A0A087WQM7_MOUSE Loading...

Protein CNPPD1

AlphaFold DB , UniProt , Accession A0A087WQM7, Species MOUSE (Mus musculus, Mouse), Gene Cnppd1, Length 114 aa.

						>A0A087WQM7_MOUSE|A0A087WQM7|Cnppd1
MDLTGLLLDEEGAFSLTGFQDFMVLPGHQKLSARIRRRLYYGWDLETDCSLEELSSPVADITVELLQKAAPSPIRRLQKKYVAHVSREACISPCAMMLALVYIERLRHRNPDYL
					

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	35.8	Very low	42.6	Very low	237 Å²	237	158.5 Å²	158.5	100%	1.167	85%	0.851	S	S	*	*				0	105	0	-72.9	-89.9	152.2	0	0	105
2	D	31.7	Very low	43.2	Very low	151 Å²	151	152.9 Å²	152.9	81%	0.807	86%	0.859	S	S	*	*			trans	-71.5	139.7	-153.9	-63.9	-60.3	0	0	0	114.4	T4	D2-T4 PolarHBondContact O-N 2.85Å
3	L	44.1	Very low	43.4	Very low	179 Å²	179	147 Å²	147	94%	0.937	84%	0.841	S	S	*	*	S	Bend	trans	-98.9	47	-179.1	-156.7	85.2	0	0	0	110.9
4	T	42.1	Very low	43.4	Very low	128 Å²	128	150.1 Å²	150.1	79%	0.785	84%	0.841	S	S	*	*			trans	-139.3	20.8	-166.7	-5	0	0	0	0	114.2	D2	D2-T4 PolarHBondContact O-N 2.85Å
5	G	44.8	Very low	43.6	Very low	70 Å²	70	145.3 Å²	145.3	72%	0.722	82%	0.821	S	S	*	*			trans	-112.7	-28.9	-160.4	0	0	0	0	0	120.2
6	L	44.5	Very low	44.1	Very low	170 Å²	170	143.9 Å²	143.9	89%	0.89	81%	0.81	S	S	*	*	S	Bend	trans	-153.5	101.3	-164.1	-93.7	153.6	0	0	0	113.2
7	L	46.8	Very low	44.5	Very low	167 Å²	167	141.5 Å²	141.5	87%	0.874	80%	0.799	S	S	*	*			trans	154.5	65.1	139.4	-84.1	164	0	0	0	110.7
8	L	38.4	Very low	44.6	Very low	161 Å²	161	137.4 Å²	137.4	84%	0.843	79%	0.794	S	S	*	*			trans	-117.1	123.8	150.9	-78.5	168.7	0	0	0	105.9
9	D	39.9	Very low	44.9	Very low	130 Å²	130	137.2 Å²	137.2	70%	0.695	78%	0.783	S	S	*	*			trans	-94.7	150.1	163.6	-161.8	16.2	0	0	0	107.8	E11	D9-E11 PolarHBondContact O-N 3.31Å
10	E	52.3	Low	45.2	Very low	186 Å²	186	138.2 Å²	138.2	87%	0.869	78%	0.781	S	S	*	*	S	Bend	trans	-75.5	24.7	-168.1	-70.9	-79.2	126.8	0	0	114.1
11	E	48.8	Very low	45.4	Very low	164 Å²	164	139.1 Å²	139.1	77%	0.766	78%	0.783	S	S	*	*	S	Bend	trans	-139.6	123.4	158.7	-68.6	-162.3	173.1	0	0	106.3	D9 A13	D9-E11 PolarHBondContact O-N 3.31Å; E11-A13 PolarHBondContact O-N 3.47Å
12	G	49.5	Very low	46.3	Very low	92 Å²	92	134.8 Å²	134.8	95%	0.948	76%	0.758	S	S	*	*	S	Bend	trans	-65.2	41.3	-167.3	0	0	0	0	0	117.4
13	A	45.5	Very low	47.3	Very low	76 Å²	76	135.7 Å²	135.7	63%	0.628	76%	0.76	S	S	*	*	S	Bend	trans	-110.5	122.7	170.7	0	0	0	0	0	109.7	E11 S15	E11-A13 PolarHBondContact O-N 3.47Å; A13-S15 PolarHBondContact O-N 3.16Å
14	F	43.1	Very low	47.9	Very low	191 Å²	191	130.6 Å²	130.6	84%	0.838	74%	0.736	S	S	*	*			trans	-61.7	108.9	171.3	-70.7	-84.1	0	0	0	109.6	L16	F14-L16 PolarHBondContact O-N 2.83Å
15	S	47.4	Very low	48.8	Very low	77 Å²	77	130.6 Å²	130.6	54%	0.538	73%	0.731	S	S	.	*			trans	-68.6	97.9	175.1	-168.8	0	0	0	0	110	A13 T17	A13-S15 PolarHBondContact O-N 3.16Å; S15-T17 PolarHBondContact O-N 3.09Å; S15-T17 PolarHBondContact OG-OG1 3.46Å
