A0A4W5QLC2_9TELE Loading...

ORM1-like protein

Plays an essential role in the homeostatic regulation of sphingolipid de novo biosynthesis by modulating the activity of the serine palmitoyltransferase (SPT) in response to ceramide levels. When complexed to SPT, the binding of ceramides to its N-terminus stabilizes a conformation that block SPT substrate entry, hence preventing SPT catalytic activity. Through this mechanism, maintains ceramide levels at sufficient concentrations for the production of complex sphingolipids, but which prevents the accumulation of ceramides to levels that trigger apoptosis.

AlphaFold DB , UniProt , Accession A0A4W5QLC2, Species 9TELE (Hucho hucho, huchen), Gene n/a, Length 153 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.9	Very low	57.4	Low	224 Å²	224	112.5 Å²	112.5	100%	1.103	67%	0.671	S	S	*	*				0	103	0	-166.8	168.4	141.5	0	0	106.6	V3	M1-V3 HydrophobicContact CE-CG2 4.42Å; M1-V3 PolarHBondContact O-N 3.39Å
2	N	46.5	Very low	59.7	Low	172 Å²	172	106.3 Å²	106.3	92%	0.92	64%	0.635	S	S	*	*			trans	-82.2	93.7	-178.8	-145	11.1	0	0	0	106.5	G4	N2-G4 PolarHBondContact O-N 2.97Å
3	V	54.5	Low	61.9	Low	108 Å²	108	99 Å²	99	66%	0.655	59%	0.591	S	S	*	*			trans	-72.7	101.2	178.2	-172.7	0	0	0	0	105.8	M1 T5	M1-V3 HydrophobicContact CE-CG2 4.42Å; M1-V3 PolarHBondContact O-N 3.39Å; V3-T5 PolarHBondContact O-N 3.33Å
4	G	49	Very low	63.7	Low	69 Å²	69	92.6 Å²	92.6	71%	0.711	55%	0.553	S	S	*	*			trans	-57.3	110.4	173.3	0	0	0	0	0	108.4	N2 A6	N2-G4 PolarHBondContact O-N 2.97Å; G4-A6 PolarHBondContact O-N 3.18Å
5	T	55.3	Low	65.2	Low	102 Å²	102	95.4 Å²	95.4	63%	0.626	55%	0.55	S	S	*	*			trans	-67.1	105.3	169.5	45.2	0	0	0	0	107	V3 H7	V3-T5 PolarHBondContact O-N 3.33Å; T5-H7 PolarHBondContact O-CD2 3.06Å; T5-H7 PolarHBondContact O-N 3.12Å; T5-H7 PolarHBondContact OG1-NE2 3.09Å
6	A	53.8	Low	66.3	Low	95 Å²	95	93.1 Å²	93.1	79%	0.785	54%	0.538	S	S	*	.			trans	-62.9	103.8	165.1	0	0	0	0	0	106.7	G4 S8	G4-A6 PolarHBondContact O-N 3.18Å; A6-S8 PolarHBondContact O-N 3.04Å
7	H	49.8	Very low	67.6	Low	167 Å²	167	89 Å²	89	77%	0.773	51%	0.513	S	S	*	.			trans	-71	88.4	169.7	-65.3	-77.6	0	0	0	107	T5 E9	T5-H7 PolarHBondContact O-CD2 3.06Å; T5-H7 PolarHBondContact O-N 3.12Å; T5-H7 PolarHBondContact OG1-NE2 3.09Å; H7-E9 PolarHBondContact O-N 3.28Å
8	S	59.2	Low	68.7	Low	100 Å²	100	88.1 Å²	88.1	70%	0.699	51%	0.506	S	S	*	.			trans	-64.5	124.1	164.7	52.7	0	0	0	0	107.4	A6 V10	A6-S8 PolarHBondContact O-N 3.04Å; S8-V10 PolarHBondContact O-N 3.32Å
9	E	62.4	Low	69.9	Low	67 Å²	67	86.7 Å²	86.7	31%	0.313	50%	0.502	S	S	.	.			trans	-53.7	123.4	169.1	-73	-74	166.7	0	0	108.9	H7 N11 R15 Y91	H7-E9 PolarHBondContact O-N 3.28Å; E9-N11 PolarHBondContact O-N 2.97Å; E9-R15 WeakPolarHBondContact OE1-CD 3.22Å; E9-R15 IonicContact OE1-CZ 3.84Å; E9-R15 IonicContact OE1-NE 3.89Å; E9-R15 IonicContact OE1-NH1 3.43Å; E9-R15 PolarHBondContact OE1-NH1 3.31Å; E9-Y91 PolarHBondContact OE1-OH 3.2Å; E9-Y91 PolarHBondContact OE2-OH 2.85Å
10	V	73	Confident	70.9	Confident	111 Å²	111	93.2 Å²	93.2	67%	0.673	52%	0.518	S	S	*	.	S	Bend	trans	-65.7	-23.1	178.6	-177.5	0	0	0	0	111.1	S8 E73	S8-V10 PolarHBondContact O-N 3.32Å; V10-E73 WeakPolarHBondContact O-CG 3.34Å
11	N	83.5	Confident	72	Confident	22 Å²	22	90.5 Å²	90.5	12%	0.118	51%	0.512	C	S	.	.			trans	-130.4	103.1	175.9	-179	-10.2	0	0	0	110.9	E9 N13 T14 T70 Q88	E9-N11 PolarHBondContact O-N 2.97Å; N11-N13 VanDerWaalsContact C-N 3.26Å; N11-N13 PolarHBondContact O-N 3.11Å; N11-N13 WeakPolarHBondContact OD1-CB 3.26Å; N11-N13 PolarHBondContact OD1-N 2.86Å; N11-T14 HydrophobicContact CB-CG2 4.06Å; N11-T14 PolarHBondContact O-N 3.24Å; N11-T14 PolarHBondContact O-OG1 3.4Å; N11-T70 HydrophobicContact CB-CG2 4.22Å; N11-T70 WeakPolarHBondContact OD1-CG2 3.29Å; N11-Q88 PolarHBondContact ND2-OE1 2.96Å; N11-Q88 PolarHBondContact OD1-OE1 3.25Å
12	P	84.6	Confident	74.4	Confident	38 Å²	38	82.7 Å²	82.7	25%	0.247	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-65.7	-25.9	-178.4	24.9	-33.1	0	0	0	113.4	T14 R15 V16 E73	P12-T14 PolarHBondContact O-N 3.37Å; P12-R15 PolarHBondContact O-N 3.26Å; P12-V16 HydrophobicContact CB-CG2 4.01Å; P12-V16 WeakPolarHBondContact O-CG2 3.44Å; P12-V16 PolarHBondContact O-N 3.45Å; P12-E73 WeakPolarHBondContact CD-OE1 3.36Å; P12-E73 HydrophobicContact CG-CG 4.26Å
13	N	87.9	Confident	76.7	Confident	12 Å²	12	77.6 Å²	77.6	6%	0.064	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-59.9	-23.7	-179.6	-61.2	-20.1	0	0	0	112.6	N11 R15 G69 Y85 Q88 M89	N11-N13 VanDerWaalsContact C-N 3.26Å; N11-N13 PolarHBondContact O-N 3.11Å; N11-N13 WeakPolarHBondContact OD1-CB 3.26Å; N11-N13 PolarHBondContact OD1-N 2.86Å; N13-R15 VanDerWaalsContact C-N 3.28Å; N13-R15 PolarHBondContact O-N 2.84Å; N13-G69 PolarHBondContact ND2-O 3.49Å; N13-Y85 HydrophobicContact CB-CD2 3.85Å; N13-Y85 HydrophobicContact CB-CE2 3.68Å; N13-Y85 WeakPolarHBondContact OD1-CD2 3.46Å; N13-Y85 WeakPolarHBondContact OD1-CE2 3.39Å; N13-Q88 HydrophobicContact CB-CB 4.1Å; N13-Q88 PolarHBondContact ND2-OE1 3.22Å; N13-M89 WeakPolarHBondContact O-CA 3.32Å
14	T	87.3	Confident	78.7	Confident	9 Å²	9	77.4 Å²	77.4	6%	0.055	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-66.7	-28.7	178	62.7	0	0	0	0	112.5	N11 P12 D90 Y91	N11-T14 HydrophobicContact CB-CG2 4.06Å; N11-T14 PolarHBondContact O-N 3.24Å; N11-T14 PolarHBondContact O-OG1 3.4Å; P12-T14 PolarHBondContact O-N 3.37Å; T14-D90 VanDerWaalsContact O-CA 3.28Å; T14-D90 WeakPolarHBondContact O-CA 3.24Å; T14-D90 PolarHBondContact O-N 3.48Å; T14-Y91 HydrophobicContact CG2-CD1 3.67Å; T14-Y91 HydrophobicContact CG2-CE1 3.68Å; T14-Y91 HydrophobicContact CG2-CG 4.33Å
15	R	86.1	Confident	81	Confident	135 Å²	135	77.8 Å²	77.8	51%	0.509	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.1	-14.2	-169.2	-70.2	-176.4	67.4	-162	-1	115.8	E9 P12 N13 M17 N18 Y91	E9-R15 WeakPolarHBondContact OE1-CD 3.22Å; E9-R15 IonicContact OE1-CZ 3.84Å; E9-R15 IonicContact OE1-NE 3.89Å; E9-R15 IonicContact OE1-NH1 3.43Å; E9-R15 PolarHBondContact OE1-NH1 3.31Å; P12-R15 PolarHBondContact O-N 3.26Å; N13-R15 VanDerWaalsContact C-N 3.28Å; N13-R15 PolarHBondContact O-N 2.84Å; R15-M17 PolarHBondContact O-N 2.85Å; R15-M17 VanDerWaalsContact O-N 3.16Å; R15-N18 WeakPolarHBondContact O-CB 3.35Å; R15-N18 PolarHBondContact O-N 3.45Å; R15-Y91 WeakPolarHBondContact CD-OH 3.41Å; R15-Y91 HydrophobicContact CG-CE2 4.29Å
16	V	83.1	Confident	83	Confident	59 Å²	59	74.8 Å²	74.8	36%	0.358	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-50.4	-44	-178.9	160.6	0	0	0	0	111.6	P12 N18 I22 Y85	P12-V16 HydrophobicContact CB-CG2 4.01Å; P12-V16 WeakPolarHBondContact O-CG2 3.44Å; P12-V16 PolarHBondContact O-N 3.45Å; V16-N18 PolarHBondContact O-N 2.98Å; V16-N18 VanDerWaalsContact O-N 3.13Å; V16-I22 HydrophobicContact CG1-CD1 3.63Å; V16-I22 WeakPolarHBondContact O-CD1 3.38Å; V16-Y85 WeakPolarHBondContact CB-OH 3.44Å; V16-Y85 VanDerWaalsContact CG1-OH 3.28Å; V16-Y85 WeakPolarHBondContact CG1-OH 3.45Å
17	M	88.4	Confident	85.1	Confident	23 Å²	23	74.2 Å²	74.2	11%	0.113	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-70.5	-8.3	-178.6	-162.3	57.9	59.9	0	0	114.3	R15 S19 I22 W23 M89 S98 L102	R15-M17 PolarHBondContact O-N 2.85Å; R15-M17 VanDerWaalsContact O-N 3.16Å; M17-S19 VanDerWaalsContact C-N 3.29Å; M17-S19 PolarHBondContact O-N 3.09Å; M17-I22 HydrophobicContact CE-CG2 4.11Å; M17-I22 HydrophobicContact SD-CG2 3.59Å; M17-I22 VanDerWaalsContact SD-CG2 3.59Å; M17-W23 PolarHBondContact O-NE1 3.37Å; M17-M89 HydrophobicContact CB-CG 4.43Å; M17-M89 HydrophobicContact CB-SD 3.63Å; M17-M89 HydrophobicContact CG-SD 3.83Å; M17-S98 PolarHBondContact O-OG 3.25Å; M17-L102 HydrophobicContact CE-CD1 4.09Å; M17-L102 HydrophobicContact CE-CD2 4.32Å; M17-L102 HydrophobicContact CG-CD1 3.81Å; M17-L102 HydrophobicContact CG-CG 4.25Å; M17-L102 HydrophobicContact SD-CD1 4.14Å; M17-L102 HydrophobicContact SD-CD2 4.07Å; M17-L102 HydrophobicContact SD-CG 4.3Å
18	N	88.1	Confident	87.4	Confident	72 Å²	72	71.4 Å²	71.4	39%	0.385	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-78.3	-8.9	-178.8	-72.5	-46.5	0	0	0	114.3	R15 V16 D90 S98	R15-N18 WeakPolarHBondContact O-CB 3.35Å; R15-N18 PolarHBondContact O-N 3.45Å; V16-N18 PolarHBondContact O-N 2.98Å; V16-N18 VanDerWaalsContact O-N 3.13Å; N18-D90 PolarHBondContact ND2-OD1 3.25Å; N18-D90 PolarHBondContact OD1-OD1 2.95Å; N18-S98 PolarHBondContact OD1-OG 3.12Å
19	S	90.5	Very high	89.3	Confident	62 Å²	62	68.5 Å²	68.5	43%	0.434	37%	0.365	S	S	.	.			trans	-78.5	130.8	178.4	179	0	0	0	0	112.2	M17 G21 I22 W23	M17-S19 VanDerWaalsContact C-N 3.29Å; M17-S19 PolarHBondContact O-N 3.09Å; S19-G21 PolarHBondContact O-N 3.46Å; S19-G21 PolarHBondContact OG-N 3.45Å; S19-I22 PolarHBondContact O-N 3.17Å; S19-I22 VanDerWaalsContact O-N 3.12Å; S19-W23 PolarHBondContact O-N 2.76Å
20	R	90.8	Very high	91	Very high	216 Å²	216	66.4 Å²	66.4	82%	0.815	36%	0.356	S	S	*	.	H	α-helix	trans	-58.9	-31.9	171.8	-65.1	-176	-178.7	179.4	0.7	112.6	I22 W23 L24	R20-I22 VanDerWaalsContact C-N 3.32Å; R20-I22 PolarHBondContact O-N 2.98Å; R20-W23 PolarHBondContact O-N 3.07Å; R20-L24 PolarHBondContact O-N 2.73Å
21	G	94.4	Very high	92.2	Very high	38 Å²	38	62.9 Å²	62.9	39%	0.392	34%	0.341	S	S	.	.	H	α-helix	trans	-61.9	-41.9	176.7	0	0	0	0	0	111.7	S19 W23 L24 S25	S19-G21 PolarHBondContact O-N 3.46Å; S19-G21 PolarHBondContact OG-N 3.45Å; G21-W23 PolarHBondContact O-N 3.04Å; G21-L24 PolarHBondContact O-N 3.16Å; G21-S25 WeakPolarHBondContact O-CB 3.43Å; G21-S25 PolarHBondContact O-N 3.37Å; G21-S25 PolarHBondContact O-OG 3.22Å; G21-S25 VanDerWaalsContact O-OG 3.09Å
22	I	93.6	Very high	92.9	Very high	59 Å²	59	66.9 Å²	66.9	30%	0.303	36%	0.362	S	S	.	.	H	α-helix	trans	-66.1	-39.3	177.4	-77.9	166.4	0	0	0	111.3	V16 M17 S19 R20 L24 S25 Y26	V16-I22 HydrophobicContact CG1-CD1 3.63Å; V16-I22 WeakPolarHBondContact O-CD1 3.38Å; M17-I22 HydrophobicContact CE-CG2 4.11Å; M17-I22 HydrophobicContact SD-CG2 3.59Å; M17-I22 VanDerWaalsContact SD-CG2 3.59Å; S19-I22 PolarHBondContact O-N 3.17Å; S19-I22 VanDerWaalsContact O-N 3.12Å; R20-I22 VanDerWaalsContact C-N 3.32Å; R20-I22 PolarHBondContact O-N 2.98Å; I22-L24 VanDerWaalsContact C-N 3.34Å; I22-L24 PolarHBondContact O-N 3.13Å; I22-S25 PolarHBondContact O-N 3.47Å; I22-Y26 VanDerWaalsContact O-CB 3.26Å; I22-Y26 WeakPolarHBondContact O-CB 3.3Å; I22-Y26 PolarHBondContact O-N 3.03Å
23	W	95.4	Very high	93.6	Very high	66 Å²	66	67.1 Å²	67.1	25%	0.25	36%	0.361	C	S	.	.	H	α-helix	trans	-62.4	-43.9	176.1	-66.7	11.6	0	0	0	111.5	M17 S19 R20 G21 Y26 L27 A97 F101	M17-W23 PolarHBondContact O-NE1 3.37Å; S19-W23 PolarHBondContact O-N 2.76Å; R20-W23 PolarHBondContact O-N 3.07Å; G21-W23 PolarHBondContact O-N 3.04Å; W23-Y26 PolarHBondContact O-N 2.83Å; W23-L27 WeakPolarHBondContact O-CG 3.34Å; W23-L27 PolarHBondContact O-N 3.32Å; W23-A97 HydrophobicContact CH2-CB 3.94Å; W23-A97 HydrophobicContact CZ2-CB 4.33Å; W23-F101 HydrophobicContact CB-CE1 3.91Å; W23-F101 HydrophobicContact CB-CE2 4.22Å; W23-F101 HydrophobicContact CB-CZ 3.71Å; W23-F101 AromaticContact CD1-CD1 3.93Å; W23-F101 AromaticContact CD1-CE1 3.89Å; W23-F101 HydrophobicContact CD2-CB 4.47Å; W23-F101 HydrophobicContact CD2-CD1 4.04Å; W23-F101 HydrophobicContact CD2-CD2 4.13Å; W23-F101 HydrophobicContact CD2-CE1 4.26Å; W23-F101 HydrophobicContact CD2-CE2 4.36Å; W23-F101 AromaticContact CD2-CG 3.95Å; W23-F101 HydrophobicContact CD2-CG 3.95Å; W23-F101 HydrophobicContact CD2-CZ 4.4Å; W23-F101 AromaticContact CE3-CD2 3.99Å; W23-F101 HydrophobicContact CE3-CD2 3.99Å; W23-F101 HydrophobicContact CE3-CE2 4.3Å; W23-F101 HydrophobicContact CE3-CG 4.19Å; W23-F101 AromaticContact CG-CD1 3.94Å; W23-F101 HydrophobicContact CG-CD1 3.94Å; W23-F101 AromaticContact CG-CE1 3.75Å; W23-F101 HydrophobicContact CG-CE1 3.75Å; W23-F101 HydrophobicContact CG-CE2 4.34Å; W23-F101 HydrophobicContact CG-CG 4.3Å; W23-F101 AromaticContact CG-CZ 3.95Å; W23-F101 HydrophobicContact CG-CZ 3.95Å; W23-F101 HydrophobicContact CH2-CB 4.36Å; W23-F101 HydrophobicContact CZ2-CB 4.21Å; W23-F101 HydrophobicContact CZ3-CD2 4.47Å
