A0A077Z8R9_TRITR Loading...

DUF7041 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z8R9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 134 aa.

						>A0A077Z8R9_TRITR|A0A077Z8R9
MGKKGNCSQPSTAPTAEPETPQPSVPTSLAVPTFLFTNPELWFARLDLFFRHRHVHDEETMFDLALSAMTEETFRTLCDFILTAGQQTAPFTVFKAICLDQPADGRVHRICQAITDEELAQAIHRPFSFAGYNS
					

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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	38.7	Very low	50.4	Low	252 Å²	252	150.6 Å²	150.6	100%	1.241	88%	0.878	S	S	*	*				0	131.4	0	-87.9	162.1	157.1	0	0	108.8
2	G	49.4	Very low	50.2	Low	80 Å²	80	149.1 Å²	149.1	83%	0.825	87%	0.872	S	S	*	*			trans	99.3	90.1	163.8	0	0	0	0	0	117.1
3	K	60.1	Low	50.4	Low	211 Å²	211	144.7 Å²	144.7	92%	0.917	86%	0.863	S	S	*	*			trans	-157.5	95.4	137.1	-131.4	176.1	172.5	-179.5	0	109.7	G5	K3-G5 PolarHBondContact O-N 2.82Å
4	K	49.9	Very low	50.5	Low	217 Å²	217	142.6 Å²	142.6	94%	0.943	86%	0.855	S	S	*	*			trans	-68.7	111.7	166	-84.3	176.3	171.5	178.6	0	107.3
5	G	49.7	Very low	50.3	Low	80 Å²	80	141.2 Å²	141.2	83%	0.825	85%	0.848	S	S	*	*			trans	-112.6	97.1	164.2	0	0	0	0	0	107.6	K3	K3-G5 PolarHBondContact O-N 2.82Å
6	N	48.2	Very low	50.4	Low	163 Å²	163	138.9 Å²	138.9	87%	0.872	85%	0.849	S	S	*	*			trans	-114.8	106.2	166.7	-170.4	21.9	0	0	0	105.8
7	C	50	Low	50.1	Low	115 Å²	115	140.6 Å²	140.6	78%	0.777	85%	0.845	S	S	*	*			trans	-135.4	110.5	177.9	-148.2	0	0	0	0	108.7
8	S	47.6	Very low	50.2	Low	99 Å²	99	139.4 Å²	139.4	69%	0.692	84%	0.841	S	S	*	*			trans	65.5	97.2	144	-51.9	0	0	0	0	118.8
9	Q	54.8	Low	50.1	Low	197 Å²	197	142.1 Å²	142.1	92%	0.921	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-97.9	117.9	137	-82.2	-176.2	-80.3	0	0	108.5
10	P	52.1	Low	50.5	Low	115 Å²	115	141.5 Å²	141.5	75%	0.747	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-74.1	129.4	168.5	27.6	-28.5	0	0	0	109.9	T12	P10-T12 PolarHBondContact O-N 3.33Å
11	S	54.4	Low	50.6	Low	128 Å²	128	140.2 Å²	140.2	90%	0.895	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-73.9	119.3	176.6	-169.1	0	0	0	0	110.4
12	T	47.5	Very low	51.4	Low	132 Å²	132	135.9 Å²	135.9	81%	0.81	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-81.4	135.8	169	-46	0	0	0	0	109.9	P10	P10-T12 PolarHBondContact O-N 3.33Å
13	A	53.4	Low	51.6	Low	92 Å²	92	138 Å²	138	76%	0.76	81%	0.812	S	S	*	*			trans	156	159.3	144.9	0	0	0	0	0	111.3
14	P	51	Low	51.4	Low	115 Å²	115	132.1 Å²	132.1	75%	0.747	80%	0.798	S	S	*	*				-125.8	168.2	-105.1	25.1	-0.8	0	0	0	115.3
15	T	47.8	Very low	51.9	Low	122 Å²	122	127.1 Å²	127.1	75%	0.748	79%	0.786	S	S	*	*			trans	47.7	90.5	147.8	-57.2	0	0	0	0	117.5	E17	T15-E17 HydrophobicContact CG2-CG 4.47Å; T15-E17 PolarHBondContact O-N 3.44Å
16	A	51.1	Low	52.2	Low	105 Å²	105	128.9 Å²	128.9	87%	0.868	78%	0.782	S	S	*	*			trans	-71.8	110.9	155.8	0	0	0	0	0	108.9
17	E	45.7	Very low	52.8	Low	168 Å²	168	125.3 Å²	125.3	79%	0.785	77%	0.767	S	S	*	*			trans	-67.3	153.5	164.8	-78.1	-175.2	107.5	0	0	110.8	T15 E19	T15-E17 HydrophobicContact CG2-CG 4.47Å; T15-E17 PolarHBondContact O-N 3.44Å; E17-E19 PolarHBondContact O-N 2.99Å
18	P	52.2	Low	53.5	Low	118 Å²	118	124.8 Å²	124.8	77%	0.766	77%	0.765	S	S	*	*			trans	-74.2	118.2	-165.6	-9.7	26.6	0	0	0	111.1	T20	P18-T20 PolarHBondContact O-N 3.47Å
19	E	49.3	Very low	54.7	Low	191 Å²	191	123.3 Å²	123.3	89%	0.893	75%	0.749	S	S	*	*			trans	-56.2	113.4	165.3	-75.5	-166.9	108	0	0	108.8	E17	E17-E19 PolarHBondContact O-N 2.99Å
20	T	57.8	Low	56.1	Low	129 Å²	129	117.8 Å²	117.8	79%	0.791	74%	0.736	S	S	*	*			trans	-60	124.2	169.5	-35.8	0	0	0	0	106.5	P18 Q22	P18-T20 PolarHBondContact O-N 3.47Å; T20-Q22 PolarHBondContact O-N 2.95Å
21	P	52.6	Low	57.7	Low	116 Å²	116	114 Å²	114	75%	0.753	71%	0.711	S	S	*	*			trans	-67.8	100.2	-175.8	21	-24.9	0	0	0	108	P23	P21-P23 WeakPolarHBondContact O-CD 2.91Å
22	Q	54.8	Low	59.3	Low	161 Å²	161	108.6 Å²	108.6	75%	0.752	67%	0.673	S	S	*	*			trans	-60.4	120.2	164	-110.9	-141.7	4.1	0	0	106.2	T20 S24	T20-Q22 PolarHBondContact O-N 2.95Å; Q22-S24 PolarHBondContact O-N 2.97Å; Q22-S24 PolarHBondContact O-OG 2.75Å
23	P	53.6	Low	61.3	Low	123 Å²	123	106.9 Å²	106.9	80%	0.799	66%	0.662	S	S	*	*			trans	-71.2	77	170	29.5	-31	0	0	0	107.6	P21 V25	P21-P23 WeakPolarHBondContact O-CD 2.91Å; P23-V25 PolarHBondContact O-N 2.78Å
24	S	56	Low	62.9	Low	89 Å²	89	103.6 Å²	103.6	62%	0.622	63%	0.631	S	S	*	*			trans	-80.2	78.8	170.3	30.8	0	0	0	0	105.9	Q22 P26	Q22-S24 PolarHBondContact O-N 2.97Å; Q22-S24 PolarHBondContact O-OG 2.75Å; S24-P26 WeakPolarHBondContact O-CD 3.33Å
25	V	59.7	Low	64.6	Low	111 Å²	111	100.5 Å²	100.5	67%	0.673	61%	0.608	S	S	*	*			trans	-74.3	104.6	151.1	-178.1	0	0	0	0	103.9	P23 T27	P23-V25 PolarHBondContact O-N 2.78Å; V25-T27 PolarHBondContact O-N 3.25Å
26	P	55.9	Low	66.1	Low	117 Å²	117	98.9 Å²	98.9	76%	0.76	59%	0.591	S	S	*	*			trans	-64.4	88.1	166.4	27.9	-33.2	0	0	0	106.1	S24 S28	S24-P26 WeakPolarHBondContact O-CD 3.33Å; P26-S28 PolarHBondContact O-N 3.4Å
27	T	62	Low	67.7	Low	89 Å²	89	100.3 Å²	100.3	55%	0.546	59%	0.589	S	S	.	*			trans	-71.9	93.6	168.2	-53.6	0	0	0	0	103.7	V25 L29	V25-T27 PolarHBondContact O-N 3.25Å; T27-L29 HydrophobicContact CG2-CD2 3.73Å; T27-L29 HydrophobicContact CG2-CG 4.34Å; T27-L29 PolarHBondContact O-N 2.76Å
28	S	65.1	Low	69.5	Low	104 Å²	104	95.5 Å²	95.5	73%	0.727	57%	0.568	S	S	*	*			trans	-63.2	84.7	168.6	179.5	0	0	0	0	106.9	P26 A30	P26-S28 PolarHBondContact O-N 3.4Å; S28-A30 PolarHBondContact O-N 2.82Å; S28-A30 VanDerWaalsContact O-N 3.09Å
29	L	71.6	Confident	71.2	Confident	68 Å²	68	91.5 Å²	91.5	36%	0.356	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-58	116.1	172.9	-65.1	177.5	0	0	0	107.1	T27 F49 H52 R53	T27-L29 HydrophobicContact CG2-CD2 3.73Å; T27-L29 HydrophobicContact CG2-CG 4.34Å; T27-L29 PolarHBondContact O-N 2.76Å; L29-F49 HydrophobicContact CB-CD2 4.23Å; L29-F49 HydrophobicContact CB-CE2 4.14Å; L29-F49 WeakPolarHBondContact O-CE2 3.24Å; L29-H52 HydrophobicContact CD1-CB 4.49Å; L29-H52 VanDerWaalsContact CD1-CD2 3.47Å; L29-H52 WeakPolarHBondContact CD1-CD2 2.96Å; L29-R53 VanDerWaalsContact N-NH2 3.15Å; L29-R53 PolarHBondContact O-NH1 2.95Å; L29-R53 PolarHBondContact O-NH2 3.48Å
30	A	84.2	Confident	73.1	Confident	80 Å²	80	89 Å²	89	66%	0.661	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-71	156.5	169.1	0	0	0	0	0	109	S28 P32	S28-A30 PolarHBondContact O-N 2.82Å; S28-A30 VanDerWaalsContact O-N 3.09Å; A30-P32 WeakPolarHBondContact O-CD 3.38Å
31	V	86.7	Confident	74.6	Confident	35 Å²	35	87 Å²	87	21%	0.212	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-58.9	128.6	169.3	-169.9	0	0	0	0	107.7	T33 L46 F49 L64 A68	V31-T33 PolarHBondContact O-N 3.21Å; V31-L46 HydrophobicContact CG1-CD2 3.94Å; V31-F49 HydrophobicContact CB-CE1 4.47Å; V31-F49 HydrophobicContact CB-CZ 4.35Å; V31-F49 HydrophobicContact CG1-CE1 4.42Å; V31-F49 HydrophobicContact CG2-CE1 3.9Å; V31-F49 HydrophobicContact CG2-CZ 3.72Å; V31-L64 HydrophobicContact CG2-CD2 3.94Å; V31-A68 HydrophobicContact CB-CB 4.4Å; V31-A68 HydrophobicContact CG1-CB 3.64Å
32	P	87.7	Confident	76.5	Confident	15 Å²	15	81.5 Å²	81.5	10%	0.097	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-58.4	127	178.4	-23.3	32	0	0	0	111.6	A30 W42 R45 F49 A68	A30-P32 WeakPolarHBondContact O-CD 3.38Å; P32-W42 PolarHBondContact O-NE1 3.4Å; P32-R45 HydrophobicContact CB-CB 4.25Å; P32-R45 HydrophobicContact CG-CB 4.15Å; P32-F49 HydrophobicContact CG-CB 4.3Å; P32-A68 WeakPolarHBondContact O-CB 3.31Å
33	T	89.5	Confident	78.3	Confident	96 Å²	96	74 Å²	74	59%	0.589	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-58.9	141.1	175	-48	0	0	0	0	111.7	V31 W42	V31-T33 PolarHBondContact O-N 3.21Å; T33-W42 PolarHBondContact O-NE1 3.05Å
34	F	86.9	Confident	80.2	Confident	23 Å²	23	70.3 Å²	70.3	10%	0.101	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-57	134.7	178.2	-173.7	-99.1	0	0	0	113.1	F36 W42 A68 M69 T73 L77	F34-F36 HydrophobicContact CD1-CB 4.43Å; F34-F36 HydrophobicContact CE1-CB 3.98Å; F34-F36 AromaticContact CE1-CD2 3.96Å; F34-F36 HydrophobicContact CE1-CD2 3.96Å; F34-F36 HydrophobicContact CE1-CG 4.43Å; F34-W42 HydrophobicContact CB-CZ2 4.27Å; F34-W42 AromaticContact CD2-CD2 3.59Å; F34-W42 HydrophobicContact CD2-CD2 3.59Å; F34-W42 AromaticContact CD2-CE2 3.73Å; F34-W42 AromaticContact CD2-CE3 3.45Å; F34-W42 HydrophobicContact CD2-CE3 3.45Å; F34-W42 VanDerWaalsContact CD2-CE3 3.45Å; F34-W42 HydrophobicContact CD2-CG 4.37Å; F34-W42 AromaticContact CD2-CH2 3.59Å; F34-W42 HydrophobicContact CD2-CH2 3.59Å; F34-W42 AromaticContact CD2-CZ2 3.72Å; F34-W42 HydrophobicContact CD2-CZ2 3.72Å; F34-W42 AromaticContact CD2-CZ3 3.45Å; F34-W42 HydrophobicContact CD2-CZ3 3.45Å; F34-W42 VanDerWaalsContact CD2-CZ3 3.45Å; F34-W42 HydrophobicContact CE2-CD2 4.16Å; F34-W42 AromaticContact CE2-CE3 3.59Å; F34-W42 HydrophobicContact CE2-CE3 3.59Å; F34-W42 HydrophobicContact CE2-CH2 4.14Å; F34-W42 AromaticContact CE2-CZ3 3.59Å; F34-W42 HydrophobicContact CE2-CZ3 3.59Å; F34-W42 HydrophobicContact CG-CD2 4.47Å; F34-A68 WeakPolarHBondContact CB-O 3.5Å; F34-A68 PolarHBondContact N-O 2.92Å; F34-M69 HydrophobicContact CB-CG 4.07Å; F34-M69 HydrophobicContact CD2-CE 3.63Å; F34-M69 HydrophobicContact CD2-CG 4.17Å; F34-M69 HydrophobicContact CD2-SD 4.49Å; F34-M69 HydrophobicContact CE2-CE 3.8Å; F34-M69 HydrophobicContact CG-CE 4.45Å; F34-M69 HydrophobicContact CG-CG 4.16Å; F34-T73 HydrophobicContact CD1-CG2 3.37Å; F34-T73 HydrophobicContact CE1-CG2 3.43Å; F34-T73 VanDerWaalsContact CE1-CG2 3.43Å; F34-T73 HydrophobicContact CG-CG2 3.99Å; F34-T73 HydrophobicContact CZ-CG2 4.1Å; F34-L77 HydrophobicContact CE2-CD1 4.4Å; F34-L77 HydrophobicContact CZ-CD1 4.04Å
