G4VIK4_SCHMA Loading...

Oxidoreductase-like domain-containing protein

AlphaFold DB , UniProt , Accession G4VIK4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 128 aa.

						>G4VIK4_SCHMA|G4VIK4
MGLLRKLNFNHSTICTVSTWLIRPWRRNYFSNTDSEPEPPHRSDCCESGCANCVWVEYAENLFKYHIKRIKESSDNTGFKDRDKVFGEIVNKLQKEINQIEDQNLRIFLLTEIEIKREKLLEALQEDT
					

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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	45.4	Very low	47.3	Very low	244 Å²	244	176.2 Å²	176.2	100%	1.202	88%	0.882	S	S	*	*				0	92.1	0	-70.3	-76.8	-138.6	0	0	107.8
2	G	40.7	Very low	47.1	Very low	78 Å²	78	169.5 Å²	169.5	80%	0.804	87%	0.865	S	S	*	*			trans	-87.3	135.5	-172.7	0	0	0	0	0	112.5	L4	G2-L4 PolarHBondContact O-N 3.03Å
3	L	48.7	Very low	47.4	Very low	184 Å²	184	165.8 Å²	165.8	96%	0.963	86%	0.855	S	S	*	*			trans	-89.8	99.5	176.5	-89.1	143.1	0	0	0	109.7
4	L	49.8	Very low	47.3	Very low	157 Å²	157	165.4 Å²	165.4	82%	0.822	85%	0.853	S	S	*	*			trans	-84.9	121.2	169.3	-84.8	164.9	0	0	0	110.9	G2	G2-L4 PolarHBondContact O-N 3.03Å
5	R	49.1	Very low	47.1	Very low	233 Å²	233	161 Å²	161	88%	0.879	84%	0.841	S	S	*	*			trans	14.1	120.5	144.2	-60	-179.4	-175.8	-169.6	0.4	117.8
6	K	46.8	Very low	47.1	Very low	194 Å²	194	157.9 Å²	157.9	84%	0.843	83%	0.831	S	S	*	*			trans	-126.4	111.2	147.9	-75.3	-177.3	178.1	-179.9	0	108.2
7	L	50.3	Low	47.1	Very low	171 Å²	171	157.5 Å²	157.5	90%	0.895	84%	0.836	S	S	*	*			trans	-113.6	106.8	155.7	-77.3	172.6	0	0	0	106.8
8	N	44.1	Very low	47.1	Very low	144 Å²	144	152.4 Å²	152.4	77%	0.77	82%	0.815	S	S	*	*			trans	-71.9	125.1	162.8	-91.9	-46.4	0	0	0	107.8
9	F	47.4	Very low	47.1	Very low	212 Å²	212	151.9 Å²	151.9	93%	0.93	82%	0.819	S	S	*	*			trans	-121.8	107.6	156.5	-120.3	-94.3	0	0	0	106.9
10	N	49.2	Very low	47	Very low	150 Å²	150	154.7 Å²	154.7	80%	0.802	82%	0.817	S	S	*	*			trans	-128.8	90.4	178.9	-159.8	2.3	0	0	0	106.6
11	H	49.2	Very low	46.7	Very low	171 Å²	171	154.7 Å²	154.7	79%	0.792	82%	0.817	S	S	*	*			trans	-162.4	107.3	151.8	-143.7	-118.4	0	0	0	111.6
12	S	44.5	Very low	46.9	Very low	96 Å²	96	150.8 Å²	150.8	67%	0.671	80%	0.799	S	S	*	*			trans	26.5	99.5	145.1	-158.2	0	0	0	0	118.1
13	T	50.6	Low	47.4	Very low	121 Å²	121	153.9 Å²	153.9	74%	0.742	79%	0.786	S	S	*	*			trans	-148.1	100.7	144.1	4.6	0	0	0	0	107.1	C15	T13-C15 PolarHBondContact O-N 2.84Å
14	I	46.2	Very low	47.5	Very low	160 Å²	160	150.5 Å²	150.5	82%	0.821	78%	0.775	S	S	*	*			trans	-68.3	83.6	162.8	-63.8	169.4	0	0	0	105.3	T16	I14-T16 PolarHBondContact O-N 3.26Å
15	C	44.2	Very low	47.4	Very low	100 Å²	100	152.2 Å²	152.2	68%	0.676	77%	0.771	S	S	*	*			trans	-85.9	102.9	160.6	-70.9	0	0	0	0	105.5	T13 V17	T13-C15 PolarHBondContact O-N 2.84Å; C15-V17 PolarHBondContact O-N 3.35Å; C15-V17 VanDerWaalsContact O-N 3.16Å
16	T	48.4	Very low	47.3	Very low	112 Å²	112	150.9 Å²	150.9	69%	0.687	77%	0.766	S	S	*	*			trans	-41.9	120.6	169.3	39.8	0	0	0	0	109.4	I14 S18	I14-T16 PolarHBondContact O-N 3.26Å; T16-S18 PolarHBondContact O-N 3Å
17	V	45.9	Very low	47.4	Very low	150 Å²	150	150 Å²	150	91%	0.909	76%	0.757	S	S	*	*			trans	-63.4	85.3	167.1	179.6	0	0	0	0	105.5	C15 T19	C15-V17 PolarHBondContact O-N 3.35Å; C15-V17 VanDerWaalsContact O-N 3.16Å; V17-T19 PolarHBondContact O-N 3.48Å
18	S	47.6	Very low	47.3	Very low	67 Å²	67	146 Å²	146	47%	0.469	74%	0.737	S	S	.	*			trans	-75.5	126.1	-179.9	42	0	0	0	0	107.2	T16 W20	T16-S18 PolarHBondContact O-N 3Å; S18-W20 VanDerWaalsContact CB-CD1 3.49Å; S18-W20 PolarHBondContact O-N 2.96Å
19	T	46.8	Very low	47.7	Very low	143 Å²	143	144.2 Å²	144.2	88%	0.877	72%	0.72	S	S	*	*			trans	-54.5	66.2	169.6	4.1	0	0	0	0	111	V17	V17-T19 PolarHBondContact O-N 3.48Å
20	W	46.2	Very low	47.8	Very low	206 Å²	206	142.2 Å²	142.2	78%	0.78	71%	0.711	S	S	*	*			trans	-105.9	23.5	173.2	-77.9	102.4	0	0	0	112.4	S18	S18-W20 VanDerWaalsContact CB-CD1 3.49Å; S18-W20 PolarHBondContact O-N 2.96Å
21	L	39.7	Very low	47.9	Very low	156 Å²	156	137.2 Å²	137.2	82%	0.817	69%	0.688	S	S	*	*			trans	-78.9	131.4	157.6	-64	172.7	0	0	0	106.9
22	I	50.1	Low	48.1	Very low	162 Å²	162	134.6 Å²	134.6	83%	0.831	68%	0.68	S	S	*	*			trans	94.7	73.5	-175.3	-44.4	157.6	0	0	0	112.9	P24	I22-P24 VanDerWaalsContact O-CD 3.3Å; I22-P24 WeakPolarHBondContact O-CD 3.1Å
23	R	50.2	Low	48.8	Very low	143 Å²	143	133.7 Å²	133.7	54%	0.54	67%	0.671	S	S	.	*			trans	-76.3	114.4	161.8	-78.3	-178.6	148.4	-162.6	-6.6	109.4	W25 N52	R23-W25 PolarHBondContact O-N 2.74Å; R23-N52 PolarHBondContact NH1-ND2 3.43Å; R23-N52 PolarHBondContact NH1-OD1 3.02Å
24	P	50.6	Low	49.8	Very low	112 Å²	112	134 Å²	134	73%	0.727	67%	0.668	S	S	*	*	S	Bend	trans	-78.9	5.2	-177.6	-13.2	29.8	0	0	0	115.2	I22	I22-P24 VanDerWaalsContact O-CD 3.3Å; I22-P24 WeakPolarHBondContact O-CD 3.1Å
25	W	49.1	Very low	51.5	Low	193 Å²	193	129.6 Å²	129.6	73%	0.731	65%	0.651	S	S	*	*			trans	-120.3	56.7	-171.8	-64.9	71.3	0	0	0	111	R23 R27	R23-W25 PolarHBondContact O-N 2.74Å; W25-R27 PolarHBondContact O-N 3.45Å
26	R	46.5	Very low	53.5	Low	205 Å²	205	128.6 Å²	128.6	77%	0.774	64%	0.636	S	S	*	*			trans	-80.9	83.5	155.6	-134.6	-172.8	-161.3	-115.8	4.6	105.7	N28	R26-N28 PolarHBondContact O-N 3.24Å
27	R	49.6	Very low	55.4	Low	175 Å²	175	124.2 Å²	124.2	66%	0.66	61%	0.61	S	S	*	*			trans	-66.7	95.9	162.7	-175.7	165.6	-69.7	159.1	0.4	104.2	W25 Y29	W25-R27 PolarHBondContact O-N 3.45Å; R27-Y29 VanDerWaalsContact C-N 3.32Å; R27-Y29 PolarHBondContact O-N 3.12Å
28	N	48.4	Very low	57.5	Low	87 Å²	87	124.7 Å²	124.7	47%	0.465	60%	0.602	S	S	.	*			trans	-57.7	102.3	174.7	-82.6	-32.8	0	0	0	106.6	R26 F30	R26-N28 PolarHBondContact O-N 3.24Å; N28-F30 HydrophobicContact CB-CB 4.34Å; N28-F30 HydrophobicContact CB-CD2 3.71Å; N28-F30 HydrophobicContact CB-CG 4.48Å; N28-F30 PolarHBondContact O-N 3.02Å
29	Y	50.7	Low	59.4	Low	108 Å²	108	124.6 Å²	124.6	42%	0.424	60%	0.6	S	S	.	*			trans	-65.6	81.8	145.8	-98.2	-90.1	0	0	0	104.8	R27 S31	R27-Y29 VanDerWaalsContact C-N 3.32Å; R27-Y29 PolarHBondContact O-N 3.12Å; Y29-S31 PolarHBondContact O-N 2.84Å
30	F	50.1	Low	61.4	Low	169 Å²	169	118.2 Å²	118.2	74%	0.741	56%	0.561	S	S	*	*			trans	-68.2	87.2	174.6	-133	-80.1	0	0	0	105.2	N28 N32	N28-F30 HydrophobicContact CB-CB 4.34Å; N28-F30 HydrophobicContact CB-CD2 3.71Å; N28-F30 HydrophobicContact CB-CG 4.48Å; N28-F30 PolarHBondContact O-N 3.02Å; F30-N32 PolarHBondContact O-N 3.37Å; F30-N32 VanDerWaalsContact O-N 3.12Å
31	S	52	Low	63.2	Low	45 Å²	45	114.4 Å²	114.4	32%	0.315	55%	0.551	S	S	.	*			trans	-68.5	107.1	171.7	47.8	0	0	0	0	106.9	Y29 T33	Y29-S31 PolarHBondContact O-N 2.84Å; S31-T33 PolarHBondContact O-N 2.85Å
32	N	53.3	Low	65.1	Low	117 Å²	117	112.8 Å²	112.8	63%	0.626	53%	0.534	S	S	*	.			trans	-56.4	113.3	159.3	-88.9	-43.4	0	0	0	106	F30 D34 S35	F30-N32 PolarHBondContact O-N 3.37Å; F30-N32 VanDerWaalsContact O-N 3.12Å; N32-D34 PolarHBondContact O-N 2.94Å; N32-S35 PolarHBondContact O-N 3.25Å; N32-S35 PolarHBondContact O-OG 3.26Å
33	T	59.2	Low	66.6	Low	77 Å²	77	109.4 Å²	109.4	47%	0.472	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	5.1	-173.5	57.4	0	0	0	0	114.1	S31 K68	S31-T33 PolarHBondContact O-N 2.85Å; T33-K68 PolarHBondContact O-NZ 2.97Å; T33-K68 PolarHBondContact OG1-NZ 3.08Å
34	D	71.1	Confident	68.3	Low	127 Å²	127	105.8 Å²	105.8	68%	0.679	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-16.6	-176	-58.9	-21.5	0	0	0	111.8	N32 K68	N32-D34 PolarHBondContact O-N 2.94Å; D34-K68 IonicContact OD1-NZ 2.68Å; D34-K68 PolarHBondContact OD1-NZ 3.41Å
35	S	82.1	Confident	69.8	Low	67 Å²	67	101.1 Å²	101.1	47%	0.469	49%	0.486	S	S	.	.	S	Bend	trans	-117.7	146.1	175.6	54.7	0	0	0	0	111	N32	N32-S35 PolarHBondContact O-N 3.25Å; N32-S35 PolarHBondContact O-OG 3.26Å
36	E	86.3	Confident	71.4	Confident	80 Å²	80	95.3 Å²	95.3	37%	0.374	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-58.3	129.3	171.9	-169.3	176	153.5	0	0	109.2	L62 Y65 K92	E36-L62 HydrophobicContact CG-CD2 3.94Å; E36-Y65 HydrophobicContact CB-CD1 4.13Å; E36-Y65 HydrophobicContact CB-CE1 3.54Å; E36-Y65 HydrophobicContact CG-CD1 4.1Å; E36-Y65 HydrophobicContact CG-CE1 3.84Å; E36-Y65 VanDerWaalsContact N-CZ 3.3Å; E36-Y65 PolarHBondContact N-OH 3.33Å; E36-K92 IonicContact OE1-NZ 3.55Å; E36-K92 PolarHBondContact OE1-NZ 2.93Å
