A0A096N5H4_PAPAN 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 (P61806), UniProt , Accession A0A096N5H4, Species PAPAN (Papio anubis, Olive baboon), Gene DAD1, Length 113 aa.

						>A0A096N5H4_PAPAN|A0A096N5H4|DAD1
MSASVVSVISRFLEEYLSSTPQRLKLLDAYLLYILLTGALQFGYCLLVGTFPFNSFLSGFISCVGSFILAVCLRIQINPQNKADFQGISPERAFADFLFASTILHLVVMNFVG
					

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(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	55.3	Low	87.7	Confident	241 Å²	241	104.7 Å²	104.7	100%	1.187	60%	0.602	S	S	*	*				0	101.6	0	-68.2	-71	-86.2	0	0	107.6	A3	M1-A3 PolarHBondContact O-N 3.36Å
2	S	74.9	Confident	88.4	Confident	123 Å²	123	108.3 Å²	108.3	86%	0.86	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-67.1	122.6	175.7	-175.7	0	0	0	0	108.2	S4	S2-S4 PolarHBondContact O-N 3.41Å
3	A	78.8	Confident	89	Confident	56 Å²	56	107.7 Å²	107.7	46%	0.463	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-63.8	132.3	169.3	0	0	0	0	0	108.3	M1 V8	M1-A3 PolarHBondContact O-N 3.36Å; A3-V8 HydrophobicContact CB-CG2 3.65Å
4	S	91.8	Very high	89.6	Confident	82 Å²	82	109.9 Å²	109.9	57%	0.573	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-68.5	140.5	171.4	-56.6	0	0	0	0	108.9	S2 V6 S7 V8	S2-S4 PolarHBondContact O-N 3.41Å; S4-V6 PolarHBondContact O-N 2.64Å; S4-V6 VanDerWaalsContact O-N 3.12Å; S4-S7 PolarHBondContact N-OG 2.92Å; S4-S7 VanDerWaalsContact N-OG 3.17Å; S4-S7 WeakPolarHBondContact O-CA 3.44Å; S4-S7 WeakPolarHBondContact O-CB 3.45Å; S4-S7 PolarHBondContact O-N 3.42Å; S4-S7 PolarHBondContact O-OG 3.39Å; S4-V8 PolarHBondContact O-N 3.31Å; S4-V8 VanDerWaalsContact O-N 3.09Å
5	V	94	Very high	90.1	Very high	113 Å²	113	110.5 Å²	110.5	69%	0.685	60%	0.6	S	S	*	*	H	α-helix	trans	-50.9	-40.7	178.6	176.4	0	0	0	0	111.7	S7 V8 I9	V5-S7 PolarHBondContact O-N 2.86Å; V5-V8 WeakPolarHBondContact O-CB 3.4Å; V5-V8 PolarHBondContact O-N 3.12Å; V5-I9 HydrophobicContact CG1-CD1 3.87Å; V5-I9 HydrophobicContact CG1-CG1 4.46Å; V5-I9 WeakPolarHBondContact O-CG1 3.48Å; V5-I9 PolarHBondContact O-N 3.17Å
6	V	94	Very high	90.4	Very high	116 Å²	116	108.7 Å²	108.7	70%	0.703	58%	0.583	S	S	*	*	H	α-helix	trans	-59.1	-43.7	175.6	-179.4	0	0	0	0	112.1	S4 V8 I9 S10	S4-V6 PolarHBondContact O-N 2.64Å; S4-V6 VanDerWaalsContact O-N 3.12Å; V6-V8 VanDerWaalsContact C-N 3.28Å; V6-V8 PolarHBondContact O-N 2.99Å; V6-I9 PolarHBondContact O-N 3.42Å; V6-S10 WeakPolarHBondContact O-CB 3.47Å; V6-S10 PolarHBondContact O-N 3.18Å; V6-S10 PolarHBondContact O-OG 3.09Å
7	S	94.2	Very high	90.8	Very high	38 Å²	38	108.5 Å²	108.5	27%	0.266	58%	0.581	S	S	.	*	H	α-helix	trans	-68.2	-28.7	178.7	71.2	0	0	0	0	113	S4 V5 S10 R11	S4-S7 PolarHBondContact N-OG 2.92Å; S4-S7 VanDerWaalsContact N-OG 3.17Å; S4-S7 WeakPolarHBondContact O-CA 3.44Å; S4-S7 WeakPolarHBondContact O-CB 3.45Å; S4-S7 PolarHBondContact O-N 3.42Å; S4-S7 PolarHBondContact O-OG 3.39Å; V5-S7 PolarHBondContact O-N 2.86Å; S7-S10 WeakPolarHBondContact CA-OG 3.44Å; S7-S10 PolarHBondContact O-OG 2.91Å; S7-S10 VanDerWaalsContact O-OG 3.07Å; S7-R11 WeakPolarHBondContact O-CB 3.2Å; S7-R11 WeakPolarHBondContact O-CD 3.44Å; S7-R11 WeakPolarHBondContact O-CG 3.44Å; S7-R11 PolarHBondContact O-N 3.39Å
8	V	95.3	Very high	91	Very high	56 Å²	56	107.4 Å²	107.4	34%	0.339	58%	0.583	S	S	.	*	H	α-helix	trans	-72.1	-48.6	175.7	175.7	0	0	0	0	109.6	A3 S4 V5 V6 S10 R11 F12	A3-V8 HydrophobicContact CB-CG2 3.65Å; S4-V8 PolarHBondContact O-N 3.31Å; S4-V8 VanDerWaalsContact O-N 3.09Å; V5-V8 WeakPolarHBondContact O-CB 3.4Å; V5-V8 PolarHBondContact O-N 3.12Å; V6-V8 VanDerWaalsContact C-N 3.28Å; V6-V8 PolarHBondContact O-N 2.99Å; V8-S10 PolarHBondContact O-N 3.39Å; V8-R11 PolarHBondContact O-N 2.61Å; V8-F12 HydrophobicContact CG1-CD2 3.69Å; V8-F12 HydrophobicContact CG1-CE2 3.38Å; V8-F12 WeakPolarHBondContact O-CD2 3.15Å; V8-F12 PolarHBondContact O-N 3.07Å
9	I	95.5	Very high	91.2	Very high	91 Å²	91	104.6 Å²	104.6	47%	0.467	57%	0.572	S	S	.	*	H	α-helix	trans	-60.9	-45.6	177.7	-65.7	168.2	0	0	0	110.9	V5 V6 R11 F12 L13	V5-I9 HydrophobicContact CG1-CD1 3.87Å; V5-I9 HydrophobicContact CG1-CG1 4.46Å; V5-I9 WeakPolarHBondContact O-CG1 3.48Å; V5-I9 PolarHBondContact O-N 3.17Å; V6-I9 PolarHBondContact O-N 3.42Å; I9-R11 VanDerWaalsContact C-N 3.31Å; I9-R11 PolarHBondContact O-N 2.89Å; I9-F12 PolarHBondContact O-N 3.38Å; I9-L13 HydrophobicContact CG2-CD1 3.94Å; I9-L13 HydrophobicContact CG2-CG 4.33Å; I9-L13 WeakPolarHBondContact O-CG 3.39Å; I9-L13 PolarHBondContact O-N 3.24Å
10	S	95.6	Very high	91.5	Very high	60 Å²	60	100.3 Å²	100.3	42%	0.42	55%	0.549	S	S	.	.	H	α-helix	trans	-61.4	-41.1	-179.6	67.2	0	0	0	0	111.8	V6 S7 V8 L13 E14	V6-S10 WeakPolarHBondContact O-CB 3.47Å; V6-S10 PolarHBondContact O-N 3.18Å; V6-S10 PolarHBondContact O-OG 3.09Å; S7-S10 WeakPolarHBondContact CA-OG 3.44Å; S7-S10 PolarHBondContact O-OG 2.91Å; S7-S10 VanDerWaalsContact O-OG 3.07Å; V8-S10 PolarHBondContact O-N 3.39Å; S10-L13 PolarHBondContact O-N 3.34Å; S10-E14 WeakPolarHBondContact O-CB 3.18Å; S10-E14 PolarHBondContact O-N 3.07Å
11	R	95.8	Very high	91.7	Very high	176 Å²	176	98.3 Å²	98.3	66%	0.664	54%	0.542	S	S	*	.	H	α-helix	trans	-63.8	-43.8	175.6	-76.3	175.5	178.6	-169.4	-0.3	112.3	S7 V8 I9 L13 E14 E15	S7-R11 WeakPolarHBondContact O-CB 3.2Å; S7-R11 WeakPolarHBondContact O-CD 3.44Å; S7-R11 WeakPolarHBondContact O-CG 3.44Å; S7-R11 PolarHBondContact O-N 3.39Å; V8-R11 PolarHBondContact O-N 2.61Å; I9-R11 VanDerWaalsContact C-N 3.31Å; I9-R11 PolarHBondContact O-N 2.89Å; R11-L13 VanDerWaalsContact C-N 3.34Å; R11-L13 PolarHBondContact O-N 3.44Å; R11-E14 PolarHBondContact O-N 3.04Å; R11-E15 VanDerWaalsContact O-CB 3.29Å; R11-E15 WeakPolarHBondContact O-CB 3.31Å; R11-E15 PolarHBondContact O-N 3.48Å
12	F	95.8	Very high	93.6	Very high	148 Å²	148	95 Å²	95	65%	0.649	52%	0.523	S	S	*	.	H	α-helix	trans	-63.3	-40.5	176.5	-79.8	-60.9	0	0	0	112.4	V8 I9 Y16	V8-F12 HydrophobicContact CG1-CD2 3.69Å; V8-F12 HydrophobicContact CG1-CE2 3.38Å; V8-F12 WeakPolarHBondContact O-CD2 3.15Å; V8-F12 PolarHBondContact O-N 3.07Å; I9-F12 PolarHBondContact O-N 3.38Å; F12-Y16 WeakPolarHBondContact O-CB 3.36Å; F12-Y16 PolarHBondContact O-N 3.44Å
13	L	96.5	Very high	94.6	Very high	100 Å²	100	97.8 Å²	97.8	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-66.5	-45.5	177	-71.3	175.2	0	0	0	111.7	I9 S10 R11 Y16 L17	I9-L13 HydrophobicContact CG2-CD1 3.94Å; I9-L13 HydrophobicContact CG2-CG 4.33Å; I9-L13 WeakPolarHBondContact O-CG 3.39Å; I9-L13 PolarHBondContact O-N 3.24Å; S10-L13 PolarHBondContact O-N 3.34Å; R11-L13 VanDerWaalsContact C-N 3.34Å; R11-L13 PolarHBondContact O-N 3.44Å; L13-Y16 PolarHBondContact O-N 2.89Å; L13-L17 VanDerWaalsContact O-CB 3.31Å; L13-L17 WeakPolarHBondContact O-CB 3.29Å; L13-L17 WeakPolarHBondContact O-CG 3.23Å; L13-L17 PolarHBondContact O-N 3.24Å
14	E	97.2	Very high	95.5	Very high	138 Å²	138	95.3 Å²	95.3	65%	0.645	49%	0.494	S	S	*	.	H	α-helix	trans	-61	-47.2	177.8	-174.2	173.6	-169.9	0	0	111.3	S10 R11 L17 S18	S10-E14 WeakPolarHBondContact O-CB 3.18Å; S10-E14 PolarHBondContact O-N 3.07Å; R11-E14 PolarHBondContact O-N 3.04Å; E14-L17 PolarHBondContact O-N 3.49Å; E14-S18 WeakPolarHBondContact O-CB 3.19Å; E14-S18 PolarHBondContact O-N 2.9Å; E14-S18 PolarHBondContact O-OG 2.72Å
15	E	96.2	Very high	95.8	Very high	119 Å²	119	94 Å²	94	56%	0.556	48%	0.477	S	S	*	.	H	α-helix	trans	-63.7	-44.3	177.6	-174.4	60.2	-152.8	0	0	111.9	R11 L17 S18 S19	R11-E15 VanDerWaalsContact O-CB 3.29Å; R11-E15 WeakPolarHBondContact O-CB 3.31Å; R11-E15 PolarHBondContact O-N 3.48Å; E15-L17 VanDerWaalsContact C-N 3.32Å; E15-L17 PolarHBondContact O-N 2.95Å; E15-S18 PolarHBondContact O-N 3.42Å; E15-S18 PolarHBondContact O-OG 2.9Å; E15-S18 VanDerWaalsContact O-OG 3.07Å; E15-S19 VanDerWaalsContact O-CB 3.23Å; E15-S19 WeakPolarHBondContact O-CB 3.4Å; E15-S19 PolarHBondContact O-N 2.94Å; E15-S19 PolarHBondContact O-OG 3.28Å
16	Y	96.3	Very high	96	Very high	82 Å²	82	94.5 Å²	94.5	32%	0.322	48%	0.476	S	S	.	.	H	α-helix	trans	-60.7	-43.9	175.6	171.4	-102	0	0	0	111.3	F12 L13 T20 K25 D28	F12-Y16 WeakPolarHBondContact O-CB 3.36Å; F12-Y16 PolarHBondContact O-N 3.44Å; L13-Y16 PolarHBondContact O-N 2.89Å; Y16-T20 HydrophobicContact CD2-CG2 4.38Å; Y16-T20 WeakPolarHBondContact CD2-OG1 3.5Å; Y16-T20 HydrophobicContact CE2-CG2 3.87Å; Y16-T20 WeakPolarHBondContact O-CB 3.31Å; Y16-T20 PolarHBondContact O-N 3.38Å; Y16-T20 VanDerWaalsContact O-N 3.08Å; Y16-T20 PolarHBondContact O-OG1 3.45Å; Y16-T20 VanDerWaalsContact O-OG1 3.07Å; Y16-K25 HydrophobicContact CE1-CG 4.25Å; Y16-D28 PolarHBondContact OH-OD2 2.82Å