16	L	51.5	Low	49.8	Very low	124 Å²	124	131.9 Å²	131.9	65%	0.649	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-74.9	4.4	173	-79.5	166.5	0	0	0	113	F14 G18 F19	F14-L16 PolarHBondContact O-N 2.83Å; L16-G18 PolarHBondContact O-N 3.23Å; L16-F19 HydrophobicContact CD2-CD2 3.66Å; L16-F19 HydrophobicContact CD2-CE2 4.1Å; L16-F19 HydrophobicContact CD2-CG 4.2Å; L16-F19 PolarHBondContact O-N 3.5Å
17	T	50.9	Low	50.8	Low	102 Å²	102	126 Å²	126	63%	0.626	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-62.5	-25.2	-177.5	57.2	0	0	0	0	113.3	S15	S15-T17 PolarHBondContact O-N 3.09Å; S15-T17 PolarHBondContact OG-OG1 3.46Å
18	G	45.6	Very low	52	Low	69 Å²	69	123.2 Å²	123.2	71%	0.711	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-80.7	-8	175.1	0	0	0	0	0	115.5	L16 Q20	L16-G18 PolarHBondContact O-N 3.23Å; G18-Q20 VanDerWaalsContact C-N 3.33Å
19	F	50.3	Low	53.4	Low	132 Å²	132	121.3 Å²	121.3	58%	0.579	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-91.1	4.7	178.6	-73.8	-92.7	0	0	0	113.2	L16 D21 F22	L16-F19 HydrophobicContact CD2-CD2 3.66Å; L16-F19 HydrophobicContact CD2-CE2 4.1Å; L16-F19 HydrophobicContact CD2-CG 4.2Å; L16-F19 PolarHBondContact O-N 3.5Å; F19-D21 VanDerWaalsContact C-N 3.29Å; F19-D21 PolarHBondContact O-N 3.08Å; F19-F22 HydrophobicContact CB-CE2 4.31Å; F19-F22 HydrophobicContact CD1-CD2 4.06Å; F19-F22 AromaticContact CD1-CE2 3.36Å; F19-F22 HydrophobicContact CD1-CE2 3.36Å; F19-F22 HydrophobicContact CD1-CZ 4.29Å; F19-F22 AromaticContact CE1-CE2 3.95Å; F19-F22 HydrophobicContact CE1-CE2 3.95Å; F19-F22 HydrophobicContact CE1-CZ 4.47Å; F19-F22 HydrophobicContact CG-CE2 4.14Å
20	Q	51.1	Low	54.8	Low	158 Å²	158	122 Å²	122	74%	0.738	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-8.2	-162.3	-143.9	161.8	16.1	0	0	115.3	G18	G18-Q20 VanDerWaalsContact C-N 3.33Å
21	D	48.6	Very low	55.5	Low	157 Å²	157	117.3 Å²	117.3	84%	0.84	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.3	52.3	175.8	-75.1	-46.4	0	0	0	113.2	F19 M23	F19-D21 VanDerWaalsContact C-N 3.29Å; F19-D21 PolarHBondContact O-N 3.08Å; D21-M23 PolarHBondContact O-N 3.36Å
22	F	55	Low	56.3	Low	146 Å²	146	110.5 Å²	110.5	64%	0.64	62%	0.623	S	S	*	*			trans	-68.5	96.7	151.4	-71.4	-79.6	0	0	0	106.7	F19 V24	F19-F22 HydrophobicContact CB-CE2 4.31Å; F19-F22 HydrophobicContact CD1-CD2 4.06Å; F19-F22 AromaticContact CD1-CE2 3.36Å; F19-F22 HydrophobicContact CD1-CE2 3.36Å; F19-F22 HydrophobicContact CD1-CZ 4.29Å; F19-F22 AromaticContact CE1-CE2 3.95Å; F19-F22 HydrophobicContact CE1-CE2 3.95Å; F19-F22 HydrophobicContact CE1-CZ 4.47Å; F19-F22 HydrophobicContact CG-CE2 4.14Å; F22-V24 VanDerWaalsContact C-N 3.29Å; F22-V24 WeakPolarHBondContact O-CG2 3.32Å; F22-V24 PolarHBondContact O-N 3.05Å