37	P	89	Confident	72.9	Confident	19 Å²	19	90.1 Å²	90.1	12%	0.123	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-63.2	144.5	-179.6	26.3	-34.7	0	0	0	110.6	Y58 N61 L62	P37-Y58 HydrophobicContact CB-CD2 4.27Å; P37-Y58 HydrophobicContact CB-CE2 4.27Å; P37-Y58 HydrophobicContact CG-CD2 4.47Å; P37-Y58 HydrophobicContact CG-CE2 4.28Å; P37-Y58 WeakPolarHBondContact O-CE2 3.49Å; P37-N61 HydrophobicContact CB-CB 4.21Å; P37-N61 HydrophobicContact CG-CB 4.15Å; P37-L62 HydrophobicContact CG-CB 4.29Å; P37-L62 HydrophobicContact CG-CD2 3.6Å; P37-L62 HydrophobicContact CG-CG 3.72Å
38	E	88.6	Confident	74.2	Confident	161 Å²	161	86.1 Å²	86.1	75%	0.752	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-82.4	143.8	176.1	-65.4	-175.9	169.3	0	0	110.8	Y58	E38-Y58 VanDerWaalsContact O-CD2 3.26Å; E38-Y58 WeakPolarHBondContact O-CD2 3.38Å; E38-Y58 VanDerWaalsContact O-CE2 3.3Å; E38-Y58 WeakPolarHBondContact O-CE2 3.44Å
39	P	87.9	Confident	75.3	Confident	64 Å²	64	83.8 Å²	83.8	42%	0.416	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-64.4	141.4	176.5	27.2	-33.9	0	0	0	110.7	W55 Y58 E96	P39-W55 HydrophobicContact CB-CZ3 4.38Å; P39-Y58 VanDerWaalsContact CA-CE2 3.48Å; P39-Y58 HydrophobicContact CB-CE1 4.08Å; P39-Y58 HydrophobicContact CB-CE2 4.23Å; P39-E96 WeakPolarHBondContact CB-OE2 3.45Å
40	P	88.3	Confident	76.6	Confident	9 Å²	9	80.5 Å²	80.5	6%	0.058	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-65.2	151	177.8	28.5	-35.2	0	0	0	110.8	V54 W55	P40-V54 HydrophobicContact CB-CB 3.83Å; P40-V54 HydrophobicContact CB-CG2 3.8Å; P40-V54 HydrophobicContact CG-CB 4.13Å; P40-V54 HydrophobicContact CG-CG2 3.93Å; P40-W55 HydrophobicContact CG-CD2 3.75Å; P40-W55 HydrophobicContact CG-CE3 3.52Å; P40-W55 HydrophobicContact CG-CG 4.45Å; P40-W55 HydrophobicContact CG-CH2 3.94Å; P40-W55 HydrophobicContact CG-CZ2 4.17Å; P40-W55 HydrophobicContact CG-CZ3 3.62Å
41	H	84.4	Confident	77.7	Confident	127 Å²	127	76.5 Å²	76.5	59%	0.588	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-71.2	146.4	173.7	-165.6	-102.2	0	0	0	109.8	S43 D44	H41-S43 PolarHBondContact ND1-N 2.96Å; H41-S43 PolarHBondContact ND1-OG 2.85Å; H41-S43 PolarHBondContact O-N 3.44Å; H41-D44 PolarHBondContact N-OD2 2.91Å; H41-D44 VanDerWaalsContact O-CB 3.31Å; H41-D44 WeakPolarHBondContact O-CB 3.47Å; H41-D44 PolarHBondContact O-N 2.94Å
42	R	79.5	Confident	78.8	Confident	121 Å²	121	78.3 Å²	78.3	46%	0.457	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-58	-36.5	-178.2	-67.4	-169.5	-168	-152.3	11.2	113.1	D44 C45 Q99	R42-D44 PolarHBondContact O-N 3.19Å; R42-D44 VanDerWaalsContact O-N 3.13Å; R42-C45 WeakPolarHBondContact O-CB 3.4Å; R42-C45 PolarHBondContact O-N 3.43Å; R42-Q99 VanDerWaalsContact NH1-CB 3.31Å; R42-Q99 PolarHBondContact NH1-O 3.3Å
43	S	82.7	Confident	80.3	Confident	92 Å²	92	72.9 Å²	72.9	64%	0.643	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-62.5	-16.5	177.2	62.8	0	0	0	0	113.9	H41 C45	H41-S43 PolarHBondContact ND1-N 2.96Å; H41-S43 PolarHBondContact ND1-OG 2.85Å; H41-S43 PolarHBondContact O-N 3.44Å; S43-C45 VanDerWaalsContact C-N 3.32Å
44	D	84.4	Confident	81.8	Confident	67 Å²	67	70.4 Å²	70.4	36%	0.358	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-83.6	-14	177.2	-58	-26.7	0	0	0	111.7	H41 R42 C46 V54	H41-D44 PolarHBondContact N-OD2 2.91Å; H41-D44 VanDerWaalsContact O-CB 3.31Å; H41-D44 WeakPolarHBondContact O-CB 3.47Å; H41-D44 PolarHBondContact O-N 2.94Å; R42-D44 PolarHBondContact O-N 3.19Å; R42-D44 VanDerWaalsContact O-N 3.13Å; D44-C46 PolarHBondContact O-N 2.96Å; D44-V54 HydrophobicContact CB-CG1 4.07Å; D44-V54 HydrophobicContact CB-CG2 4.25Å
45	C	83.6	Confident	82.6	Confident	13 Å²	13	64.8 Å²	64.8	9%	0.088	38%	0.376	C	S	.	.			trans	-80.2	118.3	173	-166	0	0	0	0	109.7	R42 S43 E47 V54	R42-C45 WeakPolarHBondContact O-CB 3.4Å; R42-C45 PolarHBondContact O-N 3.43Å; S43-C45 VanDerWaalsContact C-N 3.32Å; C45-E47 PolarHBondContact O-N 2.74Å; C45-V54 HydrophobicContact CB-CG2 4.24Å
46	C	81.7	Confident	82.9	Confident	71 Å²	71	62.4 Å²	62.4	48%	0.48	36%	0.358	S	S	.	.			trans	-70.9	-7.4	178.3	64.9	0	0	0	0	114.6	D44 S48 C50	D44-C46 PolarHBondContact O-N 2.96Å; C46-S48 PolarHBondContact O-N 2.75Å; C46-S48 PolarHBondContact SG-OG 2.86Å; C46-C50 VanDerWaalsContact SG-CB 3.56Å; C46-C50 PolarHBondContact SG-SG 3.29Å
47	E	77.4	Confident	83	Confident	97 Å²	97	61.4 Å²	61.4	45%	0.453	35%	0.354	S	S	.	.	S	Bend	trans	54.8	7.5	-175.9	-60.5	-176.7	169.4	0	0	116.8	C45 L105	C45-E47 PolarHBondContact O-N 2.74Å; E47-L105 HydrophobicContact CB-CD2 4.11Å; E47-L105 HydrophobicContact CG-CD2 4.09Å
48	S	78	Confident	83.1	Confident	91 Å²	91	60.9 Å²	60.9	64%	0.636	35%	0.35	S	S	*	.	S	Bend	trans	-103.4	15.5	-172.8	79.6	0	0	0	0	114.1	C46 C50	C46-S48 PolarHBondContact O-N 2.75Å; C46-S48 PolarHBondContact SG-OG 2.86Å; S48-C50 PolarHBondContact O-N 3.46Å
49	G	70.4	Confident	83.2	Confident	38 Å²	38	53.2 Å²	53.2	39%	0.392	31%	0.314	S	S	.	.			trans	61.6	40.9	-177.4	0	0	0	0	0	114
50	C	77.8	Confident	83.3	Confident	39 Å²	39	53.1 Å²	53.1	26%	0.264	31%	0.308	S	S	.	.			trans	-73.1	152.3	-174.9	77.3	0	0	0	0	113.1	C46 S48 N52 C53	C46-C50 VanDerWaalsContact SG-CB 3.56Å; C46-C50 PolarHBondContact SG-SG 3.29Å; S48-C50 PolarHBondContact O-N 3.46Å; C50-N52 PolarHBondContact O-N 3.42Å; C50-N52 VanDerWaalsContact SG-C 3.5Å; C50-C53 PolarHBondContact O-N 3.41Å
51	A	74.7	Confident	83.4	Confident	84 Å²	84	53.7 Å²	53.7	69%	0.694	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-20.3	177.9	0	0	0	0	0	114.5
52	N	74.3	Confident	83.7	Confident	84 Å²	84	47.7 Å²	47.7	45%	0.449	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	51.3	178	-71.8	4.1	0	0	0	109.6	R23 C50 V54	R23-N52 PolarHBondContact NH1-ND2 3.43Å; R23-N52 PolarHBondContact NH1-OD1 3.02Å; C50-N52 PolarHBondContact O-N 3.42Å; C50-N52 VanDerWaalsContact SG-C 3.5Å; N52-V54 PolarHBondContact O-N 3.47Å
53	C	85.1	Confident	84.2	Confident	3 Å²	3	42 Å²	42	2%	0.02	26%	0.261	C	S	.	.			trans	-69.3	129.5	-178.9	-176.4	0	0	0	0	110.3	C50 W55 V56 E57 L109	C50-C53 PolarHBondContact O-N 3.41Å; C53-W55 PolarHBondContact O-N 3.44Å; C53-V56 HydrophobicContact CB-CB 4.23Å; C53-V56 HydrophobicContact CB-CG2 3.86Å; C53-V56 WeakPolarHBondContact O-CB 3.42Å; C53-V56 PolarHBondContact O-N 3.19Å; C53-E57 PolarHBondContact O-N 3.26Å; C53-L109 HydrophobicContact CB-CD2 4.07Å; C53-L109 WeakPolarHBondContact SG-CD2 3.37Å
54	V	89.8	Confident	84.5	Confident	24 Å²	24	43 Å²	43	15%	0.145	25%	0.254	C	S	.	.	H	α-helix	trans	-57.1	-33.6	-179.9	-63	0	0	0	0	112.8	P40 D44 C45 N52 Y58	P40-V54 HydrophobicContact CB-CB 3.83Å; P40-V54 HydrophobicContact CB-CG2 3.8Å; P40-V54 HydrophobicContact CG-CB 4.13Å; P40-V54 HydrophobicContact CG-CG2 3.93Å; D44-V54 HydrophobicContact CB-CG1 4.07Å; D44-V54 HydrophobicContact CB-CG2 4.25Å; C45-V54 HydrophobicContact CB-CG2 4.24Å; N52-V54 PolarHBondContact O-N 3.47Å; V54-Y58 WeakPolarHBondContact O-CB 3.42Å; V54-Y58 PolarHBondContact O-N 3.04Å
55	W	89.3	Confident	84.7	Confident	10 Å²	10	41.3 Å²	41.3	4%	0.038	24%	0.242	C	C	.	.	H	α-helix	trans	-69	-35.4	175.8	-66.7	113.9	0	0	0	112.7	P39 P40 C53 Y58 A59 E96 I97 I100 L109	P39-W55 HydrophobicContact CB-CZ3 4.38Å; P40-W55 HydrophobicContact CG-CD2 3.75Å; P40-W55 HydrophobicContact CG-CE3 3.52Å; P40-W55 HydrophobicContact CG-CG 4.45Å; P40-W55 HydrophobicContact CG-CH2 3.94Å; P40-W55 HydrophobicContact CG-CZ2 4.17Å; P40-W55 HydrophobicContact CG-CZ3 3.62Å; C53-W55 PolarHBondContact O-N 3.44Å; W55-Y58 HydrophobicContact CE3-CD1 4.15Å; W55-Y58 HydrophobicContact CZ3-CD1 4.37Å; W55-A59 WeakPolarHBondContact O-CB 3.28Å; W55-A59 PolarHBondContact O-N 2.85Å; W55-E96 HydrophobicContact CH2-CB 4.14Å; W55-E96 HydrophobicContact CZ3-CB 3.86Å; W55-E96 WeakPolarHBondContact CZ3-OE2 3.36Å; W55-I97 HydrophobicContact CD2-CG1 4.43Å; W55-I97 HydrophobicContact CE3-CG1 4.47Å; W55-I100 HydrophobicContact CG-CD1 4.44Å; W55-L109 HydrophobicContact CB-CD1 4.05Å; W55-L109 HydrophobicContact CB-CD2 4.16Å; W55-L109 HydrophobicContact CG-CD1 4.12Å