24	L	96.9	Very high	94.1	Very high	103 Å²	103	67.9 Å²	67.9	54%	0.539	36%	0.364	S	S	.	.	H	α-helix	trans	-62.9	-50	176.1	179.5	61	0	0	0	111.3	R20 G21 I22 Y26 L27 L28	R20-L24 PolarHBondContact O-N 2.73Å; G21-L24 PolarHBondContact O-N 3.16Å; I22-L24 VanDerWaalsContact C-N 3.34Å; I22-L24 PolarHBondContact O-N 3.13Å; L24-Y26 VanDerWaalsContact C-N 3.26Å; L24-Y26 PolarHBondContact O-N 3.38Å; L24-L27 PolarHBondContact O-N 3.19Å; L24-L28 HydrophobicContact CD1-CD1 4.18Å; L24-L28 HydrophobicContact CD1-CG 4.15Å; L24-L28 HydrophobicContact CG-CD1 3.96Å; L24-L28 HydrophobicContact CG-CG 4.36Å; L24-L28 WeakPolarHBondContact O-CB 3.4Å; L24-L28 WeakPolarHBondContact O-CG 3.49Å; L24-L28 PolarHBondContact O-N 3.25Å
25	S	96.5	Very high	94.6	Very high	78 Å²	78	71.4 Å²	71.4	55%	0.545	39%	0.386	S	S	.	.	H	α-helix	trans	-58.3	-38.3	177.8	-63.6	0	0	0	0	112.3	G21 I22 L28 G29	G21-S25 WeakPolarHBondContact O-CB 3.43Å; G21-S25 PolarHBondContact O-N 3.37Å; G21-S25 PolarHBondContact O-OG 3.22Å; G21-S25 VanDerWaalsContact O-OG 3.09Å; I22-S25 PolarHBondContact O-N 3.47Å; S25-L28 PolarHBondContact O-N 2.93Å; S25-G29 PolarHBondContact O-N 2.94Å
26	Y	96.8	Very high	95.2	Very high	38 Å²	38	69.6 Å²	69.6	15%	0.149	39%	0.385	C	S	.	.	H	α-helix	trans	-64.5	-46.8	175.8	168	-108.7	0	0	0	112.3	I22 W23 L24 G29 I30 H56 M60 F101 L102 T105	I22-Y26 VanDerWaalsContact O-CB 3.26Å; I22-Y26 WeakPolarHBondContact O-CB 3.3Å; I22-Y26 PolarHBondContact O-N 3.03Å; W23-Y26 PolarHBondContact O-N 2.83Å; L24-Y26 VanDerWaalsContact C-N 3.26Å; L24-Y26 PolarHBondContact O-N 3.38Å; Y26-G29 PolarHBondContact O-N 3.28Å; Y26-I30 HydrophobicContact CD1-CD1 4.42Å; Y26-I30 HydrophobicContact CE1-CD1 4Å; Y26-I30 HydrophobicContact CE2-CD1 4.07Å; Y26-I30 HydrophobicContact CE2-CG1 4.49Å; Y26-I30 WeakPolarHBondContact O-CG1 3.37Å; Y26-I30 PolarHBondContact O-N 3.2Å; Y26-I30 VanDerWaalsContact O-N 3.08Å; Y26-H56 AromaticContact CE2-NE2 3.65Å; Y26-H56 AromaticContact CZ-NE2 3.43Å; Y26-H56 PolarHBondContact OH-CE1 3.34Å; Y26-H56 PolarHBondContact OH-NE2 3.3Å; Y26-M60 HydrophobicContact CD2-SD 4.38Å; Y26-M60 HydrophobicContact CE2-CE 4.14Å; Y26-M60 HydrophobicContact CE2-CG 4.35Å; Y26-M60 HydrophobicContact CE2-SD 3.52Å; Y26-M60 VanDerWaalsContact CE2-SD 3.52Å; Y26-F101 AromaticContact CD1-CE1 3.4Å; Y26-F101 HydrophobicContact CD1-CE1 3.4Å; Y26-F101 AromaticContact CD1-CZ 3.56Å; Y26-F101 HydrophobicContact CD1-CZ 3.56Å; Y26-F101 AromaticContact CE1-CE1 3.71Å; Y26-F101 HydrophobicContact CE1-CE1 3.71Å; Y26-F101 AromaticContact CE1-CZ 3.96Å; Y26-F101 HydrophobicContact CE1-CZ 3.96Å; Y26-F101 HydrophobicContact CG-CE1 4.39Å; Y26-L102 HydrophobicContact CE1-CD2 4.34Å; Y26-T105 HydrophobicContact CE1-CG2 3.55Å
27	L	98.1	Very high	95.9	Very high	84 Å²	84	67.5 Å²	67.5	44%	0.44	37%	0.372	S	S	.	.	H	α-helix	trans	-63.6	-41.9	175.8	-66.9	176.6	0	0	0	112	W23 L24 G29 I30 G31 F101 T105	W23-L27 WeakPolarHBondContact O-CG 3.34Å; W23-L27 PolarHBondContact O-N 3.32Å; L24-L27 PolarHBondContact O-N 3.19Å; L27-G29 VanDerWaalsContact C-N 3.29Å; L27-G29 PolarHBondContact O-N 3.11Å; L27-I30 PolarHBondContact O-N 2.82Å; L27-G31 PolarHBondContact O-N 3.38Å; L27-F101 HydrophobicContact CD1-CE2 4.35Å; L27-F101 HydrophobicContact CD1-CZ 4.41Å; L27-F101 HydrophobicContact CD2-CE2 4.4Å; L27-F101 HydrophobicContact CD2-CZ 4.19Å; L27-F101 HydrophobicContact CG-CE2 4.42Å; L27-F101 HydrophobicContact CG-CZ 4.07Å; L27-T105 HydrophobicContact CD2-CG2 4.18Å
28	L	98.4	Very high	96.4	Very high	108 Å²	108	70.5 Å²	70.5	57%	0.565	39%	0.388	S	S	*	.	H	α-helix	trans	-62.2	-37.5	174.1	-70	175.6	0	0	0	111.6	L24 S25 G31 L32	L24-L28 HydrophobicContact CD1-CD1 4.18Å; L24-L28 HydrophobicContact CD1-CG 4.15Å; L24-L28 HydrophobicContact CG-CD1 3.96Å; L24-L28 HydrophobicContact CG-CG 4.36Å; L24-L28 WeakPolarHBondContact O-CB 3.4Å; L24-L28 WeakPolarHBondContact O-CG 3.49Å; L24-L28 PolarHBondContact O-N 3.25Å; S25-L28 PolarHBondContact O-N 2.93Å; L28-G31 PolarHBondContact O-N 3Å; L28-L32 VanDerWaalsContact O-CB 3.31Å; L28-L32 WeakPolarHBondContact O-CB 3.29Å; L28-L32 PolarHBondContact O-N 3.21Å
29	G	98.5	Very high	96.8	Very high	38 Å²	38	71.3 Å²	71.3	39%	0.392	40%	0.399	S	S	.	.	H	α-helix	trans	-61.9	-42.2	175	0	0	0	0	0	112.8	S25 Y26 L27 L32 L33	S25-G29 PolarHBondContact O-N 2.94Å; Y26-G29 PolarHBondContact O-N 3.28Å; L27-G29 VanDerWaalsContact C-N 3.29Å; L27-G29 PolarHBondContact O-N 3.11Å; G29-L32 PolarHBondContact O-N 3.37Å; G29-L33 WeakPolarHBondContact O-CB 3.43Å; G29-L33 PolarHBondContact O-N 2.91Å
30	I	98.6	Very high	97.2	Very high	24 Å²	24	72.2 Å²	72.2	12%	0.123	40%	0.398	C	S	.	.	H	α-helix	trans	-62.9	-46.4	173.5	-62.7	169.8	0	0	0	110.4	Y26 L27 L32 L33 H34 T52 T105 L109	Y26-I30 HydrophobicContact CD1-CD1 4.42Å; Y26-I30 HydrophobicContact CE1-CD1 4Å; Y26-I30 HydrophobicContact CE2-CD1 4.07Å; Y26-I30 HydrophobicContact CE2-CG1 4.49Å; Y26-I30 WeakPolarHBondContact O-CG1 3.37Å; Y26-I30 PolarHBondContact O-N 3.2Å; Y26-I30 VanDerWaalsContact O-N 3.08Å; L27-I30 PolarHBondContact O-N 2.82Å; I30-L32 PolarHBondContact O-N 3.46Å; I30-L33 PolarHBondContact O-N 2.64Å; I30-H34 PolarHBondContact O-N 3.38Å; I30-T52 HydrophobicContact CG2-CG2 4.36Å; I30-T105 HydrophobicContact CD1-CG2 3.65Å; I30-L109 HydrophobicContact CG2-CD1 4.36Å; I30-L109 HydrophobicContact CG2-CD2 4.31Å
31	G	98.4	Very high	97.3	Very high	36 Å²	36	67.2 Å²	67.2	37%	0.371	39%	0.394	S	S	.	.	H	α-helix	trans	-60.6	-44	177.7	0	0	0	0	0	112.5	L27 L28 H34 V35	L27-G31 PolarHBondContact O-N 3.38Å; L28-G31 PolarHBondContact O-N 3Å; G31-H34 WeakPolarHBondContact O-CB 3.46Å; G31-H34 PolarHBondContact O-N 3.43Å; G31-V35 WeakPolarHBondContact O-CG2 3.49Å; G31-V35 PolarHBondContact O-N 3.17Å
32	L	98.7	Very high	97.3	Very high	107 Å²	107	74.8 Å²	74.8	56%	0.56	42%	0.416	S	S	*	.	H	α-helix	trans	-62.6	-46.8	177	178.4	61.3	0	0	0	111.5	L28 G29 I30 H34 V35 I36	L28-L32 VanDerWaalsContact O-CB 3.31Å; L28-L32 WeakPolarHBondContact O-CB 3.29Å; L28-L32 PolarHBondContact O-N 3.21Å; G29-L32 PolarHBondContact O-N 3.37Å; I30-L32 PolarHBondContact O-N 3.46Å; L32-H34 VanDerWaalsContact C-N 3.27Å; L32-H34 PolarHBondContact O-N 2.91Å; L32-V35 PolarHBondContact O-N 2.87Å; L32-I36 HydrophobicContact CD1-CD1 4.08Å; L32-I36 HydrophobicContact CD1-CG1 4.28Å; L32-I36 HydrophobicContact CG-CD1 3.91Å; L32-I36 VanDerWaalsContact O-CG1 3.29Å; L32-I36 WeakPolarHBondContact O-CG1 3.44Å; L32-I36 PolarHBondContact O-N 3.24Å
33	L	98.6	Very high	97.4	Very high	42 Å²	42	73.5 Å²	73.5	22%	0.22	41%	0.414	C	S	.	.	H	α-helix	trans	-54.3	-46.4	173.5	171	64.7	0	0	0	110.9	G29 I30 V35 I36 L37 T52 I55	G29-L33 WeakPolarHBondContact O-CB 3.43Å; G29-L33 PolarHBondContact O-N 2.91Å; I30-L33 PolarHBondContact O-N 2.64Å; L33-V35 PolarHBondContact O-N 2.83Å; L33-I36 PolarHBondContact O-N 3.17Å; L33-L37 HydrophobicContact CD1-CD1 4Å; L33-L37 HydrophobicContact CD1-CG 4.18Å; L33-L37 HydrophobicContact CG-CD1 4.08Å; L33-L37 WeakPolarHBondContact O-CG 3.33Å; L33-L37 PolarHBondContact O-N 2.92Å; L33-T52 HydrophobicContact CD2-CG2 4.37Å; L33-I55 HydrophobicContact CD1-CD1 4.31Å; L33-I55 HydrophobicContact CD1-CG2 4.08Å; L33-I55 HydrophobicContact CD2-CB 4.03Å; L33-I55 HydrophobicContact CD2-CG2 3.7Å
34	H	98.5	Very high	97.5	Very high	28 Å²	28	73.3 Å²	73.3	13%	0.13	42%	0.423	C	S	.	.	H	α-helix	trans	-62	-44.6	-180	-168.4	67.6	0	0	0	112.2	I30 G31 L32 L37 L38 W49 T52	I30-H34 PolarHBondContact O-N 3.38Å; G31-H34 WeakPolarHBondContact O-CB 3.46Å; G31-H34 PolarHBondContact O-N 3.43Å; L32-H34 VanDerWaalsContact C-N 3.27Å; L32-H34 PolarHBondContact O-N 2.91Å; H34-L37 PolarHBondContact O-N 3.33Å; H34-L38 WeakPolarHBondContact O-CG 3.4Å; H34-L38 PolarHBondContact O-N 2.81Å; H34-W49 AromaticContact CE1-CD1 3.97Å; H34-W49 AromaticContact CE1-CD2 3.57Å; H34-W49 AromaticContact CE1-CE2 3.46Å; H34-W49 VanDerWaalsContact CE1-CE2 3.46Å; H34-W49 AromaticContact CE1-CG 3.9Å; H34-W49 AromaticContact CE1-CZ2 3.86Å; H34-W49 AromaticContact CE1-NE1 3.71Å; H34-W49 AromaticContact NE2-CE2 3.62Å; H34-W49 AromaticContact NE2-CZ2 3.68Å; H34-W49 AromaticContact NE2-NE1 3.83Å; H34-T52 HydrophobicContact CB-CG2 4.03Å; H34-T52 PolarHBondContact ND1-OG1 3.26Å
35	V	98.4	Very high	97.5	Very high	84 Å²	84	72 Å²	72	51%	0.509	42%	0.42	S	S	.	.	H	α-helix	trans	-63.7	-41.7	177.3	170.8	0	0	0	0	111.8	G31 L32 L33 L37 L38 S39	G31-V35 WeakPolarHBondContact O-CG2 3.49Å; G31-V35 PolarHBondContact O-N 3.17Å; L32-V35 PolarHBondContact O-N 2.87Å; L33-V35 PolarHBondContact O-N 2.83Å; V35-L37 VanDerWaalsContact C-N 3.33Å; V35-L37 PolarHBondContact O-N 3.27Å; V35-L38 PolarHBondContact O-N 3.35Å; V35-S39 PolarHBondContact O-N 3.26Å; V35-S39 VanDerWaalsContact O-N 3.13Å; V35-S39 PolarHBondContact O-OG 2.85Å
36	I	98.6	Very high	97.6	Very high	97 Å²	97	70.2 Å²	70.2	50%	0.497	41%	0.406	S	S	.	.	H	α-helix	trans	-59.2	-46.5	174.5	-69.9	167	0	0	0	110.2	L32 L33 S39	L32-I36 HydrophobicContact CD1-CD1 4.08Å; L32-I36 HydrophobicContact CD1-CG1 4.28Å; L32-I36 HydrophobicContact CG-CD1 3.91Å; L32-I36 VanDerWaalsContact O-CG1 3.29Å; L32-I36 WeakPolarHBondContact O-CG1 3.44Å; L32-I36 PolarHBondContact O-N 3.24Å; L33-I36 PolarHBondContact O-N 3.17Å; I36-S39 WeakPolarHBondContact O-CB 3.39Å; I36-S39 PolarHBondContact O-N 3.02Å
37	L	98.3	Very high	97.7	Very high	15 Å²	15	71 Å²	71	8%	0.079	41%	0.414	C	S	.	.	H	α-helix	trans	-66.6	-37.4	178.9	-68.8	172.1	0	0	0	112.7	L33 H34 V35 S39 I40 V48 L51 T52 I55	L33-L37 HydrophobicContact CD1-CD1 4Å; L33-L37 HydrophobicContact CD1-CG 4.18Å; L33-L37 HydrophobicContact CG-CD1 4.08Å; L33-L37 WeakPolarHBondContact O-CG 3.33Å; L33-L37 PolarHBondContact O-N 2.92Å; H34-L37 PolarHBondContact O-N 3.33Å; V35-L37 VanDerWaalsContact C-N 3.33Å; V35-L37 PolarHBondContact O-N 3.27Å; L37-S39 PolarHBondContact O-N 3.39Å; L37-I40 HydrophobicContact CD2-CD1 4.04Å; L37-I40 WeakPolarHBondContact O-CB 3.25Å; L37-I40 WeakPolarHBondContact O-CG1 3.46Å; L37-I40 PolarHBondContact O-N 2.87Å; L37-V48 HydrophobicContact CB-CG1 3.63Å; L37-V48 HydrophobicContact CB-CG2 4.49Å; L37-L51 HydrophobicContact CD1-CB 3.93Å; L37-L51 HydrophobicContact CD2-CB 4.48Å; L37-L51 HydrophobicContact CD2-CD1 4.47Å; L37-T52 WeakPolarHBondContact CD1-OG1 3.39Å; L37-I55 HydrophobicContact CD1-CD1 4.22Å; L37-I55 HydrophobicContact CD2-CD1 4.28Å
38	L	98.2	Very high	97.7	Very high	85 Å²	85	67 Å²	67	45%	0.445	39%	0.393	S	S	.	.	H	α-helix	trans	-63.8	-22.9	174.5	-77.8	174	0	0	0	112.8	H34 V35 I40 V48	H34-L38 WeakPolarHBondContact O-CG 3.4Å; H34-L38 PolarHBondContact O-N 2.81Å; V35-L38 PolarHBondContact O-N 3.35Å; L38-I40 PolarHBondContact O-N 3.03Å; L38-V48 HydrophobicContact CD2-CB 4.13Å; L38-V48 HydrophobicContact CD2-CG1 3.72Å; L38-V48 HydrophobicContact CD2-CG2 4.27Å; L38-V48 HydrophobicContact CG-CG1 3.75Å
39	S	97.4	Very high	97.7	Very high	90 Å²	90	63.3 Å²	63.3	63%	0.629	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-3	178.5	-55.3	0	0	0	0	113.1	V35 I36 L37 P41	V35-S39 PolarHBondContact O-N 3.26Å; V35-S39 VanDerWaalsContact O-N 3.13Å; V35-S39 PolarHBondContact O-OG 2.85Å; I36-S39 WeakPolarHBondContact O-CB 3.39Å; I36-S39 PolarHBondContact O-N 3.02Å; L37-S39 PolarHBondContact O-N 3.39Å; S39-P41 WeakPolarHBondContact O-CD 3.37Å
40	I	97.5	Very high	97.7	Very high	80 Å²	80	62 Å²	62	41%	0.41	36%	0.357	S	S	.	.			trans	-81.6	114.7	178	-59	172.5	0	0	0	109.3	L37 L38 F42 A43	L37-I40 HydrophobicContact CD2-CD1 4.04Å; L37-I40 WeakPolarHBondContact O-CB 3.25Å; L37-I40 WeakPolarHBondContact O-CG1 3.46Å; L37-I40 PolarHBondContact O-N 2.87Å; L38-I40 PolarHBondContact O-N 3.03Å; I40-F42 PolarHBondContact O-N 3.43Å; I40-A43 HydrophobicContact CB-CB 3.94Å; I40-A43 HydrophobicContact CG2-CB 3.98Å; I40-A43 PolarHBondContact O-N 2.69Å; I40-A43 VanDerWaalsContact O-N 3.12Å
41	P	93.2	Very high	97.7	Very high	111 Å²	111	63.9 Å²	63.9	72%	0.721	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.1	-166.4	22.8	-33.8	0	0	0	115.4	S39	S39-P41 WeakPolarHBondContact O-CD 3.37Å
42	F	94.8	Very high	97.7	Very high	198 Å²	198	62.2 Å²	62.2	87%	0.868	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	2.3	-178.3	-49.7	-63.2	0	0	0	113.3	I40	I40-F42 PolarHBondContact O-N 3.43Å