23	M	52.7	Low	57.1	Low	170 Å²	170	107.9 Å²	107.9	84%	0.837	59%	0.593	S	S	*	*			trans	-40.5	100.1	161.9	-89.1	-93.3	-68.4	0	0	107.5	D21 L25	D21-M23 PolarHBondContact O-N 3.36Å; M23-L25 VanDerWaalsContact C-N 3.31Å; M23-L25 PolarHBondContact O-N 3.05Å
24	V	57.4	Low	58	Low	73 Å²	73	111.2 Å²	111.2	44%	0.442	59%	0.589	S	S	.	*			trans	-65.4	97.1	-172.2	-176.8	0	0	0	0	105.5	F22 H28 Q29	F22-V24 VanDerWaalsContact C-N 3.29Å; F22-V24 WeakPolarHBondContact O-CG2 3.32Å; F22-V24 PolarHBondContact O-N 3.05Å; V24-H28 HydrophobicContact CG1-CB 4.21Å; V24-Q29 HydrophobicContact CB-CG 4.22Å; V24-Q29 HydrophobicContact CG1-CB 4.49Å; V24-Q29 HydrophobicContact CG1-CG 3.3Å
25	L	61.6	Low	58.9	Low	127 Å²	127	106 Å²	106	67%	0.665	57%	0.569	S	S	*	*			trans	-49.7	139.5	-177.4	-86.1	89.5	0	0	0	107.9	M23 G27 H28 Q29	M23-L25 VanDerWaalsContact C-N 3.31Å; M23-L25 PolarHBondContact O-N 3.05Å; L25-G27 CarbonylContact O-C 3.57Å; L25-G27 PolarHBondContact O-N 3.43Å; L25-H28 WeakPolarHBondContact O-CA 3.45Å; L25-H28 WeakPolarHBondContact O-CB 3.32Å; L25-H28 PolarHBondContact O-N 2.87Å; L25-Q29 PolarHBondContact O-N 3.11Å
26	P	64.3	Low	59.6	Low	97 Å²	97	110.1 Å²	110.1	63%	0.63	57%	0.573	S	S	*	*	H	α-helix	trans	-53.1	-29.8	-178.7	-25.4	31.5	0	0	0	112.5	K30	P26-K30 WeakPolarHBondContact O-CG 3.4Å; P26-K30 PolarHBondContact O-N 2.72Å; P26-K30 VanDerWaalsContact O-N 3.17Å
27	G	66.4	Low	60	Low	46 Å²	46	112.9 Å²	112.9	47%	0.474	58%	0.575	S	S	.	*	H	α-helix	trans	-64.8	-38.9	171.7	0	0	0	0	0	114	L25 K30 L31	L25-G27 CarbonylContact O-C 3.57Å; L25-G27 PolarHBondContact O-N 3.43Å; G27-K30 PolarHBondContact O-N 3.38Å; G27-L31 VanDerWaalsContact O-CB 3.24Å; G27-L31 WeakPolarHBondContact O-CB 3.37Å; G27-L31 PolarHBondContact O-N 3.2Å
28	H	70.8	Confident	60.3	Low	109 Å²	109	115.3 Å²	115.3	51%	0.505	57%	0.572	S	S	.	*	H	α-helix	trans	-66.6	-40.2	176.2	-174.8	47.5	0	0	0	111.6	V24 L25 K30 L31 S32	V24-H28 HydrophobicContact CG1-CB 4.21Å; L25-H28 WeakPolarHBondContact O-CA 3.45Å; L25-H28 WeakPolarHBondContact O-CB 3.32Å; L25-H28 PolarHBondContact O-N 2.87Å; H28-K30 PolarHBondContact O-N 3.17Å; H28-L31 PolarHBondContact O-N 2.78Å; H28-S32 WeakPolarHBondContact O-CA 3.45Å; H28-S32 WeakPolarHBondContact O-CB 3.43Å; H28-S32 PolarHBondContact O-N 3.24Å
29	Q	69.1	Low	60.7	Low	121 Å²	121	116.1 Å²	116.1	57%	0.565	56%	0.56	S	S	*	*	H	α-helix	trans	-61.8	-45.3	173.4	-65.4	-174.2	2.6	0	0	111.6	V24 L25 S32 A33	V24-Q29 HydrophobicContact CB-CG 4.22Å; V24-Q29 HydrophobicContact CG1-CB 4.49Å; V24-Q29 HydrophobicContact CG1-CG 3.3Å; L25-Q29 PolarHBondContact O-N 3.11Å; Q29-S32 PolarHBondContact O-N 2.86Å; Q29-A33 WeakPolarHBondContact O-CB 3.41Å; Q29-A33 PolarHBondContact O-N 3.15Å