56	V	88	Confident	84.8	Confident	16 Å²	16	42.3 Å²	42.3	10%	0.097	25%	0.246	C	C	.	.	H	α-helix	trans	-71.1	-43.8	177.3	177.9	0	0	0	0	110.1	C53 A59 E60 L109 E112 K116	C53-V56 HydrophobicContact CB-CB 4.23Å; C53-V56 HydrophobicContact CB-CG2 3.86Å; C53-V56 WeakPolarHBondContact O-CB 3.42Å; C53-V56 PolarHBondContact O-N 3.19Å; V56-A59 PolarHBondContact O-N 3.33Å; V56-E60 WeakPolarHBondContact O-CG 3.24Å; V56-E60 PolarHBondContact O-N 3.34Å; V56-L109 HydrophobicContact CG2-CD2 3.61Å; V56-E112 HydrophobicContact CG2-CB 4.43Å; V56-K116 HydrophobicContact CG1-CD 4.17Å
57	E	88.3	Confident	85	Confident	59 Å²	59	40 Å²	40	28%	0.276	23%	0.229	S	C	.	.	H	α-helix	trans	-63.3	-43.4	175.1	-176.6	172.6	-174.8	0	0	111.8	C53 E60 N61	C53-E57 PolarHBondContact O-N 3.26Å; E57-E60 PolarHBondContact O-N 3.32Å; E57-N61 WeakPolarHBondContact O-CB 3.23Å; E57-N61 VanDerWaalsContact O-CG 3.29Å; E57-N61 PolarHBondContact O-N 3.2Å; E57-N61 PolarHBondContact O-ND2 3.29Å
58	Y	91.1	Very high	85.4	Confident	9 Å²	9	38.3 Å²	38.3	4%	0.035	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-46.3	174.3	170.5	-116.1	0	0	0	112.2	P37 E38 P39 V54 W55 E60 N61 L62 K92 L93 E96	P37-Y58 HydrophobicContact CB-CD2 4.27Å; P37-Y58 HydrophobicContact CB-CE2 4.27Å; P37-Y58 HydrophobicContact CG-CD2 4.47Å; P37-Y58 HydrophobicContact CG-CE2 4.28Å; P37-Y58 WeakPolarHBondContact O-CE2 3.49Å; E38-Y58 VanDerWaalsContact O-CD2 3.26Å; E38-Y58 WeakPolarHBondContact O-CD2 3.38Å; E38-Y58 VanDerWaalsContact O-CE2 3.3Å; E38-Y58 WeakPolarHBondContact O-CE2 3.44Å; P39-Y58 VanDerWaalsContact CA-CE2 3.48Å; P39-Y58 HydrophobicContact CB-CE1 4.08Å; P39-Y58 HydrophobicContact CB-CE2 4.23Å; V54-Y58 WeakPolarHBondContact O-CB 3.42Å; V54-Y58 PolarHBondContact O-N 3.04Å; W55-Y58 HydrophobicContact CE3-CD1 4.15Å; W55-Y58 HydrophobicContact CZ3-CD1 4.37Å; Y58-E60 PolarHBondContact O-N 2.88Å; Y58-N61 PolarHBondContact O-N 2.99Å; Y58-L62 HydrophobicContact CD1-CD1 3.99Å; Y58-L62 HydrophobicContact CD2-CD1 4.31Å; Y58-L62 HydrophobicContact CD2-CG 4.22Å; Y58-L62 HydrophobicContact CE1-CD1 3.39Å; Y58-L62 HydrophobicContact CE1-CG 4.29Å; Y58-L62 HydrophobicContact CE2-CD1 3.72Å; Y58-L62 HydrophobicContact CE2-CD2 4.2Å; Y58-L62 HydrophobicContact CE2-CG 3.73Å; Y58-L62 HydrophobicContact CG-CD1 4.43Å; Y58-L62 PolarHBondContact O-N 3.44Å; Y58-K92 PolarHBondContact OH-NZ 3.19Å; Y58-L93 HydrophobicContact CD1-CD2 3.49Å; Y58-L93 VanDerWaalsContact CD1-CD2 3.49Å; Y58-L93 HydrophobicContact CE1-CD2 3.52Å; Y58-E96 WeakPolarHBondContact CE1-OE2 3.39Å; Y58-E96 PolarHBondContact OH-OE1 2.9Å
59	A	90.3	Very high	85.7	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.9	-45.5	176.4	0	0	0	0	0	111.9	W55 V56 N61 L62 F63 L93 I113	W55-A59 WeakPolarHBondContact O-CB 3.28Å; W55-A59 PolarHBondContact O-N 2.85Å; V56-A59 PolarHBondContact O-N 3.33Å; A59-N61 VanDerWaalsContact C-N 3.33Å; A59-N61 PolarHBondContact O-N 2.98Å; A59-L62 PolarHBondContact O-N 2.89Å; A59-F63 HydrophobicContact CB-CE2 4.28Å; A59-F63 WeakPolarHBondContact O-CD2 3.47Å; A59-F63 WeakPolarHBondContact O-CG 3.47Å; A59-F63 PolarHBondContact O-N 2.99Å; A59-L93 HydrophobicContact CB-CD1 3.56Å; A59-L93 HydrophobicContact CB-CD2 3.99Å; A59-L93 HydrophobicContact CB-CG 4.45Å; A59-I113 HydrophobicContact CB-CD1 4.17Å; A59-I113 HydrophobicContact CB-CG1 3.84Å
60	E	89.8	Confident	86.3	Confident	62 Å²	62	39.9 Å²	39.9	29%	0.29	20%	0.202	S	C	.	.	H	α-helix	trans	-59	-43.4	175.2	-75.4	-173.3	-171.8	0	0	112.7	V56 E57 Y58 F63 K64 K116	V56-E60 WeakPolarHBondContact O-CG 3.24Å; V56-E60 PolarHBondContact O-N 3.34Å; E57-E60 PolarHBondContact O-N 3.32Å; Y58-E60 PolarHBondContact O-N 2.88Å; E60-F63 PolarHBondContact O-N 2.94Å; E60-K64 WeakPolarHBondContact O-CB 3.15Å; E60-K64 VanDerWaalsContact O-CG 3.28Å; E60-K64 WeakPolarHBondContact O-CG 3.48Å; E60-K64 PolarHBondContact O-N 3.43Å; E60-K64 IonicContact OE2-NZ 2.75Å; E60-K116 HydrophobicContact CG-CD 3.77Å; E60-K116 VanDerWaalsContact OE1-CE 3.24Å; E60-K116 WeakPolarHBondContact OE1-CE 3.39Å; E60-K116 IonicContact OE1-NZ 2.64Å; E60-K116 PolarHBondContact OE1-NZ 3.42Å
61	N	90.1	Very high	86.5	Confident	21 Å²	21	44 Å²	44	11%	0.112	22%	0.216	C	C	.	.	H	α-helix	trans	-66.9	-40.9	179.8	-72.5	-25.2	0	0	0	111.5	P37 E57 Y58 A59 K64 Y65	P37-N61 HydrophobicContact CB-CB 4.21Å; P37-N61 HydrophobicContact CG-CB 4.15Å; E57-N61 WeakPolarHBondContact O-CB 3.23Å; E57-N61 VanDerWaalsContact O-CG 3.29Å; E57-N61 PolarHBondContact O-N 3.2Å; E57-N61 PolarHBondContact O-ND2 3.29Å; Y58-N61 PolarHBondContact O-N 2.99Å; A59-N61 VanDerWaalsContact C-N 3.33Å; A59-N61 PolarHBondContact O-N 2.98Å; N61-K64 PolarHBondContact O-N 3.46Å; N61-Y65 WeakPolarHBondContact O-CB 3.42Å; N61-Y65 PolarHBondContact O-N 3.4Å
62	L	91.2	Very high	86.8	Confident	1 Å²	1	46 Å²	46	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-59.1	-50.3	173.9	-85.2	173.9	0	0	0	111	E36 P37 Y58 A59 K64 Y65 H66 I89 L93	E36-L62 HydrophobicContact CG-CD2 3.94Å; P37-L62 HydrophobicContact CG-CB 4.29Å; P37-L62 HydrophobicContact CG-CD2 3.6Å; P37-L62 HydrophobicContact CG-CG 3.72Å; Y58-L62 HydrophobicContact CD1-CD1 3.99Å; Y58-L62 HydrophobicContact CD2-CD1 4.31Å; Y58-L62 HydrophobicContact CD2-CG 4.22Å; Y58-L62 HydrophobicContact CE1-CD1 3.39Å; Y58-L62 HydrophobicContact CE1-CG 4.29Å; Y58-L62 HydrophobicContact CE2-CD1 3.72Å; Y58-L62 HydrophobicContact CE2-CD2 4.2Å; Y58-L62 HydrophobicContact CE2-CG 3.73Å; Y58-L62 HydrophobicContact CG-CD1 4.43Å; Y58-L62 PolarHBondContact O-N 3.44Å; A59-L62 PolarHBondContact O-N 2.89Å; L62-K64 PolarHBondContact O-N 3.2Å; L62-Y65 PolarHBondContact O-N 2.72Å; L62-H66 PolarHBondContact O-CD2 2.89Å; L62-H66 VanDerWaalsContact O-CD2 3.26Å; L62-H66 PolarHBondContact O-N 3.38Å; L62-I89 HydrophobicContact CB-CG2 4.07Å; L62-I89 HydrophobicContact CD1-CG2 4.21Å; L62-L93 HydrophobicContact CD1-CD2 4.01Å; L62-L93 HydrophobicContact CD1-CG 4.17Å
63	F	90	Very high	86.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60	-47	179.3	-68.1	-50.5	0	0	0	111.8	A59 E60 Y65 H66 I67 F86 I89 V90 L93 I113 R117 L120	A59-F63 HydrophobicContact CB-CE2 4.28Å; A59-F63 WeakPolarHBondContact O-CD2 3.47Å; A59-F63 WeakPolarHBondContact O-CG 3.47Å; A59-F63 PolarHBondContact O-N 2.99Å; E60-F63 PolarHBondContact O-N 2.94Å; F63-Y65 VanDerWaalsContact C-N 3.33Å; F63-Y65 PolarHBondContact O-N 2.68Å; F63-H66 PolarHBondContact O-N 3Å; F63-I67 WeakPolarHBondContact O-CB 3.42Å; F63-I67 WeakPolarHBondContact O-CD1 3.15Å; F63-I67 WeakPolarHBondContact O-CG1 3.46Å; F63-I67 PolarHBondContact O-N 3.05Å; F63-F86 HydrophobicContact CB-CE1 4.16Å; F63-F86 AromaticContact CD1-CD1 3.33Å; F63-F86 HydrophobicContact CD1-CD1 3.33Å; F63-F86 AromaticContact CD1-CE1 3.45Å; F63-F86 HydrophobicContact CD1-CE1 3.45Å; F63-F86 VanDerWaalsContact CD1-CE1 3.45Å; F63-F86 AromaticContact CE1-CD1 3.54Å; F63-F86 HydrophobicContact CE1-CD1 3.54Å; F63-F86 HydrophobicContact CE1-CE1 4.11Å; F63-F86 HydrophobicContact CG-CD1 4.31Å; F63-F86 HydrophobicContact CG-CE1 4.04Å; F63-I89 HydrophobicContact CD1-CB 4.27Å; F63-I89 HydrophobicContact CD1-CD1 3.79Å; F63-I89 HydrophobicContact CD1-CG2 3.73Å; F63-I89 HydrophobicContact CE1-CB 3.88Å; F63-I89 HydrophobicContact CE1-CD1 4.23Å; F63-I89 HydrophobicContact CE1-CG2 3.39Å; F63-I89 HydrophobicContact CZ-CG2 4.02Å; F63-V90 HydrophobicContact CE1-CG2 4.33Å; F63-V90 HydrophobicContact CZ-CG2 4.04Å; F63-L93 HydrophobicContact CZ-CD1 4.31Å; F63-I113 HydrophobicContact CE2-CG2 4.27Å; F63-I113 HydrophobicContact CZ-CG2 4.1Å; F63-R117 HydrophobicContact CZ-CB 4.31Å; F63-L120 HydrophobicContact CB-CD1 3.48Å; F63-L120 VanDerWaalsContact CB-CD1 3.48Å; F63-L120 HydrophobicContact CD2-CD1 3.69Å; F63-L120 HydrophobicContact CG-CD1 3.68Å
64	K	88.4	Confident	85.7	Confident	113 Å²	113	50.3 Å²	50.3	49%	0.491	25%	0.248	S	C	.	.	H	α-helix	trans	-59.3	-43.3	177.9	-73.8	169.2	-171.7	160.5	0	112.2	E60 N61 L62 I67 K68	E60-K64 WeakPolarHBondContact O-CB 3.15Å; E60-K64 VanDerWaalsContact O-CG 3.28Å; E60-K64 WeakPolarHBondContact O-CG 3.48Å; E60-K64 PolarHBondContact O-N 3.43Å; E60-K64 IonicContact OE2-NZ 2.75Å; N61-K64 PolarHBondContact O-N 3.46Å; L62-K64 PolarHBondContact O-N 3.2Å; K64-I67 PolarHBondContact O-N 3.24Å; K64-K68 WeakPolarHBondContact O-CB 3.42Å; K64-K68 PolarHBondContact O-N 3.24Å