43	A	95.9	Very high	97.7	Very high	31 Å²	31	57.1 Å²	57.1	26%	0.256	32%	0.322	S	S	.	.			trans	-87.5	123.8	178.8	0	0	0	0	0	110.3	I40 V48	I40-A43 HydrophobicContact CB-CB 3.94Å; I40-A43 HydrophobicContact CG2-CB 3.98Å; I40-A43 PolarHBondContact O-N 2.69Å; I40-A43 VanDerWaalsContact O-N 3.12Å; A43-V48 HydrophobicContact CB-CG2 3.62Å
44	S	97.4	Very high	97.7	Very high	62 Å²	62	57.6 Å²	57.6	43%	0.434	33%	0.325	S	S	.	.			trans	-73.4	153.7	172.7	71.6	0	0	0	0	110.8	V47 V48	S44-V47 WeakPolarHBondContact O-CB 3.04Å; S44-V47 PolarHBondContact O-N 3.13Å; S44-V47 VanDerWaalsContact OG-CG2 3.26Å; S44-V47 WeakPolarHBondContact OG-CG2 3.18Å; S44-V48 WeakPolarHBondContact O-CG2 3.3Å; S44-V48 PolarHBondContact O-N 3.34Å
45	V	97.7	Very high	97.8	Very high	77 Å²	77	59.2 Å²	59.2	47%	0.467	33%	0.334	S	S	.	.	H	α-helix	trans	-53.5	-45.8	179.2	175	0	0	0	0	112.8	V47 V48 W49	V45-V47 VanDerWaalsContact C-N 3.33Å; V45-V47 PolarHBondContact O-N 3.46Å; V45-V48 PolarHBondContact O-N 3.21Å; V45-W49 VanDerWaalsContact O-CD1 3.27Å; V45-W49 PolarHBondContact O-N 3.39Å
46	P	98.2	Very high	97.8	Very high	39 Å²	39	55.6 Å²	55.6	25%	0.253	31%	0.311	S	S	.	.	H	α-helix	trans	-58.8	-39.4	174.8	-27.3	37	0	0	0	114.2	T50 T117	P46-T50 PolarHBondContact O-N 3.24Å; P46-T50 PolarHBondContact O-OG1 3.49Å; P46-T50 VanDerWaalsContact O-OG1 3.07Å; P46-T117 HydrophobicContact CB-CG2 3.96Å
47	V	98.2	Very high	97.8	Very high	54 Å²	54	51 Å²	51	33%	0.327	29%	0.288	S	S	.	.	H	α-helix	trans	-65.5	-44.2	177	169.7	0	0	0	0	109.9	S44 V45 W49 T50 L51	S44-V47 WeakPolarHBondContact O-CB 3.04Å; S44-V47 PolarHBondContact O-N 3.13Å; S44-V47 VanDerWaalsContact OG-CG2 3.26Å; S44-V47 WeakPolarHBondContact OG-CG2 3.18Å; V45-V47 VanDerWaalsContact C-N 3.33Å; V45-V47 PolarHBondContact O-N 3.46Å; V47-W49 PolarHBondContact O-N 2.98Å; V47-T50 PolarHBondContact O-N 3.42Å; V47-L51 HydrophobicContact CG1-CD1 3.86Å; V47-L51 HydrophobicContact CG1-CG 4.2Å; V47-L51 WeakPolarHBondContact O-CB 3.25Å; V47-L51 WeakPolarHBondContact O-CG 3.34Å; V47-L51 PolarHBondContact O-N 3.49Å
48	V	98.6	Very high	97.8	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.006	31%	0.31	C	S	.	.	H	α-helix	trans	-60.9	-45.1	178	172.3	0	0	0	0	111.8	L37 L38 A43 S44 V45 T50 L51 T52	L37-V48 HydrophobicContact CB-CG1 3.63Å; L37-V48 HydrophobicContact CB-CG2 4.49Å; L38-V48 HydrophobicContact CD2-CB 4.13Å; L38-V48 HydrophobicContact CD2-CG1 3.72Å; L38-V48 HydrophobicContact CD2-CG2 4.27Å; L38-V48 HydrophobicContact CG-CG1 3.75Å; A43-V48 HydrophobicContact CB-CG2 3.62Å; S44-V48 WeakPolarHBondContact O-CG2 3.3Å; S44-V48 PolarHBondContact O-N 3.34Å; V45-V48 PolarHBondContact O-N 3.21Å; V48-T50 VanDerWaalsContact C-N 3.34Å; V48-T50 PolarHBondContact O-N 3.39Å; V48-L51 PolarHBondContact O-N 2.93Å; V48-T52 WeakPolarHBondContact O-CB 3.29Å; V48-T52 PolarHBondContact O-N 3.2Å; V48-T52 PolarHBondContact O-OG1 3.37Å
49	W	98.6	Very high	97.7	Very high	31 Å²	31	54 Å²	54	12%	0.117	31%	0.307	C	S	.	.	H	α-helix	trans	-59.6	-43.9	174.3	-83.8	101.5	0	0	0	112.5	H34 V45 V47 T52 N53 L109 L112 T113 Y116	H34-W49 AromaticContact CE1-CD1 3.97Å; H34-W49 AromaticContact CE1-CD2 3.57Å; H34-W49 AromaticContact CE1-CE2 3.46Å; H34-W49 VanDerWaalsContact CE1-CE2 3.46Å; H34-W49 AromaticContact CE1-CG 3.9Å; H34-W49 AromaticContact CE1-CZ2 3.86Å; H34-W49 AromaticContact CE1-NE1 3.71Å; H34-W49 AromaticContact NE2-CE2 3.62Å; H34-W49 AromaticContact NE2-CZ2 3.68Å; H34-W49 AromaticContact NE2-NE1 3.83Å; V45-W49 VanDerWaalsContact O-CD1 3.27Å; V45-W49 PolarHBondContact O-N 3.39Å; V47-W49 PolarHBondContact O-N 2.98Å; W49-T52 WeakPolarHBondContact O-CB 3.13Å; W49-T52 PolarHBondContact O-N 3.03Å; W49-N53 PolarHBondContact O-N 2.89Å; W49-L109 HydrophobicContact CE3-CD1 4.4Å; W49-L109 HydrophobicContact CZ3-CD1 4Å; W49-L112 HydrophobicContact CE3-CB 4.34Å; W49-L112 HydrophobicContact CH2-CB 4.14Å; W49-L112 HydrophobicContact CH2-CD1 4.3Å; W49-L112 HydrophobicContact CZ3-CB 3.73Å; W49-L112 HydrophobicContact CZ3-CD1 4.28Å; W49-T113 HydrophobicContact CB-CG2 4.07Å; W49-T113 PolarHBondContact O-OG1 2.9Å; W49-Y116 AromaticContact CD1-CG 3.69Å; W49-Y116 AromaticContact CD2-CD2 3.76Å; W49-Y116 HydrophobicContact CD2-CD2 3.76Å; W49-Y116 HydrophobicContact CD2-CG 4.13Å; W49-Y116 AromaticContact CE2-CD2 3.21Å; W49-Y116 AromaticContact CE2-CE2 3.67Å; W49-Y116 AromaticContact CE2-CG 3.59Å; W49-Y116 HydrophobicContact CE3-CD2 4.32Å; W49-Y116 HydrophobicContact CG-CD2 4.3Å; W49-Y116 HydrophobicContact CG-CG 4.2Å; W49-Y116 AromaticContact CH2-CD2 3.97Å; W49-Y116 HydrophobicContact CH2-CD2 3.97Å; W49-Y116 AromaticContact CH2-CE2 3.85Å; W49-Y116 HydrophobicContact CH2-CE2 3.85Å; W49-Y116 AromaticContact CZ2-CD2 3.34Å; W49-Y116 HydrophobicContact CZ2-CD2 3.34Å; W49-Y116 AromaticContact CZ2-CE2 3.27Å; W49-Y116 HydrophobicContact CZ2-CE2 3.27Å; W49-Y116 HydrophobicContact CZ2-CG 4.11Å; W49-Y116 AromaticContact CZ2-CZ 3.98Å; W49-Y116 HydrophobicContact CZ3-CD2 4.42Å; W49-Y116 AromaticContact NE1-CD1 3.73Å; W49-Y116 AromaticContact NE1-CD2 3.46Å; W49-Y116 AromaticContact NE1-CG 3.27Å; W49-Y116 VanDerWaalsContact NE1-CG 3.27Å
50	T	98.6	Very high	97.7	Very high	11 Å²	11	50.4 Å²	50.4	7%	0.067	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-48.3	176.8	-63.5	0	0	0	0	111.7	P46 V47 V48 T52 N53 L54 H123 V126 N127	P46-T50 PolarHBondContact O-N 3.24Å; P46-T50 PolarHBondContact O-OG1 3.49Å; P46-T50 VanDerWaalsContact O-OG1 3.07Å; V47-T50 PolarHBondContact O-N 3.42Å; V48-T50 VanDerWaalsContact C-N 3.34Å; V48-T50 PolarHBondContact O-N 3.39Å; T50-T52 VanDerWaalsContact C-N 3.3Å; T50-T52 PolarHBondContact O-N 2.85Å; T50-N53 PolarHBondContact O-N 3.47Å; T50-L54 HydrophobicContact CG2-CD1 4.04Å; T50-L54 HydrophobicContact CG2-CG 4.22Å; T50-L54 WeakPolarHBondContact O-CB 3.44Å; T50-L54 VanDerWaalsContact O-CG 3.29Å; T50-L54 WeakPolarHBondContact O-CG 3.21Å; T50-L54 PolarHBondContact O-N 3.38Å; T50-H123 PolarHBondContact OG1-ND1 3.36Å; T50-V126 HydrophobicContact CG2-CG1 4.27Å; T50-N127 PolarHBondContact OG1-ND2 3.31Å
51	L	98.6	Very high	97.6	Very high	63 Å²	63	50.3 Å²	50.3	33%	0.33	28%	0.276	S	S	.	.	H	α-helix	trans	-60.3	-40.5	177.1	-71.8	175.6	0	0	0	111.9	L37 V47 V48 N53 L54 I55	L37-L51 HydrophobicContact CD1-CB 3.93Å; L37-L51 HydrophobicContact CD2-CB 4.48Å; L37-L51 HydrophobicContact CD2-CD1 4.47Å; V47-L51 HydrophobicContact CG1-CD1 3.86Å; V47-L51 HydrophobicContact CG1-CG 4.2Å; V47-L51 WeakPolarHBondContact O-CB 3.25Å; V47-L51 WeakPolarHBondContact O-CG 3.34Å; V47-L51 PolarHBondContact O-N 3.49Å; V48-L51 PolarHBondContact O-N 2.93Å; L51-N53 PolarHBondContact O-N 3.21Å; L51-L54 PolarHBondContact O-N 3.45Å; L51-I55 WeakPolarHBondContact O-CB 3.28Å; L51-I55 VanDerWaalsContact O-CG1 3.27Å; L51-I55 WeakPolarHBondContact O-CG1 3.33Å; L51-I55 PolarHBondContact O-N 3.21Å
52	T	98.8	Very high	97.7	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-58	-49.2	175.9	-54.2	0	0	0	0	110.5	I30 L33 H34 L37 V48 W49 T50 H56 L109	I30-T52 HydrophobicContact CG2-CG2 4.36Å; L33-T52 HydrophobicContact CD2-CG2 4.37Å; H34-T52 HydrophobicContact CB-CG2 4.03Å; H34-T52 PolarHBondContact ND1-OG1 3.26Å; L37-T52 WeakPolarHBondContact CD1-OG1 3.39Å; V48-T52 WeakPolarHBondContact O-CB 3.29Å; V48-T52 PolarHBondContact O-N 3.2Å; V48-T52 PolarHBondContact O-OG1 3.37Å; W49-T52 WeakPolarHBondContact O-CB 3.13Å; W49-T52 PolarHBondContact O-N 3.03Å; T50-T52 VanDerWaalsContact C-N 3.3Å; T50-T52 PolarHBondContact O-N 2.85Å; T52-H56 WeakPolarHBondContact O-CB 3.48Å; T52-H56 PolarHBondContact O-N 3.46Å; T52-L109 HydrophobicContact CG2-CD1 4.31Å
53	N	98.5	Very high	97.6	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.5	-43	179.4	-173.5	53.6	0	0	0	112.4	W49 T50 L51 N57 L109 T113 N127	W49-N53 PolarHBondContact O-N 2.89Å; T50-N53 PolarHBondContact O-N 3.47Å; L51-N53 PolarHBondContact O-N 3.21Å; N53-N57 WeakPolarHBondContact O-CB 3.28Å; N53-N57 PolarHBondContact O-N 2.91Å; N53-N57 PolarHBondContact O-ND2 2.88Å; N53-N57 PolarHBondContact OD1-ND2 2.87Å; N53-L109 HydrophobicContact CB-CD2 4.38Å; N53-L109 HydrophobicContact CB-CG 4.27Å; N53-T113 HydrophobicContact CB-CG2 4.37Å; N53-N127 WeakPolarHBondContact CB-OD1 3.36Å; N53-N127 PolarHBondContact ND2-OD1 3.04Å
54	L	98.7	Very high	97.5	Very high	52 Å²	52	42.7 Å²	42.7	27%	0.272	23%	0.233	S	C	.	.	H	α-helix	trans	-63.5	-50.8	178.5	-69.9	-174.6	0	0	0	112.5	T50 L51 H56 N57 L58 V126 S130	T50-L54 HydrophobicContact CG2-CD1 4.04Å; T50-L54 HydrophobicContact CG2-CG 4.22Å; T50-L54 WeakPolarHBondContact O-CB 3.44Å; T50-L54 VanDerWaalsContact O-CG 3.29Å; T50-L54 WeakPolarHBondContact O-CG 3.21Å; T50-L54 PolarHBondContact O-N 3.38Å; L51-L54 PolarHBondContact O-N 3.45Å; L54-H56 VanDerWaalsContact C-N 3.35Å; L54-N57 PolarHBondContact O-N 3.34Å; L54-L58 VanDerWaalsContact O-CB 3.31Å; L54-L58 WeakPolarHBondContact O-CB 3.45Å; L54-L58 PolarHBondContact O-N 3.01Å; L54-V126 HydrophobicContact CD1-CG1 3.87Å; L54-V126 HydrophobicContact CD2-CG1 3.86Å; L54-V126 HydrophobicContact CG-CG1 4.31Å; L54-S130 WeakPolarHBondContact CD2-OG 3.05Å
55	I	98.7	Very high	97.3	Very high	61 Å²	61	40.6 Å²	40.6	31%	0.313	22%	0.217	S	C	.	.	H	α-helix	trans	-63.7	-44.7	-179.9	-68.2	166.5	0	0	0	109.7	L33 L37 L51 N57 L58 C59	L33-I55 HydrophobicContact CD1-CD1 4.31Å; L33-I55 HydrophobicContact CD1-CG2 4.08Å; L33-I55 HydrophobicContact CD2-CB 4.03Å; L33-I55 HydrophobicContact CD2-CG2 3.7Å; L37-I55 HydrophobicContact CD1-CD1 4.22Å; L37-I55 HydrophobicContact CD2-CD1 4.28Å; L51-I55 WeakPolarHBondContact O-CB 3.28Å; L51-I55 VanDerWaalsContact O-CG1 3.27Å; L51-I55 WeakPolarHBondContact O-CG1 3.33Å; L51-I55 PolarHBondContact O-N 3.21Å; I55-N57 PolarHBondContact O-N 2.97Å; I55-L58 PolarHBondContact O-N 3.26Å; I55-C59 WeakPolarHBondContact O-CB 3.5Å; I55-C59 PolarHBondContact O-N 3.49Å; I55-C59 PolarHBondContact O-SG 3.33Å
56	H	98.6	Very high	96.9	Very high	9 Å²	9	40.7 Å²	40.7	4%	0.042	21%	0.214	C	C	.	.	H	α-helix	trans	-54.7	-54.4	174.6	169.3	-93.4	0	0	0	111.7	Y26 T52 L54 L58 C59 M60 L109	Y26-H56 AromaticContact CE2-NE2 3.65Å; Y26-H56 AromaticContact CZ-NE2 3.43Å; Y26-H56 PolarHBondContact OH-CE1 3.34Å; Y26-H56 PolarHBondContact OH-NE2 3.3Å; T52-H56 WeakPolarHBondContact O-CB 3.48Å; T52-H56 PolarHBondContact O-N 3.46Å; L54-H56 VanDerWaalsContact C-N 3.35Å; H56-L58 VanDerWaalsContact C-N 3.33Å; H56-L58 PolarHBondContact O-N 2.98Å; H56-C59 PolarHBondContact O-N 3.35Å; H56-M60 WeakPolarHBondContact NE2-CG 3.31Å; H56-M60 WeakPolarHBondContact O-CB 3.27Å; H56-M60 VanDerWaalsContact O-CG 3.26Å; H56-M60 WeakPolarHBondContact O-CG 3.44Å; H56-M60 PolarHBondContact O-N 3.17Å; H56-L109 HydrophobicContact CB-CD2 3.72Å
57	N	98.5	Very high	96.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.6	-37	-176.7	-68.5	-20.6	0	0	0	112.1	N53 L54 I55 M60 Y61 P106 S130 V134	N53-N57 WeakPolarHBondContact O-CB 3.28Å; N53-N57 PolarHBondContact O-N 2.91Å; N53-N57 PolarHBondContact O-ND2 2.88Å; N53-N57 PolarHBondContact OD1-ND2 2.87Å; L54-N57 PolarHBondContact O-N 3.34Å; I55-N57 PolarHBondContact O-N 2.97Å; N57-M60 PolarHBondContact O-N 2.88Å; N57-Y61 VanDerWaalsContact O-CB 3.28Å; N57-Y61 WeakPolarHBondContact O-CB 3.49Å; N57-Y61 PolarHBondContact O-N 2.7Å; N57-P106 WeakPolarHBondContact OD1-CB 3.46Å; N57-S130 VanDerWaalsContact CB-OG 3.27Å; N57-S130 WeakPolarHBondContact CB-OG 3.5Å; N57-S130 PolarHBondContact ND2-OG 2.89Å; N57-V134 HydrophobicContact CB-CG1 4.33Å
58	L	98.2	Very high	96	Very high	103 Å²	103	41 Å²	41	54%	0.539	21%	0.212	S	C	.	.	H	α-helix	trans	-61.8	-52.4	174.2	177.4	61.4	0	0	0	111.2	L54 I55 H56 M60 Y61 L62	L54-L58 VanDerWaalsContact O-CB 3.31Å; L54-L58 WeakPolarHBondContact O-CB 3.45Å; L54-L58 PolarHBondContact O-N 3.01Å; I55-L58 PolarHBondContact O-N 3.26Å; H56-L58 VanDerWaalsContact C-N 3.33Å; H56-L58 PolarHBondContact O-N 2.98Å; L58-M60 VanDerWaalsContact C-N 3.31Å; L58-M60 PolarHBondContact O-N 3.47Å; L58-Y61 PolarHBondContact O-N 2.88Å; L58-L62 HydrophobicContact CD1-CD1 4.26Å; L58-L62 HydrophobicContact CD1-CG 4.32Å; L58-L62 HydrophobicContact CG-CD1 4.25Å; L58-L62 WeakPolarHBondContact O-CG 3.33Å; L58-L62 PolarHBondContact O-N 2.86Å