30	K	68.4	Low	61	Low	146 Å²	146	116.4 Å²	116.4	64%	0.635	56%	0.558	S	S	*	*	H	α-helix	trans	-65.3	-40.3	177.9	-72.6	176.9	-177.4	-179.9	0	112.7	P26 G27 H28 R34	P26-K30 WeakPolarHBondContact O-CG 3.4Å; P26-K30 PolarHBondContact O-N 2.72Å; P26-K30 VanDerWaalsContact O-N 3.17Å; G27-K30 PolarHBondContact O-N 3.38Å; H28-K30 PolarHBondContact O-N 3.17Å; K30-R34 VanDerWaalsContact O-CB 3.29Å; K30-R34 WeakPolarHBondContact O-CB 3.27Å; K30-R34 PolarHBondContact O-N 2.96Å
31	L	66.8	Low	61.4	Low	86 Å²	86	111.3 Å²	111.3	45%	0.45	53%	0.532	S	S	.	.	H	α-helix	trans	-69.3	-46.5	176.6	179.2	63.1	0	0	0	110.9	G27 H28 R34 I35	G27-L31 VanDerWaalsContact O-CB 3.24Å; G27-L31 WeakPolarHBondContact O-CB 3.37Å; G27-L31 PolarHBondContact O-N 3.2Å; H28-L31 PolarHBondContact O-N 2.78Å; L31-R34 CarbonylContact O-C 3.26Å; L31-R34 WeakPolarHBondContact O-CB 3.37Å; L31-R34 PolarHBondContact O-N 3.44Å; L31-R34 VanDerWaalsContact O-N 3.13Å; L31-I35 HydrophobicContact CD1-CD1 3.79Å; L31-I35 HydrophobicContact CD1-CG1 4.1Å; L31-I35 HydrophobicContact CD2-CD1 4.36Å; L31-I35 HydrophobicContact CG-CD1 3.73Å; L31-I35 HydrophobicContact CG-CG1 4.36Å; L31-I35 WeakPolarHBondContact O-CB 3.48Å; L31-I35 VanDerWaalsContact O-CG1 3.31Å; L31-I35 WeakPolarHBondContact O-CG1 3.35Å; L31-I35 PolarHBondContact O-N 3.14Å
32	S	66.4	Low	61.7	Low	21 Å²	21	105.3 Å²	105.3	15%	0.147	51%	0.508	C	S	.	.	H	α-helix	trans	-61.2	-44.8	177.4	-175.2	0	0	0	0	111	H28 Q29 R34 I35 R36	H28-S32 WeakPolarHBondContact O-CA 3.45Å; H28-S32 WeakPolarHBondContact O-CB 3.43Å; H28-S32 PolarHBondContact O-N 3.24Å; Q29-S32 PolarHBondContact O-N 2.86Å; S32-R34 VanDerWaalsContact C-N 3.34Å; S32-R34 PolarHBondContact O-N 3.4Å; S32-I35 PolarHBondContact O-N 3.46Å; S32-R36 VanDerWaalsContact O-CB 3.23Å; S32-R36 WeakPolarHBondContact O-CB 3.4Å; S32-R36 VanDerWaalsContact O-CG 3.24Å; S32-R36 WeakPolarHBondContact O-CG 3.29Å; S32-R36 PolarHBondContact O-N 2.87Å; S32-R36 VanDerWaalsContact OG-CZ 3.31Å; S32-R36 PolarHBondContact OG-NE 2.88Å; S32-R36 PolarHBondContact OG-NH1 3.29Å
33	A	66	Low	61.3	Low	38 Å²	38	106.6 Å²	106.6	31%	0.314	51%	0.509	S	S	.	.	H	α-helix	trans	-59.5	-43	172.1	0	0	0	0	0	111.8	Q29 R37	Q29-A33 WeakPolarHBondContact O-CB 3.41Å; Q29-A33 PolarHBondContact O-N 3.15Å; A33-R37 VanDerWaalsContact O-CB 3.29Å; A33-R37 WeakPolarHBondContact O-CB 3.38Å; A33-R37 WeakPolarHBondContact O-CG 3.35Å; A33-R37 PolarHBondContact O-N 3.31Å