35	L	85.8	Confident	81.9	Confident	51 Å²	51	71.8 Å²	71.8	27%	0.267	42%	0.416	S	S	.	.			trans	-112.8	98.4	176.7	-60.4	174.2	0	0	0	110.6	T37 N38 L41 W42	L35-T37 PolarHBondContact O-N 3.43Å; L35-N38 CarbonylContact O-C 3.49Å; L35-N38 VanDerWaalsContact O-C 3.31Å; L35-N38 PolarHBondContact O-N 3.14Å; L35-L41 HydrophobicContact CD1-CD2 4.42Å; L35-W42 HydrophobicContact CB-CB 4.08Å; L35-W42 HydrophobicContact CD1-CB 4.45Å; L35-W42 HydrophobicContact CG-CB 4.35Å
36	F	80	Confident	83.5	Confident	87 Å²	87	66.5 Å²	66.5	38%	0.382	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-27.9	177.4	-165	-86.1	0	0	0	113	F34 T76	F34-F36 HydrophobicContact CD1-CB 4.43Å; F34-F36 HydrophobicContact CE1-CB 3.98Å; F34-F36 AromaticContact CE1-CD2 3.96Å; F34-F36 HydrophobicContact CE1-CD2 3.96Å; F34-F36 HydrophobicContact CE1-CG 4.43Å; F36-T76 HydrophobicContact CE2-CG2 4.31Å
37	T	83.7	Confident	85.2	Confident	135 Å²	135	64.1 Å²	64.1	83%	0.828	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-25.3	-179.7	50.9	0	0	0	0	113.7	L35	L35-T37 PolarHBondContact O-N 3.43Å
38	N	85.1	Confident	86.7	Confident	67 Å²	67	64.6 Å²	64.6	36%	0.358	36%	0.363	S	S	.	.			trans	-152.6	80.4	-179.8	-167.5	-22.8	0	0	0	109.6	L35 E40 L41 W42	L35-N38 CarbonylContact O-C 3.49Å; L35-N38 VanDerWaalsContact O-C 3.31Å; L35-N38 PolarHBondContact O-N 3.14Å; N38-E40 VanDerWaalsContact C-N 3.25Å; N38-E40 PolarHBondContact O-N 3.04Å; N38-E40 PolarHBondContact OD1-N 2.98Å; N38-L41 HydrophobicContact CB-CB 4.1Å; N38-L41 PolarHBondContact O-N 3.33Å; N38-L41 WeakPolarHBondContact OD1-CB 3.29Å; N38-L41 PolarHBondContact OD1-N 3.29Å; N38-W42 PolarHBondContact O-N 3.21Å
39	P	86.8	Confident	87.9	Confident	34 Å²	34	60.1 Å²	60.1	22%	0.221	33%	0.331	C	S	.	.	H	α-helix	trans	-62.6	-34	-179.6	23.8	-32.9	0	0	0	111.8	L41 W42 F43 L99	P39-L41 PolarHBondContact O-N 3.45Å; P39-W42 WeakPolarHBondContact O-CB 3.18Å; P39-W42 PolarHBondContact O-N 3.3Å; P39-W42 VanDerWaalsContact O-N 3.14Å; P39-F43 HydrophobicContact CB-CE2 4.39Å; P39-F43 WeakPolarHBondContact O-CD2 3.41Å; P39-F43 PolarHBondContact O-N 2.74Å; P39-L99 HydrophobicContact CB-CD2 4.41Å; P39-L99 HydrophobicContact CG-CD2 4.42Å
40	E	89.2	Confident	89	Confident	140 Å²	140	57.1 Å²	57.1	65%	0.654	32%	0.315	S	S	*	.	H	α-helix	trans	-59.5	-47.4	177.7	-171.9	-178.7	-178	0	0	111.8	N38 W42 F43 A44 L99	N38-E40 VanDerWaalsContact C-N 3.25Å; N38-E40 PolarHBondContact O-N 3.04Å; N38-E40 PolarHBondContact OD1-N 2.98Å; E40-W42 VanDerWaalsContact C-N 3.3Å; E40-W42 PolarHBondContact O-N 3.24Å; E40-F43 PolarHBondContact O-N 3.35Å; E40-A44 PolarHBondContact O-N 2.85Å; E40-L99 HydrophobicContact CB-CD2 3.99Å
41	L	90.1	Very high	89.3	Confident	87 Å²	87	61.4 Å²	61.4	46%	0.455	31%	0.314	S	S	.	.	H	α-helix	trans	-62.8	-38.4	175.4	-179.7	62.1	0	0	0	111.9	L35 N38 P39 A44 R45	L35-L41 HydrophobicContact CD1-CD2 4.42Å; N38-L41 HydrophobicContact CB-CB 4.1Å; N38-L41 PolarHBondContact O-N 3.33Å; N38-L41 WeakPolarHBondContact OD1-CB 3.29Å; N38-L41 PolarHBondContact OD1-N 3.29Å; P39-L41 PolarHBondContact O-N 3.45Å; L41-A44 PolarHBondContact O-N 3.5Å; L41-R45 WeakPolarHBondContact O-CG 3.46Å; L41-R45 PolarHBondContact O-N 3.35Å
42	W	92.7	Very high	89.4	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-63.9	-44.2	176.8	177.3	69.6	0	0	0	111.9	P32 T33 F34 L35 N38 P39 E40 A44 R45 L46 A65 A68 M69 F94	P32-W42 PolarHBondContact O-NE1 3.4Å; T33-W42 PolarHBondContact O-NE1 3.05Å; F34-W42 HydrophobicContact CB-CZ2 4.27Å; F34-W42 AromaticContact CD2-CD2 3.59Å; F34-W42 HydrophobicContact CD2-CD2 3.59Å; F34-W42 AromaticContact CD2-CE2 3.73Å; F34-W42 AromaticContact CD2-CE3 3.45Å; F34-W42 HydrophobicContact CD2-CE3 3.45Å; F34-W42 VanDerWaalsContact CD2-CE3 3.45Å; F34-W42 HydrophobicContact CD2-CG 4.37Å; F34-W42 AromaticContact CD2-CH2 3.59Å; F34-W42 HydrophobicContact CD2-CH2 3.59Å; F34-W42 AromaticContact CD2-CZ2 3.72Å; F34-W42 HydrophobicContact CD2-CZ2 3.72Å; F34-W42 AromaticContact CD2-CZ3 3.45Å; F34-W42 HydrophobicContact CD2-CZ3 3.45Å; F34-W42 VanDerWaalsContact CD2-CZ3 3.45Å; F34-W42 HydrophobicContact CE2-CD2 4.16Å; F34-W42 AromaticContact CE2-CE3 3.59Å; F34-W42 HydrophobicContact CE2-CE3 3.59Å; F34-W42 HydrophobicContact CE2-CH2 4.14Å; F34-W42 AromaticContact CE2-CZ3 3.59Å; F34-W42 HydrophobicContact CE2-CZ3 3.59Å; F34-W42 HydrophobicContact CG-CD2 4.47Å; L35-W42 HydrophobicContact CB-CB 4.08Å; L35-W42 HydrophobicContact CD1-CB 4.45Å; L35-W42 HydrophobicContact CG-CB 4.35Å; N38-W42 PolarHBondContact O-N 3.21Å; P39-W42 WeakPolarHBondContact O-CB 3.18Å; P39-W42 PolarHBondContact O-N 3.3Å; P39-W42 VanDerWaalsContact O-N 3.14Å; E40-W42 VanDerWaalsContact C-N 3.3Å; E40-W42 PolarHBondContact O-N 3.24Å; W42-A44 PolarHBondContact O-N 2.76Å; W42-R45 WeakPolarHBondContact O-CB 3.26Å; W42-R45 PolarHBondContact O-N 2.92Å; W42-R45 VanDerWaalsContact O-N 3.14Å; W42-L46 HydrophobicContact CD2-CD1 3.98Å; W42-L46 HydrophobicContact CD2-CG 4.36Å; W42-L46 HydrophobicContact CE3-CD1 3.97Å; W42-L46 HydrophobicContact CH2-CD1 3.44Å; W42-L46 VanDerWaalsContact CH2-CD1 3.44Å; W42-L46 HydrophobicContact CZ2-CD1 3.44Å; W42-L46 VanDerWaalsContact CZ2-CD1 3.44Å; W42-L46 HydrophobicContact CZ2-CD2 4.38Å; W42-L46 HydrophobicContact CZ2-CG 4.12Å; W42-L46 HydrophobicContact CZ3-CD1 3.7Å; W42-L46 PolarHBondContact O-N 3.13Å; W42-A65 HydrophobicContact CH2-CB 3.94Å; W42-A68 HydrophobicContact CZ2-CB 3.84Å; W42-M69 HydrophobicContact CH2-CE 3.38Å; W42-M69 HydrophobicContact CZ2-CE 4.24Å; W42-M69 HydrophobicContact CZ3-CE 3.84Å; W42-F94 HydrophobicContact CZ3-CE1 4.38Å
43	F	92.9	Very high	89.5	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.009	34%	0.343	C	S	.	.	H	α-helix	trans	-62.3	-40.2	174.4	-76.4	-65.2	0	0	0	112.4	P39 E40 R45 L46 D47 F91 F94 K95 C98 L99	P39-F43 HydrophobicContact CB-CE2 4.39Å; P39-F43 WeakPolarHBondContact O-CD2 3.41Å; P39-F43 PolarHBondContact O-N 2.74Å; E40-F43 PolarHBondContact O-N 3.35Å; F43-R45 VanDerWaalsContact C-N 3.26Å; F43-R45 PolarHBondContact O-N 2.81Å; F43-L46 HydrophobicContact CD1-CD1 4.18Å; F43-L46 WeakPolarHBondContact O-CB 3.45Å; F43-L46 PolarHBondContact O-N 3.05Å; F43-L46 VanDerWaalsContact O-N 3.13Å; F43-D47 VanDerWaalsContact O-CG 3.26Å; F43-D47 PolarHBondContact O-N 3.3Å; F43-F91 HydrophobicContact CD1-CE2 4.29Å; F43-F91 HydrophobicContact CD1-CZ 4.05Å; F43-F91 HydrophobicContact CE1-CE2 4.13Å; F43-F91 HydrophobicContact CE1-CZ 4.3Å; F43-F94 HydrophobicContact CE1-CD1 4.34Å; F43-F94 HydrophobicContact CE1-CE1 4.43Å; F43-F94 HydrophobicContact CZ-CD1 4.23Å; F43-F94 HydrophobicContact CZ-CE1 4.14Å; F43-K95 HydrophobicContact CB-CD 4.39Å; F43-K95 HydrophobicContact CD1-CB 4.14Å; F43-K95 HydrophobicContact CD1-CD 3.94Å; F43-K95 HydrophobicContact CD1-CG 3.76Å; F43-K95 HydrophobicContact CD2-CG 4.05Å; F43-K95 HydrophobicContact CE1-CB 3.76Å; F43-K95 HydrophobicContact CE1-CD 4.43Å; F43-K95 HydrophobicContact CE1-CG 3.87Å; F43-K95 HydrophobicContact CE2-CG 4.16Å; F43-K95 HydrophobicContact CG-CD 4.13Å; F43-K95 HydrophobicContact CG-CG 3.87Å; F43-K95 HydrophobicContact CZ-CB 3.99Å; F43-K95 HydrophobicContact CZ-CG 4.08Å; F43-C98 HydrophobicContact CE2-CB 3.69Å; F43-C98 HydrophobicContact CZ-CB 3.78Å; F43-L99 HydrophobicContact CD2-CD2 4.05Å; F43-L99 HydrophobicContact CD2-CG 4.24Å; F43-L99 HydrophobicContact CE2-CD2 4.36Å; F43-L99 HydrophobicContact CE2-CG 4.29Å
44	A	92.7	Very high	89.5	Confident	47 Å²	47	71.8 Å²	71.8	39%	0.388	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-36.6	174.6	0	0	0	0	0	112.2	E40 L41 W42 L48	E40-A44 PolarHBondContact O-N 2.85Å; L41-A44 PolarHBondContact O-N 3.5Å; W42-A44 PolarHBondContact O-N 2.76Å; A44-L48 WeakPolarHBondContact O-CG 3.02Å; A44-L48 PolarHBondContact O-N 3.47Å
45	R	92.3	Very high	89.7	Confident	120 Å²	120	71.8 Å²	71.8	45%	0.453	35%	0.349	S	S	.	.	H	α-helix	trans	-69.4	-37.8	173.9	-69.6	178.5	72.7	-169.1	2.7	112.2	P32 L41 W42 F43 L48 F49	P32-R45 HydrophobicContact CB-CB 4.25Å; P32-R45 HydrophobicContact CG-CB 4.15Å; L41-R45 WeakPolarHBondContact O-CG 3.46Å; L41-R45 PolarHBondContact O-N 3.35Å; W42-R45 WeakPolarHBondContact O-CB 3.26Å; W42-R45 PolarHBondContact O-N 2.92Å; W42-R45 VanDerWaalsContact O-N 3.14Å; F43-R45 VanDerWaalsContact C-N 3.26Å; F43-R45 PolarHBondContact O-N 2.81Å; R45-L48 PolarHBondContact O-N 3.28Å; R45-F49 WeakPolarHBondContact O-CB 3.36Å; R45-F49 PolarHBondContact O-N 3.45Å
