A0A087XML1_POEFO Loading...

LysM and putative peptidoglycan-binding domain-containing protein 4

AlphaFold DB , UniProt , Accession A0A087XML1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 249 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	37.6	Very low	54.1	Low	240 Å²	240	166.3 Å²	166.3	100%	1.182	85%	0.853	S	S	*	*				0	99.2	0	-72.7	169.1	157.6	0	0	107.5
2	W	40.2	Very low	54.9	Low	264 Å²	264	167.3 Å²	167.3	100%	1	85%	0.852	S	S	*	*			trans	-111.7	113.4	170.9	-73.2	88.8	0	0	0	106.2
3	R	51.3	Low	55.4	Low	232 Å²	232	159.2 Å²	159.2	88%	0.875	83%	0.825	S	S	*	*			trans	-102.4	100.3	173.6	-173.5	-172.4	-67.2	-96.2	3.3	106.4
4	G	50.4	Low	55.4	Low	67 Å²	67	155.6 Å²	155.6	69%	0.691	82%	0.817	S	S	*	*			trans	-78.1	124.3	169.3	0	0	0	0	0	109.4
5	E	51.8	Low	55.2	Low	173 Å²	173	153.4 Å²	153.4	81%	0.808	81%	0.812	S	S	*	*			trans	-132.1	92.4	166.1	-82.3	-86	115.2	0	0	105.9
6	H	52.5	Low	55.3	Low	196 Å²	196	152.7 Å²	152.7	91%	0.907	81%	0.809	S	S	*	*			trans	-100.5	97.2	163	-77.9	-78	0	0	0	106.9
7	G	66.4	Low	55.4	Low	61 Å²	61	151.4 Å²	151.4	63%	0.629	81%	0.807	S	S	*	*			trans	-72.1	148.3	164.3	0	0	0	0	0	110.2	Q9	G7-Q9 PolarHBondContact O-N 3.46Å
8	P	52.7	Low	55.2	Low	134 Å²	134	152.6 Å²	152.6	87%	0.87	81%	0.807	S	S	*	*			trans	-66.9	117.9	177.1	25.6	-30.6	0	0	0	110.1	A10	P8-A10 PolarHBondContact O-N 3.17Å
9	Q	60.8	Low	55.3	Low	193 Å²	193	149.2 Å²	149.2	90%	0.902	80%	0.803	S	S	*	*			trans	-64.8	112.1	171	-173.9	175.5	2.6	0	0	108.3	G7	G7-Q9 PolarHBondContact O-N 3.46Å
10	A	65.1	Low	55.2	Low	88 Å²	88	146.6 Å²	146.6	73%	0.727	80%	0.797	S	S	*	*			trans	-61.7	138.7	175.8	0	0	0	0	0	110.1	P8 Q12	P8-A10 PolarHBondContact O-N 3.17Å; A10-Q12 PolarHBondContact O-N 2.97Å
11	F	66.3	Low	55.5	Low	181 Å²	181	145.2 Å²	145.2	79%	0.794	81%	0.806	S	S	*	*			trans	-62.6	115.7	174.8	175.7	-99.3	0	0	0	109.4	A13	F11-A13 HydrophobicContact CD1-CB 4.35Å; F11-A13 HydrophobicContact CE1-CB 3.82Å
12	Q	63.3	Low	56.5	Low	179 Å²	179	141 Å²	141	84%	0.836	79%	0.788	S	S	*	*			trans	-92.7	104.6	173.4	-162.8	139.2	15.3	0	0	107.6	A10	A10-Q12 PolarHBondContact O-N 2.97Å
13	A	61.9	Low	57.6	Low	61 Å²	61	130.8 Å²	130.8	50%	0.504	76%	0.764	S	S	.	*			trans	-62.7	134.2	-179.9	0	0	0	0	0	109.9	F11	F11-A13 HydrophobicContact CD1-CB 4.35Å; F11-A13 HydrophobicContact CE1-CB 3.82Å
14	P	55.2	Low	58.1	Low	109 Å²	109	128.7 Å²	128.7	71%	0.708	76%	0.764	S	S	*	*	S	Bend	trans	-74.9	130.3	170.3	29.4	-27.5	0	0	0	107.8
15	V	52.6	Low	58.7	Low	123 Å²	123	131.2 Å²	131.2	75%	0.745	77%	0.766	S	S	*	*			trans	101.4	83.2	178.7	-169.3	0	0	0	0	113.2	V17	V15-V17 PolarHBondContact O-N 3.06Å
16	D	55.9	Low	59	Low	142 Å²	142	131.9 Å²	131.9	76%	0.759	76%	0.763	S	S	*	*			trans	-62.7	114.8	151.5	-72.7	-41.8	0	0	0	107.7	H18	D16-H18 PolarHBondContact O-N 3.06Å
17	V	57.3	Low	59.7	Low	130 Å²	130	130.4 Å²	130.4	79%	0.788	76%	0.758	S	S	*	*			trans	-66.6	102.8	171.7	-179.5	0	0	0	0	106.6	V15 A19	V15-V17 PolarHBondContact O-N 3.06Å; V17-A19 PolarHBondContact O-N 3.46Å
18	H	51.9	Low	59.3	Low	173 Å²	173	136 Å²	136	80%	0.801	77%	0.765	S	S	*	*			trans	-59.6	102.6	167.1	-78	-89.9	0	0	0	107.9	D16 S20	D16-H18 PolarHBondContact O-N 3.06Å; H18-S20 PolarHBondContact O-N 3.43Å
19	A	57.5	Low	59.3	Low	89 Å²	89	139.4 Å²	139.4	74%	0.736	77%	0.767	S	S	*	*			trans	-63.9	105.4	166.9	0	0	0	0	0	107.1	V17 A21	V17-A19 PolarHBondContact O-N 3.46Å; A19-A21 PolarHBondContact O-N 3.24Å
20	S	54.1	Low	59.1	Low	96 Å²	96	141.5 Å²	141.5	67%	0.671	77%	0.766	S	S	*	*			trans	-51.5	140.5	169	-76.7	0	0	0	0	109.4	H18 D22 G23	H18-S20 PolarHBondContact O-N 3.43Å; S20-D22 PolarHBondContact O-N 3.5Å; S20-G23 PolarHBondContact O-N 3.48Å
21	A	59.8	Low	58.4	Low	119 Å²	119	148.3 Å²	148.3	98%	0.983	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-4.2	-173	0	0	0	0	0	115.5	A19	A19-A21 PolarHBondContact O-N 3.24Å
22	D	58.7	Low	57.4	Low	151 Å²	151	146.2 Å²	146.2	81%	0.807	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.8	17.2	-179.2	-138.7	-11.4	0	0	0	113.5	S20 Q24	S20-D22 PolarHBondContact O-N 3.5Å; D22-Q24 PolarHBondContact O-N 2.87Å
23	G	64.1	Low	56.5	Low	49 Å²	49	144.3 Å²	144.3	51%	0.505	77%	0.771	S	S	.	*			trans	-75.3	105.3	176	0	0	0	0	0	111.2	S20 V25	S20-G23 PolarHBondContact O-N 3.48Å; G23-V25 PolarHBondContact O-N 2.94Å
24	Q	62.1	Low	56	Low	188 Å²	188	150.5 Å²	150.5	88%	0.879	79%	0.789	S	S	*	*			trans	-64.6	99.4	168.7	-70.7	-173.7	14.4	0	0	109.9	D22 Y26	D22-Q24 PolarHBondContact O-N 2.87Å; Q24-Y26 PolarHBondContact O-N 2.83Å
25	V	62.3	Low	55.3	Low	120 Å²	120	150.1 Å²	150.1	73%	0.727	79%	0.789	S	S	*	*			trans	-76.7	104	172.3	-179.5	0	0	0	0	108.2	G23 M27	G23-V25 PolarHBondContact O-N 2.94Å; V25-M27 HydrophobicContact CG1-CG 4.3Å; V25-M27 PolarHBondContact O-N 3.26Å
26	Y	58.4	Low	54.9	Low	188 Å²	188	149.3 Å²	149.3	74%	0.737	80%	0.795	S	S	*	*			trans	-74.5	94.1	175.7	-156.2	-93.6	0	0	0	109.9	Q24 F28	Q24-Y26 PolarHBondContact O-N 2.83Å; Y26-F28 HydrophobicContact CD1-CD2 4.24Å; Y26-F28 HydrophobicContact CD1-CE1 4.44Å; Y26-F28 HydrophobicContact CD1-CE2 4.08Å; Y26-F28 HydrophobicContact CD1-CG 4.49Å; Y26-F28 HydrophobicContact CD1-CZ 4.19Å; Y26-F28 HydrophobicContact CE1-CD1 4.36Å; Y26-F28 HydrophobicContact CE1-CE1 4.18Å; Y26-F28 HydrophobicContact CE1-CZ 4.32Å; Y26-F28 PolarHBondContact O-N 3.41Å
27	M	67.1	Low	54.1	Low	164 Å²	164	148.7 Å²	148.7	81%	0.808	80%	0.797	S	S	*	*			trans	-76.8	110.2	170.2	-74.3	-145	-100.9	0	0	109.6	V25 K29	V25-M27 HydrophobicContact CG1-CG 4.3Å; V25-M27 PolarHBondContact O-N 3.26Å; M27-K29 PolarHBondContact O-N 2.77Å
28	F	59.2	Low	53.3	Low	179 Å²	179	147.6 Å²	147.6	79%	0.785	79%	0.794	S	S	*	*			trans	-61.5	103.2	167	-78.7	-85.1	0	0	0	108.9	Y26 R30	Y26-F28 HydrophobicContact CD1-CD2 4.24Å; Y26-F28 HydrophobicContact CD1-CE1 4.44Å; Y26-F28 HydrophobicContact CD1-CE2 4.08Å; Y26-F28 HydrophobicContact CD1-CG 4.49Å; Y26-F28 HydrophobicContact CD1-CZ 4.19Å; Y26-F28 HydrophobicContact CE1-CD1 4.36Å; Y26-F28 HydrophobicContact CE1-CE1 4.18Å; Y26-F28 HydrophobicContact CE1-CZ 4.32Å; Y26-F28 PolarHBondContact O-N 3.41Å; F28-R30 PolarHBondContact O-N 3.02Å
29	K	51.8	Low	53.2	Low	206 Å²	206	143.9 Å²	143.9	90%	0.896	79%	0.788	S	S	*	*			trans	-61.6	96.1	170.7	-94	-176.9	172.1	172.7	0	109.1	M27 R31	M27-K29 PolarHBondContact O-N 2.77Å; K29-R31 PolarHBondContact O-N 2.92Å
30	R	56.2	Low	52.3	Low	237 Å²	237	146.5 Å²	146.5	89%	0.894	79%	0.79	S	S	*	*			trans	-67.9	113.5	162.6	-162.1	175.6	-162.6	174.6	3.7	106.7	F28 T32	F28-R30 PolarHBondContact O-N 3.02Å; R30-T32 PolarHBondContact O-N 3.21Å
31	R	51	Low	51.8	Low	231 Å²	231	149.4 Å²	149.4	87%	0.872	80%	0.798	S	S	*	*			trans	-59.4	113	173.4	-74.6	-173.7	179.6	-179.5	0.3	108	K29 N33	K29-R31 PolarHBondContact O-N 2.92Å; R31-N33 VanDerWaalsContact C-N 3.34Å; R31-N33 PolarHBondContact O-N 3.33Å
32	T	45.6	Very low	51.4	Low	137 Å²	137	152.2 Å²	152.2	84%	0.84	79%	0.791	S	S	*	*			trans	-70.3	91.4	165.9	24.6	0	0	0	0	108.1	R30 E34	R30-T32 PolarHBondContact O-N 3.21Å; T32-E34 PolarHBondContact O-N 3.3Å
33	N	44.8	Very low	50.7	Low	138 Å²	138	152.9 Å²	152.9	74%	0.738	79%	0.789	S	S	*	*			trans	-79.3	105.2	151.8	50.4	-17.4	0	0	0	107.1	R31 S35	R31-N33 VanDerWaalsContact C-N 3.34Å; R31-N33 PolarHBondContact O-N 3.33Å; N33-S35 PolarHBondContact O-N 3.22Å
34	E	50.4	Low	49.8	Very low	191 Å²	191	157.4 Å²	157.4	89%	0.893	80%	0.801	S	S	*	*			trans	-55.4	94.4	171.2	53.1	-158.1	121.2	0	0	111.9	T32	T32-E34 PolarHBondContact O-N 3.3Å
35	S	40	Very low	49.4	Very low	101 Å²	101	152.7 Å²	152.7	71%	0.706	79%	0.788	S	S	*	*			trans	-160.3	87.4	152.7	57.2	0	0	0	0	108.4	N33 V37	N33-S35 PolarHBondContact O-N 3.22Å; S35-V37 PolarHBondContact O-N 3.49Å; S35-V37 VanDerWaalsContact O-N 3.17Å
36	A	45.7	Very low	48.8	Very low	106 Å²	106	150.1 Å²	150.1	88%	0.876	77%	0.773	S	S	*	*			trans	-65.9	105.1	166.8	0	0	0	0	0	109.1
37	V	37.6	Very low	48.5	Very low	130 Å²	130	145.6 Å²	145.6	79%	0.788	77%	0.765	S	S	*	*			trans	-145.4	109.6	151.6	-179	0	0	0	0	107.8	S35	S35-V37 PolarHBondContact O-N 3.49Å; S35-V37 VanDerWaalsContact O-N 3.17Å
38	S	41.4	Very low	47.8	Very low	106 Å²	106	144.5 Å²	144.5	74%	0.741	76%	0.758	S	S	*	*			trans	44.4	120.7	137	-162	0	0	0	0	120
39	S	50.5	Low	47.4	Very low	95 Å²	95	140.4 Å²	140.4	66%	0.664	75%	0.747	S	S	*	*			trans	35.5	106.4	139.8	-165	0	0	0	0	117.1
40	D	36.9	Very low	47.3	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	74%	0.737	S	S	*	*			trans	162.9	93.8	130.5	-77.7	-18.6	0	0	0	109.2	E42	D40-E42 PolarHBondContact O-N 3.48Å
41	D	45.3	Very low	46.8	Very low	156 Å²	156	137 Å²	137	83%	0.834	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	71.3	-176.3	-66.8	-64.6	0	0	0	112.1
42	E	49.4	Very low	46.5	Very low	179 Å²	179	133.3 Å²	133.3	84%	0.836	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.9	-7.3	168.9	-71.8	-66.6	136.5	0	0	114.6	D40	D40-E42 PolarHBondContact O-N 3.48Å
43	E	45.3	Very low	46.5	Very low	165 Å²	165	134.3 Å²	134.3	77%	0.771	72%	0.716	S	S	*	*	S	Bend	trans	-105.1	-12.3	-170.4	-127.4	-172.8	146.4	0	0	116	S45	E43-S45 PolarHBondContact O-N 3.34Å
44	L	44.7	Very low	46.6	Very low	144 Å²	144	136.1 Å²	136.1	75%	0.754	71%	0.712	S	S	*	*	H	α-helix	trans	-78.9	-22.6	-169.6	-151.9	79.4	0	0	0	114.5	V46 V47	L44-V46 VanDerWaalsContact C-N 3.27Å; L44-V46 PolarHBondContact O-N 3.36Å; L44-V47 PolarHBondContact O-N 3.46Å
45	S	54.4	Low	46.3	Very low	88 Å²	88	131.3 Å²	131.3	62%	0.615	69%	0.693	S	S	*	*	H	α-helix	trans	-69.1	-24.2	179.9	66.9	0	0	0	0	113.3	E43 T49	E43-S45 PolarHBondContact O-N 3.34Å; S45-T49 WeakPolarHBondContact O-CG2 3.38Å; S45-T49 PolarHBondContact O-OG1 3.15Å
46	V	49.9	Very low	46.8	Very low	66 Å²	66	130.8 Å²	130.8	40%	0.4	68%	0.682	S	S	.	*	H	α-helix	trans	-80.9	-28.9	-177.6	-175.4	0	0	0	0	112	L44 T49 R50	L44-V46 VanDerWaalsContact C-N 3.27Å; L44-V46 PolarHBondContact O-N 3.36Å; V46-T49 PolarHBondContact O-OG1 3.48Å; V46-T49 VanDerWaalsContact O-OG1 3.07Å; V46-R50 WeakPolarHBondContact O-CG 3.46Å; V46-R50 PolarHBondContact O-N 3.07Å
47	V	52	Low	47.1	Very low	94 Å²	94	130.7 Å²	130.7	57%	0.57	67%	0.67	S	S	*	*	H	α-helix	trans	-78.3	-35.5	-176.7	-173.7	0	0	0	0	111.4	L44 R50 R51	L44-V47 PolarHBondContact O-N 3.46Å; V47-R50 PolarHBondContact O-N 3.25Å; V47-R51 PolarHBondContact O-N 3.4Å
48	E	52.3	Low	47.8	Very low	141 Å²	141	132.7 Å²	132.7	66%	0.659	66%	0.664	S	S	*	*	H	α-helix	trans	-72.1	-39.2	179.6	-166.5	151.2	-164.5	0	0	112.5	R50 R51 M52	E48-R50 VanDerWaalsContact C-N 3.31Å; E48-R50 PolarHBondContact O-N 3.36Å; E48-R51 PolarHBondContact O-N 3.01Å; E48-R51 VanDerWaalsContact O-N 3.15Å; E48-M52 PolarHBondContact O-N 3.11Å
49	T	49.4	Very low	48.5	Very low	93 Å²	93	132 Å²	132	57%	0.571	65%	0.652	S	S	*	*	H	α-helix	trans	-65.4	-30.7	175.1	53.3	0	0	0	0	113.2	S45 V46 K53	S45-T49 WeakPolarHBondContact O-CG2 3.38Å; S45-T49 PolarHBondContact O-OG1 3.15Å; V46-T49 PolarHBondContact O-OG1 3.48Å; V46-T49 VanDerWaalsContact O-OG1 3.07Å; T49-K53 PolarHBondContact O-N 3.37Å
50	R	49.8	Very low	49	Very low	181 Å²	181	129.2 Å²	129.2	68%	0.683	63%	0.631	S	S	*	*	H	α-helix	trans	-70.5	-32.4	173.6	-76.1	178.7	178.7	-178.1	2.2	112.8	V46 V47 E48 R54	V46-R50 WeakPolarHBondContact O-CG 3.46Å; V46-R50 PolarHBondContact O-N 3.07Å; V47-R50 PolarHBondContact O-N 3.25Å; E48-R50 VanDerWaalsContact C-N 3.31Å; E48-R50 PolarHBondContact O-N 3.36Å; R50-R54 PolarHBondContact O-N 3Å