34	R	65	Low	61.3	Low	145 Å²	145	102.9 Å²	102.9	55%	0.547	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-39.2	177.6	-168.9	-174.9	-52.1	-172.5	2.4	112.9	K30 L31 S32 R38	K30-R34 VanDerWaalsContact O-CB 3.29Å; K30-R34 WeakPolarHBondContact O-CB 3.27Å; K30-R34 PolarHBondContact O-N 2.96Å; L31-R34 CarbonylContact O-C 3.26Å; L31-R34 WeakPolarHBondContact O-CB 3.37Å; L31-R34 PolarHBondContact O-N 3.44Å; L31-R34 VanDerWaalsContact O-N 3.13Å; S32-R34 VanDerWaalsContact C-N 3.34Å; S32-R34 PolarHBondContact O-N 3.4Å; R34-R38 WeakPolarHBondContact O-CD 3.46Å; R34-R38 VanDerWaalsContact O-CG 3.24Å; R34-R38 WeakPolarHBondContact O-CG 3.16Å; R34-R38 PolarHBondContact O-N 3.47Å
35	I	61.8	Low	60.7	Low	81 Å²	81	106.4 Å²	106.4	42%	0.415	51%	0.508	S	S	.	.	H	α-helix	trans	-73.5	-43.8	178.7	-69.4	173.2	0	0	0	110.2	L31 S32 R37 R38 L39	L31-I35 HydrophobicContact CD1-CD1 3.79Å; L31-I35 HydrophobicContact CD1-CG1 4.1Å; L31-I35 HydrophobicContact CD2-CD1 4.36Å; L31-I35 HydrophobicContact CG-CD1 3.73Å; L31-I35 HydrophobicContact CG-CG1 4.36Å; L31-I35 WeakPolarHBondContact O-CB 3.48Å; L31-I35 VanDerWaalsContact O-CG1 3.31Å; L31-I35 WeakPolarHBondContact O-CG1 3.35Å; L31-I35 PolarHBondContact O-N 3.14Å; S32-I35 PolarHBondContact O-N 3.46Å; I35-R37 VanDerWaalsContact C-N 3.33Å; I35-R37 PolarHBondContact O-N 3.44Å; I35-R38 WeakPolarHBondContact O-CA 3.31Å; I35-R38 WeakPolarHBondContact O-CB 3.24Å; I35-R38 PolarHBondContact O-N 3.02Å; I35-L39 HydrophobicContact CG2-CD1 4.12Å; I35-L39 PolarHBondContact O-N 3.06Å
36	R	62.5	Low	60.1	Low	164 Å²	164	109.5 Å²	109.5	62%	0.619	52%	0.519	S	S	*	.	H	α-helix	trans	-59.3	-43.8	174.8	-75.2	174.8	178.3	155.6	0.1	111.1	S32 R38 L39 Y40	S32-R36 VanDerWaalsContact O-CB 3.23Å; S32-R36 WeakPolarHBondContact O-CB 3.4Å; S32-R36 VanDerWaalsContact O-CG 3.24Å; S32-R36 WeakPolarHBondContact O-CG 3.29Å; S32-R36 PolarHBondContact O-N 2.87Å; S32-R36 VanDerWaalsContact OG-CZ 3.31Å; S32-R36 PolarHBondContact OG-NE 2.88Å; S32-R36 PolarHBondContact OG-NH1 3.29Å; R36-R38 PolarHBondContact O-N 3.13Å; R36-R38 VanDerWaalsContact O-N 3.15Å; R36-L39 PolarHBondContact O-N 2.62Å; R36-Y40 WeakPolarHBondContact O-CB 3.24Å; R36-Y40 PolarHBondContact O-N 2.92Å
37	R	58.7	Low	59.2	Low	182 Å²	182	108.5 Å²	108.5	69%	0.687	51%	0.511	S	S	*	.	H	α-helix	trans	-60.7	-19.3	171.8	-75.6	175.7	-175.7	171.6	2.1	114.5	A33 I35	A33-R37 VanDerWaalsContact O-CB 3.29Å; A33-R37 WeakPolarHBondContact O-CB 3.38Å; A33-R37 WeakPolarHBondContact O-CG 3.35Å; A33-R37 PolarHBondContact O-N 3.31Å; I35-R37 VanDerWaalsContact C-N 3.33Å; I35-R37 PolarHBondContact O-N 3.44Å
38	R	57.5	Low	58.1	Low	153 Å²	153	115 Å²	115	58%	0.577	54%	0.535	S	S	*	.	H	α-helix	trans	-95.9	-18.6	-178.5	-75.4	173	179.1	-160.2	-2.2	114.1	R34 I35 R36 S55	R34-R38 WeakPolarHBondContact O-CD 3.46Å; R34-R38 VanDerWaalsContact O-CG 3.24Å; R34-R38 WeakPolarHBondContact O-CG 3.16Å; R34-R38 PolarHBondContact O-N 3.47Å; I35-R38 WeakPolarHBondContact O-CA 3.31Å; I35-R38 WeakPolarHBondContact O-CB 3.24Å; I35-R38 PolarHBondContact O-N 3.02Å; R36-R38 PolarHBondContact O-N 3.13Å; R36-R38 VanDerWaalsContact O-N 3.15Å; R38-S55 PolarHBondContact O-OG 2.97Å
