F32 WeakPolarHBondContact O-CB 3.41Å; D28-F32 PolarHBondContact O-N 3.39Å; A29-F32 PolarHBondContact O-N 3.44Å; Y30-F32 VanDerWaalsContact C-N 3.32Å; Y30-F32 PolarHBondContact O-N 3.13Å; F32-I34 PolarHBondContact O-N 3.47Å; F32-L35 PolarHBondContact O-N 3.15Å; F32-L36 HydrophobicContact CD1-CD1 3.92Å; F32-L36 HydrophobicContact CD1-CG 4.43Å; F32-L36 HydrophobicContact CE1-CD1 3.35Å; F32-L36 HydrophobicContact CE1-CG 4.06Å; F32-L36 HydrophobicContact CE2-CD1 4.34Å; F32-L36 HydrophobicContact CE2-CD2 4.31Å; F32-L36 HydrophobicContact CE2-CG 4.19Å; F32-L36 HydrophobicContact CZ-CD1 3.6Å; F32-L36 HydrophobicContact CZ-CD2 4.09Å; F32-L36 HydrophobicContact CZ-CG 3.92Å; F32-L36 WeakPolarHBondContact O-CG 3.47Å; F32-L36 PolarHBondContact O-N 3.43Å
33	Y	98.2	Very high	97.3	Very high	146 Å²	146	67.3 Å²	67.3	57%	0.573	35%	0.346	S	S	*	.	H	α-helix	trans	-57.7	-46.2	174.9	162.4	-102.7	0	0	0	112.2	A29 Y30 L36 T37	A29-Y33 PolarHBondContact O-N 3.38Å; Y30-Y33 WeakPolarHBondContact O-CB 3.36Å; Y30-Y33 PolarHBondContact O-N 3.29Å; Y33-L36 PolarHBondContact O-N 3.15Å; Y33-T37 WeakPolarHBondContact O-CB 3.18Å; Y33-T37 PolarHBondContact O-N 3.4Å; Y33-T37 PolarHBondContact O-OG1 3.32Å
34	I	98.2	Very high	97.5	Very high	11 Å²	11	67.3 Å²	67.3	6%	0.056	34%	0.342	C	S	.	.	H	α-helix	trans	-64.9	-43.7	178.6	-70.7	171	0	0	0	111.3	Y30 L31 F32 L36 T37 G38 C63 A66 F67	Y30-I34 HydrophobicContact CD1-CD1 4.06Å; Y30-I34 HydrophobicContact CD2-CD1 4.05Å; Y30-I34 HydrophobicContact CE1-CD1 3.44Å; Y30-I34 VanDerWaalsContact CE1-CD1 3.44Å; Y30-I34 HydrophobicContact CE2-CD1 3.43Å; Y30-I34 VanDerWaalsContact CE2-CD1 3.43Å; Y30-I34 HydrophobicContact CE2-CG1 4.21Å; Y30-I34 HydrophobicContact CG-CD1 4.35Å; Y30-I34 PolarHBondContact O-N 3.19Å; Y30-I34 VanDerWaalsContact OH-CD1 3.25Å; Y30-I34 WeakPolarHBondContact OH-CD1 3.33Å; L31-I34 PolarHBondContact O-N 3.22Å; F32-I34 PolarHBondContact O-N 3.47Å; I34-L36 VanDerWaalsContact C-N 3.32Å; I34-L36 PolarHBondContact O-N 2.91Å; I34-T37 PolarHBondContact O-N 2.97Å; I34-G38 PolarHBondContact O-N 3.46Å; I34-C63 HydrophobicContact CG2-CB 4.14Å; I34-C63 WeakPolarHBondContact CG2-O 3.24Å; I34-A66 HydrophobicContact CD1-CB 3.73Å; I34-F67 HydrophobicContact CG2-CB 3.88Å; I34-F67 HydrophobicContact CG2-CD2 4.45Å
35	L	98.1	Very high	97.4	Very high	98 Å²	98	67.4 Å²	67.4	51%	0.513	34%	0.344	S	S	.	.	H	α-helix	trans	-57.8	-47	177.8	-178.9	70.8	0	0	0	111	L31 F32 T37 G38 A39 F67	L31-L35 WeakPolarHBondContact O-CB 3.46Å; L31-L35 PolarHBondContact O-N 3.03Å; F32-L35 PolarHBondContact O-N 3.15Å; L35-T37 VanDerWaalsContact C-N 3.33Å; L35-T37 PolarHBondContact O-N 2.93Å; L35-G38 PolarHBondContact O-N 2.74Å; L35-A39 WeakPolarHBondContact O-CB 3.46Å; L35-A39 PolarHBondContact O-N 2.82Å; L35-F67 HydrophobicContact CB-CD2 4.4Å; L35-F67 HydrophobicContact CB-CE2 4.16Å
36	L	98.3	Very high	97.4	Very high	81 Å²	81	70.4 Å²	70.4	42%	0.424	36%	0.362	S	S	.	.	H	α-helix	trans	-61.4	-42.7	176.3	-73.3	-178.2	0	0	0	111.7	F32 Y33 I34 A39 L40	F32-L36 HydrophobicContact CD1-CD1 3.92Å; F32-L36 HydrophobicContact CD1-CG 4.43Å; F32-L36 HydrophobicContact CE1-CD1 3.35Å; F32-L36 HydrophobicContact CE1-CG 4.06Å; F32-L36 HydrophobicContact CE2-CD1 4.34Å; F32-L36 HydrophobicContact CE2-CD2 4.31Å; F32-L36 HydrophobicContact CE2-CG 4.19Å; F32-L36 HydrophobicContact CZ-CD1 3.6Å; F32-L36 HydrophobicContact CZ-CD2 4.09Å; F32-L36 HydrophobicContact CZ-CG 3.92Å; F32-L36 WeakPolarHBondContact O-CG 3.47Å; F32-L36 PolarHBondContact O-N 3.43Å; Y33-L36 PolarHBondContact O-N 3.15Å; I34-L36 VanDerWaalsContact C-N 3.32Å; I34-L36 PolarHBondContact O-N 2.91Å; L36-A39 PolarHBondContact O-N 3.33Å; L36-L40 WeakPolarHBondContact O-CB 3.4Å; L36-L40 VanDerWaalsContact O-CG 3.29Å; L36-L40 WeakPolarHBondContact O-CG 3.42Å; L36-L40 PolarHBondContact O-N 3.43Å
37	T	98.1	Very high	97.4	Very high	46 Å²	46	71.8 Å²	71.8	28%	0.282	37%	0.365	S	S	.	.	H	α-helix	trans	-61.5	-47.3	178.7	-56.2	0	0	0	0	111.3	Y33 I34 L35 A39 L40 Q41	Y33-T37 WeakPolarHBondContact O-CB 3.18Å; Y33-T37 PolarHBondContact O-N 3.4Å; Y33-T37 PolarHBondContact O-OG1 3.32Å; I34-T37 PolarHBondContact O-N 2.97Å; L35-T37 VanDerWaalsContact C-N 3.33Å; L35-T37 PolarHBondContact O-N 2.93Å; T37-A39 PolarHBondContact O-N 2.97Å; T37-L40 PolarHBondContact O-N 3.05Å; T37-Q41 WeakPolarHBondContact O-CB 3.5Å; T37-Q41 PolarHBondContact O-N 3.44Å
38	G	98	Very high	97.3	Very high	7 Å²	7	75.6 Å²	75.6	7%	0.072	39%	0.388	C	S	.	.	H	α-helix	trans	-63.5	-39.5	176.7	0	0	0	0	0	112.9	I34 L35 Q41 F42	I34-G38 PolarHBondContact O-N 3.46Å; L35-G38 PolarHBondContact O-N 2.74Å; G38-Q41 PolarHBondContact O-N 2.94Å; G38-F42 WeakPolarHBondContact O-CB 3.29Å; G38-F42 PolarHBondContact O-N 2.63Å
39	A	98.2	Very high	96.9	Very high	57 Å²	57	76.3 Å²	76.3	47%	0.471	40%	0.401	S	S	.	.	H	α-helix	trans	-64.2	-42.8	175.6	0	0	0	0	0	112.1	L35 L36 T37 F42 L43	L35-A39 WeakPolarHBondContact O-CB 3.46Å; L35-A39 PolarHBondContact O-N 2.82Å; L36-A39 PolarHBondContact O-N 3.33Å; T37-A39 PolarHBondContact O-N 2.97Å; A39-F42 PolarHBondContact O-N 3.17Å; A39-L43 WeakPolarHBondContact O-CB 3.35Å; A39-L43 PolarHBondContact O-N 3.41Å
40	L	97.8	Very high	96.6	Very high	115 Å²	115	77.3 Å²	77.3	60%	0.602	40%	0.401	S	S	*	.	H	α-helix	trans	-65	-41.5	175.9	-72.3	172.1	0	0	0	111.7	L36 T37 L43 Y44	L36-L40 WeakPolarHBondContact O-CB 3.4Å; L36-L40 VanDerWaalsContact O-CG 3.29Å; L36-L40 WeakPolarHBondContact O-CG 3.42Å; L36-L40 PolarHBondContact O-N 3.43Å; T37-L40 PolarHBondContact O-N 3.05Å; L40-L43 PolarHBondContact O-N 2.98Å; L40-Y44 WeakPolarHBondContact O-CB 3.41Å; L40-Y44 PolarHBondContact O-N 3.28Å
41	Q	96.3	Very high	96.2	Very high	44 Å²	44	83.5 Å²	83.5	21%	0.206	43%	0.429	C	S	.	.	H	α-helix	trans	-64.6	-41.1	176.7	-175.3	168.6	-11.6	0	0	112	T37 G38 Y44 C45 F56 G59	T37-Q41 WeakPolarHBondContact O-CB 3.5Å; T37-Q41 PolarHBondContact O-N 3.44Å; G38-Q41 PolarHBondContact O-N 2.94Å; Q41-Y44 PolarHBondContact O-N 3.33Å; Q41-C45 PolarHBondContact O-N 3.22Å; Q41-C45 VanDerWaalsContact O-N 3.11Å; Q41-F56 HydrophobicContact CG-CD2 4.08Å; Q41-F56 HydrophobicContact CG-CE2 4.14Å; Q41-F56 PolarHBondContact NE2-O 3.35Å; Q41-G59 VanDerWaalsContact NE2-CA 3.27Å; Q41-G59 PolarHBondContact OE1-O 3.32Å