17	L	95.8	Very high	96.2	Very high	105 Å²	105	89.7 Å²	89.7	55%	0.55	45%	0.446	S	S	.	.	H	α-helix	trans	-68.4	-34.6	-179.6	-71.9	175.1	0	0	0	112.6	L13 E14 E15 K25	L13-L17 VanDerWaalsContact O-CB 3.31Å; L13-L17 WeakPolarHBondContact O-CB 3.29Å; L13-L17 WeakPolarHBondContact O-CG 3.23Å; L13-L17 PolarHBondContact O-N 3.24Å; E14-L17 PolarHBondContact O-N 3.49Å; E15-L17 VanDerWaalsContact C-N 3.32Å; E15-L17 PolarHBondContact O-N 2.95Å; L17-K25 PolarHBondContact O-NZ 3.14Å
18	S	95.7	Very high	96.3	Very high	89 Å²	89	89.7 Å²	89.7	62%	0.622	44%	0.443	S	S	*	.	H	α-helix	trans	-80.7	-40.9	179.7	66.7	0	0	0	0	113	E14 E15	E14-S18 WeakPolarHBondContact O-CB 3.19Å; E14-S18 PolarHBondContact O-N 2.9Å; E14-S18 PolarHBondContact O-OG 2.72Å; E15-S18 PolarHBondContact O-N 3.42Å; E15-S18 PolarHBondContact O-OG 2.9Å; E15-S18 VanDerWaalsContact O-OG 3.07Å
19	S	94.9	Very high	96.5	Very high	54 Å²	54	89.9 Å²	89.9	38%	0.378	45%	0.45	S	S	.	.	H	α-helix	trans	-91.1	-25.7	-171.2	67.9	0	0	0	0	114.3	E15 P21	E15-S19 VanDerWaalsContact O-CB 3.23Å; E15-S19 WeakPolarHBondContact O-CB 3.4Å; E15-S19 PolarHBondContact O-N 2.94Å; E15-S19 PolarHBondContact O-OG 3.28Å; S19-P21 WeakPolarHBondContact O-CD 3.32Å
20	T	95.9	Very high	96.6	Very high	19 Å²	19	88.9 Å²	88.9	12%	0.117	44%	0.441	C	S	.	.	S	Bend	trans	-90.1	121.9	-172.1	-56.5	0	0	0	0	111.9	Y16 L24 K25	Y16-T20 HydrophobicContact CD2-CG2 4.38Å; Y16-T20 WeakPolarHBondContact CD2-OG1 3.5Å; Y16-T20 HydrophobicContact CE2-CG2 3.87Å; Y16-T20 WeakPolarHBondContact O-CB 3.31Å; Y16-T20 PolarHBondContact O-N 3.38Å; Y16-T20 VanDerWaalsContact O-N 3.08Å; Y16-T20 PolarHBondContact O-OG1 3.45Å; Y16-T20 VanDerWaalsContact O-OG1 3.07Å; T20-L24 HydrophobicContact CG2-CB 3.62Å; T20-L24 HydrophobicContact CG2-CD1 4.31Å; T20-K25 HydrophobicContact CG2-CG 3.88Å; T20-K25 WeakPolarHBondContact O-CE 3.09Å; T20-K25 PolarHBondContact O-NZ 3.47Å
21	P	95.6	Very high	96.8	Very high	59 Å²	59	86.9 Å²	86.9	38%	0.383	43%	0.426	S	S	.	.			trans	-58.7	148.9	174.8	-24.2	32.8	0	0	0	113.4	S19 R23 L24 K25 P79	S19-P21 WeakPolarHBondContact O-CD 3.32Å; P21-R23 VanDerWaalsContact C-N 3.28Å; P21-R23 PolarHBondContact O-N 3.08Å; P21-L24 HydrophobicContact CB-CG 4.36Å; P21-L24 HydrophobicContact CG-CD1 4.07Å; P21-L24 HydrophobicContact CG-CG 4.41Å; P21-L24 WeakPolarHBondContact O-CB 3.09Å; P21-L24 PolarHBondContact O-N 3.07Å; P21-K25 PolarHBondContact O-N 3.24Å; P21-K25 VanDerWaalsContact O-N 3.15Å; P21-P79 HydrophobicContact CG-CG 4.3Å
22	Q	96.5	Very high	96.9	Very high	170 Å²	170	83.2 Å²	83.2	79%	0.794	42%	0.419	S	S	*	.	H	α-helix	trans	-55.7	-37.8	-178.5	-74.5	-170.4	-21.3	0	0	114.1	L24 K25 L26	Q22-L24 VanDerWaalsContact C-N 3.29Å; Q22-L24 PolarHBondContact O-N 3.08Å; Q22-K25 PolarHBondContact O-N 2.95Å; Q22-L26 PolarHBondContact O-N 3.09Å
23	R	95.5	Very high	97.1	Very high	182 Å²	182	83.3 Å²	83.3	69%	0.687	42%	0.416	S	S	*	.	H	α-helix	trans	-60.9	-39.5	178	-63.4	-179.7	-176.3	174	-0.7	112	P21 L26 L27	P21-R23 VanDerWaalsContact C-N 3.28Å; P21-R23 PolarHBondContact O-N 3.08Å; R23-L26 PolarHBondContact O-N 3.17Å; R23-L27 PolarHBondContact O-N 2.99Å
24	L	97.2	Very high	97.2	Very high	4 Å²	4	78.9 Å²	78.9	2%	0.021	39%	0.393	C	S	.	.	H	α-helix	trans	-70.1	-41.6	177.5	-60.6	-173.5	0	0	0	110.9	T20 P21 Q22 L26 L27 D28 I77 N78	T20-L24 HydrophobicContact CG2-CB 3.62Å; T20-L24 HydrophobicContact CG2-CD1 4.31Å; P21-L24 HydrophobicContact CB-CG 4.36Å; P21-L24 HydrophobicContact CG-CD1 4.07Å; P21-L24 HydrophobicContact CG-CG 4.41Å; P21-L24 WeakPolarHBondContact O-CB 3.09Å; P21-L24 PolarHBondContact O-N 3.07Å; Q22-L24 VanDerWaalsContact C-N 3.29Å; Q22-L24 PolarHBondContact O-N 3.08Å; L24-L26 VanDerWaalsContact C-N 3.26Å; L24-L26 PolarHBondContact O-N 3.08Å; L24-L27 WeakPolarHBondContact O-CB 3.38Å; L24-L27 PolarHBondContact O-N 2.94Å; L24-L27 VanDerWaalsContact O-N 3.12Å; L24-D28 PolarHBondContact O-N 3.49Å; L24-I77 HydrophobicContact CD2-CD1 3.9Å; L24-I77 HydrophobicContact CD2-CG1 3.62Å; L24-N78 HydrophobicContact CD1-CB 4.41Å
25	K	98.1	Very high	97.2	Very high	54 Å²	54	77 Å²	77	24%	0.235	39%	0.386	C	S	.	.	H	α-helix	trans	-58.8	-37.3	174.6	-64.7	178.7	175.4	158.8	0	112.6	Y16 L17 T20 P21 Q22 D28 A29	Y16-K25 HydrophobicContact CE1-CG 4.25Å; L17-K25 PolarHBondContact O-NZ 3.14Å; T20-K25 HydrophobicContact CG2-CG 3.88Å; T20-K25 WeakPolarHBondContact O-CE 3.09Å; T20-K25 PolarHBondContact O-NZ 3.47Å; P21-K25 PolarHBondContact O-N 3.24Å; P21-K25 VanDerWaalsContact O-N 3.15Å; Q22-K25 PolarHBondContact O-N 2.95Å; K25-D28 PolarHBondContact O-N 3.31Å; K25-A29 WeakPolarHBondContact O-CB 3.41Å; K25-A29 PolarHBondContact O-N 3.2Å
26	L	97.9	Very high	97.3	Very high	124 Å²	124	75.9 Å²	75.9	65%	0.649	38%	0.384	S	S	*	.	H	α-helix	trans	-66.3	-43.3	175.5	-171.9	153.3	0	0	0	111.4	Q22 R23 L24 D28 A29 Y30	Q22-L26 PolarHBondContact O-N 3.09Å; R23-L26 PolarHBondContact O-N 3.17Å; L24-L26 VanDerWaalsContact C-N 3.26Å; L24-L26 PolarHBondContact O-N 3.08Å; L26-D28 VanDerWaalsContact C-N 3.33Å; L26-A29 PolarHBondContact O-N 3.25Å; L26-Y30 PolarHBondContact O-N 3.03Å
27	L	97.9	Very high	97.4	Very high	16 Å²	16	73.4 Å²	73.4	8%	0.084	38%	0.378	C	S	.	.	H	α-helix	trans	-62.6	-40.2	173.2	-71.7	177.8	0	0	0	112.1	R23 L24 A29 Y30 L31 L73 R74 I77	R23-L27 PolarHBondContact O-N 2.99Å; L24-L27 WeakPolarHBondContact O-CB 3.38Å; L24-L27 PolarHBondContact O-N 2.94Å; L24-L27 VanDerWaalsContact O-N 3.12Å; L27-A29 VanDerWaalsContact C-N 3.33Å; L27-A29 PolarHBondContact O-N 3.15Å; L27-Y30 WeakPolarHBondContact O-CB 3.4Å; L27-Y30 PolarHBondContact O-N 3.19Å; L27-L31 WeakPolarHBondContact O-CB 3.45Å; L27-L31 WeakPolarHBondContact O-CG 3.3Å; L27-L31 PolarHBondContact O-N 3.48Å; L27-L73 HydrophobicContact CD1-CD2 3.99Å; L27-L73 HydrophobicContact CD1-CG 3.93Å; L27-L73 HydrophobicContact CD2-CD2 3.63Å; L27-L73 HydrophobicContact CD2-CG 4.42Å; L27-L73 HydrophobicContact CG-CD2 4.47Å; L27-R74 HydrophobicContact CD1-CB 4.29Å; L27-I77 HydrophobicContact CD1-CD1 3.53Å; L27-I77 HydrophobicContact CD1-CG1 4.11Å
28	D	98.3	Very high	97.6	Very high	37 Å²	37	68.8 Å²	68.8	20%	0.198	36%	0.355	C	S	.	.	H	α-helix	trans	-65.3	-38.2	178.5	-62.7	-22.2	0	0	0	110.7	Y16 L24 K25 L26 L31 L32 R74	Y16-D28 PolarHBondContact OH-OD2 2.82Å; L24-D28 PolarHBondContact O-N 3.49Å; K25-D28 PolarHBondContact O-N 3.31Å; L26-D28 VanDerWaalsContact C-N 3.33Å; D28-L31 PolarHBondContact O-N 3.34Å; D28-L32 PolarHBondContact O-N 3.02Å; D28-R74 WeakPolarHBondContact OD1-CD 3.21Å; D28-R74 IonicContact OD1-CZ 3.82Å; D28-R74 IonicContact OD1-NE 2.82Å; D28-R74 PolarHBondContact OD1-NE 2.88Å; D28-R74 IonicContact OD1-NH2 3.99Å; D28-R74 IonicContact OD2-CZ 3.81Å; D28-R74 IonicContact OD2-NE 3.34Å; D28-R74 PolarHBondContact OD2-NE 2.86Å; D28-R74 IonicContact OD2-NH2 3.31Å; D28-R74 PolarHBondContact OD2-NH2 3.38Å
29	A	98.5	Very high	97.7	Very high	60 Å²	60	67.4 Å²	67.4	50%	0.496	35%	0.349	S	S	.	.	H	α-helix	trans	-65.7	-40.3	171.8	0	0	0	0	0	112.7	K25 L26 L27 L32 Y33	K25-A29 WeakPolarHBondContact O-CB 3.41Å; K25-A29 PolarHBondContact O-N 3.2Å; L26-A29 PolarHBondContact O-N 3.25Å; L27-A29 VanDerWaalsContact C-N 3.33Å; L27-A29 PolarHBondContact O-N 3.15Å; A29-L32 PolarHBondContact O-N 3.34Å; A29-Y33 WeakPolarHBondContact O-CB 3.45Å; A29-Y33 PolarHBondContact O-N 3.39Å
30	Y	98.5	Very high	97.8	Very high	71 Å²	71	71 Å²	71	28%	0.278	36%	0.363	S	S	.	.	H	α-helix	trans	-63.1	-43.7	174.2	174.5	-119.5	0	0	0	112	L26 L27 L32 Y33 I34 A70 F97	L26-Y30 PolarHBondContact O-N 3.03Å; L27-Y30 WeakPolarHBondContact O-CB 3.4Å; L27-Y30 PolarHBondContact O-N 3.19Å; Y30-L32 PolarHBondContact O-N 3.41Å; Y30-Y33 HydrophobicContact CD2-CD1 4.4Å; Y30-Y33 WeakPolarHBondContact O-CB 3.34Å; Y30-Y33 PolarHBondContact O-N 3.38Å; Y30-I34 HydrophobicContact CD1-CD1 3.76Å; Y30-I34 HydrophobicContact CD2-CD1 3.93Å; Y30-I34 HydrophobicContact CD2-CG1 4.16Å; Y30-I34 HydrophobicContact CE1-CD1 3.3Å; Y30-I34 HydrophobicContact CE1-CG1 4.46Å; Y30-I34 HydrophobicContact CE2-CD1 3.48Å; Y30-I34 VanDerWaalsContact CE2-CD1 3.48Å; Y30-I34 HydrophobicContact CE2-CG1 3.8Å; Y30-I34 HydrophobicContact CG-CD1 4.06Å; Y30-I34 WeakPolarHBondContact O-CG1 3.46Å; Y30-I34 PolarHBondContact O-N 2.9Å; Y30-I34 WeakPolarHBondContact OH-CD1 3.36Å; Y30-A70 HydrophobicContact CD1-CB 3.79Å; Y30-A70 HydrophobicContact CE1-CB 3.73Å; Y30-F97 HydrophobicContact CE1-CE2 4.41Å; Y30-F97 AromaticContact CE1-CZ 3.89Å; Y30-F97 HydrophobicContact CE1-CZ 3.89Å
31	L	98.8	Very high	97.9	Very high	17 Å²	17	72.8 Å²	72.8	9%	0.089	37%	0.37	C	S	.	.	H	α-helix	trans	-58.8	-46.1	174.4	-76.7	168.9	0	0	0	111.7	L27 D28 I34 L35 F67 A70 V71	L27-L31 WeakPolarHBondContact O-CB 3.45Å; L27-L31 WeakPolarHBondContact O-CG 3.3Å; L27-L31 PolarHBondContact O-N 3.48Å; D28-L31 PolarHBondContact O-N 3.34Å; L31-I34 PolarHBondContact O-N 3.36Å; L31-L35 VanDerWaalsContact O-CB 3.32Å; L31-L35 WeakPolarHBondContact O-CB 3.34Å; L31-L35 PolarHBondContact O-N 3.18Å; L31-F67 HydrophobicContact CB-CD2 4.38Å; L31-F67 HydrophobicContact CB-CE2 4Å; L31-F67 HydrophobicContact CD2-CD1 4.35Å; L31-F67 HydrophobicContact CD2-CD2 3.59Å; L31-F67 HydrophobicContact CD2-CE1 4.42Å; L31-F67 HydrophobicContact CD2-CE2 3.68Å; L31-F67 HydrophobicContact CD2-CG 3.95Å; L31-F67 HydrophobicContact CD2-CZ 4.1Å; L31-F67 WeakPolarHBondContact CD2-O 3.47Å; L31-F67 HydrophobicContact CG-CE2 4.44Å; L31-A70 HydrophobicContact CD2-CB 3.5Å; L31-A70 VanDerWaalsContact CD2-CB 3.5Å; L31-A70 HydrophobicContact CG-CB 4.03Å; L31-V71 HydrophobicContact CD1-CG2 4.24Å; L31-V71 HydrophobicContact CD2-CG2 3.7Å