39	L	54.1	Low	56.7	Low	86 Å²	86	113.9 Å²	113.9	45%	0.45	54%	0.538	S	S	.	.	H	α-helix	trans	-127.2	-19.9	-170.9	-65.7	175.3	0	0	0	114.4	I35 R36 V58	I35-L39 HydrophobicContact CG2-CD1 4.12Å; I35-L39 PolarHBondContact O-N 3.06Å; R36-L39 PolarHBondContact O-N 2.62Å; L39-V58 HydrophobicContact CD2-CG2 4.27Å
40	Y	57.8	Low	55.8	Low	139 Å²	139	110.9 Å²	110.9	55%	0.545	53%	0.531	S	S	.	.	S	Bend	trans	-104.5	162.1	176	-76.5	-89.3	0	0	0	111.6	R36 P93	R36-Y40 WeakPolarHBondContact O-CB 3.24Å; R36-Y40 PolarHBondContact O-N 2.92Å; Y40-P93 HydrophobicContact CD1-CG 4.34Å
41	Y	59.3	Low	54.9	Low	50 Å²	50	108.8 Å²	108.8	20%	0.196	53%	0.526	C	S	.	.	S	Bend	trans	-45.3	139.3	165.1	-65.6	-82.6	0	0	0	109.8	W43 E53 L54 S86 I91 P93	Y41-W43 PolarHBondContact O-N 3.02Å; Y41-E53 VanDerWaalsContact CD1-O 3.22Å; Y41-E53 WeakPolarHBondContact CD1-O 3.2Å; Y41-L54 HydrophobicContact CE1-CB 4.3Å; Y41-S86 PolarHBondContact OH-OG 3.48Å; Y41-I91 PolarHBondContact OH-O 3.34Å; Y41-P93 HydrophobicContact CD2-CG 4.17Å; Y41-P93 HydrophobicContact CE2-CG 3.92Å
42	G	53.6	Low	54.3	Low	32 Å²	32	108.8 Å²	108.8	33%	0.33	52%	0.524	S	S	.	.			trans	-53.3	109	-178	0	0	0	0	0	110.6	D44	G42-D44 PolarHBondContact O-N 2.66Å
43	W	46.9	Very low	54.2	Low	172 Å²	172	114.1 Å²	114.1	65%	0.652	55%	0.547	S	S	*	.			trans	-94.5	83.4	171.6	-172.4	-74.8	0	0	0	107.4	Y41 L51	Y41-W43 PolarHBondContact O-N 3.02Å; W43-L51 HydrophobicContact CD2-CD1 4.27Å; W43-L51 HydrophobicContact CE3-CD1 3.77Å; W43-L51 HydrophobicContact CZ3-CD1 4.27Å
44	D	51.9	Low	54.6	Low	93 Å²	93	112.7 Å²	112.7	50%	0.497	53%	0.533	S	S	.	.			trans	-98.3	111	168.5	-70.4	-26.3	0	0	0	107.7	G42 E46	G42-D44 PolarHBondContact O-N 2.66Å; D44-E46 VanDerWaalsContact C-N 3.34Å
45	L	46.2	Very low	55.2	Low	146 Å²	146	106.2 Å²	106.2	76%	0.764	51%	0.51	S	S	*	.	S	Bend	trans	-82.9	-9.3	-173.6	-171.9	61.1	0	0	0	113
46	E	49.5	Very low	56.1	Low	192 Å²	192	105.4 Å²	105.4	90%	0.897	51%	0.512	S	S	*	.	S	Bend	trans	-113.4	-7.7	-172.8	-72.3	-174.9	165.7	0	0	114.6	D44	D44-E46 VanDerWaalsContact C-N 3.34Å
47	T	45.2	Very low	57.2	Low	77 Å²	77	100.5 Å²	100.5	47%	0.472	50%	0.501	S	S	.	.	S	Bend	trans	-135.4	126.3	174.9	32.2	0	0	0	0	106.8	C49	T47-C49 PolarHBondContact O-N 3.49Å
48	D	42.8	Very low	58.5	Low	183 Å²	183	91.9 Å²	91.9	98%	0.979	47%	0.469	S	S	*	.			trans	-63.2	45.4	170	-63.4	-51.2	0	0	0	111.9
49	C	42.3	Very low	60	Low	84 Å²	84	84.7 Å²	84.7	57%	0.568	44%	0.442	S	S	*	.			trans	-111.6	91	-175.9	-68.2	0	0	0	0	108.3	T47	T47-C49 PolarHBondContact O-N 3.49Å
50	S	48.4	Very low	61.7	Low	59 Å²	59	84 Å²	84	41%	0.413	44%	0.439	S	S	.	.			trans	57.1	77.7	154.8	-164.9	0	0	0	0	115.9	E52	S50-E52 PolarHBondContact O-N 3.35Å