42	F	96.1	Very high	95.9	Very high	97 Å²	97	86 Å²	86	43%	0.425	45%	0.447	S	S	.	.	H	α-helix	trans	-64.2	-44.5	174.1	-176.5	-107.5	0	0	0	111.8	G38 A39 Y44 C45 L46 F56 F60	G38-F42 WeakPolarHBondContact O-CB 3.29Å; G38-F42 PolarHBondContact O-N 2.63Å; A39-F42 PolarHBondContact O-N 3.17Å; F42-Y44 VanDerWaalsContact C-N 3.34Å; F42-Y44 PolarHBondContact O-N 2.94Å; F42-C45 WeakPolarHBondContact O-CB 3.44Å; F42-C45 PolarHBondContact O-N 3.03Å; F42-L46 HydrophobicContact CD1-CD1 3.98Å; F42-L46 HydrophobicContact CD1-CG 4.4Å; F42-L46 HydrophobicContact CE1-CD1 3.53Å; F42-L46 HydrophobicContact CE1-CD2 4.46Å; F42-L46 HydrophobicContact CE1-CG 4.07Å; F42-L46 HydrophobicContact CZ-CD1 4.06Å; F42-L46 HydrophobicContact CZ-CD2 4.16Å; F42-L46 HydrophobicContact CZ-CG 4.22Å; F42-L46 WeakPolarHBondContact O-CG 3.47Å; F42-L46 PolarHBondContact O-N 2.92Å; F42-F56 HydrophobicContact CD2-CZ 4.2Å; F42-F60 HydrophobicContact CB-CD2 4.33Å; F42-F60 HydrophobicContact CB-CE2 3.92Å; F42-F60 HydrophobicContact CD2-CE2 4.35Å; F42-F60 HydrophobicContact CG-CE2 4.45Å
43	L	97.4	Very high	95.5	Very high	86 Å²	86	85.3 Å²	85.3	45%	0.45	44%	0.444	S	S	.	.	H	α-helix	trans	-60.7	-43.1	176.4	-178.5	62	0	0	0	111.7	A39 L40 C45 L46 L47	A39-L43 WeakPolarHBondContact O-CB 3.35Å; A39-L43 PolarHBondContact O-N 3.41Å; L40-L43 PolarHBondContact O-N 2.98Å; L43-C45 VanDerWaalsContact C-N 3.32Å; L43-C45 PolarHBondContact O-N 3.42Å; L43-L46 PolarHBondContact O-N 3.45Å; L43-L47 HydrophobicContact CD1-CD1 4.11Å; L43-L47 HydrophobicContact CD1-CG 4.22Å; L43-L47 HydrophobicContact CG-CD1 3.95Å; L43-L47 HydrophobicContact CG-CG 4.43Å; L43-L47 VanDerWaalsContact O-CG 3.31Å; L43-L47 WeakPolarHBondContact O-CG 3.25Å; L43-L47 PolarHBondContact O-N 3.2Å
44	Y	95.5	Very high	95.3	Very high	147 Å²	147	81.5 Å²	81.5	58%	0.576	43%	0.433	S	S	*	.	H	α-helix	trans	-57.9	-45	175	175.1	-93.5	0	0	0	111.8	L40 Q41 F42 L46 L47 V48	L40-Y44 WeakPolarHBondContact O-CB 3.41Å; L40-Y44 PolarHBondContact O-N 3.28Å; Q41-Y44 PolarHBondContact O-N 3.33Å; F42-Y44 VanDerWaalsContact C-N 3.34Å; F42-Y44 PolarHBondContact O-N 2.94Å; Y44-L46 VanDerWaalsContact C-N 3.33Å; Y44-L46 PolarHBondContact O-N 2.97Å; Y44-L47 PolarHBondContact O-N 2.94Å; Y44-V48 HydrophobicContact CD2-CB 4.42Å; Y44-V48 HydrophobicContact CD2-CG2 3.81Å; Y44-V48 HydrophobicContact CE1-CB 4.28Å; Y44-V48 HydrophobicContact CE2-CB 4.02Å; Y44-V48 HydrophobicContact CE2-CG1 4.29Å; Y44-V48 HydrophobicContact CE2-CG2 3.54Å; Y44-V48 HydrophobicContact CG-CG2 4.48Å; Y44-V48 PolarHBondContact O-N 3.06Å
45	C	95.1	Very high	95.2	Very high	13 Å²	13	82.8 Å²	82.8	9%	0.088	44%	0.443	C	S	.	.	H	α-helix	trans	-60.4	-40.5	176.9	-175.3	0	0	0	0	112.4	Q41 F42 L43 G49 F56	Q41-C45 PolarHBondContact O-N 3.22Å; Q41-C45 VanDerWaalsContact O-N 3.11Å; F42-C45 WeakPolarHBondContact O-CB 3.44Å; F42-C45 PolarHBondContact O-N 3.03Å; L43-C45 VanDerWaalsContact C-N 3.32Å; L43-C45 PolarHBondContact O-N 3.42Å; C45-G49 CarbonylContact O-C 3.45Å; C45-G49 VanDerWaalsContact O-CA 3.27Å; C45-G49 WeakPolarHBondContact O-CA 3.33Å; C45-G49 PolarHBondContact O-N 3.48Å; C45-F56 HydrophobicContact CB-CD2 3.54Å; C45-F56 HydrophobicContact CB-CE1 4.48Å; C45-F56 HydrophobicContact CB-CE2 3.34Å; C45-F56 HydrophobicContact CB-CG 4.21Å; C45-F56 HydrophobicContact CB-CZ 3.86Å
46	L	95.4	Very high	95	Very high	116 Å²	116	79.7 Å²	79.7	61%	0.607	43%	0.426	S	S	*	.	H	α-helix	trans	-66.5	-34.9	175.5	-67.6	-179.2	0	0	0	113.2	F42 L43 Y44	F42-L46 HydrophobicContact CD1-CD1 3.98Å; F42-L46 HydrophobicContact CD1-CG 4.4Å; F42-L46 HydrophobicContact CE1-CD1 3.53Å; F42-L46 HydrophobicContact CE1-CD2 4.46Å; F42-L46 HydrophobicContact CE1-CG 4.07Å; F42-L46 HydrophobicContact CZ-CD1 4.06Å; F42-L46 HydrophobicContact CZ-CD2 4.16Å; F42-L46 HydrophobicContact CZ-CG 4.22Å; F42-L46 WeakPolarHBondContact O-CG 3.47Å; F42-L46 PolarHBondContact O-N 2.92Å; L43-L46 PolarHBondContact O-N 3.45Å; Y44-L46 VanDerWaalsContact C-N 3.33Å; Y44-L46 PolarHBondContact O-N 2.97Å
47	L	96.6	Very high	94.9	Very high	134 Å²	134	78.5 Å²	78.5	70%	0.702	42%	0.419	S	S	*	.	H	α-helix	trans	-84.9	-40.9	-175.3	-68.2	175.6	0	0	0	113.3	L43 Y44	L43-L47 HydrophobicContact CD1-CD1 4.11Å; L43-L47 HydrophobicContact CD1-CG 4.22Å; L43-L47 HydrophobicContact CG-CD1 3.95Å; L43-L47 HydrophobicContact CG-CG 4.43Å; L43-L47 VanDerWaalsContact O-CG 3.31Å; L43-L47 WeakPolarHBondContact O-CG 3.25Å; L43-L47 PolarHBondContact O-N 3.2Å; Y44-L47 PolarHBondContact O-N 2.94Å
48	V	95.2	Very high	94.8	Very high	98 Å²	98	76.4 Å²	76.4	59%	0.594	41%	0.407	S	S	*	.	H	α-helix	trans	-104.3	-20	-170.5	-175.3	0	0	0	0	112.1	Y44	Y44-V48 HydrophobicContact CD2-CB 4.42Å; Y44-V48 HydrophobicContact CD2-CG2 3.81Å; Y44-V48 HydrophobicContact CE1-CB 4.28Å; Y44-V48 HydrophobicContact CE2-CB 4.02Å; Y44-V48 HydrophobicContact CE2-CG1 4.29Å; Y44-V48 HydrophobicContact CE2-CG2 3.54Å; Y44-V48 HydrophobicContact CG-CG2 4.48Å; Y44-V48 PolarHBondContact O-N 3.06Å
49	G	90.4	Very high	94.8	Very high	37 Å²	37	76.8 Å²	76.8	38%	0.381	41%	0.411	S	S	.	.			trans	103	-175.1	-178.3	0	0	0	0	0	113.1	C45	C45-G49 CarbonylContact O-C 3.45Å; C45-G49 VanDerWaalsContact O-CA 3.27Å; C45-G49 WeakPolarHBondContact O-CA 3.33Å; C45-G49 PolarHBondContact O-N 3.48Å
50	T	90.2	Very high	94.7	Very high	81 Å²	81	76.8 Å²	76.8	50%	0.497	40%	0.4	S	S	.	.			trans	-108	3.1	-161.8	52	0	0	0	0	114.4	P52 F53	T50-P52 CarbonylContact O-C 3.08Å; T50-F53 HydrophobicContact CG2-CD2 4.44Å; T50-F53 WeakPolarHBondContact O-CA 3.46Å; T50-F53 WeakPolarHBondContact O-CB 3.39Å; T50-F53 PolarHBondContact O-N 2.99Å
51	F	90.6	Very high	94.6	Very high	201 Å²	201	75.2 Å²	75.2	88%	0.882	39%	0.391	S	S	*	.	S	Bend	trans	-93.8	125.3	179.2	-175.2	-95.7	0	0	0	111
52	P	91.3	Very high	94.7	Very high	65 Å²	65	74 Å²	74	42%	0.422	39%	0.388	S	S	.	.	S	Bend	cis	-81.1	133	-5.7	30.6	-33.4	0	0	0	113.7	T50 S55 F56	T50-P52 CarbonylContact O-C 3.08Å; P52-S55 VanDerWaalsContact CG-OG 3.32Å; P52-S55 WeakPolarHBondContact CG-OG 3.43Å; P52-S55 PolarHBondContact O-N 3.13Å; P52-F56 PolarHBondContact O-N 3.29Å
