A0A3B3VMA5_9TELE Loading...

Caveolin

May act as a scaffolding protein within caveolar membranes. Interacts directly with G-protein alpha subunits and can functionally regulate their activity.

AlphaFold DB , UniProt , Accession A0A3B3VMA5, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 180 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.6	Very low	46.1	Very low	250 Å²	250	144.1 Å²	144.1	100%	1.232	74%	0.743	S	S	*	*				0	98.2	0	-84.8	166.5	168.4	0	0	106.7
2	T	45.3	Very low	46.6	Very low	152 Å²	152	144.1 Å²	144.1	93%	0.933	74%	0.737	S	S	*	*			trans	-92.7	114.6	176.8	38.8	0	0	0	0	107.2
3	G	43.4	Very low	46.8	Very low	59 Å²	59	143.5 Å²	143.5	61%	0.608	73%	0.73	S	S	*	*			trans	-172.6	-5.2	-177.3	0	0	0	0	0	119.4
4	E	41.9	Very low	47	Very low	189 Å²	189	145.1 Å²	145.1	88%	0.883	72%	0.724	S	S	*	*	S	Bend	trans	-114.1	0.6	-173.6	-82	-179.4	103.5	0	0	115.3
5	L	46	Very low	47.3	Very low	154 Å²	154	143.5 Å²	143.5	81%	0.806	72%	0.718	S	S	*	*	S	Bend	trans	-96.8	3.9	-176.8	-126	122.4	0	0	0	114.4
6	R	46.8	Very low	47.5	Very low	200 Å²	200	142.1 Å²	142.1	76%	0.755	71%	0.708	S	S	*	*	S	Bend	trans	-102.7	-15.6	-175.1	-67.6	179.3	82.1	164.6	4.2	114.1	T10	R6-T10 PolarHBondContact O-OG1 3.32Å
7	D	47	Very low	47.3	Very low	114 Å²	114	136.6 Å²	136.6	61%	0.61	69%	0.687	S	S	*	*	H	α-helix	trans	-84.7	-31	-172.7	-66.2	-23.5	0	0	0	112.5	T10 E11	D7-T10 PolarHBondContact O-N 2.94Å; D7-E11 PolarHBondContact O-N 3.04Å
8	D	47.6	Very low	47.2	Very low	123 Å²	123	137.1 Å²	137.1	66%	0.658	68%	0.684	S	S	*	*	H	α-helix	trans	-71.8	-42.6	-179.6	-155.3	74	0	0	0	112.3	T10 E11 E12	D8-T10 PolarHBondContact O-N 2.69Å; D8-E11 PolarHBondContact O-N 3.5Å; D8-E12 PolarHBondContact O-N 3.5Å
9	E	49.8	Very low	47.3	Very low	139 Å²	139	136.3 Å²	136.3	65%	0.65	68%	0.681	S	S	*	*	H	α-helix	trans	-64.5	-30.8	173.4	-70.6	-173.9	165.1	0	0	112.1	E13	E9-E13 WeakPolarHBondContact O-CB 3.34Å; E9-E13 PolarHBondContact O-N 3.39Å
10	T	48.5	Very low	47.4	Very low	56 Å²	56	138.8 Å²	138.8	34%	0.344	68%	0.682	S	S	.	*	H	α-helix	trans	-72.5	-38.5	179.7	-53.1	0	0	0	0	110.5	R6 D7 D8 E13 Y14	R6-T10 PolarHBondContact O-OG1 3.32Å; D7-T10 PolarHBondContact O-N 2.94Å; D8-T10 PolarHBondContact O-N 2.69Å; T10-E13 PolarHBondContact O-N 3.13Å; T10-Y14 HydrophobicContact CG2-CD2 3.7Å; T10-Y14 HydrophobicContact CG2-CE2 3.36Å; T10-Y14 WeakPolarHBondContact O-CB 3.47Å; T10-Y14 WeakPolarHBondContact O-CD2 3.47Å; T10-Y14 PolarHBondContact O-N 3.18Å
11	E	51.8	Low	47.2	Very low	149 Å²	149	140.8 Å²	140.8	70%	0.696	69%	0.687	S	S	*	*	H	α-helix	trans	-69.3	-37.7	177.1	-70.1	-161.1	158.5	0	0	113	D7 D8 Y14 L15	D7-E11 PolarHBondContact O-N 3.04Å; D8-E11 PolarHBondContact O-N 3.5Å; E11-Y14 PolarHBondContact O-N 3.1Å; E11-L15 WeakPolarHBondContact O-CB 3.47Å; E11-L15 PolarHBondContact O-N 2.93Å
12	E	52	Low	47.6	Very low	144 Å²	144	137.1 Å²	137.1	67%	0.673	67%	0.667	S	S	*	*	H	α-helix	trans	-65.4	-40	172.7	-75.2	-160.5	147.1	0	0	112.3	D8 L15 H16	D8-E12 PolarHBondContact O-N 3.5Å; E12-L15 PolarHBondContact O-N 3.45Å; E12-H16 WeakPolarHBondContact O-CB 3.1Å; E12-H16 PolarHBondContact O-N 2.83Å
13	E	49.7	Very low	47.8	Very low	137 Å²	137	131.9 Å²	131.9	64%	0.64	64%	0.643	S	S	*	*	H	α-helix	trans	-67.5	-34.8	176.5	-168.8	174.3	-173	0	0	112.1	E9 T10 S17	E9-E13 WeakPolarHBondContact O-CB 3.34Å; E9-E13 PolarHBondContact O-N 3.39Å; T10-E13 PolarHBondContact O-N 3.13Å; E13-S17 WeakPolarHBondContact O-CB 3.19Å; E13-S17 PolarHBondContact O-N 2.93Å; E13-S17 PolarHBondContact O-OG 3.38Å
14	Y	50	Low	47.7	Very low	165 Å²	165	136.8 Å²	136.8	65%	0.647	66%	0.655	S	S	*	*	H	α-helix	trans	-72	-38.6	175.6	-85.2	-115	0	0	0	112.2	T10 E11 S17 F18	T10-Y14 HydrophobicContact CG2-CD2 3.7Å; T10-Y14 HydrophobicContact CG2-CE2 3.36Å; T10-Y14 WeakPolarHBondContact O-CB 3.47Å; T10-Y14 WeakPolarHBondContact O-CD2 3.47Å; T10-Y14 PolarHBondContact O-N 3.18Å; E11-Y14 PolarHBondContact O-N 3.1Å; Y14-S17 WeakPolarHBondContact CA-OG 3.2Å; Y14-S17 PolarHBondContact O-OG 2.79Å; Y14-S17 VanDerWaalsContact O-OG 3.1Å; Y14-F18 VanDerWaalsContact O-CB 3.22Å; Y14-F18 WeakPolarHBondContact O-CB 3.44Å; Y14-F18 PolarHBondContact O-N 3.36Å
15	L	50.4	Low	48.1	Very low	122 Å²	122	135.4 Å²	135.4	64%	0.639	65%	0.652	S	S	*	*	H	α-helix	trans	-69.4	-41.8	176.1	-148.1	86.7	0	0	0	111.5	E11 E12 F18 I19	E11-L15 WeakPolarHBondContact O-CB 3.47Å; E11-L15 PolarHBondContact O-N 2.93Å; E12-L15 PolarHBondContact O-N 3.45Å; L15-F18 PolarHBondContact O-N 3.37Å; L15-I19 WeakPolarHBondContact O-CG1 3.36Å; L15-I19 PolarHBondContact O-N 2.88Å; L15-I19 VanDerWaalsContact O-N 3.13Å
16	H	50.6	Low	47.9	Very low	121 Å²	121	138.1 Å²	138.1	56%	0.56	65%	0.653	S	S	*	*	H	α-helix	trans	-70.8	-34.9	178.6	-168	-118.4	0	0	0	112.4	E12 R20	E12-H16 WeakPolarHBondContact O-CB 3.1Å; E12-H16 PolarHBondContact O-N 2.83Å; H16-R20 WeakPolarHBondContact O-CB 3.43Å; H16-R20 PolarHBondContact O-N 2.81Å; H16-R20 VanDerWaalsContact O-N 3.15Å
17	S	45.3	Very low	47.7	Very low	49 Å²	49	138 Å²	138	34%	0.343	66%	0.658	S	S	.	*	H	α-helix	trans	-74.1	-30.9	173.2	67.3	0	0	0	0	113.3	E13 Y14 R20 K21	E13-S17 WeakPolarHBondContact O-CB 3.19Å; E13-S17 PolarHBondContact O-N 2.93Å; E13-S17 PolarHBondContact O-OG 3.38Å; Y14-S17 WeakPolarHBondContact CA-OG 3.2Å; Y14-S17 PolarHBondContact O-OG 2.79Å; Y14-S17 VanDerWaalsContact O-OG 3.1Å; S17-R20 PolarHBondContact O-N 3.38Å; S17-K21 PolarHBondContact O-N 2.88Å
18	F	45.7	Very low	47.4	Very low	144 Å²	144	138.5 Å²	138.5	63%	0.632	67%	0.667	S	S	*	*	H	α-helix	trans	-65.9	-41.5	173.4	-174.1	-99.7	0	0	0	111.7	Y14 L15 K21	Y14-F18 VanDerWaalsContact O-CB 3.22Å; Y14-F18 WeakPolarHBondContact O-CB 3.44Å; Y14-F18 PolarHBondContact O-N 3.36Å; L15-F18 PolarHBondContact O-N 3.37Å; F18-K21 PolarHBondContact O-N 3.37Å
19	I	48.6	Very low	47.4	Very low	123 Å²	123	139.1 Å²	139.1	63%	0.631	67%	0.671	S	S	*	*	H	α-helix	trans	-68.4	-36.3	175.6	-66.3	178.4	0	0	0	111.5	L15 K21	L15-I19 WeakPolarHBondContact O-CG1 3.36Å; L15-I19 PolarHBondContact O-N 2.88Å; L15-I19 VanDerWaalsContact O-N 3.13Å; I19-K21 VanDerWaalsContact C-N 3.33Å; I19-K21 PolarHBondContact O-N 3.22Å
20	R	48.8	Very low	47	Very low	185 Å²	185	138.6 Å²	138.6	70%	0.698	67%	0.673	S	S	*	*	H	α-helix	trans	-68.3	-25.9	176.6	-168.6	-178.1	-73.3	171.4	-3.2	113.6	H16 S17	H16-R20 WeakPolarHBondContact O-CB 3.43Å; H16-R20 PolarHBondContact O-N 2.81Å; H16-R20 VanDerWaalsContact O-N 3.15Å; S17-R20 PolarHBondContact O-N 3.38Å
21	K	43.3	Very low	46.9	Very low	182 Å²	182	143.6 Å²	143.6	79%	0.791	69%	0.69	S	S	*	*	H	α-helix	trans	-82.5	-14.9	-177.7	-82.3	-173.9	179.6	177.4	0	115	S17 F18 I19	S17-K21 PolarHBondContact O-N 2.88Å; F18-K21 PolarHBondContact O-N 3.37Å; I19-K21 VanDerWaalsContact C-N 3.33Å; I19-K21 PolarHBondContact O-N 3.22Å
22	Q	47.1	Very low	46.8	Very low	173 Å²	173	142.9 Å²	142.9	81%	0.808	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	6.4	-177.4	-91.3	-125.1	-25.5	0	0	115.3
23	G	48.8	Very low	46.6	Very low	41 Å²	41	143.4 Å²	143.4	42%	0.423	70%	0.695	S	S	.	*	S	Bend	trans	-124.7	108.5	169.9	0	0	0	0	0	110.1
24	N	41.5	Very low	46.6	Very low	162 Å²	162	145 Å²	145	87%	0.866	70%	0.702	S	S	*	*			trans	157.3	90.8	143.3	-77.6	2.3	0	0	0	110.5
25	I	50.7	Low	46.5	Very low	161 Å²	161	143.6 Å²	143.6	83%	0.826	71%	0.706	S	S	*	*			trans	-98.6	-10.6	169.6	-64.5	176.2	0	0	0	111.8
26	Y	41.9	Very low	46.3	Very low	211 Å²	211	146.2 Å²	146.2	83%	0.827	72%	0.715	S	S	*	*			trans	-105.3	107.6	179.6	-62.6	-78	0	0	0	111.4
27	K	42.6	Very low	46.1	Very low	196 Å²	196	143 Å²	143	85%	0.852	71%	0.706	S	S	*	*			trans	-124.4	88	161.5	-170.8	168.8	-173.3	173.1	0	108.2	N29	K27-N29 PolarHBondContact O-N 3.22Å
28	P	39.8	Very low	46.5	Very low	125 Å²	125	146.9 Å²	146.9	81%	0.812	72%	0.722	S	S	*	*			trans	-74.9	109.7	168.1	28.9	-28.3	0	0	0	108.2
29	N	49.3	Very low	46.8	Very low	136 Å²	136	147.1 Å²	147.1	73%	0.727	73%	0.73	S	S	*	*			trans	-86.7	110.9	165.9	175.3	62.4	0	0	0	107.5	K27	K27-N29 PolarHBondContact O-N 3.22Å
30	N	40.3	Very low	46.6	Very low	129 Å²	129	148.7 Å²	148.7	69%	0.69	74%	0.735	S	S	*	*			trans	-151.6	106.5	154.6	-146.5	50.3	0	0	0	110.7
31	K	47.2	Very low	46.6	Very low	161 Å²	161	147.2 Å²	147.2	70%	0.7	73%	0.733	S	S	*	*			trans	-68	153.3	152	-67.9	175.7	175.6	174.4	0	106.8
32	D	48.2	Very low	46.8	Very low	133 Å²	133	142.3 Å²	142.3	71%	0.711	73%	0.727	S	S	*	*			trans	86.9	78.3	168.5	-32.7	-34.4	0	0	0	115
33	M	48.1	Very low	46.9	Very low	155 Å²	155	142.6 Å²	142.6	76%	0.764	73%	0.73	S	S	*	*			trans	-177.6	60.4	146.5	-103.3	-173.1	-66.6	0	0	110.5
34	E	49.6	Very low	46.8	Very low	170 Å²	170	148.1 Å²	148.1	79%	0.794	75%	0.745	S	S	*	*			trans	-86.9	-2.3	-167.5	-63.7	-177.7	-176.8	0	0	115.5
35	N	49	Very low	46.9	Very low	136 Å²	136	144.7 Å²	144.7	73%	0.727	73%	0.727	S	S	*	*	S	Bend	trans	-126.2	-4	-163.9	64.5	-9.5	0	0	0	117.9
36	E	46.2	Very low	46.9	Very low	177 Å²	177	143.5 Å²	143.5	83%	0.827	73%	0.727	S	S	*	*	S	Bend	trans	-115.7	-11.9	-179.5	-129.2	171.9	170.4	0	0	114.6
37	S	46.7	Very low	47.3	Very low	53 Å²	53	142.3 Å²	142.3	37%	0.371	73%	0.728	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.9	-1	-178.3	64.9	0	0	0	0	115.5	N39 K41	S37-N39 VanDerWaalsContact C-N 3.34Å; S37-N39 PolarHBondContact O-N 2.65Å; S37-K41 WeakPolarHBondContact O-CG 3.32Å
38	L	53.6	Low	47.4	Very low	132 Å²	132	136.7 Å²	136.7	69%	0.691	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-23.5	-174	-73.8	165.9	0	0	0	113.6
39	N	50.5	Low	48.1	Very low	149 Å²	149	139.4 Å²	139.4	80%	0.797	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-20.7	-175.2	-155.3	30.9	0	0	0	113.6	S37	S37-N39 VanDerWaalsContact C-N 3.34Å; S37-N39 PolarHBondContact O-N 2.65Å
40	E	46.1	Very low	48.3	Very low	156 Å²	156	141.5 Å²	141.5	73%	0.729	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-27.4	177.5	-144	165.5	144.3	0	0	112.1	A42 M43	E40-A42 PolarHBondContact O-N 3.07Å; E40-M43 PolarHBondContact O-N 2.83Å