46	L	93	Very high	90	Very high	0 Å²	0	76 Å²	76	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-63.4	-43.7	173.1	-78.2	-179.8	0	0	0	111.8	V31 W42 F43 L48 F49 F50 A65 F91	V31-L46 HydrophobicContact CG1-CD2 3.94Å; W42-L46 HydrophobicContact CD2-CD1 3.98Å; W42-L46 HydrophobicContact CD2-CG 4.36Å; W42-L46 HydrophobicContact CE3-CD1 3.97Å; W42-L46 HydrophobicContact CH2-CD1 3.44Å; W42-L46 VanDerWaalsContact CH2-CD1 3.44Å; W42-L46 HydrophobicContact CZ2-CD1 3.44Å; W42-L46 VanDerWaalsContact CZ2-CD1 3.44Å; W42-L46 HydrophobicContact CZ2-CD2 4.38Å; W42-L46 HydrophobicContact CZ2-CG 4.12Å; W42-L46 HydrophobicContact CZ3-CD1 3.7Å; W42-L46 PolarHBondContact O-N 3.13Å; F43-L46 HydrophobicContact CD1-CD1 4.18Å; F43-L46 WeakPolarHBondContact O-CB 3.45Å; F43-L46 PolarHBondContact O-N 3.05Å; F43-L46 VanDerWaalsContact O-N 3.13Å; L46-L48 VanDerWaalsContact C-N 3.26Å; L46-L48 PolarHBondContact O-N 2.7Å; L46-F49 CarbonylContact O-C 3.31Å; L46-F49 WeakPolarHBondContact O-CA 3.3Å; L46-F49 WeakPolarHBondContact O-CB 3.18Å; L46-F49 PolarHBondContact O-N 3.24Å; L46-F50 HydrophobicContact CB-CD2 4.37Å; L46-F50 HydrophobicContact CB-CE2 3.87Å; L46-F50 HydrophobicContact CB-CZ 4.17Å; L46-F50 HydrophobicContact CD1-CZ 4.41Å; L46-F50 HydrophobicContact CD2-CE1 4.38Å; L46-F50 HydrophobicContact CD2-CZ 4Å; L46-F50 HydrophobicContact CG-CZ 4.45Å; L46-F50 VanDerWaalsContact O-CD2 3.28Å; L46-F50 WeakPolarHBondContact O-CD2 3.38Å; L46-F50 VanDerWaalsContact O-CG 3.27Å; L46-F50 WeakPolarHBondContact O-CG 3.35Å; L46-F50 PolarHBondContact O-N 2.87Å; L46-A65 HydrophobicContact CD1-CB 3.99Å; L46-F91 HydrophobicContact CD1-CE2 4.19Å
47	D	92.1	Very high	90.6	Very high	67 Å²	67	75.5 Å²	75.5	36%	0.358	37%	0.368	S	S	.	.	H	α-helix	trans	-58.2	-41.6	178	-67.8	-22.8	0	0	0	110.8	F43 R51 K95	F43-D47 VanDerWaalsContact O-CG 3.26Å; F43-D47 PolarHBondContact O-N 3.3Å; D47-R51 WeakPolarHBondContact O-CB 3.29Å; D47-R51 PolarHBondContact O-N 3.44Å; D47-R51 VanDerWaalsContact O-N 3.09Å; D47-K95 IonicContact OD1-NZ 3.42Å; D47-K95 PolarHBondContact OD1-NZ 3.31Å; D47-K95 IonicContact OD2-NZ 2.92Å; D47-K95 PolarHBondContact OD2-NZ 3.24Å
48	L	91.6	Very high	91	Very high	98 Å²	98	71.5 Å²	71.5	51%	0.513	34%	0.34	S	S	.	.	H	α-helix	trans	-64.6	-42	173	-69.4	175.6	0	0	0	112.7	A44 R45 L46 H52	A44-L48 WeakPolarHBondContact O-CG 3.02Å; A44-L48 PolarHBondContact O-N 3.47Å; R45-L48 PolarHBondContact O-N 3.28Å; L46-L48 VanDerWaalsContact C-N 3.26Å; L46-L48 PolarHBondContact O-N 2.7Å; L48-H52 PolarHBondContact O-N 3.48Å
49	F	92	Very high	91.3	Very high	10 Å²	10	74.7 Å²	74.7	4%	0.044	35%	0.353	C	S	.	.	H	α-helix	trans	-63.8	-47.4	179	175.5	-97.6	0	0	0	111.7	L29 V31 P32 R45 L46 R51 H52 R53 L64	L29-F49 HydrophobicContact CB-CD2 4.23Å; L29-F49 HydrophobicContact CB-CE2 4.14Å; L29-F49 WeakPolarHBondContact O-CE2 3.24Å; V31-F49 HydrophobicContact CB-CE1 4.47Å; V31-F49 HydrophobicContact CB-CZ 4.35Å; V31-F49 HydrophobicContact CG1-CE1 4.42Å; V31-F49 HydrophobicContact CG2-CE1 3.9Å; V31-F49 HydrophobicContact CG2-CZ 3.72Å; P32-F49 HydrophobicContact CG-CB 4.3Å; R45-F49 WeakPolarHBondContact O-CB 3.36Å; R45-F49 PolarHBondContact O-N 3.45Å; L46-F49 CarbonylContact O-C 3.31Å; L46-F49 WeakPolarHBondContact O-CA 3.3Å; L46-F49 WeakPolarHBondContact O-CB 3.18Å; L46-F49 PolarHBondContact O-N 3.24Å; F49-R51 PolarHBondContact O-N 2.89Å; F49-H52 PolarHBondContact O-N 3.49Å; F49-R53 HydrophobicContact CD2-CG 4.43Å; F49-R53 HydrophobicContact CE1-CG 4.26Å; F49-R53 HydrophobicContact CE2-CG 4.04Å; F49-R53 HydrophobicContact CZ-CG 3.95Å; F49-R53 WeakPolarHBondContact O-CB 3.05Å; F49-R53 WeakPolarHBondContact O-CG 3.33Å; F49-R53 PolarHBondContact O-N 3.45Å; F49-L64 HydrophobicContact CE1-CD1 4.31Å
50	F	93.2	Very high	91.6	Very high	5 Å²	5	76 Å²	76	2%	0.022	36%	0.361	C	S	.	.	H	α-helix	trans	-62.1	-42.7	177.6	-63	-33.1	0	0	0	111.8	L46 H52 R53 H54 V55 M61 L64 F91	L46-F50 HydrophobicContact CB-CD2 4.37Å; L46-F50 HydrophobicContact CB-CE2 3.87Å; L46-F50 HydrophobicContact CB-CZ 4.17Å; L46-F50 HydrophobicContact CD1-CZ 4.41Å; L46-F50 HydrophobicContact CD2-CE1 4.38Å; L46-F50 HydrophobicContact CD2-CZ 4Å; L46-F50 HydrophobicContact CG-CZ 4.45Å; L46-F50 VanDerWaalsContact O-CD2 3.28Å; L46-F50 WeakPolarHBondContact O-CD2 3.38Å; L46-F50 VanDerWaalsContact O-CG 3.27Å; L46-F50 WeakPolarHBondContact O-CG 3.35Å; L46-F50 PolarHBondContact O-N 2.87Å; F50-H52 VanDerWaalsContact C-N 3.32Å; F50-H52 PolarHBondContact O-N 3.12Å; F50-R53 CarbonylContact O-C 3.46Å; F50-R53 PolarHBondContact O-N 3.46Å; F50-R53 VanDerWaalsContact O-N 3.17Å; F50-H54 WeakPolarHBondContact O-CA 3.42Å; F50-H54 PolarHBondContact O-N 3.29Å; F50-V55 HydrophobicContact CB-CB 4.1Å; F50-V55 HydrophobicContact CD1-CB 3.93Å; F50-V55 HydrophobicContact CD1-CG1 4.11Å; F50-V55 HydrophobicContact CD1-CG2 4.36Å; F50-V55 HydrophobicContact CG-CB 4.3Å; F50-V55 PolarHBondContact O-N 2.91Å; F50-M61 HydrophobicContact CB-CE 4.41Å; F50-M61 HydrophobicContact CD1-CG 4.29Å; F50-M61 HydrophobicContact CD2-CB 4.38Å; F50-M61 HydrophobicContact CD2-CE 4.34Å; F50-M61 HydrophobicContact CD2-CG 3.77Å; F50-M61 HydrophobicContact CD2-SD 3.95Å; F50-M61 HydrophobicContact CE1-CB 4.39Å; F50-M61 HydrophobicContact CE1-CG 4.3Å; F50-M61 HydrophobicContact CE2-CB 3.84Å; F50-M61 HydrophobicContact CE2-CG 3.76Å; F50-M61 HydrophobicContact CE2-SD 4.18Å; F50-M61 HydrophobicContact CG-CG 4.05Å; F50-M61 HydrophobicContact CZ-CB 3.86Å; F50-M61 HydrophobicContact CZ-CG 4.03Å; F50-M61 WeakPolarHBondContact CZ-O 3.36Å; F50-L64 HydrophobicContact CD1-CD1 4.22Å; F50-L64 HydrophobicContact CE1-CB 3.83Å; F50-L64 HydrophobicContact CE1-CD1 3.83Å; F50-L64 HydrophobicContact CZ-CB 4.38Å; F50-F91 HydrophobicContact CD2-CZ 4.44Å; F50-F91 HydrophobicContact CE2-CD2 4.43Å; F50-F91 HydrophobicContact CE2-CE1 4.12Å; F50-F91 AromaticContact CE2-CE2 3.74Å; F50-F91 HydrophobicContact CE2-CE2 3.74Å; F50-F91 AromaticContact CE2-CZ 3.57Å; F50-F91 HydrophobicContact CE2-CZ 3.57Å; F50-F91 HydrophobicContact CZ-CE2 4.17Å; F50-F91 HydrophobicContact CZ-CZ 4.44Å
51	R	91.1	Very high	91.9	Very high	171 Å²	171	70.5 Å²	70.5	65%	0.645	34%	0.335	S	S	*	.	H	α-helix	trans	-61.4	-40.1	175.3	-175.2	173.5	61.3	159.5	1.4	112.6	D47 F49 R53	D47-R51 WeakPolarHBondContact O-CB 3.29Å; D47-R51 PolarHBondContact O-N 3.44Å; D47-R51 VanDerWaalsContact O-N 3.09Å; F49-R51 PolarHBondContact O-N 2.89Å; R51-R53 VanDerWaalsContact C-N 3.32Å
52	H	89.4	Confident	92	Very high	116 Å²	116	67.1 Å²	67.1	54%	0.537	32%	0.317	S	S	.	.	H	α-helix	trans	-71.7	-28.1	177.6	-172.3	78.9	0	0	0	112.8	L29 L48 F49 F50	L29-H52 HydrophobicContact CD1-CB 4.49Å; L29-H52 VanDerWaalsContact CD1-CD2 3.47Å; L29-H52 WeakPolarHBondContact CD1-CD2 2.96Å; L48-H52 PolarHBondContact O-N 3.48Å; F49-H52 PolarHBondContact O-N 3.49Å; F50-H52 VanDerWaalsContact C-N 3.32Å; F50-H52 PolarHBondContact O-N 3.12Å
53	R	88.5	Confident	92	Very high	101 Å²	101	72.1 Å²	72.1	38%	0.381	34%	0.343	S	S	.	.	H	α-helix	trans	-95.9	1.1	179.4	-67.6	-66.3	178	82.6	-6.1	114.3	L29 F49 F50 R51 V55	L29-R53 VanDerWaalsContact N-NH2 3.15Å; L29-R53 PolarHBondContact O-NH1 2.95Å; L29-R53 PolarHBondContact O-NH2 3.48Å; F49-R53 HydrophobicContact CD2-CG 4.43Å; F49-R53 HydrophobicContact CE1-CG 4.26Å; F49-R53 HydrophobicContact CE2-CG 4.04Å; F49-R53 HydrophobicContact CZ-CG 3.95Å; F49-R53 WeakPolarHBondContact O-CB 3.05Å; F49-R53 WeakPolarHBondContact O-CG 3.33Å; F49-R53 PolarHBondContact O-N 3.45Å; F50-R53 CarbonylContact O-C 3.46Å; F50-R53 PolarHBondContact O-N 3.46Å; F50-R53 VanDerWaalsContact O-N 3.17Å; R51-R53 VanDerWaalsContact C-N 3.32Å; R53-V55 HydrophobicContact CB-CG2 3.83Å; R53-V55 PolarHBondContact O-N 3.2Å
54	H	90.1	Very high	92	Very high	147 Å²	147	74 Å²	74	68%	0.681	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	34	-173.9	-57.2	-74.5	0	0	0	113.2	F50 H56	F50-H54 WeakPolarHBondContact O-CA 3.42Å; F50-H54 PolarHBondContact O-N 3.29Å; H54-H56 PolarHBondContact O-CD2 2.82Å; H54-H56 PolarHBondContact O-N 2.8Å
55	V	91.9	Very high	92	Very high	22 Å²	22	71.8 Å²	71.8	13%	0.133	34%	0.335	C	S	.	.			trans	-82.6	115.1	173.2	-177.2	0	0	0	0	107.2	F50 R53 T60 M61 L64	F50-V55 HydrophobicContact CB-CB 4.1Å; F50-V55 HydrophobicContact CD1-CB 3.93Å; F50-V55 HydrophobicContact CD1-CG1 4.11Å; F50-V55 HydrophobicContact CD1-CG2 4.36Å; F50-V55 HydrophobicContact CG-CB 4.3Å; F50-V55 PolarHBondContact O-N 2.91Å; R53-V55 HydrophobicContact CB-CG2 3.83Å; R53-V55 PolarHBondContact O-N 3.2Å; V55-T60 HydrophobicContact CG1-CG2 3.72Å; V55-M61 HydrophobicContact CG1-CG 3.69Å; V55-M61 WeakPolarHBondContact O-CE 3.24Å; V55-L64 HydrophobicContact CG1-CD1 4.08Å; V55-L64 HydrophobicContact CG2-CD1 3.86Å