32	L	98.6	Very high	97.9	Very high	99 Å²	99	74.9 Å²	74.9	52%	0.518	37%	0.373	S	S	.	.	H	α-helix	trans	-61.5	-45.2	176.5	180	62.9	0	0	0	111.5	D28 A29 Y30 I34 L35 L36	D28-L32 PolarHBondContact O-N 3.02Å; A29-L32 PolarHBondContact O-N 3.34Å; Y30-L32 PolarHBondContact O-N 3.41Å; L32-I34 PolarHBondContact O-N 3.29Å; L32-L35 PolarHBondContact O-N 3.47Å; L32-L36 HydrophobicContact CD1-CD1 4.2Å; L32-L36 HydrophobicContact CD1-CG 4.19Å; L32-L36 HydrophobicContact CG-CD1 4.1Å; L32-L36 HydrophobicContact CG-CG 4.48Å; L32-L36 WeakPolarHBondContact O-CB 3.49Å; L32-L36 VanDerWaalsContact O-CG 3.28Å; L32-L36 WeakPolarHBondContact O-CG 3.45Å; L32-L36 PolarHBondContact O-N 3.16Å
33	Y	98.5	Very high	97.9	Very high	150 Å²	150	68 Å²	68	59%	0.588	35%	0.348	S	S	*	.	H	α-helix	trans	-58.2	-48	177.1	163.8	-102.4	0	0	0	112.2	A29 Y30 L36 T37	A29-Y33 WeakPolarHBondContact O-CB 3.45Å; A29-Y33 PolarHBondContact O-N 3.39Å; Y30-Y33 HydrophobicContact CD2-CD1 4.4Å; Y30-Y33 WeakPolarHBondContact O-CB 3.34Å; Y30-Y33 PolarHBondContact O-N 3.38Å; Y33-L36 PolarHBondContact O-N 3.03Å; Y33-T37 WeakPolarHBondContact O-CB 3.19Å; Y33-T37 PolarHBondContact O-N 3.21Å; Y33-T37 PolarHBondContact O-OG1 3.2Å
34	I	98.6	Very high	97.9	Very high	8 Å²	8	66 Å²	66	4%	0.041	34%	0.341	C	S	.	.	H	α-helix	trans	-63.8	-43.8	178.7	-66.3	163.5	0	0	0	111.1	Y30 L31 L32 L36 T37 G38 C63 F67	Y30-I34 HydrophobicContact CD1-CD1 3.76Å; Y30-I34 HydrophobicContact CD2-CD1 3.93Å; Y30-I34 HydrophobicContact CD2-CG1 4.16Å; Y30-I34 HydrophobicContact CE1-CD1 3.3Å; Y30-I34 HydrophobicContact CE1-CG1 4.46Å; Y30-I34 HydrophobicContact CE2-CD1 3.48Å; Y30-I34 VanDerWaalsContact CE2-CD1 3.48Å; Y30-I34 HydrophobicContact CE2-CG1 3.8Å; Y30-I34 HydrophobicContact CG-CD1 4.06Å; Y30-I34 WeakPolarHBondContact O-CG1 3.46Å; Y30-I34 PolarHBondContact O-N 2.9Å; Y30-I34 WeakPolarHBondContact OH-CD1 3.36Å; L31-I34 PolarHBondContact O-N 3.36Å; L32-I34 PolarHBondContact O-N 3.29Å; I34-L36 VanDerWaalsContact C-N 3.35Å; I34-L36 PolarHBondContact O-N 3.41Å; I34-T37 PolarHBondContact O-N 2.95Å; I34-G38 PolarHBondContact O-N 2.96Å; I34-C63 HydrophobicContact CG2-CB 3.83Å; I34-C63 WeakPolarHBondContact CG2-O 3.06Å; I34-F67 HydrophobicContact CG2-CB 4.03Å
35	L	98.6	Very high	97.8	Very high	97 Å²	97	66.5 Å²	66.5	51%	0.508	35%	0.345	S	S	.	.	H	α-helix	trans	-58.3	-48.7	178.8	179.1	68.7	0	0	0	111	L31 L32 T37 G38 A39 F67	L31-L35 VanDerWaalsContact O-CB 3.32Å; L31-L35 WeakPolarHBondContact O-CB 3.34Å; L31-L35 PolarHBondContact O-N 3.18Å; L32-L35 PolarHBondContact O-N 3.47Å; L35-T37 VanDerWaalsContact C-N 3.33Å; L35-T37 PolarHBondContact O-N 2.83Å; L35-G38 PolarHBondContact O-N 3.44Å; L35-A39 WeakPolarHBondContact O-CB 3.46Å; L35-A39 PolarHBondContact O-N 2.96Å; L35-F67 HydrophobicContact CB-CD2 4.34Å; L35-F67 HydrophobicContact CB-CE2 4.09Å
36	L	98.6	Very high	97.7	Very high	96 Å²	96	69.7 Å²	69.7	50%	0.503	36%	0.364	S	S	.	.	H	α-helix	trans	-62.8	-41.4	177.2	-68.7	176	0	0	0	111.3	L32 Y33 I34 A39 L40	L32-L36 HydrophobicContact CD1-CD1 4.2Å; L32-L36 HydrophobicContact CD1-CG 4.19Å; L32-L36 HydrophobicContact CG-CD1 4.1Å; L32-L36 HydrophobicContact CG-CG 4.48Å; L32-L36 WeakPolarHBondContact O-CB 3.49Å; L32-L36 VanDerWaalsContact O-CG 3.28Å; L32-L36 WeakPolarHBondContact O-CG 3.45Å; L32-L36 PolarHBondContact O-N 3.16Å; Y33-L36 PolarHBondContact O-N 3.03Å; I34-L36 VanDerWaalsContact C-N 3.35Å; I34-L36 PolarHBondContact O-N 3.41Å; L36-A39 PolarHBondContact O-N 3.01Å; L36-L40 WeakPolarHBondContact O-CB 3.48Å; L36-L40 VanDerWaalsContact O-CG 3.23Å; L36-L40 WeakPolarHBondContact O-CG 3.33Å; L36-L40 PolarHBondContact O-N 3.48Å
37	T	98.4	Very high	97.7	Very high	31 Å²	31	71 Å²	71	19%	0.19	37%	0.371	C	S	.	.	H	α-helix	trans	-61.6	-47.7	177.7	-57.3	0	0	0	0	111.6	Y33 I34 L35 A39 L40 Q41	Y33-T37 WeakPolarHBondContact O-CB 3.19Å; Y33-T37 PolarHBondContact O-N 3.21Å; Y33-T37 PolarHBondContact O-OG1 3.2Å; I34-T37 PolarHBondContact O-N 2.95Å; L35-T37 VanDerWaalsContact C-N 3.33Å; L35-T37 PolarHBondContact O-N 2.83Å; T37-A39 PolarHBondContact O-N 3.48Å; T37-L40 PolarHBondContact O-N 3.35Å; T37-Q41 WeakPolarHBondContact O-CG 3.47Å; T37-Q41 PolarHBondContact O-N 2.95Å
38	G	98.4	Very high	97.5	Very high	7 Å²	7	74.8 Å²	74.8	7%	0.072	40%	0.395	C	S	.	.	H	α-helix	trans	-63.6	-40.6	176.7	0	0	0	0	0	112.6	I34 L35 Q41 F42	I34-G38 PolarHBondContact O-N 2.96Å; L35-G38 PolarHBondContact O-N 3.44Å; G38-Q41 PolarHBondContact O-N 3.45Å; G38-F42 WeakPolarHBondContact O-CB 3.49Å; G38-F42 PolarHBondContact O-N 2.83Å
39	A	98.4	Very high	97.2	Very high	60 Å²	60	74.7 Å²	74.7	50%	0.496	40%	0.402	S	S	.	.	H	α-helix	trans	-63.8	-41	175.5	0	0	0	0	0	112.3	L35 L36 T37 F42 G43	L35-A39 WeakPolarHBondContact O-CB 3.46Å; L35-A39 PolarHBondContact O-N 2.96Å; L36-A39 PolarHBondContact O-N 3.01Å; T37-A39 PolarHBondContact O-N 3.48Å; A39-F42 PolarHBondContact O-N 3.12Å; A39-G43 PolarHBondContact O-N 3.22Å
40	L	97.8	Very high	96.9	Very high	131 Å²	131	76.1 Å²	76.1	69%	0.686	41%	0.405	S	S	*	.	H	α-helix	trans	-65.7	-43.9	176.3	-74.3	172	0	0	0	111.8	L36 T37 F42 G43 Y44	L36-L40 WeakPolarHBondContact O-CB 3.48Å; L36-L40 VanDerWaalsContact O-CG 3.23Å; L36-L40 WeakPolarHBondContact O-CG 3.33Å; L36-L40 PolarHBondContact O-N 3.48Å; T37-L40 PolarHBondContact O-N 3.35Å; L40-F42 VanDerWaalsContact C-N 3.33Å; L40-F42 PolarHBondContact O-N 3.2Å; L40-G43 PolarHBondContact O-N 2.9Å; L40-Y44 WeakPolarHBondContact O-CB 3.45Å; L40-Y44 PolarHBondContact O-N 3.41Å
41	Q	96.4	Very high	96.5	Very high	55 Å²	55	81.8 Å²	81.8	26%	0.257	43%	0.431	S	S	.	.	H	α-helix	trans	-59.7	-44.9	174.6	-72.4	171.7	-1.6	0	0	111.3	T37 G38 Y44 C45 F56 G59 F60	T37-Q41 WeakPolarHBondContact O-CG 3.47Å; T37-Q41 PolarHBondContact O-N 2.95Å; G38-Q41 PolarHBondContact O-N 3.45Å; Q41-Y44 PolarHBondContact O-N 3.4Å; Q41-C45 PolarHBondContact O-N 2.93Å; Q41-F56 HydrophobicContact CB-CD2 4.33Å; Q41-F56 HydrophobicContact CB-CE2 4.15Å; Q41-F56 WeakPolarHBondContact O-CE2 3.32Å; Q41-G59 PolarHBondContact OE1-O 2.84Å; Q41-F60 VanDerWaalsContact OE1-N 3.12Å
42	F	96.4	Very high	96.2	Very high	103 Å²	103	84.1 Å²	84.1	45%	0.452	45%	0.447	S	S	.	.	H	α-helix	trans	-63.5	-46.5	178	-173.8	-107.8	0	0	0	111.6	G38 A39 L40 Y44 C45 L46 F56 F60	G38-F42 WeakPolarHBondContact O-CB 3.49Å; G38-F42 PolarHBondContact O-N 2.83Å; A39-F42 PolarHBondContact O-N 3.12Å; L40-F42 VanDerWaalsContact C-N 3.33Å; L40-F42 PolarHBondContact O-N 3.2Å; F42-Y44 VanDerWaalsContact C-N 3.33Å; F42-Y44 PolarHBondContact O-N 3.31Å; F42-C45 WeakPolarHBondContact O-CB 3.27Å; F42-C45 PolarHBondContact O-N 3.45Å; F42-L46 HydrophobicContact CD1-CD1 3.92Å; F42-L46 HydrophobicContact CD1-CG 4.45Å; F42-L46 HydrophobicContact CE1-CD1 3.5Å; F42-L46 HydrophobicContact CE1-CG 4.18Å; F42-L46 HydrophobicContact CZ-CD1 4.01Å; F42-L46 HydrophobicContact CZ-CD2 4.32Å; F42-L46 HydrophobicContact CZ-CG 4.31Å; F42-L46 WeakPolarHBondContact O-CG 3.43Å; F42-L46 PolarHBondContact O-N 3.35Å; F42-F56 HydrophobicContact CD2-CZ 4.14Å; F42-F60 HydrophobicContact CB-CD2 4.32Å; F42-F60 HydrophobicContact CB-CE2 3.91Å; F42-F60 HydrophobicContact CD2-CE2 4.3Å; F42-F60 HydrophobicContact CD2-CZ 4.48Å; F42-F60 HydrophobicContact CG-CE2 4.4Å
43	G	97.4	Very high	95.9	Very high	25 Å²	25	84.2 Å²	84.2	26%	0.258	44%	0.444	S	S	.	.	H	α-helix	trans	-59.1	-42	174.8	0	0	0	0	0	112.7	A39 L40 L46 L47	A39-G43 PolarHBondContact O-N 3.22Å; L40-G43 PolarHBondContact O-N 2.9Å; G43-L46 PolarHBondContact O-N 3.26Å; G43-L47 WeakPolarHBondContact O-CB 3.49Å; G43-L47 VanDerWaalsContact O-CG 3.24Å; G43-L47 WeakPolarHBondContact O-CG 3.42Å; G43-L47 PolarHBondContact O-N 3.43Å
44	Y	95.2	Very high	95.7	Very high	140 Å²	140	80.6 Å²	80.6	55%	0.549	44%	0.435	S	S	.	.	H	α-helix	trans	-60.5	-46.4	174.7	-180	-89.4	0	0	0	111.9	L40 Q41 F42 L46 L47 V48	L40-Y44 WeakPolarHBondContact O-CB 3.45Å; L40-Y44 PolarHBondContact O-N 3.41Å; Q41-Y44 PolarHBondContact O-N 3.4Å; F42-Y44 VanDerWaalsContact C-N 3.33Å; F42-Y44 PolarHBondContact O-N 3.31Å; Y44-L46 VanDerWaalsContact C-N 3.29Å; Y44-L46 PolarHBondContact O-N 2.96Å; Y44-L47 PolarHBondContact O-N 3.34Å; Y44-V48 HydrophobicContact CD1-CB 4.38Å; Y44-V48 HydrophobicContact CD2-CB 4.25Å; Y44-V48 HydrophobicContact CD2-CG2 3.69Å; Y44-V48 HydrophobicContact CE1-CB 4.07Å; Y44-V48 HydrophobicContact CE1-CG1 4.21Å; Y44-V48 HydrophobicContact CE2-CB 3.95Å; Y44-V48 HydrophobicContact CE2-CG1 4.1Å; Y44-V48 HydrophobicContact CE2-CG2 3.54Å; Y44-V48 HydrophobicContact CG-CB 4.47Å; Y44-V48 HydrophobicContact CG-CG2 4.27Å; Y44-V48 WeakPolarHBondContact O-CB 3.44Å; Y44-V48 PolarHBondContact O-N 2.97Å