41	K	47.7	Very low	49.2	Very low	153 Å²	153	141.9 Å²	141.9	67%	0.665	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-7	172.7	-81	179.7	174	172.8	0	115.5	S37 M43	S37-K41 WeakPolarHBondContact O-CG 3.32Å; K41-M43 VanDerWaalsContact C-N 3.34Å
42	A	48	Very low	49.7	Very low	79 Å²	79	138.3 Å²	138.3	65%	0.653	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-17.3	177.6	0	0	0	0	0	112.6	E40	E40-A42 PolarHBondContact O-N 3.07Å
43	M	49.1	Very low	50.4	Low	180 Å²	180	138 Å²	138	89%	0.887	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.1	-22.3	-172.8	-154.5	163.6	78.9	0	0	114.2	E40 K41	E40-M43 PolarHBondContact O-N 2.83Å; K41-M43 VanDerWaalsContact C-N 3.34Å
44	E	47	Very low	50.9	Low	156 Å²	156	137.3 Å²	137.3	73%	0.729	71%	0.706	S	S	*	*	S	Bend	trans	-95.4	122.8	162.1	-78.4	-174.4	139.4	0	0	109.7
45	D	42.6	Very low	51.8	Low	91 Å²	91	132.8 Å²	132.8	49%	0.487	69%	0.687	S	S	.	*			trans	104.1	33.5	161.1	-126.5	13.1	0	0	0	120.8	T48	D45-T48 WeakPolarHBondContact OD1-CA 3.44Å; D45-T48 WeakPolarHBondContact OD1-CB 3.5Å; D45-T48 PolarHBondContact OD1-N 3.24Å; D45-T48 PolarHBondContact OD1-OG1 3.46Å
46	V	52.2	Low	52.6	Low	136 Å²	136	136 Å²	136	82%	0.824	69%	0.69	S	S	*	*	S	Bend	trans	-72.2	-21.9	155.2	180	0	0	0	0	111.4
47	H	48.4	Very low	53.6	Low	185 Å²	185	129 Å²	129	86%	0.856	66%	0.657	S	S	*	*	S	Bend	trans	-87.1	-21	-176.3	-160.8	61.4	0	0	0	114.4
48	T	46.4	Very low	54.8	Low	79 Å²	79	131 Å²	131	49%	0.485	67%	0.669	S	S	.	*			trans	-125.5	66.2	176.9	-21.5	0	0	0	0	109.5	D45 E50	D45-T48 WeakPolarHBondContact OD1-CA 3.44Å; D45-T48 WeakPolarHBondContact OD1-CB 3.5Å; D45-T48 PolarHBondContact OD1-N 3.24Å; D45-T48 PolarHBondContact OD1-OG1 3.46Å; T48-E50 VanDerWaalsContact C-N 3.27Å; T48-E50 PolarHBondContact O-N 2.93Å
49	K	53	Low	55.8	Low	181 Å²	181	133 Å²	133	79%	0.787	67%	0.673	S	S	*	*			trans	-57.6	107.1	150.7	-81.4	-176	176.6	173.4	0	105.5	I51	K49-I51 PolarHBondContact O-N 3.34Å
50	E	55	Low	56.7	Low	181 Å²	181	134.2 Å²	134.2	85%	0.846	67%	0.666	S	S	*	*			trans	-45.7	104.2	179.8	-68.8	-174.1	156.8	0	0	108.5	T48 D52	T48-E50 VanDerWaalsContact C-N 3.27Å; T48-E50 PolarHBondContact O-N 2.93Å; E50-D52 PolarHBondContact O-N 3.26Å
51	I	58.3	Low	57.9	Low	137 Å²	137	132.7 Å²	132.7	70%	0.703	66%	0.661	S	S	*	*			trans	-72.1	115	176.9	42.9	161.8	0	0	0	106.5	K49 L53	K49-I51 PolarHBondContact O-N 3.34Å; I51-L53 HydrophobicContact CD1-CD2 4.36Å; I51-L53 PolarHBondContact O-N 2.88Å
52	D	58.8	Low	59.1	Low	86 Å²	86	129.5 Å²	129.5	46%	0.46	65%	0.651	S	S	.	*			trans	-67.2	102.8	173.6	-171.7	-12.7	0	0	0	108.8	E50 V54 N55	E50-D52 PolarHBondContact O-N 3.26Å; D52-V54 PolarHBondContact O-N 3.48Å; D52-V54 WeakPolarHBondContact OD1-CA 3.47Å; D52-V54 WeakPolarHBondContact OD1-CB 3.3Å; D52-V54 PolarHBondContact OD1-N 3.33Å; D52-N55 VanDerWaalsContact CG-N 3.29Å; D52-N55 CarbonylContact O-C 3.48Å; D52-N55 PolarHBondContact OD1-N 2.94Å; D52-N55 VanDerWaalsContact OD2-CB 3.26Å; D52-N55 WeakPolarHBondContact OD2-CB 3.23Å
53	L	61.2	Low	59.9	Low	126 Å²	126	128.1 Å²	128.1	66%	0.66	63%	0.633	S	S	*	*	S	Bend	trans	-70.4	-19.4	179.9	-71.3	152.4	0	0	0	112	I51 R56	I51-L53 HydrophobicContact CD1-CD2 4.36Å; I51-L53 PolarHBondContact O-N 2.88Å; L53-R56 PolarHBondContact O-NE 3.5Å
54	V	60.1	Low	60.5	Low	140 Å²	140	127.2 Å²	127.2	85%	0.848	63%	0.632	S	S	*	*	S	Bend	trans	-89.5	-49.9	-179.6	-175.6	0	0	0	0	109.9	D52	D52-V54 PolarHBondContact O-N 3.48Å; D52-V54 WeakPolarHBondContact OD1-CA 3.47Å; D52-V54 WeakPolarHBondContact OD1-CB 3.3Å; D52-V54 PolarHBondContact OD1-N 3.33Å
55	N	67.1	Low	61	Low	76 Å²	76	125 Å²	125	41%	0.406	63%	0.629	S	S	.	*			trans	-102.5	91.2	174.1	-169.8	-2.7	0	0	0	112.1	D52 D57	D52-N55 VanDerWaalsContact CG-N 3.29Å; D52-N55 CarbonylContact O-C 3.48Å; D52-N55 PolarHBondContact OD1-N 2.94Å; D52-N55 VanDerWaalsContact OD2-CB 3.26Å; D52-N55 WeakPolarHBondContact OD2-CB 3.23Å; N55-D57 VanDerWaalsContact C-N 3.28Å; N55-D57 PolarHBondContact O-N 3.36Å; N55-D57 PolarHBondContact OD1-N 3.18Å; N55-D57 PolarHBondContact OD1-O 3.48Å
56	R	66	Low	61.6	Low	204 Å²	204	125.6 Å²	125.6	77%	0.77	64%	0.635	S	S	*	*	S	Bend	trans	-79.9	-6.3	179.8	-60	-179.1	-174.8	-173.4	-1.9	114.2	L53	L53-R56 PolarHBondContact O-NE 3.5Å
57	D	68.1	Low	61.9	Low	28 Å²	28	126.8 Å²	126.8	15%	0.15	63%	0.63	C	S	.	*			trans	-131.3	66.1	174.2	-167.6	-0.4	0	0	0	111.4	N55 K59 R60 I61 N62	N55-D57 VanDerWaalsContact C-N 3.28Å; N55-D57 PolarHBondContact O-N 3.36Å; N55-D57 PolarHBondContact OD1-N 3.18Å; N55-D57 PolarHBondContact OD1-O 3.48Å; D57-K59 PolarHBondContact O-N 3.48Å; D57-K59 VanDerWaalsContact O-N 3.1Å; D57-R60 PolarHBondContact O-N 2.8Å; D57-R60 WeakPolarHBondContact OD1-CA 3.16Å; D57-R60 PolarHBondContact OD1-N 3.5Å; D57-I61 VanDerWaalsContact CG-N 3.35Å; D57-I61 WeakPolarHBondContact OD1-CG1 3.32Å; D57-I61 PolarHBondContact OD1-N 2.9Å; D57-I61 PolarHBondContact OD2-N 3.28Å; D57-N62 WeakPolarHBondContact OD2-CB 3.42Å; D57-N62 PolarHBondContact OD2-N 3.01Å; D57-N62 PolarHBondContact OD2-ND2 3.25Å
58	P	72.6	Confident	62.4	Low	95 Å²	95	121.5 Å²	121.5	62%	0.617	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-16.8	-177.8	27.8	-35.1	0	0	0	113
59	K	73.9	Confident	63.2	Low	176 Å²	176	122.5 Å²	122.5	77%	0.765	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-0.6	178.2	-67.7	-177.9	-179.2	178.8	0	113	D57 I61	D57-K59 PolarHBondContact O-N 3.48Å; D57-K59 VanDerWaalsContact O-N 3.1Å; K59-I61 HydrophobicContact CB-CG2 3.84Å; K59-I61 PolarHBondContact O-N 3.28Å
60	R	68.7	Low	63.5	Low	173 Å²	173	114.4 Å²	114.4	65%	0.653	58%	0.578	S	S	*	*			trans	53.5	38.4	177.5	-58.8	178	66.4	-169.3	-4.4	112.4	D57 N62 D63	D57-R60 PolarHBondContact O-N 2.8Å; D57-R60 WeakPolarHBondContact OD1-CA 3.16Å; D57-R60 PolarHBondContact OD1-N 3.5Å; R60-N62 VanDerWaalsContact C-N 3.28Å; R60-N62 PolarHBondContact O-N 3.35Å; R60-D63 HydrophobicContact CB-CB 4.46Å; R60-D63 IonicContact CZ-OD2 3.09Å; R60-D63 IonicContact NE-OD2 2.67Å; R60-D63 PolarHBondContact NE-OD2 3.34Å; R60-D63 IonicContact NH2-OD2 2.69Å; R60-D63 PolarHBondContact NH2-OD2 2.89Å
61	I	72.6	Confident	63.7	Low	124 Å²	124	111.7 Å²	111.7	64%	0.636	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-19.4	-177.2	64.7	174.5	0	0	0	112.6	D57 K59	D57-I61 VanDerWaalsContact CG-N 3.35Å; D57-I61 WeakPolarHBondContact OD1-CG1 3.32Å; D57-I61 PolarHBondContact OD1-N 2.9Å; D57-I61 PolarHBondContact OD2-N 3.28Å; K59-I61 HydrophobicContact CB-CG2 3.84Å; K59-I61 PolarHBondContact O-N 3.28Å
62	N	71.8	Confident	63.8	Low	86 Å²	86	110.6 Å²	110.6	46%	0.46	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.8	6.3	-177.8	-53.2	-69	0	0	0	113.8	D57 R60 D64 V65	D57-N62 WeakPolarHBondContact OD2-CB 3.42Å; D57-N62 PolarHBondContact OD2-N 3.01Å; D57-N62 PolarHBondContact OD2-ND2 3.25Å; R60-N62 VanDerWaalsContact C-N 3.28Å; R60-N62 PolarHBondContact O-N 3.35Å; N62-D64 PolarHBondContact O-N 3.1Å; N62-D64 VanDerWaalsContact O-N 3.14Å; N62-V65 PolarHBondContact O-N 3.08Å
63	D	64.8	Low	64.1	Low	51 Å²	51	110.7 Å²	110.7	27%	0.273	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.3	-29.8	-175.4	-91.5	23.6	0	0	0	113.6	R60	R60-D63 HydrophobicContact CB-CB 4.46Å; R60-D63 IonicContact CZ-OD2 3.09Å; R60-D63 IonicContact NE-OD2 2.67Å; R60-D63 PolarHBondContact NE-OD2 3.34Å; R60-D63 IonicContact NH2-OD2 2.69Å; R60-D63 PolarHBondContact NH2-OD2 2.89Å
64	D	61	Low	64.1	Low	161 Å²	161	108.8 Å²	108.8	86%	0.861	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-8.2	-174.6	-59.3	-36.4	0	0	0	113.8	N62	N62-D64 PolarHBondContact O-N 3.1Å; N62-D64 VanDerWaalsContact O-N 3.14Å
65	V	57.7	Low	64.1	Low	108 Å²	108	106 Å²	106	66%	0.655	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	-23.8	-164	179.4	0	0	0	0	113.8	N62	N62-V65 PolarHBondContact O-N 3.08Å
66	V	55.9	Low	63.7	Low	104 Å²	104	105.5 Å²	105.5	63%	0.63	54%	0.536	S	S	*	.			trans	-140.5	59.4	-168.8	-164.1	0	0	0	0	112.9
67	K	58.7	Low	63.3	Low	161 Å²	161	100 Å²	100	70%	0.7	53%	0.528	S	S	*	.			trans	-113.3	90.6	159.3	-63.2	-177.6	-171.5	174.3	0	106.7
68	V	58.8	Low	62.4	Low	74 Å²	74	103.6 Å²	103.6	45%	0.448	56%	0.561	S	S	.	*			trans	-114.1	105.2	173.3	-172.4	0	0	0	0	105.9	I73	V68-I73 HydrophobicContact CG1-CD1 3.53Å; V68-I73 HydrophobicContact CG1-CG1 3.66Å
69	D	63.8	Low	61.6	Low	100 Å²	100	102 Å²	102	54%	0.535	56%	0.562	S	S	.	*			trans	-88.6	156.7	-179	-67.9	-40.5	0	0	0	110.3	E71 D72	D69-E71 PolarHBondContact O-N 3.33Å; D69-D72 PolarHBondContact N-OD2 3.35Å; D69-D72 WeakPolarHBondContact O-CB 3.49Å; D69-D72 PolarHBondContact O-N 3.23Å
70	F	59	Low	60.5	Low	12 Å²	12	98.3 Å²	98.3	5%	0.053	55%	0.554	C	S	.	*	H	α-helix	trans	-57.6	-35.4	-178.8	174.9	-103.9	0	0	0	111.8	D72 I73 I74 W87 F91 F94	F70-D72 VanDerWaalsContact C-N 3.28Å; F70-D72 PolarHBondContact O-N 3.09Å; F70-I73 PolarHBondContact O-N 3.35Å; F70-I74 HydrophobicContact CE2-CB 4.4Å; F70-I74 HydrophobicContact CE2-CG1 4.2Å; F70-I74 HydrophobicContact CZ-CB 4.26Å; F70-I74 HydrophobicContact CZ-CG1 4.46Å; F70-I74 HydrophobicContact CZ-CG2 4.46Å; F70-I74 PolarHBondContact O-N 3.18Å; F70-W87 HydrophobicContact CD1-CZ2 4.38Å; F70-W87 HydrophobicContact CE1-CD2 4.42Å; F70-W87 HydrophobicContact CE1-CE3 4.36Å; F70-W87 AromaticContact CE1-CH2 3.95Å; F70-W87 HydrophobicContact CE1-CH2 3.95Å; F70-W87 HydrophobicContact CE1-CZ2 4Å; F70-W87 HydrophobicContact CE1-CZ3 4.11Å; F70-F91 HydrophobicContact CB-CD2 3.59Å; F70-F91 HydrophobicContact CB-CE2 3.89Å; F70-F91 HydrophobicContact CD1-CB 4.07Å; F70-F91 AromaticContact CD1-CD2 3.63Å; F70-F91 HydrophobicContact CD1-CD2 3.63Å; F70-F91 HydrophobicContact CD1-CG 4.36Å; F70-F91 HydrophobicContact CE1-CB 4.12Å; F70-F91 HydrophobicContact CE1-CD2 4.49Å; F70-F91 HydrophobicContact CG-CB 4.49Å; F70-F91 AromaticContact CG-CD2 3.75Å; F70-F91 HydrophobicContact CG-CD2 3.75Å; F70-F94 HydrophobicContact CB-CD1 3.97Å; F70-F94 HydrophobicContact CB-CE1 4.25Å; F70-F94 HydrophobicContact CD2-CB 3.64Å; F70-F94 AromaticContact CD2-CD1 3.47Å; F70-F94 HydrophobicContact CD2-CD1 3.47Å; F70-F94 VanDerWaalsContact CD2-CD1 3.47Å; F70-F94 HydrophobicContact CD2-CD2 4.23Å; F70-F94 HydrophobicContact CD2-CE1 4.18Å; F70-F94 AromaticContact CD2-CG 3.5Å; F70-F94 HydrophobicContact CD2-CG 3.5Å; F70-F94 HydrophobicContact CE2-CB 3.79Å; F70-F94 HydrophobicContact CE2-CD1 4.43Å; F70-F94 HydrophobicContact CE2-CG 4.03Å; F70-F94 HydrophobicContact CG-CD1 4.17Å