53	F	91.2	Very high	94.8	Very high	112 Å²	112	70.2 Å²	70.2	49%	0.491	37%	0.373	S	S	.	.	H	α-helix	trans	-72.1	-36.6	-171.2	-176.2	-109.9	0	0	0	112.7	T50 S55 F56 L57	T50-F53 HydrophobicContact CG2-CD2 4.44Å; T50-F53 WeakPolarHBondContact O-CA 3.46Å; T50-F53 WeakPolarHBondContact O-CB 3.39Å; T50-F53 PolarHBondContact O-N 2.99Å; F53-S55 VanDerWaalsContact C-N 3.35Å; F53-S55 PolarHBondContact O-N 3.43Å; F53-F56 HydrophobicContact CD2-CD1 4.26Å; F53-F56 HydrophobicContact CE2-CD1 4.15Å; F53-F56 PolarHBondContact O-N 2.89Å; F53-L57 HydrophobicContact CE1-CD2 4.33Å; F53-L57 WeakPolarHBondContact O-CB 3.38Å; F53-L57 PolarHBondContact O-N 3.02Å
54	N	93.9	Very high	94.9	Very high	65 Å²	65	69 Å²	69	35%	0.348	37%	0.369	S	S	.	.	H	α-helix	trans	-61.8	-42.8	176.8	-69	-8.3	0	0	0	111.4	F56 L57 A58 F111	N54-F56 PolarHBondContact O-N 3.33Å; N54-L57 PolarHBondContact O-N 3.43Å; N54-A58 WeakPolarHBondContact O-CB 3.47Å; N54-A58 PolarHBondContact O-N 3.35Å; N54-F111 HydrophobicContact CB-CE1 4.41Å; N54-F111 HydrophobicContact CB-CZ 4.43Å
55	S	94.6	Very high	95	Very high	38 Å²	38	62.7 Å²	62.7	27%	0.266	35%	0.349	S	S	.	.	H	α-helix	trans	-66.8	-39.1	178.6	-43.2	0	0	0	0	112.2	P52 F53 G59 I112	P52-S55 VanDerWaalsContact CG-OG 3.32Å; P52-S55 WeakPolarHBondContact CG-OG 3.43Å; P52-S55 PolarHBondContact O-N 3.13Å; F53-S55 VanDerWaalsContact C-N 3.35Å; F53-S55 PolarHBondContact O-N 3.43Å; S55-G59 PolarHBondContact O-N 3.27Å; S55-G59 VanDerWaalsContact O-N 3.13Å; S55-I112 WeakPolarHBondContact CA-O 3.35Å; S55-I112 WeakPolarHBondContact CB-O 3.38Å; S55-I112 PolarHBondContact N-O 3.39Å; S55-I112 PolarHBondContact OG-O 2.67Å
56	F	95.1	Very high	95.2	Very high	34 Å²	34	62.3 Å²	62.3	15%	0.149	35%	0.347	C	S	.	.	H	α-helix	trans	-60.5	-51.5	171.5	165.6	-105.4	0	0	0	111	Q41 F42 C45 P52 F53 N54 A58 G59 F60	Q41-F56 HydrophobicContact CG-CD2 4.08Å; Q41-F56 HydrophobicContact CG-CE2 4.14Å; Q41-F56 PolarHBondContact NE2-O 3.35Å; F42-F56 HydrophobicContact CD2-CZ 4.2Å; C45-F56 HydrophobicContact CB-CD2 3.54Å; C45-F56 HydrophobicContact CB-CE1 4.48Å; C45-F56 HydrophobicContact CB-CE2 3.34Å; C45-F56 HydrophobicContact CB-CG 4.21Å; C45-F56 HydrophobicContact CB-CZ 3.86Å; P52-F56 PolarHBondContact O-N 3.29Å; F53-F56 HydrophobicContact CD2-CD1 4.26Å; F53-F56 HydrophobicContact CE2-CD1 4.15Å; F53-F56 PolarHBondContact O-N 2.89Å; N54-F56 PolarHBondContact O-N 3.33Å; F56-A58 VanDerWaalsContact C-N 3.33Å; F56-A58 PolarHBondContact O-N 3.25Å; F56-G59 PolarHBondContact O-N 3.41Å; F56-F60 HydrophobicContact CE2-CB 4.12Å; F56-F60 HydrophobicContact CE2-CD2 4.43Å; F56-F60 HydrophobicContact CE2-CG 4.4Å; F56-F60 HydrophobicContact CZ-CB 4.11Å; F56-F60 HydrophobicContact CZ-CD2 4.36Å; F56-F60 HydrophobicContact CZ-CG 4.12Å; F56-F60 VanDerWaalsContact O-CB 3.3Å; F56-F60 WeakPolarHBondContact O-CB 3.41Å; F56-F60 PolarHBondContact O-N 2.94Å
57	L	95.5	Very high	95.3	Very high	55 Å²	55	60 Å²	60	29%	0.288	33%	0.332	S	S	.	.	H	α-helix	trans	-62.2	-42.1	-177.8	-172.1	68.4	0	0	0	111	F53 N54 F60 I61 F111	F53-L57 HydrophobicContact CE1-CD2 4.33Å; F53-L57 WeakPolarHBondContact O-CB 3.38Å; F53-L57 PolarHBondContact O-N 3.02Å; N54-L57 PolarHBondContact O-N 3.43Å; L57-F60 PolarHBondContact O-N 3.2Å; L57-I61 HydrophobicContact CD1-CD1 4.34Å; L57-I61 HydrophobicContact CD1-CG1 3.86Å; L57-I61 HydrophobicContact CG-CG1 4.09Å; L57-I61 VanDerWaalsContact O-CB 3.26Å; L57-I61 WeakPolarHBondContact O-CB 3.45Å; L57-I61 WeakPolarHBondContact O-CG1 3.49Å; L57-I61 PolarHBondContact O-N 3.26Å; L57-F111 HydrophobicContact CB-CE1 4.14Å; L57-F111 HydrophobicContact CD2-CE1 3.81Å; L57-F111 HydrophobicContact CD2-CZ 3.95Å; L57-F111 HydrophobicContact CG-CE1 4.15Å
58	A	97.1	Very high	95.4	Very high	3 Å²	3	58.1 Å²	58.1	3%	0.025	32%	0.322	C	S	.	.	H	α-helix	trans	-58.4	-51.4	177.1	0	0	0	0	0	111.9	N54 F56 S62 V108 F111 I112	N54-A58 WeakPolarHBondContact O-CB 3.47Å; N54-A58 PolarHBondContact O-N 3.35Å; F56-A58 VanDerWaalsContact C-N 3.33Å; F56-A58 PolarHBondContact O-N 3.25Å; A58-S62 VanDerWaalsContact O-CB 3.23Å; A58-S62 WeakPolarHBondContact O-CB 3.37Å; A58-S62 PolarHBondContact O-N 2.88Å; A58-V108 HydrophobicContact CB-CG1 4.31Å; A58-F111 HydrophobicContact CB-CD1 3.9Å; A58-I112 HydrophobicContact CB-CB 3.86Å; A58-I112 HydrophobicContact CB-CG1 3.91Å
59	G	96.5	Very high	95.5	Very high	15 Å²	15	55.3 Å²	55.3	16%	0.155	30%	0.303	C	S	.	.	H	α-helix	trans	-69.4	-36.5	179.2	0	0	0	0	0	112.9	Q41 S55 F56 S62 C63	Q41-G59 VanDerWaalsContact NE2-CA 3.27Å; Q41-G59 PolarHBondContact OE1-O 3.32Å; S55-G59 PolarHBondContact O-N 3.27Å; S55-G59 VanDerWaalsContact O-N 3.13Å; F56-G59 PolarHBondContact O-N 3.41Å; G59-S62 WeakPolarHBondContact O-CB 3.07Å; G59-S62 PolarHBondContact O-N 3Å; G59-C63 PolarHBondContact O-N 3.41Å; G59-C63 PolarHBondContact O-SG 3.34Å
60	F	96.8	Very high	95.9	Very high	57 Å²	57	53.5 Å²	53.5	25%	0.25	29%	0.285	C	S	.	.	H	α-helix	trans	-68.7	-45.8	179.8	-174.5	-103.3	0	0	0	111.2	F42 F56 L57 S62 C63 V64	F42-F60 HydrophobicContact CB-CD2 4.33Å; F42-F60 HydrophobicContact CB-CE2 3.92Å; F42-F60 HydrophobicContact CD2-CE2 4.35Å; F42-F60 HydrophobicContact CG-CE2 4.45Å; F56-F60 HydrophobicContact CE2-CB 4.12Å; F56-F60 HydrophobicContact CE2-CD2 4.43Å; F56-F60 HydrophobicContact CE2-CG 4.4Å; F56-F60 HydrophobicContact CZ-CB 4.11Å; F56-F60 HydrophobicContact CZ-CD2 4.36Å; F56-F60 HydrophobicContact CZ-CG 4.12Å; F56-F60 VanDerWaalsContact O-CB 3.3Å; F56-F60 WeakPolarHBondContact O-CB 3.41Å; F56-F60 PolarHBondContact O-N 2.94Å; L57-F60 PolarHBondContact O-N 3.2Å; F60-S62 VanDerWaalsContact C-N 3.3Å; F60-S62 PolarHBondContact O-N 3.34Å; F60-C63 WeakPolarHBondContact O-CB 3.32Å; F60-C63 PolarHBondContact O-N 3Å; F60-V64 HydrophobicContact CD1-CG2 4.25Å; F60-V64 HydrophobicContact CE1-CG2 3.9Å; F60-V64 HydrophobicContact CZ-CG2 4.15Å; F60-V64 WeakPolarHBondContact O-CG2 3.46Å; F60-V64 PolarHBondContact O-N 2.99Å
61	I	96.7	Very high	96.3	Very high	81 Å²	81	51.8 Å²	51.8	42%	0.415	27%	0.274	S	S	.	.	H	α-helix	trans	-68	-31	175.5	-62.6	-61.4	0	0	0	111.4	L57 V64 G65	L57-I61 HydrophobicContact CD1-CD1 4.34Å; L57-I61 HydrophobicContact CD1-CG1 3.86Å; L57-I61 HydrophobicContact CG-CG1 4.09Å; L57-I61 VanDerWaalsContact O-CB 3.26Å; L57-I61 WeakPolarHBondContact O-CB 3.45Å; L57-I61 WeakPolarHBondContact O-CG1 3.49Å; L57-I61 PolarHBondContact O-N 3.26Å; I61-V64 PolarHBondContact O-N 2.9Å; I61-G65 PolarHBondContact O-N 3Å