51	R	45.5	Very low	50.3	Low	191 Å²	191	127.1 Å²	127.1	72%	0.721	62%	0.616	S	S	*	*	H	α-helix	trans	-73.9	-45.6	-177.4	-136.4	178.9	-172.7	-177.7	2.4	111.5	V47 E48 K53 R54 D55	V47-R51 PolarHBondContact O-N 3.4Å; E48-R51 PolarHBondContact O-N 3.01Å; E48-R51 VanDerWaalsContact O-N 3.15Å; R51-K53 VanDerWaalsContact C-N 3.31Å; R51-K53 PolarHBondContact O-N 3.47Å; R51-R54 WeakPolarHBondContact O-CB 3.4Å; R51-R54 PolarHBondContact O-N 3.26Å; R51-D55 PolarHBondContact O-N 3.29Å; R51-D55 VanDerWaalsContact O-N 3.11Å
52	M	45.7	Very low	51.3	Low	153 Å²	153	124 Å²	124	75%	0.754	60%	0.599	S	S	*	*	H	α-helix	trans	-63	-36.3	177.4	-129.3	152.8	174.2	0	0	112.7	E48 R54 N56	E48-M52 PolarHBondContact O-N 3.11Å; M52-R54 VanDerWaalsContact C-N 3.27Å; M52-R54 PolarHBondContact O-N 3.33Å; M52-N56 PolarHBondContact O-N 3.36Å
53	K	45.2	Very low	52.2	Low	158 Å²	158	117.8 Å²	117.8	69%	0.687	57%	0.571	S	S	*	*	H	α-helix	trans	-66.7	-27	174	-168.6	173	-178.2	-179.5	0	112.8	T49 R51 V57	T49-K53 PolarHBondContact O-N 3.37Å; R51-K53 VanDerWaalsContact C-N 3.31Å; R51-K53 PolarHBondContact O-N 3.47Å; K53-V57 VanDerWaalsContact O-CG2 3.27Å; K53-V57 WeakPolarHBondContact O-CG2 3.27Å
54	R	46.6	Very low	53.4	Low	176 Å²	176	115.7 Å²	115.7	66%	0.664	56%	0.562	S	S	*	*	H	α-helix	trans	-84.3	-33.5	-179.4	-175.2	165.2	-75.3	169.5	-3.3	112.6	R50 R51 M52 N56 V57	R50-R54 PolarHBondContact O-N 3Å; R51-R54 WeakPolarHBondContact O-CB 3.4Å; R51-R54 PolarHBondContact O-N 3.26Å; M52-R54 VanDerWaalsContact C-N 3.27Å; M52-R54 PolarHBondContact O-N 3.33Å; R54-N56 VanDerWaalsContact C-N 3.34Å; R54-V57 WeakPolarHBondContact O-CB 3.32Å; R54-V57 WeakPolarHBondContact O-CG2 3.49Å; R54-V57 PolarHBondContact O-N 3.38Å
55	D	44.3	Very low	54.5	Low	89 Å²	89	112.1 Å²	112.1	48%	0.476	54%	0.538	S	S	.	.	H	α-helix	trans	-70.8	-30.2	177.1	-79.8	-25.1	0	0	0	112.8	R51 V57 R58	R51-D55 PolarHBondContact O-N 3.29Å; R51-D55 VanDerWaalsContact O-N 3.11Å; D55-V57 PolarHBondContact O-N 3.25Å; D55-R58 PolarHBondContact O-N 3.28Å
56	N	50.6	Low	55.3	Low	91 Å²	91	115 Å²	115	49%	0.487	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-61.8	-30.6	171.6	-164.6	-79.7	0	0	0	112.3	M52 R54 R58 N59 V60	M52-N56 PolarHBondContact O-N 3.36Å; R54-N56 VanDerWaalsContact C-N 3.34Å; N56-R58 VanDerWaalsContact C-N 3.26Å; N56-R58 PolarHBondContact O-N 3.32Å; N56-N59 PolarHBondContact O-N 3.22Å; N56-V60 WeakPolarHBondContact O-CG2 3.46Å
57	V	53.4	Low	56.3	Low	104 Å²	104	112.8 Å²	112.8	63%	0.63	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-67.7	-24.4	-177.3	-165.1	0	0	0	0	112.6	K53 R54 D55	K53-V57 VanDerWaalsContact O-CG2 3.27Å; K53-V57 WeakPolarHBondContact O-CG2 3.27Å; R54-V57 WeakPolarHBondContact O-CB 3.32Å; R54-V57 WeakPolarHBondContact O-CG2 3.49Å; R54-V57 PolarHBondContact O-N 3.38Å; D55-V57 PolarHBondContact O-N 3.25Å
58	R	51.5	Low	57.2	Low	172 Å²	172	113.2 Å²	113.2	65%	0.649	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-82.3	-18.9	-176	-60.8	-179.7	176.7	179.4	-3.2	113	D55 N56 K111	D55-R58 PolarHBondContact O-N 3.28Å; N56-R58 VanDerWaalsContact C-N 3.26Å; N56-R58 PolarHBondContact O-N 3.32Å; R58-K111 PolarHBondContact O-NZ 3.48Å
59	N	55.6	Low	57.6	Low	91 Å²	91	113.7 Å²	113.7	49%	0.487	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-110.6	17	-175.6	-63.7	-23.1	0	0	0	113.7	N56 K111	N56-N59 PolarHBondContact O-N 3.22Å; N59-K111 WeakPolarHBondContact O-CG 3.32Å; N59-K111 PolarHBondContact O-N 3.06Å
60	V	61.4	Low	58.7	Low	37 Å²	37	112.3 Å²	112.3	22%	0.224	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123	178.7	174.4	0	0	0	0	108.7	N56 L62 P108 V109	N56-V60 WeakPolarHBondContact O-CG2 3.46Å; V60-L62 HydrophobicContact CG1-CD2 4.41Å; V60-P108 HydrophobicContact CG1-CB 3.26Å; V60-V109 WeakPolarHBondContact CA-O 3.4Å
61	Q	64.3	Low	60	Low	101 Å²	101	103.8 Å²	103.8	47%	0.472	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.7	170.6	-164.3	160.1	15.6	0	0	108	L63 V109 K111	Q61-L63 PolarHBondContact O-N 2.85Å; Q61-V109 PolarHBondContact N-O 2.8Å; Q61-V109 PolarHBondContact O-N 2.99Å; Q61-K111 HydrophobicContact CB-CG 3.89Å
62	L	67.1	Low	61.9	Low	89 Å²	89	96.4 Å²	96.4	47%	0.466	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	109.3	179.3	-62.6	178.3	0	0	0	107.9	V60 V90 P108	V60-L62 HydrophobicContact CG1-CD2 4.41Å; L62-V90 HydrophobicContact CD2-CG1 3.66Å; L62-V90 HydrophobicContact CD2-CG2 4.49Å; L62-P108 HydrophobicContact CD2-CB 4.26Å
63	L	67	Low	63.6	Low	49 Å²	49	89.1 Å²	89.1	26%	0.257	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	120.8	172.8	178.8	67.7	0	0	0	108.9	Q61 Y80 K106 I107 V109 L119	Q61-L63 PolarHBondContact O-N 2.85Å; L63-Y80 HydrophobicContact CD2-CD1 4.08Å; L63-Y80 HydrophobicContact CD2-CE1 3.59Å; L63-K106 CarbonylContact O-C 3.56Å; L63-K106 WeakPolarHBondContact O-CA 3.27Å; L63-I107 HydrophobicContact CB-CB 4.37Å; L63-I107 PolarHBondContact N-O 2.91Å; L63-I107 PolarHBondContact O-N 2.76Å; L63-V109 HydrophobicContact CB-CG2 3.72Å; L63-V109 HydrophobicContact CD2-CG2 4.01Å; L63-L119 HydrophobicContact CD1-CD2 4Å; L63-L119 HydrophobicContact CD2-CD2 3.61Å; L63-L119 HydrophobicContact CG-CD2 4.34Å
64	E	71.1	Confident	65.6	Low	122 Å²	122	85.7 Å²	85.7	57%	0.57	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.6	174.3	-70.5	-176.7	174.1	0	0	109.2	V104 K106	E64-V104 HydrophobicContact CB-CG1 4.04Å; E64-V104 HydrophobicContact CG-CG1 4.46Å; E64-K106 HydrophobicContact CG-CG 3.96Å; E64-K106 WeakPolarHBondContact OE1-CE 3.32Å; E64-K106 IonicContact OE1-NZ 3.5Å; E64-K106 PolarHBondContact OE1-NZ 2.76Å
65	R	68.3	Low	67.6	Low	68 Å²	68	82.4 Å²	82.4	26%	0.257	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	141.6	176.7	-167.4	-154.3	-177.6	-158.8	-11.4	109.5	D71 Y80 V104 I105 I107	R65-D71 IonicContact CZ-OD2 3.33Å; R65-D71 VanDerWaalsContact CZ-OD2 3.28Å; R65-D71 IonicContact NH1-OD2 2.68Å; R65-D71 PolarHBondContact NH1-OD2 3.15Å; R65-D71 IonicContact NH2-OD2 2.7Å; R65-D71 PolarHBondContact NH2-OD2 3.05Å; R65-Y80 WeakPolarHBondContact CD-OH 3.11Å; R65-Y80 PolarHBondContact NE-OH 2.89Å; R65-V104 CarbonylContact O-C 3.54Å; R65-V104 WeakPolarHBondContact O-CA 3.14Å; R65-I105 HydrophobicContact CB-CG2 4.21Å; R65-I105 PolarHBondContact N-O 3.14Å; R65-I105 WeakPolarHBondContact O-CG2 3.08Å; R65-I105 PolarHBondContact O-N 2.74Å; R65-I107 HydrophobicContact CB-CD1 4.41Å
66	E	69.8	Low	69.4	Low	148 Å²	148	78.2 Å²	78.2	69%	0.692	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	139.6	169.3	-62.1	-172.8	165.9	0	0	111.4	K103	E66-K103 VanDerWaalsContact CA-O 3.28Å; E66-K103 WeakPolarHBondContact CA-O 3.49Å
67	V	71.4	Confident	71	Confident	21 Å²	21	74.3 Å²	74.3	13%	0.127	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-87.4	122.3	177.3	179.9	0	0	0	0	108.6	L99 L102 K103 I105	V67-L99 HydrophobicContact CG1-CD1 4Å; V67-L99 HydrophobicContact CG1-CD2 4.4Å; V67-L99 HydrophobicContact CG1-CG 3.78Å; V67-L99 HydrophobicContact CG2-CD1 3.79Å; V67-L99 HydrophobicContact CG2-CG 4.47Å; V67-L102 VanDerWaalsContact CB-O 3.29Å; V67-L102 WeakPolarHBondContact CB-O 3.47Å; V67-L102 WeakPolarHBondContact CG2-O 3.34Å; V67-K103 PolarHBondContact N-O 2.88Å; V67-I105 HydrophobicContact CG2-CB 3.65Å; V67-I105 HydrophobicContact CG2-CG2 3.61Å
68	L	71.3	Confident	72.6	Confident	103 Å²	103	76.5 Å²	76.5	54%	0.539	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-95.2	150.2	174.2	-70	157	0	0	0	110.5	G70 D71	L68-G70 PolarHBondContact O-N 3.26Å; L68-D71 WeakPolarHBondContact O-CB 3.18Å; L68-D71 PolarHBondContact O-N 2.99Å
69	D	60.5	Low	74.1	Confident	151 Å²	151	74.3 Å²	74.3	81%	0.807	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-6.4	-176	-63.5	-38.4	0	0	0	115.2
70	G	71.6	Confident	75.1	Confident	63 Å²	63	71.3 Å²	71.3	65%	0.649	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	8.2	174	0	0	0	0	0	114.7	L68	L68-G70 PolarHBondContact O-N 3.26Å
71	D	77.2	Confident	76	Confident	2 Å²	2	73 Å²	73	1%	0.011	40%	0.397	C	S	.	.			trans	-94.3	131	179.2	-75.1	-15.6	0	0	0	111.3	R65 L68 K75 L76 L99 F100	R65-D71 IonicContact CZ-OD2 3.33Å; R65-D71 VanDerWaalsContact CZ-OD2 3.28Å; R65-D71 IonicContact NH1-OD2 2.68Å; R65-D71 PolarHBondContact NH1-OD2 3.15Å; R65-D71 IonicContact NH2-OD2 2.7Å; R65-D71 PolarHBondContact NH2-OD2 3.05Å; L68-D71 WeakPolarHBondContact O-CB 3.18Å; L68-D71 PolarHBondContact O-N 2.99Å; D71-K75 WeakPolarHBondContact OD1-CE 3.41Å; D71-K75 IonicContact OD1-NZ 2.79Å; D71-K75 PolarHBondContact OD1-NZ 2.9Å; D71-L76 HydrophobicContact CB-CG 4.48Å; D71-L99 WeakPolarHBondContact O-CD2 3.28Å; D71-F100 WeakPolarHBondContact O-CE1 3.32Å; D71-F100 VanDerWaalsContact O-CZ 3.32Å; D71-F100 WeakPolarHBondContact O-CZ 3.41Å
72	S	85.7	Confident	76.8	Confident	36 Å²	36	69.2 Å²	69.2	25%	0.252	38%	0.381	S	S	.	.			trans	-110.1	153.2	171.1	147.5	0	0	0	0	109	N74 K75 L76 E96	S72-N74 PolarHBondContact O-N 2.9Å; S72-N74 VanDerWaalsContact O-N 3.17Å; S72-N74 PolarHBondContact OG-N 2.81Å; S72-N74 VanDerWaalsContact OG-N 3.08Å; S72-K75 WeakPolarHBondContact O-CB 3.37Å; S72-K75 PolarHBondContact O-N 3.21Å; S72-L76 WeakPolarHBondContact O-CG 3.43Å; S72-L76 PolarHBondContact O-N 3.48Å; S72-E96 PolarHBondContact OG-OE1 3.41Å
73	L	82.9	Confident	77.7	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-55.1	-33.9	173.6	-72.4	176.9	0	0	0	112	A77 V84 L87 K88 L93 E96 L99 I105	L73-A77 WeakPolarHBondContact O-CB 3.39Å; L73-A77 PolarHBondContact O-N 3.04Å; L73-V84 HydrophobicContact CB-CG1 4.11Å; L73-V84 HydrophobicContact CD1-CG1 4.41Å; L73-L87 HydrophobicContact CD2-CB 4.29Å; L73-L87 HydrophobicContact CD2-CD2 4.01Å; L73-K88 HydrophobicContact CD1-CD 4.31Å; L73-K88 VanDerWaalsContact CD1-CE 3.46Å; L73-K88 HydrophobicContact CD1-CG 3.81Å; L73-L93 HydrophobicContact CD1-CD1 4.22Å; L73-L93 HydrophobicContact CD2-CD1 3.75Å; L73-E96 HydrophobicContact CB-CG 4.25Å; L73-E96 HydrophobicContact CD1-CB 4.14Å; L73-E96 HydrophobicContact CD1-CG 4.04Å; L73-E96 HydrophobicContact CG-CG 4.17Å; L73-E96 PolarHBondContact N-OE1 3.1Å; L73-L99 HydrophobicContact CD2-CD1 3.96Å; L73-L99 HydrophobicContact CD2-CD2 4.12Å; L73-L99 HydrophobicContact CD2-CG 4.45Å; L73-L99 HydrophobicContact CG-CB 4.43Å; L73-L99 HydrophobicContact CG-CD2 4.03Å; L73-I105 HydrophobicContact CD2-CD1 3.9Å
74	N	87.3	Confident	78.5	Confident	86 Å²	86	71.5 Å²	71.5	46%	0.46	39%	0.389	S	S	.	.	H	α-helix	trans	-68.1	-41.6	175.3	-75.1	3.7	0	0	0	111.8	S72 A77 L78 V84	S72-N74 PolarHBondContact O-N 2.9Å; S72-N74 VanDerWaalsContact O-N 3.17Å; S72-N74 PolarHBondContact OG-N 2.81Å; S72-N74 VanDerWaalsContact OG-N 3.08Å; N74-A77 PolarHBondContact O-N 2.82Å; N74-L78 VanDerWaalsContact O-CG 3.27Å; N74-L78 WeakPolarHBondContact O-CG 3.22Å; N74-L78 PolarHBondContact O-N 3.02Å; N74-V84 WeakPolarHBondContact OD1-CG2 3.3Å
75	K	87.1	Confident	79.1	Confident	108 Å²	108	68.7 Å²	68.7	47%	0.47	39%	0.386	S	S	.	.	H	α-helix	trans	-62.9	-45.2	177.4	-173.9	-172.8	173.8	-160.8	0	110.7	D71 S72 L78 Q79	D71-K75 WeakPolarHBondContact OD1-CE 3.41Å; D71-K75 IonicContact OD1-NZ 2.79Å; D71-K75 PolarHBondContact OD1-NZ 2.9Å; S72-K75 WeakPolarHBondContact O-CB 3.37Å; S72-K75 PolarHBondContact O-N 3.21Å; K75-L78 PolarHBondContact O-N 3.24Å; K75-Q79 VanDerWaalsContact O-CB 3.32Å; K75-Q79 WeakPolarHBondContact O-CB 3.46Å; K75-Q79 PolarHBondContact O-N 3.43Å