45	C	94.9	Very high	95.6	Very high	16 Å²	16	82.2 Å²	82.2	11%	0.108	45%	0.447	C	S	.	.	H	α-helix	trans	-59.5	-39.9	177.8	-172.8	0	0	0	0	112.1	Q41 F42 G49 F56	Q41-C45 PolarHBondContact O-N 2.93Å; F42-C45 WeakPolarHBondContact O-CB 3.27Å; F42-C45 PolarHBondContact O-N 3.45Å; C45-G49 CarbonylContact O-C 3.4Å; C45-G49 WeakPolarHBondContact O-CA 3.37Å; C45-G49 PolarHBondContact O-N 3.46Å; C45-F56 HydrophobicContact CB-CD1 4.4Å; C45-F56 HydrophobicContact CB-CD2 3.74Å; C45-F56 HydrophobicContact CB-CE1 4.31Å; C45-F56 HydrophobicContact CB-CE2 3.65Å; C45-F56 HydrophobicContact CB-CG 4.13Å; C45-F56 HydrophobicContact CB-CZ 3.95Å
46	L	95.8	Very high	95.4	Very high	120 Å²	120	79.4 Å²	79.4	63%	0.628	43%	0.431	S	S	*	.	H	α-helix	trans	-69.6	-35.9	176.5	-67.3	-179.5	0	0	0	113.6	F42 G43 Y44	F42-L46 HydrophobicContact CD1-CD1 3.92Å; F42-L46 HydrophobicContact CD1-CG 4.45Å; F42-L46 HydrophobicContact CE1-CD1 3.5Å; F42-L46 HydrophobicContact CE1-CG 4.18Å; F42-L46 HydrophobicContact CZ-CD1 4.01Å; F42-L46 HydrophobicContact CZ-CD2 4.32Å; F42-L46 HydrophobicContact CZ-CG 4.31Å; F42-L46 WeakPolarHBondContact O-CG 3.43Å; F42-L46 PolarHBondContact O-N 3.35Å; G43-L46 PolarHBondContact O-N 3.26Å; Y44-L46 VanDerWaalsContact C-N 3.29Å; Y44-L46 PolarHBondContact O-N 2.96Å
47	L	96.9	Very high	95.3	Very high	153 Å²	153	77.2 Å²	77.2	80%	0.801	42%	0.419	S	S	*	.	H	α-helix	trans	-91.8	-38.1	-172.2	-67.6	174.6	0	0	0	113.8	G43 Y44	G43-L47 WeakPolarHBondContact O-CB 3.49Å; G43-L47 VanDerWaalsContact O-CG 3.24Å; G43-L47 WeakPolarHBondContact O-CG 3.42Å; G43-L47 PolarHBondContact O-N 3.43Å; Y44-L47 PolarHBondContact O-N 3.34Å
48	V	95	Very high	95.2	Very high	95 Å²	95	76.1 Å²	76.1	58%	0.576	41%	0.413	S	S	*	.	H	α-helix	trans	-100.2	-28.6	-174	-177.9	0	0	0	0	111.5	Y44	Y44-V48 HydrophobicContact CD1-CB 4.38Å; Y44-V48 HydrophobicContact CD2-CB 4.25Å; Y44-V48 HydrophobicContact CD2-CG2 3.69Å; Y44-V48 HydrophobicContact CE1-CB 4.07Å; Y44-V48 HydrophobicContact CE1-CG1 4.21Å; Y44-V48 HydrophobicContact CE2-CB 3.95Å; Y44-V48 HydrophobicContact CE2-CG1 4.1Å; Y44-V48 HydrophobicContact CE2-CG2 3.54Å; Y44-V48 HydrophobicContact CG-CB 4.47Å; Y44-V48 HydrophobicContact CG-CG2 4.27Å; Y44-V48 WeakPolarHBondContact O-CB 3.44Å; Y44-V48 PolarHBondContact O-N 2.97Å
49	G	91.1	Very high	95.2	Very high	34 Å²	34	76.6 Å²	76.6	35%	0.351	42%	0.418	S	S	.	.			trans	117.3	-178.6	178.7	0	0	0	0	0	112.9	C45	C45-G49 CarbonylContact O-C 3.4Å; C45-G49 WeakPolarHBondContact O-CA 3.37Å; C45-G49 PolarHBondContact O-N 3.46Å
50	T	91.9	Very high	95.1	Very high	91 Å²	91	76.7 Å²	76.7	56%	0.558	41%	0.407	S	S	*	.	S	Bend	trans	-97.3	9.8	-164.5	59.4	0	0	0	0	114	P52 F53	T50-P52 CarbonylContact O-C 3.57Å; T50-F53 HydrophobicContact CG2-CD2 4.41Å; T50-F53 WeakPolarHBondContact O-CA 3.29Å; T50-F53 WeakPolarHBondContact O-CB 3.24Å; T50-F53 PolarHBondContact O-N 3.49Å
51	F	91.4	Very high	95.1	Very high	189 Å²	189	73.8 Å²	73.8	83%	0.829	39%	0.392	S	S	*	.	S	Bend	trans	-108.4	125.6	-176.6	-176.3	-95.3	0	0	0	111.6
52	P	91.7	Very high	95.2	Very high	66 Å²	66	72.1 Å²	72.1	43%	0.429	39%	0.386	S	S	.	.	S	Bend	cis	-82.3	123.9	-5.1	31.6	-33.3	0	0	0	113.4	T50 N54 S55 F56	T50-P52 CarbonylContact O-C 3.57Å; P52-N54 PolarHBondContact O-N 3Å; P52-S55 WeakPolarHBondContact CG-OG 3.39Å; P52-S55 PolarHBondContact O-N 3.47Å; P52-F56 PolarHBondContact O-N 2.98Å
53	F	92.9	Very high	95.3	Very high	101 Å²	101	67.9 Å²	67.9	44%	0.443	37%	0.369	S	S	.	.	H	α-helix	trans	-69.4	-37.1	-170.2	-170.9	-117.2	0	0	0	113.1	T50 F56 L57	T50-F53 HydrophobicContact CG2-CD2 4.41Å; T50-F53 WeakPolarHBondContact O-CA 3.29Å; T50-F53 WeakPolarHBondContact O-CB 3.24Å; T50-F53 PolarHBondContact O-N 3.49Å; F53-F56 HydrophobicContact CD2-CD1 4.06Å; F53-F56 AromaticContact CE2-CD1 3.85Å; F53-F56 HydrophobicContact CE2-CD1 3.85Å; F53-F56 HydrophobicContact CE2-CE1 4.18Å; F53-F56 WeakPolarHBondContact O-CB 3.31Å; F53-F56 PolarHBondContact O-N 3.34Å; F53-L57 WeakPolarHBondContact O-CB 3.28Å; F53-L57 PolarHBondContact O-N 2.87Å
54	N	95	Very high	95.3	Very high	75 Å²	75	70 Å²	70	40%	0.401	38%	0.377	S	S	.	.	H	α-helix	trans	-63.6	-45	-179.8	-69.7	-13.4	0	0	0	111	P52 F56 L57 S58 F111 G113	P52-N54 PolarHBondContact O-N 3Å; N54-F56 VanDerWaalsContact C-N 3.28Å; N54-F56 PolarHBondContact O-N 3.04Å; N54-L57 CarbonylContact O-C 3.41Å; N54-L57 WeakPolarHBondContact O-CA 3.43Å; N54-L57 WeakPolarHBondContact O-CB 3.49Å; N54-L57 PolarHBondContact O-N 3.36Å; N54-S58 WeakPolarHBondContact O-CB 3.23Å; N54-S58 PolarHBondContact O-N 3.43Å; N54-F111 CarbonylContact C-O 2.89Å; N54-F111 WeakPolarHBondContact CB-O 3.26Å; N54-G113 VanDerWaalsContact CB-OXT 3.22Å; N54-G113 WeakPolarHBondContact CB-OXT 3.34Å; N54-G113 PolarHBondContact ND2-OXT 3.16Å
55	S	95.3	Very high	95.5	Very high	42 Å²	42	64 Å²	64	29%	0.294	36%	0.358	S	S	.	.	H	α-helix	trans	-62.3	-38	177.9	-38.2	0	0	0	0	111.6	P52 G59 F111 V112	P52-S55 WeakPolarHBondContact CG-OG 3.39Å; P52-S55 PolarHBondContact O-N 3.47Å; S55-G59 PolarHBondContact O-N 3.18Å; S55-F111 PolarHBondContact N-O 2.94Å; S55-V112 PolarHBondContact OG-O 3.06Å
56	F	95.3	Very high	95.7	Very high	38 Å²	38	63.5 Å²	63.5	17%	0.167	36%	0.355	C	S	.	.	H	α-helix	trans	-60.9	-49.7	170.3	164.1	-101.3	0	0	0	111.4	Q41 F42 C45 P52 F53 N54 S58 G59 F60	Q41-F56 HydrophobicContact CB-CD2 4.33Å; Q41-F56 HydrophobicContact CB-CE2 4.15Å; Q41-F56 WeakPolarHBondContact O-CE2 3.32Å; F42-F56 HydrophobicContact CD2-CZ 4.14Å; C45-F56 HydrophobicContact CB-CD1 4.4Å; C45-F56 HydrophobicContact CB-CD2 3.74Å; C45-F56 HydrophobicContact CB-CE1 4.31Å; C45-F56 HydrophobicContact CB-CE2 3.65Å; C45-F56 HydrophobicContact CB-CG 4.13Å; C45-F56 HydrophobicContact CB-CZ 3.95Å; P52-F56 PolarHBondContact O-N 2.98Å; F53-F56 HydrophobicContact CD2-CD1 4.06Å; F53-F56 AromaticContact CE2-CD1 3.85Å; F53-F56 HydrophobicContact CE2-CD1 3.85Å; F53-F56 HydrophobicContact CE2-CE1 4.18Å; F53-F56 WeakPolarHBondContact O-CB 3.31Å; F53-F56 PolarHBondContact O-N 3.34Å; N54-F56 VanDerWaalsContact C-N 3.28Å; N54-F56 PolarHBondContact O-N 3.04Å; F56-S58 VanDerWaalsContact C-N 3.3Å; F56-S58 PolarHBondContact O-N 3.49Å; F56-G59 PolarHBondContact O-N 2.92Å; F56-F60 HydrophobicContact CE1-CB 4.48Å; F56-F60 HydrophobicContact CE2-CB 4.01Å; F56-F60 HydrophobicContact CE2-CD2 4.24Å; F56-F60 HydrophobicContact CE2-CG 4.28Å; F56-F60 HydrophobicContact CZ-CB 3.98Å; F56-F60 HydrophobicContact CZ-CD2 4.18Å; F56-F60 AromaticContact CZ-CG 3.99Å; F56-F60 HydrophobicContact CZ-CG 3.99Å; F56-F60 VanDerWaalsContact O-CB 3.28Å; F56-F60 WeakPolarHBondContact O-CB 3.5Å; F56-F60 PolarHBondContact O-N 3.21Å
57	L	95.3	Very high	95.8	Very high	49 Å²	49	61 Å²	61	26%	0.257	34%	0.339	S	S	.	.	H	α-helix	trans	-59	-42.6	179.3	-170.9	70.6	0	0	0	111.4	F53 N54 F60 I61 F111	F53-L57 WeakPolarHBondContact O-CB 3.28Å; F53-L57 PolarHBondContact O-N 2.87Å; N54-L57 CarbonylContact O-C 3.41Å; N54-L57 WeakPolarHBondContact O-CA 3.43Å; N54-L57 WeakPolarHBondContact O-CB 3.49Å; N54-L57 PolarHBondContact O-N 3.36Å; L57-F60 PolarHBondContact O-N 2.94Å; L57-I61 HydrophobicContact CD1-CD1 3.78Å; L57-I61 HydrophobicContact CD1-CG1 4.15Å; L57-I61 HydrophobicContact CD2-CD1 4.24Å; L57-I61 HydrophobicContact CG-CD1 3.62Å; L57-I61 HydrophobicContact CG-CG1 4.26Å; L57-I61 VanDerWaalsContact O-CB 3.27Å; L57-I61 WeakPolarHBondContact O-CB 3.34Å; L57-I61 WeakPolarHBondContact O-CG1 3.26Å; L57-I61 PolarHBondContact O-N 3.43Å; L57-F111 HydrophobicContact CD2-CD1 4.13Å; L57-F111 HydrophobicContact CD2-CE1 4.37Å
58	S	97.8	Very high	95.9	Very high	8 Å²	8	58.2 Å²	58.2	6%	0.056	32%	0.324	C	S	.	.	H	α-helix	trans	-56.9	-54.5	174.8	-179.7	0	0	0	0	111.6	N54 F56 F60 S62 V108 V112	N54-S58 WeakPolarHBondContact O-CB 3.23Å; N54-S58 PolarHBondContact O-N 3.43Å; F56-S58 VanDerWaalsContact C-N 3.3Å; F56-S58 PolarHBondContact O-N 3.49Å; S58-F60 PolarHBondContact O-N 2.93Å; S58-S62 VanDerWaalsContact O-CB 3.27Å; S58-S62 WeakPolarHBondContact O-CB 3.39Å; S58-S62 PolarHBondContact O-N 2.96Å; S58-V108 WeakPolarHBondContact CB-O 3.22Å; S58-V108 PolarHBondContact OG-O 2.65Å; S58-V112 WeakPolarHBondContact OG-CG2 3.35Å
59	G	97	Very high	96	Very high	18 Å²	18	55.6 Å²	55.6	19%	0.186	31%	0.306	C	S	.	.	H	α-helix	trans	-62	-43.8	179.3	0	0	0	0	0	112.6	Q41 S55 F56 S62 C63	Q41-G59 PolarHBondContact OE1-O 2.84Å; S55-G59 PolarHBondContact O-N 3.18Å; F56-G59 PolarHBondContact O-N 2.92Å; G59-S62 WeakPolarHBondContact O-CB 3.47Å; G59-S62 PolarHBondContact O-N 3.46Å; G59-C63 PolarHBondContact O-N 2.95Å; G59-C63 PolarHBondContact O-SG 3.28Å