71	E	59.3	Low	59.9	Low	123 Å²	123	99.1 Å²	99.1	58%	0.575	56%	0.558	S	S	*	*	H	α-helix	trans	-68.2	-25	178.3	-64.8	166.1	-173.6	0	0	112.6	D69 I73	D69-E71 PolarHBondContact O-N 3.33Å; E71-I73 VanDerWaalsContact C-N 3.33Å
72	D	60.7	Low	59.2	Low	114 Å²	114	95.6 Å²	95.6	61%	0.61	55%	0.545	S	S	*	.	H	α-helix	trans	-76.6	-20.9	174.8	-63.1	-38.2	0	0	0	112.5	D69 F70	D69-D72 PolarHBondContact N-OD2 3.35Å; D69-D72 WeakPolarHBondContact O-CB 3.49Å; D69-D72 PolarHBondContact O-N 3.23Å; F70-D72 VanDerWaalsContact C-N 3.28Å; F70-D72 PolarHBondContact O-N 3.09Å
73	I	63.8	Low	58.7	Low	89 Å²	89	100 Å²	100	46%	0.456	56%	0.56	S	S	.	*	H	α-helix	trans	-102.9	-39	-175.6	-57.3	164.7	0	0	0	111.4	V68 F70 E71 F94	V68-I73 HydrophobicContact CG1-CD1 3.53Å; V68-I73 HydrophobicContact CG1-CG1 3.66Å; F70-I73 PolarHBondContact O-N 3.35Å; E71-I73 VanDerWaalsContact C-N 3.33Å; I73-F94 HydrophobicContact CD1-CE1 4.03Å; I73-F94 HydrophobicContact CD1-CE2 4.06Å; I73-F94 HydrophobicContact CD1-CZ 3.31Å
74	I	61.8	Low	58.7	Low	86 Å²	86	103.1 Å²	103.1	44%	0.441	58%	0.577	S	S	.	*	S	Bend	trans	-126.2	86.3	179.2	-55.9	-78.8	0	0	0	106.5	F70 W87	F70-I74 HydrophobicContact CE2-CB 4.4Å; F70-I74 HydrophobicContact CE2-CG1 4.2Å; F70-I74 HydrophobicContact CZ-CB 4.26Å; F70-I74 HydrophobicContact CZ-CG1 4.46Å; F70-I74 HydrophobicContact CZ-CG2 4.46Å; F70-I74 PolarHBondContact O-N 3.18Å; I74-W87 HydrophobicContact CG2-CH2 4.43Å; I74-W87 HydrophobicContact CG2-CZ3 4.09Å; I74-W87 VanDerWaalsContact O-CH2 3.28Å; I74-W87 WeakPolarHBondContact O-CH2 3.07Å
75	A	59	Low	59	Low	82 Å²	82	97.7 Å²	97.7	68%	0.678	56%	0.559	S	S	*	*			trans	-92.8	109.4	174	0	0	0	0	0	109.5
76	E	59.8	Low	59.7	Low	64 Å²	64	96.6 Å²	96.6	30%	0.299	55%	0.552	S	S	.	*			trans	-74.3	128.5	166.3	-79.8	-179.4	-165.4	0	0	109.4	S82 W87	E76-S82 VanDerWaalsContact CD-OG 3.22Å; E76-S82 WeakPolarHBondContact OE1-CB 3.49Å; E76-S82 PolarHBondContact OE1-OG 3.39Å; E76-S82 WeakPolarHBondContact OE2-CB 3.24Å; E76-S82 PolarHBondContact OE2-N 2.97Å; E76-S82 PolarHBondContact OE2-OG 3.23Å; E76-W87 HydrophobicContact CB-CH2 4.21Å; E76-W87 HydrophobicContact CB-CZ3 4.09Å; E76-W87 VanDerWaalsContact CD-CE3 3.5Å; E76-W87 HydrophobicContact CG-CE3 4.19Å; E76-W87 HydrophobicContact CG-CH2 4.1Å; E76-W87 HydrophobicContact CG-CZ3 3.5Å; E76-W87 VanDerWaalsContact OE1-CE3 3.26Å; E76-W87 VanDerWaalsContact OE1-CZ3 3.31Å; E76-W87 WeakPolarHBondContact OE1-CZ3 3.33Å
77	P	58.1	Low	60.5	Low	90 Å²	90	94.9 Å²	94.9	58%	0.584	53%	0.534	S	S	*	.			trans	-69.5	145.6	179.1	27.6	-33	0	0	0	111.4	G79 T80	P77-G79 PolarHBondContact O-N 2.85Å; P77-T80 PolarHBondContact O-N 2.69Å
78	A	49	Very low	61	Low	102 Å²	102	94.2 Å²	94.2	84%	0.843	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	89.8	177.2	0	0	0	0	0	111.2
79	G	55.3	Low	61.8	Low	62 Å²	62	93 Å²	93	64%	0.639	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	158.8	-21.2	-179.3	0	0	0	0	0	115.7	P77	P77-G79 PolarHBondContact O-N 2.85Å
80	T	51.5	Low	62.3	Low	98 Å²	98	90.7 Å²	90.7	60%	0.601	52%	0.521	S	S	*	.			trans	-134	83.5	177.2	47.9	0	0	0	0	109.9	P77	P77-T80 PolarHBondContact O-N 2.69Å
81	Y	55.3	Low	63.1	Low	190 Å²	190	94.5 Å²	94.5	75%	0.745	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-75.8	123.6	177.2	-66.3	-81.8	0	0	0	110.4
82	S	57.8	Low	63.7	Low	50 Å²	50	92.3 Å²	92.3	35%	0.35	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-61.4	156.2	160.6	-66.3	0	0	0	0	110.4	E76 D84	E76-S82 VanDerWaalsContact CD-OG 3.22Å; E76-S82 WeakPolarHBondContact OE1-CB 3.49Å; E76-S82 PolarHBondContact OE1-OG 3.39Å; E76-S82 WeakPolarHBondContact OE2-CB 3.24Å; E76-S82 PolarHBondContact OE2-N 2.97Å; E76-S82 PolarHBondContact OE2-OG 3.23Å; S82-D84 PolarHBondContact O-N 2.84Å
83	F	62.6	Low	64.5	Low	180 Å²	180	91.1 Å²	91.1	79%	0.789	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-53.6	128.3	175.7	-137.5	-94.1	0	0	0	110.2	G85 V86 W87	F83-G85 PolarHBondContact O-N 3.36Å; F83-V86 HydrophobicContact CB-CG2 4.22Å; F83-V86 WeakPolarHBondContact O-CB 3.36Å; F83-V86 PolarHBondContact O-N 3.01Å; F83-W87 PolarHBondContact O-N 3.06Å
84	D	64.6	Low	65.1	Low	116 Å²	116	89.8 Å²	89.8	62%	0.62	52%	0.521	S	S	*	.	H	α-helix	trans	-50.3	-32.8	-174	-69.6	-13.3	0	0	0	114	S82 K88	S82-D84 PolarHBondContact O-N 2.84Å; D84-K88 WeakPolarHBondContact O-CB 3.38Å; D84-K88 WeakPolarHBondContact O-CG 3.41Å; D84-K88 PolarHBondContact O-N 2.78Å
85	G	65.8	Low	65.6	Low	47 Å²	47	88.4 Å²	88.4	49%	0.485	52%	0.516	S	S	.	.	H	α-helix	trans	-67.7	-37.1	176.6	0	0	0	0	0	113.7	F83 A89	F83-G85 PolarHBondContact O-N 3.36Å; G85-A89 WeakPolarHBondContact O-CB 3.49Å; G85-A89 PolarHBondContact O-N 3.1Å
86	V	72.6	Confident	66.4	Low	85 Å²	85	87.8 Å²	87.8	52%	0.515	50%	0.504	S	S	.	.	H	α-helix	trans	-74.3	-37.8	178.1	-180	0	0	0	0	110.1	F83 S90	F83-V86 HydrophobicContact CB-CG2 4.22Å; F83-V86 WeakPolarHBondContact O-CB 3.36Å; F83-V86 PolarHBondContact O-N 3.01Å; V86-S90 VanDerWaalsContact O-CB 3.25Å; V86-S90 WeakPolarHBondContact O-CB 3.03Å; V86-S90 PolarHBondContact O-N 3.36Å; V86-S90 PolarHBondContact O-OG 2.99Å
87	W	72.6	Confident	67.3	Low	68 Å²	68	88.8 Å²	88.8	26%	0.258	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-50.8	175.4	-173.3	-107.2	0	0	0	111.6	F70 I74 E76 F83 A89 S90 F91	F70-W87 HydrophobicContact CD1-CZ2 4.38Å; F70-W87 HydrophobicContact CE1-CD2 4.42Å; F70-W87 HydrophobicContact CE1-CE3 4.36Å; F70-W87 AromaticContact CE1-CH2 3.95Å; F70-W87 HydrophobicContact CE1-CH2 3.95Å; F70-W87 HydrophobicContact CE1-CZ2 4Å; F70-W87 HydrophobicContact CE1-CZ3 4.11Å; I74-W87 HydrophobicContact CG2-CH2 4.43Å; I74-W87 HydrophobicContact CG2-CZ3 4.09Å; I74-W87 VanDerWaalsContact O-CH2 3.28Å; I74-W87 WeakPolarHBondContact O-CH2 3.07Å; E76-W87 HydrophobicContact CB-CH2 4.21Å; E76-W87 HydrophobicContact CB-CZ3 4.09Å; E76-W87 VanDerWaalsContact CD-CE3 3.5Å; E76-W87 HydrophobicContact CG-CE3 4.19Å; E76-W87 HydrophobicContact CG-CH2 4.1Å; E76-W87 HydrophobicContact CG-CZ3 3.5Å; E76-W87 VanDerWaalsContact OE1-CE3 3.26Å; E76-W87 VanDerWaalsContact OE1-CZ3 3.31Å; E76-W87 WeakPolarHBondContact OE1-CZ3 3.33Å; F83-W87 PolarHBondContact O-N 3.06Å; W87-A89 PolarHBondContact O-N 3.27Å; W87-S90 PolarHBondContact O-N 3.47Å; W87-F91 WeakPolarHBondContact O-CB 3.49Å; W87-F91 PolarHBondContact O-N 3.03Å
88	K	70.5	Confident	68.1	Low	146 Å²	146	89.8 Å²	89.8	64%	0.635	51%	0.51	S	S	*	.	H	α-helix	trans	-62.9	-39.3	176.9	-72.9	-178.4	-179.3	-176	0	113	D84 T92	D84-K88 WeakPolarHBondContact O-CB 3.38Å; D84-K88 WeakPolarHBondContact O-CG 3.41Å; D84-K88 PolarHBondContact O-N 2.78Å; K88-T92 WeakPolarHBondContact O-CB 3.32Å; K88-T92 PolarHBondContact O-N 3.47Å; K88-T92 PolarHBondContact O-OG1 2.85Å
89	A	74.8	Confident	69.3	Low	50 Å²	50	91.1 Å²	91.1	41%	0.413	49%	0.494	S	S	.	.	H	α-helix	trans	-65.7	-42.4	176.1	0	0	0	0	0	111.3	G85 W87 T92 T93	G85-A89 WeakPolarHBondContact O-CB 3.49Å; G85-A89 PolarHBondContact O-N 3.1Å; W87-A89 PolarHBondContact O-N 3.27Å; A89-T92 PolarHBondContact O-N 3.11Å; A89-T93 WeakPolarHBondContact O-CB 3.32Å; A89-T93 PolarHBondContact O-N 3.32Å; A89-T93 PolarHBondContact O-OG1 3.44Å; A89-T93 VanDerWaalsContact O-OG1 3.09Å
90	S	74.6	Confident	70.5	Confident	51 Å²	51	96 Å²	96	36%	0.357	49%	0.493	S	S	.	.	H	α-helix	trans	-65.2	-45.1	179.2	-59.9	0	0	0	0	111.7	V86 W87 T92 T93 F94	V86-S90 VanDerWaalsContact O-CB 3.25Å; V86-S90 WeakPolarHBondContact O-CB 3.03Å; V86-S90 PolarHBondContact O-N 3.36Å; V86-S90 PolarHBondContact O-OG 2.99Å; W87-S90 PolarHBondContact O-N 3.47Å; S90-T92 VanDerWaalsContact C-N 3.34Å; S90-T92 PolarHBondContact O-N 3.36Å; S90-T93 PolarHBondContact O-N 2.85Å; S90-F94 WeakPolarHBondContact O-CB 3.38Å; S90-F94 PolarHBondContact O-N 3.34Å
91	F	74.9	Confident	71.9	Confident	92 Å²	92	94.4 Å²	94.4	40%	0.404	49%	0.486	S	S	.	.	H	α-helix	trans	-57.3	-46.3	173.7	177.8	-97.1	0	0	0	112	F70 W87 T95	F70-F91 HydrophobicContact CB-CD2 3.59Å; F70-F91 HydrophobicContact CB-CE2 3.89Å; F70-F91 HydrophobicContact CD1-CB 4.07Å; F70-F91 AromaticContact CD1-CD2 3.63Å; F70-F91 HydrophobicContact CD1-CD2 3.63Å; F70-F91 HydrophobicContact CD1-CG 4.36Å; F70-F91 HydrophobicContact CE1-CB 4.12Å; F70-F91 HydrophobicContact CE1-CD2 4.49Å; F70-F91 HydrophobicContact CG-CB 4.49Å; F70-F91 AromaticContact CG-CD2 3.75Å; F70-F91 HydrophobicContact CG-CD2 3.75Å; W87-F91 WeakPolarHBondContact O-CB 3.49Å; W87-F91 PolarHBondContact O-N 3.03Å; F91-T95 WeakPolarHBondContact O-CB 3.38Å; F91-T95 PolarHBondContact O-N 3Å; F91-T95 PolarHBondContact O-OG1 3.23Å
92	T	73.3	Confident	73.1	Confident	77 Å²	77	92.7 Å²	92.7	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-66.5	-50.4	-179.1	-58.5	0	0	0	0	111.2	K88 A89 S90 F94 T95 V96	K88-T92 WeakPolarHBondContact O-CB 3.32Å; K88-T92 PolarHBondContact O-N 3.47Å; K88-T92 PolarHBondContact O-OG1 2.85Å; A89-T92 PolarHBondContact O-N 3.11Å; S90-T92 VanDerWaalsContact C-N 3.34Å; S90-T92 PolarHBondContact O-N 3.36Å; T92-F94 VanDerWaalsContact C-N 3.32Å; T92-F94 PolarHBondContact O-N 3.27Å; T92-T95 PolarHBondContact O-N 3.23Å; T92-V96 HydrophobicContact CG2-CG2 4.34Å; T92-V96 WeakPolarHBondContact O-CB 3.41Å; T92-V96 VanDerWaalsContact O-CG2 3.23Å; T92-V96 WeakPolarHBondContact O-CG2 3.38Å; T92-V96 PolarHBondContact O-N 2.82Å
93	T	77.9	Confident	74.2	Confident	89 Å²	89	96.5 Å²	96.5	55%	0.546	49%	0.486	S	S	.	.	H	α-helix	trans	-64.4	-36.8	-179.5	-60.8	0	0	0	0	112	A89 S90 T97	A89-T93 WeakPolarHBondContact O-CB 3.32Å; A89-T93 PolarHBondContact O-N 3.32Å; A89-T93 PolarHBondContact O-OG1 3.44Å; A89-T93 VanDerWaalsContact O-OG1 3.09Å; S90-T93 PolarHBondContact O-N 2.85Å; T93-T97 WeakPolarHBondContact O-CB 3.31Å; T93-T97 PolarHBondContact O-N 2.92Å; T93-T97 PolarHBondContact O-OG1 3.44Å