76	L	81.9	Confident	79.8	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	39%	0.385	C	S	.	.	H	α-helix	trans	-64.6	-43.2	176.1	-64.9	171.2	0	0	0	111.9	D71 S72 L78 Q79 Y80 L87 L99 I105 I107	D71-L76 HydrophobicContact CB-CG 4.48Å; S72-L76 WeakPolarHBondContact O-CG 3.43Å; S72-L76 PolarHBondContact O-N 3.48Å; L76-L78 VanDerWaalsContact C-N 3.29Å; L76-L78 PolarHBondContact O-N 3.4Å; L76-Q79 PolarHBondContact O-N 3Å; L76-Y80 HydrophobicContact CD2-CD2 4.43Å; L76-Y80 HydrophobicContact CD2-CE2 4.03Å; L76-Y80 WeakPolarHBondContact O-CB 3.27Å; L76-Y80 VanDerWaalsContact O-CD2 3.32Å; L76-Y80 WeakPolarHBondContact O-CD2 3.49Å; L76-Y80 PolarHBondContact O-N 3.31Å; L76-L87 HydrophobicContact CB-CD2 3.8Å; L76-L87 HydrophobicContact CD1-CD2 4.43Å; L76-L99 HydrophobicContact CD1-CD1 4.26Å; L76-L99 HydrophobicContact CD1-CD2 4.15Å; L76-I105 HydrophobicContact CD1-CD1 3.87Å; L76-I105 HydrophobicContact CD1-CG2 4.29Å; L76-I107 HydrophobicContact CD2-CD1 4.35Å
77	A	85.6	Confident	80.5	Confident	9 Å²	9	60.6 Å²	60.6	7%	0.074	35%	0.353	C	S	.	.	H	α-helix	trans	-57.4	-42.8	175.8	0	0	0	0	0	112.2	L73 N74 G81 C82 V84	L73-A77 WeakPolarHBondContact O-CB 3.39Å; L73-A77 PolarHBondContact O-N 3.04Å; N74-A77 PolarHBondContact O-N 2.82Å; A77-G81 CarbonylContact O-C 3.45Å; A77-G81 WeakPolarHBondContact O-CA 3.39Å; A77-G81 PolarHBondContact O-N 3.37Å; A77-C82 CarbonylContact C-O 3.54Å; A77-C82 VanDerWaalsContact CA-O 3.27Å; A77-C82 WeakPolarHBondContact CA-O 3.41Å; A77-C82 WeakPolarHBondContact CB-O 3.31Å; A77-C82 PolarHBondContact O-N 3.02Å; A77-V84 HydrophobicContact CB-CG2 3.61Å
78	L	85.8	Confident	81.1	Confident	150 Å²	150	62.7 Å²	62.7	79%	0.785	36%	0.36	S	S	*	.	H	α-helix	trans	-71.4	-44.9	177.7	-68.2	170.7	0	0	0	112.1	N74 K75 L76 Y80 G81	N74-L78 VanDerWaalsContact O-CG 3.27Å; N74-L78 WeakPolarHBondContact O-CG 3.22Å; N74-L78 PolarHBondContact O-N 3.02Å; K75-L78 PolarHBondContact O-N 3.24Å; L76-L78 VanDerWaalsContact C-N 3.29Å; L76-L78 PolarHBondContact O-N 3.4Å; L78-Y80 VanDerWaalsContact C-N 3.32Å; L78-Y80 PolarHBondContact O-N 3.45Å; L78-G81 PolarHBondContact O-N 3.19Å
79	Q	83.3	Confident	81.6	Confident	125 Å²	125	64.8 Å²	64.8	58%	0.584	36%	0.361	S	S	*	.	H	α-helix	trans	-61.2	-40.7	-179.4	-174.5	64.4	54.7	0	0	112.5	K75 L76	K75-Q79 VanDerWaalsContact O-CB 3.32Å; K75-Q79 WeakPolarHBondContact O-CB 3.46Å; K75-Q79 PolarHBondContact O-N 3.43Å; L76-Q79 PolarHBondContact O-N 3Å
80	Y	77.3	Confident	82.5	Confident	29 Å²	29	59.7 Å²	59.7	11%	0.114	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	7.1	-175.2	-64.7	-81	0	0	0	113.6	L63 R65 L76 L78 C82 I107 L115 L119	L63-Y80 HydrophobicContact CD2-CD1 4.08Å; L63-Y80 HydrophobicContact CD2-CE1 3.59Å; R65-Y80 WeakPolarHBondContact CD-OH 3.11Å; R65-Y80 PolarHBondContact NE-OH 2.89Å; L76-Y80 HydrophobicContact CD2-CD2 4.43Å; L76-Y80 HydrophobicContact CD2-CE2 4.03Å; L76-Y80 WeakPolarHBondContact O-CB 3.27Å; L76-Y80 VanDerWaalsContact O-CD2 3.32Å; L76-Y80 WeakPolarHBondContact O-CD2 3.49Å; L76-Y80 PolarHBondContact O-N 3.31Å; L78-Y80 VanDerWaalsContact C-N 3.32Å; L78-Y80 PolarHBondContact O-N 3.45Å; Y80-C82 PolarHBondContact O-N 2.81Å; Y80-C82 PolarHBondContact O-SG 3.04Å; Y80-I107 HydrophobicContact CD1-CG2 4.48Å; Y80-I107 HydrophobicContact CD2-CD1 3.52Å; Y80-I107 HydrophobicContact CD2-CG2 4.41Å; Y80-I107 HydrophobicContact CE2-CD1 3.53Å; Y80-I107 HydrophobicContact CG-CD1 4.09Å; Y80-I107 HydrophobicContact CG-CG2 4Å; Y80-L115 WeakPolarHBondContact O-CD1 3.47Å; Y80-L119 HydrophobicContact CE1-CD2 4.43Å
81	G	78.8	Confident	82.7	Confident	73 Å²	73	57.6 Å²	57.6	75%	0.753	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	25.4	-179.3	0	0	0	0	0	114.5	A77 L78	A77-G81 CarbonylContact O-C 3.45Å; A77-G81 WeakPolarHBondContact O-CA 3.39Å; A77-G81 PolarHBondContact O-N 3.37Å; L78-G81 PolarHBondContact O-N 3.19Å
82	C	82.1	Confident	82.8	Confident	20 Å²	20	64.2 Å²	64.2	14%	0.135	34%	0.344	C	S	.	.			trans	-101.7	152.5	-174.9	-67.7	0	0	0	0	111.6	A77 Y80 L87 P108	A77-C82 CarbonylContact C-O 3.54Å; A77-C82 VanDerWaalsContact CA-O 3.27Å; A77-C82 WeakPolarHBondContact CA-O 3.41Å; A77-C82 WeakPolarHBondContact CB-O 3.31Å; A77-C82 PolarHBondContact O-N 3.02Å; Y80-C82 PolarHBondContact O-N 2.81Å; Y80-C82 PolarHBondContact O-SG 3.04Å; C82-L87 HydrophobicContact CB-CD1 3.47Å; C82-L87 VanDerWaalsContact CB-CD1 3.47Å; C82-P108 PolarHBondContact SG-O 2.77Å
83	K	85.6	Confident	82.3	Confident	150 Å²	150	63 Å²	63	65%	0.652	34%	0.335	S	S	*	.			trans	-79.5	138.1	172.4	-63.4	174.3	-177.4	168.3	0	110	A85 D86 L87	K83-A85 PolarHBondContact O-N 2.83Å; K83-D86 HydrophobicContact CB-CB 4.4Å; K83-D86 WeakPolarHBondContact CB-OD2 3.29Å; K83-D86 WeakPolarHBondContact O-CA 3.4Å; K83-D86 WeakPolarHBondContact O-CB 3.45Å; K83-D86 PolarHBondContact O-N 3.43Å; K83-L87 PolarHBondContact O-N 3.46Å; K83-L87 VanDerWaalsContact O-N 3.1Å
84	V	84.7	Confident	81.4	Confident	37 Å²	37	71.2 Å²	71.2	22%	0.224	38%	0.375	C	S	.	.	H	α-helix	trans	-55	-37.3	175.4	178.2	0	0	0	0	112	L73 N74 A77 D86 L87 K88	L73-V84 HydrophobicContact CB-CG1 4.11Å; L73-V84 HydrophobicContact CD1-CG1 4.41Å; N74-V84 WeakPolarHBondContact OD1-CG2 3.3Å; A77-V84 HydrophobicContact CB-CG2 3.61Å; V84-D86 VanDerWaalsContact C-N 3.26Å; V84-D86 PolarHBondContact O-N 3.04Å; V84-L87 PolarHBondContact O-N 3.25Å; V84-K88 HydrophobicContact CG1-CD 4.23Å; V84-K88 HydrophobicContact CG1-CG 4.43Å; V84-K88 WeakPolarHBondContact O-CB 3.49Å; V84-K88 WeakPolarHBondContact O-CG 3.35Å; V84-K88 PolarHBondContact O-N 3.15Å
85	A	82.9	Confident	80.6	Confident	63 Å²	63	72.3 Å²	72.3	52%	0.521	38%	0.378	S	S	.	.	H	α-helix	trans	-65.1	-29.6	177.2	0	0	0	0	0	113.2	K83 R89	K83-A85 PolarHBondContact O-N 2.83Å; A85-R89 WeakPolarHBondContact O-CB 3.5Å; A85-R89 PolarHBondContact O-N 3.2Å
86	D	83.2	Confident	79.7	Confident	45 Å²	45	70.4 Å²	70.4	24%	0.241	37%	0.371	C	S	.	.	H	α-helix	trans	-80.1	-41.2	178.5	-61.6	-27.6	0	0	0	110.1	K83 V84 K88 R89 V90 P108	K83-D86 HydrophobicContact CB-CB 4.4Å; K83-D86 WeakPolarHBondContact CB-OD2 3.29Å; K83-D86 WeakPolarHBondContact O-CA 3.4Å; K83-D86 WeakPolarHBondContact O-CB 3.45Å; K83-D86 PolarHBondContact O-N 3.43Å; V84-D86 VanDerWaalsContact C-N 3.26Å; V84-D86 PolarHBondContact O-N 3.04Å; D86-K88 PolarHBondContact O-N 2.71Å; D86-R89 PolarHBondContact O-N 3.19Å; D86-R89 IonicContact OD1-CZ 3.98Å; D86-R89 IonicContact OD1-NH1 3.16Å; D86-R89 PolarHBondContact OD1-NH1 2.98Å; D86-R89 IonicContact OD1-NH2 3.34Å; D86-R89 PolarHBondContact OD1-NH2 2.99Å; D86-V90 VanDerWaalsContact O-CG2 3.27Å; D86-V90 WeakPolarHBondContact O-CG2 3.46Å; D86-V90 PolarHBondContact O-N 3.34Å; D86-P108 HydrophobicContact CB-CG 4.3Å
87	L	83.8	Confident	79.1	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-56.6	-47.3	170.4	-102.8	68.2	0	0	0	112	L73 L76 C82 K83 V84 R89 V90 N91 I105 I107 P108	L73-L87 HydrophobicContact CD2-CB 4.29Å; L73-L87 HydrophobicContact CD2-CD2 4.01Å; L76-L87 HydrophobicContact CB-CD2 3.8Å; L76-L87 HydrophobicContact CD1-CD2 4.43Å; C82-L87 HydrophobicContact CB-CD1 3.47Å; C82-L87 VanDerWaalsContact CB-CD1 3.47Å; K83-L87 PolarHBondContact O-N 3.46Å; K83-L87 VanDerWaalsContact O-N 3.1Å; V84-L87 PolarHBondContact O-N 3.25Å; L87-R89 VanDerWaalsContact C-N 3.34Å; L87-R89 PolarHBondContact O-N 3.27Å; L87-V90 PolarHBondContact O-N 2.97Å; L87-N91 PolarHBondContact O-N 3.34Å; L87-N91 VanDerWaalsContact O-N 3.14Å; L87-N91 PolarHBondContact O-ND2 3.11Å; L87-I105 HydrophobicContact CD2-CD1 4.13Å; L87-I105 HydrophobicContact CG-CD1 4.46Å; L87-I107 HydrophobicContact CD1-CG2 4.25Å; L87-P108 HydrophobicContact CD1-CG 4.44Å
88	K	84	Confident	78.2	Confident	66 Å²	66	79.7 Å²	79.7	29%	0.287	41%	0.414	S	S	.	.	H	α-helix	trans	-61	-43	178.8	-75.4	-178.3	176	-172.4	0	112.2	L73 V84 D86 N92 L93	L73-K88 HydrophobicContact CD1-CD 4.31Å; L73-K88 VanDerWaalsContact CD1-CE 3.46Å; L73-K88 HydrophobicContact CD1-CG 3.81Å; V84-K88 HydrophobicContact CG1-CD 4.23Å; V84-K88 HydrophobicContact CG1-CG 4.43Å; V84-K88 WeakPolarHBondContact O-CB 3.49Å; V84-K88 WeakPolarHBondContact O-CG 3.35Å; V84-K88 PolarHBondContact O-N 3.15Å; D86-K88 PolarHBondContact O-N 2.71Å; K88-N92 WeakPolarHBondContact O-CA 3.46Å; K88-N92 PolarHBondContact O-N 3.06Å; K88-L93 HydrophobicContact CB-CB 4.44Å; K88-L93 HydrophobicContact CG-CB 4.22Å; K88-L93 PolarHBondContact O-N 2.79Å
89	R	82.4	Confident	77.6	Confident	147 Å²	147	72.6 Å²	72.6	56%	0.555	38%	0.377	S	S	*	.	H	α-helix	trans	-68.1	-37.5	-179.5	-175.5	172	65.6	-107.9	2.1	112.7	A85 D86 L87	A85-R89 WeakPolarHBondContact O-CB 3.5Å; A85-R89 PolarHBondContact O-N 3.2Å; D86-R89 PolarHBondContact O-N 3.19Å; D86-R89 IonicContact OD1-CZ 3.98Å; D86-R89 IonicContact OD1-NH1 3.16Å; D86-R89 PolarHBondContact OD1-NH1 2.98Å; D86-R89 IonicContact OD1-NH2 3.34Å; D86-R89 PolarHBondContact OD1-NH2 2.99Å; L87-R89 VanDerWaalsContact C-N 3.34Å; L87-R89 PolarHBondContact O-N 3.27Å
90	V	79.1	Confident	77	Confident	44 Å²	44	71.3 Å²	71.3	27%	0.267	37%	0.37	S	S	.	.	H	α-helix	trans	-73.8	-30.3	-179.3	171.9	0	0	0	0	111.8	L62 D86 L87 K106 P108	L62-V90 HydrophobicContact CD2-CG1 3.66Å; L62-V90 HydrophobicContact CD2-CG2 4.49Å; D86-V90 VanDerWaalsContact O-CG2 3.27Å; D86-V90 WeakPolarHBondContact O-CG2 3.46Å; D86-V90 PolarHBondContact O-N 3.34Å; L87-V90 PolarHBondContact O-N 2.97Å; V90-K106 HydrophobicContact CG1-CB 3.66Å; V90-K106 WeakPolarHBondContact CG1-O 3.46Å; V90-P108 HydrophobicContact CG2-CB 4.3Å; V90-P108 HydrophobicContact CG2-CG 4.06Å
91	N	76.2	Confident	77	Confident	19 Å²	19	73.9 Å²	73.9	10%	0.102	40%	0.397	C	S	.	.	H	α-helix	trans	-104.9	5.1	-176.8	-65.8	-79.9	0	0	0	114.5	L87 L93 L102 K106	L87-N91 PolarHBondContact O-N 3.34Å; L87-N91 VanDerWaalsContact O-N 3.14Å; L87-N91 PolarHBondContact O-ND2 3.11Å; N91-L93 HydrophobicContact CB-CD1 3.88Å; N91-L93 HydrophobicContact CB-CG 3.74Å; N91-L93 PolarHBondContact O-N 3.29Å; N91-L102 HydrophobicContact CB-CD1 4.26Å; N91-K106 PolarHBondContact ND2-O 2.96Å; N91-K106 WeakPolarHBondContact OD1-CB 3.34Å; N91-K106 PolarHBondContact OD1-N 3.39Å
92	N	78.3	Confident	76.6	Confident	141 Å²	141	73.4 Å²	73.4	75%	0.754	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	35.9	-174.9	-57.2	-38.4	0	0	0	113.9	K88 M94	K88-N92 WeakPolarHBondContact O-CA 3.46Å; K88-N92 PolarHBondContact O-N 3.06Å; N92-M94 PolarHBondContact O-N 2.68Å
93	L	75.2	Confident	75.8	Confident	11 Å²	11	81.2 Å²	81.2	6%	0.058	41%	0.409	C	S	.	.			trans	-83.6	115.6	179.9	-61.6	171.6	0	0	0	109.9	L73 K88 N91 D98 L99 L102 I105	L73-L93 HydrophobicContact CD1-CD1 4.22Å; L73-L93 HydrophobicContact CD2-CD1 3.75Å; K88-L93 HydrophobicContact CB-CB 4.44Å; K88-L93 HydrophobicContact CG-CB 4.22Å; K88-L93 PolarHBondContact O-N 2.79Å; N91-L93 HydrophobicContact CB-CD1 3.88Å; N91-L93 HydrophobicContact CB-CG 3.74Å; N91-L93 PolarHBondContact O-N 3.29Å; L93-D98 HydrophobicContact CD2-CB 3.62Å; L93-D98 WeakPolarHBondContact CD2-O 3.33Å; L93-L99 HydrophobicContact CD1-CD1 4.31Å; L93-L102 HydrophobicContact CD2-CD1 3.54Å; L93-L102 HydrophobicContact CD2-CG 4.2Å; L93-L102 HydrophobicContact CG-CD1 4.33Å; L93-I105 HydrophobicContact CD1-CD1 4.4Å
94	M	65	Low	75.3	Confident	171 Å²	171	77.2 Å²	77.2	84%	0.842	40%	0.397	S	S	*	.	S	Bend	trans	-81.4	-34.4	178	-58.2	-170.5	79.2	0	0	110.4	N92 D98	N92-M94 PolarHBondContact O-N 2.68Å; M94-D98 PolarHBondContact N-OD2 2.91Å; M94-D98 VanDerWaalsContact N-OD2 3.14Å