51	L	49.3	Very low	63.4	Low	101 Å²	101	80.3 Å²	80.3	53%	0.529	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	22.3	156.9	-153.8	94.6	0	0	0	112.5	W43	W43-L51 HydrophobicContact CD2-CD1 4.27Å; W43-L51 HydrophobicContact CE3-CD1 3.77Å; W43-L51 HydrophobicContact CZ3-CD1 4.27Å
52	E	55.5	Low	65	Low	87 Å²	87	78 Å²	78	41%	0.407	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	-10.7	-156.1	-65.6	-141	108.3	0	0	114.3	S50 R87	S50-E52 PolarHBondContact O-N 3.35Å; E52-R87 WeakPolarHBondContact O-CD 3.39Å; E52-R87 IonicContact OE1-CZ 2.91Å; E52-R87 VanDerWaalsContact OE1-CZ 3.27Å; E52-R87 IonicContact OE1-NE 2.83Å; E52-R87 PolarHBondContact OE1-NE 2.96Å; E52-R87 IonicContact OE1-NH2 2.58Å; E52-R87 PolarHBondContact OE1-NH2 3.17Å; E52-R87 IonicContact OE2-CZ 2.93Å; E52-R87 IonicContact OE2-NE 3.05Å; E52-R87 PolarHBondContact OE2-NE 2.93Å; E52-R87 IonicContact OE2-NH1 3.85Å; E52-R87 IonicContact OE2-NH2 3.27Å; E52-R87 PolarHBondContact OE2-NH2 3.32Å
53	E	63.6	Low	66.9	Low	133 Å²	133	77.4 Å²	77.4	62%	0.621	41%	0.409	S	S	*	.	S	Bend	trans	-100.9	126.1	178.9	-76.1	-172.8	160.6	0	0	112.3	Y41 S55	Y41-E53 VanDerWaalsContact CD1-O 3.22Å; Y41-E53 WeakPolarHBondContact CD1-O 3.2Å; E53-S55 PolarHBondContact O-N 3.38Å
54	L	74.1	Confident	69.2	Low	7 Å²	7	73.8 Å²	73.8	4%	0.037	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-49.6	138.5	170.8	-178	69.3	0	0	0	109.3	Y41 S56 V58 A59 V82 A83 M96	Y41-L54 HydrophobicContact CE1-CB 4.3Å; L54-S56 PolarHBondContact O-N 3.34Å; L54-V58 HydrophobicContact CD1-CB 4.35Å; L54-V58 HydrophobicContact CD1-CG1 3.9Å; L54-V58 HydrophobicContact CD2-CG1 4.13Å; L54-V58 HydrophobicContact CG-CB 4.31Å; L54-V58 HydrophobicContact CG-CG1 4.14Å; L54-A59 HydrophobicContact CD2-CB 4.03Å; L54-V82 HydrophobicContact CD2-CG1 3.92Å; L54-A83 HydrophobicContact CB-CB 4.32Å; L54-M96 HydrophobicContact CD2-CE 4.34Å
55	S	78.4	Confident	71.2	Confident	9 Å²	9	71.3 Å²	71.3	6%	0.063	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-53.9	132.8	-178.4	75.4	0	0	0	0	111.1	R38 E53 P57 V58 A59	R38-S55 PolarHBondContact O-OG 2.97Å; E53-S55 PolarHBondContact O-N 3.38Å; S55-P57 VanDerWaalsContact C-CD 3.48Å; S55-P57 VanDerWaalsContact C-N 3.32Å; S55-V58 PolarHBondContact O-N 3.34Å; S55-V58 VanDerWaalsContact OG-CB 3.26Å; S55-V58 WeakPolarHBondContact OG-CB 3.47Å; S55-V58 WeakPolarHBondContact OG-CG2 3.24Å; S55-A59 PolarHBondContact O-N 3.36Å
56	S	81.1	Confident	73.4	Confident	64 Å²	64	66.9 Å²	66.9	45%	0.448	36%	0.363	S	S	.	.	H	α-helix	trans	-48.9	-46.6	-176.9	159	0	0	0	0	113.1	L54 A59 D60 K79	L54-S56 PolarHBondContact O-N 3.34Å; S56-A59 PolarHBondContact O-N 3.03Å; S56-D60 PolarHBondContact O-N 3.26Å; S56-D60 VanDerWaalsContact O-OD2 3.1Å; S56-K79 VanDerWaalsContact O-CE 3.24Å; S56-K79 WeakPolarHBondContact O-CE 3.24Å; S56-K79 PolarHBondContact O-NZ 3.04Å; S56-K79 WeakPolarHBondContact OG-CE 3.5Å; S56-K79 PolarHBondContact OG-NZ 3.22Å