94	F	75.3	Confident	75.1	Confident	60 Å²	60	93.9 Å²	93.9	26%	0.263	48%	0.479	S	S	.	.	H	α-helix	trans	-63.1	-50.2	174.9	176.5	-98.7	0	0	0	111.8	F70 I73 S90 T92 V96 T97 K98	F70-F94 HydrophobicContact CB-CD1 3.97Å; F70-F94 HydrophobicContact CB-CE1 4.25Å; F70-F94 HydrophobicContact CD2-CB 3.64Å; F70-F94 AromaticContact CD2-CD1 3.47Å; F70-F94 HydrophobicContact CD2-CD1 3.47Å; F70-F94 VanDerWaalsContact CD2-CD1 3.47Å; F70-F94 HydrophobicContact CD2-CD2 4.23Å; F70-F94 HydrophobicContact CD2-CE1 4.18Å; F70-F94 AromaticContact CD2-CG 3.5Å; F70-F94 HydrophobicContact CD2-CG 3.5Å; F70-F94 HydrophobicContact CE2-CB 3.79Å; F70-F94 HydrophobicContact CE2-CD1 4.43Å; F70-F94 HydrophobicContact CE2-CG 4.03Å; F70-F94 HydrophobicContact CG-CD1 4.17Å; I73-F94 HydrophobicContact CD1-CE1 4.03Å; I73-F94 HydrophobicContact CD1-CE2 4.06Å; I73-F94 HydrophobicContact CD1-CZ 3.31Å; S90-F94 WeakPolarHBondContact O-CB 3.38Å; S90-F94 PolarHBondContact O-N 3.34Å; T92-F94 VanDerWaalsContact C-N 3.32Å; T92-F94 PolarHBondContact O-N 3.27Å; F94-V96 PolarHBondContact O-N 2.97Å; F94-T97 PolarHBondContact O-N 3.43Å; F94-K98 HydrophobicContact CE1-CD 4.25Å; F94-K98 HydrophobicContact CZ-CD 4.35Å; F94-K98 VanDerWaalsContact O-CB 3.31Å; F94-K98 WeakPolarHBondContact O-CB 3.39Å; F94-K98 PolarHBondContact O-N 3.25Å
95	T	73.2	Confident	75.8	Confident	57 Å²	57	93 Å²	93	35%	0.35	47%	0.474	S	S	.	.	H	α-helix	trans	-63.6	-44.3	-178	-59.6	0	0	0	0	111.7	F91 T92 Y99	F91-T95 WeakPolarHBondContact O-CB 3.38Å; F91-T95 PolarHBondContact O-N 3Å; F91-T95 PolarHBondContact O-OG1 3.23Å; T92-T95 PolarHBondContact O-N 3.23Å; T95-Y99 WeakPolarHBondContact O-CB 3.42Å; T95-Y99 PolarHBondContact O-N 2.79Å
96	V	75.7	Confident	76.7	Confident	70 Å²	70	93.5 Å²	93.5	42%	0.424	47%	0.468	S	S	.	.	H	α-helix	trans	-64	-49.3	177.9	173	0	0	0	0	110.3	T92 F94 K98 Y99 W100	T92-V96 HydrophobicContact CG2-CG2 4.34Å; T92-V96 WeakPolarHBondContact O-CB 3.41Å; T92-V96 VanDerWaalsContact O-CG2 3.23Å; T92-V96 WeakPolarHBondContact O-CG2 3.38Å; T92-V96 PolarHBondContact O-N 2.82Å; F94-V96 PolarHBondContact O-N 2.97Å; V96-K98 PolarHBondContact O-N 2.94Å; V96-Y99 PolarHBondContact O-N 2.94Å; V96-W100 PolarHBondContact O-N 3.39Å
97	T	77.9	Confident	77.1	Confident	85 Å²	85	92.3 Å²	92.3	52%	0.521	47%	0.467	S	S	.	.	H	α-helix	trans	-60.4	-44.3	179.5	-59.6	0	0	0	0	111.6	T93 F94 Y99 W100 C101	T93-T97 WeakPolarHBondContact O-CB 3.31Å; T93-T97 PolarHBondContact O-N 2.92Å; T93-T97 PolarHBondContact O-OG1 3.44Å; F94-T97 PolarHBondContact O-N 3.43Å; T97-Y99 VanDerWaalsContact C-N 3.34Å; T97-Y99 PolarHBondContact O-N 2.88Å; T97-W100 PolarHBondContact O-N 2.9Å; T97-C101 WeakPolarHBondContact O-CB 3.46Å; T97-C101 PolarHBondContact O-N 2.85Å
98	K	75.8	Confident	77.7	Confident	111 Å²	111	95.2 Å²	95.2	48%	0.483	49%	0.487	S	S	.	.	H	α-helix	trans	-58.3	-45.6	175.8	-177.6	177	71.3	89.9	0	111.7	F94 V96 Y102	F94-K98 HydrophobicContact CE1-CD 4.25Å; F94-K98 HydrophobicContact CZ-CD 4.35Å; F94-K98 VanDerWaalsContact O-CB 3.31Å; F94-K98 WeakPolarHBondContact O-CB 3.39Å; F94-K98 PolarHBondContact O-N 3.25Å; V96-K98 PolarHBondContact O-N 2.94Å; K98-Y102 VanDerWaalsContact O-CB 3.29Å; K98-Y102 WeakPolarHBondContact O-CB 3.23Å; K98-Y102 PolarHBondContact O-N 3.46Å
99	Y	74.6	Confident	78.5	Confident	129 Å²	129	92.1 Å²	92.1	51%	0.506	48%	0.48	S	S	.	.	H	α-helix	trans	-65.6	-46.5	-179.3	-178.3	-102.6	0	0	0	112.7	T95 V96 T97 Y102 R103	T95-Y99 WeakPolarHBondContact O-CB 3.42Å; T95-Y99 PolarHBondContact O-N 2.79Å; V96-Y99 PolarHBondContact O-N 2.94Å; T97-Y99 VanDerWaalsContact C-N 3.34Å; T97-Y99 PolarHBondContact O-N 2.88Å; Y99-Y102 PolarHBondContact O-N 3.25Å; Y99-R103 HydrophobicContact CE1-CG 4.34Å; Y99-R103 WeakPolarHBondContact O-CG 3.41Å; Y99-R103 PolarHBondContact O-N 3.33Å; Y99-R103 PolarHBondContact OH-NH1 2.92Å
100	W	78.5	Confident	79.1	Confident	164 Å²	164	91 Å²	91	62%	0.621	47%	0.474	S	S	*	.	H	α-helix	trans	-67.2	-41.4	178	-79.4	99.8	0	0	0	112.5	V96 T97 R103 L104	V96-W100 PolarHBondContact O-N 3.39Å; T97-W100 PolarHBondContact O-N 2.9Å; W100-R103 PolarHBondContact O-N 2.98Å; W100-L104 WeakPolarHBondContact O-CB 3.39Å; W100-L104 PolarHBondContact O-N 3.22Å
101	C	81.1	Confident	79.6	Confident	66 Å²	66	94 Å²	94	45%	0.446	48%	0.484	S	S	.	.	H	α-helix	trans	-59.6	-48.6	174.6	-170.9	0	0	0	0	110.8	T97 R103 L104 L105	T97-C101 WeakPolarHBondContact O-CB 3.46Å; T97-C101 PolarHBondContact O-N 2.85Å; C101-R103 PolarHBondContact O-N 2.91Å; C101-L104 PolarHBondContact O-N 3.29Å; C101-L105 WeakPolarHBondContact O-CD1 3.24Å; C101-L105 PolarHBondContact O-N 3.33Å; C101-L105 VanDerWaalsContact SG-CD1 3.5Å
102	Y	81.6	Confident	80.3	Confident	153 Å²	153	92.7 Å²	92.7	60%	0.6	49%	0.485	S	S	*	.	H	α-helix	trans	-58.6	-44.1	176.4	178.2	-101.3	0	0	0	112.8	K98 Y99 L104 T106	K98-Y102 VanDerWaalsContact O-CB 3.29Å; K98-Y102 WeakPolarHBondContact O-CB 3.23Å; K98-Y102 PolarHBondContact O-N 3.46Å; Y99-Y102 PolarHBondContact O-N 3.25Å; Y102-L104 PolarHBondContact O-N 3.28Å; Y102-T106 VanDerWaalsContact O-CB 3.22Å; Y102-T106 WeakPolarHBondContact O-CB 3.49Å; Y102-T106 PolarHBondContact O-N 2.94Å; Y102-T106 PolarHBondContact O-OG1 3.5Å
103	R	79.7	Confident	80.9	Confident	130 Å²	130	93 Å²	93	49%	0.491	48%	0.483	S	S	.	.	H	α-helix	trans	-62.8	-42	177.3	-76.2	-175.8	68.2	167.8	-1	112.1	Y99 W100 C101 A107	Y99-R103 HydrophobicContact CE1-CG 4.34Å; Y99-R103 WeakPolarHBondContact O-CG 3.41Å; Y99-R103 PolarHBondContact O-N 3.33Å; Y99-R103 PolarHBondContact OH-NH1 2.92Å; W100-R103 PolarHBondContact O-N 2.98Å; C101-R103 PolarHBondContact O-N 2.91Å; R103-A107 VanDerWaalsContact O-CB 3.29Å; R103-A107 WeakPolarHBondContact O-CB 3.21Å; R103-A107 PolarHBondContact O-N 3.41Å
104	L	81.9	Confident	81.4	Confident	126 Å²	126	91.8 Å²	91.8	66%	0.66	48%	0.482	S	S	*	.	H	α-helix	trans	-68.2	-46.1	179.6	-173.5	65.4	0	0	0	111.5	W100 C101 Y102 A107 L108	W100-L104 WeakPolarHBondContact O-CB 3.39Å; W100-L104 PolarHBondContact O-N 3.22Å; C101-L104 PolarHBondContact O-N 3.29Å; Y102-L104 PolarHBondContact O-N 3.28Å; L104-A107 PolarHBondContact O-N 3.49Å; L104-L108 WeakPolarHBondContact O-CB 3.4Å; L104-L108 PolarHBondContact O-N 3.17Å
105	L	78.9	Confident	82.1	Confident	98 Å²	98	94.4 Å²	94.4	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-63.2	-42.4	176.6	-90.7	82.9	0	0	0	111.6	C101 A107 L108 V109	C101-L105 WeakPolarHBondContact O-CD1 3.24Å; C101-L105 PolarHBondContact O-N 3.33Å; C101-L105 VanDerWaalsContact SG-CD1 3.5Å; L105-A107 VanDerWaalsContact C-N 3.35Å; L105-L108 PolarHBondContact O-N 2.97Å; L105-V109 WeakPolarHBondContact O-CB 3.41Å; L105-V109 PolarHBondContact O-N 3.49Å
106	T	84.6	Confident	83	Confident	57 Å²	57	96.8 Å²	96.8	35%	0.35	51%	0.508	S	S	.	.	I	π-helix	trans	-66.3	-38.1	177.9	-56.9	0	0	0	0	111.4	Y102 G110	Y102-T106 VanDerWaalsContact O-CB 3.22Å; Y102-T106 WeakPolarHBondContact O-CB 3.49Å; Y102-T106 PolarHBondContact O-N 2.94Å; Y102-T106 PolarHBondContact O-OG1 3.5Å; T106-G110 WeakPolarHBondContact O-CA 3.43Å; T106-G110 PolarHBondContact O-N 3.37Å
107	A	82.8	Confident	83.8	Confident	60 Å²	60	99.6 Å²	99.6	50%	0.496	51%	0.511	S	S	.	.	I	π-helix	trans	-66.4	-41.9	175.3	0	0	0	0	0	111.9	R103 L104 L105	R103-A107 VanDerWaalsContact O-CB 3.29Å; R103-A107 WeakPolarHBondContact O-CB 3.21Å; R103-A107 PolarHBondContact O-N 3.41Å; L104-A107 PolarHBondContact O-N 3.49Å; L105-A107 VanDerWaalsContact C-N 3.35Å
108	L	84.3	Confident	84.5	Confident	129 Å²	129	97.6 Å²	97.6	68%	0.675	51%	0.507	S	S	*	.	I	π-helix	trans	-74	-42.9	-177.5	-172.4	71.1	0	0	0	112.6	L104 L105 P112	L104-L108 WeakPolarHBondContact O-CB 3.4Å; L104-L108 PolarHBondContact O-N 3.17Å; L105-L108 PolarHBondContact O-N 2.97Å; L108-P112 VanDerWaalsContact O-CD 3.24Å; L108-P112 WeakPolarHBondContact O-CD 3.47Å; L108-P112 VanDerWaalsContact O-CG 3.25Å; L108-P112 WeakPolarHBondContact O-CG 3.3Å
109	V	87.9	Confident	85.3	Confident	81 Å²	81	97.3 Å²	97.3	49%	0.491	51%	0.51	S	S	.	.	I	π-helix	trans	-106.5	-29.9	-170.5	-174.2	0	0	0	0	112.2	L105 P112 L113	L105-V109 WeakPolarHBondContact O-CB 3.41Å; L105-V109 PolarHBondContact O-N 3.49Å; V109-P112 WeakPolarHBondContact O-CD 3.38Å; V109-L113 WeakPolarHBondContact O-CB 3.15Å; V109-L113 PolarHBondContact O-N 3.3Å
110	G	86.7	Confident	86.3	Confident	27 Å²	27	96 Å²	96	28%	0.278	51%	0.507	S	S	.	.	I	π-helix	trans	-65.1	-43.3	-176.7	0	0	0	0	0	113.2	T106 L113 A114	T106-G110 WeakPolarHBondContact O-CA 3.43Å; T106-G110 PolarHBondContact O-N 3.37Å; G110-L113 PolarHBondContact O-N 2.82Å; G110-A114 WeakPolarHBondContact O-CB 3.28Å; G110-A114 PolarHBondContact O-N 3.3Å
111	I	84.8	Confident	86.9	Confident	114 Å²	114	93.8 Å²	93.8	59%	0.585	50%	0.502	S	S	*	.	H	α-helix	trans	-65.5	-50.8	178.3	-59	169.4	0	0	0	111.1	L113 A114 L115	I111-L113 VanDerWaalsContact C-N 3.31Å; I111-L113 PolarHBondContact O-N 3.01Å; I111-A114 PolarHBondContact O-N 3.02Å; I111-L115 HydrophobicContact CG2-CD1 4.49Å; I111-L115 WeakPolarHBondContact O-CG 3.33Å; I111-L115 PolarHBondContact O-N 3.45Å; I111-L115 VanDerWaalsContact O-N 3.12Å
112	P	89.1	Confident	87.5	Confident	63 Å²	63	93.5 Å²	93.5	41%	0.409	50%	0.504	S	S	.	.	H	α-helix	trans	-57.8	-41.8	174.4	-27	35	0	0	0	113.5	L108 V109 L115 I116	L108-P112 VanDerWaalsContact O-CD 3.24Å; L108-P112 WeakPolarHBondContact O-CD 3.47Å; L108-P112 VanDerWaalsContact O-CG 3.25Å; L108-P112 WeakPolarHBondContact O-CG 3.3Å; V109-P112 WeakPolarHBondContact O-CD 3.38Å; P112-L115 PolarHBondContact O-N 2.91Å; P112-I116 WeakPolarHBondContact O-CG1 3.44Å; P112-I116 PolarHBondContact O-N 2.97Å
113	L	87.1	Confident	88.1	Confident	84 Å²	84	91 Å²	91	44%	0.44	50%	0.5	S	S	.	.	H	α-helix	trans	-66.8	-40.4	-178.8	-168.6	64	0	0	0	111.5	V109 G110 I111 L115 I116 W117	V109-L113 WeakPolarHBondContact O-CB 3.15Å; V109-L113 PolarHBondContact O-N 3.3Å; G110-L113 PolarHBondContact O-N 2.82Å; I111-L113 VanDerWaalsContact C-N 3.31Å; I111-L113 PolarHBondContact O-N 3.01Å; L113-L115 VanDerWaalsContact C-N 3.32Å; L113-L115 PolarHBondContact O-N 3.39Å; L113-I116 PolarHBondContact O-N 3.44Å; L113-W117 PolarHBondContact O-N 3.31Å