59	C	97.4	Very high	95.4	Very high	59 Å²	59	41.5 Å²	41.5	40%	0.399	22%	0.217	S	C	.	.	H	α-helix	trans	-58.5	-44.9	178	-71.6	0	0	0	0	111.3	I55 H56 Y61 L62 L63	I55-C59 WeakPolarHBondContact O-CB 3.5Å; I55-C59 PolarHBondContact O-N 3.49Å; I55-C59 PolarHBondContact O-SG 3.33Å; H56-C59 PolarHBondContact O-N 3.35Å; C59-Y61 VanDerWaalsContact C-N 3.35Å; C59-Y61 PolarHBondContact O-N 2.92Å; C59-L62 PolarHBondContact O-N 3.13Å; C59-L63 WeakPolarHBondContact O-CB 3.39Å; C59-L63 VanDerWaalsContact O-CG 3.29Å; C59-L63 WeakPolarHBondContact O-CG 3.27Å; C59-L63 PolarHBondContact O-N 3.12Å
60	M	96.8	Very high	94.6	Very high	15 Å²	15	40.8 Å²	40.8	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-65.4	-37.5	178.3	-69.7	-49.2	-63	0	0	112.5	Y26 H56 N57 L58 L64 L102 V134	Y26-M60 HydrophobicContact CD2-SD 4.38Å; Y26-M60 HydrophobicContact CE2-CE 4.14Å; Y26-M60 HydrophobicContact CE2-CG 4.35Å; Y26-M60 HydrophobicContact CE2-SD 3.52Å; Y26-M60 VanDerWaalsContact CE2-SD 3.52Å; H56-M60 WeakPolarHBondContact NE2-CG 3.31Å; H56-M60 WeakPolarHBondContact O-CB 3.27Å; H56-M60 VanDerWaalsContact O-CG 3.26Å; H56-M60 WeakPolarHBondContact O-CG 3.44Å; H56-M60 PolarHBondContact O-N 3.17Å; N57-M60 PolarHBondContact O-N 2.88Å; L58-M60 VanDerWaalsContact C-N 3.31Å; L58-M60 PolarHBondContact O-N 3.47Å; M60-L64 HydrophobicContact CE-CD1 3.42Å; M60-L64 VanDerWaalsContact CE-CD1 3.42Å; M60-L64 HydrophobicContact CE-CD2 4.33Å; M60-L64 HydrophobicContact CE-CG 3.78Å; M60-L64 WeakPolarHBondContact O-CB 3.36Å; M60-L64 WeakPolarHBondContact O-CG 3.31Å; M60-L64 PolarHBondContact O-N 3.24Å; M60-L102 HydrophobicContact CE-CD2 3.86Å; M60-V134 HydrophobicContact CB-CG2 4Å
61	Y	95.8	Very high	92.9	Very high	78 Å²	78	44.1 Å²	44.1	31%	0.306	24%	0.238	S	C	.	.	H	α-helix	trans	-62.2	-48.7	174.4	-179.8	-93.8	0	0	0	111.4	N57 L58 C59 H65 L66 T133 P137	N57-Y61 VanDerWaalsContact O-CB 3.28Å; N57-Y61 WeakPolarHBondContact O-CB 3.49Å; N57-Y61 PolarHBondContact O-N 2.7Å; L58-Y61 PolarHBondContact O-N 2.88Å; C59-Y61 VanDerWaalsContact C-N 3.35Å; C59-Y61 PolarHBondContact O-N 2.92Å; Y61-H65 HydrophobicContact CD2-CB 4.17Å; Y61-H65 HydrophobicContact CE2-CB 4.15Å; Y61-H65 WeakPolarHBondContact O-CA 3.33Å; Y61-H65 WeakPolarHBondContact O-CB 3.09Å; Y61-H65 PolarHBondContact O-N 3.32Å; Y61-L66 PolarHBondContact O-N 3.08Å; Y61-T133 WeakPolarHBondContact CD2-O 3.18Å; Y61-P137 HydrophobicContact CE2-CG 4.17Å
62	L	94.6	Very high	91.4	Very high	72 Å²	72	50.2 Å²	50.2	38%	0.377	26%	0.262	S	S	.	.	I	π-helix	trans	-59.7	-52.2	179	-65.8	173.5	0	0	0	111.1	L58 C59 L66 V67	L58-L62 HydrophobicContact CD1-CD1 4.26Å; L58-L62 HydrophobicContact CD1-CG 4.32Å; L58-L62 HydrophobicContact CG-CD1 4.25Å; L58-L62 WeakPolarHBondContact O-CG 3.33Å; L58-L62 PolarHBondContact O-N 2.86Å; C59-L62 PolarHBondContact O-N 3.13Å; L62-L66 HydrophobicContact CD2-CB 4.48Å; L62-L66 HydrophobicContact CD2-CD2 3.56Å; L62-L66 WeakPolarHBondContact O-CB 3.42Å; L62-L66 PolarHBondContact O-N 3.06Å; L62-L66 VanDerWaalsContact O-N 3.16Å; L62-V67 WeakPolarHBondContact O-CG2 3.32Å; L62-V67 PolarHBondContact O-N 2.77Å
63	L	93.1	Very high	89.9	Confident	105 Å²	105	53.6 Å²	53.6	55%	0.55	28%	0.278	S	S	.	.	I	π-helix	trans	-66.2	-41.3	-176.3	-68	173.2	0	0	0	113	C59 Y85	C59-L63 WeakPolarHBondContact O-CB 3.39Å; C59-L63 VanDerWaalsContact O-CG 3.29Å; C59-L63 WeakPolarHBondContact O-CG 3.27Å; C59-L63 PolarHBondContact O-N 3.12Å; L63-Y85 WeakPolarHBondContact O-CB 3.49Å
64	L	94.2	Very high	88.2	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.021	31%	0.313	C	S	.	.	I	π-helix	trans	-90.7	-33	-172.7	-65.3	-174.6	0	0	0	114	M60 T84 Y85 W86 L102	M60-L64 HydrophobicContact CE-CD1 3.42Å; M60-L64 VanDerWaalsContact CE-CD1 3.42Å; M60-L64 HydrophobicContact CE-CD2 4.33Å; M60-L64 HydrophobicContact CE-CG 3.78Å; M60-L64 WeakPolarHBondContact O-CB 3.36Å; M60-L64 WeakPolarHBondContact O-CG 3.31Å; M60-L64 PolarHBondContact O-N 3.24Å; L64-T84 VanDerWaalsContact O-CB 3.24Å; L64-T84 WeakPolarHBondContact O-CB 3.33Å; L64-T84 PolarHBondContact O-OG1 2.89Å; L64-Y85 HydrophobicContact CD2-CD1 3.69Å; L64-Y85 HydrophobicContact CD2-CE1 4.33Å; L64-W86 HydrophobicContact CB-CB 4.18Å; L64-W86 HydrophobicContact CD1-CE3 4.14Å; L64-W86 VanDerWaalsContact O-CB 3.25Å; L64-W86 WeakPolarHBondContact O-CB 3.27Å; L64-W86 PolarHBondContact O-N 3.35Å; L64-L102 HydrophobicContact CD1-CD1 4.19Å; L64-L102 HydrophobicContact CD2-CD1 4.31Å
65	H	92.9	Very high	86.3	Confident	18 Å²	18	62.7 Å²	62.7	8%	0.083	34%	0.338	C	S	.	.	I	π-helix	trans	-119.8	-14.9	-167	-58.8	-61.4	0	0	0	114	Y61 T84 W86 P137 N151	Y61-H65 HydrophobicContact CD2-CB 4.17Å; Y61-H65 HydrophobicContact CE2-CB 4.15Å; Y61-H65 WeakPolarHBondContact O-CA 3.33Å; Y61-H65 WeakPolarHBondContact O-CB 3.09Å; Y61-H65 PolarHBondContact O-N 3.32Å; H65-T84 VanDerWaalsContact O-CG2 3.27Å; H65-T84 WeakPolarHBondContact O-CG2 3.26Å; H65-W86 AromaticContact CE1-CD1 3.78Å; H65-W86 AromaticContact CE1-CG 3.54Å; H65-P137 HydrophobicContact CB-CB 4.49Å; H65-N151 PolarHBondContact O-ND2 3.42Å
66	L	90.1	Very high	84.4	Confident	78 Å²	78	62 Å²	62	41%	0.408	34%	0.335	S	S	.	.	I	π-helix	trans	-102.4	-45	174.5	-166.2	62	0	0	0	112.3	Y61 L62 K68 N151	Y61-L66 PolarHBondContact O-N 3.08Å; L62-L66 HydrophobicContact CD2-CB 4.48Å; L62-L66 HydrophobicContact CD2-CD2 3.56Å; L62-L66 WeakPolarHBondContact O-CB 3.42Å; L62-L66 PolarHBondContact O-N 3.06Å; L62-L66 VanDerWaalsContact O-N 3.16Å; L66-K68 PolarHBondContact O-N 3.04Å; L66-N151 PolarHBondContact O-ND2 2.96Å; L66-N151 VanDerWaalsContact O-ND2 3.13Å
67	V	89.1	Confident	82.6	Confident	64 Å²	64	70 Å²	70	39%	0.388	37%	0.372	S	S	.	.			trans	-67.5	129.6	178.8	179	0	0	0	0	110.8	L62 T84 Y85	L62-V67 WeakPolarHBondContact O-CG2 3.32Å; L62-V67 PolarHBondContact O-N 2.77Å; V67-T84 CarbonylContact O-C 3.6Å; V67-T84 VanDerWaalsContact O-CA 3.24Å; V67-T84 WeakPolarHBondContact O-CA 3.41Å; V67-Y85 PolarHBondContact O-N 2.73Å; V67-Y85 VanDerWaalsContact O-N 3.08Å
68	K	87.8	Confident	81.3	Confident	37 Å²	37	72.5 Å²	72.5	16%	0.161	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-122.7	164.1	-179.1	-78.1	177.2	162	-178.1	0	112.6	L66 F82 Y83 T84 N151 Y153	L66-K68 PolarHBondContact O-N 3.04Å; K68-F82 VanDerWaalsContact CE-O 3.23Å; K68-F82 WeakPolarHBondContact CE-O 3.36Å; K68-Y83 WeakPolarHBondContact CA-O 3.39Å; K68-T84 HydrophobicContact CG-CG2 4.23Å; K68-N151 VanDerWaalsContact CD-OD1 3.28Å; K68-N151 WeakPolarHBondContact CD-OD1 2.99Å; K68-N151 WeakPolarHBondContact CE-ND2 3.33Å; K68-N151 WeakPolarHBondContact CE-O 3.43Å; K68-N151 WeakPolarHBondContact CE-OD1 3.41Å; K68-N151 VanDerWaalsContact NZ-C 3.3Å; K68-N151 PolarHBondContact NZ-O 2.91Å; K68-N151 PolarHBondContact NZ-OD1 3.05Å; K68-Y153 PolarHBondContact NZ-O 3.03Å; K68-Y153 PolarHBondContact NZ-OXT 3.17Å
69	G	86.1	Confident	80.4	Confident	10 Å²	10	75.1 Å²	75.1	10%	0.103	40%	0.397	C	S	.	.	S	Bend	trans	72.6	-162.6	175.8	0	0	0	0	0	112.9	N13 A80 Y83 Q88	N13-G69 PolarHBondContact ND2-O 3.49Å; G69-A80 WeakPolarHBondContact CA-O 3.43Å; G69-Y83 PolarHBondContact N-O 3.46Å; G69-Q88 PolarHBondContact O-NE2 3.37Å
70	T	81.4	Confident	79.6	Confident	17 Å²	17	72.7 Å²	72.7	10%	0.104	38%	0.381	C	S	.	.			trans	-122.6	88.6	-175.9	44.3	0	0	0	0	108.8	N11 F72 E73	N11-T70 HydrophobicContact CB-CG2 4.22Å; N11-T70 WeakPolarHBondContact OD1-CG2 3.29Å; T70-F72 PolarHBondContact O-N 2.71Å; T70-E73 PolarHBondContact O-N 3.43Å
71	P	64.3	Low	79	Confident	80 Å²	80	78.1 Å²	78.1	52%	0.519	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-24	-165.6	-24.5	32	0	0	0	115.5
72	F	65.9	Low	78.5	Confident	191 Å²	191	78 Å²	78	84%	0.838	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.2	2.5	-172.9	-53.6	-68.6	0	0	0	113.6	T70	T70-F72 PolarHBondContact O-N 2.71Å
73	E	67.7	Low	78.3	Confident	73 Å²	73	78.7 Å²	78.7	34%	0.341	40%	0.4	S	S	.	.	S	Bend	trans	-94	156.1	171.9	-68.4	-62.9	150.1	0	0	109.7	V10 P12 T70	V10-E73 WeakPolarHBondContact O-CG 3.34Å; P12-E73 WeakPolarHBondContact CD-OE1 3.36Å; P12-E73 HydrophobicContact CG-CG 4.26Å; T70-E73 PolarHBondContact O-N 3.43Å
74	T	63	Low	78.3	Confident	120 Å²	120	73.9 Å²	73.9	74%	0.736	38%	0.376	S	S	*	.	S	Bend	trans	-52.8	146.7	170.8	8.6	0	0	0	0	109.2	D76	T74-D76 VanDerWaalsContact C-N 3.34Å; T74-D76 WeakPolarHBondContact O-CA 3.35Å; T74-D76 PolarHBondContact O-N 2.98Å
75	P	59.2	Low	78.2	Confident	122 Å²	122	75.3 Å²	75.3	79%	0.792	38%	0.381	S	S	*	.			trans	-49.2	96.4	-171.4	-27.3	33.6	0	0	0	111.8	Q77	P75-Q77 PolarHBondContact O-N 3.2Å; P75-Q77 VanDerWaalsContact O-N 3.08Å
76	D	58	Low	78.3	Confident	48 Å²	48	74.8 Å²	74.8	26%	0.257	38%	0.378	S	S	.	.			trans	-74.5	110.4	-173.6	-176.3	12.2	0	0	0	106.8	T74 S78 A80	T74-D76 VanDerWaalsContact C-N 3.34Å; T74-D76 WeakPolarHBondContact O-CA 3.35Å; T74-D76 PolarHBondContact O-N 2.98Å; D76-S78 PolarHBondContact O-N 2.92Å; D76-S78 WeakPolarHBondContact OD1-CB 3.49Å; D76-S78 PolarHBondContact OD1-N 3.21Å; D76-S78 PolarHBondContact OD1-OG 3.4Å; D76-S78 WeakPolarHBondContact OD2-CB 3.14Å; D76-S78 PolarHBondContact OD2-OG 3.29Å; D76-A80 WeakPolarHBondContact OD2-CB 3.41Å
77	Q	59.7	Low	78.4	Confident	176 Å²	176	71.6 Å²	71.6	82%	0.822	36%	0.361	S	S	*	.			trans	-75.3	0.5	175	-65.7	-166.2	-6.9	0	0	112	P75	P75-Q77 PolarHBondContact O-N 3.2Å; P75-Q77 VanDerWaalsContact O-N 3.08Å
78	S	72.4	Confident	78.6	Confident	53 Å²	53	69 Å²	69	37%	0.371	35%	0.345	S	S	.	.	S	Bend	trans	-73.4	178.3	178.9	93.9	0	0	0	0	113.5	D76 A80 R81	D76-S78 PolarHBondContact O-N 2.92Å; D76-S78 WeakPolarHBondContact OD1-CB 3.49Å; D76-S78 PolarHBondContact OD1-N 3.21Å; D76-S78 PolarHBondContact OD1-OG 3.4Å; D76-S78 WeakPolarHBondContact OD2-CB 3.14Å; D76-S78 PolarHBondContact OD2-OG 3.29Å; S78-A80 PolarHBondContact O-N 2.95Å; S78-A80 VanDerWaalsContact O-N 3.12Å; S78-A80 PolarHBondContact OG-N 2.99Å; S78-A80 VanDerWaalsContact OG-N 3.16Å; S78-R81 WeakPolarHBondContact O-CG 3.23Å; S78-R81 PolarHBondContact O-N 3.35Å
79	K	78	Confident	78.8	Confident	157 Å²	157	67.3 Å²	67.3	68%	0.683	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-58.9	-20.7	176.3	-63.6	-175.5	178.9	179.9	0	113.2	R81 F82 Y83	K79-R81 PolarHBondContact O-N 2.94Å; K79-F82 PolarHBondContact O-N 3.47Å; K79-F82 VanDerWaalsContact O-N 3.14Å; K79-Y83 HydrophobicContact CB-CE2 4.05Å; K79-Y83 WeakPolarHBondContact O-CD2 3.26Å
80	A	81.9	Confident	79.2	Confident	9 Å²	9	67.5 Å²	67.5	7%	0.074	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-58.5	-31.1	-178.5	0	0	0	0	0	113.1	G69 D76 S78 F82 Y83 Q88	G69-A80 WeakPolarHBondContact CA-O 3.43Å; D76-A80 WeakPolarHBondContact OD2-CB 3.41Å; S78-A80 PolarHBondContact O-N 2.95Å; S78-A80 VanDerWaalsContact O-N 3.12Å; S78-A80 PolarHBondContact OG-N 2.99Å; S78-A80 VanDerWaalsContact OG-N 3.16Å; A80-F82 PolarHBondContact O-N 3.35Å; A80-F82 VanDerWaalsContact O-N 3.14Å; A80-Y83 PolarHBondContact O-N 3.04Å; A80-Y83 VanDerWaalsContact O-N 3.1Å; A80-Q88 PolarHBondContact O-NE2 3.17Å
81	R	83.7	Confident	79.6	Confident	129 Å²	129	73.2 Å²	73.2	49%	0.487	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-58.3	-27.8	178.1	80.9	-175.8	-145.1	-172.3	6.3	113.9	S78 K79	S78-R81 WeakPolarHBondContact O-CG 3.23Å; S78-R81 PolarHBondContact O-N 3.35Å; K79-R81 PolarHBondContact O-N 2.94Å
82	F	86.5	Confident	80.9	Confident	76 Å²	76	70.3 Å²	70.3	33%	0.333	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-93.7	-11.6	-177.5	-60.3	-69.1	0	0	0	113.3	K68 K79 A80 R146 Y153	K68-F82 VanDerWaalsContact CE-O 3.23Å; K68-F82 WeakPolarHBondContact CE-O 3.36Å; K79-F82 PolarHBondContact O-N 3.47Å; K79-F82 VanDerWaalsContact O-N 3.14Å; A80-F82 PolarHBondContact O-N 3.35Å; A80-F82 VanDerWaalsContact O-N 3.14Å; F82-R146 PolarHBondContact O-NH2 3.08Å; F82-Y153 WeakPolarHBondContact CD1-OXT 3.08Å
83	Y	89.9	Confident	82.2	Confident	85 Å²	85	65.4 Å²	65.4	33%	0.333	33%	0.327	S	S	.	.	S	Bend	trans	-94.7	141.8	-177.8	-70.4	-48.5	0	0	0	111.4	K68 G69 K79 A80 E87 Q88	K68-Y83 WeakPolarHBondContact CA-O 3.39Å; G69-Y83 PolarHBondContact N-O 3.46Å; K79-Y83 HydrophobicContact CB-CE2 4.05Å; K79-Y83 WeakPolarHBondContact O-CD2 3.26Å; A80-Y83 PolarHBondContact O-N 3.04Å; A80-Y83 VanDerWaalsContact O-N 3.1Å; Y83-E87 VanDerWaalsContact CA-OE2 3.29Å; Y83-E87 WeakPolarHBondContact CA-OE2 3.24Å; Y83-E87 HydrophobicContact CD1-CB 4.03Å; Y83-E87 WeakPolarHBondContact CD1-OE2 3.24Å; Y83-E87 HydrophobicContact CG-CB 4.21Å; Y83-Q88 PolarHBondContact O-NE2 3.46Å