65	Y	88.8	Confident	84.4	Confident	32 Å²	32	55.5 Å²	55.5	13%	0.125	27%	0.274	C	S	.	.	H	α-helix	trans	-59.5	-49.7	177.4	171	-105.6	0	0	0	111.7	E36 N61 L62 F63 K68 R69	E36-Y65 HydrophobicContact CB-CD1 4.13Å; E36-Y65 HydrophobicContact CB-CE1 3.54Å; E36-Y65 HydrophobicContact CG-CD1 4.1Å; E36-Y65 HydrophobicContact CG-CE1 3.84Å; E36-Y65 VanDerWaalsContact N-CZ 3.3Å; E36-Y65 PolarHBondContact N-OH 3.33Å; N61-Y65 WeakPolarHBondContact O-CB 3.42Å; N61-Y65 PolarHBondContact O-N 3.4Å; L62-Y65 PolarHBondContact O-N 2.72Å; F63-Y65 VanDerWaalsContact C-N 3.33Å; F63-Y65 PolarHBondContact O-N 2.68Å; Y65-K68 PolarHBondContact O-N 3.04Å; Y65-R69 HydrophobicContact CE2-CG 4.33Å; Y65-R69 WeakPolarHBondContact O-CG 3.25Å; Y65-R69 PolarHBondContact O-N 3.18Å; Y65-R69 VanDerWaalsContact O-N 3.08Å
66	H	86.8	Confident	83	Confident	34 Å²	34	63.3 Å²	63.3	16%	0.157	32%	0.317	C	S	.	.	H	α-helix	trans	-67.8	-37.6	179.1	-78.6	-81.3	0	0	0	112.9	L62 F63 R69 I70 V85 I89	L62-H66 PolarHBondContact O-CD2 2.89Å; L62-H66 VanDerWaalsContact O-CD2 3.26Å; L62-H66 PolarHBondContact O-N 3.38Å; F63-H66 PolarHBondContact O-N 3Å; H66-R69 PolarHBondContact O-N 3.19Å; H66-I70 WeakPolarHBondContact O-CD1 3.3Å; H66-I70 VanDerWaalsContact O-CG1 3.24Å; H66-I70 WeakPolarHBondContact O-CG1 3.3Å; H66-I70 PolarHBondContact O-N 3.26Å; H66-V85 HydrophobicContact CB-CG1 3.83Å; H66-I89 HydrophobicContact CB-CD1 3.7Å; H66-I89 WeakPolarHBondContact CD2-CD1 3.36Å
67	I	85.7	Confident	81.7	Confident	23 Å²	23	67.1 Å²	67.1	12%	0.118	34%	0.341	C	S	.	.	H	α-helix	trans	-61.1	-46.3	174.2	-69.1	167.3	0	0	0	111	F63 K64 R69 I70 K71 F86 L120 L124	F63-I67 WeakPolarHBondContact O-CB 3.42Å; F63-I67 WeakPolarHBondContact O-CD1 3.15Å; F63-I67 WeakPolarHBondContact O-CG1 3.46Å; F63-I67 PolarHBondContact O-N 3.05Å; K64-I67 PolarHBondContact O-N 3.24Å; I67-R69 VanDerWaalsContact C-N 3.32Å; I67-R69 PolarHBondContact O-N 2.73Å; I67-I70 PolarHBondContact O-N 2.68Å; I67-K71 HydrophobicContact CG2-CD 4.27Å; I67-K71 HydrophobicContact CG2-CG 4.49Å; I67-K71 WeakPolarHBondContact O-CG 3.26Å; I67-K71 PolarHBondContact O-N 3.38Å; I67-F86 HydrophobicContact CD1-CE1 4.21Å; I67-F86 HydrophobicContact CD1-CZ 3.72Å; I67-F86 HydrophobicContact CG1-CE1 4.29Å; I67-F86 HydrophobicContact CG1-CE2 4.45Å; I67-F86 HydrophobicContact CG1-CZ 3.59Å; I67-L120 HydrophobicContact CD1-CB 4.5Å; I67-L120 HydrophobicContact CD1-CD1 4.44Å; I67-L120 HydrophobicContact CD1-CD2 4.02Å; I67-L124 HydrophobicContact CD1-CD1 4.2Å; I67-L124 HydrophobicContact CG1-CD1 4.12Å; I67-L124 HydrophobicContact CG2-CD2 3.96Å
68	K	85.6	Confident	80.5	Confident	61 Å²	61	66.2 Å²	66.2	27%	0.265	35%	0.347	S	S	.	.	H	α-helix	trans	-57.2	-47.8	177.3	-176.2	-174	170.6	-161.6	0	110.4	T33 D34 K64 Y65 I70 K71 E72	T33-K68 PolarHBondContact O-NZ 2.97Å; T33-K68 PolarHBondContact OG1-NZ 3.08Å; D34-K68 IonicContact OD1-NZ 2.68Å; D34-K68 PolarHBondContact OD1-NZ 3.41Å; K64-K68 WeakPolarHBondContact O-CB 3.42Å; K64-K68 PolarHBondContact O-N 3.24Å; Y65-K68 PolarHBondContact O-N 3.04Å; K68-I70 PolarHBondContact O-N 3.47Å; K68-K71 PolarHBondContact O-N 2.99Å; K68-E72 WeakPolarHBondContact CE-OE1 3.31Å; K68-E72 WeakPolarHBondContact O-CG 3.42Å; K68-E72 PolarHBondContact O-N 3.4Å
69	R	84.6	Confident	79.4	Confident	126 Å²	126	69.7 Å²	69.7	48%	0.475	36%	0.362	S	S	.	.	H	α-helix	trans	-60.9	-40.3	177.5	-73.2	-175.6	62.6	-165.2	1.1	113.4	Y65 H66 I67 E72 S73	Y65-R69 HydrophobicContact CE2-CG 4.33Å; Y65-R69 WeakPolarHBondContact O-CG 3.25Å; Y65-R69 PolarHBondContact O-N 3.18Å; Y65-R69 VanDerWaalsContact O-N 3.08Å; H66-R69 PolarHBondContact O-N 3.19Å; I67-R69 VanDerWaalsContact C-N 3.32Å; I67-R69 PolarHBondContact O-N 2.73Å; R69-E72 PolarHBondContact O-N 3.11Å; R69-S73 PolarHBondContact O-N 2.92Å; R69-S73 PolarHBondContact O-OG 3.45Å
70	I	81.6	Confident	78.4	Confident	36 Å²	36	78.5 Å²	78.5	19%	0.185	40%	0.4	C	S	.	.	H	α-helix	trans	-66	-40.4	176.6	-68.1	163.2	0	0	0	110.9	H66 I67 K68 E72 S73 R82 V85	H66-I70 WeakPolarHBondContact O-CD1 3.3Å; H66-I70 VanDerWaalsContact O-CG1 3.24Å; H66-I70 WeakPolarHBondContact O-CG1 3.3Å; H66-I70 PolarHBondContact O-N 3.26Å; I67-I70 PolarHBondContact O-N 2.68Å; K68-I70 PolarHBondContact O-N 3.47Å; I70-E72 VanDerWaalsContact C-N 3.3Å; I70-E72 PolarHBondContact O-N 2.92Å; I70-S73 WeakPolarHBondContact CA-OG 3.27Å; I70-S73 PolarHBondContact O-N 3.16Å; I70-S73 PolarHBondContact O-OG 3.49Å; I70-R82 HydrophobicContact CD1-CG 4.35Å; I70-R82 HydrophobicContact CG2-CG 4.17Å; I70-V85 HydrophobicContact CD1-CB 4.25Å; I70-V85 HydrophobicContact CD1-CG1 4.16Å; I70-V85 HydrophobicContact CD1-CG2 4.34Å
71	K	82	Confident	78	Confident	127 Å²	127	78.6 Å²	78.6	55%	0.552	40%	0.403	S	S	*	.	H	α-helix	trans	-66.7	-31.7	176.7	-72	-174	174.9	-166.7	0	112.2	I67 K68 D127	I67-K71 HydrophobicContact CG2-CD 4.27Å; I67-K71 HydrophobicContact CG2-CG 4.49Å; I67-K71 WeakPolarHBondContact O-CG 3.26Å; I67-K71 PolarHBondContact O-N 3.38Å; K68-K71 PolarHBondContact O-N 2.99Å; K71-D127 IonicContact NZ-OD2 3.03Å; K71-D127 PolarHBondContact NZ-OD2 3.2Å
72	E	81.8	Confident	77.6	Confident	124 Å²	124	79.1 Å²	79.1	58%	0.579	40%	0.403	S	S	*	.	H	α-helix	trans	-76.7	-32.6	176.5	-72	170.3	174.3	0	0	113	K68 R69 I70 S74	K68-E72 WeakPolarHBondContact CE-OE1 3.31Å; K68-E72 WeakPolarHBondContact O-CG 3.42Å; K68-E72 PolarHBondContact O-N 3.4Å; R69-E72 PolarHBondContact O-N 3.11Å; I70-E72 VanDerWaalsContact C-N 3.3Å; I70-E72 PolarHBondContact O-N 2.92Å; E72-S74 VanDerWaalsContact C-N 3.31Å; E72-S74 PolarHBondContact O-N 2.89Å
73	S	75.3	Confident	77.3	Confident	66 Å²	66	81.5 Å²	81.5	46%	0.462	42%	0.416	S	S	.	.	S	Bend	trans	-76.2	83.6	172.2	60.3	0	0	0	0	110.2	R69 I70 D75	R69-S73 PolarHBondContact O-N 2.92Å; R69-S73 PolarHBondContact O-OG 3.45Å; I70-S73 WeakPolarHBondContact CA-OG 3.27Å; I70-S73 PolarHBondContact O-N 3.16Å; I70-S73 PolarHBondContact O-OG 3.49Å; S73-D75 PolarHBondContact O-N 3.33Å
74	S	60.3	Low	77.2	Confident	113 Å²	113	87.6 Å²	87.6	79%	0.79	44%	0.443	S	S	*	.			trans	-59.1	51	-178.1	178.3	0	0	0	0	116	E72	E72-S74 VanDerWaalsContact C-N 3.31Å; E72-S74 PolarHBondContact O-N 2.89Å
75	D	63.3	Low	77.2	Confident	132 Å²	132	83.2 Å²	83.2	71%	0.706	43%	0.425	S	S	*	.			trans	-126.2	134.6	174.4	-78.6	-35.8	0	0	0	111.4	S73 T77	S73-D75 PolarHBondContact O-N 3.33Å; D75-T77 PolarHBondContact O-N 3.44Å
76	N	59.7	Low	77.2	Confident	174 Å²	174	81.8 Å²	81.8	93%	0.93	42%	0.42	S	S	*	.	S	Bend	trans	-63.5	23.2	-175.3	-69.9	-59.6	0	0	0	115.6	G78	N76-G78 PolarHBondContact O-N 3.03Å
77	T	62	Low	77.4	Confident	97 Å²	97	81.1 Å²	81.1	60%	0.595	42%	0.422	S	S	*	.			trans	-81.8	48.7	178.3	-43.5	0	0	0	0	110.3	D75 F79 D81	D75-T77 PolarHBondContact O-N 3.44Å; T77-F79 PolarHBondContact O-N 3.38Å; T77-D81 HydrophobicContact CG2-CB 4.28Å; T77-D81 WeakPolarHBondContact O-CB 3.29Å
78	G	63	Low	77.6	Confident	39 Å²	39	85.2 Å²	85.2	40%	0.402	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	19.7	-147.7	0	0	0	0	0	117.9	N76 R82	N76-G78 PolarHBondContact O-N 3.03Å; G78-R82 PolarHBondContact O-NE 3.22Å; G78-R82 PolarHBondContact O-NH2 3.22Å
79	F	66.3	Low	77.9	Confident	83 Å²	83	82.6 Å²	82.6	36%	0.364	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.1	-50.5	173.8	-165	-98.2	0	0	0	113.6	T77 D81 R82 D83 Q125	T77-F79 PolarHBondContact O-N 3.38Å; F79-D81 PolarHBondContact O-N 2.95Å; F79-R82 WeakPolarHBondContact O-CB 3.45Å; F79-R82 PolarHBondContact O-N 2.87Å; F79-D83 WeakPolarHBondContact CD1-OD2 3.34Å; F79-D83 WeakPolarHBondContact CE1-OD2 3.21Å; F79-D83 PolarHBondContact O-N 2.9Å; F79-Q125 HydrophobicContact CE2-CG 4.23Å
80	K	71.1	Confident	78.3	Confident	185 Å²	185	77.1 Å²	77.1	80%	0.804	41%	0.41	S	S	*	.	H	α-helix	trans	-60.3	-34.9	177.8	-68.9	-175.8	178.7	178.9	0	112.5	K84	K80-K84 WeakPolarHBondContact O-CB 3Å; K80-K84 PolarHBondContact O-N 3.25Å
81	D	81	Confident	78.9	Confident	64 Å²	64	79.6 Å²	79.6	34%	0.342	42%	0.424	S	S	.	.	H	α-helix	trans	-69.2	-41.4	176.6	-163.6	58.9	0	0	0	111	T77 F79 K84 V85	T77-D81 HydrophobicContact CG2-CB 4.28Å; T77-D81 WeakPolarHBondContact O-CB 3.29Å; F79-D81 PolarHBondContact O-N 2.95Å; D81-K84 PolarHBondContact O-N 3.02Å; D81-V85 VanDerWaalsContact O-CG2 3.27Å; D81-V85 WeakPolarHBondContact O-CG2 3.08Å; D81-V85 PolarHBondContact O-N 2.96Å