95	Q	70.2	Confident	75.2	Confident	109 Å²	109	75.5 Å²	75.5	51%	0.509	39%	0.386	S	S	.	.	S	Bend	trans	-128.7	163.1	176.2	-62.1	-173	11.5	0	0	111.9	Q97 D98	Q95-Q97 PolarHBondContact O-N 3.2Å; Q95-D98 PolarHBondContact N-OD2 3.24Å; Q95-D98 WeakPolarHBondContact O-CB 3.5Å; Q95-D98 PolarHBondContact O-N 3.45Å
96	E	68.2	Low	75	Confident	69 Å²	69	76.4 Å²	76.4	32%	0.322	38%	0.378	S	S	.	.	S	Bend	trans	-70.3	-23.8	176.3	-175.6	162.9	-168.4	0	0	112.3	S72 L73 D98 L99	S72-E96 PolarHBondContact OG-OE1 3.41Å; L73-E96 HydrophobicContact CB-CG 4.25Å; L73-E96 HydrophobicContact CD1-CB 4.14Å; L73-E96 HydrophobicContact CD1-CG 4.04Å; L73-E96 HydrophobicContact CG-CG 4.17Å; L73-E96 PolarHBondContact N-OE1 3.1Å; E96-D98 VanDerWaalsContact C-N 3.31Å; E96-L99 WeakPolarHBondContact O-CB 3.42Å; E96-L99 PolarHBondContact O-N 3.26Å
97	Q	68.8	Low	74.9	Confident	147 Å²	147	74.3 Å²	74.3	69%	0.687	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-71.6	-25.6	175.8	-64.1	176.7	4.9	0	0	112.6	Q95 L99 F100	Q95-Q97 PolarHBondContact O-N 3.2Å; Q97-L99 PolarHBondContact O-N 3Å; Q97-F100 PolarHBondContact O-N 3.45Å
98	D	68.4	Low	74.6	Confident	58 Å²	58	75.1 Å²	75.1	31%	0.31	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-66.9	-16.6	176.8	-58.1	-21.7	0	0	0	111.8	L93 M94 Q95 E96 F100 A101	L93-D98 HydrophobicContact CD2-CB 3.62Å; L93-D98 WeakPolarHBondContact CD2-O 3.33Å; M94-D98 PolarHBondContact N-OD2 2.91Å; M94-D98 VanDerWaalsContact N-OD2 3.14Å; Q95-D98 PolarHBondContact N-OD2 3.24Å; Q95-D98 WeakPolarHBondContact O-CB 3.5Å; Q95-D98 PolarHBondContact O-N 3.45Å; E96-D98 VanDerWaalsContact C-N 3.31Å; D98-F100 VanDerWaalsContact C-N 3.32Å; D98-F100 PolarHBondContact O-N 2.99Å; D98-A101 WeakPolarHBondContact O-CB 3.36Å; D98-A101 PolarHBondContact O-N 3.38Å
99	L	72.8	Confident	74	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-58.4	-45.3	173.9	177.9	64.8	0	0	0	110.9	V67 D71 L73 L76 L93 E96 Q97 A101 L102 I105	V67-L99 HydrophobicContact CG1-CD1 4Å; V67-L99 HydrophobicContact CG1-CD2 4.4Å; V67-L99 HydrophobicContact CG1-CG 3.78Å; V67-L99 HydrophobicContact CG2-CD1 3.79Å; V67-L99 HydrophobicContact CG2-CG 4.47Å; D71-L99 WeakPolarHBondContact O-CD2 3.28Å; L73-L99 HydrophobicContact CD2-CD1 3.96Å; L73-L99 HydrophobicContact CD2-CD2 4.12Å; L73-L99 HydrophobicContact CD2-CG 4.45Å; L73-L99 HydrophobicContact CG-CB 4.43Å; L73-L99 HydrophobicContact CG-CD2 4.03Å; L76-L99 HydrophobicContact CD1-CD1 4.26Å; L76-L99 HydrophobicContact CD1-CD2 4.15Å; L93-L99 HydrophobicContact CD1-CD1 4.31Å; E96-L99 WeakPolarHBondContact O-CB 3.42Å; E96-L99 PolarHBondContact O-N 3.26Å; Q97-L99 PolarHBondContact O-N 3Å; L99-A101 PolarHBondContact O-N 3.49Å; L99-L102 PolarHBondContact O-N 3.01Å; L99-L102 VanDerWaalsContact O-N 3.09Å; L99-L102 VanDerWaalsContact O-O 3.11Å; L99-I105 HydrophobicContact CD1-CB 4.39Å; L99-I105 HydrophobicContact CD1-CD1 3.35Å; L99-I105 HydrophobicContact CD1-CG1 4.41Å
100	F	70.9	Confident	73.2	Confident	99 Å²	99	71.1 Å²	71.1	43%	0.434	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-16.2	-178.3	-58.7	-75.9	0	0	0	113	D71 Q97 D98 L102	D71-F100 WeakPolarHBondContact O-CE1 3.32Å; D71-F100 VanDerWaalsContact O-CZ 3.32Å; D71-F100 WeakPolarHBondContact O-CZ 3.41Å; Q97-F100 PolarHBondContact O-N 3.45Å; D98-F100 VanDerWaalsContact C-N 3.32Å; D98-F100 PolarHBondContact O-N 2.99Å; F100-L102 VanDerWaalsContact C-N 3.32Å
101	A	77.1	Confident	72.3	Confident	83 Å²	83	73.3 Å²	73.3	69%	0.686	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-21	172.7	0	0	0	0	0	112.1	D98 L99	D98-A101 WeakPolarHBondContact O-CB 3.36Å; D98-A101 PolarHBondContact O-N 3.38Å; L99-A101 PolarHBondContact O-N 3.49Å
102	L	69.3	Low	71.2	Confident	63 Å²	63	80.7 Å²	80.7	33%	0.33	40%	0.401	S	S	.	.			trans	-95.9	126.3	178	-62.2	-176.5	0	0	0	110.4	V67 N91 L93 L99 F100 V104	V67-L102 VanDerWaalsContact CB-O 3.29Å; V67-L102 WeakPolarHBondContact CB-O 3.47Å; V67-L102 WeakPolarHBondContact CG2-O 3.34Å; N91-L102 HydrophobicContact CB-CD1 4.26Å; L93-L102 HydrophobicContact CD2-CD1 3.54Å; L93-L102 HydrophobicContact CD2-CG 4.2Å; L93-L102 HydrophobicContact CG-CD1 4.33Å; L99-L102 PolarHBondContact O-N 3.01Å; L99-L102 VanDerWaalsContact O-N 3.09Å; L99-L102 VanDerWaalsContact O-O 3.11Å; F100-L102 VanDerWaalsContact C-N 3.32Å; L102-V104 VanDerWaalsContact C-N 3.3Å
103	K	65.9	Low	70.2	Confident	184 Å²	184	76.3 Å²	76.3	80%	0.8	38%	0.381	S	S	*	.	S	Bend	trans	-73.1	-23.4	172.8	-69.3	-178.9	175.6	-177.2	0	113	E66 V67	E66-K103 VanDerWaalsContact CA-O 3.28Å; E66-K103 WeakPolarHBondContact CA-O 3.49Å; V67-K103 PolarHBondContact N-O 2.88Å
104	V	75.4	Confident	69.5	Low	66 Å²	66	83.9 Å²	83.9	40%	0.4	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	131.5	-175.7	-176.8	0	0	0	0	109.7	E64 R65 L102	E64-V104 HydrophobicContact CB-CG1 4.04Å; E64-V104 HydrophobicContact CG-CG1 4.46Å; R65-V104 CarbonylContact O-C 3.54Å; R65-V104 WeakPolarHBondContact O-CA 3.14Å; L102-V104 VanDerWaalsContact C-N 3.3Å
105	I	81.4	Confident	69.1	Low	1 Å²	1	78.4 Å²	78.4	1%	0.005	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.5	177.2	-177.2	153.8	0	0	0	111.4	R65 V67 L73 L76 L87 L93 L99 I107	R65-I105 HydrophobicContact CB-CG2 4.21Å; R65-I105 PolarHBondContact N-O 3.14Å; R65-I105 WeakPolarHBondContact O-CG2 3.08Å; R65-I105 PolarHBondContact O-N 2.74Å; V67-I105 HydrophobicContact CG2-CB 3.65Å; V67-I105 HydrophobicContact CG2-CG2 3.61Å; L73-I105 HydrophobicContact CD2-CD1 3.9Å; L76-I105 HydrophobicContact CD1-CD1 3.87Å; L76-I105 HydrophobicContact CD1-CG2 4.29Å; L87-I105 HydrophobicContact CD2-CD1 4.13Å; L87-I105 HydrophobicContact CG-CD1 4.46Å; L93-I105 HydrophobicContact CD1-CD1 4.4Å; L99-I105 HydrophobicContact CD1-CB 4.39Å; L99-I105 HydrophobicContact CD1-CD1 3.35Å; L99-I105 HydrophobicContact CD1-CG1 4.41Å; I105-I107 HydrophobicContact CG1-CG1 4.26Å; I105-I107 HydrophobicContact CG2-CD1 4.36Å; I105-I107 HydrophobicContact CG2-CG1 4.39Å
106	K	78.8	Confident	68.4	Low	82 Å²	82	75.3 Å²	75.3	36%	0.357	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	112.8	175.4	-67.6	177.7	-177.3	-156.7	0	110.5	L63 E64 V90 N91	L63-K106 CarbonylContact O-C 3.56Å; L63-K106 WeakPolarHBondContact O-CA 3.27Å; E64-K106 HydrophobicContact CG-CG 3.96Å; E64-K106 WeakPolarHBondContact OE1-CE 3.32Å; E64-K106 IonicContact OE1-NZ 3.5Å; E64-K106 PolarHBondContact OE1-NZ 2.76Å; V90-K106 HydrophobicContact CG1-CB 3.66Å; V90-K106 WeakPolarHBondContact CG1-O 3.46Å; N91-K106 PolarHBondContact ND2-O 2.96Å; N91-K106 WeakPolarHBondContact OD1-CB 3.34Å; N91-K106 PolarHBondContact OD1-N 3.39Å
107	I	82.3	Confident	68	Low	0 Å²	0	79.1 Å²	79.1	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	119.5	-177.8	-60.7	174.9	0	0	0	108.3	L63 R65 L76 Y80 L87 I105 V109	L63-I107 HydrophobicContact CB-CB 4.37Å; L63-I107 PolarHBondContact N-O 2.91Å; L63-I107 PolarHBondContact O-N 2.76Å; R65-I107 HydrophobicContact CB-CD1 4.41Å; L76-I107 HydrophobicContact CD2-CD1 4.35Å; Y80-I107 HydrophobicContact CD1-CG2 4.48Å; Y80-I107 HydrophobicContact CD2-CD1 3.52Å; Y80-I107 HydrophobicContact CD2-CG2 4.41Å; Y80-I107 HydrophobicContact CE2-CD1 3.53Å; Y80-I107 HydrophobicContact CG-CD1 4.09Å; Y80-I107 HydrophobicContact CG-CG2 4Å; L87-I107 HydrophobicContact CD1-CG2 4.25Å; I105-I107 HydrophobicContact CG1-CG1 4.26Å; I105-I107 HydrophobicContact CG2-CD1 4.36Å; I105-I107 HydrophobicContact CG2-CG1 4.39Å; I107-V109 HydrophobicContact CG2-CG2 3.95Å; I107-V109 PolarHBondContact O-N 3.48Å
108	P	75.9	Confident	67.2	Low	17 Å²	17	77 Å²	77	11%	0.11	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	95.4	175.5	29.1	-32.7	0	0	0	110.7	V60 L62 C82 D86 L87 V90	V60-P108 HydrophobicContact CG1-CB 3.26Å; L62-P108 HydrophobicContact CD2-CB 4.26Å; C82-P108 PolarHBondContact SG-O 2.77Å; D86-P108 HydrophobicContact CB-CG 4.3Å; L87-P108 HydrophobicContact CD1-CG 4.44Å; V90-P108 HydrophobicContact CG2-CB 4.3Å; V90-P108 HydrophobicContact CG2-CG 4.06Å
109	V	73.4	Confident	66.3	Low	7 Å²	7	77.2 Å²	77.2	4%	0.042	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	140.6	175.6	-172.1	0	0	0	0	109.4	V60 Q61 L63 I107 L115	V60-V109 WeakPolarHBondContact CA-O 3.4Å; Q61-V109 PolarHBondContact N-O 2.8Å; Q61-V109 PolarHBondContact O-N 2.99Å; L63-V109 HydrophobicContact CB-CG2 3.72Å; L63-V109 HydrophobicContact CD2-CG2 4.01Å; I107-V109 HydrophobicContact CG2-CG2 3.95Å; I107-V109 PolarHBondContact O-N 3.48Å; V109-L115 HydrophobicContact CG1-CB 4.2Å
110	Q	65.6	Low	65	Low	122 Å²	122	82.1 Å²	82.1	57%	0.57	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	130.3	175.9	-61.8	-176.3	14	0	0	109.6	H112 S113	Q110-H112 PolarHBondContact O-N 3.03Å; Q110-S113 PolarHBondContact O-N 3.28Å
111	K	59.1	Low	63.8	Low	90 Å²	90	85.5 Å²	85.5	39%	0.391	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-10	-173.2	-71.3	176.4	-174.2	174.4	0	116.4	R58 N59 Q61	R58-K111 PolarHBondContact O-NZ 3.48Å; N59-K111 WeakPolarHBondContact O-CG 3.32Å; N59-K111 PolarHBondContact O-N 3.06Å; Q61-K111 HydrophobicContact CB-CG 3.89Å
112	H	54.1	Low	62.1	Low	174 Å²	174	89.4 Å²	89.4	81%	0.806	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.1	20.2	-179.2	-54.9	-59.1	0	0	0	112.7	Q110	Q110-H112 PolarHBondContact O-N 3.03Å
113	S	57.3	Low	60.5	Low	50 Å²	50	95 Å²	95	35%	0.35	47%	0.472	S	S	.	.	S	Bend	trans	-93.6	134.2	172.7	-171.2	0	0	0	0	108.5	Q110 L115 T116	Q110-S113 PolarHBondContact O-N 3.28Å; S113-L115 PolarHBondContact O-N 3.36Å; S113-T116 PolarHBondContact O-N 3.31Å
114	F	59.5	Low	58.9	Low	170 Å²	170	92.8 Å²	92.8	75%	0.746	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.1	-14.9	177.6	-91.1	-97.5	0	0	0	116.4
115	L	56	Low	57.2	Low	55 Å²	55	95 Å²	95	29%	0.288	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-21	177.5	-57.5	-177.8	0	0	0	114.4	Y80 V109 S113	Y80-L115 WeakPolarHBondContact O-CD1 3.47Å; V109-L115 HydrophobicContact CG1-CB 4.2Å; S113-L115 PolarHBondContact O-N 3.36Å
116	T	56.8	Low	55	Low	45 Å²	45	103.2 Å²	103.2	28%	0.276	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-31.1	178.6	-52.9	0	0	0	0	112	S113	S113-T116 PolarHBondContact O-N 3.31Å
117	E	58.5	Low	53	Low	149 Å²	149	107.2 Å²	107.2	70%	0.696	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-37.6	-179	-67.4	178.3	173.8	0	0	112.3	L119	E117-L119 PolarHBondContact O-N 3.47Å
118	T	51.6	Low	50.9	Low	102 Å²	102	115.6 Å²	115.6	63%	0.626	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-13.9	-173.5	53	0	0	0	0	115.2
119	L	50.9	Low	49.8	Very low	63 Å²	63	120.9 Å²	120.9	33%	0.33	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-113.6	-19.1	-176.1	-161.7	72.4	0	0	0	113.9	L63 Y80 E117 E121 Q122	L63-L119 HydrophobicContact CD1-CD2 4Å; L63-L119 HydrophobicContact CD2-CD2 3.61Å; L63-L119 HydrophobicContact CG-CD2 4.34Å; Y80-L119 HydrophobicContact CE1-CD2 4.43Å; E117-L119 PolarHBondContact O-N 3.47Å; L119-E121 PolarHBondContact O-N 3.47Å; L119-E121 VanDerWaalsContact O-N 3.15Å; L119-Q122 PolarHBondContact O-N 3.05Å
120	S	45.8	Very low	48.4	Very low	102 Å²	102	126.2 Å²	126.2	71%	0.713	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-64.1	-12.5	171	-104.7	0	0	0	0	113.1	Q122	S120-Q122 VanDerWaalsContact C-N 3.34Å
121	E	44.4	Very low	47.1	Very low	171 Å²	171	126.4 Å²	126.4	80%	0.799	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-80.9	-8	177.6	-138.4	170.9	127.7	0	0	113.9	L119	L119-E121 PolarHBondContact O-N 3.47Å; L119-E121 VanDerWaalsContact O-N 3.15Å