60	F	97.1	Very high	96.4	Very high	62 Å²	62	54 Å²	54	27%	0.272	29%	0.29	S	S	.	.	H	α-helix	trans	-70.6	-45.5	-175.9	-172.5	-100.7	0	0	0	111.9	Q41 F42 F56 L57 S58 S62 C63 V64	Q41-F60 VanDerWaalsContact OE1-N 3.12Å; F42-F60 HydrophobicContact CB-CD2 4.32Å; F42-F60 HydrophobicContact CB-CE2 3.91Å; F42-F60 HydrophobicContact CD2-CE2 4.3Å; F42-F60 HydrophobicContact CD2-CZ 4.48Å; F42-F60 HydrophobicContact CG-CE2 4.4Å; F56-F60 HydrophobicContact CE1-CB 4.48Å; F56-F60 HydrophobicContact CE2-CB 4.01Å; F56-F60 HydrophobicContact CE2-CD2 4.24Å; F56-F60 HydrophobicContact CE2-CG 4.28Å; F56-F60 HydrophobicContact CZ-CB 3.98Å; F56-F60 HydrophobicContact CZ-CD2 4.18Å; F56-F60 AromaticContact CZ-CG 3.99Å; F56-F60 HydrophobicContact CZ-CG 3.99Å; F56-F60 VanDerWaalsContact O-CB 3.28Å; F56-F60 WeakPolarHBondContact O-CB 3.5Å; F56-F60 PolarHBondContact O-N 3.21Å; L57-F60 PolarHBondContact O-N 2.94Å; S58-F60 PolarHBondContact O-N 2.93Å; F60-S62 VanDerWaalsContact C-N 3.28Å; F60-S62 PolarHBondContact O-N 3.35Å; F60-C63 WeakPolarHBondContact O-CB 3.36Å; F60-C63 PolarHBondContact O-N 3.49Å; F60-V64 HydrophobicContact CD1-CG2 4.25Å; F60-V64 HydrophobicContact CE1-CG2 3.87Å; F60-V64 HydrophobicContact CZ-CG2 4.12Å; F60-V64 WeakPolarHBondContact O-CG2 3.42Å; F60-V64 PolarHBondContact O-N 3.11Å
61	I	97.2	Very high	96.7	Very high	70 Å²	70	51.9 Å²	51.9	36%	0.359	28%	0.277	S	S	.	.	H	α-helix	trans	-62.3	-38.8	174	-67.4	176	0	0	0	110.3	L57 C63 V64 G65 V108	L57-I61 HydrophobicContact CD1-CD1 3.78Å; L57-I61 HydrophobicContact CD1-CG1 4.15Å; L57-I61 HydrophobicContact CD2-CD1 4.24Å; L57-I61 HydrophobicContact CG-CD1 3.62Å; L57-I61 HydrophobicContact CG-CG1 4.26Å; L57-I61 VanDerWaalsContact O-CB 3.27Å; L57-I61 WeakPolarHBondContact O-CB 3.34Å; L57-I61 WeakPolarHBondContact O-CG1 3.26Å; L57-I61 PolarHBondContact O-N 3.43Å; I61-C63 VanDerWaalsContact C-N 3.31Å; I61-C63 PolarHBondContact O-N 3.41Å; I61-V64 PolarHBondContact O-N 3.44Å; I61-G65 PolarHBondContact O-N 3.45Å; I61-V108 HydrophobicContact CB-CG1 4.21Å; I61-V108 HydrophobicContact CG2-CG1 3.77Å
62	S	98.3	Very high	97	Very high	19 Å²	19	45.5 Å²	45.5	13%	0.133	26%	0.255	C	S	.	.	H	α-helix	trans	-58.7	-43.5	174.6	-172.3	0	0	0	0	111.7	S58 G59 F60 S66 H105	S58-S62 VanDerWaalsContact O-CB 3.27Å; S58-S62 WeakPolarHBondContact O-CB 3.39Å; S58-S62 PolarHBondContact O-N 2.96Å; G59-S62 WeakPolarHBondContact O-CB 3.47Å; G59-S62 PolarHBondContact O-N 3.46Å; F60-S62 VanDerWaalsContact C-N 3.28Å; F60-S62 PolarHBondContact O-N 3.35Å; S62-S66 WeakPolarHBondContact O-CB 3.44Å; S62-S66 PolarHBondContact O-N 2.97Å; S62-S66 PolarHBondContact O-OG 3.48Å; S62-H105 PolarHBondContact OG-NE2 3.27Å
63	C	98.4	Very high	97.3	Very high	15 Å²	15	42.5 Å²	42.5	10%	0.101	24%	0.235	C	C	.	.	H	α-helix	trans	-63.6	-51	176.1	-65.6	0	0	0	0	111.6	I34 G59 F60 I61 G65 S66 F67	I34-C63 HydrophobicContact CG2-CB 3.83Å; I34-C63 WeakPolarHBondContact CG2-O 3.06Å; G59-C63 PolarHBondContact O-N 2.95Å; G59-C63 PolarHBondContact O-SG 3.28Å; F60-C63 WeakPolarHBondContact O-CB 3.36Å; F60-C63 PolarHBondContact O-N 3.49Å; I61-C63 VanDerWaalsContact C-N 3.31Å; I61-C63 PolarHBondContact O-N 3.41Å; C63-G65 PolarHBondContact O-N 3.38Å; C63-S66 PolarHBondContact O-N 2.97Å; C63-F67 VanDerWaalsContact O-CB 3.31Å; C63-F67 WeakPolarHBondContact O-CB 3.42Å; C63-F67 PolarHBondContact O-N 2.79Å
64	V	98.3	Very high	97.6	Very high	68 Å²	68	39.6 Å²	39.6	41%	0.412	22%	0.221	S	C	.	.	H	α-helix	trans	-60.5	-47.3	-179.5	174.3	0	0	0	0	111.3	F60 I61 F67 I68	F60-V64 HydrophobicContact CD1-CG2 4.25Å; F60-V64 HydrophobicContact CE1-CG2 3.87Å; F60-V64 HydrophobicContact CZ-CG2 4.12Å; F60-V64 WeakPolarHBondContact O-CG2 3.42Å; F60-V64 PolarHBondContact O-N 3.11Å; I61-V64 PolarHBondContact O-N 3.44Å; V64-F67 PolarHBondContact O-N 2.87Å; V64-I68 HydrophobicContact CG1-CD1 4.01Å; V64-I68 WeakPolarHBondContact O-CG1 3.17Å; V64-I68 PolarHBondContact O-N 2.83Å
65	G	98.5	Very high	97.7	Very high	16 Å²	16	39.6 Å²	39.6	17%	0.165	22%	0.22	C	C	.	.	H	α-helix	trans	-63.1	-46.4	178.9	0	0	0	0	0	112.3	I61 C63 F67 I68 L69 L104	I61-G65 PolarHBondContact O-N 3.45Å; C63-G65 PolarHBondContact O-N 3.38Å; G65-F67 VanDerWaalsContact C-N 3.3Å; G65-F67 PolarHBondContact O-N 3.06Å; G65-I68 PolarHBondContact O-N 3.34Å; G65-L69 WeakPolarHBondContact O-CG 3.2Å; G65-L69 PolarHBondContact O-N 3.49Å; G65-L104 VanDerWaalsContact C-CD2 3.46Å
66	S	98.7	Very high	97.8	Very high	5 Å²	5	40.2 Å²	40.2	4%	0.035	22%	0.219	C	C	.	.	H	α-helix	trans	-63.8	-37	178.8	-60	0	0	0	0	111.8	S62 C63 L69 A70	S62-S66 WeakPolarHBondContact O-CB 3.44Å; S62-S66 PolarHBondContact O-N 2.97Å; S62-S66 PolarHBondContact O-OG 3.48Å; C63-S66 PolarHBondContact O-N 2.97Å; S66-L69 PolarHBondContact O-N 2.9Å; S66-A70 VanDerWaalsContact O-CB 3.26Å; S66-A70 WeakPolarHBondContact O-CB 3.37Å; S66-A70 PolarHBondContact O-N 2.94Å
67	F	98.7	Very high	97.8	Very high	67 Å²	67	40 Å²	40	29%	0.294	22%	0.219	S	C	.	.	H	α-helix	trans	-61.9	-49.1	174.8	-172.5	-86.8	0	0	0	111.3	L31 I34 L35 C63 V64 G65 L69 A70 V71	L31-F67 HydrophobicContact CB-CD2 4.38Å; L31-F67 HydrophobicContact CB-CE2 4Å; L31-F67 HydrophobicContact CD2-CD1 4.35Å; L31-F67 HydrophobicContact CD2-CD2 3.59Å; L31-F67 HydrophobicContact CD2-CE1 4.42Å; L31-F67 HydrophobicContact CD2-CE2 3.68Å; L31-F67 HydrophobicContact CD2-CG 3.95Å; L31-F67 HydrophobicContact CD2-CZ 4.1Å; L31-F67 WeakPolarHBondContact CD2-O 3.47Å; L31-F67 HydrophobicContact CG-CE2 4.44Å; I34-F67 HydrophobicContact CG2-CB 4.03Å; L35-F67 HydrophobicContact CB-CD2 4.34Å; L35-F67 HydrophobicContact CB-CE2 4.09Å; C63-F67 VanDerWaalsContact O-CB 3.31Å; C63-F67 WeakPolarHBondContact O-CB 3.42Å; C63-F67 PolarHBondContact O-N 2.79Å; V64-F67 PolarHBondContact O-N 2.87Å; G65-F67 VanDerWaalsContact C-N 3.3Å; G65-F67 PolarHBondContact O-N 3.06Å; F67-L69 PolarHBondContact O-N 3.26Å; F67-A70 PolarHBondContact O-N 3.39Å; F67-V71 HydrophobicContact CD1-CG2 3.98Å; F67-V71 HydrophobicContact CE1-CG2 3.67Å; F67-V71 HydrophobicContact CZ-CG2 4.23Å; F67-V71 WeakPolarHBondContact O-CG2 3.33Å; F67-V71 PolarHBondContact O-N 3.27Å
68	I	98.6	Very high	97.8	Very high	94 Å²	94	38.5 Å²	38.5	48%	0.482	21%	0.211	S	C	.	.	H	α-helix	trans	-60.2	-46.8	178.3	-67	166.3	0	0	0	110.7	V64 G65 A70 V71 C72	V64-I68 HydrophobicContact CG1-CD1 4.01Å; V64-I68 WeakPolarHBondContact O-CG1 3.17Å; V64-I68 PolarHBondContact O-N 2.83Å; G65-I68 PolarHBondContact O-N 3.34Å; I68-A70 VanDerWaalsContact C-N 3.32Å; I68-A70 PolarHBondContact O-N 3.46Å; I68-V71 PolarHBondContact O-N 3.13Å; I68-C72 PolarHBondContact O-N 2.92Å; I68-C72 PolarHBondContact O-SG 2.91Å; I68-C72 VanDerWaalsContact O-SG 3.35Å
69	L	98.6	Very high	97.6	Very high	40 Å²	40	42.1 Å²	42.1	21%	0.209	23%	0.234	C	C	.	.	H	α-helix	trans	-60.8	-41.6	178.3	-68.6	178.1	0	0	0	111.9	G65 S66 F67 C72 L73 F97 A100 L104	G65-L69 WeakPolarHBondContact O-CG 3.2Å; G65-L69 PolarHBondContact O-N 3.49Å; S66-L69 PolarHBondContact O-N 2.9Å; F67-L69 PolarHBondContact O-N 3.26Å; L69-C72 WeakPolarHBondContact O-CB 3.49Å; L69-C72 PolarHBondContact O-N 2.96Å; L69-L73 PolarHBondContact O-N 3.4Å; L69-F97 HydrophobicContact CB-CD2 3.84Å; L69-F97 HydrophobicContact CB-CE2 3.89Å; L69-A100 HydrophobicContact CD1-CB 3.94Å; L69-A100 HydrophobicContact CD2-CB 3.71Å; L69-A100 HydrophobicContact CG-CB 4.49Å; L69-L104 HydrophobicContact CD1-CD2 4.13Å
70	A	98.6	Very high	97.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-67.1	-36.5	176.8	0	0	0	0	0	112.6	Y30 L31 S66 F67 I68 L73 R74 F97	Y30-A70 HydrophobicContact CD1-CB 3.79Å; Y30-A70 HydrophobicContact CE1-CB 3.73Å; L31-A70 HydrophobicContact CD2-CB 3.5Å; L31-A70 VanDerWaalsContact CD2-CB 3.5Å; L31-A70 HydrophobicContact CG-CB 4.03Å; S66-A70 VanDerWaalsContact O-CB 3.26Å; S66-A70 WeakPolarHBondContact O-CB 3.37Å; S66-A70 PolarHBondContact O-N 2.94Å; F67-A70 PolarHBondContact O-N 3.39Å; I68-A70 VanDerWaalsContact C-N 3.32Å; I68-A70 PolarHBondContact O-N 3.46Å; A70-L73 PolarHBondContact O-N 2.74Å; A70-R74 WeakPolarHBondContact O-CB 3.39Å; A70-R74 PolarHBondContact O-N 2.91Å; A70-F97 HydrophobicContact CB-CE2 4.17Å
71	V	98.5	Very high	97.3	Very high	47 Å²	47	47.3 Å²	47.3	29%	0.285	26%	0.256	S	S	.	.	H	α-helix	trans	-63.7	-45.3	172.2	169.9	0	0	0	0	110.6	L31 F67 I68 L73 R74 I75	L31-V71 HydrophobicContact CD1-CG2 4.24Å; L31-V71 HydrophobicContact CD2-CG2 3.7Å; F67-V71 HydrophobicContact CD1-CG2 3.98Å; F67-V71 HydrophobicContact CE1-CG2 3.67Å; F67-V71 HydrophobicContact CZ-CG2 4.23Å; F67-V71 WeakPolarHBondContact O-CG2 3.33Å; F67-V71 PolarHBondContact O-N 3.27Å; I68-V71 PolarHBondContact O-N 3.13Å; V71-L73 VanDerWaalsContact C-N 3.34Å; V71-L73 PolarHBondContact O-N 3.35Å; V71-R74 WeakPolarHBondContact O-CB 3.4Å; V71-R74 PolarHBondContact O-N 2.71Å; V71-I75 HydrophobicContact CG1-CD1 3.7Å; V71-I75 HydrophobicContact CG1-CG1 4.33Å; V71-I75 WeakPolarHBondContact O-CB 3.42Å; V71-I75 VanDerWaalsContact O-CG1 3.3Å; V71-I75 WeakPolarHBondContact O-CG1 3.48Å; V71-I75 PolarHBondContact O-N 3.22Å