62	S	98.1	Very high	96.6	Very high	20 Å²	20	44.9 Å²	44.9	14%	0.14	25%	0.25	C	S	.	.	H	α-helix	trans	-58.2	-47.6	169.3	-175.6	0	0	0	0	111.3	A58 G59 F60 G65 A66	A58-S62 VanDerWaalsContact O-CB 3.23Å; A58-S62 WeakPolarHBondContact O-CB 3.37Å; A58-S62 PolarHBondContact O-N 2.88Å; G59-S62 WeakPolarHBondContact O-CB 3.07Å; G59-S62 PolarHBondContact O-N 3Å; F60-S62 VanDerWaalsContact C-N 3.3Å; F60-S62 PolarHBondContact O-N 3.34Å; S62-G65 PolarHBondContact O-N 3.1Å; S62-A66 VanDerWaalsContact O-CB 3.24Å; S62-A66 WeakPolarHBondContact O-CB 3.41Å; S62-A66 PolarHBondContact O-N 3.22Å
63	C	98.2	Very high	96.9	Very high	17 Å²	17	42.4 Å²	42.4	12%	0.115	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-48.6	176.3	-64.8	0	0	0	0	111.7	I34 G59 F60 G65 A66 F67	I34-C63 HydrophobicContact CG2-CB 4.14Å; I34-C63 WeakPolarHBondContact CG2-O 3.24Å; G59-C63 PolarHBondContact O-N 3.41Å; G59-C63 PolarHBondContact O-SG 3.34Å; F60-C63 WeakPolarHBondContact O-CB 3.32Å; F60-C63 PolarHBondContact O-N 3Å; C63-G65 PolarHBondContact O-N 2.93Å; C63-A66 PolarHBondContact O-N 3.42Å; C63-F67 WeakPolarHBondContact O-CB 3.33Å; C63-F67 PolarHBondContact O-N 2.95Å
64	V	98.2	Very high	97.1	Very high	59 Å²	59	40.8 Å²	40.8	36%	0.358	22%	0.224	S	C	.	.	H	α-helix	trans	-61.6	-45.9	179.6	173.7	0	0	0	0	111.2	F60 I61 F67 I68	F60-V64 HydrophobicContact CD1-CG2 4.25Å; F60-V64 HydrophobicContact CE1-CG2 3.9Å; F60-V64 HydrophobicContact CZ-CG2 4.15Å; F60-V64 WeakPolarHBondContact O-CG2 3.46Å; F60-V64 PolarHBondContact O-N 2.99Å; I61-V64 PolarHBondContact O-N 2.9Å; V64-F67 WeakPolarHBondContact O-CB 3.34Å; V64-F67 PolarHBondContact O-N 3.47Å; V64-I68 HydrophobicContact CG1-CD1 3.9Å; V64-I68 WeakPolarHBondContact O-CG1 3.45Å; V64-I68 PolarHBondContact O-N 2.89Å
65	G	98.3	Very high	97.2	Very high	15 Å²	15	41 Å²	41	16%	0.155	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-46.7	178.4	0	0	0	0	0	112.2	I61 S62 C63 F67 I68 L69	I61-G65 PolarHBondContact O-N 3Å; S62-G65 PolarHBondContact O-N 3.1Å; C63-G65 PolarHBondContact O-N 2.93Å; G65-F67 VanDerWaalsContact C-N 3.28Å; G65-F67 PolarHBondContact O-N 3.42Å; G65-I68 PolarHBondContact O-N 3.32Å; G65-L69 WeakPolarHBondContact O-CG 3.24Å; G65-L69 PolarHBondContact O-N 2.89Å
66	A	98.4	Very high	97.2	Very high	6 Å²	6	41.7 Å²	41.7	5%	0.05	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-36	177.9	0	0	0	0	0	112	I34 S62 C63 G70 L104	I34-A66 HydrophobicContact CD1-CB 3.73Å; S62-A66 VanDerWaalsContact O-CB 3.24Å; S62-A66 WeakPolarHBondContact O-CB 3.41Å; S62-A66 PolarHBondContact O-N 3.22Å; C63-A66 PolarHBondContact O-N 3.42Å; A66-G70 PolarHBondContact O-N 2.93Å; A66-L104 HydrophobicContact CB-CD2 4.34Å
67	F	98.5	Very high	97.2	Very high	67 Å²	67	41.3 Å²	41.3	29%	0.294	22%	0.223	S	C	.	.	H	α-helix	trans	-64.3	-48.9	174.1	-172.7	-90.6	0	0	0	111.7	L31 I34 L35 C63 V64 G65 L69 G70 V71	L31-F67 HydrophobicContact CB-CD2 4.31Å; L31-F67 HydrophobicContact CB-CE2 3.96Å; L31-F67 HydrophobicContact CD2-CD2 3.73Å; L31-F67 HydrophobicContact CD2-CE2 3.92Å; L31-F67 HydrophobicContact CD2-CG 4.13Å; L31-F67 HydrophobicContact CD2-CZ 4.47Å; L31-F67 WeakPolarHBondContact CD2-O 3.35Å; I34-F67 HydrophobicContact CG2-CB 3.88Å; I34-F67 HydrophobicContact CG2-CD2 4.45Å; L35-F67 HydrophobicContact CB-CD2 4.4Å; L35-F67 HydrophobicContact CB-CE2 4.16Å; C63-F67 WeakPolarHBondContact O-CB 3.33Å; C63-F67 PolarHBondContact O-N 2.95Å; V64-F67 WeakPolarHBondContact O-CB 3.34Å; V64-F67 PolarHBondContact O-N 3.47Å; G65-F67 VanDerWaalsContact C-N 3.28Å; G65-F67 PolarHBondContact O-N 3.42Å; F67-L69 PolarHBondContact O-N 3.48Å; F67-G70 PolarHBondContact O-N 3.36Å; F67-V71 HydrophobicContact CD1-CG2 4.04Å; F67-V71 HydrophobicContact CE1-CG2 3.7Å; F67-V71 HydrophobicContact CZ-CG2 4.15Å; F67-V71 WeakPolarHBondContact O-CG2 3.33Å; F67-V71 PolarHBondContact O-N 3.31Å
68	I	98.4	Very high	97.1	Very high	94 Å²	94	40.3 Å²	40.3	48%	0.482	22%	0.218	S	C	.	.	H	α-helix	trans	-58.6	-48.5	178.2	-68.5	166.5	0	0	0	110.3	V64 G65 G70 V71 C72	V64-I68 HydrophobicContact CG1-CD1 3.9Å; V64-I68 WeakPolarHBondContact O-CG1 3.45Å; V64-I68 PolarHBondContact O-N 2.89Å; G65-I68 PolarHBondContact O-N 3.32Å; I68-G70 VanDerWaalsContact C-N 3.31Å; I68-G70 PolarHBondContact O-N 3.22Å; I68-V71 PolarHBondContact O-N 3.49Å; I68-V71 VanDerWaalsContact O-N 3.17Å; I68-C72 PolarHBondContact O-N 2.92Å; I68-C72 PolarHBondContact O-SG 3.19Å
69	L	98.3	Very high	96.8	Very high	39 Å²	39	44 Å²	44	20%	0.204	24%	0.241	C	C	.	.	H	α-helix	trans	-60.8	-40.2	177.9	-66.9	179.1	0	0	0	111.9	G65 F67 C72 L73 F97 A100 H101 L104	G65-L69 WeakPolarHBondContact O-CG 3.24Å; G65-L69 PolarHBondContact O-N 2.89Å; F67-L69 PolarHBondContact O-N 3.48Å; L69-C72 PolarHBondContact O-N 3.45Å; L69-L73 PolarHBondContact O-N 2.95Å; L69-F97 HydrophobicContact CB-CD2 3.96Å; L69-F97 HydrophobicContact CB-CE2 3.86Å; L69-A100 HydrophobicContact CD1-CB 3.93Å; L69-A100 HydrophobicContact CD2-CB 3.74Å; L69-A100 HydrophobicContact CG-CB 4.49Å; L69-H101 HydrophobicContact CD1-CB 4.38Å; L69-L104 HydrophobicContact CD1-CB 4.49Å; L69-L104 HydrophobicContact CD1-CD2 4.08Å
70	G	97.9	Very high	96.5	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-38.4	175.4	0	0	0	0	0	113	A66 F67 I68 L73 R74	A66-G70 PolarHBondContact O-N 2.93Å; F67-G70 PolarHBondContact O-N 3.36Å; I68-G70 VanDerWaalsContact C-N 3.31Å; I68-G70 PolarHBondContact O-N 3.22Å; G70-L73 PolarHBondContact O-N 3.45Å; G70-R74 WeakPolarHBondContact O-CB 3.22Å; G70-R74 PolarHBondContact O-N 3.04Å
71	V	98.1	Very high	96.3	Very high	44 Å²	44	49.2 Å²	49.2	27%	0.267	27%	0.268	S	S	.	.	H	α-helix	trans	-67.1	-43.1	174.7	171.2	0	0	0	0	110.6	L31 F67 I68 L73 R74 I75	L31-V71 HydrophobicContact CD1-CG2 4Å; L31-V71 HydrophobicContact CD2-CG2 3.87Å; F67-V71 HydrophobicContact CD1-CG2 4.04Å; F67-V71 HydrophobicContact CE1-CG2 3.7Å; F67-V71 HydrophobicContact CZ-CG2 4.15Å; F67-V71 WeakPolarHBondContact O-CG2 3.33Å; F67-V71 PolarHBondContact O-N 3.31Å; I68-V71 PolarHBondContact O-N 3.49Å; I68-V71 VanDerWaalsContact O-N 3.17Å; V71-L73 VanDerWaalsContact C-N 3.33Å; V71-L73 PolarHBondContact O-N 2.9Å; V71-R74 WeakPolarHBondContact O-CB 3.49Å; V71-R74 PolarHBondContact O-N 3.38Å; V71-I75 HydrophobicContact CG1-CD1 3.82Å; V71-I75 HydrophobicContact CG1-CG1 4.42Å; V71-I75 VanDerWaalsContact O-CG1 3.32Å; V71-I75 WeakPolarHBondContact O-CG1 3.22Å; V71-I75 PolarHBondContact O-N 3.17Å