82	R	81.4	Confident	79.4	Confident	31 Å²	31	76.8 Å²	76.8	12%	0.117	41%	0.411	C	S	.	.	H	α-helix	trans	-57.8	-57.2	176	-60.9	-166.3	-85	-175	-2.2	111	I70 G78 F79 K84 V85 F86 L124	I70-R82 HydrophobicContact CD1-CG 4.35Å; I70-R82 HydrophobicContact CG2-CG 4.17Å; G78-R82 PolarHBondContact O-NE 3.22Å; G78-R82 PolarHBondContact O-NH2 3.22Å; F79-R82 WeakPolarHBondContact O-CB 3.45Å; F79-R82 PolarHBondContact O-N 2.87Å; R82-K84 PolarHBondContact O-N 2.96Å; R82-V85 PolarHBondContact O-N 3.07Å; R82-V85 VanDerWaalsContact O-N 3.11Å; R82-F86 HydrophobicContact CB-CD2 4.32Å; R82-F86 HydrophobicContact CB-CE2 4.31Å; R82-F86 WeakPolarHBondContact O-CD2 3.41Å; R82-F86 PolarHBondContact O-N 3.48Å; R82-L124 PolarHBondContact NH1-O 3.32Å
83	D	84.7	Confident	79.9	Confident	51 Å²	51	70.9 Å²	70.9	27%	0.273	38%	0.384	S	S	.	.	H	α-helix	trans	-56.2	-39.5	-179	-76.4	-30.4	0	0	0	112.5	F79 G87	F79-D83 WeakPolarHBondContact CD1-OD2 3.34Å; F79-D83 WeakPolarHBondContact CE1-OD2 3.21Å; F79-D83 PolarHBondContact O-N 2.9Å; D83-G87 PolarHBondContact O-N 3.02Å
84	K	87.9	Confident	80.7	Confident	129 Å²	129	70.6 Å²	70.6	56%	0.561	38%	0.375	S	S	*	.	H	α-helix	trans	-64.8	-48.8	177.1	-173.9	-173.5	174.2	-159.5	0	111.3	K80 D81 R82 F86 G87 E88	K80-K84 WeakPolarHBondContact O-CB 3Å; K80-K84 PolarHBondContact O-N 3.25Å; D81-K84 PolarHBondContact O-N 3.02Å; R82-K84 PolarHBondContact O-N 2.96Å; K84-F86 PolarHBondContact O-N 2.64Å; K84-G87 PolarHBondContact O-N 2.91Å; K84-G87 VanDerWaalsContact O-N 3.16Å; K84-E88 VanDerWaalsContact CE-OE1 3.29Å; K84-E88 WeakPolarHBondContact CE-OE1 3.34Å; K84-E88 WeakPolarHBondContact O-CG 3.38Å; K84-E88 PolarHBondContact O-N 3.12Å
85	V	88	Confident	82.2	Confident	20 Å²	20	72.6 Å²	72.6	12%	0.121	37%	0.369	C	S	.	.	H	α-helix	trans	-60.8	-45.5	177.6	172.1	0	0	0	0	110.9	H66 I70 D81 R82 G87 E88 I89	H66-V85 HydrophobicContact CB-CG1 3.83Å; I70-V85 HydrophobicContact CD1-CB 4.25Å; I70-V85 HydrophobicContact CD1-CG1 4.16Å; I70-V85 HydrophobicContact CD1-CG2 4.34Å; D81-V85 VanDerWaalsContact O-CG2 3.27Å; D81-V85 WeakPolarHBondContact O-CG2 3.08Å; D81-V85 PolarHBondContact O-N 2.96Å; R82-V85 PolarHBondContact O-N 3.07Å; R82-V85 VanDerWaalsContact O-N 3.11Å; V85-G87 VanDerWaalsContact C-N 3.3Å; V85-G87 PolarHBondContact O-N 3.2Å; V85-E88 PolarHBondContact O-N 2.97Å; V85-I89 HydrophobicContact CG1-CD1 4.01Å; V85-I89 VanDerWaalsContact O-CG1 3.31Å; V85-I89 WeakPolarHBondContact O-CG1 3.48Å; V85-I89 PolarHBondContact O-N 3.42Å
86	F	89.8	Confident	83.4	Confident	3 Å²	3	68.2 Å²	68.2	1%	0.013	35%	0.345	C	S	.	.	H	α-helix	trans	-60.4	-40.4	174.8	-78.9	-72.4	0	0	0	112.1	F63 I67 R82 K84 I89 V90 R117 L120 L121 L124	F63-F86 HydrophobicContact CB-CE1 4.16Å; F63-F86 AromaticContact CD1-CD1 3.33Å; F63-F86 HydrophobicContact CD1-CD1 3.33Å; F63-F86 AromaticContact CD1-CE1 3.45Å; F63-F86 HydrophobicContact CD1-CE1 3.45Å; F63-F86 VanDerWaalsContact CD1-CE1 3.45Å; F63-F86 AromaticContact CE1-CD1 3.54Å; F63-F86 HydrophobicContact CE1-CD1 3.54Å; F63-F86 HydrophobicContact CE1-CE1 4.11Å; F63-F86 HydrophobicContact CG-CD1 4.31Å; F63-F86 HydrophobicContact CG-CE1 4.04Å; I67-F86 HydrophobicContact CD1-CE1 4.21Å; I67-F86 HydrophobicContact CD1-CZ 3.72Å; I67-F86 HydrophobicContact CG1-CE1 4.29Å; I67-F86 HydrophobicContact CG1-CE2 4.45Å; I67-F86 HydrophobicContact CG1-CZ 3.59Å; R82-F86 HydrophobicContact CB-CD2 4.32Å; R82-F86 HydrophobicContact CB-CE2 4.31Å; R82-F86 WeakPolarHBondContact O-CD2 3.41Å; R82-F86 PolarHBondContact O-N 3.48Å; K84-F86 PolarHBondContact O-N 2.64Å; F86-I89 PolarHBondContact O-N 3.07Å; F86-V90 WeakPolarHBondContact O-CG2 3.35Å; F86-V90 PolarHBondContact O-N 3.22Å; F86-R117 HydrophobicContact CB-CG 4.44Å; F86-R117 HydrophobicContact CD1-CG 4.43Å; F86-L120 HydrophobicContact CE1-CB 4.35Å; F86-L120 HydrophobicContact CE1-CD1 4.35Å; F86-L120 HydrophobicContact CZ-CB 4.44Å; F86-L121 HydrophobicContact CD2-CD2 3.61Å; F86-L121 HydrophobicContact CD2-CG 4.48Å; F86-L121 HydrophobicContact CE2-CD2 3.8Å; F86-L121 HydrophobicContact CG-CD2 4.33Å; F86-L124 HydrophobicContact CE2-CD1 3.6Å; F86-L124 HydrophobicContact CZ-CD1 3.66Å
87	G	90.3	Very high	84.9	Confident	20 Å²	20	59.9 Å²	59.9	21%	0.206	30%	0.3	C	S	.	.	H	α-helix	trans	-61.6	-42.6	174.3	0	0	0	0	0	112.8	D83 K84 V85 V90 N91	D83-G87 PolarHBondContact O-N 3.02Å; K84-G87 PolarHBondContact O-N 2.91Å; K84-G87 VanDerWaalsContact O-N 3.16Å; V85-G87 VanDerWaalsContact C-N 3.3Å; V85-G87 PolarHBondContact O-N 3.2Å; G87-V90 PolarHBondContact O-N 3.24Å; G87-N91 WeakPolarHBondContact O-CB 2.97Å; G87-N91 PolarHBondContact O-N 3Å; G87-N91 PolarHBondContact O-ND2 2.73Å; G87-N91 VanDerWaalsContact O-ND2 3.13Å
88	E	91	Very high	86.2	Confident	108 Å²	108	59.6 Å²	59.6	51%	0.505	30%	0.295	S	S	.	.	H	α-helix	trans	-62.8	-42.3	175.7	-71.6	173.9	-173	0	0	112	K84 V85 N91 K92	K84-E88 VanDerWaalsContact CE-OE1 3.29Å; K84-E88 WeakPolarHBondContact CE-OE1 3.34Å; K84-E88 WeakPolarHBondContact O-CG 3.38Å; K84-E88 PolarHBondContact O-N 3.12Å; V85-E88 PolarHBondContact O-N 2.97Å; E88-N91 PolarHBondContact O-N 3.12Å; E88-K92 PolarHBondContact O-N 3.16Å
89	I	91.6	Very high	87.4	Confident	6 Å²	6	62.9 Å²	62.9	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-62.5	-47.8	176	-65.4	164	0	0	0	111	L62 F63 H66 V85 F86 N91 K92 L93	L62-I89 HydrophobicContact CB-CG2 4.07Å; L62-I89 HydrophobicContact CD1-CG2 4.21Å; F63-I89 HydrophobicContact CD1-CB 4.27Å; F63-I89 HydrophobicContact CD1-CD1 3.79Å; F63-I89 HydrophobicContact CD1-CG2 3.73Å; F63-I89 HydrophobicContact CE1-CB 3.88Å; F63-I89 HydrophobicContact CE1-CD1 4.23Å; F63-I89 HydrophobicContact CE1-CG2 3.39Å; F63-I89 HydrophobicContact CZ-CG2 4.02Å; H66-I89 HydrophobicContact CB-CD1 3.7Å; H66-I89 WeakPolarHBondContact CD2-CD1 3.36Å; V85-I89 HydrophobicContact CG1-CD1 4.01Å; V85-I89 VanDerWaalsContact O-CG1 3.31Å; V85-I89 WeakPolarHBondContact O-CG1 3.48Å; V85-I89 PolarHBondContact O-N 3.42Å; F86-I89 PolarHBondContact O-N 3.07Å; I89-N91 VanDerWaalsContact C-N 3.31Å; I89-N91 PolarHBondContact O-N 2.89Å; I89-K92 WeakPolarHBondContact O-CB 3.4Å; I89-K92 PolarHBondContact O-N 3.4Å; I89-L93 HydrophobicContact CG2-CD1 3.84Å; I89-L93 HydrophobicContact CG2-CG 4.46Å; I89-L93 WeakPolarHBondContact O-CG 3.24Å; I89-L93 PolarHBondContact O-N 2.91Å
90	V	92.6	Very high	88.4	Confident	11 Å²	11	59.4 Å²	59.4	7%	0.067	29%	0.285	C	S	.	.	H	α-helix	trans	-62	-41.5	178	171.4	0	0	0	0	110.8	F63 F86 G87 K92 L93 Q94 I113	F63-V90 HydrophobicContact CE1-CG2 4.33Å; F63-V90 HydrophobicContact CZ-CG2 4.04Å; F86-V90 WeakPolarHBondContact O-CG2 3.35Å; F86-V90 PolarHBondContact O-N 3.22Å; G87-V90 PolarHBondContact O-N 3.24Å; V90-K92 VanDerWaalsContact C-N 3.32Å; V90-K92 PolarHBondContact O-N 2.78Å; V90-L93 PolarHBondContact O-N 3.31Å; V90-Q94 HydrophobicContact CG1-CG 4.21Å; V90-Q94 WeakPolarHBondContact O-CB 3.36Å; V90-Q94 VanDerWaalsContact O-CG 3.26Å; V90-Q94 WeakPolarHBondContact O-CG 3.31Å; V90-Q94 PolarHBondContact O-N 3.42Å; V90-I113 HydrophobicContact CG2-CG2 4.14Å
91	N	93.5	Very high	89.1	Confident	89 Å²	89	58.4 Å²	58.4	48%	0.476	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-38.1	176	-72.7	-28	0	0	0	112.3	G87 E88 I89 K95	G87-N91 WeakPolarHBondContact O-CB 2.97Å; G87-N91 PolarHBondContact O-N 3Å; G87-N91 PolarHBondContact O-ND2 2.73Å; G87-N91 VanDerWaalsContact O-ND2 3.13Å; E88-N91 PolarHBondContact O-N 3.12Å; I89-N91 VanDerWaalsContact C-N 3.31Å; I89-N91 PolarHBondContact O-N 2.89Å; N91-K95 WeakPolarHBondContact O-CG 3.09Å; N91-K95 PolarHBondContact O-N 3.38Å
92	K	92.7	Very high	89.4	Confident	67 Å²	67	58.4 Å²	58.4	29%	0.291	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-51.6	174	-173.7	-172.6	-178.7	-167.4	0	110.6	E36 Y58 E88 I89 V90 Q94 K95 E96	E36-K92 IonicContact OE1-NZ 3.55Å; E36-K92 PolarHBondContact OE1-NZ 2.93Å; Y58-K92 PolarHBondContact OH-NZ 3.19Å; E88-K92 PolarHBondContact O-N 3.16Å; I89-K92 WeakPolarHBondContact O-CB 3.4Å; I89-K92 PolarHBondContact O-N 3.4Å; V90-K92 VanDerWaalsContact C-N 3.32Å; V90-K92 PolarHBondContact O-N 2.78Å; K92-Q94 VanDerWaalsContact C-N 3.33Å; K92-Q94 PolarHBondContact O-N 3.13Å; K92-K95 WeakPolarHBondContact O-CB 3.35Å; K92-K95 PolarHBondContact O-N 3.36Å; K92-K95 VanDerWaalsContact O-N 3.14Å; K92-E96 PolarHBondContact O-N 3.49Å