122	Q	42.2	Very low	45.8	Very low	165 Å²	165	126.9 Å²	126.9	77%	0.771	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-103.9	9.7	-170.5	-133.8	-177.6	-77.3	0	0	115.7	L119 S120	L119-Q122 PolarHBondContact O-N 3.05Å; S120-Q122 VanDerWaalsContact C-N 3.34Å
123	H	35.6	Very low	45.1	Very low	179 Å²	179	124 Å²	124	83%	0.829	67%	0.671	S	S	*	*	S	Bend	trans	-130.1	51.4	175.1	-165.8	-76	0	0	0	112.6
124	D	31.9	Very low	44.5	Very low	138 Å²	138	130 Å²	130	74%	0.738	69%	0.694	S	S	*	*			trans	-165.7	123.7	147.5	-132.5	-15.7	0	0	0	111.8
125	P	40.7	Very low	43.3	Very low	113 Å²	113	129.4 Å²	129.4	73%	0.734	70%	0.698	S	S	*	*			trans	-106.4	103.7	160.2	27.6	-13.3	0	0	0	110.3
126	Q	33.9	Very low	42.3	Very low	174 Å²	174	130.2 Å²	130.2	81%	0.813	72%	0.72	S	S	*	*			trans	151.1	125.8	155.9	-86	168.5	-19.1	0	0	107.3
127	E	37.4	Very low	41.2	Very low	166 Å²	166	132.4 Å²	132.4	78%	0.776	74%	0.742	S	S	*	*			cis	-168.6	136.3	34.1	-142.7	167.9	-169.4	0	0	108.2
128	E	39.4	Very low	40.5	Very low	175 Å²	175	130.3 Å²	130.3	82%	0.818	74%	0.742	S	S	*	*			trans	43.6	119	149.8	-58.4	-173.6	-178.9	0	0	122.3
129	V	51	Low	40.1	Very low	129 Å²	129	134.9 Å²	134.9	78%	0.782	75%	0.753	S	S	*	*			trans	-54.7	149.2	158.2	-134.8	0	0	0	0	110.5
130	P	44.8	Very low	40.2	Very low	118 Å²	118	137.3 Å²	137.3	77%	0.766	76%	0.763	S	S	*	*				-143.1	152	87.5	33.1	-15.5	0	0	0	115	S132	P130-S132 PolarHBondContact O-N 3.44Å
131	C	38.2	Very low	40.4	Very low	127 Å²	127	136.5 Å²	136.5	86%	0.858	76%	0.755	S	S	*	*			trans	-40	134.5	165.4	-77.9	0	0	0	0	112.9
132	S	30.9	Very low	40.7	Very low	99 Å²	99	138.1 Å²	138.1	69%	0.692	75%	0.754	S	S	*	*			trans	-138.2	117	147	55.3	0	0	0	0	110.9	P130 H134	P130-S132 PolarHBondContact O-N 3.44Å; S132-H134 PolarHBondContact O-N 2.96Å
133	T	41	Very low	41.6	Very low	113 Å²	113	134.9 Å²	134.9	69%	0.693	75%	0.745	S	S	*	*			trans	-35.2	124.7	156.8	-57.4	0	0	0	0	112.3
134	H	43.9	Very low	43.1	Very low	178 Å²	178	132.8 Å²	132.8	82%	0.824	73%	0.73	S	S	*	*			trans	-134.1	116.1	147.8	-81.1	-71.5	0	0	0	109.9	S132	S132-H134 PolarHBondContact O-N 2.96Å
135	D	35.2	Very low	44.9	Very low	156 Å²	156	131 Å²	131	83%	0.834	72%	0.72	S	S	*	*			trans	-51.2	150.3	172.2	-70.4	-61.8	0	0	0	114.2
136	G	33.3	Very low	46.6	Very low	72 Å²	72	129.6 Å²	129.6	74%	0.742	71%	0.71	S	S	*	*			trans	145.6	85.2	146.9	0	0	0	0	0	118.1
137	A	35	Very low	48.8	Very low	91 Å²	91	124.9 Å²	124.9	75%	0.752	69%	0.693	S	S	*	*			trans	78.9	149.5	149.1	0	0	0	0	0	120.2	F139	A137-F139 PolarHBondContact O-N 2.88Å
138	P	44.2	Very low	51.1	Low	105 Å²	105	121 Å²	121	68%	0.682	68%	0.678	S	S	*	*			trans	-86.7	114.8	-149.9	-5.5	24.4	0	0	0	113.6	E140	P138-E140 HydrophobicContact CB-CB 4.36Å; P138-E140 PolarHBondContact O-N 3.18Å
139	F	42.1	Very low	53.4	Low	198 Å²	198	118.9 Å²	118.9	87%	0.868	67%	0.666	S	S	*	*			trans	-85.8	22.2	159.9	-89.1	-89	0	0	0	112.4	A137	A137-F139 PolarHBondContact O-N 2.88Å
140	E	53	Low	55.3	Low	114 Å²	114	117.9 Å²	117.9	53%	0.533	66%	0.656	S	S	.	*	H	α-helix	trans	-81.3	-10.8	-176.2	-127.5	-162.4	149	0	0	117.6	P138 R144	P138-E140 HydrophobicContact CB-CB 4.36Å; P138-E140 PolarHBondContact O-N 3.18Å; E140-R144 WeakPolarHBondContact O-CD 3.46Å; E140-R144 WeakPolarHBondContact O-CG 3.5Å; E140-R144 IonicContact OE1-CZ 2.71Å; E140-R144 IonicContact OE1-NH1 2.77Å; E140-R144 PolarHBondContact OE1-NH1 3.4Å; E140-R144 IonicContact OE1-NH2 3.28Å; E140-R144 IonicContact OE2-NH1 3.41Å; E140-R144 PolarHBondContact OE2-NH1 3.35Å
141	P	50.5	Low	57.2	Low	85 Å²	85	118.3 Å²	118.3	55%	0.552	65%	0.649	S	S	*	*	H	α-helix	trans	-72.8	-42.1	179.3	-16.5	29.2	0	0	0	112.8	D145	P141-D145 PolarHBondContact O-N 3.17Å
142	R	51.2	Low	59.6	Low	205 Å²	205	119 Å²	119	77%	0.774	64%	0.639	S	S	*	*	H	α-helix	trans	-79.8	-28.5	-165.3	-125.5	-172.1	-164.2	-172.9	5	114.7	V146	R142-V146 WeakPolarHBondContact O-CG2 3.47Å; R142-V146 PolarHBondContact O-N 3.38Å
143	V	60.8	Low	62.4	Low	98 Å²	98	117.3 Å²	117.3	59%	0.594	63%	0.625	S	S	*	*	H	α-helix	trans	-74.9	-36.2	178.8	-178	0	0	0	0	109.9	V146 T147	V143-V146 PolarHBondContact O-N 3.37Å; V143-T147 PolarHBondContact O-N 3.01Å; V143-T147 PolarHBondContact O-OG1 3.47Å
144	R	66.2	Low	64.7	Low	135 Å²	135	116.9 Å²	116.9	51%	0.509	62%	0.618	S	S	.	*	H	α-helix	trans	-61.5	-46	172.5	-69.9	175.5	125.2	127.3	6.7	111.4	E140 V146 T147 D148	E140-R144 WeakPolarHBondContact O-CD 3.46Å; E140-R144 WeakPolarHBondContact O-CG 3.5Å; E140-R144 IonicContact OE1-CZ 2.71Å; E140-R144 IonicContact OE1-NH1 2.77Å; E140-R144 PolarHBondContact OE1-NH1 3.4Å; E140-R144 IonicContact OE1-NH2 3.28Å; E140-R144 IonicContact OE2-NH1 3.41Å; E140-R144 PolarHBondContact OE2-NH1 3.35Å; R144-V146 PolarHBondContact O-N 3Å; R144-T147 WeakPolarHBondContact CA-OG1 3.46Å; R144-T147 PolarHBondContact O-N 2.84Å; R144-T147 VanDerWaalsContact O-N 3.15Å; R144-T147 PolarHBondContact O-OG1 3.14Å; R144-D148 VanDerWaalsContact O-CB 3.31Å; R144-D148 WeakPolarHBondContact O-CB 3.32Å; R144-D148 PolarHBondContact O-N 2.97Å
145	D	70.9	Confident	66.9	Low	99 Å²	99	112.1 Å²	112.1	53%	0.529	61%	0.605	S	S	.	*	H	α-helix	trans	-58	-37.5	176.4	-60.9	-29.1	0	0	0	112.4	P141 F149	P141-D145 PolarHBondContact O-N 3.17Å; D145-F149 VanDerWaalsContact O-CB 3.32Å; D145-F149 WeakPolarHBondContact O-CB 3.34Å; D145-F149 PolarHBondContact O-N 2.91Å
146	V	75.7	Confident	69.4	Low	84 Å²	84	109.8 Å²	109.8	51%	0.509	59%	0.592	S	S	.	*	H	α-helix	trans	-72.9	-40.8	178	176.1	0	0	0	0	111.2	R142 V143 R144 D148 L150	R142-V146 WeakPolarHBondContact O-CG2 3.47Å; R142-V146 PolarHBondContact O-N 3.38Å; V143-V146 PolarHBondContact O-N 3.37Å; R144-V146 PolarHBondContact O-N 3Å; V146-D148 VanDerWaalsContact C-N 3.35Å; V146-L150 HydrophobicContact CG1-CD1 4.1Å; V146-L150 HydrophobicContact CG1-CG 4.49Å; V146-L150 WeakPolarHBondContact O-CB 3.29Å; V146-L150 WeakPolarHBondContact O-CG 3.24Å; V146-L150 PolarHBondContact O-N 3.24Å
147	T	80.9	Confident	71.7	Confident	75 Å²	75	111.8 Å²	111.8	46%	0.46	58%	0.584	S	S	.	*	H	α-helix	trans	-68.2	-36.7	176.2	51.9	0	0	0	0	112.1	V143 R144 L150 M151	V143-T147 PolarHBondContact O-N 3.01Å; V143-T147 PolarHBondContact O-OG1 3.47Å; R144-T147 WeakPolarHBondContact CA-OG1 3.46Å; R144-T147 PolarHBondContact O-N 2.84Å; R144-T147 VanDerWaalsContact O-N 3.15Å; R144-T147 PolarHBondContact O-OG1 3.14Å; T147-L150 PolarHBondContact O-N 3.48Å; T147-M151 VanDerWaalsContact O-CB 3.29Å; T147-M151 WeakPolarHBondContact O-CB 3.47Å; T147-M151 PolarHBondContact O-N 2.71Å
148	D	84.4	Confident	74	Confident	86 Å²	86	111.1 Å²	111.1	46%	0.46	57%	0.568	S	S	.	*	H	α-helix	trans	-68.4	-41.9	177.9	-69	-14.7	0	0	0	110.5	R144 V146 M151 E152	R144-D148 VanDerWaalsContact O-CB 3.31Å; R144-D148 WeakPolarHBondContact O-CB 3.32Å; R144-D148 PolarHBondContact O-N 2.97Å; V146-D148 VanDerWaalsContact C-N 3.35Å; D148-M151 PolarHBondContact O-N 3.38Å; D148-E152 WeakPolarHBondContact O-CB 3.5Å; D148-E152 PolarHBondContact O-N 2.88Å
149	F	88.8	Confident	75.7	Confident	130 Å²	130	112.4 Å²	112.4	57%	0.57	56%	0.563	S	S	*	*	H	α-helix	trans	-62.9	-44.4	173.1	179.5	-96.5	0	0	0	112.6	D145 M151 E152 V153	D145-F149 VanDerWaalsContact O-CB 3.32Å; D145-F149 WeakPolarHBondContact O-CB 3.34Å; D145-F149 PolarHBondContact O-N 2.91Å; F149-M151 VanDerWaalsContact C-N 3.3Å; F149-M151 PolarHBondContact O-N 3.19Å; F149-E152 PolarHBondContact O-N 3.35Å; F149-V153 HydrophobicContact CD1-CG2 4.2Å; F149-V153 HydrophobicContact CE1-CG2 3.77Å; F149-V153 HydrophobicContact CE2-CG2 4.19Å; F149-V153 HydrophobicContact CZ-CG2 3.76Å; F149-V153 VanDerWaalsContact O-CG2 3.3Å; F149-V153 WeakPolarHBondContact O-CG2 3.32Å; F149-V153 PolarHBondContact O-N 3.09Å
150	L	89.5	Confident	77.4	Confident	108 Å²	108	108.4 Å²	108.4	57%	0.565	55%	0.55	S	S	*	.	H	α-helix	trans	-64	-37.9	178.4	-71.6	173.2	0	0	0	111.6	V146 T147 D154	V146-L150 HydrophobicContact CG1-CD1 4.1Å; V146-L150 HydrophobicContact CG1-CG 4.49Å; V146-L150 WeakPolarHBondContact O-CB 3.29Å; V146-L150 WeakPolarHBondContact O-CG 3.24Å; V146-L150 PolarHBondContact O-N 3.24Å; T147-L150 PolarHBondContact O-N 3.48Å; L150-D154 WeakPolarHBondContact O-CB 3.43Å; L150-D154 PolarHBondContact O-N 3.17Å; L150-D154 VanDerWaalsContact O-N 3.11Å
151	M	86.3	Confident	78.7	Confident	127 Å²	127	108.2 Å²	108.2	63%	0.626	55%	0.551	S	S	*	*	H	α-helix	trans	-69.6	-37.1	175.9	-175.9	176.5	66.9	0	0	112.3	T147 D148 F149 S155	T147-M151 VanDerWaalsContact O-CB 3.29Å; T147-M151 WeakPolarHBondContact O-CB 3.47Å; T147-M151 PolarHBondContact O-N 2.71Å; D148-M151 PolarHBondContact O-N 3.38Å; F149-M151 VanDerWaalsContact C-N 3.3Å; F149-M151 PolarHBondContact O-N 3.19Å; M151-S155 WeakPolarHBondContact O-CB 3.28Å; M151-S155 PolarHBondContact O-N 3.09Å
152	E	86.9	Confident	79.6	Confident	141 Å²	141	111.1 Å²	111.1	66%	0.659	56%	0.557	S	S	*	*	H	α-helix	trans	-66.2	-42.8	175.7	-175.3	172.5	-173.4	0	0	111.9	D148 F149 S155 D156	D148-E152 WeakPolarHBondContact O-CB 3.5Å; D148-E152 PolarHBondContact O-N 2.88Å; F149-E152 PolarHBondContact O-N 3.35Å; E152-S155 PolarHBondContact O-N 3.3Å; E152-D156 PolarHBondContact O-N 3.33Å
153	V	90.3	Very high	80.1	Confident	64 Å²	64	105.7 Å²	105.7	39%	0.388	55%	0.547	S	S	.	.	H	α-helix	trans	-63.5	-43.6	176.3	171.5	0	0	0	0	111.5	F149 S155 D156 M157	F149-V153 HydrophobicContact CD1-CG2 4.2Å; F149-V153 HydrophobicContact CE1-CG2 3.77Å; F149-V153 HydrophobicContact CE2-CG2 4.19Å; F149-V153 HydrophobicContact CZ-CG2 3.76Å; F149-V153 VanDerWaalsContact O-CG2 3.3Å; F149-V153 WeakPolarHBondContact O-CG2 3.32Å; F149-V153 PolarHBondContact O-N 3.09Å; V153-S155 VanDerWaalsContact C-N 3.3Å; V153-S155 PolarHBondContact O-N 3.39Å; V153-D156 PolarHBondContact O-N 3.46Å; V153-M157 PolarHBondContact O-N 3.3Å
154	D	89.7	Confident	80.1	Confident	104 Å²	104	106.1 Å²	106.1	56%	0.556	55%	0.55	S	S	*	*	H	α-helix	trans	-62.2	-41.4	177.8	-157.8	47.8	0	0	0	110.9	L150 D156 M157 D158	L150-D154 WeakPolarHBondContact O-CB 3.43Å; L150-D154 PolarHBondContact O-N 3.17Å; L150-D154 VanDerWaalsContact O-N 3.11Å; D154-D156 PolarHBondContact O-N 3.47Å; D154-M157 WeakPolarHBondContact O-CB 3.33Å; D154-M157 PolarHBondContact O-N 2.93Å; D154-D158 PolarHBondContact O-N 3.28Å
155	S	90.2	Very high	79.8	Confident	77 Å²	77	103.8 Å²	103.8	54%	0.538	55%	0.552	S	S	.	*	H	α-helix	trans	-66.7	-35.9	176.9	-154.3	0	0	0	0	113.4	M151 E152 V153 D158 K159	M151-S155 WeakPolarHBondContact O-CB 3.28Å; M151-S155 PolarHBondContact O-N 3.09Å; E152-S155 PolarHBondContact O-N 3.3Å; V153-S155 VanDerWaalsContact C-N 3.3Å; V153-S155 PolarHBondContact O-N 3.39Å; S155-D158 PolarHBondContact O-N 3.43Å; S155-K159 WeakPolarHBondContact O-CB 3.27Å; S155-K159 PolarHBondContact O-N 3.28Å
156	D	88.3	Confident	78.6	Confident	107 Å²	107	106.1 Å²	106.1	57%	0.572	57%	0.565	S	S	*	*	H	α-helix	trans	-69.4	-35.7	174.9	-165.3	45	0	0	0	111.9	E152 V153 D154 K159 L160	E152-D156 PolarHBondContact O-N 3.33Å; V153-D156 PolarHBondContact O-N 3.46Å; D154-D156 PolarHBondContact O-N 3.47Å; D156-K159 PolarHBondContact O-N 3.5Å; D156-L160 PolarHBondContact O-N 3.11Å
157	M	81.3	Confident	77.2	Confident	114 Å²	114	109.1 Å²	109.1	56%	0.562	57%	0.573	S	S	*	*	H	α-helix	trans	-62.6	-44.9	172.4	-76.8	-151	61.5	0	0	112.3	V153 D154 K159 L160 I161	V153-M157 PolarHBondContact O-N 3.3Å; D154-M157 WeakPolarHBondContact O-CB 3.33Å; D154-M157 PolarHBondContact O-N 2.93Å; M157-K159 VanDerWaalsContact C-N 3.3Å; M157-K159 PolarHBondContact O-N 2.95Å; M157-L160 PolarHBondContact O-N 2.83Å; M157-I161 WeakPolarHBondContact O-CD1 3.34Å; M157-I161 WeakPolarHBondContact O-CG1 3.32Å; M157-I161 PolarHBondContact O-N 3.46Å; M157-I161 VanDerWaalsContact O-N 3.17Å