72	C	96.9	Very high	95.8	Very high	56 Å²	56	52.9 Å²	52.9	38%	0.378	28%	0.281	S	S	.	.	H	α-helix	trans	-58.6	-45.7	174.8	-67.7	0	0	0	0	111.4	I68 L69 I75 Q76	I68-C72 PolarHBondContact O-N 2.92Å; I68-C72 PolarHBondContact O-SG 3.19Å; L69-C72 PolarHBondContact O-N 3.45Å; C72-I75 PolarHBondContact O-N 3.39Å; C72-Q76 WeakPolarHBondContact O-CG 3.47Å; C72-Q76 PolarHBondContact O-N 3.31Å
73	L	97.1	Very high	95.3	Very high	14 Å²	14	54.6 Å²	54.6	7%	0.073	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-48	175	179.2	66.2	0	0	0	111	L69 G70 V71 I75 Q76 I77 A93 F94 F97	L69-L73 PolarHBondContact O-N 2.95Å; G70-L73 PolarHBondContact O-N 3.45Å; V71-L73 VanDerWaalsContact C-N 3.33Å; V71-L73 PolarHBondContact O-N 2.9Å; L73-I75 VanDerWaalsContact C-N 3.29Å; L73-I75 PolarHBondContact O-N 3.34Å; L73-Q76 PolarHBondContact O-N 3.33Å; L73-I77 HydrophobicContact CD1-CG2 3.77Å; L73-I77 HydrophobicContact CG-CD1 4.37Å; L73-I77 HydrophobicContact CG-CG2 4.36Å; L73-I77 WeakPolarHBondContact O-CG1 3.46Å; L73-I77 WeakPolarHBondContact O-CG2 3.46Å; L73-I77 PolarHBondContact O-N 2.95Å; L73-A93 HydrophobicContact CD1-CB 4.24Å; L73-F94 HydrophobicContact CD2-CD2 4.35Å; L73-F97 HydrophobicContact CB-CB 4.4Å; L73-F97 HydrophobicContact CB-CD2 3.96Å; L73-F97 HydrophobicContact CB-CG 4.27Å; L73-F97 HydrophobicContact CD1-CB 4.09Å; L73-F97 HydrophobicContact CD1-CG 4.49Å; L73-F97 HydrophobicContact CD2-CB 4.33Å; L73-F97 HydrophobicContact CD2-CD1 3.95Å; L73-F97 HydrophobicContact CD2-CD2 4.09Å; L73-F97 HydrophobicContact CD2-CE1 4.28Å; L73-F97 HydrophobicContact CD2-CE2 4.41Å; L73-F97 HydrophobicContact CD2-CG 3.85Å; L73-F97 HydrophobicContact CG-CG 4.43Å
74	R	97.1	Very high	94.9	Very high	77 Å²	77	60 Å²	60	29%	0.291	33%	0.33	S	S	.	.	H	α-helix	trans	-54.7	-45.4	177.9	-172.7	-141.2	177.3	102.3	20.4	111.7	L24 V27 D28 G70 V71 N78	L24-R74 HydrophobicContact CD2-CG 4.05Å; V27-R74 HydrophobicContact CG1-CB 3.94Å; V27-R74 HydrophobicContact CG1-CG 4.43Å; D28-R74 IonicContact OD1-CZ 3.34Å; D28-R74 IonicContact OD1-NE 2.63Å; D28-R74 IonicContact OD1-NH1 3.29Å; D28-R74 PolarHBondContact OD1-NH1 2.96Å; D28-R74 IonicContact OD1-NH2 2.81Å; D28-R74 PolarHBondContact OD1-NH2 3.27Å; D28-R74 IonicContact OD2-CZ 3.75Å; D28-R74 VanDerWaalsContact OD2-CZ 3.29Å; D28-R74 IonicContact OD2-NH1 3.02Å; D28-R74 PolarHBondContact OD2-NH1 2.93Å; D28-R74 VanDerWaalsContact OD2-NH1 3.09Å; D28-R74 IonicContact OD2-NH2 2.66Å; D28-R74 PolarHBondContact OD2-NH2 3.48Å; G70-R74 WeakPolarHBondContact O-CB 3.22Å; G70-R74 PolarHBondContact O-N 3.04Å; V71-R74 WeakPolarHBondContact O-CB 3.49Å; V71-R74 PolarHBondContact O-N 3.38Å; R74-N78 WeakPolarHBondContact O-CB 3.46Å; R74-N78 PolarHBondContact O-N 3.43Å
75	I	95.9	Very high	94.4	Very high	71 Å²	71	59.7 Å²	59.7	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-64.4	-43.8	-179.6	-71	167.7	0	0	0	110.8	V71 C72 L73 N81 F85	V71-I75 HydrophobicContact CG1-CD1 3.82Å; V71-I75 HydrophobicContact CG1-CG1 4.42Å; V71-I75 VanDerWaalsContact O-CG1 3.32Å; V71-I75 WeakPolarHBondContact O-CG1 3.22Å; V71-I75 PolarHBondContact O-N 3.17Å; C72-I75 PolarHBondContact O-N 3.39Å; L73-I75 VanDerWaalsContact C-N 3.29Å; L73-I75 PolarHBondContact O-N 3.34Å; I75-N81 PolarHBondContact O-ND2 3.42Å; I75-F85 HydrophobicContact CG2-CE2 3.72Å; I75-F85 HydrophobicContact CG2-CZ 3.81Å
76	Q	95.1	Very high	93.3	Very high	52 Å²	52	66.3 Å²	66.3	24%	0.243	36%	0.355	C	S	.	.	H	α-helix	trans	-72.4	-33.6	-177.1	-70.1	175.8	17.6	0	0	113.3	C72 L73 F85 A93	C72-Q76 WeakPolarHBondContact O-CG 3.47Å; C72-Q76 PolarHBondContact O-N 3.31Å; L73-Q76 PolarHBondContact O-N 3.33Å; Q76-F85 HydrophobicContact CG-CD1 4.49Å; Q76-F85 HydrophobicContact CG-CE1 4.27Å; Q76-F85 HydrophobicContact CG-CZ 4.3Å; Q76-A93 HydrophobicContact CB-CB 3.89Å
77	I	94.1	Very high	92.6	Very high	25 Å²	25	70.5 Å²	70.5	13%	0.128	38%	0.384	C	S	.	.	H	α-helix	trans	-88.2	-7.8	-179.4	72.9	-177.6	0	0	0	113.4	L24 V27 L73 P79 Q90 A93	L24-I77 HydrophobicContact CD2-CD1 4.03Å; L24-I77 HydrophobicContact CD2-CG1 3.71Å; V27-I77 HydrophobicContact CG2-CD1 3.96Å; L73-I77 HydrophobicContact CD1-CG2 3.77Å; L73-I77 HydrophobicContact CG-CD1 4.37Å; L73-I77 HydrophobicContact CG-CG2 4.36Å; L73-I77 WeakPolarHBondContact O-CG1 3.46Å; L73-I77 WeakPolarHBondContact O-CG2 3.46Å; L73-I77 PolarHBondContact O-N 2.95Å; I77-P79 WeakPolarHBondContact O-CD 3.38Å; I77-Q90 PolarHBondContact O-NE2 2.92Å; I77-A93 HydrophobicContact CG2-CB 4.17Å
78	N	94.3	Very high	92.1	Very high	35 Å²	35	69.5 Å²	69.5	19%	0.187	38%	0.381	C	S	.	.			trans	-68.4	119.6	177.8	-173.2	12.2	0	0	0	110.5	R74 D80 N81	R74-N78 WeakPolarHBondContact O-CB 3.46Å; R74-N78 PolarHBondContact O-N 3.43Å; N78-D80 PolarHBondContact O-N 2.89Å; N78-D80 VanDerWaalsContact O-N 3.15Å; N78-D80 PolarHBondContact OD1-N 2.91Å; N78-N81 HydrophobicContact CB-CB 4.49Å; N78-N81 PolarHBondContact O-N 3.44Å
79	P	89.9	Confident	91.8	Very high	80 Å²	80	67.6 Å²	67.6	52%	0.519	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-56.4	-31.7	179.9	-26.5	35.7	0	0	0	114.2	I77 N81 K82	I77-P79 WeakPolarHBondContact O-CD 3.38Å; P79-N81 PolarHBondContact O-N 2.98Å; P79-K82 VanDerWaalsContact O-CB 3.24Å; P79-K82 WeakPolarHBondContact O-CB 3.31Å; P79-K82 PolarHBondContact O-N 2.83Å
80	D	90.7	Very high	91.5	Very high	141 Å²	141	69.8 Å²	69.8	75%	0.754	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-64.9	-26.3	179.9	-59	-29	0	0	0	112.3	N78	N78-D80 PolarHBondContact O-N 2.89Å; N78-D80 VanDerWaalsContact O-N 3.15Å; N78-D80 PolarHBondContact OD1-N 2.91Å