93	L	91.6	Very high	89.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-58.9	-42.6	177.9	-74.5	165.9	0	0	0	112.1	Y58 A59 L62 F63 I89 V90 K95 E96 I97 I113	Y58-L93 HydrophobicContact CD1-CD2 3.49Å; Y58-L93 VanDerWaalsContact CD1-CD2 3.49Å; Y58-L93 HydrophobicContact CE1-CD2 3.52Å; A59-L93 HydrophobicContact CB-CD1 3.56Å; A59-L93 HydrophobicContact CB-CD2 3.99Å; A59-L93 HydrophobicContact CB-CG 4.45Å; L62-L93 HydrophobicContact CD1-CD2 4.01Å; L62-L93 HydrophobicContact CD1-CG 4.17Å; F63-L93 HydrophobicContact CZ-CD1 4.31Å; I89-L93 HydrophobicContact CG2-CD1 3.84Å; I89-L93 HydrophobicContact CG2-CG 4.46Å; I89-L93 WeakPolarHBondContact O-CG 3.24Å; I89-L93 PolarHBondContact O-N 2.91Å; V90-L93 PolarHBondContact O-N 3.31Å; L93-K95 VanDerWaalsContact C-N 3.33Å; L93-K95 PolarHBondContact O-N 3.18Å; L93-E96 PolarHBondContact O-N 3.38Å; L93-I97 HydrophobicContact CB-CD1 4.31Å; L93-I97 VanDerWaalsContact O-CB 3.31Å; L93-I97 WeakPolarHBondContact O-CB 3.3Å; L93-I97 VanDerWaalsContact O-CG1 3.29Å; L93-I97 WeakPolarHBondContact O-CG1 3.47Å; L93-I97 PolarHBondContact O-N 2.93Å; L93-I113 HydrophobicContact CB-CD1 4.24Å; L93-I113 HydrophobicContact CD1-CD1 4.13Å; L93-I113 HydrophobicContact CD1-CG2 3.96Å; L93-I113 HydrophobicContact CD2-CD1 4.49Å
94	Q	92.6	Very high	90	Very high	59 Å²	59	66 Å²	66	28%	0.276	32%	0.323	S	S	.	.	H	α-helix	trans	-58	-44	175.7	-80.7	175.7	-5.2	0	0	111.7	V90 K92 E96 N98 L110	V90-Q94 HydrophobicContact CG1-CG 4.21Å; V90-Q94 WeakPolarHBondContact O-CB 3.36Å; V90-Q94 VanDerWaalsContact O-CG 3.26Å; V90-Q94 WeakPolarHBondContact O-CG 3.31Å; V90-Q94 PolarHBondContact O-N 3.42Å; K92-Q94 VanDerWaalsContact C-N 3.33Å; K92-Q94 PolarHBondContact O-N 3.13Å; Q94-E96 VanDerWaalsContact C-N 3.31Å; Q94-E96 PolarHBondContact O-N 3.2Å; Q94-N98 WeakPolarHBondContact O-CB 3.42Å; Q94-N98 PolarHBondContact O-N 2.94Å; Q94-N98 PolarHBondContact O-ND2 3.43Å; Q94-N98 VanDerWaalsContact O-ND2 3.08Å; Q94-L110 HydrophobicContact CB-CD2 4.44Å; Q94-L110 HydrophobicContact CG-CD2 3.58Å
95	K	92	Very high	90	Very high	155 Å²	155	60.2 Å²	60.2	67%	0.674	30%	0.298	S	S	*	.	H	α-helix	trans	-62.2	-38.9	177.8	-73.2	174.9	-178	178.2	0	112.4	N91 K92 L93 Q99	N91-K95 WeakPolarHBondContact O-CG 3.09Å; N91-K95 PolarHBondContact O-N 3.38Å; K92-K95 WeakPolarHBondContact O-CB 3.35Å; K92-K95 PolarHBondContact O-N 3.36Å; K92-K95 VanDerWaalsContact O-N 3.14Å; L93-K95 VanDerWaalsContact C-N 3.33Å; L93-K95 PolarHBondContact O-N 3.18Å; K95-Q99 WeakPolarHBondContact O-CG 3.47Å
96	E	89.5	Confident	90.2	Very high	40 Å²	40	62 Å²	62	19%	0.187	30%	0.302	C	S	.	.	H	α-helix	trans	-73.3	-47.1	179.2	-66.4	173.4	-168	0	0	111.4	P39 W55 Y58 K92 L93 Q94 N98 Q99	P39-E96 WeakPolarHBondContact CB-OE2 3.45Å; W55-E96 HydrophobicContact CH2-CB 4.14Å; W55-E96 HydrophobicContact CZ3-CB 3.86Å; W55-E96 WeakPolarHBondContact CZ3-OE2 3.36Å; Y58-E96 WeakPolarHBondContact CE1-OE2 3.39Å; Y58-E96 PolarHBondContact OH-OE1 2.9Å; K92-E96 PolarHBondContact O-N 3.49Å; L93-E96 PolarHBondContact O-N 3.38Å; Q94-E96 VanDerWaalsContact C-N 3.31Å; Q94-E96 PolarHBondContact O-N 3.2Å; E96-N98 PolarHBondContact O-N 3.42Å; E96-Q99 VanDerWaalsContact O-CB 3.24Å; E96-Q99 WeakPolarHBondContact O-CB 3.43Å; E96-Q99 WeakPolarHBondContact O-CG 3.43Å; E96-Q99 PolarHBondContact O-N 2.97Å
97	I	89.8	Confident	90.2	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-68.8	-33.6	-179.6	-69.4	166.2	0	0	0	111.8	W55 L93 Q99 I100 R106 L109 L110 I113	W55-I97 HydrophobicContact CD2-CG1 4.43Å; W55-I97 HydrophobicContact CE3-CG1 4.47Å; L93-I97 HydrophobicContact CB-CD1 4.31Å; L93-I97 VanDerWaalsContact O-CB 3.31Å; L93-I97 WeakPolarHBondContact O-CB 3.3Å; L93-I97 VanDerWaalsContact O-CG1 3.29Å; L93-I97 WeakPolarHBondContact O-CG1 3.47Å; L93-I97 PolarHBondContact O-N 2.93Å; I97-Q99 PolarHBondContact O-N 3.36Å; I97-I100 HydrophobicContact CG2-CD1 4.2Å; I97-I100 VanDerWaalsContact O-CB 3.3Å; I97-I100 WeakPolarHBondContact O-CB 3.36Å; I97-I100 WeakPolarHBondContact O-CG1 3.49Å; I97-I100 PolarHBondContact O-N 2.96Å; I97-R106 HydrophobicContact CG2-CB 4.33Å; I97-R106 HydrophobicContact CG2-CG 4.22Å; I97-R106 WeakPolarHBondContact O-CD 3.49Å; I97-R106 WeakPolarHBondContact O-CG 3.46Å; I97-L109 HydrophobicContact CD1-CB 4.11Å; I97-L109 HydrophobicContact CG1-CD1 4.45Å; I97-L109 HydrophobicContact CG2-CB 4.12Å; I97-L109 HydrophobicContact CG2-CD1 4.21Å; I97-L110 HydrophobicContact CD1-CD2 4.37Å; I97-L110 HydrophobicContact CG2-CD2 4.25Å; I97-L110 HydrophobicContact CG2-CG 4.21Å; I97-I113 HydrophobicContact CD1-CD1 3.18Å
98	N	89.6	Confident	90.3	Very high	91 Å²	91	68.9 Å²	68.9	49%	0.487	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-12.1	175.4	-79.5	-22.6	0	0	0	113.5	Q94 E96	Q94-N98 WeakPolarHBondContact O-CB 3.42Å; Q94-N98 PolarHBondContact O-N 2.94Å; Q94-N98 PolarHBondContact O-ND2 3.43Å; Q94-N98 VanDerWaalsContact O-ND2 3.08Å; E96-N98 PolarHBondContact O-N 3.42Å
99	Q	87.9	Confident	90.2	Very high	107 Å²	107	63.8 Å²	63.8	50%	0.5	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-15.6	175.2	-56.1	-70.8	-47.7	0	0	114.7	R42 K95 E96 I97	R42-Q99 VanDerWaalsContact NH1-CB 3.31Å; R42-Q99 PolarHBondContact NH1-O 3.3Å; K95-Q99 WeakPolarHBondContact O-CG 3.47Å; E96-Q99 VanDerWaalsContact O-CB 3.24Å; E96-Q99 WeakPolarHBondContact O-CB 3.43Å; E96-Q99 WeakPolarHBondContact O-CG 3.43Å; E96-Q99 PolarHBondContact O-N 2.97Å; I97-Q99 PolarHBondContact O-N 3.36Å
100	I	87.1	Confident	90.3	Very high	10 Å²	10	65.3 Å²	65.3	5%	0.051	31%	0.314	C	S	.	.			trans	-65.8	136	176	-66.2	173.4	0	0	0	108.7	W55 I97 L105 R106 L109	W55-I100 HydrophobicContact CG-CD1 4.44Å; I97-I100 HydrophobicContact CG2-CD1 4.2Å; I97-I100 VanDerWaalsContact O-CB 3.3Å; I97-I100 WeakPolarHBondContact O-CB 3.36Å; I97-I100 WeakPolarHBondContact O-CG1 3.49Å; I97-I100 PolarHBondContact O-N 2.96Å; I100-L105 HydrophobicContact CD1-CD2 4.43Å; I100-L105 HydrophobicContact CG2-CB 4.32Å; I100-L105 HydrophobicContact CG2-CD2 3.69Å; I100-L105 HydrophobicContact CG2-CG 4.28Å; I100-R106 HydrophobicContact CB-CG 3.96Å; I100-R106 HydrophobicContact CG2-CG 4.22Å; I100-R106 WeakPolarHBondContact O-CD 3.19Å; I100-R106 PolarHBondContact O-NH1 3.29Å; I100-L109 HydrophobicContact CD1-CD1 3.45Å; I100-L109 VanDerWaalsContact CD1-CD1 3.45Å
101	E	86.4	Confident	90.2	Very high	165 Å²	165	67.8 Å²	67.8	77%	0.771	33%	0.329	S	S	*	.	S	Bend	trans	-71.1	-41.5	-174.9	-64.2	-175.5	-177.3	0	0	112.8	Q103 R106	E101-Q103 PolarHBondContact O-N 3.42Å; E101-R106 VanDerWaalsContact C-NH1 3.28Å; E101-R106 PolarHBondContact O-NH1 3.19Å
102	D	87	Confident	90.1	Very high	63 Å²	63	66.3 Å²	66.3	34%	0.337	32%	0.32	S	S	.	.			trans	-72.6	119.7	-177.1	-172.6	-74.7	0	0	0	112.8	N104 L105 R106	D102-N104 WeakPolarHBondContact OD1-CA 3.42Å; D102-N104 WeakPolarHBondContact OD1-CB 3.43Å; D102-N104 PolarHBondContact OD1-N 2.97Å; D102-L105 HydrophobicContact CB-CB 3.92Å; D102-L105 PolarHBondContact O-N 3.27Å; D102-L105 PolarHBondContact OD1-N 3.28Å; D102-R106 WeakPolarHBondContact O-CG 3.33Å; D102-R106 PolarHBondContact O-N 3.49Å
103	Q	90.7	Very high	90	Very high	124 Å²	124	63.2 Å²	63.2	58%	0.579	31%	0.306	S	S	*	.	H	α-helix	trans	-66.2	-39.1	-179.2	179.3	171.2	-2	0	0	113.2	E101 L105 R106 I107	E101-Q103 PolarHBondContact O-N 3.42Å; Q103-L105 VanDerWaalsContact C-N 3.31Å; Q103-R106 PolarHBondContact O-N 3Å; Q103-I107 HydrophobicContact CG-CD1 3.89Å; Q103-I107 HydrophobicContact CG-CG1 4.48Å; Q103-I107 VanDerWaalsContact O-CG1 3.29Å; Q103-I107 WeakPolarHBondContact O-CG1 3.42Å; Q103-I107 PolarHBondContact O-N 3.35Å
104	N	89.3	Confident	90	Very high	119 Å²	119	67.6 Å²	67.6	64%	0.636	33%	0.327	S	S	*	.	H	α-helix	trans	-68.1	-38.3	-178.3	-61.8	-41.7	0	0	0	110.2	D102 I107 F108	D102-N104 WeakPolarHBondContact OD1-CA 3.42Å; D102-N104 WeakPolarHBondContact OD1-CB 3.43Å; D102-N104 PolarHBondContact OD1-N 2.97Å; N104-I107 PolarHBondContact O-N 3.48Å; N104-F108 VanDerWaalsContact O-CB 3.3Å; N104-F108 WeakPolarHBondContact O-CB 3.43Å; N104-F108 PolarHBondContact O-N 3.04Å