84	T	92.6	Very high	83.5	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.031	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-72.5	165.7	172.1	79.6	0	0	0	0	110.4	L64 H65 V67 K68 W86 E87 Q88	L64-T84 VanDerWaalsContact O-CB 3.24Å; L64-T84 WeakPolarHBondContact O-CB 3.33Å; L64-T84 PolarHBondContact O-OG1 2.89Å; H65-T84 VanDerWaalsContact O-CG2 3.27Å; H65-T84 WeakPolarHBondContact O-CG2 3.26Å; V67-T84 CarbonylContact O-C 3.6Å; V67-T84 VanDerWaalsContact O-CA 3.24Å; V67-T84 WeakPolarHBondContact O-CA 3.41Å; K68-T84 HydrophobicContact CG-CG2 4.23Å; T84-W86 PolarHBondContact O-N 3.3Å; T84-W86 PolarHBondContact OG1-N 2.96Å; T84-E87 PolarHBondContact N-OE2 2.95Å; T84-E87 PolarHBondContact O-N 2.74Å; T84-E87 PolarHBondContact OG1-N 2.87Å; T84-Q88 WeakPolarHBondContact O-CG 3.3Å; T84-Q88 PolarHBondContact O-N 3.16Å
85	Y	92.1	Very high	84.9	Confident	34 Å²	34	65.1 Å²	65.1	13%	0.133	32%	0.315	C	S	.	.	H	α-helix	trans	-55.1	-42	175.9	-168.7	-84.1	0	0	0	112.2	N13 V16 L63 L64 V67 E87 Q88 M89	N13-Y85 HydrophobicContact CB-CD2 3.85Å; N13-Y85 HydrophobicContact CB-CE2 3.68Å; N13-Y85 WeakPolarHBondContact OD1-CD2 3.46Å; N13-Y85 WeakPolarHBondContact OD1-CE2 3.39Å; V16-Y85 WeakPolarHBondContact CB-OH 3.44Å; V16-Y85 VanDerWaalsContact CG1-OH 3.28Å; V16-Y85 WeakPolarHBondContact CG1-OH 3.45Å; L63-Y85 WeakPolarHBondContact O-CB 3.49Å; L64-Y85 HydrophobicContact CD2-CD1 3.69Å; L64-Y85 HydrophobicContact CD2-CE1 4.33Å; V67-Y85 PolarHBondContact O-N 2.73Å; V67-Y85 VanDerWaalsContact O-N 3.08Å; Y85-E87 VanDerWaalsContact C-N 3.3Å; Y85-E87 PolarHBondContact O-N 2.93Å; Y85-Q88 PolarHBondContact O-N 3.47Å; Y85-M89 PolarHBondContact O-N 2.65Å
86	W	94.6	Very high	86.6	Confident	6 Å²	6	60.7 Å²	60.7	2%	0.023	29%	0.286	C	S	.	.	H	α-helix	trans	-59.3	-38.7	174.7	178.2	-103.9	0	0	0	113.3	L64 H65 T84 M89 R99 L102 K138	L64-W86 HydrophobicContact CB-CB 4.18Å; L64-W86 HydrophobicContact CD1-CE3 4.14Å; L64-W86 VanDerWaalsContact O-CB 3.25Å; L64-W86 WeakPolarHBondContact O-CB 3.27Å; L64-W86 PolarHBondContact O-N 3.35Å; H65-W86 AromaticContact CE1-CD1 3.78Å; H65-W86 AromaticContact CE1-CG 3.54Å; T84-W86 PolarHBondContact O-N 3.3Å; T84-W86 PolarHBondContact OG1-N 2.96Å; W86-M89 HydrophobicContact CD2-CE 4.13Å; W86-M89 HydrophobicContact CE3-CE 3.3Å; W86-M89 HydrophobicContact CH2-CE 4.22Å; W86-M89 HydrophobicContact CZ3-CE 3.36Å; W86-R99 HydrophobicContact CH2-CB 3.67Å; W86-R99 HydrophobicContact CH2-CG 3.7Å; W86-R99 HydrophobicContact CZ2-CB 4.3Å; W86-R99 HydrophobicContact CZ2-CG 4.09Å; W86-R99 HydrophobicContact CZ3-CB 4.26Å; W86-R99 HydrophobicContact CZ3-CG 4.04Å; W86-R99 VanDerWaalsContact NE1-NH1 3.17Å; W86-R99 PolarHBondContact O-NH1 3.14Å; W86-R99 PolarHBondContact O-NH2 3.2Å; W86-L102 HydrophobicContact CZ3-CB 4.07Å; W86-L102 HydrophobicContact CZ3-CD1 4.24Å; W86-K138 HydrophobicContact CD2-CG 4.06Å; W86-K138 HydrophobicContact CE3-CG 4.25Å; W86-K138 HydrophobicContact CH2-CB 4.08Å; W86-K138 HydrophobicContact CH2-CD 3.94Å; W86-K138 HydrophobicContact CH2-CG 3.84Å; W86-K138 HydrophobicContact CZ2-CB 3.54Å; W86-K138 HydrophobicContact CZ2-CD 4.24Å; W86-K138 HydrophobicContact CZ2-CG 3.64Å; W86-K138 HydrophobicContact CZ3-CD 4.12Å; W86-K138 HydrophobicContact CZ3-CG 4.14Å
87	E	93.1	Very high	88.4	Confident	12 Å²	12	61.3 Å²	61.3	6%	0.056	30%	0.298	C	S	.	.	H	α-helix	trans	-73.2	-37	-177.9	-68.1	172.2	146.2	0	0	111.3	Y83 T84 Y85 G92 H143 G144 R146	Y83-E87 VanDerWaalsContact CA-OE2 3.29Å; Y83-E87 WeakPolarHBondContact CA-OE2 3.24Å; Y83-E87 HydrophobicContact CD1-CB 4.03Å; Y83-E87 WeakPolarHBondContact CD1-OE2 3.24Å; Y83-E87 HydrophobicContact CG-CB 4.21Å; T84-E87 PolarHBondContact N-OE2 2.95Å; T84-E87 PolarHBondContact O-N 2.74Å; T84-E87 PolarHBondContact OG1-N 2.87Å; Y85-E87 VanDerWaalsContact C-N 3.3Å; Y85-E87 PolarHBondContact O-N 2.93Å; E87-G92 WeakPolarHBondContact O-CA 3.36Å; E87-H143 PolarHBondContact O-CE1 3.13Å; E87-G144 WeakPolarHBondContact OE1-CA 3.35Å; E87-G144 PolarHBondContact OE1-N 2.7Å; E87-R146 IonicContact OE1-CZ 3.96Å; E87-R146 IonicContact OE1-NH1 3.49Å; E87-R146 PolarHBondContact OE1-NH1 3.31Å; E87-R146 IonicContact OE1-NH2 3.57Å; E87-R146 PolarHBondContact OE1-NH2 3.26Å; E87-R146 IonicContact OE2-CZ 3.33Å; E87-R146 IonicContact OE2-NH1 2.73Å; E87-R146 PolarHBondContact OE2-NH1 3.12Å; E87-R146 IonicContact OE2-NH2 3.53Å; E87-R146 PolarHBondContact OE2-NH2 3.25Å
88	Q	92.5	Very high	90.1	Very high	10 Å²	10	53 Å²	53	5%	0.047	26%	0.259	C	S	.	.	H	α-helix	trans	-72.7	-30.8	178.5	-63.2	177.1	48.2	0	0	113.4	N11 N13 G69 A80 Y83 T84 Y85 D90 Y91	N11-Q88 PolarHBondContact ND2-OE1 2.96Å; N11-Q88 PolarHBondContact OD1-OE1 3.25Å; N13-Q88 HydrophobicContact CB-CB 4.1Å; N13-Q88 PolarHBondContact ND2-OE1 3.22Å; G69-Q88 PolarHBondContact O-NE2 3.37Å; A80-Q88 PolarHBondContact O-NE2 3.17Å; Y83-Q88 PolarHBondContact O-NE2 3.46Å; T84-Q88 WeakPolarHBondContact O-CG 3.3Å; T84-Q88 PolarHBondContact O-N 3.16Å; Y85-Q88 PolarHBondContact O-N 3.47Å; Q88-D90 PolarHBondContact O-N 2.9Å; Q88-Y91 PolarHBondContact O-N 2.95Å; Q88-Y91 VanDerWaalsContact O-N 3.15Å
89	M	92.9	Very high	91.2	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-54.6	138.2	-175.3	-177.3	172.4	52.1	0	0	112.6	N13 M17 Y85 W86 Y91 G92 R99 L102	N13-M89 WeakPolarHBondContact O-CA 3.32Å; M17-M89 HydrophobicContact CB-CG 4.43Å; M17-M89 HydrophobicContact CB-SD 3.63Å; M17-M89 HydrophobicContact CG-SD 3.83Å; Y85-M89 PolarHBondContact O-N 2.65Å; W86-M89 HydrophobicContact CD2-CE 4.13Å; W86-M89 HydrophobicContact CE3-CE 3.3Å; W86-M89 HydrophobicContact CH2-CE 4.22Å; W86-M89 HydrophobicContact CZ3-CE 3.36Å; M89-Y91 PolarHBondContact O-N 2.98Å; M89-Y91 VanDerWaalsContact O-N 3.13Å; M89-G92 PolarHBondContact O-N 3.36Å; M89-R99 HydrophobicContact CE-CB 4.38Å; M89-R99 HydrophobicContact CE-CG 3.39Å; M89-R99 PolarHBondContact O-NH2 3.25Å; M89-L102 HydrophobicContact CE-CD1 3.86Å; M89-L102 HydrophobicContact SD-CD1 3.85Å
90	D	93	Very high	92.1	Very high	14 Å²	14	48.3 Å²	48.3	8%	0.075	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	49.1	36.7	-177.4	-55.6	-45	0	0	0	113.5	T14 N18 Q88 G92 V93 T96	T14-D90 VanDerWaalsContact O-CA 3.28Å; T14-D90 WeakPolarHBondContact O-CA 3.24Å; T14-D90 PolarHBondContact O-N 3.48Å; N18-D90 PolarHBondContact ND2-OD1 3.25Å; N18-D90 PolarHBondContact OD1-OD1 2.95Å; Q88-D90 PolarHBondContact O-N 2.9Å; D90-G92 PolarHBondContact O-N 2.85Å; D90-G92 VanDerWaalsContact O-N 3.11Å; D90-V93 VanDerWaalsContact O-CB 3.31Å; D90-V93 WeakPolarHBondContact O-CB 3.18Å; D90-V93 WeakPolarHBondContact O-CG2 3.44Å; D90-V93 PolarHBondContact O-N 3.01Å; D90-T96 HydrophobicContact CB-CG2 3.75Å; D90-T96 VanDerWaalsContact OD2-CB 3.26Å; D90-T96 WeakPolarHBondContact OD2-CB 3.41Å; D90-T96 PolarHBondContact OD2-OG1 2.98Å
91	Y	91.1	Very high	92.8	Very high	137 Å²	137	49.4 Å²	49.4	54%	0.537	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	55.6	28.2	-177.5	-48.3	-85.6	0	0	0	113.7	E9 T14 R15 Q88 M89 V93	E9-Y91 PolarHBondContact OE1-OH 3.2Å; E9-Y91 PolarHBondContact OE2-OH 2.85Å; T14-Y91 HydrophobicContact CG2-CD1 3.67Å; T14-Y91 HydrophobicContact CG2-CE1 3.68Å; T14-Y91 HydrophobicContact CG2-CG 4.33Å; R15-Y91 WeakPolarHBondContact CD-OH 3.41Å; R15-Y91 HydrophobicContact CG-CE2 4.29Å; Q88-Y91 PolarHBondContact O-N 2.95Å; Q88-Y91 VanDerWaalsContact O-N 3.15Å; M89-Y91 PolarHBondContact O-N 2.98Å; M89-Y91 VanDerWaalsContact O-N 3.13Å; Y91-V93 VanDerWaalsContact C-N 3.26Å; Y91-V93 PolarHBondContact O-N 3.11Å
92	G	91.3	Very high	93.4	Very high	19 Å²	19	43.3 Å²	43.3	20%	0.196	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	79.1	0.8	-177.1	0	0	0	0	0	114.9	E87 M89 D90 Q94	E87-G92 WeakPolarHBondContact O-CA 3.36Å; M89-G92 PolarHBondContact O-N 3.36Å; D90-G92 PolarHBondContact O-N 2.85Å; D90-G92 VanDerWaalsContact O-N 3.11Å; G92-Q94 PolarHBondContact O-N 3.37Å; G92-Q94 PolarHBondContact O-NE2 3.44Å
93	V	93.8	Very high	93.9	Very high	87 Å²	87	41.5 Å²	41.5	53%	0.527	21%	0.207	S	C	.	.			trans	-64.2	127.7	176.3	178.7	0	0	0	0	109.5	D90 Y91 T96 R99	D90-V93 VanDerWaalsContact O-CB 3.31Å; D90-V93 WeakPolarHBondContact O-CB 3.18Å; D90-V93 WeakPolarHBondContact O-CG2 3.44Å; D90-V93 PolarHBondContact O-N 3.01Å; Y91-V93 VanDerWaalsContact C-N 3.26Å; Y91-V93 PolarHBondContact O-N 3.11Å; V93-T96 HydrophobicContact CB-CG2 4.01Å; V93-T96 HydrophobicContact CG1-CG2 3.79Å; V93-T96 WeakPolarHBondContact O-CG2 3.46Å; V93-R99 WeakPolarHBondContact O-CD 3.44Å; V93-R99 PolarHBondContact O-NE 3.14Å
94	Q	93.1	Very high	94.3	Very high	50 Å²	50	42 Å²	42	23%	0.234	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	157.5	-177.2	-57.6	-57.8	-42.7	0	0	111.8	G92 T96 P140	G92-Q94 PolarHBondContact O-N 3.37Å; G92-Q94 PolarHBondContact O-NE2 3.44Å; Q94-T96 PolarHBondContact O-N 2.73Å; Q94-T96 VanDerWaalsContact O-N 3.1Å; Q94-P140 HydrophobicContact CB-CG 4.49Å; Q94-P140 HydrophobicContact CG-CB 4.16Å; Q94-P140 HydrophobicContact CG-CG 4.32Å
95	F	92.8	Very high	94.6	Very high	138 Å²	138	42.5 Å²	42.5	61%	0.605	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	23.7	172.9	-53.3	-67.9	0	0	0	116.5	K100 P140	F95-K100 WeakPolarHBondContact O-CE 3.26Å; F95-K100 PolarHBondContact O-NZ 3.02Å; F95-P140 HydrophobicContact CE1-CG 4.34Å; F95-P140 HydrophobicContact CE2-CG 3.86Å; F95-P140 HydrophobicContact CZ-CG 3.57Å
96	T	95.9	Very high	94.9	Very high	29 Å²	29	40.9 Å²	40.9	18%	0.178	21%	0.212	C	C	.	.			trans	-64.5	166	169	61.1	0	0	0	0	111.6	D90 V93 Q94 S98 R99 K100	D90-T96 HydrophobicContact CB-CG2 3.75Å; D90-T96 VanDerWaalsContact OD2-CB 3.26Å; D90-T96 WeakPolarHBondContact OD2-CB 3.41Å; D90-T96 PolarHBondContact OD2-OG1 2.98Å; V93-T96 HydrophobicContact CB-CG2 4.01Å; V93-T96 HydrophobicContact CG1-CG2 3.79Å; V93-T96 WeakPolarHBondContact O-CG2 3.46Å; Q94-T96 PolarHBondContact O-N 2.73Å; Q94-T96 VanDerWaalsContact O-N 3.1Å; T96-S98 VanDerWaalsContact C-N 3.33Å; T96-S98 PolarHBondContact O-N 3.29Å; T96-R99 PolarHBondContact O-N 3.41Å; T96-R99 WeakPolarHBondContact OG1-CB 3.43Å; T96-R99 VanDerWaalsContact OG1-CG 3.32Å; T96-R99 WeakPolarHBondContact OG1-CG 3.43Å; T96-R99 PolarHBondContact OG1-N 3.1Å; T96-K100 WeakPolarHBondContact O-CB 3.49Å; T96-K100 WeakPolarHBondContact O-CG 3.19Å; T96-K100 PolarHBondContact O-N 2.84Å
97	A	96	Very high	95.1	Very high	61 Å²	61	43.4 Å²	43.4	50%	0.504	23%	0.225	S	C	.	.	H	α-helix	trans	-59.4	-44	-179.9	0	0	0	0	0	111.9	W23 K100 F101	W23-A97 HydrophobicContact CH2-CB 3.94Å; W23-A97 HydrophobicContact CZ2-CB 4.33Å; A97-K100 PolarHBondContact O-N 2.98Å; A97-F101 WeakPolarHBondContact O-CB 3.29Å; A97-F101 PolarHBondContact O-N 2.85Å
98	S	94.9	Very high	95.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-44.6	177.6	-62.2	0	0	0	0	112.6	M17 N18 T96 F101 L102	M17-S98 PolarHBondContact O-OG 3.25Å; N18-S98 PolarHBondContact OD1-OG 3.12Å; T96-S98 VanDerWaalsContact C-N 3.33Å; T96-S98 PolarHBondContact O-N 3.29Å; S98-F101 PolarHBondContact O-N 3.05Å; S98-L102 WeakPolarHBondContact O-CG 3.33Å; S98-L102 PolarHBondContact O-N 2.91Å
99	R	95.6	Very high	95.6	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.015	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-42.9	174.9	-74.9	178.2	-178.2	-81.3	1.5	112.3	W86 M89 V93 T96 T103	W86-R99 HydrophobicContact CH2-CB 3.67Å; W86-R99 HydrophobicContact CH2-CG 3.7Å; W86-R99 HydrophobicContact CZ2-CB 4.3Å; W86-R99 HydrophobicContact CZ2-CG 4.09Å; W86-R99 HydrophobicContact CZ3-CB 4.26Å; W86-R99 HydrophobicContact CZ3-CG 4.04Å; W86-R99 VanDerWaalsContact NE1-NH1 3.17Å; W86-R99 PolarHBondContact O-NH1 3.14Å; W86-R99 PolarHBondContact O-NH2 3.2Å; M89-R99 HydrophobicContact CE-CB 4.38Å; M89-R99 HydrophobicContact CE-CG 3.39Å; M89-R99 PolarHBondContact O-NH2 3.25Å; V93-R99 WeakPolarHBondContact O-CD 3.44Å; V93-R99 PolarHBondContact O-NE 3.14Å; T96-R99 PolarHBondContact O-N 3.41Å; T96-R99 WeakPolarHBondContact OG1-CB 3.43Å; T96-R99 VanDerWaalsContact OG1-CG 3.32Å; T96-R99 WeakPolarHBondContact OG1-CG 3.43Å; T96-R99 PolarHBondContact OG1-N 3.1Å; R99-T103 WeakPolarHBondContact O-CB 3.15Å; R99-T103 PolarHBondContact O-N 3.19Å; R99-T103 PolarHBondContact O-OG1 3.36Å