72	C	97.9	Very high	97	Very high	55 Å²	55	51.5 Å²	51.5	37%	0.372	27%	0.272	S	S	.	.	H	α-helix	trans	-57.7	-47.5	175.6	-70.5	0	0	0	0	111.4	I68 L69 R74 I75 Q76	I68-C72 PolarHBondContact O-N 2.92Å; I68-C72 PolarHBondContact O-SG 2.91Å; I68-C72 VanDerWaalsContact O-SG 3.35Å; L69-C72 WeakPolarHBondContact O-CB 3.49Å; L69-C72 PolarHBondContact O-N 2.96Å; C72-R74 PolarHBondContact O-N 2.98Å; C72-I75 PolarHBondContact O-N 3.42Å; C72-Q76 VanDerWaalsContact O-CG 3.27Å; C72-Q76 WeakPolarHBondContact O-CG 3.28Å; C72-Q76 PolarHBondContact O-N 3.42Å
73	L	98.3	Very high	96.7	Very high	4 Å²	4	54 Å²	54	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-58.4	-48.9	174.7	178.4	63.5	0	0	0	110.8	L27 L69 A70 V71 I75 Q76 I77 A93 F94 F97	L27-L73 HydrophobicContact CD1-CD2 3.99Å; L27-L73 HydrophobicContact CD1-CG 3.93Å; L27-L73 HydrophobicContact CD2-CD2 3.63Å; L27-L73 HydrophobicContact CD2-CG 4.42Å; L27-L73 HydrophobicContact CG-CD2 4.47Å; L69-L73 PolarHBondContact O-N 3.4Å; A70-L73 PolarHBondContact O-N 2.74Å; V71-L73 VanDerWaalsContact C-N 3.34Å; V71-L73 PolarHBondContact O-N 3.35Å; L73-I75 VanDerWaalsContact C-N 3.27Å; L73-I75 PolarHBondContact O-N 3.04Å; L73-Q76 PolarHBondContact O-N 3.48Å; L73-Q76 VanDerWaalsContact O-N 3.16Å; L73-I77 HydrophobicContact CD1-CG2 3.69Å; L73-I77 HydrophobicContact CG-CD1 4.5Å; L73-I77 HydrophobicContact CG-CG2 4.5Å; L73-I77 WeakPolarHBondContact O-CG1 3.24Å; L73-I77 PolarHBondContact O-N 2.95Å; L73-A93 HydrophobicContact CD1-CB 3.96Å; L73-F94 HydrophobicContact CD1-CB 4.37Å; L73-F94 HydrophobicContact CD2-CD2 4.06Å; L73-F97 HydrophobicContact CB-CB 4.27Å; L73-F97 HydrophobicContact CB-CD2 4.15Å; L73-F97 HydrophobicContact CB-CG 4.31Å; L73-F97 HydrophobicContact CD1-CB 4.26Å; L73-F97 HydrophobicContact CD2-CB 4.06Å; L73-F97 HydrophobicContact CD2-CD1 3.88Å; L73-F97 HydrophobicContact CD2-CD2 4.12Å; L73-F97 HydrophobicContact CD2-CE1 4.39Å; L73-F97 HydrophobicContact CD2-CG 3.74Å; L73-F97 HydrophobicContact CG-CB 4.44Å
74	R	97.8	Very high	96.5	Very high	39 Å²	39	59.2 Å²	59.2	15%	0.147	32%	0.32	C	S	.	.	H	α-helix	trans	-58.5	-37.1	-178.7	179.6	61.8	-179	79.3	-1.7	113	L27 D28 A70 V71 C72 N78	L27-R74 HydrophobicContact CD1-CB 4.29Å; D28-R74 WeakPolarHBondContact OD1-CD 3.21Å; D28-R74 IonicContact OD1-CZ 3.82Å; D28-R74 IonicContact OD1-NE 2.82Å; D28-R74 PolarHBondContact OD1-NE 2.88Å; D28-R74 IonicContact OD1-NH2 3.99Å; D28-R74 IonicContact OD2-CZ 3.81Å; D28-R74 IonicContact OD2-NE 3.34Å; D28-R74 PolarHBondContact OD2-NE 2.86Å; D28-R74 IonicContact OD2-NH2 3.31Å; D28-R74 PolarHBondContact OD2-NH2 3.38Å; A70-R74 WeakPolarHBondContact O-CB 3.39Å; A70-R74 PolarHBondContact O-N 2.91Å; V71-R74 WeakPolarHBondContact O-CB 3.4Å; V71-R74 PolarHBondContact O-N 2.71Å; C72-R74 PolarHBondContact O-N 2.98Å; R74-N78 PolarHBondContact NH1-ND2 2.96Å; R74-N78 WeakPolarHBondContact O-CB 3.27Å; R74-N78 PolarHBondContact O-N 3.43Å
75	I	97.3	Very high	96.2	Very high	75 Å²	75	58.6 Å²	58.6	39%	0.385	31%	0.312	S	S	.	.	H	α-helix	trans	-71.6	-45.7	176.6	-71.6	169.7	0	0	0	110.5	V71 C72 L73 N81 F85	V71-I75 HydrophobicContact CG1-CD1 3.7Å; V71-I75 HydrophobicContact CG1-CG1 4.33Å; V71-I75 WeakPolarHBondContact O-CB 3.42Å; V71-I75 VanDerWaalsContact O-CG1 3.3Å; V71-I75 WeakPolarHBondContact O-CG1 3.48Å; V71-I75 PolarHBondContact O-N 3.22Å; C72-I75 PolarHBondContact O-N 3.42Å; L73-I75 VanDerWaalsContact C-N 3.27Å; L73-I75 PolarHBondContact O-N 3.04Å; I75-N81 WeakPolarHBondContact O-CB 3.5Å; I75-N81 PolarHBondContact O-ND2 2.89Å; I75-F85 HydrophobicContact CG2-CE2 3.49Å; I75-F85 VanDerWaalsContact CG2-CE2 3.49Å; I75-F85 HydrophobicContact CG2-CZ 3.5Å; I75-F85 VanDerWaalsContact CG2-CZ 3.5Å
76	Q	96.9	Very high	95.7	Very high	56 Å²	56	65.4 Å²	65.4	26%	0.262	34%	0.34	S	S	.	.	H	α-helix	trans	-68.8	-38.1	-176.1	-71.8	173.3	17.2	0	0	113.1	C72 L73 F85 A93	C72-Q76 VanDerWaalsContact O-CG 3.27Å; C72-Q76 WeakPolarHBondContact O-CG 3.28Å; C72-Q76 PolarHBondContact O-N 3.42Å; L73-Q76 PolarHBondContact O-N 3.48Å; L73-Q76 VanDerWaalsContact O-N 3.16Å; Q76-F85 HydrophobicContact CG-CD1 3.89Å; Q76-F85 HydrophobicContact CG-CE1 3.85Å; Q76-F85 HydrophobicContact CG-CG 4.33Å; Q76-F85 HydrophobicContact CG-CZ 4.28Å; Q76-A93 HydrophobicContact CB-CB 4.03Å
77	I	96.2	Very high	95.2	Very high	33 Å²	33	69.5 Å²	69.5	17%	0.169	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	0.7	-177	75.1	165.3	0	0	0	113.7	L24 L27 L73 P79 P90 A93	L24-I77 HydrophobicContact CD2-CD1 3.9Å; L24-I77 HydrophobicContact CD2-CG1 3.62Å; L27-I77 HydrophobicContact CD1-CD1 3.53Å; L27-I77 HydrophobicContact CD1-CG1 4.11Å; L73-I77 HydrophobicContact CD1-CG2 3.69Å; L73-I77 HydrophobicContact CG-CD1 4.5Å; L73-I77 HydrophobicContact CG-CG2 4.5Å; L73-I77 WeakPolarHBondContact O-CG1 3.24Å; L73-I77 PolarHBondContact O-N 2.95Å; I77-P79 WeakPolarHBondContact O-CD 3.27Å; I77-P90 HydrophobicContact CB-CB 4.44Å; I77-P90 HydrophobicContact CG2-CB 4.1Å; I77-A93 HydrophobicContact CG2-CB 3.78Å
78	N	95.8	Very high	94.9	Very high	18 Å²	18	69.5 Å²	69.5	10%	0.096	39%	0.385	C	S	.	.			trans	-69.6	120.8	175.9	-173.4	-8.4	0	0	0	109.7	L24 R74 Q80 N81	L24-N78 HydrophobicContact CD1-CB 4.41Å; R74-N78 PolarHBondContact NH1-ND2 2.96Å; R74-N78 WeakPolarHBondContact O-CB 3.27Å; R74-N78 PolarHBondContact O-N 3.43Å; N78-Q80 PolarHBondContact O-N 2.88Å; N78-Q80 VanDerWaalsContact O-N 3.08Å; N78-Q80 WeakPolarHBondContact OD1-CB 3.48Å; N78-Q80 PolarHBondContact OD1-N 3.24Å; N78-Q80 VanDerWaalsContact OD1-N 3.09Å; N78-N81 HydrophobicContact CB-CB 4.33Å; N78-N81 PolarHBondContact O-N 2.87Å
79	P	92.9	Very high	94.7	Very high	83 Å²	83	67.4 Å²	67.4	54%	0.539	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-55.3	-29.3	177.6	-26.3	35.6	0	0	0	114	P21 I77 N81 K82	P21-P79 HydrophobicContact CG-CG 4.3Å; I77-P79 WeakPolarHBondContact O-CD 3.27Å; P79-N81 VanDerWaalsContact C-N 3.29Å; P79-N81 PolarHBondContact O-N 3.32Å; P79-K82 VanDerWaalsContact O-CB 3.31Å; P79-K82 WeakPolarHBondContact O-CB 3.4Å; P79-K82 PolarHBondContact O-N 3.5Å
80	Q	92.6	Very high	94.5	Very high	151 Å²	151	68.3 Å²	68.3	71%	0.706	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-67.2	-28.9	177.4	-65.4	173	-18.4	0	0	112.8	N78	N78-Q80 PolarHBondContact O-N 2.88Å; N78-Q80 VanDerWaalsContact O-N 3.08Å; N78-Q80 WeakPolarHBondContact OD1-CB 3.48Å; N78-Q80 PolarHBondContact OD1-N 3.24Å; N78-Q80 VanDerWaalsContact OD1-N 3.09Å
81	N	94.3	Very high	94.4	Very high	38 Å²	38	74.2 Å²	74.2	20%	0.203	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-94.2	7.2	-178.4	-61.8	-5.9	0	0	0	112.4	I75 N78 P79 A83 D84 F85	I75-N81 WeakPolarHBondContact O-CB 3.5Å; I75-N81 PolarHBondContact O-ND2 2.89Å; N78-N81 HydrophobicContact CB-CB 4.33Å; N78-N81 PolarHBondContact O-N 2.87Å; P79-N81 VanDerWaalsContact C-N 3.29Å; P79-N81 PolarHBondContact O-N 3.32Å; N81-A83 PolarHBondContact O-N 3.35Å; N81-A83 VanDerWaalsContact O-N 3.08Å; N81-D84 PolarHBondContact O-N 3.47Å; N81-F85 HydrophobicContact CB-CD2 3.94Å; N81-F85 HydrophobicContact CB-CE2 3.98Å; N81-F85 WeakPolarHBondContact O-CD2 3.37Å; N81-F85 PolarHBondContact O-N 3.19Å
82	K	90.8	Very high	94.4	Very high	159 Å²	159	79 Å²	79	69%	0.691	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.3	-175.3	-174.4	176.4	179.6	-177.5	0	113.1	P79 D84	P79-K82 VanDerWaalsContact O-CB 3.31Å; P79-K82 WeakPolarHBondContact O-CB 3.4Å; P79-K82 PolarHBondContact O-N 3.5Å; K82-D84 VanDerWaalsContact C-N 3.28Å; K82-D84 PolarHBondContact O-N 3.08Å
83	A	93.1	Very high	94.3	Very high	70 Å²	70	76.5 Å²	76.5	58%	0.579	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-29.6	176.9	0	0	0	0	0	113.1	N81 Q86	N81-A83 PolarHBondContact O-N 3.35Å; N81-A83 VanDerWaalsContact O-N 3.08Å; A83-Q86 WeakPolarHBondContact O-CG 3.38Å; A83-Q86 PolarHBondContact O-NE2 3.43Å; A83-Q86 VanDerWaalsContact O-NE2 3.17Å
84	D	94	Very high	94.3	Very high	126 Å²	126	81.3 Å²	81.3	67%	0.674	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-26.4	-177.5	-57	-41.3	0	0	0	112.5	N81 K82	N81-D84 PolarHBondContact O-N 3.47Å; K82-D84 VanDerWaalsContact C-N 3.28Å; K82-D84 PolarHBondContact O-N 3.08Å