114	A	88.3	Confident	88.7	Confident	63 Å²	63	88.7 Å²	88.7	52%	0.521	50%	0.497	S	S	.	.	H	α-helix	trans	-61	-40.4	174.4	0	0	0	0	0	112	G110 I111 W117 G118	G110-A114 WeakPolarHBondContact O-CB 3.28Å; G110-A114 PolarHBondContact O-N 3.3Å; I111-A114 PolarHBondContact O-N 3.02Å; A114-W117 PolarHBondContact O-N 2.95Å; A114-G118 PolarHBondContact O-N 3.27Å
115	L	89.4	Confident	89.3	Confident	115 Å²	115	85.6 Å²	85.6	60%	0.602	49%	0.486	S	S	*	.	H	α-helix	trans	-63.9	-45	175.5	-70.2	173.3	0	0	0	112	I111 P112 L113 W117 G118 I119	I111-L115 HydrophobicContact CG2-CD1 4.49Å; I111-L115 WeakPolarHBondContact O-CG 3.33Å; I111-L115 PolarHBondContact O-N 3.45Å; I111-L115 VanDerWaalsContact O-N 3.12Å; P112-L115 PolarHBondContact O-N 2.91Å; L113-L115 VanDerWaalsContact C-N 3.32Å; L113-L115 PolarHBondContact O-N 3.39Å; L115-W117 PolarHBondContact O-N 3.28Å; L115-G118 PolarHBondContact O-N 3.49Å; L115-I119 WeakPolarHBondContact O-CG1 3.43Å; L115-I119 PolarHBondContact O-N 3.46Å
116	I	93	Very high	90.1	Very high	107 Å²	107	86.9 Å²	86.9	55%	0.549	49%	0.487	S	S	.	.	H	α-helix	trans	-59.8	-47.3	177.2	-67.8	165.5	0	0	0	110.4	P112 L113 G118 I119 F120	P112-I116 WeakPolarHBondContact O-CG1 3.44Å; P112-I116 PolarHBondContact O-N 2.97Å; L113-I116 PolarHBondContact O-N 3.44Å; I116-G118 PolarHBondContact O-N 2.95Å; I116-I119 PolarHBondContact O-N 3.37Å; I116-F120 WeakPolarHBondContact O-CB 3.06Å; I116-F120 PolarHBondContact O-N 3.01Å
117	W	91.7	Very high	90.5	Very high	130 Å²	130	87.3 Å²	87.3	49%	0.492	49%	0.49	S	S	.	.	H	α-helix	trans	-61.9	-42.1	176.8	-83	111.8	0	0	0	112.4	L113 A114 L115 I119 F120 F121	L113-W117 PolarHBondContact O-N 3.31Å; A114-W117 PolarHBondContact O-N 2.95Å; L115-W117 PolarHBondContact O-N 3.28Å; W117-I119 PolarHBondContact O-N 3.48Å; W117-F120 HydrophobicContact CE3-CD1 4.1Å; W117-F120 HydrophobicContact CZ3-CD1 4.01Å; W117-F120 HydrophobicContact CZ3-CE1 4.25Å; W117-F120 PolarHBondContact O-N 3.45Å; W117-F121 HydrophobicContact CE3-CD2 4.25Å; W117-F121 AromaticContact CE3-CE2 3.64Å; W117-F121 HydrophobicContact CE3-CE2 3.64Å; W117-F121 HydrophobicContact CE3-CZ 4.29Å; W117-F121 HydrophobicContact CZ3-CE2 4.2Å; W117-F121 HydrophobicContact CZ3-CZ 4.4Å; W117-F121 WeakPolarHBondContact O-CD2 3.4Å; W117-F121 PolarHBondContact O-N 2.9Å
118	G	93.1	Very high	91	Very high	42 Å²	42	89.4 Å²	89.4	43%	0.433	49%	0.489	S	S	.	.	H	α-helix	trans	-58.9	-47	176.3	0	0	0	0	0	112.6	A114 L115 I116 F120 F121 A122	A114-G118 PolarHBondContact O-N 3.27Å; L115-G118 PolarHBondContact O-N 3.49Å; I116-G118 PolarHBondContact O-N 2.95Å; G118-F120 PolarHBondContact O-N 2.71Å; G118-F121 PolarHBondContact O-N 2.94Å; G118-A122 WeakPolarHBondContact O-CB 3.28Å; G118-A122 PolarHBondContact O-N 2.81Å
119	I	93.1	Very high	91.4	Very high	106 Å²	106	88 Å²	88	54%	0.544	48%	0.481	S	S	.	.	H	α-helix	trans	-63.1	-43.1	176.6	-66.6	166.7	0	0	0	110.8	L115 I116 W117 F121 A122 I123	L115-I119 WeakPolarHBondContact O-CG1 3.43Å; L115-I119 PolarHBondContact O-N 3.46Å; I116-I119 PolarHBondContact O-N 3.37Å; W117-I119 PolarHBondContact O-N 3.48Å; I119-F121 PolarHBondContact O-N 3.48Å; I119-A122 WeakPolarHBondContact O-CB 3.36Å; I119-A122 PolarHBondContact O-N 3.37Å; I119-I123 HydrophobicContact CG2-CD1 3.85Å; I119-I123 HydrophobicContact CG2-CG1 4.44Å; I119-I123 WeakPolarHBondContact O-CG1 3.37Å; I119-I123 PolarHBondContact O-N 2.8Å
120	F	93.9	Very high	91.7	Very high	102 Å²	102	92.6 Å²	92.6	45%	0.447	49%	0.49	S	S	.	.	H	α-helix	trans	-59.3	-48.8	178.5	-176.6	-105.7	0	0	0	111.9	I116 W117 G118 A122 I123 L124	I116-F120 WeakPolarHBondContact O-CB 3.06Å; I116-F120 PolarHBondContact O-N 3.01Å; W117-F120 HydrophobicContact CE3-CD1 4.1Å; W117-F120 HydrophobicContact CZ3-CD1 4.01Å; W117-F120 HydrophobicContact CZ3-CE1 4.25Å; W117-F120 PolarHBondContact O-N 3.45Å; G118-F120 PolarHBondContact O-N 2.71Å; F120-A122 VanDerWaalsContact C-N 3.31Å; F120-A122 PolarHBondContact O-N 2.99Å; F120-I123 PolarHBondContact O-N 2.92Å; F120-L124 HydrophobicContact CD1-CD1 3.68Å; F120-L124 HydrophobicContact CD1-CG 4.31Å; F120-L124 HydrophobicContact CE1-CD1 3.25Å; F120-L124 HydrophobicContact CE1-CG 4.03Å; F120-L124 HydrophobicContact CZ-CD1 3.74Å; F120-L124 HydrophobicContact CZ-CD2 4.37Å; F120-L124 HydrophobicContact CZ-CG 4.13Å; F120-L124 WeakPolarHBondContact O-CB 3.27Å; F120-L124 WeakPolarHBondContact O-CG 3.35Å; F120-L124 PolarHBondContact O-N 3.34Å
121	F	92.2	Very high	91.9	Very high	117 Å²	117	93.4 Å²	93.4	51%	0.513	49%	0.494	S	S	.	.	H	α-helix	trans	-64.2	-34.3	176.5	-80.8	-66.5	0	0	0	112.8	W117 G118 I119 L124 S125	W117-F121 HydrophobicContact CE3-CD2 4.25Å; W117-F121 AromaticContact CE3-CE2 3.64Å; W117-F121 HydrophobicContact CE3-CE2 3.64Å; W117-F121 HydrophobicContact CE3-CZ 4.29Å; W117-F121 HydrophobicContact CZ3-CE2 4.2Å; W117-F121 HydrophobicContact CZ3-CZ 4.4Å; W117-F121 WeakPolarHBondContact O-CD2 3.4Å; W117-F121 PolarHBondContact O-N 2.9Å; G118-F121 PolarHBondContact O-N 2.94Å; I119-F121 PolarHBondContact O-N 3.48Å; F121-L124 HydrophobicContact CD1-CD1 4.45Å; F121-S125 VanDerWaalsContact O-CB 3.31Å; F121-S125 WeakPolarHBondContact O-CB 3.39Å; F121-S125 PolarHBondContact O-N 3.12Å; F121-S125 PolarHBondContact O-OG 3.49Å
122	A	93.9	Very high	92.3	Very high	60 Å²	60	90.9 Å²	90.9	50%	0.496	48%	0.484	S	S	.	.	H	α-helix	trans	-64.5	-46.7	175.2	0	0	0	0	0	111.9	G118 I119 F120 S125 F126	G118-A122 WeakPolarHBondContact O-CB 3.28Å; G118-A122 PolarHBondContact O-N 2.81Å; I119-A122 WeakPolarHBondContact O-CB 3.36Å; I119-A122 PolarHBondContact O-N 3.37Å; F120-A122 VanDerWaalsContact C-N 3.31Å; F120-A122 PolarHBondContact O-N 2.99Å; A122-S125 PolarHBondContact O-N 2.97Å; A122-F126 PolarHBondContact O-N 2.75Å
123	I	94.6	Very high	92.5	Very high	101 Å²	101	90.6 Å²	90.6	52%	0.518	48%	0.48	S	S	.	.	H	α-helix	trans	-63.8	-45.5	176.8	-65.2	168.3	0	0	0	110.5	I119 F120 S125 F126 V127	I119-I123 HydrophobicContact CG2-CD1 3.85Å; I119-I123 HydrophobicContact CG2-CG1 4.44Å; I119-I123 WeakPolarHBondContact O-CG1 3.37Å; I119-I123 PolarHBondContact O-N 2.8Å; F120-I123 PolarHBondContact O-N 2.92Å; I123-S125 VanDerWaalsContact C-N 3.28Å; I123-S125 PolarHBondContact O-N 2.87Å; I123-F126 WeakPolarHBondContact O-CB 3.46Å; I123-F126 PolarHBondContact O-N 3.46Å; I123-V127 HydrophobicContact CG2-CG2 4.41Å; I123-V127 WeakPolarHBondContact O-CG2 3.4Å; I123-V127 PolarHBondContact O-N 3.21Å
124	L	92.1	Very high	92.8	Very high	80 Å²	80	89.6 Å²	89.6	42%	0.419	48%	0.479	S	S	.	.	H	α-helix	trans	-57.6	-43	175.8	-78.6	-179.1	0	0	0	111.8	F120 F121 F126 V127 H128	F120-L124 HydrophobicContact CD1-CD1 3.68Å; F120-L124 HydrophobicContact CD1-CG 4.31Å; F120-L124 HydrophobicContact CE1-CD1 3.25Å; F120-L124 HydrophobicContact CE1-CG 4.03Å; F120-L124 HydrophobicContact CZ-CD1 3.74Å; F120-L124 HydrophobicContact CZ-CD2 4.37Å; F120-L124 HydrophobicContact CZ-CG 4.13Å; F120-L124 WeakPolarHBondContact O-CB 3.27Å; F120-L124 WeakPolarHBondContact O-CG 3.35Å; F120-L124 PolarHBondContact O-N 3.34Å; F121-L124 HydrophobicContact CD1-CD1 4.45Å; L124-F126 VanDerWaalsContact C-N 3.34Å; L124-F126 PolarHBondContact O-N 2.94Å; L124-V127 PolarHBondContact O-N 3.33Å; L124-H128 VanDerWaalsContact O-CB 3.27Å; L124-H128 WeakPolarHBondContact O-CB 3.44Å; L124-H128 PolarHBondContact O-N 3.34Å
125	S	94.3	Very high	92.9	Very high	61 Å²	61	90.6 Å²	90.6	43%	0.427	48%	0.481	S	S	.	.	H	α-helix	trans	-63.6	-41.8	178	-60.1	0	0	0	0	111.2	F121 A122 I123 H128 I129	F121-S125 VanDerWaalsContact O-CB 3.31Å; F121-S125 WeakPolarHBondContact O-CB 3.39Å; F121-S125 PolarHBondContact O-N 3.12Å; F121-S125 PolarHBondContact O-OG 3.49Å; A122-S125 PolarHBondContact O-N 2.97Å; I123-S125 VanDerWaalsContact C-N 3.28Å; I123-S125 PolarHBondContact O-N 2.87Å; S125-H128 PolarHBondContact O-N 2.97Å; S125-I129 WeakPolarHBondContact O-CD1 3.27Å; S125-I129 VanDerWaalsContact O-CG1 3.27Å; S125-I129 WeakPolarHBondContact O-CG1 3.37Å; S125-I129 PolarHBondContact O-N 2.94Å
126	F	94.3	Very high	93	Very high	125 Å²	125	88.7 Å²	88.7	55%	0.548	47%	0.474	S	S	.	.	H	α-helix	trans	-60.7	-52.2	174.5	-179.9	-95.1	0	0	0	111.5	A122 I123 L124 H128 I129 W130	A122-F126 PolarHBondContact O-N 2.75Å; I123-F126 WeakPolarHBondContact O-CB 3.46Å; I123-F126 PolarHBondContact O-N 3.46Å; L124-F126 VanDerWaalsContact C-N 3.34Å; L124-F126 PolarHBondContact O-N 2.94Å; F126-H128 VanDerWaalsContact C-N 3.28Å; F126-H128 PolarHBondContact O-N 3.39Å; F126-I129 PolarHBondContact O-N 2.89Å; F126-W130 AromaticContact CD2-CD1 3.23Å; F126-W130 HydrophobicContact CD2-CG 4.17Å; F126-W130 AromaticContact CD2-NE1 3.5Å; F126-W130 HydrophobicContact CE1-CB 4.5Å; F126-W130 AromaticContact CE2-CD1 3.26Å; F126-W130 HydrophobicContact CE2-CD2 4.33Å; F126-W130 AromaticContact CE2-CG 3.85Å; F126-W130 HydrophobicContact CE2-CG 3.85Å; F126-W130 AromaticContact CE2-NE1 3.43Å; F126-W130 AromaticContact CG-CD1 3.82Å; F126-W130 HydrophobicContact CZ-CB 4.38Å; F126-W130 AromaticContact CZ-CD1 3.88Å; F126-W130 HydrophobicContact CZ-CG 4.07Å; F126-W130 WeakPolarHBondContact O-CB 3.48Å; F126-W130 PolarHBondContact O-N 2.94Å
127	V	94.3	Very high	92.9	Very high	66 Å²	66	90 Å²	90	40%	0.4	48%	0.476	S	S	.	.	H	α-helix	trans	-59.8	-40.5	178.1	173.4	0	0	0	0	111.1	I123 L124 A131 V132	I123-V127 HydrophobicContact CG2-CG2 4.41Å; I123-V127 WeakPolarHBondContact O-CG2 3.4Å; I123-V127 PolarHBondContact O-N 3.21Å; L124-V127 PolarHBondContact O-N 3.33Å; V127-A131 HydrophobicContact CG1-CB 4.24Å; V127-A131 WeakPolarHBondContact O-CA 3.36Å; V127-A131 VanDerWaalsContact O-CB 3.28Å; V127-A131 WeakPolarHBondContact O-CB 3.2Å; V127-A131 PolarHBondContact O-N 3.2Å; V127-V132 HydrophobicContact CG1-CG2 4.42Å; V127-V132 PolarHBondContact O-N 3.24Å