100	K	96.6	Very high	95.9	Very high	108 Å²	108	47.8 Å²	47.8	47%	0.47	25%	0.249	S	C	.	.	H	α-helix	trans	-61.9	-47.5	175.9	-77.3	173.1	176	163.7	0	110.8	F95 T96 A97 L102 T103 I104	F95-K100 WeakPolarHBondContact O-CE 3.26Å; F95-K100 PolarHBondContact O-NZ 3.02Å; T96-K100 WeakPolarHBondContact O-CB 3.49Å; T96-K100 WeakPolarHBondContact O-CG 3.19Å; T96-K100 PolarHBondContact O-N 2.84Å; A97-K100 PolarHBondContact O-N 2.98Å; K100-L102 PolarHBondContact O-N 3.43Å; K100-T103 PolarHBondContact O-N 2.97Å; K100-T103 VanDerWaalsContact O-N 3.1Å; K100-I104 HydrophobicContact CB-CD1 4.28Å; K100-I104 WeakPolarHBondContact O-CB 3.39Å; K100-I104 VanDerWaalsContact O-CG1 3.23Å; K100-I104 WeakPolarHBondContact O-CG1 3.28Å; K100-I104 PolarHBondContact O-N 2.94Å
101	F	96.8	Very high	96.1	Very high	33 Å²	33	51.8 Å²	51.8	15%	0.145	27%	0.269	C	S	.	.	H	α-helix	trans	-54.3	-54.2	176.5	175.3	-103.7	0	0	0	111.6	W23 Y26 L27 A97 S98 T103 I104 T105	W23-F101 HydrophobicContact CB-CE1 3.91Å; W23-F101 HydrophobicContact CB-CE2 4.22Å; W23-F101 HydrophobicContact CB-CZ 3.71Å; W23-F101 AromaticContact CD1-CD1 3.93Å; W23-F101 AromaticContact CD1-CE1 3.89Å; W23-F101 HydrophobicContact CD2-CB 4.47Å; W23-F101 HydrophobicContact CD2-CD1 4.04Å; W23-F101 HydrophobicContact CD2-CD2 4.13Å; W23-F101 HydrophobicContact CD2-CE1 4.26Å; W23-F101 HydrophobicContact CD2-CE2 4.36Å; W23-F101 AromaticContact CD2-CG 3.95Å; W23-F101 HydrophobicContact CD2-CG 3.95Å; W23-F101 HydrophobicContact CD2-CZ 4.4Å; W23-F101 AromaticContact CE3-CD2 3.99Å; W23-F101 HydrophobicContact CE3-CD2 3.99Å; W23-F101 HydrophobicContact CE3-CE2 4.3Å; W23-F101 HydrophobicContact CE3-CG 4.19Å; W23-F101 AromaticContact CG-CD1 3.94Å; W23-F101 HydrophobicContact CG-CD1 3.94Å; W23-F101 AromaticContact CG-CE1 3.75Å; W23-F101 HydrophobicContact CG-CE1 3.75Å; W23-F101 HydrophobicContact CG-CE2 4.34Å; W23-F101 HydrophobicContact CG-CG 4.3Å; W23-F101 AromaticContact CG-CZ 3.95Å; W23-F101 HydrophobicContact CG-CZ 3.95Å; W23-F101 HydrophobicContact CH2-CB 4.36Å; W23-F101 HydrophobicContact CZ2-CB 4.21Å; W23-F101 HydrophobicContact CZ3-CD2 4.47Å; Y26-F101 AromaticContact CD1-CE1 3.4Å; Y26-F101 HydrophobicContact CD1-CE1 3.4Å; Y26-F101 AromaticContact CD1-CZ 3.56Å; Y26-F101 HydrophobicContact CD1-CZ 3.56Å; Y26-F101 AromaticContact CE1-CE1 3.71Å; Y26-F101 HydrophobicContact CE1-CE1 3.71Å; Y26-F101 AromaticContact CE1-CZ 3.96Å; Y26-F101 HydrophobicContact CE1-CZ 3.96Å; Y26-F101 HydrophobicContact CG-CE1 4.39Å; L27-F101 HydrophobicContact CD1-CE2 4.35Å; L27-F101 HydrophobicContact CD1-CZ 4.41Å; L27-F101 HydrophobicContact CD2-CE2 4.4Å; L27-F101 HydrophobicContact CD2-CZ 4.19Å; L27-F101 HydrophobicContact CG-CE2 4.42Å; L27-F101 HydrophobicContact CG-CZ 4.07Å; A97-F101 WeakPolarHBondContact O-CB 3.29Å; A97-F101 PolarHBondContact O-N 2.85Å; S98-F101 PolarHBondContact O-N 3.05Å; F101-T103 PolarHBondContact O-N 3.05Å; F101-I104 PolarHBondContact O-N 3.08Å; F101-T105 PolarHBondContact O-N 2.82Å; F101-T105 PolarHBondContact O-OG1 3.28Å
102	L	96.6	Very high	96.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.1	-19.3	179.1	-68.8	178.4	0	0	0	114	M17 Y26 M60 L64 W86 M89 S98 K100 P106 K138	M17-L102 HydrophobicContact CE-CD1 4.09Å; M17-L102 HydrophobicContact CE-CD2 4.32Å; M17-L102 HydrophobicContact CG-CD1 3.81Å; M17-L102 HydrophobicContact CG-CG 4.25Å; M17-L102 HydrophobicContact SD-CD1 4.14Å; M17-L102 HydrophobicContact SD-CD2 4.07Å; M17-L102 HydrophobicContact SD-CG 4.3Å; Y26-L102 HydrophobicContact CE1-CD2 4.34Å; M60-L102 HydrophobicContact CE-CD2 3.86Å; L64-L102 HydrophobicContact CD1-CD1 4.19Å; L64-L102 HydrophobicContact CD2-CD1 4.31Å; W86-L102 HydrophobicContact CZ3-CB 4.07Å; W86-L102 HydrophobicContact CZ3-CD1 4.24Å; M89-L102 HydrophobicContact CE-CD1 3.86Å; M89-L102 HydrophobicContact SD-CD1 3.85Å; S98-L102 WeakPolarHBondContact O-CG 3.33Å; S98-L102 PolarHBondContact O-N 2.91Å; K100-L102 PolarHBondContact O-N 3.43Å; L102-P106 WeakPolarHBondContact O-CD 3.32Å; L102-K138 PolarHBondContact O-NZ 2.72Å
103	T	97.4	Very high	96.8	Very high	39 Å²	39	47.8 Å²	47.8	24%	0.239	25%	0.252	C	S	.	.	H	α-helix	trans	-85.3	-41.8	174.7	-56.5	0	0	0	0	111.3	R99 K100 F101 P106 I107 L135	R99-T103 WeakPolarHBondContact O-CB 3.15Å; R99-T103 PolarHBondContact O-N 3.19Å; R99-T103 PolarHBondContact O-OG1 3.36Å; K100-T103 PolarHBondContact O-N 2.97Å; K100-T103 VanDerWaalsContact O-N 3.1Å; F101-T103 PolarHBondContact O-N 3.05Å; T103-P106 WeakPolarHBondContact O-CD 3.37Å; T103-P106 WeakPolarHBondContact O-CG 3.25Å; T103-I107 HydrophobicContact CG2-CD1 4.38Å; T103-I107 WeakPolarHBondContact O-CD1 3.42Å; T103-I107 WeakPolarHBondContact O-CG1 3.39Å; T103-L135 HydrophobicContact CG2-CD2 3.97Å
104	I	98.1	Very high	97	Very high	94 Å²	94	43.9 Å²	43.9	48%	0.482	23%	0.229	S	C	.	.	H	α-helix	trans	-73.8	-39.9	-176.4	-68.6	165.6	0	0	0	111.2	K100 F101 I107 V108	K100-I104 HydrophobicContact CB-CD1 4.28Å; K100-I104 WeakPolarHBondContact O-CB 3.39Å; K100-I104 VanDerWaalsContact O-CG1 3.23Å; K100-I104 WeakPolarHBondContact O-CG1 3.28Å; K100-I104 PolarHBondContact O-N 2.94Å; F101-I104 PolarHBondContact O-N 3.08Å; I104-I107 WeakPolarHBondContact O-CA 3.38Å; I104-I107 WeakPolarHBondContact O-CB 3.44Å; I104-I107 PolarHBondContact O-N 2.99Å; I104-V108 HydrophobicContact CG2-CG2 3.85Å; I104-V108 PolarHBondContact O-N 2.67Å
105	T	98.2	Very high	97.3	Very high	17 Å²	17	47.5 Å²	47.5	10%	0.104	24%	0.244	C	C	.	.	H	α-helix	trans	-55.3	-51.3	-176.9	-58.4	0	0	0	0	114.3	Y26 L27 I30 F101 I107 V108 L109	Y26-T105 HydrophobicContact CE1-CG2 3.55Å; L27-T105 HydrophobicContact CD2-CG2 4.18Å; I30-T105 HydrophobicContact CD1-CG2 3.65Å; F101-T105 PolarHBondContact O-N 2.82Å; F101-T105 PolarHBondContact O-OG1 3.28Å; T105-I107 PolarHBondContact O-N 3.2Å; T105-V108 PolarHBondContact O-N 3.28Å; T105-L109 WeakPolarHBondContact O-CB 3.36Å; T105-L109 PolarHBondContact O-N 3.08Å
106	P	98.1	Very high	97.5	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-29.7	175.8	21.6	-31.5	0	0	0	113.2	N57 L102 T103 Y110 L131 V134 L135	N57-P106 WeakPolarHBondContact OD1-CB 3.46Å; L102-P106 WeakPolarHBondContact O-CD 3.32Å; T103-P106 WeakPolarHBondContact O-CD 3.37Å; T103-P106 WeakPolarHBondContact O-CG 3.25Å; P106-Y110 VanDerWaalsContact O-CB 3.26Å; P106-Y110 WeakPolarHBondContact O-CB 3.29Å; P106-Y110 PolarHBondContact O-N 3.2Å; P106-L131 HydrophobicContact CB-CD1 3.87Å; P106-V134 HydrophobicContact CB-CG1 4.11Å; P106-V134 HydrophobicContact CG-CG1 4.33Å; P106-L135 HydrophobicContact CG-CD2 4.39Å
107	I	98.6	Very high	97.6	Very high	58 Å²	58	44.8 Å²	44.8	30%	0.297	23%	0.228	S	C	.	.	H	α-helix	trans	-67.9	-46.4	175.8	-63.2	168.4	0	0	0	110.4	T103 I104 T105 L109 Y110 I111 L131 L135	T103-I107 HydrophobicContact CG2-CD1 4.38Å; T103-I107 WeakPolarHBondContact O-CD1 3.42Å; T103-I107 WeakPolarHBondContact O-CG1 3.39Å; I104-I107 WeakPolarHBondContact O-CA 3.38Å; I104-I107 WeakPolarHBondContact O-CB 3.44Å; I104-I107 PolarHBondContact O-N 2.99Å; T105-I107 PolarHBondContact O-N 3.2Å; I107-L109 VanDerWaalsContact C-N 3.35Å; I107-Y110 WeakPolarHBondContact O-CB 3.47Å; I107-Y110 PolarHBondContact O-N 2.83Å; I107-I111 HydrophobicContact CG2-CD1 3.98Å; I107-I111 VanDerWaalsContact O-CG1 3.32Å; I107-I111 WeakPolarHBondContact O-CG1 3.32Å; I107-I111 PolarHBondContact O-N 3.01Å; I107-L131 HydrophobicContact CG1-CD1 4.33Å; I107-L135 HydrophobicContact CD1-CD1 4.11Å; I107-L135 HydrophobicContact CD1-CD2 4.25Å; I107-L135 HydrophobicContact CG1-CD1 3.87Å; I107-L135 HydrophobicContact CG1-CD2 4.17Å
108	V	98.6	Very high	97.7	Very high	72 Å²	72	50.4 Å²	50.4	44%	0.436	24%	0.241	S	C	.	.	H	α-helix	trans	-62	-44.8	176.5	173.8	0	0	0	0	110.4	I104 T105 Y110 I111 L112	I104-V108 HydrophobicContact CG2-CG2 3.85Å; I104-V108 PolarHBondContact O-N 2.67Å; T105-V108 PolarHBondContact O-N 3.28Å; V108-Y110 VanDerWaalsContact C-N 3.31Å; V108-Y110 PolarHBondContact O-N 2.79Å; V108-I111 PolarHBondContact O-N 3.5Å; V108-L112 HydrophobicContact CG1-CD1 4.18Å; V108-L112 HydrophobicContact CG1-CG 4.47Å; V108-L112 WeakPolarHBondContact O-CG 3.2Å; V108-L112 PolarHBondContact O-N 2.88Å
109	L	98.5	Very high	97.7	Very high	12 Å²	12	57.2 Å²	57.2	6%	0.063	27%	0.268	C	S	.	.	H	α-helix	trans	-60.8	-40.2	177.1	-175.2	59.6	0	0	0	112.1	I30 W49 T52 N53 H56 T105 I107 T113	I30-L109 HydrophobicContact CG2-CD1 4.36Å; I30-L109 HydrophobicContact CG2-CD2 4.31Å; W49-L109 HydrophobicContact CE3-CD1 4.4Å; W49-L109 HydrophobicContact CZ3-CD1 4Å; T52-L109 HydrophobicContact CG2-CD1 4.31Å; N53-L109 HydrophobicContact CB-CD2 4.38Å; N53-L109 HydrophobicContact CB-CG 4.27Å; H56-L109 HydrophobicContact CB-CD2 3.72Å; T105-L109 WeakPolarHBondContact O-CB 3.36Å; T105-L109 PolarHBondContact O-N 3.08Å; I107-L109 VanDerWaalsContact C-N 3.35Å; L109-T113 VanDerWaalsContact O-CB 3.31Å; L109-T113 WeakPolarHBondContact O-CB 3.39Å; L109-T113 PolarHBondContact O-N 3.45Å; L109-T113 PolarHBondContact O-OG1 2.85Å
110	Y	98.6	Very high	97.8	Very high	31 Å²	31	60.6 Å²	60.6	12%	0.122	29%	0.286	C	S	.	.	H	α-helix	trans	-63.3	-43.3	174.2	170.1	-98.5	0	0	0	112.8	P106 I107 V108 T113 S114 F124 N127 T128 L131	P106-Y110 VanDerWaalsContact O-CB 3.26Å; P106-Y110 WeakPolarHBondContact O-CB 3.29Å; P106-Y110 PolarHBondContact O-N 3.2Å; I107-Y110 WeakPolarHBondContact O-CB 3.47Å; I107-Y110 PolarHBondContact O-N 2.83Å; V108-Y110 VanDerWaalsContact C-N 3.31Å; V108-Y110 PolarHBondContact O-N 2.79Å; Y110-T113 PolarHBondContact O-N 3.28Å; Y110-S114 WeakPolarHBondContact O-CB 3.48Å; Y110-S114 PolarHBondContact O-N 2.79Å; Y110-S114 PolarHBondContact O-OG 2.81Å; Y110-F124 WeakPolarHBondContact OH-CE2 3.32Å; Y110-F124 VanDerWaalsContact OH-CZ 3.3Å; Y110-F124 WeakPolarHBondContact OH-CZ 3.38Å; Y110-N127 HydrophobicContact CD2-CB 3.77Å; Y110-N127 HydrophobicContact CE2-CB 3.74Å; Y110-T128 PolarHBondContact OH-OG1 2.88Å; Y110-L131 HydrophobicContact CD1-CD2 3.8Å; Y110-L131 HydrophobicContact CD2-CB 4.3Å; Y110-L131 HydrophobicContact CD2-CD2 4.14Å; Y110-L131 HydrophobicContact CE1-CD2 4.34Å; Y110-L131 HydrophobicContact CG-CD2 3.68Å
111	I	98.5	Very high	97.8	Very high	98 Å²	98	65.8 Å²	65.8	50%	0.503	30%	0.303	S	S	.	.	H	α-helix	trans	-63.6	-47	177.6	-69.1	166.3	0	0	0	110.2	I107 V108 T113 S114 F115	I107-I111 HydrophobicContact CG2-CD1 3.98Å; I107-I111 VanDerWaalsContact O-CG1 3.32Å; I107-I111 WeakPolarHBondContact O-CG1 3.32Å; I107-I111 PolarHBondContact O-N 3.01Å; V108-I111 PolarHBondContact O-N 3.5Å; I111-T113 VanDerWaalsContact C-N 3.33Å; I111-T113 PolarHBondContact O-N 3.35Å; I111-S114 PolarHBondContact O-N 2.97Å; I111-F115 PolarHBondContact O-N 3.24Å
112	L	98.2	Very high	97.9	Very high	72 Å²	72	67.3 Å²	67.3	38%	0.377	32%	0.322	S	S	.	.	H	α-helix	trans	-58.6	-46.9	175.1	-70.1	174.5	0	0	0	110.9	W49 V108 S114 F115 Y116	W49-L112 HydrophobicContact CE3-CB 4.34Å; W49-L112 HydrophobicContact CH2-CB 4.14Å; W49-L112 HydrophobicContact CH2-CD1 4.3Å; W49-L112 HydrophobicContact CZ3-CB 3.73Å; W49-L112 HydrophobicContact CZ3-CD1 4.28Å; V108-L112 HydrophobicContact CG1-CD1 4.18Å; V108-L112 HydrophobicContact CG1-CG 4.47Å; V108-L112 WeakPolarHBondContact O-CG 3.2Å; V108-L112 PolarHBondContact O-N 2.88Å; L112-S114 VanDerWaalsContact C-N 3.33Å; L112-S114 PolarHBondContact O-N 3.13Å; L112-F115 WeakPolarHBondContact O-CB 3.4Å; L112-F115 PolarHBondContact O-N 2.7Å; L112-Y116 WeakPolarHBondContact O-CD2 3.45Å; L112-Y116 PolarHBondContact O-N 3Å
113	T	98.3	Very high	97.9	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-57.4	-47.5	177.4	-60.5	0	0	0	0	111.1	W49 N53 L109 Y110 I111 F115 Y116 T117 N127	W49-T113 HydrophobicContact CB-CG2 4.07Å; W49-T113 PolarHBondContact O-OG1 2.9Å; N53-T113 HydrophobicContact CB-CG2 4.37Å; L109-T113 VanDerWaalsContact O-CB 3.31Å; L109-T113 WeakPolarHBondContact O-CB 3.39Å; L109-T113 PolarHBondContact O-N 3.45Å; L109-T113 PolarHBondContact O-OG1 2.85Å; Y110-T113 PolarHBondContact O-N 3.28Å; I111-T113 VanDerWaalsContact C-N 3.33Å; I111-T113 PolarHBondContact O-N 3.35Å; T113-F115 VanDerWaalsContact C-N 3.29Å; T113-F115 PolarHBondContact O-N 3.47Å; T113-Y116 PolarHBondContact O-N 2.67Å; T113-T117 HydrophobicContact CG2-CG2 4.1Å; T113-T117 WeakPolarHBondContact O-CB 3.5Å; T113-T117 WeakPolarHBondContact O-CG2 3.46Å; T113-T117 PolarHBondContact O-N 2.73Å; T113-T117 PolarHBondContact O-OG1 2.85Å; T113-N127 WeakPolarHBondContact CG2-ND2 3.04Å