56	H	91	Very high	91.9	Very high	141 Å²	141	67.7 Å²	67.7	65%	0.653	32%	0.322	S	S	*	.			trans	-123.3	-9.8	179.3	-65.4	-64.1	0	0	0	112.9	H54	H54-H56 PolarHBondContact O-CD2 2.82Å; H54-H56 PolarHBondContact O-N 2.8Å
57	D	92.5	Very high	91.8	Very high	75 Å²	75	71.4 Å²	71.4	40%	0.401	35%	0.348	S	S	.	.			trans	-83.6	127.2	-178.6	177.2	69.9	0	0	0	110.4	E59 T60 M61	D57-E59 VanDerWaalsContact C-N 3.33Å; D57-E59 PolarHBondContact O-N 2.82Å; D57-E59 WeakPolarHBondContact OD2-CB 3.2Å; D57-E59 PolarHBondContact OD2-N 2.93Å; D57-T60 PolarHBondContact O-N 2.63Å; D57-T60 WeakPolarHBondContact OD2-CB 3.47Å; D57-T60 PolarHBondContact OD2-N 2.71Å; D57-T60 PolarHBondContact OD2-OG1 2.98Å; D57-M61 VanDerWaalsContact O-CG 3.29Å; D57-M61 WeakPolarHBondContact O-CG 3.06Å; D57-M61 PolarHBondContact O-N 3.28Å
58	E	93.3	Very high	91.7	Very high	51 Å²	51	68.7 Å²	68.7	24%	0.238	34%	0.335	C	S	.	.	H	α-helix	trans	-63.5	-37.9	-176.1	-80.1	-82	145.7	0	0	112.1	M61 F62 A89 F91 T92	E58-M61 PolarHBondContact O-N 3.32Å; E58-F62 VanDerWaalsContact O-CB 3.28Å; E58-F62 WeakPolarHBondContact O-CB 3.35Å; E58-F62 PolarHBondContact O-N 2.98Å; E58-A89 HydrophobicContact CG-CB 4.32Å; E58-F91 WeakPolarHBondContact OE2-CB 3.2Å; E58-F91 PolarHBondContact OE2-N 2.82Å; E58-T92 PolarHBondContact OE1-OG1 3.48Å; E58-T92 PolarHBondContact OE2-N 3.32Å; E58-T92 PolarHBondContact OE2-OG1 2.86Å
59	E	91.7	Very high	91.6	Very high	135 Å²	135	65.1 Å²	65.1	63%	0.631	32%	0.316	S	S	*	.	H	α-helix	trans	-65	-46.8	177.4	-59.3	-176.6	166.9	0	0	110	D57 M61 F62 D63	D57-E59 VanDerWaalsContact C-N 3.33Å; D57-E59 PolarHBondContact O-N 2.82Å; D57-E59 WeakPolarHBondContact OD2-CB 3.2Å; D57-E59 PolarHBondContact OD2-N 2.93Å; E59-M61 PolarHBondContact O-N 3.48Å; E59-F62 WeakPolarHBondContact O-CB 3.43Å; E59-F62 PolarHBondContact O-N 2.92Å; E59-D63 PolarHBondContact O-N 2.78Å
60	T	93	Very high	91.3	Very high	61 Å²	61	68.1 Å²	68.1	37%	0.374	34%	0.335	S	S	.	.	H	α-helix	trans	-64.3	-40.9	177.7	-53.4	0	0	0	0	112.1	V55 D57 F62 L64	V55-T60 HydrophobicContact CG1-CG2 3.72Å; D57-T60 PolarHBondContact O-N 2.63Å; D57-T60 WeakPolarHBondContact OD2-CB 3.47Å; D57-T60 PolarHBondContact OD2-N 2.71Å; D57-T60 PolarHBondContact OD2-OG1 2.98Å; T60-F62 VanDerWaalsContact C-N 3.3Å; T60-F62 PolarHBondContact O-N 3.21Å; T60-L64 HydrophobicContact CG2-CD1 4Å; T60-L64 HydrophobicContact CG2-CG 4.5Å; T60-L64 WeakPolarHBondContact O-CB 3.39Å; T60-L64 WeakPolarHBondContact O-CD1 3.43Å; T60-L64 VanDerWaalsContact O-CG 3.23Å; T60-L64 WeakPolarHBondContact O-CG 3.5Å; T60-L64 PolarHBondContact O-N 3.23Å
61	M	94	Very high	91	Very high	24 Å²	24	75.1 Å²	75.1	12%	0.118	37%	0.368	C	S	.	.	H	α-helix	trans	-61.2	-42.7	174.1	-73.8	-177.1	-171.9	0	0	111.2	F50 V55 D57 E58 E59 L64 A65 F91	F50-M61 HydrophobicContact CB-CE 4.41Å; F50-M61 HydrophobicContact CD1-CG 4.29Å; F50-M61 HydrophobicContact CD2-CB 4.38Å; F50-M61 HydrophobicContact CD2-CE 4.34Å; F50-M61 HydrophobicContact CD2-CG 3.77Å; F50-M61 HydrophobicContact CD2-SD 3.95Å; F50-M61 HydrophobicContact CE1-CB 4.39Å; F50-M61 HydrophobicContact CE1-CG 4.3Å; F50-M61 HydrophobicContact CE2-CB 3.84Å; F50-M61 HydrophobicContact CE2-CG 3.76Å; F50-M61 HydrophobicContact CE2-SD 4.18Å; F50-M61 HydrophobicContact CG-CG 4.05Å; F50-M61 HydrophobicContact CZ-CB 3.86Å; F50-M61 HydrophobicContact CZ-CG 4.03Å; F50-M61 WeakPolarHBondContact CZ-O 3.36Å; V55-M61 HydrophobicContact CG1-CG 3.69Å; V55-M61 WeakPolarHBondContact O-CE 3.24Å; D57-M61 VanDerWaalsContact O-CG 3.29Å; D57-M61 WeakPolarHBondContact O-CG 3.06Å; D57-M61 PolarHBondContact O-N 3.28Å; E58-M61 PolarHBondContact O-N 3.32Å; E59-M61 PolarHBondContact O-N 3.48Å; M61-L64 PolarHBondContact O-N 3.34Å; M61-A65 VanDerWaalsContact O-CB 3.27Å; M61-A65 WeakPolarHBondContact O-CB 3.27Å; M61-A65 PolarHBondContact O-N 2.95Å; M61-F91 HydrophobicContact CB-CB 3.84Å; M61-F91 HydrophobicContact CB-CD1 4.02Å; M61-F91 HydrophobicContact CB-CD2 3.88Å; M61-F91 HydrophobicContact CB-CE2 4.5Å; M61-F91 HydrophobicContact CB-CG 3.62Å; M61-F91 HydrophobicContact SD-CD1 3.79Å; M61-F91 HydrophobicContact SD-CE1 4.11Å; M61-F91 HydrophobicContact SD-CG 4.35Å
62	F	93.3	Very high	90.7	Very high	16 Å²	16	74 Å²	74	7%	0.07	37%	0.37	C	S	.	.	H	α-helix	trans	-63.6	-50.9	178.8	-175.4	-118.9	0	0	0	110.9	E58 E59 T60 L64 A65 L66 I81 A84 P90 F91 F94	E58-F62 VanDerWaalsContact O-CB 3.28Å; E58-F62 WeakPolarHBondContact O-CB 3.35Å; E58-F62 PolarHBondContact O-N 2.98Å; E59-F62 WeakPolarHBondContact O-CB 3.43Å; E59-F62 PolarHBondContact O-N 2.92Å; T60-F62 VanDerWaalsContact C-N 3.3Å; T60-F62 PolarHBondContact O-N 3.21Å; F62-L64 VanDerWaalsContact C-N 3.32Å; F62-L64 PolarHBondContact O-N 3.01Å; F62-A65 WeakPolarHBondContact O-CB 3.26Å; F62-A65 PolarHBondContact O-N 2.86Å; F62-A65 VanDerWaalsContact O-N 3.09Å; F62-L66 HydrophobicContact CD1-CD1 3.97Å; F62-L66 HydrophobicContact CE1-CD1 3.64Å; F62-L66 HydrophobicContact CE1-CG 4.4Å; F62-L66 HydrophobicContact CE2-CD1 4.4Å; F62-L66 HydrophobicContact CE2-CD2 4.22Å; F62-L66 HydrophobicContact CE2-CG 4.34Å; F62-L66 HydrophobicContact CZ-CD1 3.89Å; F62-L66 HydrophobicContact CZ-CD2 4.27Å; F62-L66 HydrophobicContact CZ-CG 4.3Å; F62-L66 WeakPolarHBondContact O-CG 3.37Å; F62-L66 PolarHBondContact O-N 3.5Å; F62-I81 HydrophobicContact CZ-CG2 3.89Å; F62-A84 HydrophobicContact CE2-CB 4.12Å; F62-A84 HydrophobicContact CZ-CB 4.25Å; F62-P90 HydrophobicContact CB-CB 4.17Å; F62-P90 HydrophobicContact CB-CG 4.11Å; F62-P90 HydrophobicContact CD1-CB 3.92Å; F62-P90 HydrophobicContact CD1-CG 4.41Å; F62-P90 HydrophobicContact CD2-CB 4.17Å; F62-P90 HydrophobicContact CE1-CB 4.27Å; F62-P90 HydrophobicContact CG-CB 3.84Å; F62-P90 HydrophobicContact CG-CG 4.29Å; F62-F91 HydrophobicContact CB-CB 4.04Å; F62-F94 HydrophobicContact CD2-CB 3.97Å; F62-F94 HydrophobicContact CD2-CD1 4.49Å; F62-F94 HydrophobicContact CD2-CG 4.17Å; F62-F94 HydrophobicContact CE2-CB 3.69Å; F62-F94 HydrophobicContact CE2-CD1 4.36Å; F62-F94 AromaticContact CE2-CD2 3.95Å; F62-F94 HydrophobicContact CE2-CD2 3.95Å; F62-F94 AromaticContact CE2-CG 3.73Å; F62-F94 HydrophobicContact CE2-CG 3.73Å
63	D	92.4	Very high	90.4	Very high	105 Å²	105	69.1 Å²	69.1	56%	0.561	35%	0.349	S	S	*	.	H	α-helix	trans	-57.9	-43.1	177.4	-78.6	-13.8	0	0	0	112.4	E59 L66 S67	E59-D63 PolarHBondContact O-N 2.78Å; D63-L66 PolarHBondContact O-N 3.34Å; D63-S67 WeakPolarHBondContact O-CB 3.47Å; D63-S67 PolarHBondContact O-N 3.41Å
64	L	93.2	Very high	90.2	Very high	42 Å²	42	68.5 Å²	68.5	22%	0.22	35%	0.349	C	S	.	.	H	α-helix	trans	-64.9	-42	176.1	-73.4	168.9	0	0	0	111.6	V31 F49 F50 V55 T60 M61 F62 L66 S67 A68	V31-L64 HydrophobicContact CG2-CD2 3.94Å; F49-L64 HydrophobicContact CE1-CD1 4.31Å; F50-L64 HydrophobicContact CD1-CD1 4.22Å; F50-L64 HydrophobicContact CE1-CB 3.83Å; F50-L64 HydrophobicContact CE1-CD1 3.83Å; F50-L64 HydrophobicContact CZ-CB 4.38Å; V55-L64 HydrophobicContact CG1-CD1 4.08Å; V55-L64 HydrophobicContact CG2-CD1 3.86Å; T60-L64 HydrophobicContact CG2-CD1 4Å; T60-L64 HydrophobicContact CG2-CG 4.5Å; T60-L64 WeakPolarHBondContact O-CB 3.39Å; T60-L64 WeakPolarHBondContact O-CD1 3.43Å; T60-L64 VanDerWaalsContact O-CG 3.23Å; T60-L64 WeakPolarHBondContact O-CG 3.5Å; T60-L64 PolarHBondContact O-N 3.23Å; M61-L64 PolarHBondContact O-N 3.34Å; F62-L64 VanDerWaalsContact C-N 3.32Å; F62-L64 PolarHBondContact O-N 3.01Å; L64-L66 VanDerWaalsContact C-N 3.33Å; L64-L66 PolarHBondContact O-N 3.16Å; L64-S67 PolarHBondContact O-N 3.39Å; L64-S67 PolarHBondContact O-OG 3.44Å; L64-A68 PolarHBondContact O-N 2.86Å
65	A	92.2	Very high	90	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-61.5	-41.9	176.1	0	0	0	0	0	111.6	W42 L46 M61 F62 A68 F91	W42-A65 HydrophobicContact CH2-CB 3.94Å; L46-A65 HydrophobicContact CD1-CB 3.99Å; M61-A65 VanDerWaalsContact O-CB 3.27Å; M61-A65 WeakPolarHBondContact O-CB 3.27Å; M61-A65 PolarHBondContact O-N 2.95Å; F62-A65 WeakPolarHBondContact O-CB 3.26Å; F62-A65 PolarHBondContact O-N 2.86Å; F62-A65 VanDerWaalsContact O-N 3.09Å; A65-A68 PolarHBondContact O-N 2.89Å; A65-F91 HydrophobicContact CB-CD2 4.04Å; A65-F91 HydrophobicContact CB-CE2 3.94Å
66	L	90.9	Very high	89.6	Confident	34 Å²	34	72.4 Å²	72.4	18%	0.178	36%	0.363	C	S	.	.	H	α-helix	trans	-64.2	-39.4	174.6	-65.1	-178.5	0	0	0	112.1	F62 D63 L64 A68 M69 F74 I81	F62-L66 HydrophobicContact CD1-CD1 3.97Å; F62-L66 HydrophobicContact CE1-CD1 3.64Å; F62-L66 HydrophobicContact CE1-CG 4.4Å; F62-L66 HydrophobicContact CE2-CD1 4.4Å; F62-L66 HydrophobicContact CE2-CD2 4.22Å; F62-L66 HydrophobicContact CE2-CG 4.34Å; F62-L66 HydrophobicContact CZ-CD1 3.89Å; F62-L66 HydrophobicContact CZ-CD2 4.27Å; F62-L66 HydrophobicContact CZ-CG 4.3Å; F62-L66 WeakPolarHBondContact O-CG 3.37Å; F62-L66 PolarHBondContact O-N 3.5Å; D63-L66 PolarHBondContact O-N 3.34Å; L64-L66 VanDerWaalsContact C-N 3.33Å; L64-L66 PolarHBondContact O-N 3.16Å; L66-A68 PolarHBondContact O-N 3.34Å; L66-A68 VanDerWaalsContact O-N 3.17Å; L66-M69 HydrophobicContact CD2-SD 4.41Å; L66-M69 WeakPolarHBondContact O-CB 3.39Å; L66-M69 PolarHBondContact O-N 3.09Å; L66-F74 HydrophobicContact CD2-CE2 4.5Å; L66-I81 HydrophobicContact CD1-CG2 4.12Å; L66-I81 HydrophobicContact CD2-CB 4.45Å; L66-I81 HydrophobicContact CD2-CD1 3.67Å; L66-I81 HydrophobicContact CD2-CG1 3.75Å; L66-I81 HydrophobicContact CD2-CG2 3.84Å