128	H	92.2	Very high	92.9	Very high	104 Å²	104	86.6 Å²	86.6	48%	0.481	47%	0.472	S	S	.	.	I	π-helix	trans	-60.6	-50.3	178.4	179.9	-94.7	0	0	0	111.7	L124 S125 F126 V132 V133	L124-H128 VanDerWaalsContact O-CB 3.27Å; L124-H128 WeakPolarHBondContact O-CB 3.44Å; L124-H128 PolarHBondContact O-N 3.34Å; S125-H128 PolarHBondContact O-N 2.97Å; F126-H128 VanDerWaalsContact C-N 3.28Å; F126-H128 PolarHBondContact O-N 3.39Å; H128-V132 WeakPolarHBondContact O-CB 3.31Å; H128-V132 PolarHBondContact O-N 3.14Å; H128-V133 WeakPolarHBondContact O-CG2 3.35Å; H128-V133 PolarHBondContact O-N 3.47Å
129	I	93.3	Very high	92.8	Very high	100 Å²	100	92 Å²	92	51%	0.513	48%	0.481	S	S	.	.	I	π-helix	trans	-69.8	-44.2	-176.9	-64.4	160.5	0	0	0	111.4	S125 F126 P134	S125-I129 WeakPolarHBondContact O-CD1 3.27Å; S125-I129 VanDerWaalsContact O-CG1 3.27Å; S125-I129 WeakPolarHBondContact O-CG1 3.37Å; S125-I129 PolarHBondContact O-N 2.94Å; F126-I129 PolarHBondContact O-N 2.89Å; I129-P134 WeakPolarHBondContact O-CD 3.4Å
130	W	93.6	Very high	92.7	Very high	178 Å²	178	91.6 Å²	91.6	67%	0.674	48%	0.479	S	S	*	.	I	π-helix	trans	-93.4	-23.7	-169.1	-67.3	97	0	0	0	114.5	F126 P134	F126-W130 AromaticContact CD2-CD1 3.23Å; F126-W130 HydrophobicContact CD2-CG 4.17Å; F126-W130 AromaticContact CD2-NE1 3.5Å; F126-W130 HydrophobicContact CE1-CB 4.5Å; F126-W130 AromaticContact CE2-CD1 3.26Å; F126-W130 HydrophobicContact CE2-CD2 4.33Å; F126-W130 AromaticContact CE2-CG 3.85Å; F126-W130 HydrophobicContact CE2-CG 3.85Å; F126-W130 AromaticContact CE2-NE1 3.43Å; F126-W130 AromaticContact CG-CD1 3.82Å; F126-W130 HydrophobicContact CZ-CB 4.38Å; F126-W130 AromaticContact CZ-CD1 3.88Å; F126-W130 HydrophobicContact CZ-CG 4.07Å; F126-W130 WeakPolarHBondContact O-CB 3.48Å; F126-W130 PolarHBondContact O-N 2.94Å; W130-P134 WeakPolarHBondContact O-CG 3.09Å
131	A	91.6	Very high	92.5	Very high	44 Å²	44	92.8 Å²	92.8	36%	0.364	49%	0.489	S	S	.	.	I	π-helix	trans	-114.8	-54	178.1	0	0	0	0	0	111.6	V127 P134 C135	V127-A131 HydrophobicContact CG1-CB 4.24Å; V127-A131 WeakPolarHBondContact O-CA 3.36Å; V127-A131 VanDerWaalsContact O-CB 3.28Å; V127-A131 WeakPolarHBondContact O-CB 3.2Å; V127-A131 PolarHBondContact O-N 3.2Å; A131-P134 VanDerWaalsContact O-CD 3.28Å; A131-P134 WeakPolarHBondContact O-CD 3.47Å; A131-P134 WeakPolarHBondContact O-CG 3.34Å; A131-C135 WeakPolarHBondContact O-CB 3.14Å; A131-C135 PolarHBondContact O-N 3.41Å; A131-C135 PolarHBondContact O-SG 3.02Å
132	V	93.6	Very high	92.5	Very high	61 Å²	61	92.5 Å²	92.5	37%	0.37	49%	0.489	S	S	.	.	I	π-helix	trans	-66	-49	-172.8	-178.6	0	0	0	0	111.6	V127 H128 C135 V136	V127-V132 HydrophobicContact CG1-CG2 4.42Å; V127-V132 PolarHBondContact O-N 3.24Å; H128-V132 WeakPolarHBondContact O-CB 3.31Å; H128-V132 PolarHBondContact O-N 3.14Å; V132-C135 PolarHBondContact O-N 3.47Å; V132-V136 HydrophobicContact CG1-CG2 3.97Å; V132-V136 WeakPolarHBondContact O-CB 3.25Å; V132-V136 VanDerWaalsContact O-CG2 3.24Å; V132-V136 WeakPolarHBondContact O-CG2 3.33Å; V132-V136 PolarHBondContact O-N 2.96Å
133	V	93.4	Very high	92.2	Very high	56 Å²	56	91.7 Å²	91.7	34%	0.339	48%	0.478	S	S	.	.	H	α-helix	trans	-57.8	-50.6	179.7	172.7	0	0	0	0	112.3	H128 V136 K137	H128-V133 WeakPolarHBondContact O-CG2 3.35Å; H128-V133 PolarHBondContact O-N 3.47Å; V133-V136 PolarHBondContact O-N 3.25Å; V133-K137 HydrophobicContact CG1-CG 4.41Å; V133-K137 WeakPolarHBondContact O-CB 3.45Å; V133-K137 WeakPolarHBondContact O-CG 3.36Å; V133-K137 PolarHBondContact O-N 2.83Å
134	P	92.6	Very high	92	Very high	63 Å²	63	92.2 Å²	92.2	41%	0.409	48%	0.478	S	S	.	.	H	α-helix	trans	-66.1	-37	176.2	20	-27.9	0	0	0	113	I129 W130 A131 K137 S138	I129-P134 WeakPolarHBondContact O-CD 3.4Å; W130-P134 WeakPolarHBondContact O-CG 3.09Å; A131-P134 VanDerWaalsContact O-CD 3.28Å; A131-P134 WeakPolarHBondContact O-CD 3.47Å; A131-P134 WeakPolarHBondContact O-CG 3.34Å; P134-K137 PolarHBondContact O-N 2.91Å; P134-S138 WeakPolarHBondContact O-CB 3.49Å; P134-S138 PolarHBondContact O-N 3.04Å
135	C	90.1	Very high	91.7	Very high	84 Å²	84	92.1 Å²	92.1	57%	0.568	48%	0.483	S	S	*	.	H	α-helix	trans	-61.3	-45.6	174.3	-73.2	0	0	0	0	111.9	A131 V132 S138 Y139	A131-C135 WeakPolarHBondContact O-CB 3.14Å; A131-C135 PolarHBondContact O-N 3.41Å; A131-C135 PolarHBondContact O-SG 3.02Å; V132-C135 PolarHBondContact O-N 3.47Å; C135-S138 WeakPolarHBondContact O-CB 3.24Å; C135-S138 PolarHBondContact O-N 3.39Å; C135-Y139 WeakPolarHBondContact O-CB 3.12Å; C135-Y139 PolarHBondContact O-N 2.96Å
136	V	92.5	Very high	91.5	Very high	76 Å²	76	94.5 Å²	94.5	46%	0.461	49%	0.49	S	S	.	.	H	α-helix	trans	-62.3	-44.4	176.3	170.6	0	0	0	0	110.4	V132 V133 S138 Y139 L140	V132-V136 HydrophobicContact CG1-CG2 3.97Å; V132-V136 WeakPolarHBondContact O-CB 3.25Å; V132-V136 VanDerWaalsContact O-CG2 3.24Å; V132-V136 WeakPolarHBondContact O-CG2 3.33Å; V132-V136 PolarHBondContact O-N 2.96Å; V133-V136 PolarHBondContact O-N 3.25Å; V136-S138 VanDerWaalsContact C-N 3.32Å; V136-S138 PolarHBondContact O-N 2.87Å; V136-Y139 PolarHBondContact O-N 3.44Å; V136-L140 HydrophobicContact CG1-CD1 4.15Å; V136-L140 WeakPolarHBondContact O-CB 3.22Å; V136-L140 VanDerWaalsContact O-CG 3.3Å; V136-L140 WeakPolarHBondContact O-CG 3.48Å; V136-L140 PolarHBondContact O-N 3.33Å
137	K	90.8	Very high	91.3	Very high	133 Å²	133	92 Å²	92	58%	0.578	49%	0.488	S	S	*	.	H	α-helix	trans	-60.6	-41.3	175.3	-69.4	-81.1	-177.2	69.6	0	111.6	V133 P134 L140 I141	V133-K137 HydrophobicContact CG1-CG 4.41Å; V133-K137 WeakPolarHBondContact O-CB 3.45Å; V133-K137 WeakPolarHBondContact O-CG 3.36Å; V133-K137 PolarHBondContact O-N 2.83Å; P134-K137 PolarHBondContact O-N 2.91Å; K137-L140 PolarHBondContact O-N 3.17Å; K137-I141 WeakPolarHBondContact O-CG1 3.29Å; K137-I141 PolarHBondContact O-N 3.43Å
138	S	90.5	Very high	91.1	Very high	60 Å²	60	96.8 Å²	96.8	42%	0.42	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-47.4	176.6	-167.6	0	0	0	0	111.6	P134 C135 V136 L140 I141 E142	P134-S138 WeakPolarHBondContact O-CB 3.49Å; P134-S138 PolarHBondContact O-N 3.04Å; C135-S138 WeakPolarHBondContact O-CB 3.24Å; C135-S138 PolarHBondContact O-N 3.39Å; V136-S138 VanDerWaalsContact C-N 3.32Å; V136-S138 PolarHBondContact O-N 2.87Å; S138-L140 VanDerWaalsContact C-N 3.27Å; S138-L140 PolarHBondContact O-N 3.1Å; S138-I141 WeakPolarHBondContact O-CB 3.14Å; S138-I141 PolarHBondContact O-N 2.9Å; S138-E142 PolarHBondContact O-N 3.46Å
139	Y	91.8	Very high	91	Very high	154 Å²	154	96.2 Å²	96.2	60%	0.604	50%	0.502	S	S	*	.	H	α-helix	trans	-61.5	-36.1	177.5	-175.8	-103.4	0	0	0	112	C135 V136 I141 E142 T143	C135-Y139 WeakPolarHBondContact O-CB 3.12Å; C135-Y139 PolarHBondContact O-N 2.96Å; V136-Y139 PolarHBondContact O-N 3.44Å; Y139-I141 VanDerWaalsContact C-N 3.33Å; Y139-I141 PolarHBondContact O-N 3.21Å; Y139-E142 PolarHBondContact O-N 3.01Å; Y139-T143 HydrophobicContact CD1-CG2 3.96Å; Y139-T143 HydrophobicContact CD2-CG2 4.43Å; Y139-T143 HydrophobicContact CE1-CG2 3.49Å; Y139-T143 VanDerWaalsContact CE1-CG2 3.49Å; Y139-T143 HydrophobicContact CE2-CG2 4.01Å; Y139-T143 HydrophobicContact CG-CG2 4.41Å; Y139-T143 WeakPolarHBondContact O-CB 3.38Å; Y139-T143 WeakPolarHBondContact O-CG2 3.31Å; Y139-T143 PolarHBondContact O-N 2.85Å; Y139-T143 PolarHBondContact O-OG1 2.95Å
140	L	90.5	Very high	90.9	Very high	99 Å²	99	99 Å²	99	52%	0.518	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-37.5	173.1	-76	170.1	0	0	0	112.3	V136 K137 S138 T143 H144	V136-L140 HydrophobicContact CG1-CD1 4.15Å; V136-L140 WeakPolarHBondContact O-CB 3.22Å; V136-L140 VanDerWaalsContact O-CG 3.3Å; V136-L140 WeakPolarHBondContact O-CG 3.48Å; V136-L140 PolarHBondContact O-N 3.33Å; K137-L140 PolarHBondContact O-N 3.17Å; S138-L140 VanDerWaalsContact C-N 3.27Å; S138-L140 PolarHBondContact O-N 3.1Å; L140-T143 VanDerWaalsContact CA-OG1 3.32Å; L140-T143 WeakPolarHBondContact CA-OG1 3.4Å; L140-T143 PolarHBondContact O-OG1 3.38Å; L140-T143 VanDerWaalsContact O-OG1 3.06Å; L140-H144 VanDerWaalsContact O-CB 3.23Å; L140-H144 WeakPolarHBondContact O-CB 3.29Å; L140-H144 PolarHBondContact O-N 3.2Å
141	I	91.4	Very high	90.7	Very high	126 Å²	126	93 Å²	93	65%	0.646	49%	0.493	S	S	*	.	H	α-helix	trans	-68.7	-43.9	175.8	-64.8	164.6	0	0	0	110.5	K137 S138 Y139 H144 C145	K137-I141 WeakPolarHBondContact O-CG1 3.29Å; K137-I141 PolarHBondContact O-N 3.43Å; S138-I141 WeakPolarHBondContact O-CB 3.14Å; S138-I141 PolarHBondContact O-N 2.9Å; Y139-I141 VanDerWaalsContact C-N 3.33Å; Y139-I141 PolarHBondContact O-N 3.21Å; I141-H144 PolarHBondContact O-N 2.56Å; I141-C145 PolarHBondContact O-N 3.03Å
142	E	90.7	Very high	90.7	Very high	112 Å²	112	96.1 Å²	96.1	52%	0.523	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-48.2	176.9	-71.7	-177.5	175.6	0	0	112.1	S138 Y139 H144 C145 I146	S138-E142 PolarHBondContact O-N 3.46Å; Y139-E142 PolarHBondContact O-N 3.01Å; E142-H144 VanDerWaalsContact C-N 3.3Å; E142-H144 PolarHBondContact O-N 3.44Å; E142-C145 WeakPolarHBondContact O-CA 3.4Å; E142-C145 VanDerWaalsContact O-CB 3.31Å; E142-C145 WeakPolarHBondContact O-CB 3.4Å; E142-C145 PolarHBondContact O-N 2.81Å; E142-C145 VanDerWaalsContact O-N 3.1Å; E142-I146 WeakPolarHBondContact O-CG1 3.21Å; E142-I146 PolarHBondContact O-N 2.7Å
143	T	88.4	Confident	90.6	Very high	42 Å²	42	98.4 Å²	98.4	26%	0.258	51%	0.508	S	S	.	.	H	α-helix	trans	-63.4	-36	177.4	48.4	0	0	0	0	112.2	Y139 L140 C145 I146 S147	Y139-T143 HydrophobicContact CD1-CG2 3.96Å; Y139-T143 HydrophobicContact CD2-CG2 4.43Å; Y139-T143 HydrophobicContact CE1-CG2 3.49Å; Y139-T143 VanDerWaalsContact CE1-CG2 3.49Å; Y139-T143 HydrophobicContact CE2-CG2 4.01Å; Y139-T143 HydrophobicContact CG-CG2 4.41Å; Y139-T143 WeakPolarHBondContact O-CB 3.38Å; Y139-T143 WeakPolarHBondContact O-CG2 3.31Å; Y139-T143 PolarHBondContact O-N 2.85Å; Y139-T143 PolarHBondContact O-OG1 2.95Å; L140-T143 VanDerWaalsContact CA-OG1 3.32Å; L140-T143 WeakPolarHBondContact CA-OG1 3.4Å; L140-T143 PolarHBondContact O-OG1 3.38Å; L140-T143 VanDerWaalsContact O-OG1 3.06Å; T143-C145 VanDerWaalsContact C-N 3.31Å; T143-C145 PolarHBondContact O-N 2.67Å; T143-I146 PolarHBondContact O-N 2.91Å; T143-S147 WeakPolarHBondContact O-CB 3.19Å; T143-S147 PolarHBondContact O-N 3.44Å