158	D	83.4	Confident	75.9	Confident	78 Å²	78	113.8 Å²	113.8	42%	0.417	59%	0.589	S	S	.	*	H	α-helix	trans	-64.7	-36.2	176.9	-77.4	-32.1	0	0	0	112.4	D154 S155 I161 Q162	D154-D158 PolarHBondContact O-N 3.28Å; S155-D158 PolarHBondContact O-N 3.43Å; D158-I161 PolarHBondContact O-N 2.59Å; D158-Q162 WeakPolarHBondContact O-CB 3.22Å; D158-Q162 VanDerWaalsContact O-CG 3.28Å; D158-Q162 WeakPolarHBondContact O-CG 3.42Å; D158-Q162 PolarHBondContact O-N 3.08Å; D158-Q162 PolarHBondContact O-NE2 2.96Å
159	K	79.8	Confident	74.1	Confident	132 Å²	132	118 Å²	118	57%	0.574	61%	0.607	S	S	*	*	H	α-helix	trans	-67	-40.3	175.9	-169.2	-178.9	177	-170.4	0	111.4	S155 D156 M157 I161 Q162 T163	S155-K159 WeakPolarHBondContact O-CB 3.27Å; S155-K159 PolarHBondContact O-N 3.28Å; D156-K159 PolarHBondContact O-N 3.5Å; M157-K159 VanDerWaalsContact C-N 3.3Å; M157-K159 PolarHBondContact O-N 2.95Å; K159-I161 VanDerWaalsContact C-N 3.34Å; K159-I161 PolarHBondContact O-N 2.97Å; K159-Q162 PolarHBondContact O-N 3.17Å; K159-T163 HydrophobicContact CG-CG2 4.33Å; K159-T163 WeakPolarHBondContact O-CB 3.36Å; K159-T163 VanDerWaalsContact O-CG2 3.24Å; K159-T163 WeakPolarHBondContact O-CG2 3.45Å; K159-T163 PolarHBondContact O-N 3.25Å; K159-T163 PolarHBondContact O-OG1 2.7Å; K159-T163 VanDerWaalsContact O-OG1 3.11Å
160	L	77.5	Confident	71.9	Confident	114 Å²	114	118.7 Å²	118.7	60%	0.597	62%	0.616	S	S	*	*	H	α-helix	trans	-59.5	-45.8	175.4	-178.2	62.4	0	0	0	111.4	D156 M157 Q162 T163 T164	D156-L160 PolarHBondContact O-N 3.11Å; M157-L160 PolarHBondContact O-N 2.83Å; L160-Q162 VanDerWaalsContact C-N 3.3Å; L160-Q162 PolarHBondContact O-N 3.24Å; L160-T163 WeakPolarHBondContact CA-OG1 3.49Å; L160-T163 PolarHBondContact O-N 3.03Å; L160-T163 PolarHBondContact O-OG1 3.33Å; L160-T164 PolarHBondContact O-N 3.38Å; L160-T164 PolarHBondContact O-OG1 3.46Å
161	I	79.5	Confident	69.5	Low	109 Å²	109	121 Å²	121	56%	0.559	62%	0.622	S	S	*	*	H	α-helix	trans	-63.7	-37.2	178.4	-62.7	163.3	0	0	0	111.1	M157 D158 K159 T164	M157-I161 WeakPolarHBondContact O-CD1 3.34Å; M157-I161 WeakPolarHBondContact O-CG1 3.32Å; M157-I161 PolarHBondContact O-N 3.46Å; M157-I161 VanDerWaalsContact O-N 3.17Å; D158-I161 PolarHBondContact O-N 2.59Å; K159-I161 VanDerWaalsContact C-N 3.34Å; K159-I161 PolarHBondContact O-N 2.97Å; I161-T164 PolarHBondContact O-OG1 2.9Å
162	Q	69.1	Low	67.7	Low	146 Å²	146	120.4 Å²	120.4	68%	0.682	63%	0.631	S	S	*	*	H	α-helix	trans	-76.9	-28.6	177.5	-72.3	174.2	56.8	0	0	113.6	D158 K159 L160 T164 P165	D158-Q162 WeakPolarHBondContact O-CB 3.22Å; D158-Q162 VanDerWaalsContact O-CG 3.28Å; D158-Q162 WeakPolarHBondContact O-CG 3.42Å; D158-Q162 PolarHBondContact O-N 3.08Å; D158-Q162 PolarHBondContact O-NE2 2.96Å; K159-Q162 PolarHBondContact O-N 3.17Å; L160-Q162 VanDerWaalsContact C-N 3.3Å; L160-Q162 PolarHBondContact O-N 3.24Å; Q162-T164 PolarHBondContact O-N 2.89Å; Q162-P165 WeakPolarHBondContact O-CD 3.5Å
163	T	62.3	Low	65.5	Low	92 Å²	92	123.3 Å²	123.3	56%	0.564	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-2.8	174.9	58.5	0	0	0	0	113.8	K159 L160 P165	K159-T163 HydrophobicContact CG-CG2 4.33Å; K159-T163 WeakPolarHBondContact O-CB 3.36Å; K159-T163 VanDerWaalsContact O-CG2 3.24Å; K159-T163 WeakPolarHBondContact O-CG2 3.45Å; K159-T163 PolarHBondContact O-N 3.25Å; K159-T163 PolarHBondContact O-OG1 2.7Å; K159-T163 VanDerWaalsContact O-OG1 3.11Å; L160-T163 WeakPolarHBondContact CA-OG1 3.49Å; L160-T163 PolarHBondContact O-N 3.03Å; L160-T163 PolarHBondContact O-OG1 3.33Å; T163-P165 WeakPolarHBondContact O-CD 3.1Å
164	T	60.2	Low	63.5	Low	107 Å²	107	123.9 Å²	123.9	66%	0.656	65%	0.645	S	S	*	*			trans	-99.1	69.9	163.3	52.1	0	0	0	0	112.3	L160 I161 Q162	L160-T164 PolarHBondContact O-N 3.38Å; L160-T164 PolarHBondContact O-OG1 3.46Å; I161-T164 PolarHBondContact O-OG1 2.9Å; Q162-T164 PolarHBondContact O-N 2.89Å
165	P	60.5	Low	61.3	Low	85 Å²	85	122.3 Å²	122.3	55%	0.552	65%	0.646	S	S	*	*			trans	-99.4	139.2	155.6	35.2	-22.8	0	0	0	109.9	Q162 T163	Q162-P165 WeakPolarHBondContact O-CD 3.5Å; T163-P165 WeakPolarHBondContact O-CD 3.1Å
166	D	45.6	Very low	59	Low	149 Å²	149	122 Å²	122	80%	0.797	66%	0.655	S	S	*	*			trans	76.7	67.3	158.7	-47.9	-33.5	0	0	0	118.8
167	H	46.8	Very low	56.7	Low	146 Å²	146	126 Å²	126	68%	0.676	66%	0.662	S	S	*	*			trans	-135.8	53.3	139.2	-159	-65.8	0	0	0	110.6
168	E	52.6	Low	54.8	Low	173 Å²	173	130.1 Å²	130.1	81%	0.808	67%	0.672	S	S	*	*			trans	-72	147.7	153.3	-56.2	-98.2	119.9	0	0	106.8
169	E	47.6	Very low	52.7	Low	175 Å²	175	138 Å²	138	82%	0.818	70%	0.696	S	S	*	*	S	Bend	trans	87.3	73	-172.4	-44.6	-71.1	148.8	0	0	115
170	D	41.7	Very low	50.8	Low	145 Å²	145	142.6 Å²	142.6	78%	0.775	71%	0.709	S	S	*	*	S	Bend		164.8	23.3	129.2	-149.9	15.8	0	0	0	114.5
171	F	39.7	Very low	48.8	Very low	155 Å²	155	141.9 Å²	141.9	68%	0.68	71%	0.713	S	S	*	*			trans	-112.4	27.3	177	-73.5	-78.5	0	0	0	114.3	E173 N174	F171-E173 PolarHBondContact O-N 3.12Å; F171-N174 PolarHBondContact O-N 2.95Å
172	S	47.8	Very low	46.9	Very low	116 Å²	116	139.9 Å²	139.9	81%	0.811	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-16.9	179	-167.3	0	0	0	0	113.8
173	E	42	Very low	45.5	Very low	201 Å²	201	143.1 Å²	143.1	94%	0.939	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-10.1	177.9	-86.2	-168.7	136.2	0	0	115.7	F171	F171-E173 PolarHBondContact O-N 3.12Å
174	N	47.9	Very low	44.3	Very low	76 Å²	76	141.7 Å²	141.7	41%	0.406	74%	0.735	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.2	-6.8	-178.1	-142.5	9.7	0	0	0	114.6	F171 G176 R177	F171-N174 PolarHBondContact O-N 2.95Å; N174-G176 PolarHBondContact O-N 2.85Å; N174-R177 PolarHBondContact O-N 3.44Å; N174-R177 VanDerWaalsContact O-N 3.1Å; N174-R177 PolarHBondContact OD1-NE 2.93Å
175	A	42.8	Very low	43.2	Very low	71 Å²	71	146.3 Å²	146.3	59%	0.587	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-16.3	174.3	0	0	0	0	0	113.6	R177	A175-R177 VanDerWaalsContact C-N 3.33Å
176	G	42.1	Very low	42.4	Very low	70 Å²	70	153.6 Å²	153.6	72%	0.722	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-15.5	171.2	0	0	0	0	0	114.6	N174	N174-G176 PolarHBondContact O-N 2.85Å
177	R	41.6	Very low	42.2	Very low	191 Å²	191	154.7 Å²	154.7	72%	0.721	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-23.9	-174.1	-160.3	177.3	-69.1	-107.7	0.2	113.6	N174 A175	N174-R177 PolarHBondContact O-N 3.44Å; N174-R177 VanDerWaalsContact O-N 3.1Å; N174-R177 PolarHBondContact OD1-NE 2.93Å; A175-R177 VanDerWaalsContact C-N 3.33Å
178	W	40.4	Very low	42	Very low	202 Å²	202	153.5 Å²	153.5	77%	0.765	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-96.4	-9	-174.3	-65.6	73.7	0	0	0	114.2	R180	W178-R180 VanDerWaalsContact C-N 3.29Å; W178-R180 PolarHBondContact O-N 3.09Å
179	R	39.5	Very low	41.3	Very low	243 Å²	243	152.3 Å²	152.3	92%	0.917	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-83.3	9.3	168.7	-83.1	-169.8	-166.4	-100.7	1	114.9
180	R	39.7	Very low	41.4	Very low	228 Å²	228	148.9 Å²	148.9	86%	0.86	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-114.3	1	172.9	-163.2	172.4	-72.2	-153.6	0.7	114.4	W178 G182	W178-R180 VanDerWaalsContact C-N 3.29Å; W178-R180 PolarHBondContact O-N 3.09Å; R180-G182 PolarHBondContact O-N 3.41Å
181	C	36.3	Very low	41.7	Very low	100 Å²	100	148.1 Å²	148.1	68%	0.676	74%	0.736	S	S	*	*			trans	-83.7	70.2	169.1	-83.5	0	0	0	0	110.5	F183	C181-F183 PolarHBondContact O-N 2.96Å
182	G	39.4	Very low	42.1	Very low	66 Å²	66	145.1 Å²	145.1	68%	0.68	75%	0.748	S	S	*	*			trans	-58.5	128.4	153.1	0	0	0	0	0	107.7	R180 G184	R180-G182 PolarHBondContact O-N 3.41Å; G182-G184 PolarHBondContact O-N 3.31Å
183	F	38.3	Very low	42.2	Very low	215 Å²	215	143.4 Å²	143.4	94%	0.943	74%	0.741	S	S	*	*			trans	-64.1	60.6	170.3	-84.5	-99	0	0	0	110.9	C181 R185	C181-F183 PolarHBondContact O-N 2.96Å; F183-R185 PolarHBondContact O-N 2.88Å
184	G	38.8	Very low	42.6	Very low	62 Å²	62	139.5 Å²	139.5	64%	0.639	73%	0.727	S	S	*	*			trans	-75.4	109.2	156.5	0	0	0	0	0	106.3	G182 R186	G182-G184 PolarHBondContact O-N 3.31Å; G184-R186 PolarHBondContact O-N 2.73Å
185	R	37.2	Very low	43.1	Very low	204 Å²	204	147 Å²	147	77%	0.77	75%	0.75	S	S	*	*			trans	-57.4	85.6	171.6	-72.5	171.8	86.8	-162.8	18.9	109.4	F183 R187	F183-R185 PolarHBondContact O-N 2.88Å; R185-R187 VanDerWaalsContact NH2-NH2 3.17Å; R185-R187 PolarHBondContact O-N 2.7Å
186	R	43.5	Very low	44.2	Very low	237 Å²	237	147.4 Å²	147.4	89%	0.894	76%	0.76	S	S	*	*			trans	-74.8	82.3	163.7	-144.8	176.9	-155.3	-140.9	3.7	105.8	G184 V188	G184-R186 PolarHBondContact O-N 2.73Å; R186-V188 PolarHBondContact O-N 2.69Å; R186-V188 VanDerWaalsContact O-N 3.09Å
187	R	40.3	Very low	45.5	Very low	172 Å²	172	149 Å²	149	65%	0.649	75%	0.751	S	S	*	*			trans	-75.7	98.8	171.6	-153.1	-172.8	-57.7	-146.9	10.9	106.4	R185 M189	R185-R187 VanDerWaalsContact NH2-NH2 3.17Å; R185-R187 PolarHBondContact O-N 2.7Å; R187-M189 VanDerWaalsContact C-N 3.29Å; R187-M189 PolarHBondContact O-N 2.7Å
188	V	42	Very low	47.4	Very low	122 Å²	122	146.2 Å²	146.2	74%	0.739	75%	0.746	S	S	*	*			trans	-61.5	96.2	166.7	-177.8	0	0	0	0	106.3	R186 S190	R186-V188 PolarHBondContact O-N 2.69Å; R186-V188 VanDerWaalsContact O-N 3.09Å; V188-S190 PolarHBondContact O-N 3.38Å
189	M	39.2	Very low	49.2	Very low	147 Å²	147	146 Å²	146	72%	0.724	75%	0.745	S	S	*	*			trans	-82.5	99.9	163.1	-71.5	-173.4	79.5	0	0	106.1	R187 H191	R187-M189 VanDerWaalsContact C-N 3.29Å; R187-M189 PolarHBondContact O-N 2.7Å; M189-H191 PolarHBondContact O-N 3.1Å; M189-H191 VanDerWaalsContact O-N 3.09Å
190	S	49.8	Very low	51.4	Low	103 Å²	103	143.3 Å²	143.3	72%	0.72	74%	0.735	S	S	*	*			trans	-65.1	97.9	160	-66.5	0	0	0	0	107.6	V188	V188-S190 PolarHBondContact O-N 3.38Å
191	H	47.9	Very low	53.7	Low	130 Å²	130	136.5 Å²	136.5	60%	0.602	72%	0.716	S	S	*	*			trans	-139.8	96.1	157.8	-88	66.3	0	0	0	106.8	M189 A193 D194	M189-H191 PolarHBondContact O-N 3.1Å; M189-H191 VanDerWaalsContact O-N 3.09Å; H191-A193 VanDerWaalsContact C-N 3.27Å; H191-A193 PolarHBondContact O-N 3.39Å; H191-D194 VanDerWaalsContact CB-OD2 3.32Å; H191-D194 WeakPolarHBondContact CB-OD2 3.36Å
192	G	47.1	Very low	56.2	Low	92 Å²	92	133.6 Å²	133.6	95%	0.948	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	82.5	174.4	0	0	0	0	0	109.9
193	A	51.6	Low	58.6	Low	80 Å²	80	133.7 Å²	133.7	66%	0.661	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-174.2	-9.1	164.7	0	0	0	0	0	112	H191 W195	H191-A193 VanDerWaalsContact C-N 3.27Å; H191-A193 PolarHBondContact O-N 3.39Å; A193-W195 PolarHBondContact O-N 2.87Å; A193-W195 VanDerWaalsContact O-N 3.12Å
194	D	49.4	Very low	61.2	Low	119 Å²	119	127.8 Å²	127.8	64%	0.636	67%	0.665	S	S	*	*			trans	-86.1	100	-166	-54.1	-20.7	0	0	0	109.9	H191 G196	H191-D194 VanDerWaalsContact CB-OD2 3.32Å; H191-D194 WeakPolarHBondContact CB-OD2 3.36Å; D194-G196 PolarHBondContact O-N 3.32Å
195	W	59	Low	63.7	Low	234 Å²	234	127 Å²	127	89%	0.886	65%	0.652	S	S	*	*			trans	-63.6	45.1	173	-74.1	5.1	0	0	0	113.6	A193 I197	A193-W195 PolarHBondContact O-N 2.87Å; A193-W195 VanDerWaalsContact O-N 3.12Å; W195-I197 HydrophobicContact CB-CD1 4.48Å; W195-I197 VanDerWaalsContact O-CG1 3.27Å; W195-I197 WeakPolarHBondContact O-CG1 3.3Å; W195-I197 PolarHBondContact O-N 2.84Å