67	S	90.4	Very high	89.3	Confident	79 Å²	79	65.9 Å²	65.9	55%	0.552	33%	0.332	S	S	*	.	H	α-helix	trans	-62.9	-21.8	178.1	79.9	0	0	0	0	113.8	D63 L64 M69	D63-S67 WeakPolarHBondContact O-CB 3.47Å; D63-S67 PolarHBondContact O-N 3.41Å; L64-S67 PolarHBondContact O-N 3.39Å; L64-S67 PolarHBondContact O-OG 3.44Å; S67-M69 VanDerWaalsContact C-N 3.33Å
68	A	90.3	Very high	89	Confident	10 Å²	10	64.1 Å²	64.1	8%	0.083	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-5.6	176.6	0	0	0	0	0	114	V31 P32 F34 W42 L64 A65 L66	V31-A68 HydrophobicContact CB-CB 4.4Å; V31-A68 HydrophobicContact CG1-CB 3.64Å; P32-A68 WeakPolarHBondContact O-CB 3.31Å; F34-A68 WeakPolarHBondContact CB-O 3.5Å; F34-A68 PolarHBondContact N-O 2.92Å; W42-A68 HydrophobicContact CZ2-CB 3.84Å; L64-A68 PolarHBondContact O-N 2.86Å; A65-A68 PolarHBondContact O-N 2.89Å; L66-A68 PolarHBondContact O-N 3.34Å; L66-A68 VanDerWaalsContact O-N 3.17Å
69	M	88.6	Confident	88.7	Confident	23 Å²	23	67.6 Å²	67.6	11%	0.113	35%	0.346	C	S	.	.	S	Bend	trans	-92.5	143.4	-179.9	-61.9	-172.3	-176	0	0	111.6	F34 W42 L66 S67 T73 L77 F94	F34-M69 HydrophobicContact CB-CG 4.07Å; F34-M69 HydrophobicContact CD2-CE 3.63Å; F34-M69 HydrophobicContact CD2-CG 4.17Å; F34-M69 HydrophobicContact CD2-SD 4.49Å; F34-M69 HydrophobicContact CE2-CE 3.8Å; F34-M69 HydrophobicContact CG-CE 4.45Å; F34-M69 HydrophobicContact CG-CG 4.16Å; W42-M69 HydrophobicContact CH2-CE 3.38Å; W42-M69 HydrophobicContact CZ2-CE 4.24Å; W42-M69 HydrophobicContact CZ3-CE 3.84Å; L66-M69 HydrophobicContact CD2-SD 4.41Å; L66-M69 WeakPolarHBondContact O-CB 3.39Å; L66-M69 PolarHBondContact O-N 3.09Å; S67-M69 VanDerWaalsContact C-N 3.33Å; M69-T73 HydrophobicContact CB-CG2 4.21Å; M69-T73 HydrophobicContact CG-CG2 4.14Å; M69-T73 HydrophobicContact SD-CG2 4.04Å; M69-L77 HydrophobicContact CE-CD1 4.21Å; M69-L77 HydrophobicContact SD-CD1 3.96Å; M69-F94 HydrophobicContact CE-CE1 3.37Å; M69-F94 HydrophobicContact CE-CE2 4.43Å; M69-F94 HydrophobicContact CE-CZ 3.18Å; M69-F94 HydrophobicContact SD-CZ 3.99Å
70	T	86.9	Confident	88.4	Confident	73 Å²	73	64.5 Å²	64.5	45%	0.448	33%	0.331	S	S	.	.			trans	-78.1	159	168.7	60.4	0	0	0	0	110.3	E72 T73 F74	T70-E72 PolarHBondContact O-N 3.1Å; T70-T73 WeakPolarHBondContact O-CB 3.19Å; T70-T73 PolarHBondContact O-N 3.49Å; T70-T73 PolarHBondContact OG1-N 2.99Å; T70-T73 PolarHBondContact OG1-OG1 3.38Å; T70-F74 PolarHBondContact O-N 3.31Å
71	E	87.1	Confident	88.1	Confident	151 Å²	151	62.1 Å²	62.1	71%	0.706	32%	0.315	S	S	*	.	H	α-helix	trans	-55.4	-35.2	176.5	-170.2	-176.2	161.8	0	0	112.6	F74 R75	E71-F74 PolarHBondContact O-N 3.34Å; E71-R75 PolarHBondContact O-N 2.84Å; E71-R75 IonicContact OE1-NH2 3.96Å
72	E	84.5	Confident	87.9	Confident	147 Å²	147	66.1 Å²	66.1	69%	0.687	34%	0.337	S	S	*	.	H	α-helix	trans	-63.1	-44.1	174.7	-176.5	179.6	-174.6	0	0	112.3	T70 R75 T76	T70-E72 PolarHBondContact O-N 3.1Å; E72-R75 PolarHBondContact O-N 3.39Å; E72-T76 PolarHBondContact O-N 3.27Å; E72-T76 PolarHBondContact O-OG1 3.42Å
73	T	83.2	Confident	87.6	Confident	15 Å²	15	68.9 Å²	68.9	9%	0.092	36%	0.355	C	S	.	.	H	α-helix	trans	-66.7	-44.1	177	-53.5	0	0	0	0	110.3	F34 M69 T70 R75 T76 L77	F34-T73 HydrophobicContact CD1-CG2 3.37Å; F34-T73 HydrophobicContact CE1-CG2 3.43Å; F34-T73 VanDerWaalsContact CE1-CG2 3.43Å; F34-T73 HydrophobicContact CG-CG2 3.99Å; F34-T73 HydrophobicContact CZ-CG2 4.1Å; M69-T73 HydrophobicContact CB-CG2 4.21Å; M69-T73 HydrophobicContact CG-CG2 4.14Å; M69-T73 HydrophobicContact SD-CG2 4.04Å; T70-T73 WeakPolarHBondContact O-CB 3.19Å; T70-T73 PolarHBondContact O-N 3.49Å; T70-T73 PolarHBondContact OG1-N 2.99Å; T70-T73 PolarHBondContact OG1-OG1 3.38Å; T73-R75 VanDerWaalsContact C-N 3.29Å; T73-R75 PolarHBondContact O-N 2.9Å; T73-T76 WeakPolarHBondContact O-CB 3.34Å; T73-T76 PolarHBondContact O-N 3.4Å; T73-T76 VanDerWaalsContact O-N 3.07Å; T73-L77 HydrophobicContact CG2-CD1 3.87Å; T73-L77 HydrophobicContact CG2-CG 4.36Å; T73-L77 PolarHBondContact O-N 3.47Å
74	F	83.9	Confident	87.3	Confident	87 Å²	87	63.9 Å²	63.9	38%	0.382	33%	0.328	S	S	.	.	H	α-helix	trans	-58.2	-42.9	178.8	-171.5	-87.5	0	0	0	111.2	L66 T70 E71 T76 L77 C78 I81	L66-F74 HydrophobicContact CD2-CE2 4.5Å; T70-F74 PolarHBondContact O-N 3.31Å; E71-F74 PolarHBondContact O-N 3.34Å; F74-T76 VanDerWaalsContact C-N 3.31Å; F74-T76 PolarHBondContact O-N 3.07Å; F74-L77 CarbonylContact O-C 3.57Å; F74-L77 PolarHBondContact O-N 2.98Å; F74-C78 VanDerWaalsContact O-CA 3.24Å; F74-C78 WeakPolarHBondContact O-CA 3.4Å; F74-C78 VanDerWaalsContact O-CB 3.29Å; F74-C78 WeakPolarHBondContact O-CB 3.5Å; F74-C78 PolarHBondContact O-N 3.4Å; F74-I81 HydrophobicContact CD2-CD1 3.55Å; F74-I81 HydrophobicContact CE2-CD1 3.65Å; F74-I81 HydrophobicContact CE2-CG2 4.13Å; F74-I81 HydrophobicContact CG-CD1 4.19Å; F74-I81 HydrophobicContact CZ-CD1 4.35Å; F74-I81 HydrophobicContact CZ-CG2 4.39Å
75	R	85.1	Confident	87	Confident	184 Å²	184	64.2 Å²	64.2	69%	0.694	34%	0.342	S	S	*	.	H	α-helix	trans	-61.1	-40.1	175.9	-171.3	-179.5	-60.9	-179.8	3	112.5	E71 E72 T73	E71-R75 PolarHBondContact O-N 2.84Å; E71-R75 IonicContact OE1-NH2 3.96Å; E72-R75 PolarHBondContact O-N 3.39Å; T73-R75 VanDerWaalsContact C-N 3.29Å; T73-R75 PolarHBondContact O-N 2.9Å
76	T	83.9	Confident	86.8	Confident	67 Å²	67	71.9 Å²	71.9	41%	0.411	38%	0.377	S	S	.	.	H	α-helix	trans	-69.5	-35.3	179.5	-53	0	0	0	0	111.8	F36 E72 T73 F74	F36-T76 HydrophobicContact CE2-CG2 4.31Å; E72-T76 PolarHBondContact O-N 3.27Å; E72-T76 PolarHBondContact O-OG1 3.42Å; T73-T76 WeakPolarHBondContact O-CB 3.34Å; T73-T76 PolarHBondContact O-N 3.4Å; T73-T76 VanDerWaalsContact O-N 3.07Å; F74-T76 VanDerWaalsContact C-N 3.31Å; F74-T76 PolarHBondContact O-N 3.07Å
77	L	84.5	Confident	86.8	Confident	4 Å²	4	75 Å²	75	2%	0.021	39%	0.391	C	S	.	.	H	α-helix	trans	-99.3	4.1	-178.1	-58.7	-179.3	0	0	0	113.6	F34 M69 T73 F74 D79 F80 I81 F94	F34-L77 HydrophobicContact CE2-CD1 4.4Å; F34-L77 HydrophobicContact CZ-CD1 4.04Å; M69-L77 HydrophobicContact CE-CD1 4.21Å; M69-L77 HydrophobicContact SD-CD1 3.96Å; T73-L77 HydrophobicContact CG2-CD1 3.87Å; T73-L77 HydrophobicContact CG2-CG 4.36Å; T73-L77 PolarHBondContact O-N 3.47Å; F74-L77 CarbonylContact O-C 3.57Å; F74-L77 PolarHBondContact O-N 2.98Å; L77-D79 PolarHBondContact O-N 3.43Å; L77-F80 HydrophobicContact CD2-CD2 3.86Å; L77-F80 HydrophobicContact CD2-CE2 4.41Å; L77-F80 CarbonylContact O-C 3.55Å; L77-F80 WeakPolarHBondContact O-CA 3.39Å; L77-F80 WeakPolarHBondContact O-CB 3.36Å; L77-F80 PolarHBondContact O-N 3.5Å; L77-I81 HydrophobicContact CB-CD1 3.91Å; L77-I81 HydrophobicContact CB-CG1 4.19Å; L77-I81 VanDerWaalsContact O-CG1 3.26Å; L77-I81 WeakPolarHBondContact O-CG1 3.07Å; L77-I81 PolarHBondContact O-N 3.36Å; L77-F94 HydrophobicContact CD1-CE2 4.37Å; L77-F94 HydrophobicContact CD1-CZ 4.01Å
78	C	86.6	Confident	86.7	Confident	38 Å²	38	78.3 Å²	78.3	26%	0.257	41%	0.409	S	S	.	.	H	α-helix	trans	-56.8	-47.1	-168.6	-169	0	0	0	0	112.3	F74 F80 I81 L82	F74-C78 VanDerWaalsContact O-CA 3.24Å; F74-C78 WeakPolarHBondContact O-CA 3.4Å; F74-C78 VanDerWaalsContact O-CB 3.29Å; F74-C78 WeakPolarHBondContact O-CB 3.5Å; F74-C78 PolarHBondContact O-N 3.4Å; C78-F80 VanDerWaalsContact C-N 3.26Å; C78-F80 PolarHBondContact O-N 2.94Å; C78-I81 PolarHBondContact O-N 3Å; C78-L82 WeakPolarHBondContact O-CG 3.37Å; C78-L82 PolarHBondContact O-N 3.03Å
79	D	86.3	Confident	86.8	Confident	125 Å²	125	79 Å²	79	67%	0.668	41%	0.414	S	S	*	.	H	α-helix	trans	-60.8	-38.6	178.5	-65.3	-18	0	0	0	111.3	L77 T83	L77-D79 PolarHBondContact O-N 3.43Å; D79-T83 WeakPolarHBondContact O-CB 3.24Å; D79-T83 PolarHBondContact O-N 2.88Å; D79-T83 PolarHBondContact O-OG1 3.19Å
80	F	85.9	Confident	87	Confident	70 Å²	70	78.5 Å²	78.5	31%	0.307	41%	0.412	S	S	.	.	H	α-helix	trans	-71.3	-38.7	177.1	-57.4	-52.4	0	0	0	112.5	L77 C78 T83 A84 I97 Q101	L77-F80 HydrophobicContact CD2-CD2 3.86Å; L77-F80 HydrophobicContact CD2-CE2 4.41Å; L77-F80 CarbonylContact O-C 3.55Å; L77-F80 WeakPolarHBondContact O-CA 3.39Å; L77-F80 WeakPolarHBondContact O-CB 3.36Å; L77-F80 PolarHBondContact O-N 3.5Å; C78-F80 VanDerWaalsContact C-N 3.26Å; C78-F80 PolarHBondContact O-N 2.94Å; F80-T83 PolarHBondContact O-N 2.88Å; F80-A84 VanDerWaalsContact O-CB 3.31Å; F80-A84 WeakPolarHBondContact O-CB 3.48Å; F80-A84 PolarHBondContact O-N 3.33Å; F80-I97 HydrophobicContact CB-CG2 3.61Å; F80-I97 HydrophobicContact CD1-CG2 3.16Å; F80-I97 HydrophobicContact CD2-CG2 4.18Å; F80-I97 HydrophobicContact CE1-CG2 3.78Å; F80-I97 HydrophobicContact CG-CG2 3.38Å; F80-Q101 VanDerWaalsContact CD2-OE1 3.26Å; F80-Q101 HydrophobicContact CE2-CG 4.31Å