81	N	91.6	Very high	91.3	Very high	41 Å²	41	76.1 Å²	76.1	22%	0.219	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-94.1	5.7	-179.1	-60.1	-12.7	0	0	0	112.6	I75 N78 P79 G83 D84 F85	I75-N81 PolarHBondContact O-ND2 3.42Å; N78-N81 HydrophobicContact CB-CB 4.49Å; N78-N81 PolarHBondContact O-N 3.44Å; P79-N81 PolarHBondContact O-N 2.98Å; N81-G83 PolarHBondContact O-N 3.46Å; N81-G83 VanDerWaalsContact O-N 3.13Å; N81-D84 PolarHBondContact O-N 3.31Å; N81-F85 HydrophobicContact CB-CD2 4.05Å; N81-F85 HydrophobicContact CB-CE2 4Å; N81-F85 WeakPolarHBondContact O-CD2 3.3Å; N81-F85 PolarHBondContact O-N 3.01Å
82	K	86.5	Confident	91.2	Very high	157 Å²	157	80 Å²	80	68%	0.683	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.4	-175.4	-170.8	177.1	-179.9	-176.7	0	112.9	P79 D84 F85	P79-K82 VanDerWaalsContact O-CB 3.24Å; P79-K82 WeakPolarHBondContact O-CB 3.31Å; P79-K82 PolarHBondContact O-N 2.83Å; K82-D84 VanDerWaalsContact C-N 3.27Å; K82-D84 PolarHBondContact O-N 3.38Å; K82-F85 PolarHBondContact O-N 3.05Å
83	G	87.6	Confident	91.1	Very high	56 Å²	56	77.3 Å²	77.3	58%	0.577	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-27.5	175.7	0	0	0	0	0	114	N81 L86	N81-G83 PolarHBondContact O-N 3.46Å; N81-G83 VanDerWaalsContact O-N 3.13Å; G83-L86 WeakPolarHBondContact O-CG 3.42Å
84	D	89.3	Confident	91.1	Very high	130 Å²	130	81.8 Å²	81.8	70%	0.695	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-19.8	-179.7	-57.4	-37.5	0	0	0	112.1	N81 K82	N81-D84 PolarHBondContact O-N 3.31Å; K82-D84 VanDerWaalsContact C-N 3.27Å; K82-D84 PolarHBondContact O-N 3.38Å
85	F	88.2	Confident	91.1	Very high	54 Å²	54	80.7 Å²	80.7	24%	0.237	43%	0.433	C	S	.	.			trans	-121.7	43.7	-173.4	-59.6	-66.4	0	0	0	112.9	I75 Q76 N81 K82 S87 I88	I75-F85 HydrophobicContact CG2-CE2 3.72Å; I75-F85 HydrophobicContact CG2-CZ 3.81Å; Q76-F85 HydrophobicContact CG-CD1 4.49Å; Q76-F85 HydrophobicContact CG-CE1 4.27Å; Q76-F85 HydrophobicContact CG-CZ 4.3Å; N81-F85 HydrophobicContact CB-CD2 4.05Å; N81-F85 HydrophobicContact CB-CE2 4Å; N81-F85 WeakPolarHBondContact O-CD2 3.3Å; N81-F85 PolarHBondContact O-N 3.01Å; K82-F85 PolarHBondContact O-N 3.05Å; F85-S87 PolarHBondContact O-N 2.77Å; F85-I88 HydrophobicContact CB-CB 4.25Å; F85-I88 HydrophobicContact CD1-CD1 3.93Å; F85-I88 PolarHBondContact O-N 2.96Å
86	L	76	Confident	91.1	Very high	153 Å²	153	80.7 Å²	80.7	80%	0.801	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-25.6	-173.4	-65.3	170.3	0	0	0	115.1	G83	G83-L86 WeakPolarHBondContact O-CG 3.42Å
87	S	82.7	Confident	91.3	Very high	95 Å²	95	79.5 Å²	79.5	66%	0.664	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	2.2	-178.4	63.3	0	0	0	0	114.5	F85 R92	F85-S87 PolarHBondContact O-N 2.77Å; S87-R92 PolarHBondContact O-NH1 3.5Å
88	I	89.3	Confident	91.4	Very high	45 Å²	45	82.4 Å²	82.4	23%	0.231	44%	0.443	C	S	.	.			trans	-112.3	111.7	-177.1	-58	178.1	0	0	0	108.7	F85 A93	F85-I88 HydrophobicContact CB-CB 4.25Å; F85-I88 HydrophobicContact CD1-CD1 3.93Å; F85-I88 PolarHBondContact O-N 2.96Å; I88-A93 HydrophobicContact CG2-CB 3.93Å
89	S	92.2	Very high	91.6	Very high	55 Å²	55	86.2 Å²	86.2	39%	0.385	46%	0.463	S	S	.	.			trans	-77.8	160.9	170.4	87.9	0	0	0	0	110.6	E91 R92 A93	S89-E91 WeakPolarHBondContact CB-OE2 3.37Å; S89-E91 PolarHBondContact O-N 3.2Å; S89-E91 PolarHBondContact OG-N 2.97Å; S89-E91 PolarHBondContact OG-OE2 2.87Å; S89-R92 PolarHBondContact O-N 2.95Å; S89-R92 PolarHBondContact OG-N 3.38Å; S89-R92 VanDerWaalsContact OG-N 3.15Å; S89-A93 PolarHBondContact O-N 3.44Å
90	Q	91.5	Very high	92	Very high	84 Å²	84	84.1 Å²	84.1	39%	0.393	45%	0.453	S	S	.	.	H	α-helix	trans	-62.3	-34.7	177.5	-67.8	-171.4	-27.4	0	0	111.6	I77 F94	I77-Q90 PolarHBondContact O-NE2 2.92Å; Q90-F94 WeakPolarHBondContact O-CB 3.36Å; Q90-F94 PolarHBondContact O-N 3.44Å
91	E	93.8	Very high	92.4	Very high	133 Å²	133	79.7 Å²	79.7	62%	0.621	43%	0.427	S	S	*	.	H	α-helix	trans	-66.9	-41.7	177.1	-55.4	71.6	-153.7	0	0	110.8	S89 F94 A95	S89-E91 WeakPolarHBondContact CB-OE2 3.37Å; S89-E91 PolarHBondContact O-N 3.2Å; S89-E91 PolarHBondContact OG-N 2.97Å; S89-E91 PolarHBondContact OG-OE2 2.87Å; E91-F94 PolarHBondContact O-N 3.18Å; E91-A95 WeakPolarHBondContact O-CB 3.33Å; E91-A95 PolarHBondContact O-N 3.47Å
92	R	95.3	Very high	92.7	Very high	125 Å²	125	82.1 Å²	82.1	47%	0.472	44%	0.444	S	S	.	.	H	α-helix	trans	-64.6	-48.4	175	-178.2	178.9	177.2	-175.7	4.1	111.6	S87 S89 F94 A95 D96	S87-R92 PolarHBondContact O-NH1 3.5Å; S89-R92 PolarHBondContact O-N 2.95Å; S89-R92 PolarHBondContact OG-N 3.38Å; S89-R92 VanDerWaalsContact OG-N 3.15Å; R92-F94 PolarHBondContact O-N 3.03Å; R92-A95 PolarHBondContact O-N 3.42Å; R92-A95 VanDerWaalsContact O-N 3.1Å; R92-D96 IonicContact NE-OD2 3.9Å; R92-D96 PolarHBondContact O-N 3.03Å
93	A	95.6	Very high	93.3	Very high	1 Å²	1	78.6 Å²	78.6	1%	0.008	44%	0.435	C	S	.	.	H	α-helix	trans	-55.5	-40.8	176.7	0	0	0	0	0	111.7	L73 Q76 I77 I88 S89 F97	L73-A93 HydrophobicContact CD1-CB 4.24Å; Q76-A93 HydrophobicContact CB-CB 3.89Å; I77-A93 HydrophobicContact CG2-CB 4.17Å; I88-A93 HydrophobicContact CG2-CB 3.93Å; S89-A93 PolarHBondContact O-N 3.44Å; A93-F97 WeakPolarHBondContact O-CB 3.23Å; A93-F97 PolarHBondContact O-N 3.43Å
94	F	95.4	Very high	93.7	Very high	108 Å²	108	77.5 Å²	77.5	47%	0.474	42%	0.416	S	S	.	.	H	α-helix	trans	-69.2	-40.7	176.7	-172.3	-109.8	0	0	0	112.8	L73 Q90 E91 R92 F97 L98	L73-F94 HydrophobicContact CD2-CD2 4.35Å; Q90-F94 WeakPolarHBondContact O-CB 3.36Å; Q90-F94 PolarHBondContact O-N 3.44Å; E91-F94 PolarHBondContact O-N 3.18Å; R92-F94 PolarHBondContact O-N 3.03Å; F94-F97 HydrophobicContact CD2-CD1 4.49Å; F94-F97 HydrophobicContact CE2-CD1 4.46Å; F94-F97 WeakPolarHBondContact O-CB 3.42Å; F94-F97 PolarHBondContact O-N 3.11Å; F94-L98 HydrophobicContact CD1-CD1 4.02Å; F94-L98 HydrophobicContact CD1-CG 4.44Å; F94-L98 HydrophobicContact CE1-CD1 3.58Å; F94-L98 HydrophobicContact CE1-CG 4.11Å; F94-L98 HydrophobicContact CZ-CD1 4.08Å; F94-L98 HydrophobicContact CZ-CD2 4.17Å; F94-L98 HydrophobicContact CZ-CG 4.2Å; F94-L98 WeakPolarHBondContact O-CG 3.47Å; F94-L98 PolarHBondContact O-N 3.19Å
95	A	97.4	Very high	94.1	Very high	53 Å²	53	74.2 Å²	74.2	44%	0.438	40%	0.396	S	S	.	.	H	α-helix	trans	-62.8	-44.7	175.2	0	0	0	0	0	112	E91 R92 F97 L98 L99	E91-A95 WeakPolarHBondContact O-CB 3.33Å; E91-A95 PolarHBondContact O-N 3.47Å; R92-A95 PolarHBondContact O-N 3.42Å; R92-A95 VanDerWaalsContact O-N 3.1Å; A95-F97 VanDerWaalsContact C-N 3.3Å; A95-F97 PolarHBondContact O-N 3.2Å; A95-L98 PolarHBondContact O-N 2.96Å; A95-L99 PolarHBondContact O-N 3.22Å