114	S	98.1	Very high	97.9	Very high	5 Å²	5	71.6 Å²	71.6	4%	0.035	34%	0.338	C	S	.	.	H	α-helix	trans	-59.9	-39.9	178.6	-59.1	0	0	0	0	112.3	Y110 I111 L112 T117 K118 Y119	Y110-S114 WeakPolarHBondContact O-CB 3.48Å; Y110-S114 PolarHBondContact O-N 2.79Å; Y110-S114 PolarHBondContact O-OG 2.81Å; I111-S114 PolarHBondContact O-N 2.97Å; L112-S114 VanDerWaalsContact C-N 3.33Å; L112-S114 PolarHBondContact O-N 3.13Å; S114-T117 PolarHBondContact O-OG1 3.39Å; S114-K118 PolarHBondContact O-N 3.31Å; S114-Y119 PolarHBondContact O-N 3.35Å
115	F	98.1	Very high	97.9	Very high	127 Å²	127	71.2 Å²	71.2	56%	0.557	34%	0.34	S	S	*	.	H	α-helix	trans	-64.5	-49.9	175.9	-179.8	-98.1	0	0	0	111.7	I111 L112 T113 T117 K118	I111-F115 PolarHBondContact O-N 3.24Å; L112-F115 WeakPolarHBondContact O-CB 3.4Å; L112-F115 PolarHBondContact O-N 2.7Å; T113-F115 VanDerWaalsContact C-N 3.29Å; T113-F115 PolarHBondContact O-N 3.47Å; F115-T117 VanDerWaalsContact C-N 3.33Å; F115-T117 PolarHBondContact O-N 3.1Å; F115-K118 PolarHBondContact O-N 3.46Å
116	Y	97.9	Very high	98	Very high	105 Å²	105	73.8 Å²	73.8	41%	0.412	36%	0.355	S	S	.	.	H	α-helix	trans	-73.1	-22.1	-178.8	-76	-73.1	0	0	0	114	W49 L112 T113	W49-Y116 AromaticContact CD1-CG 3.69Å; W49-Y116 AromaticContact CD2-CD2 3.76Å; W49-Y116 HydrophobicContact CD2-CD2 3.76Å; W49-Y116 HydrophobicContact CD2-CG 4.13Å; W49-Y116 AromaticContact CE2-CD2 3.21Å; W49-Y116 AromaticContact CE2-CE2 3.67Å; W49-Y116 AromaticContact CE2-CG 3.59Å; W49-Y116 HydrophobicContact CE3-CD2 4.32Å; W49-Y116 HydrophobicContact CG-CD2 4.3Å; W49-Y116 HydrophobicContact CG-CG 4.2Å; W49-Y116 AromaticContact CH2-CD2 3.97Å; W49-Y116 HydrophobicContact CH2-CD2 3.97Å; W49-Y116 AromaticContact CH2-CE2 3.85Å; W49-Y116 HydrophobicContact CH2-CE2 3.85Å; W49-Y116 AromaticContact CZ2-CD2 3.34Å; W49-Y116 HydrophobicContact CZ2-CD2 3.34Å; W49-Y116 AromaticContact CZ2-CE2 3.27Å; W49-Y116 HydrophobicContact CZ2-CE2 3.27Å; W49-Y116 HydrophobicContact CZ2-CG 4.11Å; W49-Y116 AromaticContact CZ2-CZ 3.98Å; W49-Y116 HydrophobicContact CZ3-CD2 4.42Å; W49-Y116 AromaticContact NE1-CD1 3.73Å; W49-Y116 AromaticContact NE1-CD2 3.46Å; W49-Y116 AromaticContact NE1-CG 3.27Å; W49-Y116 VanDerWaalsContact NE1-CG 3.27Å; L112-Y116 WeakPolarHBondContact O-CD2 3.45Å; L112-Y116 PolarHBondContact O-N 3Å; T113-Y116 PolarHBondContact O-N 2.67Å
117	T	97.9	Very high	98	Very high	5 Å²	5	73.8 Å²	73.8	3%	0.031	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	6.3	169.6	65.3	0	0	0	0	112.4	P46 T113 S114 F115 Y119 D120 H123	P46-T117 HydrophobicContact CB-CG2 3.96Å; T113-T117 HydrophobicContact CG2-CG2 4.1Å; T113-T117 WeakPolarHBondContact O-CB 3.5Å; T113-T117 WeakPolarHBondContact O-CG2 3.46Å; T113-T117 PolarHBondContact O-N 2.73Å; T113-T117 PolarHBondContact O-OG1 2.85Å; S114-T117 PolarHBondContact O-OG1 3.39Å; F115-T117 VanDerWaalsContact C-N 3.33Å; F115-T117 PolarHBondContact O-N 3.1Å; T117-Y119 PolarHBondContact O-N 3.19Å; T117-Y119 VanDerWaalsContact O-N 3.13Å; T117-D120 WeakPolarHBondContact O-CB 3.5Å; T117-D120 PolarHBondContact O-N 3.36Å; T117-H123 HydrophobicContact CG2-CB 3.74Å
118	K	97.3	Very high	98	Very high	179 Å²	179	73 Å²	73	78%	0.778	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	33.8	-179.3	-55	179.8	-177.9	178.2	0	113	S114 F115 D120	S114-K118 PolarHBondContact O-N 3.31Å; F115-K118 PolarHBondContact O-N 3.46Å; K118-D120 PolarHBondContact O-N 2.89Å; K118-D120 VanDerWaalsContact O-N 3.16Å
119	Y	95.4	Very high	97.9	Very high	143 Å²	143	73.9 Å²	73.9	56%	0.561	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	27.7	-177.1	-50.1	-87	0	0	0	113.9	S114 T117 R121	S114-Y119 PolarHBondContact O-N 3.35Å; T117-Y119 PolarHBondContact O-N 3.19Å; T117-Y119 VanDerWaalsContact O-N 3.13Å; Y119-R121 PolarHBondContact O-N 3.29Å
120	D	97.9	Very high	97.9	Very high	74 Å²	74	74 Å²	74	40%	0.396	36%	0.36	S	S	.	.			trans	-53.4	135.7	171	174.9	-97	0	0	0	110.8	T117 K118 A122 H123 F124	T117-D120 WeakPolarHBondContact O-CB 3.5Å; T117-D120 PolarHBondContact O-N 3.36Å; K118-D120 PolarHBondContact O-N 2.89Å; K118-D120 VanDerWaalsContact O-N 3.16Å; D120-A122 PolarHBondContact O-N 3.43Å; D120-A122 WeakPolarHBondContact OD1-CB 3.31Å; D120-A122 PolarHBondContact OD1-N 2.88Å; D120-H123 HydrophobicContact CB-CB 4.4Å; D120-H123 PolarHBondContact O-N 2.57Å; D120-H123 IonicContact OD1-CD2 2.71Å; D120-H123 PolarHBondContact OD1-CD2 2.91Å; D120-H123 IonicContact OD1-CG 2.97Å; D120-H123 PolarHBondContact OD1-N 3.16Å; D120-F124 VanDerWaalsContact O-CB 3.22Å; D120-F124 WeakPolarHBondContact O-CB 3.09Å; D120-F124 PolarHBondContact O-N 3.17Å
121	R	97.4	Very high	97.9	Very high	217 Å²	217	73.1 Å²	73.1	82%	0.819	36%	0.358	S	S	*	.	H	α-helix	trans	-63.4	-40.2	-170.9	-76.8	-177	-96.7	164.2	-7.3	112.6	Y119 V125	Y119-R121 PolarHBondContact O-N 3.29Å; R121-V125 WeakPolarHBondContact O-CG2 3.35Å; R121-V125 PolarHBondContact O-N 3.32Å; R121-V125 VanDerWaalsContact O-N 3.11Å
122	A	97.4	Very high	97.9	Very high	66 Å²	66	72.7 Å²	72.7	55%	0.545	36%	0.355	S	S	.	.	H	α-helix	trans	-69.4	-48.4	-177.6	0	0	0	0	0	110.4	D120 F124 V126	D120-A122 PolarHBondContact O-N 3.43Å; D120-A122 WeakPolarHBondContact OD1-CB 3.31Å; D120-A122 PolarHBondContact OD1-N 2.88Å; A122-F124 VanDerWaalsContact C-N 3.34Å; A122-F124 PolarHBondContact O-N 3.15Å; A122-V126 WeakPolarHBondContact O-CG2 3.37Å; A122-V126 PolarHBondContact O-N 3.06Å; A122-V126 VanDerWaalsContact O-N 3.17Å
123	H	98.1	Very high	97.7	Very high	42 Å²	42	72.4 Å²	72.4	19%	0.194	36%	0.356	C	S	.	.	H	α-helix	trans	-59.8	-44.5	175.2	-72.1	-72.1	0	0	0	111.7	T50 T117 D120 V126 N127	T50-H123 PolarHBondContact OG1-ND1 3.36Å; T117-H123 HydrophobicContact CG2-CB 3.74Å; D120-H123 HydrophobicContact CB-CB 4.4Å; D120-H123 PolarHBondContact O-N 2.57Å; D120-H123 IonicContact OD1-CD2 2.71Å; D120-H123 PolarHBondContact OD1-CD2 2.91Å; D120-H123 IonicContact OD1-CG 2.97Å; D120-H123 PolarHBondContact OD1-N 3.16Å; H123-V126 PolarHBondContact O-N 3.2Å; H123-N127 VanDerWaalsContact O-CB 3.3Å; H123-N127 WeakPolarHBondContact O-CB 3.44Å; H123-N127 PolarHBondContact O-N 2.88Å; H123-N127 PolarHBondContact O-ND2 2.81Å
124	F	97.7	Very high	97.6	Very high	86 Å²	86	72.4 Å²	72.4	38%	0.377	36%	0.356	S	S	.	.	H	α-helix	trans	-57.1	-55.1	-180	-175.8	-96.3	0	0	0	111.4	Y110 D120 A122 V126 N127 T128	Y110-F124 WeakPolarHBondContact OH-CE2 3.32Å; Y110-F124 VanDerWaalsContact OH-CZ 3.3Å; Y110-F124 WeakPolarHBondContact OH-CZ 3.38Å; D120-F124 VanDerWaalsContact O-CB 3.22Å; D120-F124 WeakPolarHBondContact O-CB 3.09Å; D120-F124 PolarHBondContact O-N 3.17Å; A122-F124 VanDerWaalsContact C-N 3.34Å; A122-F124 PolarHBondContact O-N 3.15Å; F124-V126 PolarHBondContact O-N 3.49Å; F124-N127 PolarHBondContact O-N 3Å; F124-T128 PolarHBondContact O-N 3.02Å; F124-T128 PolarHBondContact O-OG1 3.05Å
125	V	98.3	Very high	97.6	Very high	87 Å²	87	73.8 Å²	73.8	53%	0.527	36%	0.362	S	S	.	.	H	α-helix	trans	-58.2	-47.3	-178.5	171.6	0	0	0	0	111.7	R121 N127 T128 V129	R121-V125 WeakPolarHBondContact O-CG2 3.35Å; R121-V125 PolarHBondContact O-N 3.32Å; R121-V125 VanDerWaalsContact O-N 3.11Å; V125-N127 PolarHBondContact O-N 2.95Å; V125-T128 PolarHBondContact O-N 3.27Å; V125-V129 WeakPolarHBondContact O-CG2 3.47Å; V125-V129 PolarHBondContact O-N 3.42Å
126	V	98.4	Very high	97.4	Very high	70 Å²	70	70.9 Å²	70.9	42%	0.424	35%	0.352	S	S	.	.	H	α-helix	trans	-60.8	-45.7	-179.7	168.1	0	0	0	0	111.2	T50 L54 A122 H123 F124 S130	T50-V126 HydrophobicContact CG2-CG1 4.27Å; L54-V126 HydrophobicContact CD1-CG1 3.87Å; L54-V126 HydrophobicContact CD2-CG1 3.86Å; L54-V126 HydrophobicContact CG-CG1 4.31Å; A122-V126 WeakPolarHBondContact O-CG2 3.37Å; A122-V126 PolarHBondContact O-N 3.06Å; A122-V126 VanDerWaalsContact O-N 3.17Å; H123-V126 PolarHBondContact O-N 3.2Å; F124-V126 PolarHBondContact O-N 3.49Å; V126-S130 WeakPolarHBondContact O-CB 3.23Å; V126-S130 PolarHBondContact O-N 3.41Å; V126-S130 VanDerWaalsContact O-N 3.09Å
127	N	98.3	Very high	97.2	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-69.2	-34	179	-74.5	-63.3	0	0	0	112.2	T50 N53 Y110 T113 H123 F124 V125 L131	T50-N127 PolarHBondContact OG1-ND2 3.31Å; N53-N127 WeakPolarHBondContact CB-OD1 3.36Å; N53-N127 PolarHBondContact ND2-OD1 3.04Å; Y110-N127 HydrophobicContact CD2-CB 3.77Å; Y110-N127 HydrophobicContact CE2-CB 3.74Å; T113-N127 WeakPolarHBondContact CG2-ND2 3.04Å; H123-N127 VanDerWaalsContact O-CB 3.3Å; H123-N127 WeakPolarHBondContact O-CB 3.44Å; H123-N127 PolarHBondContact O-N 2.88Å; H123-N127 PolarHBondContact O-ND2 2.81Å; F124-N127 PolarHBondContact O-N 3Å; V125-N127 PolarHBondContact O-N 2.95Å; N127-L131 WeakPolarHBondContact O-CB 3.41Å; N127-L131 PolarHBondContact O-N 3.2Å
128	T	98.4	Very high	97.1	Very high	41 Å²	41	67.8 Å²	67.8	25%	0.252	34%	0.344	S	S	.	.	H	α-helix	trans	-65.5	-49.4	175.7	-52.9	0	0	0	0	110.4	Y110 F124 V125 S130 L131 M132	Y110-T128 PolarHBondContact OH-OG1 2.88Å; F124-T128 PolarHBondContact O-N 3.02Å; F124-T128 PolarHBondContact O-OG1 3.05Å; V125-T128 PolarHBondContact O-N 3.27Å; T128-S130 VanDerWaalsContact C-N 3.29Å; T128-S130 PolarHBondContact O-N 3.09Å; T128-L131 PolarHBondContact O-N 3.41Å; T128-L131 VanDerWaalsContact O-N 3.11Å; T128-M132 HydrophobicContact CG2-CG 4.44Å; T128-M132 WeakPolarHBondContact O-CG 3.2Å; T128-M132 PolarHBondContact O-N 3.1Å
129	V	98.3	Very high	96.9	Very high	91 Å²	91	63.2 Å²	63.2	55%	0.552	33%	0.328	S	S	*	.	H	α-helix	trans	-57.3	-46.7	178.4	171.4	0	0	0	0	110.1	V125 L131 M132 T133	V125-V129 WeakPolarHBondContact O-CG2 3.47Å; V125-V129 PolarHBondContact O-N 3.42Å; V129-L131 VanDerWaalsContact C-N 3.35Å; V129-L131 PolarHBondContact O-N 3.48Å; V129-M132 PolarHBondContact O-N 3.11Å; V129-T133 WeakPolarHBondContact O-CG2 3.32Å; V129-T133 PolarHBondContact O-N 3.41Å
130	S	98.3	Very high	96.8	Very high	14 Å²	14	58.6 Å²	58.6	10%	0.098	32%	0.315	C	S	.	.	H	α-helix	trans	-61.5	-37.9	176.4	178.6	0	0	0	0	113.7	L54 N57 V126 T128 T133	L54-S130 WeakPolarHBondContact CD2-OG 3.05Å; N57-S130 VanDerWaalsContact CB-OG 3.27Å; N57-S130 WeakPolarHBondContact CB-OG 3.5Å; N57-S130 PolarHBondContact ND2-OG 2.89Å; V126-S130 WeakPolarHBondContact O-CB 3.23Å; V126-S130 PolarHBondContact O-N 3.41Å; V126-S130 VanDerWaalsContact O-N 3.09Å; T128-S130 VanDerWaalsContact C-N 3.29Å; T128-S130 PolarHBondContact O-N 3.09Å; S130-T133 PolarHBondContact O-OG1 3.2Å
131	L	98.4	Very high	96.4	Very high	14 Å²	14	62.1 Å²	62.1	7%	0.073	33%	0.329	C	S	.	.	H	α-helix	trans	-66.4	-41.4	175.4	-179.2	65.4	0	0	0	111.1	P106 I107 Y110 N127 T128 V129 T133 V134 L135	P106-L131 HydrophobicContact CB-CD1 3.87Å; I107-L131 HydrophobicContact CG1-CD1 4.33Å; Y110-L131 HydrophobicContact CD1-CD2 3.8Å; Y110-L131 HydrophobicContact CD2-CB 4.3Å; Y110-L131 HydrophobicContact CD2-CD2 4.14Å; Y110-L131 HydrophobicContact CE1-CD2 4.34Å; Y110-L131 HydrophobicContact CG-CD2 3.68Å; N127-L131 WeakPolarHBondContact O-CB 3.41Å; N127-L131 PolarHBondContact O-N 3.2Å; T128-L131 PolarHBondContact O-N 3.41Å; T128-L131 VanDerWaalsContact O-N 3.11Å; V129-L131 VanDerWaalsContact C-N 3.35Å; V129-L131 PolarHBondContact O-N 3.48Å; L131-T133 VanDerWaalsContact C-N 3.31Å; L131-T133 PolarHBondContact O-N 2.81Å; L131-V134 HydrophobicContact CD1-CG1 4.38Å; L131-V134 VanDerWaalsContact O-CG1 3.3Å; L131-V134 WeakPolarHBondContact O-CG1 3.41Å; L131-V134 PolarHBondContact O-N 2.81Å; L131-L135 HydrophobicContact CD1-CD1 3.8Å; L131-L135 HydrophobicContact CD1-CD2 4.4Å; L131-L135 HydrophobicContact CD1-CG 3.84Å; L131-L135 HydrophobicContact CD2-CD1 3.98Å; L131-L135 HydrophobicContact CG-CD1 3.64Å; L131-L135 HydrophobicContact CG-CG 3.99Å; L131-L135 WeakPolarHBondContact O-CG 3.32Å; L131-L135 PolarHBondContact O-N 2.7Å