81	I	87.8	Confident	87.2	Confident	11 Å²	11	75.3 Å²	75.3	6%	0.056	39%	0.393	C	S	.	.	H	α-helix	trans	-64	-45.9	176.5	-68.1	165.2	0	0	0	109.9	F62 L66 F74 L77 C78 T83 A84 G85 F94	F62-I81 HydrophobicContact CZ-CG2 3.89Å; L66-I81 HydrophobicContact CD1-CG2 4.12Å; L66-I81 HydrophobicContact CD2-CB 4.45Å; L66-I81 HydrophobicContact CD2-CD1 3.67Å; L66-I81 HydrophobicContact CD2-CG1 3.75Å; L66-I81 HydrophobicContact CD2-CG2 3.84Å; F74-I81 HydrophobicContact CD2-CD1 3.55Å; F74-I81 HydrophobicContact CE2-CD1 3.65Å; F74-I81 HydrophobicContact CE2-CG2 4.13Å; F74-I81 HydrophobicContact CG-CD1 4.19Å; F74-I81 HydrophobicContact CZ-CD1 4.35Å; F74-I81 HydrophobicContact CZ-CG2 4.39Å; L77-I81 HydrophobicContact CB-CD1 3.91Å; L77-I81 HydrophobicContact CB-CG1 4.19Å; L77-I81 VanDerWaalsContact O-CG1 3.26Å; L77-I81 WeakPolarHBondContact O-CG1 3.07Å; L77-I81 PolarHBondContact O-N 3.36Å; C78-I81 PolarHBondContact O-N 3Å; I81-T83 VanDerWaalsContact C-N 3.32Å; I81-T83 PolarHBondContact O-N 3.47Å; I81-A84 PolarHBondContact O-N 2.9Å; I81-G85 PolarHBondContact O-N 3.14Å; I81-F94 HydrophobicContact CD1-CE2 4.46Å; I81-F94 HydrophobicContact CG1-CD2 4.17Å; I81-F94 HydrophobicContact CG1-CE2 3.59Å; I81-F94 HydrophobicContact CG1-CZ 4.4Å
82	L	89.4	Confident	87.5	Confident	108 Å²	108	71.7 Å²	71.7	57%	0.565	38%	0.381	S	S	*	.	H	α-helix	trans	-63.6	-38.9	176.6	-70.5	174.5	0	0	0	111.9	C78	C78-L82 WeakPolarHBondContact O-CG 3.37Å; C78-L82 PolarHBondContact O-N 3.03Å
83	T	87.3	Confident	87.9	Confident	73 Å²	73	66.5 Å²	66.5	45%	0.448	36%	0.359	S	S	.	.	H	α-helix	trans	-66	-46.4	175.7	-58	0	0	0	0	111.1	D79 F80 I81 G85 Q86 I97	D79-T83 WeakPolarHBondContact O-CB 3.24Å; D79-T83 PolarHBondContact O-N 2.88Å; D79-T83 PolarHBondContact O-OG1 3.19Å; F80-T83 PolarHBondContact O-N 2.88Å; I81-T83 VanDerWaalsContact C-N 3.32Å; I81-T83 PolarHBondContact O-N 3.47Å; T83-G85 PolarHBondContact O-N 3.09Å; T83-Q86 PolarHBondContact O-N 3.47Å; T83-I97 HydrophobicContact CG2-CD1 4.42Å
84	A	86.2	Confident	88.2	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-65.6	-38.5	-179.8	0	0	0	0	0	112.5	F62 F80 I81 Q86 Q87 P90 V93 F94	F62-A84 HydrophobicContact CE2-CB 4.12Å; F62-A84 HydrophobicContact CZ-CB 4.25Å; F80-A84 VanDerWaalsContact O-CB 3.31Å; F80-A84 WeakPolarHBondContact O-CB 3.48Å; F80-A84 PolarHBondContact O-N 3.33Å; I81-A84 PolarHBondContact O-N 2.9Å; A84-Q86 PolarHBondContact O-N 3.47Å; A84-Q86 VanDerWaalsContact O-N 3.13Å; A84-Q87 WeakPolarHBondContact O-CB 3.38Å; A84-Q87 PolarHBondContact O-N 3.38Å; A84-P90 WeakPolarHBondContact O-CA 3.33Å; A84-P90 WeakPolarHBondContact O-CB 3.43Å; A84-V93 HydrophobicContact CB-CB 4.47Å; A84-V93 HydrophobicContact CB-CG1 4.24Å; A84-F94 HydrophobicContact CB-CB 3.8Å; A84-F94 HydrophobicContact CB-CD2 4.4Å
85	G	85.4	Confident	88.5	Confident	49 Å²	49	64.2 Å²	64.2	51%	0.505	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-13.3	-180	0	0	0	0	0	115.2	I81 T83	I81-G85 PolarHBondContact O-N 3.14Å; T83-G85 PolarHBondContact O-N 3.09Å
86	Q	89	Confident	88.8	Confident	161 Å²	161	58.2 Å²	58.2	75%	0.752	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.3	175.5	-65.8	177.3	3.8	0	0	113.1	T83 A84	T83-Q86 PolarHBondContact O-N 3.47Å; A84-Q86 PolarHBondContact O-N 3.47Å; A84-Q86 VanDerWaalsContact O-N 3.13Å
87	Q	90.3	Very high	89	Confident	99 Å²	99	56.6 Å²	56.6	46%	0.463	33%	0.326	S	S	.	.	S	Bend	trans	-95.2	159.7	-173.6	-58.1	-67.7	106.8	0	0	111.4	A84 A89 V93	A84-Q87 WeakPolarHBondContact O-CB 3.38Å; A84-Q87 PolarHBondContact O-N 3.38Å; Q87-A89 PolarHBondContact O-N 2.76Å; Q87-V93 HydrophobicContact CB-CB 4.4Å; Q87-V93 HydrophobicContact CB-CG2 3.9Å; Q87-V93 HydrophobicContact CG-CB 4.32Å; Q87-V93 HydrophobicContact CG-CG1 4.1Å; Q87-V93 HydrophobicContact CG-CG2 4.01Å
88	T	89	Confident	89	Confident	150 Å²	150	56.8 Å²	56.8	92%	0.92	33%	0.327	S	S	*	.	S	Bend	trans	-68.7	-17.9	177.6	53.2	0	0	0	0	113.9
89	A	92.6	Very high	88.9	Confident	25 Å²	25	58.9 Å²	58.9	21%	0.207	34%	0.335	C	S	.	.	S	Bend	trans	-136.2	74.5	179.5	0	0	0	0	0	108.8	E58 Q87 F91 T92 V93	E58-A89 HydrophobicContact CG-CB 4.32Å; Q87-A89 PolarHBondContact O-N 2.76Å; A89-F91 PolarHBondContact O-N 3.33Å; A89-T92 PolarHBondContact O-N 3.44Å; A89-V93 WeakPolarHBondContact O-CG2 3.42Å; A89-V93 PolarHBondContact O-N 3.42Å
90	P	91.7	Very high	88.8	Confident	11 Å²	11	59.6 Å²	59.6	7%	0.071	34%	0.339	C	S	.	.	H	α-helix	trans	-61.6	-41.1	-170	23.7	-35.2	0	0	0	112.3	F62 A84 F94	F62-P90 HydrophobicContact CB-CB 4.17Å; F62-P90 HydrophobicContact CB-CG 4.11Å; F62-P90 HydrophobicContact CD1-CB 3.92Å; F62-P90 HydrophobicContact CD1-CG 4.41Å; F62-P90 HydrophobicContact CD2-CB 4.17Å; F62-P90 HydrophobicContact CE1-CB 4.27Å; F62-P90 HydrophobicContact CG-CB 3.84Å; F62-P90 HydrophobicContact CG-CG 4.29Å; A84-P90 WeakPolarHBondContact O-CA 3.33Å; A84-P90 WeakPolarHBondContact O-CB 3.43Å; P90-F94 WeakPolarHBondContact O-CB 3.09Å; P90-F94 PolarHBondContact O-N 3.18Å
91	F	92.3	Very high	88.2	Confident	7 Å²	7	57.8 Å²	57.8	3%	0.031	33%	0.332	C	S	.	.	H	α-helix	trans	-66.6	-46.1	179.4	175.6	-101.3	0	0	0	111.8	F43 L46 F50 E58 M61 F62 A65 A89 V93 F94 K95	F43-F91 HydrophobicContact CD1-CE2 4.29Å; F43-F91 HydrophobicContact CD1-CZ 4.05Å; F43-F91 HydrophobicContact CE1-CE2 4.13Å; F43-F91 HydrophobicContact CE1-CZ 4.3Å; L46-F91 HydrophobicContact CD1-CE2 4.19Å; F50-F91 HydrophobicContact CD2-CZ 4.44Å; F50-F91 HydrophobicContact CE2-CD2 4.43Å; F50-F91 HydrophobicContact CE2-CE1 4.12Å; F50-F91 AromaticContact CE2-CE2 3.74Å; F50-F91 HydrophobicContact CE2-CE2 3.74Å; F50-F91 AromaticContact CE2-CZ 3.57Å; F50-F91 HydrophobicContact CE2-CZ 3.57Å; F50-F91 HydrophobicContact CZ-CE2 4.17Å; F50-F91 HydrophobicContact CZ-CZ 4.44Å; E58-F91 WeakPolarHBondContact OE2-CB 3.2Å; E58-F91 PolarHBondContact OE2-N 2.82Å; M61-F91 HydrophobicContact CB-CB 3.84Å; M61-F91 HydrophobicContact CB-CD1 4.02Å; M61-F91 HydrophobicContact CB-CD2 3.88Å; M61-F91 HydrophobicContact CB-CE2 4.5Å; M61-F91 HydrophobicContact CB-CG 3.62Å; M61-F91 HydrophobicContact SD-CD1 3.79Å; M61-F91 HydrophobicContact SD-CE1 4.11Å; M61-F91 HydrophobicContact SD-CG 4.35Å; F62-F91 HydrophobicContact CB-CB 4.04Å; A65-F91 HydrophobicContact CB-CD2 4.04Å; A65-F91 HydrophobicContact CB-CE2 3.94Å; A89-F91 PolarHBondContact O-N 3.33Å; F91-V93 PolarHBondContact O-N 2.92Å; F91-F94 PolarHBondContact O-N 2.91Å; F91-K95 HydrophobicContact CE1-CD 4.38Å; F91-K95 WeakPolarHBondContact O-CB 3.43Å; F91-K95 PolarHBondContact O-N 3.36Å
92	T	93.1	Very high	86.7	Confident	75 Å²	75	62.3 Å²	62.3	46%	0.46	36%	0.362	S	S	.	.	H	α-helix	trans	-61.5	-44.8	178.3	-70.2	0	0	0	0	111.8	E58 A89 K95 A96	E58-T92 PolarHBondContact OE1-OG1 3.48Å; E58-T92 PolarHBondContact OE2-N 3.32Å; E58-T92 PolarHBondContact OE2-OG1 2.86Å; A89-T92 PolarHBondContact O-N 3.44Å; T92-K95 PolarHBondContact O-N 3.17Å; T92-A96 PolarHBondContact O-N 3.02Å; T92-A96 VanDerWaalsContact O-N 3.09Å
93	V	92	Very high	85.2	Confident	37 Å²	37	60.4 Å²	60.4	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-66	-44.5	177	173.2	0	0	0	0	110.8	A84 Q87 A89 F91 K95 A96 I97	A84-V93 HydrophobicContact CB-CB 4.47Å; A84-V93 HydrophobicContact CB-CG1 4.24Å; Q87-V93 HydrophobicContact CB-CB 4.4Å; Q87-V93 HydrophobicContact CB-CG2 3.9Å; Q87-V93 HydrophobicContact CG-CB 4.32Å; Q87-V93 HydrophobicContact CG-CG1 4.1Å; Q87-V93 HydrophobicContact CG-CG2 4.01Å; A89-V93 WeakPolarHBondContact O-CG2 3.42Å; A89-V93 PolarHBondContact O-N 3.42Å; F91-V93 PolarHBondContact O-N 2.92Å; V93-K95 VanDerWaalsContact C-N 3.31Å; V93-K95 PolarHBondContact O-N 3.3Å; V93-A96 WeakPolarHBondContact O-CB 3.28Å; V93-A96 PolarHBondContact O-N 3.48Å; V93-A96 VanDerWaalsContact O-N 3.16Å; V93-I97 HydrophobicContact CG1-CD1 3.61Å; V93-I97 HydrophobicContact CG1-CG1 4.22Å; V93-I97 WeakPolarHBondContact O-CG1 3.42Å; V93-I97 PolarHBondContact O-N 2.89Å
94	F	90.5	Very high	83.7	Confident	0 Å²	0	62 Å²	62	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-57	-44.6	176.4	179.2	-106.6	0	0	0	112.3	W42 F43 F62 M69 L77 I81 A84 P90 F91 I97 C98	W42-F94 HydrophobicContact CZ3-CE1 4.38Å; F43-F94 HydrophobicContact CE1-CD1 4.34Å; F43-F94 HydrophobicContact CE1-CE1 4.43Å; F43-F94 HydrophobicContact CZ-CD1 4.23Å; F43-F94 HydrophobicContact CZ-CE1 4.14Å; F62-F94 HydrophobicContact CD2-CB 3.97Å; F62-F94 HydrophobicContact CD2-CD1 4.49Å; F62-F94 HydrophobicContact CD2-CG 4.17Å; F62-F94 HydrophobicContact CE2-CB 3.69Å; F62-F94 HydrophobicContact CE2-CD1 4.36Å; F62-F94 AromaticContact CE2-CD2 3.95Å; F62-F94 HydrophobicContact CE2-CD2 3.95Å; F62-F94 AromaticContact CE2-CG 3.73Å; F62-F94 HydrophobicContact CE2-CG 3.73Å; M69-F94 HydrophobicContact CE-CE1 3.37Å; M69-F94 HydrophobicContact CE-CE2 4.43Å; M69-F94 HydrophobicContact CE-CZ 3.18Å; M69-F94 HydrophobicContact SD-CZ 3.99Å; L77-F94 HydrophobicContact CD1-CE2 4.37Å; L77-F94 HydrophobicContact CD1-CZ 4.01Å; I81-F94 HydrophobicContact CD1-CE2 4.46Å; I81-F94 HydrophobicContact CG1-CD2 4.17Å; I81-F94 HydrophobicContact CG1-CE2 3.59Å; I81-F94 HydrophobicContact CG1-CZ 4.4Å; A84-F94 HydrophobicContact CB-CB 3.8Å; A84-F94 HydrophobicContact CB-CD2 4.4Å; P90-F94 WeakPolarHBondContact O-CB 3.09Å; P90-F94 PolarHBondContact O-N 3.18Å; F91-F94 PolarHBondContact O-N 2.91Å; F94-I97 PolarHBondContact O-N 3.27Å; F94-C98 VanDerWaalsContact CE1-SG 3.55Å; F94-C98 WeakPolarHBondContact CE2-SG 3.29Å; F94-C98 WeakPolarHBondContact CZ-SG 3.44Å; F94-C98 WeakPolarHBondContact O-CB 3.47Å; F94-C98 PolarHBondContact O-N 2.92Å; F94-C98 PolarHBondContact O-SG 3.5Å