96	D	97.3	Very high	94.6	Very high	71 Å²	71	77.7 Å²	77.7	38%	0.38	42%	0.416	S	S	.	.	H	α-helix	trans	-61.6	-40.5	176.7	-68.5	-18.2	0	0	0	110.8	R92 L99 A100	R92-D96 IonicContact NE-OD2 3.9Å; R92-D96 PolarHBondContact O-N 3.03Å; D96-L99 PolarHBondContact O-N 3.42Å; D96-A100 WeakPolarHBondContact O-CB 3.41Å; D96-A100 PolarHBondContact O-N 2.9Å
97	F	97.6	Very high	95.6	Very high	28 Å²	28	74.6 Å²	74.6	12%	0.123	40%	0.404	C	S	.	.	H	α-helix	trans	-60.2	-48.6	173.7	170.8	-99.1	0	0	0	112.5	Y30 L69 L73 A93 F94 A95 L99 A100 H101	Y30-F97 HydrophobicContact CE1-CZ 4.2Å; L69-F97 HydrophobicContact CB-CD2 3.96Å; L69-F97 HydrophobicContact CB-CE2 3.86Å; L73-F97 HydrophobicContact CB-CB 4.4Å; L73-F97 HydrophobicContact CB-CD2 3.96Å; L73-F97 HydrophobicContact CB-CG 4.27Å; L73-F97 HydrophobicContact CD1-CB 4.09Å; L73-F97 HydrophobicContact CD1-CG 4.49Å; L73-F97 HydrophobicContact CD2-CB 4.33Å; L73-F97 HydrophobicContact CD2-CD1 3.95Å; L73-F97 HydrophobicContact CD2-CD2 4.09Å; L73-F97 HydrophobicContact CD2-CE1 4.28Å; L73-F97 HydrophobicContact CD2-CE2 4.41Å; L73-F97 HydrophobicContact CD2-CG 3.85Å; L73-F97 HydrophobicContact CG-CG 4.43Å; A93-F97 WeakPolarHBondContact O-CB 3.23Å; A93-F97 PolarHBondContact O-N 3.43Å; F94-F97 HydrophobicContact CD2-CD1 4.49Å; F94-F97 HydrophobicContact CE2-CD1 4.46Å; F94-F97 WeakPolarHBondContact O-CB 3.42Å; F94-F97 PolarHBondContact O-N 3.11Å; A95-F97 VanDerWaalsContact C-N 3.3Å; A95-F97 PolarHBondContact O-N 3.2Å; F97-L99 VanDerWaalsContact C-N 3.35Å; F97-L99 PolarHBondContact O-N 3.46Å; F97-A100 PolarHBondContact O-N 3.44Å; F97-H101 VanDerWaalsContact O-CB 3.22Å; F97-H101 WeakPolarHBondContact O-CB 3.43Å; F97-H101 PolarHBondContact O-N 3.47Å
98	L	98.1	Very high	96.3	Very high	85 Å²	85	70.8 Å²	70.8	45%	0.445	38%	0.377	S	S	.	.	H	α-helix	trans	-62.7	-41.8	179.4	-70.8	178	0	0	0	112.2	F94 A95 H101 T102	F94-L98 HydrophobicContact CD1-CD1 4.02Å; F94-L98 HydrophobicContact CD1-CG 4.44Å; F94-L98 HydrophobicContact CE1-CD1 3.58Å; F94-L98 HydrophobicContact CE1-CG 4.11Å; F94-L98 HydrophobicContact CZ-CD1 4.08Å; F94-L98 HydrophobicContact CZ-CD2 4.17Å; F94-L98 HydrophobicContact CZ-CG 4.2Å; F94-L98 WeakPolarHBondContact O-CG 3.47Å; F94-L98 PolarHBondContact O-N 3.19Å; A95-L98 PolarHBondContact O-N 2.96Å; L98-H101 PolarHBondContact O-N 3.38Å; L98-T102 WeakPolarHBondContact O-CB 3.39Å; L98-T102 PolarHBondContact O-N 2.96Å; L98-T102 PolarHBondContact O-OG1 3.31Å
99	L	98.3	Very high	96.7	Very high	116 Å²	116	74.5 Å²	74.5	61%	0.607	40%	0.395	S	S	*	.	H	α-helix	trans	-64	-49.9	178.5	-176.2	66.7	0	0	0	110.8	A95 D96 F97 H101 T102 V103	A95-L99 PolarHBondContact O-N 3.22Å; D96-L99 PolarHBondContact O-N 3.42Å; F97-L99 VanDerWaalsContact C-N 3.35Å; F97-L99 PolarHBondContact O-N 3.46Å; L99-H101 VanDerWaalsContact C-N 3.29Å; L99-H101 PolarHBondContact O-N 3.13Å; L99-T102 WeakPolarHBondContact O-CB 3.42Å; L99-T102 PolarHBondContact O-N 3.16Å; L99-V103 WeakPolarHBondContact O-CG2 3.24Å; L99-V103 PolarHBondContact O-N 3.48Å
100	A	98.3	Very high	96.9	Very high	36 Å²	36	78.7 Å²	78.7	30%	0.298	41%	0.413	S	S	.	.	H	α-helix	trans	-61	-39.7	177.9	0	0	0	0	0	111.9	L69 D96 F97 V103 L104	L69-A100 HydrophobicContact CD1-CB 3.93Å; L69-A100 HydrophobicContact CD2-CB 3.74Å; L69-A100 HydrophobicContact CG-CB 4.49Å; D96-A100 WeakPolarHBondContact O-CB 3.41Å; D96-A100 PolarHBondContact O-N 2.9Å; F97-A100 PolarHBondContact O-N 3.44Å; A100-V103 PolarHBondContact O-N 3.26Å; A100-L104 WeakPolarHBondContact O-CB 3.4Å; A100-L104 PolarHBondContact O-N 3.38Å
101	H	97.8	Very high	97	Very high	47 Å²	47	78.8 Å²	78.8	22%	0.218	41%	0.413	C	S	.	.	H	α-helix	trans	-65.6	-38.4	177.4	-163.2	-87.6	0	0	0	112.1	Y30 L69 F97 L98 L99 L104 H105	Y30-H101 PolarHBondContact OH-NE2 3.3Å; L69-H101 HydrophobicContact CD1-CB 4.38Å; F97-H101 VanDerWaalsContact O-CB 3.22Å; F97-H101 WeakPolarHBondContact O-CB 3.43Å; F97-H101 PolarHBondContact O-N 3.47Å; L98-H101 PolarHBondContact O-N 3.38Å; L99-H101 VanDerWaalsContact C-N 3.29Å; L99-H101 PolarHBondContact O-N 3.13Å; H101-L104 PolarHBondContact O-N 2.94Å; H101-H105 AromaticContact CD2-CE1 3.98Å; H101-H105 AromaticContact CE1-CE1 2.89Å; H101-H105 PolarHBondContact CE1-CE1 2.79Å; H101-H105 AromaticContact CE1-ND1 3.33Å; H101-H105 PolarHBondContact CE1-ND1 2.9Å; H101-H105 VanDerWaalsContact CE1-ND1 3.33Å; H101-H105 AromaticContact CE1-NE2 3.61Å; H101-H105 AromaticContact CG-ND1 3.89Å; H101-H105 AromaticContact ND1-CE1 3.35Å; H101-H105 PolarHBondContact ND1-CE1 3.36Å; H101-H105 AromaticContact ND1-ND1 3.25Å; H101-H105 PolarHBondContact ND1-ND1 3.43Å; H101-H105 AromaticContact NE2-CE1 3.29Å; H101-H105 PolarHBondContact NE2-CE1 2.85Å; H101-H105 VanDerWaalsContact NE2-CE1 3.29Å; H101-H105 AromaticContact NE2-ND1 3.94Å; H101-H105 PolarHBondContact O-N 2.94Å; H101-H105 PolarHBondContact O-ND1 3.29Å
102	T	98.3	Very high	96.9	Very high	93 Å²	93	76.2 Å²	76.2	57%	0.571	40%	0.403	S	S	*	.	H	α-helix	trans	-63.3	-46.8	175.4	-57.2	0	0	0	0	111	L98 L99 L104 H105 L106	L98-T102 WeakPolarHBondContact O-CB 3.39Å; L98-T102 PolarHBondContact O-N 2.96Å; L98-T102 PolarHBondContact O-OG1 3.31Å; L99-T102 WeakPolarHBondContact O-CB 3.42Å; L99-T102 PolarHBondContact O-N 3.16Å; T102-L104 PolarHBondContact O-N 3.44Å; T102-H105 PolarHBondContact O-N 3.41Å; T102-L106 WeakPolarHBondContact O-CB 3.48Å; T102-L106 PolarHBondContact O-N 2.95Å
103	V	98.4	Very high	96.5	Very high	82 Å²	82	74.8 Å²	74.8	50%	0.497	43%	0.427	S	S	.	.	H	α-helix	trans	-62.1	-44.2	177	174.7	0	0	0	0	111	L99 A100 H105 L106 V107	L99-V103 WeakPolarHBondContact O-CG2 3.24Å; L99-V103 PolarHBondContact O-N 3.48Å; A100-V103 PolarHBondContact O-N 3.26Å; V103-H105 VanDerWaalsContact C-N 3.34Å; V103-H105 PolarHBondContact O-N 3.08Å; V103-L106 PolarHBondContact O-N 3.02Å; V103-V107 WeakPolarHBondContact O-CG2 3.27Å; V103-V107 PolarHBondContact O-N 2.86Å; V103-V107 VanDerWaalsContact O-N 3.08Å