105	L	87.9	Confident	90	Very high	7 Å²	7	67.6 Å²	67.6	4%	0.037	33%	0.328	C	S	.	.	H	α-helix	trans	-65.1	-44.8	174.6	-171.2	65.3	0	0	0	111	E47 I100 D102 Q103 I107 F108 L109	E47-L105 HydrophobicContact CB-CD2 4.11Å; E47-L105 HydrophobicContact CG-CD2 4.09Å; I100-L105 HydrophobicContact CD1-CD2 4.43Å; I100-L105 HydrophobicContact CG2-CB 4.32Å; I100-L105 HydrophobicContact CG2-CD2 3.69Å; I100-L105 HydrophobicContact CG2-CG 4.28Å; D102-L105 HydrophobicContact CB-CB 3.92Å; D102-L105 PolarHBondContact O-N 3.27Å; D102-L105 PolarHBondContact OD1-N 3.28Å; Q103-L105 VanDerWaalsContact C-N 3.31Å; L105-I107 VanDerWaalsContact C-N 3.34Å; L105-I107 PolarHBondContact O-N 2.99Å; L105-F108 HydrophobicContact CD1-CD1 4.44Å; L105-F108 PolarHBondContact O-N 3.48Å; L105-L109 HydrophobicContact CD1-CD1 4.36Å; L105-L109 HydrophobicContact CD1-CG 4.3Å; L105-L109 HydrophobicContact CG-CD1 3.94Å; L105-L109 HydrophobicContact CG-CG 4.28Å; L105-L109 WeakPolarHBondContact O-CB 3.24Å; L105-L109 WeakPolarHBondContact O-CG 3.43Å; L105-L109 PolarHBondContact O-N 2.87Å
106	R	90.9	Very high	89.9	Confident	57 Å²	57	62.3 Å²	62.3	22%	0.215	31%	0.305	C	S	.	.	H	α-helix	trans	-56.3	-49.4	174.2	-71.7	-164.3	-56.3	-82	0.1	111.5	I97 I100 E101 D102 Q103 L109 L110	I97-R106 HydrophobicContact CG2-CB 4.33Å; I97-R106 HydrophobicContact CG2-CG 4.22Å; I97-R106 WeakPolarHBondContact O-CD 3.49Å; I97-R106 WeakPolarHBondContact O-CG 3.46Å; I100-R106 HydrophobicContact CB-CG 3.96Å; I100-R106 HydrophobicContact CG2-CG 4.22Å; I100-R106 WeakPolarHBondContact O-CD 3.19Å; I100-R106 PolarHBondContact O-NH1 3.29Å; E101-R106 VanDerWaalsContact C-NH1 3.28Å; E101-R106 PolarHBondContact O-NH1 3.19Å; D102-R106 WeakPolarHBondContact O-CG 3.33Å; D102-R106 PolarHBondContact O-N 3.49Å; Q103-R106 PolarHBondContact O-N 3Å; R106-L109 PolarHBondContact O-N 3.42Å; R106-L110 WeakPolarHBondContact O-CB 3.1Å; R106-L110 WeakPolarHBondContact O-CG 3.29Å; R106-L110 PolarHBondContact O-N 2.85Å
107	I	90.9	Very high	90	Very high	91 Å²	91	64.2 Å²	64.2	47%	0.467	31%	0.31	S	S	.	.	H	α-helix	trans	-59.9	-49.7	179.2	-67.7	166.4	0	0	0	110.2	Q103 N104 L105 L109 L110 T111	Q103-I107 HydrophobicContact CG-CD1 3.89Å; Q103-I107 HydrophobicContact CG-CG1 4.48Å; Q103-I107 VanDerWaalsContact O-CG1 3.29Å; Q103-I107 WeakPolarHBondContact O-CG1 3.42Å; Q103-I107 PolarHBondContact O-N 3.35Å; N104-I107 PolarHBondContact O-N 3.48Å; L105-I107 VanDerWaalsContact C-N 3.34Å; L105-I107 PolarHBondContact O-N 2.99Å; I107-L109 PolarHBondContact O-N 3.2Å; I107-L110 PolarHBondContact O-N 3.08Å; I107-T111 WeakPolarHBondContact O-CB 3.35Å; I107-T111 PolarHBondContact O-N 3.41Å; I107-T111 PolarHBondContact O-OG1 2.82Å; I107-T111 VanDerWaalsContact O-OG1 3.06Å
108	F	91.1	Very high	90	Very high	77 Å²	77	69.9 Å²	69.9	34%	0.338	34%	0.337	S	S	.	.	H	α-helix	trans	-56	-48.9	178.6	172.7	-102.4	0	0	0	112.2	N104 L105 T111 E112	N104-F108 VanDerWaalsContact O-CB 3.3Å; N104-F108 WeakPolarHBondContact O-CB 3.43Å; N104-F108 PolarHBondContact O-N 3.04Å; L105-F108 HydrophobicContact CD1-CD1 4.44Å; L105-F108 PolarHBondContact O-N 3.48Å; F108-T111 PolarHBondContact O-N 3.14Å; F108-E112 HydrophobicContact CD2-CG 4.24Å; F108-E112 HydrophobicContact CE1-CG 4.12Å; F108-E112 HydrophobicContact CE2-CG 3.76Å; F108-E112 HydrophobicContact CZ-CG 3.69Å; F108-E112 WeakPolarHBondContact O-CB 3.31Å; F108-E112 WeakPolarHBondContact O-CG 3.41Å; F108-E112 PolarHBondContact O-N 3.18Å
109	L	90.4	Very high	90.1	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-64.7	-42.8	-178.9	-67.5	175.2	0	0	0	112.4	C53 W55 V56 I97 I100 L105 R106 I107 E112 I113	C53-L109 HydrophobicContact CB-CD2 4.07Å; C53-L109 WeakPolarHBondContact SG-CD2 3.37Å; W55-L109 HydrophobicContact CB-CD1 4.05Å; W55-L109 HydrophobicContact CB-CD2 4.16Å; W55-L109 HydrophobicContact CG-CD1 4.12Å; V56-L109 HydrophobicContact CG2-CD2 3.61Å; I97-L109 HydrophobicContact CD1-CB 4.11Å; I97-L109 HydrophobicContact CG1-CD1 4.45Å; I97-L109 HydrophobicContact CG2-CB 4.12Å; I97-L109 HydrophobicContact CG2-CD1 4.21Å; I100-L109 HydrophobicContact CD1-CD1 3.45Å; I100-L109 VanDerWaalsContact CD1-CD1 3.45Å; L105-L109 HydrophobicContact CD1-CD1 4.36Å; L105-L109 HydrophobicContact CD1-CG 4.3Å; L105-L109 HydrophobicContact CG-CD1 3.94Å; L105-L109 HydrophobicContact CG-CG 4.28Å; L105-L109 WeakPolarHBondContact O-CB 3.24Å; L105-L109 WeakPolarHBondContact O-CG 3.43Å; L105-L109 PolarHBondContact O-N 2.87Å; R106-L109 PolarHBondContact O-N 3.42Å; I107-L109 PolarHBondContact O-N 3.2Å; L109-E112 PolarHBondContact O-N 3.21Å; L109-I113 WeakPolarHBondContact O-CB 3.48Å; L109-I113 WeakPolarHBondContact O-CD1 3.26Å; L109-I113 WeakPolarHBondContact O-CG1 3.48Å; L109-I113 PolarHBondContact O-N 3.13Å
110	L	91.8	Very high	90.1	Very high	38 Å²	38	68.8 Å²	68.8	20%	0.199	33%	0.328	C	S	.	.	H	α-helix	trans	-63.7	-44.9	177.9	-69.1	176.3	0	0	0	111.3	Q94 I97 R106 I107 I113 E114	Q94-L110 HydrophobicContact CB-CD2 4.44Å; Q94-L110 HydrophobicContact CG-CD2 3.58Å; I97-L110 HydrophobicContact CD1-CD2 4.37Å; I97-L110 HydrophobicContact CG2-CD2 4.25Å; I97-L110 HydrophobicContact CG2-CG 4.21Å; R106-L110 WeakPolarHBondContact O-CB 3.1Å; R106-L110 WeakPolarHBondContact O-CG 3.29Å; R106-L110 PolarHBondContact O-N 2.85Å; I107-L110 PolarHBondContact O-N 3.08Å; L110-I113 PolarHBondContact O-N 3.19Å; L110-E114 WeakPolarHBondContact O-CG 3.34Å; L110-E114 PolarHBondContact O-N 2.86Å
111	T	92	Very high	90	Very high	64 Å²	64	69.5 Å²	69.5	39%	0.393	33%	0.332	S	S	.	.	H	α-helix	trans	-61.6	-45.1	176	-61	0	0	0	0	111.9	I107 F108 I113 E114 I115	I107-T111 WeakPolarHBondContact O-CB 3.35Å; I107-T111 PolarHBondContact O-N 3.41Å; I107-T111 PolarHBondContact O-OG1 2.82Å; I107-T111 VanDerWaalsContact O-OG1 3.06Å; F108-T111 PolarHBondContact O-N 3.14Å; T111-I113 VanDerWaalsContact C-N 3.32Å; T111-I113 PolarHBondContact O-N 2.8Å; T111-E114 PolarHBondContact O-N 3.44Å; T111-I115 HydrophobicContact CG2-CD1 3.89Å; T111-I115 WeakPolarHBondContact O-CG1 3.43Å; T111-I115 PolarHBondContact O-N 3.33Å
112	E	90.9	Very high	90.1	Very high	58 Å²	58	67.1 Å²	67.1	27%	0.271	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-39	177.3	-78.3	-65.2	123	0	0	112.2	V56 F108 L109 K116	V56-E112 HydrophobicContact CG2-CB 4.43Å; F108-E112 HydrophobicContact CD2-CG 4.24Å; F108-E112 HydrophobicContact CE1-CG 4.12Å; F108-E112 HydrophobicContact CE2-CG 3.76Å; F108-E112 HydrophobicContact CZ-CG 3.69Å; F108-E112 WeakPolarHBondContact O-CB 3.31Å; F108-E112 WeakPolarHBondContact O-CG 3.41Å; F108-E112 PolarHBondContact O-N 3.18Å; L109-E112 PolarHBondContact O-N 3.21Å; E112-K116 WeakPolarHBondContact O-CB 3.22Å; E112-K116 VanDerWaalsContact O-CG 3.3Å; E112-K116 WeakPolarHBondContact O-CG 3.42Å; E112-K116 PolarHBondContact O-N 3.4Å
113	I	91.4	Very high	90.2	Very high	2 Å²	2	66.3 Å²	66.3	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-65.6	-41.6	176.7	-72.4	164.5	0	0	0	111.2	A59 F63 V90 L93 I97 L109 L110 T111 K116 R117	A59-I113 HydrophobicContact CB-CD1 4.17Å; A59-I113 HydrophobicContact CB-CG1 3.84Å; F63-I113 HydrophobicContact CE2-CG2 4.27Å; F63-I113 HydrophobicContact CZ-CG2 4.1Å; V90-I113 HydrophobicContact CG2-CG2 4.14Å; L93-I113 HydrophobicContact CB-CD1 4.24Å; L93-I113 HydrophobicContact CD1-CD1 4.13Å; L93-I113 HydrophobicContact CD1-CG2 3.96Å; L93-I113 HydrophobicContact CD2-CD1 4.49Å; I97-I113 HydrophobicContact CD1-CD1 3.18Å; L109-I113 WeakPolarHBondContact O-CB 3.48Å; L109-I113 WeakPolarHBondContact O-CD1 3.26Å; L109-I113 WeakPolarHBondContact O-CG1 3.48Å; L109-I113 PolarHBondContact O-N 3.13Å; L110-I113 PolarHBondContact O-N 3.19Å; T111-I113 VanDerWaalsContact C-N 3.32Å; T111-I113 PolarHBondContact O-N 2.8Å; I113-K116 PolarHBondContact O-N 3.31Å; I113-R117 WeakPolarHBondContact O-CB 3.38Å; I113-R117 PolarHBondContact O-N 3.42Å
114	E	91.9	Very high	89.7	Confident	92 Å²	92	61 Å²	61	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-62.6	-49.1	176.5	-74.9	176.2	174	0	0	111.7	L110 T111 K116 R117 E118	L110-E114 WeakPolarHBondContact O-CG 3.34Å; L110-E114 PolarHBondContact O-N 2.86Å; T111-E114 PolarHBondContact O-N 3.44Å; E114-K116 PolarHBondContact O-N 2.94Å; E114-R117 WeakPolarHBondContact O-CB 3.46Å; E114-R117 PolarHBondContact O-N 3.4Å; E114-R117 VanDerWaalsContact O-N 3.12Å; E114-E118 PolarHBondContact O-N 3.38Å