95	K	90.6	Very high	82.1	Confident	55 Å²	55	63.2 Å²	63.2	24%	0.239	38%	0.379	C	S	.	.	H	α-helix	trans	-58.3	-47.1	174.7	-178.6	172.3	-176.5	169.9	0	111.6	F43 D47 F91 T92 V93 I97 C98 L99	F43-K95 HydrophobicContact CB-CD 4.39Å; F43-K95 HydrophobicContact CD1-CB 4.14Å; F43-K95 HydrophobicContact CD1-CD 3.94Å; F43-K95 HydrophobicContact CD1-CG 3.76Å; F43-K95 HydrophobicContact CD2-CG 4.05Å; F43-K95 HydrophobicContact CE1-CB 3.76Å; F43-K95 HydrophobicContact CE1-CD 4.43Å; F43-K95 HydrophobicContact CE1-CG 3.87Å; F43-K95 HydrophobicContact CE2-CG 4.16Å; F43-K95 HydrophobicContact CG-CD 4.13Å; F43-K95 HydrophobicContact CG-CG 3.87Å; F43-K95 HydrophobicContact CZ-CB 3.99Å; F43-K95 HydrophobicContact CZ-CG 4.08Å; D47-K95 IonicContact OD1-NZ 3.42Å; D47-K95 PolarHBondContact OD1-NZ 3.31Å; D47-K95 IonicContact OD2-NZ 2.92Å; D47-K95 PolarHBondContact OD2-NZ 3.24Å; F91-K95 HydrophobicContact CE1-CD 4.38Å; F91-K95 WeakPolarHBondContact O-CB 3.43Å; F91-K95 PolarHBondContact O-N 3.36Å; T92-K95 PolarHBondContact O-N 3.17Å; V93-K95 VanDerWaalsContact C-N 3.31Å; V93-K95 PolarHBondContact O-N 3.3Å; K95-I97 PolarHBondContact O-N 3.26Å; K95-C98 PolarHBondContact O-N 3Å; K95-L99 HydrophobicContact CG-CD1 4.02Å; K95-L99 WeakPolarHBondContact O-CB 3.42Å; K95-L99 VanDerWaalsContact O-CG 3.24Å; K95-L99 WeakPolarHBondContact O-CG 3.49Å; K95-L99 PolarHBondContact O-N 2.89Å; K95-L99 VanDerWaalsContact O-N 3.1Å
96	A	90	Very high	80.4	Confident	57 Å²	57	69.7 Å²	69.7	47%	0.471	39%	0.389	S	S	.	.	H	α-helix	trans	-60.5	-46.6	177.8	0	0	0	0	0	111.9	T92 V93 L99 D100	T92-A96 PolarHBondContact O-N 3.02Å; T92-A96 VanDerWaalsContact O-N 3.09Å; V93-A96 WeakPolarHBondContact O-CB 3.28Å; V93-A96 PolarHBondContact O-N 3.48Å; V93-A96 VanDerWaalsContact O-N 3.16Å; A96-L99 PolarHBondContact O-N 2.87Å; A96-D100 WeakPolarHBondContact O-CB 3.49Å; A96-D100 PolarHBondContact O-N 3.14Å
97	I	87.7	Confident	78.6	Confident	34 Å²	34	66.9 Å²	66.9	17%	0.174	38%	0.382	C	S	.	.	H	α-helix	trans	-64.9	-42.4	179.7	-64.4	167.8	0	0	0	111.5	F80 T83 V93 F94 K95 L99 D100 Q101	F80-I97 HydrophobicContact CB-CG2 3.61Å; F80-I97 HydrophobicContact CD1-CG2 3.16Å; F80-I97 HydrophobicContact CD2-CG2 4.18Å; F80-I97 HydrophobicContact CE1-CG2 3.78Å; F80-I97 HydrophobicContact CG-CG2 3.38Å; T83-I97 HydrophobicContact CG2-CD1 4.42Å; V93-I97 HydrophobicContact CG1-CD1 3.61Å; V93-I97 HydrophobicContact CG1-CG1 4.22Å; V93-I97 WeakPolarHBondContact O-CG1 3.42Å; V93-I97 PolarHBondContact O-N 2.89Å; F94-I97 PolarHBondContact O-N 3.27Å; K95-I97 PolarHBondContact O-N 3.26Å; I97-L99 VanDerWaalsContact C-N 3.28Å; I97-L99 PolarHBondContact O-N 3.31Å; I97-D100 PolarHBondContact O-N 3.46Å; I97-Q101 WeakPolarHBondContact O-CB 3.48Å; I97-Q101 PolarHBondContact O-N 2.92Å
98	C	84.6	Confident	76.5	Confident	8 Å²	8	67.7 Å²	67.7	5%	0.054	39%	0.386	C	S	.	.	H	α-helix	trans	-66.7	-29.9	179.5	-71.8	0	0	0	0	113.3	F43 F94 K95	F43-C98 HydrophobicContact CE2-CB 3.69Å; F43-C98 HydrophobicContact CZ-CB 3.78Å; F94-C98 VanDerWaalsContact CE1-SG 3.55Å; F94-C98 WeakPolarHBondContact CE2-SG 3.29Å; F94-C98 WeakPolarHBondContact CZ-SG 3.44Å; F94-C98 WeakPolarHBondContact O-CB 3.47Å; F94-C98 PolarHBondContact O-N 2.92Å; F94-C98 PolarHBondContact O-SG 3.5Å; K95-C98 PolarHBondContact O-N 3Å
99	L	85.6	Confident	74.8	Confident	81 Å²	81	69.7 Å²	69.7	42%	0.424	38%	0.377	S	S	.	.	H	α-helix	trans	-82.4	-32.1	176.4	-67.1	175.1	0	0	0	112.2	P39 E40 F43 K95 A96 I97	P39-L99 HydrophobicContact CB-CD2 4.41Å; P39-L99 HydrophobicContact CG-CD2 4.42Å; E40-L99 HydrophobicContact CB-CD2 3.99Å; F43-L99 HydrophobicContact CD2-CD2 4.05Å; F43-L99 HydrophobicContact CD2-CG 4.24Å; F43-L99 HydrophobicContact CE2-CD2 4.36Å; F43-L99 HydrophobicContact CE2-CG 4.29Å; K95-L99 HydrophobicContact CG-CD1 4.02Å; K95-L99 WeakPolarHBondContact O-CB 3.42Å; K95-L99 VanDerWaalsContact O-CG 3.24Å; K95-L99 WeakPolarHBondContact O-CG 3.49Å; K95-L99 PolarHBondContact O-N 2.89Å; K95-L99 VanDerWaalsContact O-N 3.1Å; A96-L99 PolarHBondContact O-N 2.87Å; I97-L99 VanDerWaalsContact C-N 3.28Å; I97-L99 PolarHBondContact O-N 3.31Å
100	D	83.2	Confident	73.2	Confident	141 Å²	141	73.4 Å²	73.4	75%	0.754	39%	0.392	S	S	*	.	H	α-helix	trans	-77.6	-26.2	174.7	-167.9	60.1	0	0	0	112.3	A96 I97 P102	A96-D100 WeakPolarHBondContact O-CB 3.49Å; A96-D100 PolarHBondContact O-N 3.14Å; I97-D100 PolarHBondContact O-N 3.46Å; D100-P102 WeakPolarHBondContact O-CD 3.23Å
101	Q	73.3	Confident	71.4	Confident	31 Å²	31	76.2 Å²	76.2	15%	0.145	41%	0.411	C	S	.	.	S	Bend	trans	-57.2	114.8	176	179.9	170.3	-19.5	0	0	108.6	F80 I97 A103	F80-Q101 VanDerWaalsContact CD2-OE1 3.26Å; F80-Q101 HydrophobicContact CE2-CG 4.31Å; I97-Q101 WeakPolarHBondContact O-CB 3.48Å; I97-Q101 PolarHBondContact O-N 2.92Å; Q101-A103 PolarHBondContact O-N 3.42Å
102	P	57.6	Low	69.6	Low	107 Å²	107	80.4 Å²	80.4	70%	0.695	43%	0.431	S	S	*	.			trans	-59.3	121.1	168.5	25.8	-31.1	0	0	0	105.2	D100 D104	D100-P102 WeakPolarHBondContact O-CD 3.23Å; P102-D104 VanDerWaalsContact C-N 3.31Å; P102-D104 VanDerWaalsContact O-CA 3.27Å; P102-D104 WeakPolarHBondContact O-CA 3.36Å; P102-D104 PolarHBondContact O-N 3.21Å
103	A	57.4	Low	68	Low	67 Å²	67	79.4 Å²	79.4	55%	0.554	43%	0.43	S	S	*	.			trans	-48.1	102	173.7	0	0	0	0	0	107.5	Q101 G105	Q101-A103 PolarHBondContact O-N 3.42Å; A103-G105 PolarHBondContact O-N 3.01Å
104	D	55.1	Low	66.4	Low	108 Å²	108	82.8 Å²	82.8	58%	0.578	45%	0.445	S	S	*	.			trans	-55.1	114.2	-155.9	172.7	29.3	0	0	0	110.8	P102 R106	P102-D104 VanDerWaalsContact C-N 3.31Å; P102-D104 VanDerWaalsContact O-CA 3.27Å; P102-D104 WeakPolarHBondContact O-CA 3.36Å; P102-D104 PolarHBondContact O-N 3.21Å; D104-R106 PolarHBondContact O-N 2.86Å
105	G	53.9	Low	65.1	Low	24 Å²	24	86.9 Å²	86.9	25%	0.247	47%	0.471	C	S	.	.	S	Bend	trans	66.5	-22.6	132.2	0	0	0	0	0	119.5	A103 R109	A103-G105 PolarHBondContact O-N 3.01Å; G105-R109 WeakPolarHBondContact O-CB 3.27Å; G105-R109 VanDerWaalsContact O-CD 3.24Å; G105-R109 WeakPolarHBondContact O-CD 3.27Å; G105-R109 WeakPolarHBondContact O-CG 3.28Å; G105-R109 PolarHBondContact O-N 3.36Å
106	R	48.9	Very low	63.5	Low	185 Å²	185	88.9 Å²	88.9	70%	0.698	48%	0.484	S	S	*	.	H	α-helix	trans	-92.2	-46.9	-179.2	-69.3	-168.7	-69.4	177	-3.7	112.1	D104 R109 I110	D104-R106 PolarHBondContact O-N 2.86Å; R106-R109 PolarHBondContact O-N 3Å; R106-I110 WeakPolarHBondContact O-CB 3.38Å; R106-I110 WeakPolarHBondContact O-CD1 3.45Å; R106-I110 WeakPolarHBondContact O-CG1 3.46Å; R106-I110 PolarHBondContact O-N 3.13Å
107	V	50.5	Low	62.2	Low	102 Å²	102	92.5 Å²	92.5	62%	0.618	49%	0.491	S	S	*	.	H	α-helix	trans	-72.5	-39.5	175.5	-176.8	0	0	0	0	110.1	R109 I110 C111	V107-R109 PolarHBondContact O-N 2.8Å; V107-I110 PolarHBondContact O-N 3.34Å; V107-C111 WeakPolarHBondContact O-CB 3.45Å; V107-C111 PolarHBondContact O-N 3.24Å; V107-C111 PolarHBondContact O-SG 3.38Å
108	H	47.8	Very low	60.8	Low	117 Å²	117	97.8 Å²	97.8	54%	0.542	52%	0.515	S	S	.	.	H	α-helix	trans	-62.1	-42.7	172.5	-168	-78.1	0	0	0	111.4	Q112	H108-Q112 PolarHBondContact CE1-OE1 2.66Å; H108-Q112 VanDerWaalsContact CE1-OE1 3.29Å; H108-Q112 PolarHBondContact ND1-OE1 3.45Å; H108-Q112 WeakPolarHBondContact O-CB 3.39Å; H108-Q112 PolarHBondContact O-N 3.3Å
109	R	52.8	Low	59.6	Low	191 Å²	191	102.1 Å²	102.1	72%	0.721	54%	0.537	S	S	*	.	H	α-helix	trans	-66.7	-37.4	174.8	-79.3	179.6	137.2	-159.1	-7.7	113.5	G105 R106 V107 A113	G105-R109 WeakPolarHBondContact O-CB 3.27Å; G105-R109 VanDerWaalsContact O-CD 3.24Å; G105-R109 WeakPolarHBondContact O-CD 3.27Å; G105-R109 WeakPolarHBondContact O-CG 3.28Å; G105-R109 PolarHBondContact O-N 3.36Å; R106-R109 PolarHBondContact O-N 3Å; V107-R109 PolarHBondContact O-N 2.8Å; R109-A113 WeakPolarHBondContact O-CA 3.05Å; R109-A113 WeakPolarHBondContact O-CB 3.49Å; R109-A113 PolarHBondContact O-N 3Å
110	I	58.7	Low	58.4	Low	104 Å²	104	100.9 Å²	100.9	53%	0.533	54%	0.539	S	S	.	.	H	α-helix	trans	-67.5	-46.6	176.3	-70	164.8	0	0	0	110.2	R106 V107 Q112 A113 I114	R106-I110 WeakPolarHBondContact O-CB 3.38Å; R106-I110 WeakPolarHBondContact O-CD1 3.45Å; R106-I110 WeakPolarHBondContact O-CG1 3.46Å; R106-I110 PolarHBondContact O-N 3.13Å; V107-I110 PolarHBondContact O-N 3.34Å; I110-Q112 PolarHBondContact O-N 3.06Å; I110-A113 PolarHBondContact O-N 3.31Å; I110-I114 HydrophobicContact CG2-CD1 3.75Å; I110-I114 HydrophobicContact CG2-CG1 4.44Å; I110-I114 WeakPolarHBondContact O-CB 3.45Å; I110-I114 WeakPolarHBondContact O-CD1 3.45Å; I110-I114 WeakPolarHBondContact O-CG1 3.49Å; I110-I114 PolarHBondContact O-N 3.22Å