144	H	90.6	Very high	90.5	Very high	113 Å²	113	97.7 Å²	97.7	52%	0.523	50%	0.503	S	S	.	.	H	α-helix	trans	-66.4	-34.1	174	-162.2	-74.1	0	0	0	112.2	L140 I141 E142 R148	L140-H144 VanDerWaalsContact O-CB 3.23Å; L140-H144 WeakPolarHBondContact O-CB 3.29Å; L140-H144 PolarHBondContact O-N 3.2Å; I141-H144 PolarHBondContact O-N 2.56Å; E142-H144 VanDerWaalsContact C-N 3.3Å; E142-H144 PolarHBondContact O-N 3.44Å; H144-R148 WeakPolarHBondContact O-CG 3.28Å; H144-R148 PolarHBondContact O-N 2.91Å
145	C	85.4	Confident	90.4	Very high	77 Å²	77	99.9 Å²	99.9	52%	0.52	51%	0.508	S	S	.	.	H	α-helix	trans	-66.6	-48.5	171.6	-172.5	0	0	0	0	111.4	I141 E142 T143 S147 R148 V149	I141-C145 PolarHBondContact O-N 3.03Å; E142-C145 WeakPolarHBondContact O-CA 3.4Å; E142-C145 VanDerWaalsContact O-CB 3.31Å; E142-C145 WeakPolarHBondContact O-CB 3.4Å; E142-C145 PolarHBondContact O-N 2.81Å; E142-C145 VanDerWaalsContact O-N 3.1Å; T143-C145 VanDerWaalsContact C-N 3.31Å; T143-C145 PolarHBondContact O-N 2.67Å; C145-S147 VanDerWaalsContact C-N 3.27Å; C145-S147 PolarHBondContact O-N 3.24Å; C145-R148 WeakPolarHBondContact O-CB 2.85Å; C145-R148 PolarHBondContact O-N 3.07Å; C145-R148 VanDerWaalsContact O-N 3.08Å; C145-V149 PolarHBondContact O-N 2.67Å; C145-V149 VanDerWaalsContact O-N 3.1Å
146	I	90.3	Very high	90.3	Very high	111 Å²	111	100 Å²	100	57%	0.569	51%	0.506	S	S	*	.	H	α-helix	trans	-57.7	-42.5	176.4	-67.3	165.6	0	0	0	110.6	E142 T143 R148 V149 Y150	E142-I146 WeakPolarHBondContact O-CG1 3.21Å; E142-I146 PolarHBondContact O-N 2.7Å; T143-I146 PolarHBondContact O-N 2.91Å; I146-R148 VanDerWaalsContact C-N 3.29Å; I146-R148 PolarHBondContact O-N 3.05Å; I146-V149 PolarHBondContact O-N 2.94Å; I146-Y150 VanDerWaalsContact O-CB 3.24Å; I146-Y150 WeakPolarHBondContact O-CB 3.25Å; I146-Y150 PolarHBondContact O-N 2.96Å
147	S	89.9	Confident	90.1	Very high	73 Å²	73	101.6 Å²	101.6	51%	0.51	51%	0.507	S	S	.	.	H	α-helix	trans	-60.2	-37.3	177.4	-178	0	0	0	0	112.8	T143 C145 S151	T143-S147 WeakPolarHBondContact O-CB 3.19Å; T143-S147 PolarHBondContact O-N 3.44Å; C145-S147 VanDerWaalsContact C-N 3.27Å; C145-S147 PolarHBondContact O-N 3.24Å; S147-S151 WeakPolarHBondContact O-CB 3.19Å; S147-S151 PolarHBondContact O-N 3.32Å
148	R	90	Very high	89.8	Confident	167 Å²	167	96.9 Å²	96.9	63%	0.63	49%	0.49	S	S	*	.	H	α-helix	trans	-67.1	-47.5	175.7	-71.3	-93.3	-177.6	85.8	-2.1	111.1	H144 C145 I146 Y150 S151 I152	H144-R148 WeakPolarHBondContact O-CG 3.28Å; H144-R148 PolarHBondContact O-N 2.91Å; C145-R148 WeakPolarHBondContact O-CB 2.85Å; C145-R148 PolarHBondContact O-N 3.07Å; C145-R148 VanDerWaalsContact O-N 3.08Å; I146-R148 VanDerWaalsContact C-N 3.29Å; I146-R148 PolarHBondContact O-N 3.05Å; R148-Y150 VanDerWaalsContact C-N 3.32Å; R148-Y150 PolarHBondContact O-N 2.86Å; R148-S151 PolarHBondContact O-N 3.49Å; R148-I152 WeakPolarHBondContact O-CG1 3.31Å; R148-I152 PolarHBondContact O-N 2.69Å
149	V	90.6	Very high	89.6	Confident	91 Å²	91	97.4 Å²	97.4	55%	0.552	49%	0.488	S	S	*	.	H	α-helix	trans	-61.9	-43.3	177.9	176.7	0	0	0	0	110.7	C145 I146 S151 I152 F153	C145-V149 PolarHBondContact O-N 2.67Å; C145-V149 VanDerWaalsContact O-N 3.1Å; I146-V149 PolarHBondContact O-N 2.94Å; V149-S151 PolarHBondContact O-N 3.09Å; V149-I152 PolarHBondContact O-N 3.41Å; V149-F153 WeakPolarHBondContact O-CB 3.42Å; V149-F153 PolarHBondContact O-N 2.74Å
150	Y	90.7	Very high	89.4	Confident	158 Å²	158	93.2 Å²	93.2	62%	0.62	48%	0.48	S	S	*	.	H	α-helix	trans	-60.1	-45.3	175.9	-179.9	-101.7	0	0	0	111.8	I146 R148 I152 F153 V154	I146-Y150 VanDerWaalsContact O-CB 3.24Å; I146-Y150 WeakPolarHBondContact O-CB 3.25Å; I146-Y150 PolarHBondContact O-N 2.96Å; R148-Y150 VanDerWaalsContact C-N 3.32Å; R148-Y150 PolarHBondContact O-N 2.86Å; Y150-I152 PolarHBondContact O-N 2.98Å; Y150-F153 WeakPolarHBondContact O-CB 3.41Å; Y150-F153 PolarHBondContact O-N 3.34Å; Y150-V154 HydrophobicContact CD1-CG2 4.28Å; Y150-V154 HydrophobicContact CE1-CG2 3.87Å; Y150-V154 HydrophobicContact CE2-CG2 4.2Å; Y150-V154 WeakPolarHBondContact O-CG2 3.18Å; Y150-V154 PolarHBondContact O-N 3.01Å
151	S	89.8	Confident	89.2	Confident	54 Å²	54	93.5 Å²	93.5	38%	0.378	48%	0.482	S	S	.	.	H	α-helix	trans	-60.8	-43.2	175.6	173.2	0	0	0	0	112.2	S147 R148 V149 F153 V154 H155	S147-S151 WeakPolarHBondContact O-CB 3.19Å; S147-S151 PolarHBondContact O-N 3.32Å; R148-S151 PolarHBondContact O-N 3.49Å; V149-S151 PolarHBondContact O-N 3.09Å; S151-F153 VanDerWaalsContact C-N 3.35Å; S151-F153 PolarHBondContact O-N 2.92Å; S151-V154 PolarHBondContact O-N 3.39Å; S151-H155 PolarHBondContact O-CD2 3.44Å; S151-H155 PolarHBondContact O-N 3.39Å
152	I	91.5	Very high	89	Confident	108 Å²	108	93.9 Å²	93.9	55%	0.554	48%	0.479	S	S	*	.	H	α-helix	trans	-62.1	-43.6	175.5	-65.5	164	0	0	0	110.8	R148 V149 Y150 V154 H155 T156	R148-I152 WeakPolarHBondContact O-CG1 3.31Å; R148-I152 PolarHBondContact O-N 2.69Å; V149-I152 PolarHBondContact O-N 3.41Å; Y150-I152 PolarHBondContact O-N 2.98Å; I152-V154 PolarHBondContact O-N 2.87Å; I152-H155 PolarHBondContact O-N 2.95Å; I152-T156 WeakPolarHBondContact O-CB 3.23Å; I152-T156 PolarHBondContact O-N 3.44Å; I152-T156 PolarHBondContact O-OG1 2.92Å
153	F	91.2	Very high	88.8	Confident	110 Å²	110	93.9 Å²	93.9	48%	0.482	48%	0.479	S	S	.	.	H	α-helix	trans	-60.2	-46.9	177.7	-176.2	-92.8	0	0	0	111.4	V149 Y150 S151 H155 T156 F157	V149-F153 WeakPolarHBondContact O-CB 3.42Å; V149-F153 PolarHBondContact O-N 2.74Å; Y150-F153 WeakPolarHBondContact O-CB 3.41Å; Y150-F153 PolarHBondContact O-N 3.34Å; S151-F153 VanDerWaalsContact C-N 3.35Å; S151-F153 PolarHBondContact O-N 2.92Å; F153-H155 PolarHBondContact O-N 3.22Å; F153-T156 PolarHBondContact O-N 3.39Å; F153-F157 HydrophobicContact CD1-CD2 4.47Å; F153-F157 AromaticContact CD2-CD2 3.51Å; F153-F157 HydrophobicContact CD2-CD2 3.51Å; F153-F157 AromaticContact CD2-CE2 3.67Å; F153-F157 HydrophobicContact CD2-CE2 3.67Å; F153-F157 HydrophobicContact CE1-CB 4.5Å; F153-F157 HydrophobicContact CE1-CD2 4.42Å; F153-F157 AromaticContact CE2-CD2 3.45Å; F153-F157 HydrophobicContact CE2-CD2 3.45Å; F153-F157 VanDerWaalsContact CE2-CD2 3.45Å; F153-F157 AromaticContact CE2-CE2 3.55Å; F153-F157 HydrophobicContact CE2-CE2 3.55Å; F153-F157 HydrophobicContact CE2-CG 4.13Å; F153-F157 HydrophobicContact CE2-CZ 4.31Å; F153-F157 HydrophobicContact CG-CD2 4.05Å; F153-F157 HydrophobicContact CZ-CB 4.49Å; F153-F157 AromaticContact CZ-CD2 3.93Å; F153-F157 HydrophobicContact CZ-CD2 3.93Å; F153-F157 HydrophobicContact CZ-CE2 4.4Å; F153-F157 HydrophobicContact CZ-CG 4.19Å; F153-F157 WeakPolarHBondContact O-CB 3.4Å; F153-F157 WeakPolarHBondContact O-CD2 3.32Å; F153-F157 PolarHBondContact O-N 3.29Å
154	V	91.1	Very high	88.7	Confident	40 Å²	40	94.3 Å²	94.3	24%	0.242	49%	0.487	C	S	.	.	I	π-helix	trans	-59.7	-47.8	176.4	172.9	0	0	0	0	110.7	Y150 S151 I152 T156 C158 D159	Y150-V154 HydrophobicContact CD1-CG2 4.28Å; Y150-V154 HydrophobicContact CE1-CG2 3.87Å; Y150-V154 HydrophobicContact CE2-CG2 4.2Å; Y150-V154 WeakPolarHBondContact O-CG2 3.18Å; Y150-V154 PolarHBondContact O-N 3.01Å; S151-V154 PolarHBondContact O-N 3.39Å; I152-V154 PolarHBondContact O-N 2.87Å; V154-T156 VanDerWaalsContact C-N 3.3Å; V154-T156 PolarHBondContact O-N 2.79Å; V154-C158 HydrophobicContact CG1-CB 3.93Å; V154-C158 VanDerWaalsContact O-CA 3.32Å; V154-C158 WeakPolarHBondContact O-CA 3.39Å; V154-C158 WeakPolarHBondContact O-CB 3.49Å; V154-C158 PolarHBondContact O-N 2.95Å; V154-D159 PolarHBondContact O-N 3.19Å; V154-D159 VanDerWaalsContact O-N 3.07Å
155	H	90.5	Very high	88.6	Confident	110 Å²	110	93 Å²	93	51%	0.509	48%	0.481	S	S	.	.	I	π-helix	trans	-64.9	-31.9	178.3	-79	-58.7	0	0	0	113.8	S151 I152 F153 D159	S151-H155 PolarHBondContact O-CD2 3.44Å; S151-H155 PolarHBondContact O-N 3.39Å; I152-H155 PolarHBondContact O-N 2.95Å; F153-H155 PolarHBondContact O-N 3.22Å; H155-D159 IonicContact CE1-OD2 3.65Å; H155-D159 IonicContact CG-OD2 3.63Å; H155-D159 IonicContact ND1-OD1 3.97Å; H155-D159 IonicContact ND1-OD2 2.69Å; H155-D159 PolarHBondContact ND1-OD2 2.81Å; H155-D159 WeakPolarHBondContact O-CB 3.45Å
156	T	89.3	Confident	88.7	Confident	86 Å²	86	91.2 Å²	91.2	53%	0.528	48%	0.477	S	S	.	.	I	π-helix	trans	-84.8	-31.3	-176.1	-47.6	0	0	0	0	112.3	I152 F153 V154 P160	I152-T156 WeakPolarHBondContact O-CB 3.23Å; I152-T156 PolarHBondContact O-N 3.44Å; I152-T156 PolarHBondContact O-OG1 2.92Å; F153-T156 PolarHBondContact O-N 3.39Å; V154-T156 VanDerWaalsContact C-N 3.3Å; V154-T156 PolarHBondContact O-N 2.79Å; T156-P160 WeakPolarHBondContact O-CG 3.5Å
157	F	86.5	Confident	88.3	Confident	110 Å²	110	92 Å²	92	48%	0.482	48%	0.476	S	S	.	.	I	π-helix	trans	-110.7	-51.2	-175.2	-71.8	-84.9	0	0	0	112.6	F153 P160 L161	F153-F157 HydrophobicContact CD1-CD2 4.47Å; F153-F157 AromaticContact CD2-CD2 3.51Å; F153-F157 HydrophobicContact CD2-CD2 3.51Å; F153-F157 AromaticContact CD2-CE2 3.67Å; F153-F157 HydrophobicContact CD2-CE2 3.67Å; F153-F157 HydrophobicContact CE1-CB 4.5Å; F153-F157 HydrophobicContact CE1-CD2 4.42Å; F153-F157 AromaticContact CE2-CD2 3.45Å; F153-F157 HydrophobicContact CE2-CD2 3.45Å; F153-F157 VanDerWaalsContact CE2-CD2 3.45Å; F153-F157 AromaticContact CE2-CE2 3.55Å; F153-F157 HydrophobicContact CE2-CE2 3.55Å; F153-F157 HydrophobicContact CE2-CG 4.13Å; F153-F157 HydrophobicContact CE2-CZ 4.31Å; F153-F157 HydrophobicContact CG-CD2 4.05Å; F153-F157 HydrophobicContact CZ-CB 4.49Å; F153-F157 AromaticContact CZ-CD2 3.93Å; F153-F157 HydrophobicContact CZ-CD2 3.93Å; F153-F157 HydrophobicContact CZ-CE2 4.4Å; F153-F157 HydrophobicContact CZ-CG 4.19Å; F153-F157 WeakPolarHBondContact O-CB 3.4Å; F153-F157 WeakPolarHBondContact O-CD2 3.32Å; F153-F157 PolarHBondContact O-N 3.29Å; F157-P160 WeakPolarHBondContact O-CD 3.26Å; F157-P160 WeakPolarHBondContact O-CG 3.38Å; F157-L161 VanDerWaalsContact O-CB 3.3Å; F157-L161 WeakPolarHBondContact O-CB 3.19Å; F157-L161 WeakPolarHBondContact O-CD1 3.36Å; F157-L161 WeakPolarHBondContact O-CG 3.49Å; F157-L161 PolarHBondContact O-N 3.26Å