132	M	97.8	Very high	96.1	Very high	89 Å²	89	53.8 Å²	53.8	44%	0.438	30%	0.301	S	S	.	.	H	α-helix	trans	-63.8	-35.7	-179.2	-66.7	-54.3	-69.9	0	0	112.2	T128 V129 V134 L135 I136	T128-M132 HydrophobicContact CG2-CG 4.44Å; T128-M132 WeakPolarHBondContact O-CG 3.2Å; T128-M132 PolarHBondContact O-N 3.1Å; V129-M132 PolarHBondContact O-N 3.11Å; M132-V134 PolarHBondContact O-N 3.4Å; M132-L135 PolarHBondContact O-N 2.95Å; M132-I136 HydrophobicContact CB-CD1 4.11Å; M132-I136 HydrophobicContact CE-CD1 3.92Å; M132-I136 HydrophobicContact CE-CG1 3.86Å; M132-I136 WeakPolarHBondContact O-CB 3.43Å; M132-I136 VanDerWaalsContact O-CG1 3.25Å; M132-I136 WeakPolarHBondContact O-CG1 3.49Å; M132-I136 PolarHBondContact O-N 2.52Å
133	T	94.5	Very high	95.6	Very high	66 Å²	66	53.8 Å²	53.8	41%	0.405	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-29.6	177.8	63	0	0	0	0	112.9	Y61 V129 S130 L131 P137	Y61-T133 WeakPolarHBondContact CD2-O 3.18Å; V129-T133 WeakPolarHBondContact O-CG2 3.32Å; V129-T133 PolarHBondContact O-N 3.41Å; S130-T133 PolarHBondContact O-OG1 3.2Å; L131-T133 VanDerWaalsContact C-N 3.31Å; L131-T133 PolarHBondContact O-N 2.81Å; T133-P137 WeakPolarHBondContact O-CD 3.47Å; T133-P137 VanDerWaalsContact O-CG 3.29Å; T133-P137 WeakPolarHBondContact O-CG 3.21Å
134	V	96.1	Very high	95	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-96.7	-22.5	179.7	77.3	0	0	0	0	113.5	N57 M60 P106 L131 M132 K138	N57-V134 HydrophobicContact CB-CG1 4.33Å; M60-V134 HydrophobicContact CB-CG2 4Å; P106-V134 HydrophobicContact CB-CG1 4.11Å; P106-V134 HydrophobicContact CG-CG1 4.33Å; L131-V134 HydrophobicContact CD1-CG1 4.38Å; L131-V134 VanDerWaalsContact O-CG1 3.3Å; L131-V134 WeakPolarHBondContact O-CG1 3.41Å; L131-V134 PolarHBondContact O-N 2.81Å; M132-V134 PolarHBondContact O-N 3.4Å; V134-K138 VanDerWaalsContact O-CD 3.26Å; V134-K138 WeakPolarHBondContact O-CD 3.26Å; V134-K138 VanDerWaalsContact O-CE 3.24Å; V134-K138 WeakPolarHBondContact O-CE 3.41Å; V134-K138 WeakPolarHBondContact O-CG 3.28Å
135	L	97	Very high	94.4	Very high	33 Å²	33	52.8 Å²	52.8	17%	0.173	30%	0.3	C	S	.	.	H	α-helix	trans	-86.7	-40.5	178.3	-69.5	-171.7	0	0	0	113.4	T103 P106 I107 L131 M132 K138	T103-L135 HydrophobicContact CG2-CD2 3.97Å; P106-L135 HydrophobicContact CG-CD2 4.39Å; I107-L135 HydrophobicContact CD1-CD1 4.11Å; I107-L135 HydrophobicContact CD1-CD2 4.25Å; I107-L135 HydrophobicContact CG1-CD1 3.87Å; I107-L135 HydrophobicContact CG1-CD2 4.17Å; L131-L135 HydrophobicContact CD1-CD1 3.8Å; L131-L135 HydrophobicContact CD1-CD2 4.4Å; L131-L135 HydrophobicContact CD1-CG 3.84Å; L131-L135 HydrophobicContact CD2-CD1 3.98Å; L131-L135 HydrophobicContact CG-CD1 3.64Å; L131-L135 HydrophobicContact CG-CG 3.99Å; L131-L135 WeakPolarHBondContact O-CG 3.32Å; L131-L135 PolarHBondContact O-N 2.7Å; M132-L135 PolarHBondContact O-N 2.95Å; L135-K138 WeakPolarHBondContact O-CB 3.49Å; L135-K138 PolarHBondContact O-N 3.14Å
136	I	95.6	Very high	93.8	Very high	66 Å²	66	51.4 Å²	51.4	34%	0.338	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-55.1	-50.7	-178.5	-69.5	169.4	0	0	0	110.8	M132 K138 L139 L142	M132-I136 HydrophobicContact CB-CD1 4.11Å; M132-I136 HydrophobicContact CE-CD1 3.92Å; M132-I136 HydrophobicContact CE-CG1 3.86Å; M132-I136 WeakPolarHBondContact O-CB 3.43Å; M132-I136 VanDerWaalsContact O-CG1 3.25Å; M132-I136 WeakPolarHBondContact O-CG1 3.49Å; M132-I136 PolarHBondContact O-N 2.52Å; I136-K138 PolarHBondContact O-N 3.26Å; I136-L139 WeakPolarHBondContact O-CB 3.06Å; I136-L139 VanDerWaalsContact O-CG 3.32Å; I136-L139 WeakPolarHBondContact O-CG 3.34Å; I136-L139 PolarHBondContact O-N 3.19Å; I136-L139 VanDerWaalsContact O-N 3.08Å; I136-L142 HydrophobicContact CG2-CD1 3.37Å; I136-L142 WeakPolarHBondContact O-CD1 3.31Å
137	P	93.6	Very high	92.7	Very high	34 Å²	34	52 Å²	52	22%	0.221	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-67.8	-10.9	-178.3	-19.1	34.1	0	0	0	114.3	Y61 H65 T133	Y61-P137 HydrophobicContact CE2-CG 4.17Å; H65-P137 HydrophobicContact CB-CB 4.49Å; T133-P137 WeakPolarHBondContact O-CD 3.47Å; T133-P137 VanDerWaalsContact O-CG 3.29Å; T133-P137 WeakPolarHBondContact O-CG 3.21Å
138	K	94.9	Very high	91.5	Very high	11 Å²	11	61.4 Å²	61.4	5%	0.048	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-84.8	-13.5	176.2	-66.7	177.1	-177.1	164.4	0	113.1	W86 L102 V134 L135 I136	W86-K138 HydrophobicContact CD2-CG 4.06Å; W86-K138 HydrophobicContact CE3-CG 4.25Å; W86-K138 HydrophobicContact CH2-CB 4.08Å; W86-K138 HydrophobicContact CH2-CD 3.94Å; W86-K138 HydrophobicContact CH2-CG 3.84Å; W86-K138 HydrophobicContact CZ2-CB 3.54Å; W86-K138 HydrophobicContact CZ2-CD 4.24Å; W86-K138 HydrophobicContact CZ2-CG 3.64Å; W86-K138 HydrophobicContact CZ3-CD 4.12Å; W86-K138 HydrophobicContact CZ3-CG 4.14Å; L102-K138 PolarHBondContact O-NZ 2.72Å; V134-K138 VanDerWaalsContact O-CD 3.26Å; V134-K138 WeakPolarHBondContact O-CD 3.26Å; V134-K138 VanDerWaalsContact O-CE 3.24Å; V134-K138 WeakPolarHBondContact O-CE 3.41Å; V134-K138 WeakPolarHBondContact O-CG 3.28Å; L135-K138 WeakPolarHBondContact O-CB 3.49Å; L135-K138 PolarHBondContact O-N 3.14Å; I136-K138 PolarHBondContact O-N 3.26Å
139	L	93.4	Very high	90	Very high	84 Å²	84	61.4 Å²	61.4	44%	0.44	33%	0.334	S	S	.	.	S	Bend	trans	-62.6	132.6	179.7	-66	176.9	0	0	0	110.6	I136 Q141 L142	I136-L139 WeakPolarHBondContact O-CB 3.06Å; I136-L139 VanDerWaalsContact O-CG 3.32Å; I136-L139 WeakPolarHBondContact O-CG 3.34Å; I136-L139 PolarHBondContact O-N 3.19Å; I136-L139 VanDerWaalsContact O-N 3.08Å; L139-Q141 PolarHBondContact O-N 3.01Å; L139-Q141 VanDerWaalsContact O-N 3.11Å; L139-L142 PolarHBondContact O-N 2.9Å
140	P	92.1	Very high	88.6	Confident	45 Å²	45	61.9 Å²	61.9	29%	0.292	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-54	-33.1	178.5	-28.7	35.2	0	0	0	114	Q94 F95 L142 H143	Q94-P140 HydrophobicContact CB-CG 4.49Å; Q94-P140 HydrophobicContact CG-CB 4.16Å; Q94-P140 HydrophobicContact CG-CG 4.32Å; F95-P140 HydrophobicContact CE1-CG 4.34Å; F95-P140 HydrophobicContact CE2-CG 3.86Å; F95-P140 HydrophobicContact CZ-CG 3.57Å; P140-L142 PolarHBondContact O-N 3.16Å; P140-H143 VanDerWaalsContact O-CB 3.28Å; P140-H143 WeakPolarHBondContact O-CB 3.5Å; P140-H143 PolarHBondContact O-N 2.97Å
141	Q	91	Very high	87	Confident	149 Å²	149	63.1 Å²	63.1	70%	0.696	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-65.2	-20.6	179.1	-59.9	86.1	-17.3	0	0	113.1	L139	L139-Q141 PolarHBondContact O-N 3.01Å; L139-Q141 VanDerWaalsContact O-N 3.11Å
142	L	90.4	Very high	85.6	Confident	42 Å²	42	68.4 Å²	68.4	22%	0.22	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-104.3	7.1	180	-65.3	179.3	0	0	0	112.8	I136 L139 P140 G144 V145 I147	I136-L142 HydrophobicContact CG2-CD1 3.37Å; I136-L142 WeakPolarHBondContact O-CD1 3.31Å; L139-L142 PolarHBondContact O-N 2.9Å; P140-L142 PolarHBondContact O-N 3.16Å; L142-G144 PolarHBondContact O-N 3.38Å; L142-V145 HydrophobicContact CD2-CB 4.32Å; L142-V145 HydrophobicContact CD2-CG1 4.28Å; L142-V145 WeakPolarHBondContact O-CB 3.4Å; L142-V145 PolarHBondContact O-N 3.3Å; L142-V145 VanDerWaalsContact O-N 3.12Å; L142-I147 HydrophobicContact CD1-CD1 4.21Å; L142-I147 HydrophobicContact CD2-CD1 4.18Å
143	H	88	Confident	84	Confident	66 Å²	66	74.2 Å²	74.2	31%	0.306	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	124.6	175.6	-171.6	82.6	0	0	0	111	E87 P140 V145	E87-H143 PolarHBondContact O-CE1 3.13Å; P140-H143 VanDerWaalsContact O-CB 3.28Å; P140-H143 WeakPolarHBondContact O-CB 3.5Å; P140-H143 PolarHBondContact O-N 2.97Å; H143-V145 PolarHBondContact O-N 3.49Å
144	G	84.1	Confident	83.5	Confident	36 Å²	36	74.6 Å²	74.6	37%	0.371	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	-2.4	-176.9	0	0	0	0	0	114.5	E87 L142	E87-G144 WeakPolarHBondContact OE1-CA 3.35Å; E87-G144 PolarHBondContact OE1-N 2.7Å; L142-G144 PolarHBondContact O-N 3.38Å
145	V	85.4	Confident	82.8	Confident	70 Å²	70	78.5 Å²	78.5	42%	0.424	40%	0.398	S	S	.	.			trans	-83.4	137.1	-178.6	-178.2	0	0	0	0	109.7	L142 H143 I147	L142-V145 HydrophobicContact CD2-CB 4.32Å; L142-V145 HydrophobicContact CD2-CG1 4.28Å; L142-V145 WeakPolarHBondContact O-CB 3.4Å; L142-V145 PolarHBondContact O-N 3.3Å; L142-V145 VanDerWaalsContact O-N 3.12Å; H143-V145 PolarHBondContact O-N 3.49Å; V145-I147 HydrophobicContact CG1-CG1 4.14Å
146	R	85.5	Confident	82	Confident	59 Å²	59	81.1 Å²	81.1	22%	0.223	41%	0.41	C	S	.	.			trans	-114.7	86.2	176.4	-60.3	-61.7	179.7	-102.9	2.6	108.9	F82 E87 F148 G149 I150 N151	F82-R146 PolarHBondContact O-NH2 3.08Å; E87-R146 IonicContact OE1-CZ 3.96Å; E87-R146 IonicContact OE1-NH1 3.49Å; E87-R146 PolarHBondContact OE1-NH1 3.31Å; E87-R146 IonicContact OE1-NH2 3.57Å; E87-R146 PolarHBondContact OE1-NH2 3.26Å; E87-R146 IonicContact OE2-CZ 3.33Å; E87-R146 IonicContact OE2-NH1 2.73Å; E87-R146 PolarHBondContact OE2-NH1 3.12Å; E87-R146 IonicContact OE2-NH2 3.53Å; E87-R146 PolarHBondContact OE2-NH2 3.25Å; R146-F148 PolarHBondContact O-N 3.31Å; R146-G149 PolarHBondContact O-N 2.66Å; R146-I150 WeakPolarHBondContact CB-O 3.26Å; R146-I150 VanDerWaalsContact CD-O 3.25Å; R146-I150 WeakPolarHBondContact CD-O 3.28Å; R146-N151 WeakPolarHBondContact CD-O 3.15Å; R146-N151 PolarHBondContact NE-O 3.43Å
147	I	74.5	Confident	81.2	Confident	83 Å²	83	81.9 Å²	81.9	43%	0.426	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-59.7	128.7	179.5	-55.8	176	0	0	0	108.3	L142 V145 G149 I150	L142-I147 HydrophobicContact CD1-CD1 4.21Å; L142-I147 HydrophobicContact CD2-CD1 4.18Å; V145-I147 HydrophobicContact CG1-CG1 4.14Å; I147-G149 PolarHBondContact O-N 2.79Å; I147-G149 VanDerWaalsContact O-N 3.09Å; I147-I150 PolarHBondContact O-N 3.49Å
148	F	73.5	Confident	80.5	Confident	197 Å²	197	84.9 Å²	84.9	86%	0.864	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	56.5	18.3	-174.4	-50.9	-60.4	0	0	0	115.7	R146 I150	R146-F148 PolarHBondContact O-N 3.31Å; F148-I150 HydrophobicContact CB-CG1 4.41Å; F148-I150 PolarHBondContact O-N 3.03Å
149	G	68.1	Low	79.5	Confident	40 Å²	40	89.9 Å²	89.9	41%	0.412	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	71.7	8.5	-176.9	0	0	0	0	0	114.5	R146 I147 N151 K152	R146-G149 PolarHBondContact O-N 2.66Å; I147-G149 PolarHBondContact O-N 2.79Å; I147-G149 VanDerWaalsContact O-N 3.09Å; G149-N151 PolarHBondContact O-N 2.97Å; G149-K152 WeakPolarHBondContact O-CB 3.33Å; G149-K152 PolarHBondContact O-N 3.36Å
150	I	67.9	Low	78.5	Confident	101 Å²	101	90.3 Å²	90.3	52%	0.518	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	131.4	172.3	-61.9	171.5	0	0	0	108	R146 I147 F148 K152	R146-I150 WeakPolarHBondContact CB-O 3.26Å; R146-I150 VanDerWaalsContact CD-O 3.25Å; R146-I150 WeakPolarHBondContact CD-O 3.28Å; I147-I150 PolarHBondContact O-N 3.49Å; F148-I150 HydrophobicContact CB-CG1 4.41Å; F148-I150 PolarHBondContact O-N 3.03Å; I150-K152 PolarHBondContact O-N 2.99Å
151	N	64.6	Low	77.5	Confident	40 Å²	40	93.8 Å²	93.8	21%	0.214	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	36.2	179.3	-133.4	2.4	0	0	0	113.4	H65 L66 K68 R146 G149	H65-N151 PolarHBondContact O-ND2 3.42Å; L66-N151 PolarHBondContact O-ND2 2.96Å; L66-N151 VanDerWaalsContact O-ND2 3.13Å; K68-N151 VanDerWaalsContact CD-OD1 3.28Å; K68-N151 WeakPolarHBondContact CD-OD1 2.99Å; K68-N151 WeakPolarHBondContact CE-ND2 3.33Å; K68-N151 WeakPolarHBondContact CE-O 3.43Å; K68-N151 WeakPolarHBondContact CE-OD1 3.41Å; K68-N151 VanDerWaalsContact NZ-C 3.3Å; K68-N151 PolarHBondContact NZ-O 2.91Å; K68-N151 PolarHBondContact NZ-OD1 3.05Å; R146-N151 WeakPolarHBondContact CD-O 3.15Å; R146-N151 PolarHBondContact NE-O 3.43Å; G149-N151 PolarHBondContact O-N 2.97Å
152	K	68.8	Low	76.3	Confident	126 Å²	126	89.2 Å²	89.2	55%	0.548	45%	0.446	S	S	.	.			trans	-73	-33.4	177.4	-173.5	178	-179.8	-174.2	0	114	G149 I150	G149-K152 WeakPolarHBondContact O-CB 3.33Å; G149-K152 PolarHBondContact O-N 3.36Å; I150-K152 PolarHBondContact O-N 2.99Å
153	Y	65.1	Low	75.1	Confident	210 Å²	210	93.5 Å²	93.5	82%	0.824	47%	0.466	S	S	*	.			trans	-103.9	0	-180	-52.8	-69.2	0	0	0	110	K68 F82	K68-Y153 PolarHBondContact NZ-O 3.03Å; K68-Y153 PolarHBondContact NZ-OXT 3.17Å; F82-Y153 WeakPolarHBondContact CD1-OXT 3.08Å

Retrieved 153 of 153 residues in 973.1 ms (Link to these results)

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