85	F	92.4	Very high	94.3	Very high	55 Å²	55	81.8 Å²	81.8	24%	0.241	44%	0.444	C	S	.	.	S	Bend	trans	-111	46.1	-177.7	-59.9	-76.1	0	0	0	112.3	I75 Q76 N81 G87 I88	I75-F85 HydrophobicContact CG2-CE2 3.49Å; I75-F85 VanDerWaalsContact CG2-CE2 3.49Å; I75-F85 HydrophobicContact CG2-CZ 3.5Å; I75-F85 VanDerWaalsContact CG2-CZ 3.5Å; Q76-F85 HydrophobicContact CG-CD1 3.89Å; Q76-F85 HydrophobicContact CG-CE1 3.85Å; Q76-F85 HydrophobicContact CG-CG 4.33Å; Q76-F85 HydrophobicContact CG-CZ 4.28Å; N81-F85 HydrophobicContact CB-CD2 3.94Å; N81-F85 HydrophobicContact CB-CE2 3.98Å; N81-F85 WeakPolarHBondContact O-CD2 3.37Å; N81-F85 PolarHBondContact O-N 3.19Å; F85-G87 PolarHBondContact O-N 3.17Å; F85-I88 HydrophobicContact CB-CB 4.35Å; F85-I88 HydrophobicContact CB-CD1 4.27Å; F85-I88 HydrophobicContact CD1-CD1 3.94Å; F85-I88 PolarHBondContact O-N 3.01Å
86	Q	87.1	Confident	94.3	Very high	159 Å²	159	81.2 Å²	81.2	74%	0.743	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	131.4	178	-61	-176.3	14.3	0	0	110.8	A83 I88	A83-Q86 WeakPolarHBondContact O-CG 3.38Å; A83-Q86 PolarHBondContact O-NE2 3.43Å; A83-Q86 VanDerWaalsContact O-NE2 3.17Å; Q86-I88 VanDerWaalsContact C-N 3.28Å; Q86-I88 PolarHBondContact O-N 3.42Å
87	G	89.3	Confident	94.4	Very high	90 Å²	90	79.7 Å²	79.7	93%	0.928	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	-8.1	-179.2	0	0	0	0	0	115.2	F85	F85-G87 PolarHBondContact O-N 3.17Å
88	I	92.9	Very high	94.5	Very high	68 Å²	68	82 Å²	82	35%	0.349	45%	0.446	S	S	.	.			trans	-91.1	109.3	171.2	-62.6	168.6	0	0	0	107.9	F85 Q86 A93	F85-I88 HydrophobicContact CB-CB 4.35Å; F85-I88 HydrophobicContact CB-CD1 4.27Å; F85-I88 HydrophobicContact CD1-CD1 3.94Å; F85-I88 PolarHBondContact O-N 3.01Å; Q86-I88 VanDerWaalsContact C-N 3.28Å; Q86-I88 PolarHBondContact O-N 3.42Å; I88-A93 HydrophobicContact CG2-CB 3.98Å
89	S	94.3	Very high	94.7	Very high	50 Å²	50	87.9 Å²	87.9	35%	0.35	47%	0.471	S	S	.	.			trans	-75.9	150.6	172.6	81.5	0	0	0	0	110.5	E91 R92 A93	S89-E91 VanDerWaalsContact CB-OE2 3.24Å; S89-E91 WeakPolarHBondContact CB-OE2 3.41Å; S89-E91 PolarHBondContact O-N 3.43Å; S89-E91 PolarHBondContact OG-OE2 3.36Å; S89-E91 VanDerWaalsContact OG-OE2 3.06Å; S89-R92 PolarHBondContact O-N 2.88Å; S89-R92 PolarHBondContact OG-N 2.73Å; S89-R92 VanDerWaalsContact OG-N 3.16Å; S89-A93 PolarHBondContact O-N 2.98Å
90	P	94.5	Very high	94.9	Very high	59 Å²	59	85.4 Å²	85.4	38%	0.383	46%	0.458	S	S	.	.	H	α-helix	trans	-55.1	-33	174.8	-26.6	35.6	0	0	0	113.4	I77 F94	I77-P90 HydrophobicContact CB-CB 4.44Å; I77-P90 HydrophobicContact CG2-CB 4.1Å; P90-F94 VanDerWaalsContact O-CB 3.29Å; P90-F94 WeakPolarHBondContact O-CB 3.41Å; P90-F94 PolarHBondContact O-N 3.2Å
91	E	96.2	Very high	95.2	Very high	123 Å²	123	78.8 Å²	78.8	58%	0.575	43%	0.428	S	S	*	.	H	α-helix	trans	-68.4	-40.2	177.5	-58.1	70.3	-150	0	0	111.2	S89 F94 A95	S89-E91 VanDerWaalsContact CB-OE2 3.24Å; S89-E91 WeakPolarHBondContact CB-OE2 3.41Å; S89-E91 PolarHBondContact O-N 3.43Å; S89-E91 PolarHBondContact OG-OE2 3.36Å; S89-E91 VanDerWaalsContact OG-OE2 3.06Å; E91-F94 PolarHBondContact O-N 3Å; E91-A95 WeakPolarHBondContact O-CB 3.39Å; E91-A95 PolarHBondContact O-N 2.97Å
92	R	97	Very high	95.4	Very high	148 Å²	148	81 Å²	81	56%	0.558	44%	0.443	S	S	*	.	H	α-helix	trans	-66.7	-47.7	175.6	176.5	57.7	-170.6	-100	2	111.3	S89 F94 A95 D96	S89-R92 PolarHBondContact O-N 2.88Å; S89-R92 PolarHBondContact OG-N 2.73Å; S89-R92 VanDerWaalsContact OG-N 3.16Å; R92-F94 VanDerWaalsContact C-N 3.25Å; R92-F94 PolarHBondContact O-N 3.37Å; R92-A95 PolarHBondContact O-N 2.91Å; R92-A95 VanDerWaalsContact O-N 3.13Å; R92-D96 IonicContact CZ-OD1 3.6Å; R92-D96 IonicContact CZ-OD2 3.93Å; R92-D96 IonicContact NE-OD1 2.87Å; R92-D96 PolarHBondContact NE-OD1 3.18Å; R92-D96 IonicContact NE-OD2 3.11Å; R92-D96 PolarHBondContact NE-OD2 2.82Å; R92-D96 VanDerWaalsContact NE-OD2 3.11Å; R92-D96 IonicContact NH2-OD1 3.44Å; R92-D96 PolarHBondContact NH2-OD1 3.49Å; R92-D96 IonicContact NH2-OD2 3.91Å; R92-D96 PolarHBondContact O-N 2.99Å
93	A	97.5	Very high	95.8	Very high	2 Å²	2	77.3 Å²	77.3	2%	0.017	43%	0.43	C	S	.	.	H	α-helix	trans	-56.8	-41.8	175.9	0	0	0	0	0	111.6	L73 Q76 I77 I88 S89 D96 F97	L73-A93 HydrophobicContact CD1-CB 3.96Å; Q76-A93 HydrophobicContact CB-CB 4.03Å; I77-A93 HydrophobicContact CG2-CB 3.78Å; I88-A93 HydrophobicContact CG2-CB 3.98Å; S89-A93 PolarHBondContact O-N 2.98Å; A93-D96 PolarHBondContact O-N 3.42Å; A93-F97 WeakPolarHBondContact O-CB 3.47Å; A93-F97 PolarHBondContact O-N 2.84Å
94	F	97.5	Very high	96	Very high	106 Å²	106	75.4 Å²	75.4	47%	0.465	41%	0.41	S	S	.	.	H	α-helix	trans	-66.6	-40.9	176.1	-175	-111.9	0	0	0	112.8	L73 P90 E91 R92 F97 L98	L73-F94 HydrophobicContact CD1-CB 4.37Å; L73-F94 HydrophobicContact CD2-CD2 4.06Å; P90-F94 VanDerWaalsContact O-CB 3.29Å; P90-F94 WeakPolarHBondContact O-CB 3.41Å; P90-F94 PolarHBondContact O-N 3.2Å; E91-F94 PolarHBondContact O-N 3Å; R92-F94 VanDerWaalsContact C-N 3.25Å; R92-F94 PolarHBondContact O-N 3.37Å; F94-F97 HydrophobicContact CD2-CD1 4.33Å; F94-F97 HydrophobicContact CE2-CD1 4.33Å; F94-F97 WeakPolarHBondContact O-CB 3.44Å; F94-F97 PolarHBondContact O-N 3.47Å; F94-L98 HydrophobicContact CD1-CD1 4.02Å; F94-L98 HydrophobicContact CD1-CG 4.47Å; F94-L98 HydrophobicContact CE1-CD1 3.51Å; F94-L98 HydrophobicContact CE1-CG 4.11Å; F94-L98 HydrophobicContact CE2-CD2 4.41Å; F94-L98 HydrophobicContact CE2-CG 4.4Å; F94-L98 HydrophobicContact CZ-CD1 3.86Å; F94-L98 HydrophobicContact CZ-CD2 4.11Å; F94-L98 HydrophobicContact CZ-CG 4.07Å; F94-L98 WeakPolarHBondContact O-CG 3.48Å; F94-L98 PolarHBondContact O-N 3.39Å
95	A	98.2	Very high	96.2	Very high	49 Å²	49	73.3 Å²	73.3	41%	0.405	40%	0.396	S	S	.	.	H	α-helix	trans	-63.2	-43.8	175.1	0	0	0	0	0	112.1	E91 R92 F97 L98 F99	E91-A95 WeakPolarHBondContact O-CB 3.39Å; E91-A95 PolarHBondContact O-N 2.97Å; R92-A95 PolarHBondContact O-N 2.91Å; R92-A95 VanDerWaalsContact O-N 3.13Å; A95-F97 VanDerWaalsContact C-N 3.31Å; A95-F97 PolarHBondContact O-N 3.34Å; A95-L98 PolarHBondContact O-N 3.32Å; A95-F99 WeakPolarHBondContact O-CB 3.49Å; A95-F99 PolarHBondContact O-N 3.23Å
96	D	98.1	Very high	96.4	Very high	63 Å²	63	76.1 Å²	76.1	34%	0.337	41%	0.413	S	S	.	.	H	α-helix	trans	-62	-41	176.1	-67.3	-22.6	0	0	0	110.7	R92 A93 F99 A100	R92-D96 IonicContact CZ-OD1 3.6Å; R92-D96 IonicContact CZ-OD2 3.93Å; R92-D96 IonicContact NE-OD1 2.87Å; R92-D96 PolarHBondContact NE-OD1 3.18Å; R92-D96 IonicContact NE-OD2 3.11Å; R92-D96 PolarHBondContact NE-OD2 2.82Å; R92-D96 VanDerWaalsContact NE-OD2 3.11Å; R92-D96 IonicContact NH2-OD1 3.44Å; R92-D96 PolarHBondContact NH2-OD1 3.49Å; R92-D96 IonicContact NH2-OD2 3.91Å; R92-D96 PolarHBondContact O-N 2.99Å; A93-D96 PolarHBondContact O-N 3.42Å; D96-F99 PolarHBondContact O-N 3.36Å; D96-A100 VanDerWaalsContact O-CB 3.26Å; D96-A100 WeakPolarHBondContact O-CB 3.45Å; D96-A100 PolarHBondContact O-N 2.84Å
97	F	98.4	Very high	96.9	Very high	23 Å²	23	72.3 Å²	72.3	10%	0.101	40%	0.4	C	S	.	.	H	α-helix	trans	-59.2	-48	173.3	167.4	-98.1	0	0	0	112.6	Y30 L69 A70 L73 A93 F94 A95 S101	Y30-F97 HydrophobicContact CE1-CE2 4.41Å; Y30-F97 AromaticContact CE1-CZ 3.89Å; Y30-F97 HydrophobicContact CE1-CZ 3.89Å; L69-F97 HydrophobicContact CB-CD2 3.84Å; L69-F97 HydrophobicContact CB-CE2 3.89Å; A70-F97 HydrophobicContact CB-CE2 4.17Å; L73-F97 HydrophobicContact CB-CB 4.27Å; L73-F97 HydrophobicContact CB-CD2 4.15Å; L73-F97 HydrophobicContact CB-CG 4.31Å; L73-F97 HydrophobicContact CD1-CB 4.26Å; L73-F97 HydrophobicContact CD2-CB 4.06Å; L73-F97 HydrophobicContact CD2-CD1 3.88Å; L73-F97 HydrophobicContact CD2-CD2 4.12Å; L73-F97 HydrophobicContact CD2-CE1 4.39Å; L73-F97 HydrophobicContact CD2-CG 3.74Å; L73-F97 HydrophobicContact CG-CB 4.44Å; A93-F97 WeakPolarHBondContact O-CB 3.47Å; A93-F97 PolarHBondContact O-N 2.84Å; F94-F97 HydrophobicContact CD2-CD1 4.33Å; F94-F97 HydrophobicContact CE2-CD1 4.33Å; F94-F97 WeakPolarHBondContact O-CB 3.44Å; F94-F97 PolarHBondContact O-N 3.47Å; A95-F97 VanDerWaalsContact C-N 3.31Å; A95-F97 PolarHBondContact O-N 3.34Å; F97-S101 WeakPolarHBondContact O-CB 3.45Å; F97-S101 PolarHBondContact O-N 3.21Å; F97-S101 PolarHBondContact O-OG 3.48Å
98	L	98.4	Very high	97.3	Very high	82 Å²	82	68.3 Å²	68.3	43%	0.429	36%	0.358	S	S	.	.	H	α-helix	trans	-65.3	-42.6	179.7	-71.3	-179.7	0	0	0	112.2	F94 A95 S101 T102	F94-L98 HydrophobicContact CD1-CD1 4.02Å; F94-L98 HydrophobicContact CD1-CG 4.47Å; F94-L98 HydrophobicContact CE1-CD1 3.51Å; F94-L98 HydrophobicContact CE1-CG 4.11Å; F94-L98 HydrophobicContact CE2-CD2 4.41Å; F94-L98 HydrophobicContact CE2-CG 4.4Å; F94-L98 HydrophobicContact CZ-CD1 3.86Å; F94-L98 HydrophobicContact CZ-CD2 4.11Å; F94-L98 HydrophobicContact CZ-CG 4.07Å; F94-L98 WeakPolarHBondContact O-CG 3.48Å; F94-L98 PolarHBondContact O-N 3.39Å; A95-L98 PolarHBondContact O-N 3.32Å; L98-S101 PolarHBondContact O-N 3.35Å; L98-T102 WeakPolarHBondContact O-CB 3.43Å; L98-T102 PolarHBondContact O-N 3.49Å; L98-T102 PolarHBondContact O-OG1 2.98Å