196	G	64.4	Low	66.3	Low	78 Å²	78	123.9 Å²	123.9	80%	0.804	65%	0.648	S	S	*	*	S	Bend	trans	57.3	4	171.1	0	0	0	0	0	116.4	D194	D194-G196 PolarHBondContact O-N 3.32Å
197	I	70.6	Confident	68.7	Low	103 Å²	103	117.6 Å²	117.6	53%	0.528	63%	0.632	S	S	.	*			trans	-95.1	116.1	-172.7	-76.1	156.8	0	0	0	107.3	W195 W199 N201 A202	W195-I197 HydrophobicContact CB-CD1 4.48Å; W195-I197 VanDerWaalsContact O-CG1 3.27Å; W195-I197 WeakPolarHBondContact O-CG1 3.3Å; W195-I197 PolarHBondContact O-N 2.84Å; I197-W199 PolarHBondContact O-N 3.11Å; I197-N201 HydrophobicContact CG2-CB 4Å; I197-A202 HydrophobicContact CG2-CB 3.81Å
198	Q	81.3	Confident	71.3	Confident	134 Å²	134	114.2 Å²	114.2	63%	0.626	63%	0.626	S	S	*	*			trans	-55.2	135.1	169.6	-63	175.4	-56.7	0	0	108.6	W200 N201 A202	Q198-W200 PolarHBondContact O-N 3.41Å; Q198-N201 HydrophobicContact CB-CB 4.47Å; Q198-N201 WeakPolarHBondContact O-CA 3.46Å; Q198-N201 WeakPolarHBondContact O-CB 3.39Å; Q198-N201 PolarHBondContact O-N 3.35Å; Q198-N201 PolarHBondContact OE1-ND2 3.27Å; Q198-A202 PolarHBondContact O-N 2.88Å; Q198-A202 VanDerWaalsContact O-N 3.11Å
199	W	78.3	Confident	73.7	Confident	196 Å²	196	113 Å²	113	74%	0.742	61%	0.614	S	S	*	*	H	α-helix	trans	-54.5	-31.3	-176.2	-160.2	69.5	0	0	0	112.9	I197 A202 L203	I197-W199 PolarHBondContact O-N 3.11Å; W199-A202 WeakPolarHBondContact O-CB 3.27Å; W199-A202 PolarHBondContact O-N 2.76Å; W199-L203 HydrophobicContact CD2-CD1 4.24Å; W199-L203 HydrophobicContact CD2-CG 4.4Å; W199-L203 HydrophobicContact CE3-CD1 3.57Å; W199-L203 HydrophobicContact CE3-CG 4.21Å; W199-L203 HydrophobicContact CH2-CD1 4.17Å; W199-L203 HydrophobicContact CH2-CD2 4.43Å; W199-L203 HydrophobicContact CZ3-CD1 3.55Å; W199-L203 HydrophobicContact CZ3-CG 4.34Å; W199-L203 WeakPolarHBondContact O-CG 3.24Å; W199-L203 PolarHBondContact O-N 3.32Å
200	W	85.1	Confident	76.3	Confident	187 Å²	187	108.1 Å²	108.1	71%	0.708	60%	0.602	S	S	*	*	H	α-helix	trans	-62.6	-41.4	170.4	-75	106.1	0	0	0	113.9	Q198 A202 L203 V204	Q198-W200 PolarHBondContact O-N 3.41Å; W200-A202 VanDerWaalsContact C-N 3.3Å; W200-A202 PolarHBondContact O-N 3.03Å; W200-L203 HydrophobicContact CE3-CD1 4.17Å; W200-L203 HydrophobicContact CZ3-CD1 4.42Å; W200-L203 PolarHBondContact O-N 2.94Å; W200-V204 WeakPolarHBondContact O-CB 3.27Å; W200-V204 VanDerWaalsContact O-CG2 3.27Å; W200-V204 WeakPolarHBondContact O-CG2 3.2Å; W200-V204 PolarHBondContact O-N 3.44Å
201	N	88.3	Confident	78.4	Confident	85 Å²	85	107.3 Å²	107.3	46%	0.455	59%	0.589	S	S	.	*	H	α-helix	trans	-66.6	-35	174.7	-63.1	-4	0	0	0	110.8	I197 Q198 A205	I197-N201 HydrophobicContact CG2-CB 4Å; Q198-N201 HydrophobicContact CB-CB 4.47Å; Q198-N201 WeakPolarHBondContact O-CA 3.46Å; Q198-N201 WeakPolarHBondContact O-CB 3.39Å; Q198-N201 PolarHBondContact O-N 3.35Å; Q198-N201 PolarHBondContact OE1-ND2 3.27Å; N201-A205 VanDerWaalsContact O-CB 3.22Å; N201-A205 WeakPolarHBondContact O-CB 3.42Å; N201-A205 PolarHBondContact O-N 3.48Å
202	A	89.4	Confident	80.6	Confident	40 Å²	40	104.8 Å²	104.8	33%	0.331	58%	0.582	S	S	.	*	H	α-helix	trans	-67.1	-42.7	173.1	0	0	0	0	0	112.2	I197 Q198 W199 W200 A205 M206	I197-A202 HydrophobicContact CG2-CB 3.81Å; Q198-A202 PolarHBondContact O-N 2.88Å; Q198-A202 VanDerWaalsContact O-N 3.11Å; W199-A202 WeakPolarHBondContact O-CB 3.27Å; W199-A202 PolarHBondContact O-N 2.76Å; W200-A202 VanDerWaalsContact C-N 3.3Å; W200-A202 PolarHBondContact O-N 3.03Å; A202-A205 PolarHBondContact O-N 3.39Å; A202-M206 VanDerWaalsContact O-CB 3.3Å; A202-M206 WeakPolarHBondContact O-CB 3.22Å; A202-M206 PolarHBondContact O-N 3.5Å
203	L	89.9	Confident	82.7	Confident	68 Å²	68	105.7 Å²	105.7	36%	0.356	57%	0.565	S	S	.	*	H	α-helix	trans	-61.7	-45	174.6	-75.8	173.8	0	0	0	111.8	W199 W200 M206 L207	W199-L203 HydrophobicContact CD2-CD1 4.24Å; W199-L203 HydrophobicContact CD2-CG 4.4Å; W199-L203 HydrophobicContact CE3-CD1 3.57Å; W199-L203 HydrophobicContact CE3-CG 4.21Å; W199-L203 HydrophobicContact CH2-CD1 4.17Å; W199-L203 HydrophobicContact CH2-CD2 4.43Å; W199-L203 HydrophobicContact CZ3-CD1 3.55Å; W199-L203 HydrophobicContact CZ3-CG 4.34Å; W199-L203 WeakPolarHBondContact O-CG 3.24Å; W199-L203 PolarHBondContact O-N 3.32Å; W200-L203 HydrophobicContact CE3-CD1 4.17Å; W200-L203 HydrophobicContact CZ3-CD1 4.42Å; W200-L203 PolarHBondContact O-N 2.94Å; L203-M206 PolarHBondContact O-N 2.87Å; L203-L207 WeakPolarHBondContact O-CB 3.33Å; L203-L207 PolarHBondContact O-N 3.43Å
204	V	91.6	Very high	84.6	Confident	90 Å²	90	104.6 Å²	104.6	55%	0.545	55%	0.551	S	S	.	*	H	α-helix	trans	-64.1	-42.6	176.1	171.9	0	0	0	0	110.9	W200 L207 L208	W200-V204 WeakPolarHBondContact O-CB 3.27Å; W200-V204 VanDerWaalsContact O-CG2 3.27Å; W200-V204 WeakPolarHBondContact O-CG2 3.2Å; W200-V204 PolarHBondContact O-N 3.44Å; V204-L207 PolarHBondContact O-N 2.93Å; V204-L208 VanDerWaalsContact O-CB 3.27Å; V204-L208 WeakPolarHBondContact O-CB 3.44Å; V204-L208 PolarHBondContact O-N 2.89Å
205	A	91.1	Very high	86.7	Confident	45 Å²	45	103.6 Å²	103.6	37%	0.372	55%	0.545	S	S	.	.	H	α-helix	trans	-64.4	-42.1	176.8	0	0	0	0	0	112.1	N201 A202 L208 I209	N201-A205 VanDerWaalsContact O-CB 3.22Å; N201-A205 WeakPolarHBondContact O-CB 3.42Å; N201-A205 PolarHBondContact O-N 3.48Å; A202-A205 PolarHBondContact O-N 3.39Å; A205-L208 PolarHBondContact O-N 3.36Å; A205-I209 WeakPolarHBondContact O-CB 3.03Å; A205-I209 WeakPolarHBondContact O-CD1 3.32Å; A205-I209 WeakPolarHBondContact O-CG1 3Å; A205-I209 PolarHBondContact O-N 2.85Å
206	M	92.4	Very high	88.4	Confident	139 Å²	139	99.1 Å²	99.1	69%	0.685	53%	0.532	S	S	*	.	H	α-helix	trans	-64.4	-43.3	177.1	-173.6	-84.1	-160.5	0	0	111.3	A202 L203 I209 G210	A202-M206 VanDerWaalsContact O-CB 3.3Å; A202-M206 WeakPolarHBondContact O-CB 3.22Å; A202-M206 PolarHBondContact O-N 3.5Å; L203-M206 PolarHBondContact O-N 2.87Å; M206-I209 PolarHBondContact O-N 3.42Å; M206-G210 PolarHBondContact O-N 2.99Å
207	L	93.8	Very high	89.8	Confident	105 Å²	105	102.6 Å²	102.6	55%	0.55	52%	0.522	S	S	.	.	H	α-helix	trans	-62.5	-43.5	174.3	-176.1	66.6	0	0	0	111.6	L203 V204 G210 I211	L203-L207 WeakPolarHBondContact O-CB 3.33Å; L203-L207 PolarHBondContact O-N 3.43Å; V204-L207 PolarHBondContact O-N 2.93Å; L207-G210 PolarHBondContact O-N 3.44Å; L207-I211 HydrophobicContact CD1-CD1 3.62Å; L207-I211 HydrophobicContact CD1-CG1 4.26Å; L207-I211 HydrophobicContact CG-CD1 3.82Å; L207-I211 WeakPolarHBondContact O-CB 3.38Å; L207-I211 VanDerWaalsContact O-CG1 3.32Å; L207-I211 WeakPolarHBondContact O-CG1 3.29Å; L207-I211 PolarHBondContact O-N 3.42Å
208	L	94.3	Very high	90.8	Very high	101 Å²	101	102.8 Å²	102.8	53%	0.529	52%	0.524	S	S	.	.	H	α-helix	trans	-64.3	-47.9	179.1	-171.8	145.5	0	0	0	110.9	V204 A205 G210 I211 V212	V204-L208 VanDerWaalsContact O-CB 3.27Å; V204-L208 WeakPolarHBondContact O-CB 3.44Å; V204-L208 PolarHBondContact O-N 2.89Å; A205-L208 PolarHBondContact O-N 3.36Å; L208-G210 VanDerWaalsContact C-N 3.31Å; L208-G210 PolarHBondContact O-N 3.38Å; L208-I211 PolarHBondContact O-N 2.85Å; L208-V212 HydrophobicContact CD2-CB 4.46Å; L208-V212 HydrophobicContact CD2-CG2 3.88Å; L208-V212 HydrophobicContact CG-CG2 3.89Å; L208-V212 WeakPolarHBondContact O-CB 3.27Å; L208-V212 WeakPolarHBondContact O-CG2 3.48Å; L208-V212 PolarHBondContact O-N 3.27Å
209	I	93.9	Very high	91.3	Very high	96 Å²	96	101.2 Å²	101.2	49%	0.492	52%	0.519	S	S	.	.	H	α-helix	trans	-62.6	-42.3	176.7	-66.3	164.2	0	0	0	110.2	A205 M206 I211 L213	A205-I209 WeakPolarHBondContact O-CB 3.03Å; A205-I209 WeakPolarHBondContact O-CD1 3.32Å; A205-I209 WeakPolarHBondContact O-CG1 3Å; A205-I209 PolarHBondContact O-N 2.85Å; M206-I209 PolarHBondContact O-N 3.42Å; I209-I211 VanDerWaalsContact C-N 3.32Å; I209-I211 PolarHBondContact O-N 3.1Å; I209-L213 HydrophobicContact CG2-CD1 3.46Å; I209-L213 VanDerWaalsContact CG2-CD1 3.46Å; I209-L213 HydrophobicContact CG2-CG 4.11Å; I209-L213 VanDerWaalsContact O-CB 3.24Å; I209-L213 WeakPolarHBondContact O-CB 3.27Å; I209-L213 VanDerWaalsContact O-CG 3.27Å; I209-L213 WeakPolarHBondContact O-CG 3.3Å; I209-L213 PolarHBondContact O-N 3.25Å; I209-L213 VanDerWaalsContact O-N 3.1Å
210	G	92.8	Very high	91.9	Very high	46 Å²	46	96.7 Å²	96.7	47%	0.474	50%	0.502	S	S	.	.	H	α-helix	trans	-67.1	-24.3	179.4	0	0	0	0	0	114.9	M206 L207 L208 P214	M206-G210 PolarHBondContact O-N 2.99Å; L207-G210 PolarHBondContact O-N 3.44Å; L208-G210 VanDerWaalsContact C-N 3.31Å; L208-G210 PolarHBondContact O-N 3.38Å; G210-P214 WeakPolarHBondContact O-CD 3.13Å; G210-P214 WeakPolarHBondContact O-CG 3.43Å
211	I	93.7	Very high	92.1	Very high	86 Å²	86	93.3 Å²	93.3	44%	0.441	49%	0.493	S	S	.	.	H	α-helix	trans	-99.3	-41.1	177.2	-65.6	172.9	0	0	0	111.6	L207 L208 I209 P214 L215	L207-I211 HydrophobicContact CD1-CD1 3.62Å; L207-I211 HydrophobicContact CD1-CG1 4.26Å; L207-I211 HydrophobicContact CG-CD1 3.82Å; L207-I211 WeakPolarHBondContact O-CB 3.38Å; L207-I211 VanDerWaalsContact O-CG1 3.32Å; L207-I211 WeakPolarHBondContact O-CG1 3.29Å; L207-I211 PolarHBondContact O-N 3.42Å; L208-I211 PolarHBondContact O-N 2.85Å; I209-I211 VanDerWaalsContact C-N 3.32Å; I209-I211 PolarHBondContact O-N 3.1Å; I211-P214 VanDerWaalsContact O-CD 3.29Å; I211-P214 WeakPolarHBondContact O-CD 3.28Å; I211-P214 VanDerWaalsContact O-CG 3.3Å; I211-P214 WeakPolarHBondContact O-CG 3.31Å; I211-L215 HydrophobicContact CG2-CD1 3.79Å; I211-L215 HydrophobicContact CG2-CG 4.41Å; I211-L215 WeakPolarHBondContact O-CB 3.45Å; I211-L215 VanDerWaalsContact O-CG 3.25Å; I211-L215 WeakPolarHBondContact O-CG 3.35Å; I211-L215 PolarHBondContact O-N 3.41Å
212	V	94.4	Very high	92.1	Very high	76 Å²	76	96.4 Å²	96.4	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-69.1	-41.3	-177.2	174.1	0	0	0	0	111.1	L208 L215 F216	L208-V212 HydrophobicContact CD2-CB 4.46Å; L208-V212 HydrophobicContact CD2-CG2 3.88Å; L208-V212 HydrophobicContact CG-CG2 3.89Å; L208-V212 WeakPolarHBondContact O-CB 3.27Å; L208-V212 WeakPolarHBondContact O-CG2 3.48Å; L208-V212 PolarHBondContact O-N 3.27Å; V212-L215 PolarHBondContact O-N 2.87Å; V212-F216 VanDerWaalsContact O-CB 3.28Å; V212-F216 WeakPolarHBondContact O-CB 3.37Å; V212-F216 PolarHBondContact O-N 3.49Å
213	L	91.4	Very high	91.7	Very high	111 Å²	111	98.4 Å²	98.4	58%	0.581	51%	0.51	S	S	*	.	H	α-helix	trans	-61.9	-48.8	178.2	-72.8	176.4	0	0	0	113.9	I209 F216 Y217	I209-L213 HydrophobicContact CG2-CD1 3.46Å; I209-L213 VanDerWaalsContact CG2-CD1 3.46Å; I209-L213 HydrophobicContact CG2-CG 4.11Å; I209-L213 VanDerWaalsContact O-CB 3.24Å; I209-L213 WeakPolarHBondContact O-CB 3.27Å; I209-L213 VanDerWaalsContact O-CG 3.27Å; I209-L213 WeakPolarHBondContact O-CG 3.3Å; I209-L213 PolarHBondContact O-N 3.25Å; I209-L213 VanDerWaalsContact O-N 3.1Å; L213-F216 PolarHBondContact O-N 2.81Å; L213-Y217 VanDerWaalsContact O-CB 3.3Å; L213-Y217 WeakPolarHBondContact O-CB 3.22Å; L213-Y217 PolarHBondContact O-N 2.88Å
214	P	92.1	Very high	91.3	Very high	57 Å²	57	102.4 Å²	102.4	37%	0.37	52%	0.521	S	S	.	.	H	α-helix	trans	-68	-35.3	177.5	24.8	-33.8	0	0	0	112.5	G210 I211 Y217 L218	G210-P214 WeakPolarHBondContact O-CD 3.13Å; G210-P214 WeakPolarHBondContact O-CG 3.43Å; I211-P214 VanDerWaalsContact O-CD 3.29Å; I211-P214 WeakPolarHBondContact O-CD 3.28Å; I211-P214 VanDerWaalsContact O-CG 3.3Å; I211-P214 WeakPolarHBondContact O-CG 3.31Å; P214-Y217 PolarHBondContact O-N 3.33Å; P214-L218 WeakPolarHBondContact O-CB 3.3Å; P214-L218 VanDerWaalsContact O-CG 3.22Å; P214-L218 WeakPolarHBondContact O-CG 3.27Å; P214-L218 PolarHBondContact O-N 2.77Å