158	C	84.4	Confident	88	Confident	33 Å²	33	93.1 Å²	93.1	22%	0.223	48%	0.483	C	S	.	.	I	π-helix	trans	-71.9	-44.3	-174.5	-61.1	0	0	0	0	111	V154 L161 F162	V154-C158 HydrophobicContact CG1-CB 3.93Å; V154-C158 VanDerWaalsContact O-CA 3.32Å; V154-C158 WeakPolarHBondContact O-CA 3.39Å; V154-C158 WeakPolarHBondContact O-CB 3.49Å; V154-C158 PolarHBondContact O-N 2.95Å; C158-L161 PolarHBondContact O-N 2.9Å; C158-F162 HydrophobicContact CB-CD2 3.86Å; C158-F162 HydrophobicContact CB-CE2 3.78Å; C158-F162 WeakPolarHBondContact O-CB 3.37Å; C158-F162 WeakPolarHBondContact O-CD2 3.49Å; C158-F162 WeakPolarHBondContact O-CG 3.44Å; C158-F162 PolarHBondContact O-N 3.43Å
159	D	86.2	Confident	87.5	Confident	71 Å²	71	92 Å²	92	38%	0.38	48%	0.482	S	S	.	.	H	α-helix	trans	-57	-52.8	179.3	-71.1	0	0	0	0	113	V154 H155 L161 F162 E163	V154-D159 PolarHBondContact O-N 3.19Å; V154-D159 VanDerWaalsContact O-N 3.07Å; H155-D159 IonicContact CE1-OD2 3.65Å; H155-D159 IonicContact CG-OD2 3.63Å; H155-D159 IonicContact ND1-OD1 3.97Å; H155-D159 IonicContact ND1-OD2 2.69Å; H155-D159 PolarHBondContact ND1-OD2 2.81Å; H155-D159 WeakPolarHBondContact O-CB 3.45Å; D159-L161 VanDerWaalsContact C-N 3.31Å; D159-L161 PolarHBondContact O-N 3.24Å; D159-F162 PolarHBondContact O-N 3.02Å; D159-E163 VanDerWaalsContact O-CB 3.23Å; D159-E163 WeakPolarHBondContact O-CB 3.2Å; D159-E163 PolarHBondContact O-N 2.78Å
160	P	89	Confident	86.9	Confident	67 Å²	67	91.7 Å²	91.7	44%	0.435	49%	0.485	S	S	.	.	H	α-helix	trans	-66.5	-31.7	178.1	23.4	-32	0	0	0	112.9	T156 F157 A164	T156-P160 WeakPolarHBondContact O-CG 3.5Å; F157-P160 WeakPolarHBondContact O-CD 3.26Å; F157-P160 WeakPolarHBondContact O-CG 3.38Å; P160-A164 WeakPolarHBondContact O-CB 3.39Å; P160-A164 PolarHBondContact O-N 3.05Å
161	L	85.8	Confident	85.9	Confident	105 Å²	105	91.1 Å²	91.1	55%	0.55	49%	0.492	S	S	.	.	H	α-helix	trans	-65.9	-47.9	174.4	-80.2	170.6	0	0	0	111.7	F157 C158 D159 E163 A164 M165	F157-L161 VanDerWaalsContact O-CB 3.3Å; F157-L161 WeakPolarHBondContact O-CB 3.19Å; F157-L161 WeakPolarHBondContact O-CD1 3.36Å; F157-L161 WeakPolarHBondContact O-CG 3.49Å; F157-L161 PolarHBondContact O-N 3.26Å; C158-L161 PolarHBondContact O-N 2.9Å; D159-L161 VanDerWaalsContact C-N 3.31Å; D159-L161 PolarHBondContact O-N 3.24Å; L161-E163 VanDerWaalsContact C-N 3.34Å; L161-A164 PolarHBondContact O-N 3.02Å; L161-M165 WeakPolarHBondContact O-CB 3.37Å; L161-M165 VanDerWaalsContact O-CG 3.32Å; L161-M165 WeakPolarHBondContact O-CG 2.98Å; L161-M165 PolarHBondContact O-N 3.34Å
162	F	86.7	Confident	85.1	Confident	134 Å²	134	93.9 Å²	93.9	59%	0.588	50%	0.502	S	S	*	.	H	α-helix	trans	-68.2	-35.6	178.1	-74.4	-62.1	0	0	0	111.5	C158 D159 M165 G166	C158-F162 HydrophobicContact CB-CD2 3.86Å; C158-F162 HydrophobicContact CB-CE2 3.78Å; C158-F162 WeakPolarHBondContact O-CB 3.37Å; C158-F162 WeakPolarHBondContact O-CD2 3.49Å; C158-F162 WeakPolarHBondContact O-CG 3.44Å; C158-F162 PolarHBondContact O-N 3.43Å; D159-F162 PolarHBondContact O-N 3.02Å; F162-M165 HydrophobicContact CD1-CE 3.31Å; F162-M165 HydrophobicContact CE1-CE 3.57Å; F162-M165 HydrophobicContact CG-CE 4.08Å; F162-G166 PolarHBondContact O-N 3.3Å
163	E	87.6	Confident	84.1	Confident	112 Å²	112	98.4 Å²	98.4	52%	0.523	51%	0.512	S	S	.	.	H	α-helix	trans	-65.7	-43.2	173	-167.8	-175.5	153.3	0	0	111.6	D159 L161 G166 K167	D159-E163 VanDerWaalsContact O-CB 3.23Å; D159-E163 WeakPolarHBondContact O-CB 3.2Å; D159-E163 PolarHBondContact O-N 2.78Å; L161-E163 VanDerWaalsContact C-N 3.34Å; E163-G166 PolarHBondContact O-N 2.93Å; E163-K167 WeakPolarHBondContact O-CG 3.46Å; E163-K167 PolarHBondContact O-N 2.98Å; E163-K167 IonicContact OE1-NZ 2.65Å; E163-K167 PolarHBondContact OE1-NZ 3.43Å
164	A	86.8	Confident	83.2	Confident	51 Å²	51	100.7 Å²	100.7	42%	0.421	53%	0.528	S	S	.	.	H	α-helix	trans	-63.5	-46.8	175.6	0	0	0	0	0	111.6	P160 L161 G166 K167 C168	P160-A164 WeakPolarHBondContact O-CB 3.39Å; P160-A164 PolarHBondContact O-N 3.05Å; L161-A164 PolarHBondContact O-N 3.02Å; A164-G166 VanDerWaalsContact C-N 3.33Å; A164-G166 PolarHBondContact O-N 3.43Å; A164-K167 WeakPolarHBondContact O-CB 3.5Å; A164-K167 PolarHBondContact O-N 3.42Å; A164-C168 PolarHBondContact O-N 3.38Å; A164-C168 PolarHBondContact O-SG 3.22Å
165	M	87.4	Confident	82.2	Confident	84 Å²	84	108.8 Å²	108.8	41%	0.414	55%	0.554	S	S	.	*	H	α-helix	trans	-60.3	-43.4	174.5	-73.2	-170.7	-68.8	0	0	111.4	L161 F162 K167 C168 F169	L161-M165 WeakPolarHBondContact O-CB 3.37Å; L161-M165 VanDerWaalsContact O-CG 3.32Å; L161-M165 WeakPolarHBondContact O-CG 2.98Å; L161-M165 PolarHBondContact O-N 3.34Å; F162-M165 HydrophobicContact CD1-CE 3.31Å; F162-M165 HydrophobicContact CE1-CE 3.57Å; F162-M165 HydrophobicContact CG-CE 4.08Å; M165-K167 VanDerWaalsContact C-N 3.3Å; M165-K167 PolarHBondContact O-N 3.13Å; M165-C168 WeakPolarHBondContact O-CB 3.44Å; M165-C168 PolarHBondContact O-N 3.42Å; M165-C168 VanDerWaalsContact O-N 3.13Å; M165-F169 WeakPolarHBondContact O-CD2 3.14Å; M165-F169 PolarHBondContact O-N 3.33Å
166	G	86.9	Confident	81.2	Confident	41 Å²	41	109.3 Å²	109.3	42%	0.423	57%	0.566	S	S	.	*	H	α-helix	trans	-57.9	-40.9	174.5	0	0	0	0	0	112.6	F162 E163 A164 F169 S170	F162-G166 PolarHBondContact O-N 3.3Å; E163-G166 PolarHBondContact O-N 2.93Å; A164-G166 VanDerWaalsContact C-N 3.33Å; A164-G166 PolarHBondContact O-N 3.43Å; G166-F169 PolarHBondContact O-N 3.18Å; G166-S170 VanDerWaalsContact O-CB 3.32Å; G166-S170 WeakPolarHBondContact O-CB 3.22Å; G166-S170 PolarHBondContact O-N 3.07Å
167	K	83.2	Confident	80	Confident	128 Å²	128	110.9 Å²	110.9	56%	0.557	58%	0.575	S	S	*	*	H	α-helix	trans	-67.9	-35.7	173.8	-78	171	173	152.4	0	113.2	E163 A164 M165 F169 S170	E163-K167 WeakPolarHBondContact O-CG 3.46Å; E163-K167 PolarHBondContact O-N 2.98Å; E163-K167 IonicContact OE1-NZ 2.65Å; E163-K167 PolarHBondContact OE1-NZ 3.43Å; A164-K167 WeakPolarHBondContact O-CB 3.5Å; A164-K167 PolarHBondContact O-N 3.42Å; M165-K167 VanDerWaalsContact C-N 3.3Å; M165-K167 PolarHBondContact O-N 3.13Å; K167-F169 VanDerWaalsContact C-N 3.32Å; K167-F169 PolarHBondContact O-N 3.33Å; K167-S170 PolarHBondContact O-N 3.41Å; K167-S170 PolarHBondContact O-OG 3.15Å; K167-S170 VanDerWaalsContact O-OG 3.1Å
168	C	83.3	Confident	78.8	Confident	96 Å²	96	114.5 Å²	114.5	65%	0.649	59%	0.591	S	S	*	*	H	α-helix	trans	-63	-39.8	173.6	-67.6	0	0	0	0	111.7	A164 M165	A164-C168 PolarHBondContact O-N 3.38Å; A164-C168 PolarHBondContact O-SG 3.22Å; M165-C168 WeakPolarHBondContact O-CB 3.44Å; M165-C168 PolarHBondContact O-N 3.42Å; M165-C168 VanDerWaalsContact O-N 3.13Å
169	F	78.9	Confident	77.6	Confident	142 Å²	142	121.6 Å²	121.6	62%	0.623	62%	0.621	S	S	*	*	H	α-helix	trans	-83.7	-22.8	178.9	-66.3	-63	0	0	0	114	M165 G166 K167 N171 I172	M165-F169 WeakPolarHBondContact O-CD2 3.14Å; M165-F169 PolarHBondContact O-N 3.33Å; G166-F169 PolarHBondContact O-N 3.18Å; K167-F169 VanDerWaalsContact C-N 3.32Å; K167-F169 PolarHBondContact O-N 3.33Å; F169-N171 PolarHBondContact O-N 3.35Å; F169-I172 HydrophobicContact CD1-CD1 4.13Å; F169-I172 PolarHBondContact O-N 3.4Å
170	S	77.3	Confident	76.1	Confident	86 Å²	86	128.3 Å²	128.3	60%	0.601	66%	0.664	S	S	*	*	H	α-helix	trans	-67.1	-21.1	-178.5	75.5	0	0	0	0	113.7	G166 K167 I172	G166-S170 VanDerWaalsContact O-CB 3.32Å; G166-S170 WeakPolarHBondContact O-CB 3.22Å; G166-S170 PolarHBondContact O-N 3.07Å; K167-S170 PolarHBondContact O-N 3.41Å; K167-S170 PolarHBondContact O-OG 3.15Å; K167-S170 VanDerWaalsContact O-OG 3.1Å; S170-I172 PolarHBondContact O-N 2.98Å
171	N	71	Confident	75.4	Confident	145 Å²	145	131.4 Å²	131.4	78%	0.775	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-7.5	178.7	-141.7	3.2	0	0	0	112.9	F169 R173	F169-N171 PolarHBondContact O-N 3.35Å; N171-R173 PolarHBondContact O-N 2.9Å; N171-R173 VanDerWaalsContact O-N 3.09Å
172	I	73.3	Confident	74.9	Confident	113 Å²	113	132.8 Å²	132.8	58%	0.579	68%	0.682	S	S	*	*			trans	-83.2	85.2	175.4	-58.3	168	0	0	0	108.4	F169 S170 L174	F169-I172 HydrophobicContact CD1-CD1 4.13Å; F169-I172 PolarHBondContact O-N 3.4Å; S170-I172 PolarHBondContact O-N 2.98Å; I172-L174 HydrophobicContact CG2-CG 4.47Å; I172-L174 PolarHBondContact O-N 2.85Å
173	R	70.3	Confident	74.3	Confident	203 Å²	203	132.7 Å²	132.7	77%	0.766	69%	0.687	S	S	*	*			trans	-82.5	99.7	170.7	-97.6	177.8	144.6	-130.4	-2.8	110.2	N171 R175	N171-R173 PolarHBondContact O-N 2.9Å; N171-R173 VanDerWaalsContact O-N 3.09Å; R173-R175 PolarHBondContact O-N 2.95Å
174	L	72.1	Confident	73.5	Confident	158 Å²	158	133.9 Å²	133.9	83%	0.827	70%	0.697	S	S	*	*			trans	-70.3	109.4	168.1	-67.2	169.9	0	0	0	109.3	I172	I172-L174 HydrophobicContact CG2-CG 4.47Å; I172-L174 PolarHBondContact O-N 2.85Å
175	R	70.8	Confident	72.6	Confident	209 Å²	209	139.1 Å²	139.1	79%	0.789	71%	0.714	S	S	*	*			trans	-88.9	103.8	165.4	-74.4	-172.8	-179.8	-107	6.4	108.1	R173 T177	R173-R175 PolarHBondContact O-N 2.95Å; R175-T177 PolarHBondContact O-N 3.1Å
176	T	68.1	Low	71.7	Confident	122 Å²	122	142.8 Å²	142.8	75%	0.748	73%	0.734	S	S	*	*			trans	-76.5	103.6	166.7	-73.8	0	0	0	0	108.3	K178	T176-K178 HydrophobicContact CG2-CG 4.13Å; T176-K178 PolarHBondContact O-N 3.18Å
177	T	64.3	Low	70.6	Confident	119 Å²	119	150.1 Å²	150.1	73%	0.73	76%	0.756	S	S	*	*			trans	-78.6	110.6	159.8	-60.6	0	0	0	0	106.4	R175 E179	R175-T177 PolarHBondContact O-N 3.1Å; T177-E179 PolarHBondContact O-N 2.64Å
178	K	62.3	Low	69.6	Low	185 Å²	185	151.8 Å²	151.8	80%	0.804	77%	0.772	S	S	*	*			trans	-74.7	108.5	164.6	-79.1	-165.7	172	-174.2	0	107.1	T176	T176-K178 HydrophobicContact CG2-CG 4.13Å; T176-K178 PolarHBondContact O-N 3.18Å
179	E	59.1	Low	68.5	Low	183 Å²	183	156.4 Å²	156.4	86%	0.855	78%	0.782	S	S	*	*			trans	-73.1	132.3	162.2	-72.8	-159.5	124.2	0	0	108.7	T177	T177-E179 PolarHBondContact O-N 2.64Å
180	V	54.1	Low	67.5	Low	212 Å²	212	157.7 Å²	157.7	100%	1.285	80%	0.796	S	S	*	*			trans	-82.9	0	178.9	171.9	0	0	0	0	109.3

Retrieved 180 of 180 residues in 41.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).