115	I	91.9	Very high	89.3	Confident	59 Å²	59	60.5 Å²	60.5	30%	0.303	29%	0.292	S	S	.	.	H	α-helix	trans	-57.6	-40.5	176.5	-67.9	166.4	0	0	0	111	T111 K119	T111-I115 HydrophobicContact CG2-CD1 3.89Å; T111-I115 WeakPolarHBondContact O-CG1 3.43Å; T111-I115 PolarHBondContact O-N 3.33Å; I115-K119 HydrophobicContact CG2-CD 4.21Å; I115-K119 WeakPolarHBondContact O-CG 3.21Å; I115-K119 PolarHBondContact O-N 2.88Å; I115-K119 VanDerWaalsContact O-N 3.12Å
116	K	89.7	Confident	88.9	Confident	44 Å²	44	68 Å²	68	19%	0.191	33%	0.327	C	S	.	.	H	α-helix	trans	-68.8	-40.8	177.9	-75.5	-179.5	-170.6	-65.1	0	112.3	V56 E60 E112 I113 E114 E118 K119 L120	V56-K116 HydrophobicContact CG1-CD 4.17Å; E60-K116 HydrophobicContact CG-CD 3.77Å; E60-K116 VanDerWaalsContact OE1-CE 3.24Å; E60-K116 WeakPolarHBondContact OE1-CE 3.39Å; E60-K116 IonicContact OE1-NZ 2.64Å; E60-K116 PolarHBondContact OE1-NZ 3.42Å; E112-K116 WeakPolarHBondContact O-CB 3.22Å; E112-K116 VanDerWaalsContact O-CG 3.3Å; E112-K116 WeakPolarHBondContact O-CG 3.42Å; E112-K116 PolarHBondContact O-N 3.4Å; I113-K116 PolarHBondContact O-N 3.31Å; E114-K116 PolarHBondContact O-N 2.94Å; K116-E118 VanDerWaalsContact C-N 3.32Å; K116-E118 PolarHBondContact O-N 3.41Å; K116-K119 PolarHBondContact O-N 3.33Å; K116-L120 WeakPolarHBondContact O-CB 3.3Å; K116-L120 VanDerWaalsContact O-CG 3.23Å; K116-L120 WeakPolarHBondContact O-CG 3.41Å; K116-L120 PolarHBondContact O-N 2.98Å
117	R	90.9	Very high	87.8	Confident	80 Å²	80	70.6 Å²	70.6	30%	0.302	35%	0.345	S	S	.	.	H	α-helix	trans	-57.3	-47.4	174.5	174.2	-173.7	166.6	-151.5	-2.8	110.5	F63 F86 I113 E114 L120 L121	F63-R117 HydrophobicContact CZ-CB 4.31Å; F86-R117 HydrophobicContact CB-CG 4.44Å; F86-R117 HydrophobicContact CD1-CG 4.43Å; I113-R117 WeakPolarHBondContact O-CB 3.38Å; I113-R117 PolarHBondContact O-N 3.42Å; E114-R117 WeakPolarHBondContact O-CB 3.46Å; E114-R117 PolarHBondContact O-N 3.4Å; E114-R117 VanDerWaalsContact O-N 3.12Å; R117-L120 PolarHBondContact O-N 3.06Å; R117-L121 HydrophobicContact CG-CD1 3.99Å; R117-L121 HydrophobicContact CG-CG 4.4Å; R117-L121 WeakPolarHBondContact O-CG 3.38Å; R117-L121 PolarHBondContact O-N 2.92Å
118	E	90.6	Very high	86.1	Confident	119 Å²	119	73.8 Å²	73.8	56%	0.556	37%	0.369	S	S	*	.	H	α-helix	trans	-59.3	-51.4	178.9	-70.9	177.2	170.4	0	0	111.5	E114 K116 L120 L121 E122	E114-E118 PolarHBondContact O-N 3.38Å; K116-E118 VanDerWaalsContact C-N 3.32Å; K116-E118 PolarHBondContact O-N 3.41Å; E118-L120 PolarHBondContact O-N 3.45Å; E118-L121 PolarHBondContact O-N 2.96Å; E118-E122 WeakPolarHBondContact O-CG 3.39Å; E118-E122 PolarHBondContact O-N 2.74Å
119	K	90.7	Very high	85.8	Confident	131 Å²	131	73.6 Å²	73.6	57%	0.57	37%	0.37	S	S	*	.	H	α-helix	trans	-57	-36.8	176.6	-72.6	174.4	179.8	175	0	113.1	I115 K116 A123	I115-K119 HydrophobicContact CG2-CD 4.21Å; I115-K119 WeakPolarHBondContact O-CG 3.21Å; I115-K119 PolarHBondContact O-N 2.88Å; I115-K119 VanDerWaalsContact O-N 3.12Å; K116-K119 PolarHBondContact O-N 3.33Å; K119-A123 WeakPolarHBondContact O-CB 3.35Å; K119-A123 PolarHBondContact O-N 2.97Å
120	L	88.3	Confident	85.6	Confident	44 Å²	44	77.5 Å²	77.5	23%	0.23	39%	0.39	C	S	.	.	H	α-helix	trans	-72.9	-38.3	177.5	-72.7	169.9	0	0	0	112.1	F63 I67 F86 K116 R117 E118 L124	F63-L120 HydrophobicContact CB-CD1 3.48Å; F63-L120 VanDerWaalsContact CB-CD1 3.48Å; F63-L120 HydrophobicContact CD2-CD1 3.69Å; F63-L120 HydrophobicContact CG-CD1 3.68Å; I67-L120 HydrophobicContact CD1-CB 4.5Å; I67-L120 HydrophobicContact CD1-CD1 4.44Å; I67-L120 HydrophobicContact CD1-CD2 4.02Å; F86-L120 HydrophobicContact CE1-CB 4.35Å; F86-L120 HydrophobicContact CE1-CD1 4.35Å; F86-L120 HydrophobicContact CZ-CB 4.44Å; K116-L120 WeakPolarHBondContact O-CB 3.3Å; K116-L120 VanDerWaalsContact O-CG 3.23Å; K116-L120 WeakPolarHBondContact O-CG 3.41Å; K116-L120 PolarHBondContact O-N 2.98Å; R117-L120 PolarHBondContact O-N 3.06Å; E118-L120 PolarHBondContact O-N 3.45Å; L120-L124 VanDerWaalsContact O-CB 3.25Å; L120-L124 WeakPolarHBondContact O-CB 3.3Å; L120-L124 WeakPolarHBondContact O-CD1 3.33Å; L120-L124 WeakPolarHBondContact O-CG 3.4Å; L120-L124 PolarHBondContact O-N 2.83Å
121	L	86.4	Confident	85.3	Confident	25 Å²	25	79.7 Å²	79.7	13%	0.131	40%	0.4	C	S	.	.	H	α-helix	trans	-64.8	-40.6	174.1	-71.9	173	0	0	0	111.3	F86 R117 E118 L124 Q125	F86-L121 HydrophobicContact CD2-CD2 3.61Å; F86-L121 HydrophobicContact CD2-CG 4.48Å; F86-L121 HydrophobicContact CE2-CD2 3.8Å; F86-L121 HydrophobicContact CG-CD2 4.33Å; R117-L121 HydrophobicContact CG-CD1 3.99Å; R117-L121 HydrophobicContact CG-CG 4.4Å; R117-L121 WeakPolarHBondContact O-CG 3.38Å; R117-L121 PolarHBondContact O-N 2.92Å; E118-L121 PolarHBondContact O-N 2.96Å; L121-L124 PolarHBondContact O-N 2.73Å; L121-Q125 WeakPolarHBondContact O-CG 3.29Å; L121-Q125 PolarHBondContact O-N 3.49Å
122	E	88.3	Confident	84.9	Confident	116 Å²	116	80.6 Å²	80.6	54%	0.542	40%	0.401	S	S	.	.	H	α-helix	trans	-61.9	-51.2	173.9	-71.2	174.6	173	0	0	111.4	E118 L124 Q125 E126	E118-E122 WeakPolarHBondContact O-CG 3.39Å; E118-E122 PolarHBondContact O-N 2.74Å; E122-L124 PolarHBondContact O-N 3.34Å; E122-Q125 WeakPolarHBondContact O-CB 3.35Å; E122-Q125 PolarHBondContact O-N 2.98Å; E122-E126 PolarHBondContact O-N 3.41Å
123	A	87.4	Confident	84.5	Confident	46 Å²	46	82 Å²	82	38%	0.38	41%	0.409	S	S	.	.	H	α-helix	trans	-59.2	-32.1	178	0	0	0	0	0	112.8	K119 Q125 D127	K119-A123 WeakPolarHBondContact O-CB 3.35Å; K119-A123 PolarHBondContact O-N 2.97Å; A123-Q125 VanDerWaalsContact C-N 3.34Å; A123-D127 PolarHBondContact O-N 2.7Å
124	L	81.7	Confident	84	Confident	12 Å²	12	87.3 Å²	87.3	6%	0.063	44%	0.436	C	S	.	.	H	α-helix	trans	-76.3	-18.6	177	-81	176.1	0	0	0	114.2	I67 R82 F86 L120 L121 E122 T128	I67-L124 HydrophobicContact CD1-CD1 4.2Å; I67-L124 HydrophobicContact CG1-CD1 4.12Å; I67-L124 HydrophobicContact CG2-CD2 3.96Å; R82-L124 PolarHBondContact NH1-O 3.32Å; F86-L124 HydrophobicContact CE2-CD1 3.6Å; F86-L124 HydrophobicContact CZ-CD1 3.66Å; L120-L124 VanDerWaalsContact O-CB 3.25Å; L120-L124 WeakPolarHBondContact O-CB 3.3Å; L120-L124 WeakPolarHBondContact O-CD1 3.33Å; L120-L124 WeakPolarHBondContact O-CG 3.4Å; L120-L124 PolarHBondContact O-N 2.83Å; L121-L124 PolarHBondContact O-N 2.73Å; E122-L124 PolarHBondContact O-N 3.34Å; L124-T128 PolarHBondContact O-OG1 3.05Å
125	Q	80.4	Confident	83.5	Confident	108 Å²	108	87 Å²	87	51%	0.505	44%	0.436	S	S	.	.	H	α-helix	trans	-81.8	-35.6	171.6	-72.1	175.3	-11.3	0	0	111.2	F79 L121 E122 A123 D127 T128	F79-Q125 HydrophobicContact CE2-CG 4.23Å; L121-Q125 WeakPolarHBondContact O-CG 3.29Å; L121-Q125 PolarHBondContact O-N 3.49Å; E122-Q125 WeakPolarHBondContact O-CB 3.35Å; E122-Q125 PolarHBondContact O-N 2.98Å; A123-Q125 VanDerWaalsContact C-N 3.34Å; Q125-D127 VanDerWaalsContact C-N 3.28Å; Q125-D127 PolarHBondContact O-N 2.87Å; Q125-T128 PolarHBondContact O-N 2.76Å
126	E	80	Confident	82.8	Confident	166 Å²	166	89.2 Å²	89.2	78%	0.776	45%	0.446	S	S	*	.	H	α-helix	trans	-67.8	-25.8	177.8	-65.9	-177.9	171.7	0	0	113.4	E122 T128	E122-E126 PolarHBondContact O-N 3.41Å; E126-T128 VanDerWaalsContact C-N 3.27Å; E126-T128 PolarHBondContact O-N 3.37Å
127	D	67.6	Low	82.2	Confident	111 Å²	111	92.9 Å²	92.9	59%	0.594	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-7.7	176.5	-82.3	-11.7	0	0	0	113.9	K71 A123 Q125	K71-D127 IonicContact NZ-OD2 3.03Å; K71-D127 PolarHBondContact NZ-OD2 3.2Å; A123-D127 PolarHBondContact O-N 2.7Å; Q125-D127 VanDerWaalsContact C-N 3.28Å; Q125-D127 PolarHBondContact O-N 2.87Å
128	T	54.6	Low	81.5	Confident	157 Å²	157	94.1 Å²	94.1	96%	0.963	48%	0.483	S	S	*	.			trans	-104.4	0	-177.1	-48.3	0	0	0	0	111.9	L124 Q125 E126	L124-T128 PolarHBondContact O-OG1 3.05Å; Q125-T128 PolarHBondContact O-N 2.76Å; E126-T128 VanDerWaalsContact C-N 3.27Å; E126-T128 PolarHBondContact O-N 3.37Å

Retrieved 128 of 128 residues in 137.1 ms (Link to these results)

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