104	L	98.1	Very high	96.5	Very high	33 Å²	33	78.5 Å²	78.5	17%	0.173	45%	0.448	C	S	.	.	H	α-helix	trans	-55.6	-49.2	175.7	174.6	64.7	0	0	0	111.4	A66 L69 A100 H101 T102 L106 V107 V108	A66-L104 HydrophobicContact CB-CD2 4.34Å; L69-L104 HydrophobicContact CD1-CB 4.49Å; L69-L104 HydrophobicContact CD1-CD2 4.08Å; A100-L104 WeakPolarHBondContact O-CB 3.4Å; A100-L104 PolarHBondContact O-N 3.38Å; H101-L104 PolarHBondContact O-N 2.94Å; T102-L104 PolarHBondContact O-N 3.44Å; L104-L106 PolarHBondContact O-N 3.06Å; L104-V107 PolarHBondContact O-N 3.48Å; L104-V108 HydrophobicContact CD1-CG2 4.17Å; L104-V108 HydrophobicContact CG-CG2 4.45Å; L104-V108 VanDerWaalsContact O-CG2 3.24Å; L104-V108 WeakPolarHBondContact O-CG2 3.32Å; L104-V108 PolarHBondContact O-N 3.49Å
105	H	97.3	Very high	96.6	Very high	62 Å²	62	76.9 Å²	76.9	29%	0.287	45%	0.446	S	S	.	.	H	α-helix	trans	-68.5	-35	-178	-76.8	68.8	0	0	0	112.4	H101 T102 V103 V108 I109	H101-H105 AromaticContact CD2-CE1 3.98Å; H101-H105 AromaticContact CE1-CE1 2.89Å; H101-H105 PolarHBondContact CE1-CE1 2.79Å; H101-H105 AromaticContact CE1-ND1 3.33Å; H101-H105 PolarHBondContact CE1-ND1 2.9Å; H101-H105 VanDerWaalsContact CE1-ND1 3.33Å; H101-H105 AromaticContact CE1-NE2 3.61Å; H101-H105 AromaticContact CG-ND1 3.89Å; H101-H105 AromaticContact ND1-CE1 3.35Å; H101-H105 PolarHBondContact ND1-CE1 3.36Å; H101-H105 AromaticContact ND1-ND1 3.25Å; H101-H105 PolarHBondContact ND1-ND1 3.43Å; H101-H105 AromaticContact NE2-CE1 3.29Å; H101-H105 PolarHBondContact NE2-CE1 2.85Å; H101-H105 VanDerWaalsContact NE2-CE1 3.29Å; H101-H105 AromaticContact NE2-ND1 3.94Å; H101-H105 PolarHBondContact O-N 2.94Å; H101-H105 PolarHBondContact O-ND1 3.29Å; T102-H105 PolarHBondContact O-N 3.41Å; V103-H105 VanDerWaalsContact C-N 3.34Å; V103-H105 PolarHBondContact O-N 3.08Å; H105-V108 PolarHBondContact O-N 3.26Å; H105-I109 WeakPolarHBondContact O-CB 3.34Å; H105-I109 WeakPolarHBondContact O-CD1 3.22Å; H105-I109 VanDerWaalsContact O-CG1 3.22Å; H105-I109 WeakPolarHBondContact O-CG1 3.35Å; H105-I109 PolarHBondContact O-N 3.5Å
106	L	98.1	Very high	96.5	Very high	126 Å²	126	78.3 Å²	78.3	66%	0.66	45%	0.447	S	S	*	.	H	α-helix	trans	-59.6	-46.7	173.6	-177.1	66.5	0	0	0	111.4	T102 V103 L104 N110	T102-L106 WeakPolarHBondContact O-CB 3.48Å; T102-L106 PolarHBondContact O-N 2.95Å; V103-L106 PolarHBondContact O-N 3.02Å; L104-L106 PolarHBondContact O-N 3.06Å; L106-N110 WeakPolarHBondContact O-CB 3.01Å; L106-N110 PolarHBondContact O-N 3.28Å
107	V	97.6	Very high	96.5	Very high	88 Å²	88	78.7 Å²	78.7	53%	0.533	45%	0.451	S	S	.	.	H	α-helix	trans	-66.6	-43.1	178.7	175.5	0	0	0	0	111.2	V103 L104 I109 N110 F111	V103-V107 WeakPolarHBondContact O-CG2 3.27Å; V103-V107 PolarHBondContact O-N 2.86Å; V103-V107 VanDerWaalsContact O-N 3.08Å; L104-V107 PolarHBondContact O-N 3.48Å; V107-I109 PolarHBondContact O-N 3.47Å; V107-N110 PolarHBondContact O-N 2.86Å; V107-F111 WeakPolarHBondContact O-CB 3.2Å; V107-F111 PolarHBondContact O-N 3.13Å
108	V	97.7	Very high	96.4	Very high	16 Å²	16	81.9 Å²	81.9	10%	0.097	47%	0.471	C	S	.	.	H	α-helix	trans	-59.7	-47.6	177.7	166.6	0	0	0	0	111.3	A58 L104 H105 N110 F111 I112	A58-V108 HydrophobicContact CB-CG1 4.31Å; L104-V108 HydrophobicContact CD1-CG2 4.17Å; L104-V108 HydrophobicContact CG-CG2 4.45Å; L104-V108 VanDerWaalsContact O-CG2 3.24Å; L104-V108 WeakPolarHBondContact O-CG2 3.32Å; L104-V108 PolarHBondContact O-N 3.49Å; H105-V108 PolarHBondContact O-N 3.26Å; V108-N110 VanDerWaalsContact C-N 3.3Å; V108-N110 PolarHBondContact O-N 3.49Å; V108-F111 PolarHBondContact O-N 3.33Å; V108-F111 VanDerWaalsContact O-N 3.16Å; V108-I112 WeakPolarHBondContact O-CB 3.26Å; V108-I112 PolarHBondContact O-N 3.43Å
109	I	96.8	Very high	96.3	Very high	122 Å²	122	81.7 Å²	81.7	63%	0.626	47%	0.473	S	S	*	.	H	α-helix	trans	-65.7	-35.8	179.7	-67.5	166.4	0	0	0	110.9	H105 V107 F111 I112	H105-I109 WeakPolarHBondContact O-CB 3.34Å; H105-I109 WeakPolarHBondContact O-CD1 3.22Å; H105-I109 VanDerWaalsContact O-CG1 3.22Å; H105-I109 WeakPolarHBondContact O-CG1 3.35Å; H105-I109 PolarHBondContact O-N 3.5Å; V107-I109 PolarHBondContact O-N 3.47Å; I109-F111 VanDerWaalsContact C-N 3.3Å; I109-F111 PolarHBondContact O-N 2.77Å; I109-I112 WeakPolarHBondContact O-CG2 3.33Å
110	N	95.4	Very high	96.1	Very high	143 Å²	143	79.2 Å²	79.2	77%	0.765	46%	0.464	S	S	*	.	H	α-helix	trans	-67.7	-30.1	175.3	-177.2	-110.7	0	0	0	112.8	L106 V107 V108	L106-N110 WeakPolarHBondContact O-CB 3.01Å; L106-N110 PolarHBondContact O-N 3.28Å; V107-N110 PolarHBondContact O-N 2.86Å; V108-N110 VanDerWaalsContact C-N 3.3Å; V108-N110 PolarHBondContact O-N 3.49Å
111	F	95.1	Very high	96	Very high	86 Å²	86	82.5 Å²	82.5	38%	0.377	48%	0.476	S	S	.	.	H	α-helix	trans	-95.6	-16.9	-174.6	-175.3	-104.9	0	0	0	114.7	N54 L57 A58 V107 V108 I109 G113	N54-F111 HydrophobicContact CB-CE1 4.41Å; N54-F111 HydrophobicContact CB-CZ 4.43Å; L57-F111 HydrophobicContact CB-CE1 4.14Å; L57-F111 HydrophobicContact CD2-CE1 3.81Å; L57-F111 HydrophobicContact CD2-CZ 3.95Å; L57-F111 HydrophobicContact CG-CE1 4.15Å; A58-F111 HydrophobicContact CB-CD1 3.9Å; V107-F111 WeakPolarHBondContact O-CB 3.2Å; V107-F111 PolarHBondContact O-N 3.13Å; V108-F111 PolarHBondContact O-N 3.33Å; V108-F111 VanDerWaalsContact O-N 3.16Å; I109-F111 VanDerWaalsContact C-N 3.3Å; I109-F111 PolarHBondContact O-N 2.77Å; F111-G113 PolarHBondContact O-N 2.99Å; F111-G113 VanDerWaalsContact O-N 3.13Å
112	I	91.9	Very high	95.8	Very high	80 Å²	80	85.5 Å²	85.5	41%	0.41	50%	0.498	S	S	.	.			trans	-63.2	-20.9	-171.4	-161.3	167.3	0	0	0	114.9	S55 A58 V108 I109	S55-I112 WeakPolarHBondContact CA-O 3.35Å; S55-I112 WeakPolarHBondContact CB-O 3.38Å; S55-I112 PolarHBondContact N-O 3.39Å; S55-I112 PolarHBondContact OG-O 2.67Å; A58-I112 HydrophobicContact CB-CB 3.86Å; A58-I112 HydrophobicContact CB-CG1 3.91Å; V108-I112 WeakPolarHBondContact O-CB 3.26Å; V108-I112 PolarHBondContact O-N 3.43Å; I109-I112 WeakPolarHBondContact O-CG2 3.33Å
113	G	85.3	Confident	95.6	Very high	95 Å²	95	84.8 Å²	84.8	98%	0.979	49%	0.491	S	S	*	.			trans	-88.9	0	176.8	0	0	0	0	0	112.4	F111	F111-G113 PolarHBondContact O-N 2.99Å; F111-G113 VanDerWaalsContact O-N 3.13Å

Retrieved 113 of 113 residues in 100.5 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).