99	F	98.6	Very high	97.4	Very high	142 Å²	142	71 Å²	71	62%	0.623	37%	0.37	S	S	*	.	H	α-helix	trans	-63.3	-50.3	178.3	-179.7	-105	0	0	0	111.3	A95 D96 S101 T102 I103	A95-F99 WeakPolarHBondContact O-CB 3.49Å; A95-F99 PolarHBondContact O-N 3.23Å; D96-F99 PolarHBondContact O-N 3.36Å; F99-S101 VanDerWaalsContact C-N 3.32Å; F99-S101 PolarHBondContact O-N 2.98Å; F99-T102 WeakPolarHBondContact O-CB 3.08Å; F99-T102 PolarHBondContact O-N 2.78Å; F99-I103 HydrophobicContact CD1-CD1 3.94Å; F99-I103 HydrophobicContact CE1-CD1 3.38Å; F99-I103 HydrophobicContact CE2-CD1 4.24Å; F99-I103 HydrophobicContact CZ-CD1 3.56Å; F99-I103 HydrophobicContact CZ-CG1 4.49Å; F99-I103 PolarHBondContact O-N 3.38Å; F99-I103 VanDerWaalsContact O-N 3.08Å
100	A	98.7	Very high	97.4	Very high	31 Å²	31	74.9 Å²	74.9	26%	0.256	39%	0.387	S	S	.	.	H	α-helix	trans	-62.1	-39.4	176.6	0	0	0	0	0	112	L69 D96 T102 I103 L104	L69-A100 HydrophobicContact CD1-CB 3.94Å; L69-A100 HydrophobicContact CD2-CB 3.71Å; L69-A100 HydrophobicContact CG-CB 4.49Å; D96-A100 VanDerWaalsContact O-CB 3.26Å; D96-A100 WeakPolarHBondContact O-CB 3.45Å; D96-A100 PolarHBondContact O-N 2.84Å; A100-T102 VanDerWaalsContact C-N 3.33Å; A100-T102 PolarHBondContact O-N 3.46Å; A100-I103 PolarHBondContact O-N 3.05Å; A100-L104 WeakPolarHBondContact O-CB 3.32Å; A100-L104 PolarHBondContact O-N 2.87Å
101	S	98.5	Very high	97.3	Very high	12 Å²	12	76.1 Å²	76.1	8%	0.084	39%	0.387	C	S	.	.	H	α-helix	trans	-62.7	-41.2	175.8	-63.6	0	0	0	0	111.3	F97 L98 F99 L104 H105	F97-S101 WeakPolarHBondContact O-CB 3.45Å; F97-S101 PolarHBondContact O-N 3.21Å; F97-S101 PolarHBondContact O-OG 3.48Å; L98-S101 PolarHBondContact O-N 3.35Å; F99-S101 VanDerWaalsContact C-N 3.32Å; F99-S101 PolarHBondContact O-N 2.98Å; S101-L104 PolarHBondContact O-N 3.48Å; S101-H105 PolarHBondContact O-N 3.29Å; S101-H105 PolarHBondContact O-ND1 2.86Å
102	T	98.4	Very high	97.1	Very high	84 Å²	84	73.4 Å²	73.4	52%	0.515	38%	0.378	S	S	.	.	H	α-helix	trans	-62.1	-47.1	177.2	-58.2	0	0	0	0	110.9	L98 F99 A100 L104 H105 L106	L98-T102 WeakPolarHBondContact O-CB 3.43Å; L98-T102 PolarHBondContact O-N 3.49Å; L98-T102 PolarHBondContact O-OG1 2.98Å; F99-T102 WeakPolarHBondContact O-CB 3.08Å; F99-T102 PolarHBondContact O-N 2.78Å; A100-T102 VanDerWaalsContact C-N 3.33Å; A100-T102 PolarHBondContact O-N 3.46Å; T102-L104 PolarHBondContact O-N 2.97Å; T102-H105 PolarHBondContact O-N 3.46Å; T102-L106 HydrophobicContact CG2-CD1 4.32Å; T102-L106 WeakPolarHBondContact O-CG 3.36Å; T102-L106 PolarHBondContact O-N 3.04Å
103	I	98.5	Very high	96.5	Very high	81 Å²	81	70.7 Å²	70.7	42%	0.415	40%	0.397	S	S	.	.	H	α-helix	trans	-60.6	-45.5	176.8	-66.8	174	0	0	0	110.9	F99 A100 H105 L106 V107	F99-I103 HydrophobicContact CD1-CD1 3.94Å; F99-I103 HydrophobicContact CE1-CD1 3.38Å; F99-I103 HydrophobicContact CE2-CD1 4.24Å; F99-I103 HydrophobicContact CZ-CD1 3.56Å; F99-I103 HydrophobicContact CZ-CG1 4.49Å; F99-I103 PolarHBondContact O-N 3.38Å; F99-I103 VanDerWaalsContact O-N 3.08Å; A100-I103 PolarHBondContact O-N 3.05Å; I103-H105 VanDerWaalsContact C-N 3.31Å; I103-H105 PolarHBondContact O-N 3.39Å; I103-L106 PolarHBondContact O-N 3.2Å; I103-V107 HydrophobicContact CG2-CG2 4.46Å; I103-V107 WeakPolarHBondContact O-CG2 3.11Å; I103-V107 PolarHBondContact O-N 3.01Å
104	L	98.3	Very high	96.5	Very high	31 Å²	31	74.2 Å²	74.2	16%	0.162	42%	0.416	C	S	.	.	H	α-helix	trans	-55	-48.7	176.8	175.2	66.7	0	0	0	111	G65 L69 A100 S101 T102 L106 V107 V108	G65-L104 VanDerWaalsContact C-CD2 3.46Å; L69-L104 HydrophobicContact CD1-CD2 4.13Å; A100-L104 WeakPolarHBondContact O-CB 3.32Å; A100-L104 PolarHBondContact O-N 2.87Å; S101-L104 PolarHBondContact O-N 3.48Å; T102-L104 PolarHBondContact O-N 2.97Å; L104-L106 PolarHBondContact O-N 3.27Å; L104-V107 PolarHBondContact O-N 2.97Å; L104-V108 HydrophobicContact CD1-CG1 4.08Å; L104-V108 WeakPolarHBondContact O-CG1 3.21Å; L104-V108 WeakPolarHBondContact O-CG2 3.49Å; L104-V108 PolarHBondContact O-N 2.97Å
105	H	97.4	Very high	96.4	Very high	82 Å²	82	72.5 Å²	72.5	38%	0.38	41%	0.413	S	S	.	.	H	α-helix	trans	-64.1	-40.5	179.8	-74.2	87.3	0	0	0	111.9	S62 S101 T102 I103 V107 V108 M109	S62-H105 PolarHBondContact OG-NE2 3.27Å; S101-H105 PolarHBondContact O-N 3.29Å; S101-H105 PolarHBondContact O-ND1 2.86Å; T102-H105 PolarHBondContact O-N 3.46Å; I103-H105 VanDerWaalsContact C-N 3.31Å; I103-H105 PolarHBondContact O-N 3.39Å; H105-V107 VanDerWaalsContact C-N 3.3Å; H105-V107 PolarHBondContact O-N 3.45Å; H105-V108 WeakPolarHBondContact O-CG2 3.41Å; H105-V108 PolarHBondContact O-N 3.27Å; H105-M109 VanDerWaalsContact O-CB 3.32Å; H105-M109 WeakPolarHBondContact O-CB 3.02Å; H105-M109 WeakPolarHBondContact O-CG 3.33Å; H105-M109 PolarHBondContact O-N 3.33Å
106	L	97.4	Very high	96.3	Very high	114 Å²	114	73.8 Å²	73.8	60%	0.597	41%	0.414	S	S	*	.	H	α-helix	trans	-60.5	-39.5	174.4	-69.4	173.2	0	0	0	112.2	T102 I103 L104 N110	T102-L106 HydrophobicContact CG2-CD1 4.32Å; T102-L106 WeakPolarHBondContact O-CG 3.36Å; T102-L106 PolarHBondContact O-N 3.04Å; I103-L106 PolarHBondContact O-N 3.2Å; L104-L106 PolarHBondContact O-N 3.27Å; L106-N110 PolarHBondContact O-ND2 3.18Å
107	V	97.3	Very high	96.2	Very high	78 Å²	78	74.4 Å²	74.4	47%	0.473	42%	0.418	S	S	.	.	H	α-helix	trans	-67.8	-53.3	178.2	172.8	0	0	0	0	111	I103 L104 H105 M109 N110	I103-V107 HydrophobicContact CG2-CG2 4.46Å; I103-V107 WeakPolarHBondContact O-CG2 3.11Å; I103-V107 PolarHBondContact O-N 3.01Å; L104-V107 PolarHBondContact O-N 2.97Å; H105-V107 VanDerWaalsContact C-N 3.3Å; H105-V107 PolarHBondContact O-N 3.45Å; V107-M109 VanDerWaalsContact C-N 3.27Å; V107-M109 PolarHBondContact O-N 3.17Å; V107-N110 WeakPolarHBondContact O-CB 3.42Å; V107-N110 PolarHBondContact O-N 2.86Å; V107-N110 PolarHBondContact O-ND2 3.31Å
108	V	97.3	Very high	96.1	Very high	6 Å²	6	77.6 Å²	77.6	4%	0.036	44%	0.438	C	S	.	.	H	α-helix	trans	-67.2	-27.1	-175.8	-57.9	0	0	0	0	112.7	S58 I61 L104 H105 N110 F111	S58-V108 WeakPolarHBondContact CB-O 3.22Å; S58-V108 PolarHBondContact OG-O 2.65Å; I61-V108 HydrophobicContact CB-CG1 4.21Å; I61-V108 HydrophobicContact CG2-CG1 3.77Å; L104-V108 HydrophobicContact CD1-CG1 4.08Å; L104-V108 WeakPolarHBondContact O-CG1 3.21Å; L104-V108 WeakPolarHBondContact O-CG2 3.49Å; L104-V108 PolarHBondContact O-N 2.97Å; H105-V108 WeakPolarHBondContact O-CG2 3.41Å; H105-V108 PolarHBondContact O-N 3.27Å; V108-N110 PolarHBondContact O-N 3.19Å; V108-F111 WeakPolarHBondContact O-CB 3.41Å; V108-F111 PolarHBondContact O-N 2.72Å
109	M	95.4	Very high	95.9	Very high	124 Å²	124	77.3 Å²	77.3	61%	0.611	44%	0.439	S	S	*	.	H	α-helix	trans	-59	-27.3	175.4	-79.7	-64.8	-62.2	0	0	113.1	H105 V107 F111 V112	H105-M109 VanDerWaalsContact O-CB 3.32Å; H105-M109 WeakPolarHBondContact O-CB 3.02Å; H105-M109 WeakPolarHBondContact O-CG 3.33Å; H105-M109 PolarHBondContact O-N 3.33Å; V107-M109 VanDerWaalsContact C-N 3.27Å; V107-M109 PolarHBondContact O-N 3.17Å; M109-F111 PolarHBondContact O-N 3.29Å; M109-V112 HydrophobicContact CE-CG2 4.48Å; M109-V112 WeakPolarHBondContact O-CG2 3.5Å; M109-V112 PolarHBondContact O-N 3.47Å; M109-V112 HydrophobicContact SD-CG2 3.95Å
110	N	93	Very high	95.7	Very high	132 Å²	132	72.7 Å²	72.7	71%	0.706	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-21.4	175.3	-68.1	-84	0	0	0	113.1	L106 V107 V108	L106-N110 PolarHBondContact O-ND2 3.18Å; V107-N110 WeakPolarHBondContact O-CB 3.42Å; V107-N110 PolarHBondContact O-N 2.86Å; V107-N110 PolarHBondContact O-ND2 3.31Å; V108-N110 PolarHBondContact O-N 3.19Å
111	F	93.6	Very high	95.5	Very high	86 Å²	86	75.9 Å²	75.9	38%	0.377	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	5.2	179.5	-65.8	-92	0	0	0	112.5	N54 S55 L57 V108 M109 G113	N54-F111 CarbonylContact C-O 2.89Å; N54-F111 WeakPolarHBondContact CB-O 3.26Å; S55-F111 PolarHBondContact N-O 2.94Å; L57-F111 HydrophobicContact CD2-CD1 4.13Å; L57-F111 HydrophobicContact CD2-CE1 4.37Å; V108-F111 WeakPolarHBondContact O-CB 3.41Å; V108-F111 PolarHBondContact O-N 2.72Å; M109-F111 PolarHBondContact O-N 3.29Å; F111-G113 VanDerWaalsContact C-N 3.3Å; F111-G113 PolarHBondContact O-N 3.22Å
112	V	91	Very high	95.3	Very high	65 Å²	65	81.3 Å²	81.3	39%	0.394	47%	0.468	S	S	.	.			trans	-72	-27.8	-177.5	174.6	0	0	0	0	112.1	S55 S58 M109	S55-V112 PolarHBondContact OG-O 3.06Å; S58-V112 WeakPolarHBondContact OG-CG2 3.35Å; M109-V112 HydrophobicContact CE-CG2 4.48Å; M109-V112 WeakPolarHBondContact O-CG2 3.5Å; M109-V112 PolarHBondContact O-N 3.47Å; M109-V112 HydrophobicContact SD-CG2 3.95Å
113	G	85.7	Confident	95	Very high	92 Å²	92	81 Å²	81	95%	0.948	46%	0.464	S	S	*	.			trans	-81.3	0	176.6	0	0	0	0	0	113.8	N54 F111	N54-G113 VanDerWaalsContact CB-OXT 3.22Å; N54-G113 WeakPolarHBondContact CB-OXT 3.34Å; N54-G113 PolarHBondContact ND2-OXT 3.16Å; F111-G113 VanDerWaalsContact C-N 3.3Å; F111-G113 PolarHBondContact O-N 3.22Å

Retrieved 113 of 113 residues in 299.8 ms (Link to these results)

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