111	C	53.4	Low	57.4	Low	69 Å²	69	100.6 Å²	100.6	47%	0.466	53%	0.533	S	S	.	.	H	α-helix	trans	-63.4	-42	175.8	-67.4	0	0	0	0	111.5	V107 I114 T115	V107-C111 WeakPolarHBondContact O-CB 3.45Å; V107-C111 PolarHBondContact O-N 3.24Å; V107-C111 PolarHBondContact O-SG 3.38Å; C111-I114 PolarHBondContact O-N 3.47Å; C111-T115 WeakPolarHBondContact O-CB 3.44Å; C111-T115 PolarHBondContact O-N 2.99Å; C111-T115 PolarHBondContact O-OG1 3.27Å
112	Q	54.5	Low	56.8	Low	96 Å²	96	102.7 Å²	102.7	45%	0.449	56%	0.555	S	S	.	*	H	α-helix	trans	-68.4	-39.8	178.1	-163.5	168.2	32.5	0	0	111.6	H108 I110 T115 D116	H108-Q112 PolarHBondContact CE1-OE1 2.66Å; H108-Q112 VanDerWaalsContact CE1-OE1 3.29Å; H108-Q112 PolarHBondContact ND1-OE1 3.45Å; H108-Q112 WeakPolarHBondContact O-CB 3.39Å; H108-Q112 PolarHBondContact O-N 3.3Å; I110-Q112 PolarHBondContact O-N 3.06Å; Q112-T115 CarbonylContact O-C 3.6Å; Q112-T115 PolarHBondContact O-N 2.98Å; Q112-D116 WeakPolarHBondContact O-CB 3.44Å; Q112-D116 PolarHBondContact O-N 3.35Å
113	A	59.4	Low	57	Low	53 Å²	53	103.6 Å²	103.6	44%	0.438	55%	0.553	S	S	.	*	H	α-helix	trans	-67.2	-39.9	175.2	0	0	0	0	0	112.6	R109 I110 T115 D116 E117	R109-A113 WeakPolarHBondContact O-CA 3.05Å; R109-A113 WeakPolarHBondContact O-CB 3.49Å; R109-A113 PolarHBondContact O-N 3Å; I110-A113 PolarHBondContact O-N 3.31Å; A113-T115 VanDerWaalsContact C-N 3.27Å; A113-T115 PolarHBondContact O-N 3.29Å; A113-D116 PolarHBondContact O-N 2.96Å; A113-E117 WeakPolarHBondContact O-CB 3.1Å; A113-E117 PolarHBondContact O-N 3.17Å
114	I	58.9	Low	56.8	Low	108 Å²	108	108 Å²	108	55%	0.554	56%	0.562	S	S	*	*	H	α-helix	trans	-61.7	-40.9	172.7	-68.4	165.9	0	0	0	109.8	I110 C111 E118	I110-I114 HydrophobicContact CG2-CD1 3.75Å; I110-I114 HydrophobicContact CG2-CG1 4.44Å; I110-I114 WeakPolarHBondContact O-CB 3.45Å; I110-I114 WeakPolarHBondContact O-CD1 3.45Å; I110-I114 WeakPolarHBondContact O-CG1 3.49Å; I110-I114 PolarHBondContact O-N 3.22Å; C111-I114 PolarHBondContact O-N 3.47Å; I114-E118 PolarHBondContact O-N 3.05Å; I114-E118 VanDerWaalsContact O-N 3.12Å
115	T	62.5	Low	56.6	Low	87 Å²	87	112.8 Å²	112.8	53%	0.534	57%	0.572	S	S	.	*	H	α-helix	trans	-71.2	-40.4	179.1	-43.5	0	0	0	0	112.2	C111 Q112 A113 E118 L119	C111-T115 WeakPolarHBondContact O-CB 3.44Å; C111-T115 PolarHBondContact O-N 2.99Å; C111-T115 PolarHBondContact O-OG1 3.27Å; Q112-T115 CarbonylContact O-C 3.6Å; Q112-T115 PolarHBondContact O-N 2.98Å; A113-T115 VanDerWaalsContact C-N 3.27Å; A113-T115 PolarHBondContact O-N 3.29Å; T115-E118 PolarHBondContact O-N 3.09Å; T115-L119 VanDerWaalsContact O-CB 3.3Å; T115-L119 WeakPolarHBondContact O-CB 3.48Å; T115-L119 PolarHBondContact O-N 3.44Å
116	D	57.8	Low	56.5	Low	97 Å²	97	116.5 Å²	116.5	52%	0.519	59%	0.591	S	S	.	*	H	α-helix	trans	-67.2	-36.3	177.6	-85.1	-30.1	0	0	0	111.7	Q112 A113 L119 A120	Q112-D116 WeakPolarHBondContact O-CB 3.44Å; Q112-D116 PolarHBondContact O-N 3.35Å; A113-D116 PolarHBondContact O-N 2.96Å; D116-L119 PolarHBondContact O-N 2.95Å; D116-A120 WeakPolarHBondContact O-CB 3.44Å; D116-A120 PolarHBondContact O-N 2.87Å
117	E	62.8	Low	56.7	Low	132 Å²	132	117.3 Å²	117.3	62%	0.617	60%	0.6	S	S	*	*	H	α-helix	trans	-74.7	-33.3	177.2	-168.8	143.7	-166.9	0	0	112.5	A113 Q121	A113-E117 WeakPolarHBondContact O-CB 3.1Å; A113-E117 PolarHBondContact O-N 3.17Å; E117-Q121 WeakPolarHBondContact O-CB 3.41Å; E117-Q121 VanDerWaalsContact O-CG 3.29Å; E117-Q121 WeakPolarHBondContact O-CG 3.47Å; E117-Q121 PolarHBondContact O-N 2.65Å; E117-Q121 VanDerWaalsContact O-N 3.14Å; E117-Q121 PolarHBondContact O-NE2 3.4Å
118	E	59.1	Low	56.8	Low	145 Å²	145	117.9 Å²	117.9	68%	0.678	61%	0.609	S	S	*	*	H	α-helix	trans	-68.2	-40.5	169.8	-124.5	-166.7	146.7	0	0	111.7	I114 T115 Q121 A122	I114-E118 PolarHBondContact O-N 3.05Å; I114-E118 VanDerWaalsContact O-N 3.12Å; T115-E118 PolarHBondContact O-N 3.09Å; E118-Q121 PolarHBondContact O-N 3.47Å; E118-A122 PolarHBondContact O-N 2.72Å
119	L	57.7	Low	56.8	Low	99 Å²	99	120.8 Å²	120.8	52%	0.518	62%	0.62	S	S	.	*	H	α-helix	trans	-67.2	-42.4	177.1	-163.1	87.6	0	0	0	111.5	T115 D116 Q121 A122 I123	T115-L119 VanDerWaalsContact O-CB 3.3Å; T115-L119 WeakPolarHBondContact O-CB 3.48Å; T115-L119 PolarHBondContact O-N 3.44Å; D116-L119 PolarHBondContact O-N 2.95Å; L119-Q121 VanDerWaalsContact C-N 3.32Å; L119-Q121 PolarHBondContact O-N 3.09Å; L119-A122 PolarHBondContact O-N 2.87Å; L119-I123 HydrophobicContact CD2-CD1 3.9Å; L119-I123 HydrophobicContact CG-CD1 3.83Å; L119-I123 VanDerWaalsContact O-CG1 3.26Å; L119-I123 WeakPolarHBondContact O-CG1 3.38Å; L119-I123 PolarHBondContact O-N 2.71Å
120	A	61.7	Low	56.8	Low	56 Å²	56	116 Å²	116	46%	0.463	62%	0.621	S	S	.	*	H	α-helix	trans	-63.3	-38.3	177.7	0	0	0	0	0	111.8	D116 I123 H124	D116-A120 WeakPolarHBondContact O-CB 3.44Å; D116-A120 PolarHBondContact O-N 2.87Å; A120-I123 PolarHBondContact O-N 3.03Å; A120-H124 WeakPolarHBondContact O-CB 2.94Å; A120-H124 PolarHBondContact O-N 3.24Å
121	Q	61.8	Low	56.4	Low	135 Å²	135	113.6 Å²	113.6	63%	0.631	62%	0.622	S	S	*	*	H	α-helix	trans	-69.8	-33.1	175	-74.1	-177.6	79.9	0	0	112.9	E117 E118 L119	E117-Q121 WeakPolarHBondContact O-CB 3.41Å; E117-Q121 VanDerWaalsContact O-CG 3.29Å; E117-Q121 WeakPolarHBondContact O-CG 3.47Å; E117-Q121 PolarHBondContact O-N 2.65Å; E117-Q121 VanDerWaalsContact O-N 3.14Å; E117-Q121 PolarHBondContact O-NE2 3.4Å; E118-Q121 PolarHBondContact O-N 3.47Å; L119-Q121 VanDerWaalsContact C-N 3.32Å; L119-Q121 PolarHBondContact O-N 3.09Å
122	A	61.2	Low	56.2	Low	74 Å²	74	121.1 Å²	121.1	61%	0.612	64%	0.643	S	S	*	*	H	α-helix	trans	-70	-38.5	174	0	0	0	0	0	112.6	E118 L119	E118-A122 PolarHBondContact O-N 2.72Å; L119-A122 PolarHBondContact O-N 2.87Å
123	I	61	Low	56.1	Low	127 Å²	127	124.5 Å²	124.5	65%	0.651	66%	0.664	S	S	*	*	H	α-helix	trans	-76.3	-30.5	-179.7	-61.2	165	0	0	0	111.4	L119 A120 R125	L119-I123 HydrophobicContact CD2-CD1 3.9Å; L119-I123 HydrophobicContact CG-CD1 3.83Å; L119-I123 VanDerWaalsContact O-CG1 3.26Å; L119-I123 WeakPolarHBondContact O-CG1 3.38Å; L119-I123 PolarHBondContact O-N 2.71Å; A120-I123 PolarHBondContact O-N 3.03Å; I123-R125 VanDerWaalsContact C-N 3.34Å; I123-R125 PolarHBondContact O-N 2.73Å
124	H	53.2	Low	56.1	Low	158 Å²	158	130.9 Å²	130.9	73%	0.731	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	16.4	-179.5	-158.3	72.2	0	0	0	114.8	A120 P126	A120-H124 WeakPolarHBondContact O-CB 2.94Å; A120-H124 PolarHBondContact O-N 3.24Å; H124-P126 VanDerWaalsContact C-CD 3.46Å; H124-P126 WeakPolarHBondContact O-CD 3.2Å
125	R	50.2	Low	56	Low	210 Å²	210	132.1 Å²	132.1	79%	0.792	71%	0.713	S	S	*	*			trans	-90.9	92.3	160.8	-156.2	177.1	-172.1	169.5	2.8	108.1	I123 F127	I123-R125 VanDerWaalsContact C-N 3.34Å; I123-R125 PolarHBondContact O-N 2.73Å; R125-F127 PolarHBondContact O-N 3.3Å
126	P	53	Low	55.6	Low	101 Å²	101	134.4 Å²	134.4	66%	0.656	72%	0.722	S	S	*	*			trans	-57.3	118.4	168.1	25	-32	0	0	0	106.3	H124 S128	H124-P126 VanDerWaalsContact C-CD 3.46Å; H124-P126 WeakPolarHBondContact O-CD 3.2Å; P126-S128 PolarHBondContact O-N 2.82Å
127	F	52.3	Low	55.5	Low	202 Å²	202	136.5 Å²	136.5	89%	0.886	73%	0.734	S	S	*	*			trans	-51.1	97.7	159.9	-93.3	-97.6	0	0	0	106	R125 F129	R125-F127 PolarHBondContact O-N 3.3Å; F127-F129 PolarHBondContact O-N 3.37Å
128	S	53.2	Low	55.1	Low	114 Å²	114	136.8 Å²	136.8	80%	0.797	74%	0.74	S	S	*	*			trans	-71.1	75.3	168.9	-167.4	0	0	0	0	106.2	P126 A130	P126-S128 PolarHBondContact O-N 2.82Å; S128-A130 VanDerWaalsContact C-N 3.26Å; S128-A130 PolarHBondContact O-N 3.01Å
129	F	46.8	Very low	54.8	Low	179 Å²	179	136.3 Å²	136.3	79%	0.785	74%	0.744	S	S	*	*			trans	-84.2	84.8	163.4	-165.8	-97.4	0	0	0	105.5	F127 G131	F127-F129 PolarHBondContact O-N 3.37Å; F129-G131 PolarHBondContact O-N 3.35Å
130	A	53.3	Low	54.6	Low	89 Å²	89	138.7 Å²	138.7	74%	0.736	76%	0.759	S	S	*	*			trans	-62.8	88.2	167.7	0	0	0	0	0	108	S128 Y132	S128-A130 VanDerWaalsContact C-N 3.26Å; S128-A130 PolarHBondContact O-N 3.01Å; A130-Y132 PolarHBondContact O-N 3.5Å
131	G	51.3	Low	54.1	Low	54 Å²	54	144.6 Å²	144.6	56%	0.557	78%	0.781	S	S	*	*			trans	-74.4	108.2	172	0	0	0	0	0	110	F129	F129-G131 PolarHBondContact O-N 3.35Å
132	Y	49.4	Very low	53.5	Low	228 Å²	228	145.4 Å²	145.4	89%	0.894	79%	0.792	S	S	*	*			trans	16	106.2	140.2	-82.6	-97.8	0	0	0	116.4	A130	A130-Y132 PolarHBondContact O-N 3.5Å
133	N	51.6	Low	52.9	Low	167 Å²	167	151.3 Å²	151.3	89%	0.893	81%	0.807	S	S	*	*			trans	-91.5	129.9	158.4	-147.7	10.1	0	0	0	108.4
134	S	59.5	Low	52.2	Low	187 Å²	187	153.5 Å²	153.5	100%	1.308	82%	0.821	S	S	*	*			trans	-59.1	0	179.9	-67.9	0	0	0	0	114.2

Retrieved 134 of 134 residues in 58.3 ms (Link to these results)

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