215	L	93.5	Very high	90.4	Very high	98 Å²	98	102.2 Å²	102.2	51%	0.513	52%	0.52	S	S	.	.	H	α-helix	trans	-63.1	-45.8	173.8	-72.7	176.1	0	0	0	111.3	I211 V212 Y217 L218 I219	I211-L215 HydrophobicContact CG2-CD1 3.79Å; I211-L215 HydrophobicContact CG2-CG 4.41Å; I211-L215 WeakPolarHBondContact O-CB 3.45Å; I211-L215 VanDerWaalsContact O-CG 3.25Å; I211-L215 WeakPolarHBondContact O-CG 3.35Å; I211-L215 PolarHBondContact O-N 3.41Å; V212-L215 PolarHBondContact O-N 2.87Å; L215-Y217 VanDerWaalsContact C-N 3.34Å; L215-Y217 PolarHBondContact O-N 2.85Å; L215-L218 PolarHBondContact O-N 3.49Å; L215-I219 WeakPolarHBondContact O-CB 3.47Å; L215-I219 WeakPolarHBondContact O-CD1 3.21Å; L215-I219 WeakPolarHBondContact O-CG1 3.43Å; L215-I219 PolarHBondContact O-N 3.36Å
216	F	93.8	Very high	89.1	Confident	140 Å²	140	104.3 Å²	104.3	61%	0.614	53%	0.531	S	S	*	.	H	α-helix	trans	-63.3	-40.9	176	-171.7	-98	0	0	0	111.6	V212 L213 I219 Y220	V212-F216 VanDerWaalsContact O-CB 3.28Å; V212-F216 WeakPolarHBondContact O-CB 3.37Å; V212-F216 PolarHBondContact O-N 3.49Å; L213-F216 PolarHBondContact O-N 2.81Å; F216-I219 PolarHBondContact O-N 2.83Å; F216-Y220 WeakPolarHBondContact O-CB 3.25Å; F216-Y220 PolarHBondContact O-N 3.39Å
217	Y	93.6	Very high	87.7	Confident	152 Å²	152	100 Å²	100	60%	0.596	52%	0.523	S	S	*	.	H	α-helix	trans	-62.5	-43.2	175.4	179.6	-97.9	0	0	0	112.2	L213 P214 L215 Y220 F221	L213-Y217 VanDerWaalsContact O-CB 3.3Å; L213-Y217 WeakPolarHBondContact O-CB 3.22Å; L213-Y217 PolarHBondContact O-N 2.88Å; P214-Y217 PolarHBondContact O-N 3.33Å; L215-Y217 VanDerWaalsContact C-N 3.34Å; L215-Y217 PolarHBondContact O-N 2.85Å; Y217-Y220 PolarHBondContact O-N 3.41Å; Y217-F221 VanDerWaalsContact O-CB 3.31Å; Y217-F221 WeakPolarHBondContact O-CB 3.46Å; Y217-F221 PolarHBondContact O-N 2.87Å
218	L	91.3	Very high	85.6	Confident	107 Å²	107	100.8 Å²	100.8	56%	0.56	53%	0.532	S	S	*	.	H	α-helix	trans	-66.4	-41.5	176.5	-72.7	173.8	0	0	0	111.8	P214 L215 F221 K222	P214-L218 WeakPolarHBondContact O-CB 3.3Å; P214-L218 VanDerWaalsContact O-CG 3.22Å; P214-L218 WeakPolarHBondContact O-CG 3.27Å; P214-L218 PolarHBondContact O-N 2.77Å; L215-L218 PolarHBondContact O-N 3.49Å; L218-F221 PolarHBondContact O-N 3.45Å; L218-K222 WeakPolarHBondContact O-CB 3.12Å; L218-K222 PolarHBondContact O-N 3.25Å
219	I	91.8	Very high	83.6	Confident	101 Å²	101	102.1 Å²	102.1	52%	0.518	54%	0.544	S	S	.	.	H	α-helix	trans	-65.2	-44	175	-68.4	164.6	0	0	0	110.3	L215 F216 K222 T223	L215-I219 WeakPolarHBondContact O-CB 3.47Å; L215-I219 WeakPolarHBondContact O-CD1 3.21Å; L215-I219 WeakPolarHBondContact O-CG1 3.43Å; L215-I219 PolarHBondContact O-N 3.36Å; F216-I219 PolarHBondContact O-N 2.83Å; I219-K222 PolarHBondContact O-N 2.95Å; I219-T223 HydrophobicContact CG2-CG2 4.25Å; I219-T223 WeakPolarHBondContact O-CB 3.16Å; I219-T223 WeakPolarHBondContact O-CG2 3.12Å; I219-T223 PolarHBondContact O-N 2.98Å; I219-T223 PolarHBondContact O-OG1 2.87Å
220	Y	92.4	Very high	81.4	Confident	101 Å²	101	102.1 Å²	102.1	40%	0.396	55%	0.552	S	S	.	*	H	α-helix	trans	-61.2	-46.3	176.1	174.5	-99.2	0	0	0	111.8	F216 Y217 T223 R224	F216-Y220 WeakPolarHBondContact O-CB 3.25Å; F216-Y220 PolarHBondContact O-N 3.39Å; Y217-Y220 PolarHBondContact O-N 3.41Å; Y220-T223 WeakPolarHBondContact CA-OG1 3.35Å; Y220-T223 PolarHBondContact O-N 3.29Å; Y220-T223 PolarHBondContact O-OG1 2.94Å; Y220-R224 HydrophobicContact CD1-CG 4.27Å; Y220-R224 HydrophobicContact CD2-CG 4.3Å; Y220-R224 HydrophobicContact CE1-CG 3.96Å; Y220-R224 HydrophobicContact CE2-CG 3.99Å; Y220-R224 VanDerWaalsContact CE2-NE 3.33Å; Y220-R224 HydrophobicContact CG-CG 4.45Å; Y220-R224 VanDerWaalsContact O-CB 3.3Å; Y220-R224 WeakPolarHBondContact O-CB 3.33Å; Y220-R224 WeakPolarHBondContact O-CG 3.41Å; Y220-R224 PolarHBondContact O-N 2.76Å; Y220-R224 PolarHBondContact OH-NE 3.39Å; Y220-R224 PolarHBondContact OH-NH2 2.81Å
221	F	88.9	Confident	79.5	Confident	115 Å²	115	105.2 Å²	105.2	50%	0.504	56%	0.564	S	S	.	*	H	α-helix	trans	-65.3	-45.4	177.4	-176.6	-99.6	0	0	0	111.2	Y217 L218 T223 R224 V225	Y217-F221 VanDerWaalsContact O-CB 3.31Å; Y217-F221 WeakPolarHBondContact O-CB 3.46Å; Y217-F221 PolarHBondContact O-N 2.87Å; L218-F221 PolarHBondContact O-N 3.45Å; F221-T223 VanDerWaalsContact C-N 3.33Å; F221-T223 PolarHBondContact O-N 3.22Å; F221-R224 PolarHBondContact O-N 2.78Å; F221-V225 HydrophobicContact CD1-CG2 4.08Å; F221-V225 HydrophobicContact CD2-CG2 4.42Å; F221-V225 HydrophobicContact CE1-CG2 3.69Å; F221-V225 HydrophobicContact CE2-CG2 4.06Å; F221-V225 HydrophobicContact CG-CG2 4.43Å; F221-V225 HydrophobicContact CZ-CG2 3.69Å; F221-V225 WeakPolarHBondContact O-CB 3.13Å; F221-V225 VanDerWaalsContact O-CG2 3.27Å; F221-V225 WeakPolarHBondContact O-CG2 3.21Å; F221-V225 PolarHBondContact O-N 3.38Å
222	K	87.5	Confident	76.7	Confident	150 Å²	150	107.3 Å²	107.3	65%	0.652	58%	0.581	S	S	*	*	H	α-helix	trans	-61.3	-40.5	176.9	-171.8	-177.9	175.3	82.6	0	111.8	L218 I219 S226	L218-K222 WeakPolarHBondContact O-CB 3.12Å; L218-K222 PolarHBondContact O-N 3.25Å; I219-K222 PolarHBondContact O-N 2.95Å; K222-S226 WeakPolarHBondContact O-CB 3.3Å; K222-S226 PolarHBondContact O-N 3.07Å; K222-S226 PolarHBondContact O-OG 2.97Å; K222-S226 VanDerWaalsContact O-OG 3.07Å
223	T	81.1	Confident	74.5	Confident	83 Å²	83	109.1 Å²	109.1	51%	0.509	59%	0.592	S	S	.	*	H	α-helix	trans	-72.6	-34.2	177	51.3	0	0	0	0	112.7	I219 Y220 F221 G227	I219-T223 HydrophobicContact CG2-CG2 4.25Å; I219-T223 WeakPolarHBondContact O-CB 3.16Å; I219-T223 WeakPolarHBondContact O-CG2 3.12Å; I219-T223 PolarHBondContact O-N 2.98Å; I219-T223 PolarHBondContact O-OG1 2.87Å; Y220-T223 WeakPolarHBondContact CA-OG1 3.35Å; Y220-T223 PolarHBondContact O-N 3.29Å; Y220-T223 PolarHBondContact O-OG1 2.94Å; F221-T223 VanDerWaalsContact C-N 3.33Å; F221-T223 PolarHBondContact O-N 3.22Å; T223-G227 PolarHBondContact O-N 3.26Å
224	R	80.9	Confident	71.8	Confident	151 Å²	151	109 Å²	109	57%	0.57	60%	0.601	S	S	*	*	H	α-helix	trans	-67.1	-42.5	172.7	-74.5	-87.5	-179.6	170.9	0.1	112.1	Y220 F221 G227 V228	Y220-R224 HydrophobicContact CD1-CG 4.27Å; Y220-R224 HydrophobicContact CD2-CG 4.3Å; Y220-R224 HydrophobicContact CE1-CG 3.96Å; Y220-R224 HydrophobicContact CE2-CG 3.99Å; Y220-R224 VanDerWaalsContact CE2-NE 3.33Å; Y220-R224 HydrophobicContact CG-CG 4.45Å; Y220-R224 VanDerWaalsContact O-CB 3.3Å; Y220-R224 WeakPolarHBondContact O-CB 3.33Å; Y220-R224 WeakPolarHBondContact O-CG 3.41Å; Y220-R224 PolarHBondContact O-N 2.76Å; Y220-R224 PolarHBondContact OH-NE 3.39Å; Y220-R224 PolarHBondContact OH-NH2 2.81Å; F221-R224 PolarHBondContact O-N 2.78Å; R224-G227 PolarHBondContact O-N 2.89Å; R224-V228 PolarHBondContact O-N 3.42Å
225	V	74.1	Confident	69.6	Low	87 Å²	87	114.6 Å²	114.6	53%	0.527	62%	0.622	S	S	.	*	H	α-helix	trans	-67.8	-38.9	177.4	171.8	0	0	0	0	111	F221 G227	F221-V225 HydrophobicContact CD1-CG2 4.08Å; F221-V225 HydrophobicContact CD2-CG2 4.42Å; F221-V225 HydrophobicContact CE1-CG2 3.69Å; F221-V225 HydrophobicContact CE2-CG2 4.06Å; F221-V225 HydrophobicContact CG-CG2 4.43Å; F221-V225 HydrophobicContact CZ-CG2 3.69Å; F221-V225 WeakPolarHBondContact O-CB 3.13Å; F221-V225 VanDerWaalsContact O-CG2 3.27Å; F221-V225 WeakPolarHBondContact O-CG2 3.21Å; F221-V225 PolarHBondContact O-N 3.38Å; V225-G227 VanDerWaalsContact C-N 3.33Å
226	S	64.4	Low	66.9	Low	88 Å²	88	115.2 Å²	115.2	62%	0.615	63%	0.634	S	S	*	*	H	α-helix	trans	-74.1	-21	173.2	-61.5	0	0	0	0	113.9	K222	K222-S226 WeakPolarHBondContact O-CB 3.3Å; K222-S226 PolarHBondContact O-N 3.07Å; K222-S226 PolarHBondContact O-OG 2.97Å; K222-S226 VanDerWaalsContact O-OG 3.07Å
227	G	61.5	Low	64.6	Low	49 Å²	49	113.8 Å²	113.8	51%	0.505	64%	0.641	S	S	.	*	H	α-helix	trans	-88.9	-9.4	-178	0	0	0	0	0	115.5	T223 R224 V225 V229	T223-G227 PolarHBondContact O-N 3.26Å; R224-G227 PolarHBondContact O-N 2.89Å; V225-G227 VanDerWaalsContact C-N 3.33Å; G227-V229 VanDerWaalsContact C-N 3.3Å
228	V	50.7	Low	62.1	Low	121 Å²	121	112.6 Å²	112.6	73%	0.733	65%	0.65	S	S	*	*			trans	-98	30.1	173	179	0	0	0	0	111	R224	R224-V228 PolarHBondContact O-N 3.42Å
229	V	51.1	Low	59.5	Low	130 Å²	130	112.6 Å²	112.6	79%	0.788	66%	0.659	S	S	*	*	S	Bend	trans	-101.6	84.8	150.5	179.3	0	0	0	0	105.7	G227	G227-V229 VanDerWaalsContact C-N 3.3Å
230	S	47.8	Very low	57.1	Low	95 Å²	95	113.2 Å²	113.2	66%	0.664	67%	0.672	S	S	*	*			trans	-74.4	159	-177.4	-97.8	0	0	0	0	112.9
231	P	53	Low	54.6	Low	111 Å²	111	114.1 Å²	114.1	72%	0.721	69%	0.693	S	S	*	*			trans	-71.4	146.5	-176.2	32.3	-36.2	0	0	0	111.2
232	T	36.4	Very low	52.5	Low	131 Å²	131	115.6 Å²	115.6	80%	0.804	71%	0.706	S	S	*	*			trans	-137	103	154.4	-64.5	0	0	0	0	108	S234	T232-S234 PolarHBondContact O-N 3.48Å
233	V	47.8	Very low	50.5	Low	113 Å²	113	114.6 Å²	114.6	69%	0.685	71%	0.713	S	S	*	*			trans	-60.2	126.6	160.4	167.6	0	0	0	0	107.7	Q235	V233-Q235 HydrophobicContact CG1-CG 4.23Å
234	S	34.7	Very low	48.8	Very low	110 Å²	110	117.1 Å²	117.1	77%	0.769	73%	0.728	S	S	*	*			trans	-134.4	90.9	146.5	-68.3	0	0	0	0	106.2	T232	T232-S234 PolarHBondContact O-N 3.48Å
235	Q	45.9	Very low	47.1	Very low	174 Å²	174	118.7 Å²	118.7	81%	0.813	74%	0.742	S	S	*	*			trans	-70	121	158.4	-72.7	179.1	27.9	0	0	107.3	V233	V233-Q235 HydrophobicContact CG1-CG 4.23Å
236	S	37.1	Very low	46	Very low	110 Å²	110	121.8 Å²	121.8	77%	0.769	76%	0.762	S	S	*	*			trans	-138.6	94.8	146.7	60	0	0	0	0	107.4
237	S	45.8	Very low	45.3	Very low	110 Å²	110	125.5 Å²	125.5	77%	0.769	77%	0.769	S	S	*	*			trans	-62.9	125.6	164	49.1	0	0	0	0	111.1
238	V	40.6	Very low	44.5	Very low	127 Å²	127	134.4 Å²	134.4	77%	0.77	79%	0.787	S	S	*	*			trans	-161.8	100	147.9	-106.4	0	0	0	0	106.2
239	S	36.7	Very low	44.4	Very low	107 Å²	107	137.9 Å²	137.9	75%	0.748	82%	0.817	S	S	*	*				92.1	116.7	96	-62	0	0	0	0	112.7
240	S	40.5	Very low	44.1	Very low	115 Å²	115	138.3 Å²	138.3	80%	0.804	82%	0.819	S	S	*	*			trans	9.6	139	143.3	-37.8	0	0	0	0	117.2
241	S	39.3	Very low	43.9	Very low	119 Å²	119	140.6 Å²	140.6	83%	0.832	83%	0.827	S	S	*	*				177.3	162.4	56	38.6	0	0	0	0	112.1
242	N	45.5	Very low	43.4	Very low	146 Å²	146	142.2 Å²	142.2	78%	0.781	83%	0.833	S	S	*	*			trans	-48	166.3	171.3	-64.5	-28.2	0	0	0	117.2
243	T	46.7	Very low	43.8	Very low	130 Å²	130	142.9 Å²	142.9	80%	0.798	83%	0.834	S	S	*	*			trans	110.4	113.4	147.2	64.5	0	0	0	0	119.7
244	T	45.4	Very low	43.6	Very low	135 Å²	135	144.8 Å²	144.8	83%	0.828	84%	0.844	S	S	*	*			trans	14.2	123.1	136.6	37.3	0	0	0	0	119.9
245	Q	44.6	Very low	44.2	Very low	184 Å²	184	147.1 Å²	147.1	86%	0.86	85%	0.849	S	S	*	*				-173.9	112.7	121.9	-150.4	171.4	43.5	0	0	110.7
246	T	51.6	Low	44	Very low	153 Å²	153	145.1 Å²	145.1	94%	0.939	85%	0.851	S	S	*	*			trans	-113.5	104.6	164.5	51.5	0	0	0	0	108.4
247	H	48.2	Very low	44.6	Very low	166 Å²	166	147.8 Å²	147.8	77%	0.769	86%	0.857	S	S	*	*			trans	-128.8	110.1	169.3	179.5	-81.1	0	0	0	108.4
248	R	46.3	Very low	44.5	Very low	235 Å²	235	151 Å²	151	89%	0.887	87%	0.865	S	S	*	*			trans	-175.5	104.1	147.5	-118.5	-179.8	179.1	156.6	0.6	111.7
249	S	48.1	Very low	44.8	Very low	195 Å²	195	153.2 Å²	153.2	100%	1.364	87%	0.874	S	S	*	*				-160.4	0	128.1	-77.2	0	0	0	0	107.7

Retrieved 249 of 249 residues in 129.9 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).