57	P	84.4	Confident	75.4	Confident	61 Å²	61	60.1 Å²	60.1	40%	0.396	33%	0.331	S	S	.	.	H	α-helix	trans	-64.9	-38.5	176.5	-21.7	34.4	0	0	0	113.8	S55 A59 D60 I61	S55-P57 VanDerWaalsContact C-CD 3.48Å; S55-P57 VanDerWaalsContact C-N 3.32Å; P57-A59 VanDerWaalsContact C-N 3.32Å; P57-A59 PolarHBondContact O-N 2.99Å; P57-D60 PolarHBondContact O-N 2.91Å; P57-I61 WeakPolarHBondContact O-CG2 3.47Å; P57-I61 PolarHBondContact O-N 3.48Å
58	V	86.1	Confident	77.6	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.012	33%	0.334	C	S	.	.	H	α-helix	trans	-65.7	-39.5	177.8	174.8	0	0	0	0	110.3	L39 L54 S55 I61 T62 M96	L39-V58 HydrophobicContact CD2-CG2 4.27Å; L54-V58 HydrophobicContact CD1-CB 4.35Å; L54-V58 HydrophobicContact CD1-CG1 3.9Å; L54-V58 HydrophobicContact CD2-CG1 4.13Å; L54-V58 HydrophobicContact CG-CB 4.31Å; L54-V58 HydrophobicContact CG-CG1 4.14Å; S55-V58 PolarHBondContact O-N 3.34Å; S55-V58 VanDerWaalsContact OG-CB 3.26Å; S55-V58 WeakPolarHBondContact OG-CB 3.47Å; S55-V58 WeakPolarHBondContact OG-CG2 3.24Å; V58-I61 WeakPolarHBondContact O-CG1 3.23Å; V58-T62 VanDerWaalsContact O-CB 3.24Å; V58-T62 WeakPolarHBondContact O-CB 3.29Å; V58-T62 PolarHBondContact O-N 3.02Å; V58-T62 PolarHBondContact O-OG1 3.42Å; V58-M96 HydrophobicContact CG1-CG 4.1Å
59	A	89.8	Confident	79.8	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-64	-40.2	173.7	0	0	0	0	0	111.9	L54 S55 S56 P57 T62 V63 K79 V82	L54-A59 HydrophobicContact CD2-CB 4.03Å; S55-A59 PolarHBondContact O-N 3.36Å; S56-A59 PolarHBondContact O-N 3.03Å; P57-A59 VanDerWaalsContact C-N 3.32Å; P57-A59 PolarHBondContact O-N 2.99Å; A59-T62 PolarHBondContact O-N 3.27Å; A59-V63 VanDerWaalsContact O-CG2 3.29Å; A59-V63 WeakPolarHBondContact O-CG2 3.21Å; A59-V63 PolarHBondContact O-N 2.73Å; A59-K79 HydrophobicContact CB-CD 4.45Å; A59-K79 HydrophobicContact CB-CG 3.56Å; A59-V82 HydrophobicContact CB-CG1 4.45Å
60	D	90.1	Very high	81.9	Confident	73 Å²	73	52.4 Å²	52.4	39%	0.39	28%	0.284	S	S	.	.	H	α-helix	trans	-64	-49.3	178.6	-67.2	-29.5	0	0	0	112.1	S56 P57 T62 V63 E64 K79	S56-D60 PolarHBondContact O-N 3.26Å; S56-D60 VanDerWaalsContact O-OD2 3.1Å; P57-D60 PolarHBondContact O-N 2.91Å; D60-T62 VanDerWaalsContact C-N 3.27Å; D60-T62 PolarHBondContact O-N 3.48Å; D60-V63 PolarHBondContact O-N 2.96Å; D60-E64 PolarHBondContact O-N 3.27Å; D60-K79 WeakPolarHBondContact OD1-CD 3.24Å; D60-K79 WeakPolarHBondContact OD1-CE 3.18Å; D60-K79 IonicContact OD1-NZ 2.76Å; D60-K79 PolarHBondContact OD1-NZ 3.21Å; D60-K79 IonicContact OD2-NZ 2.82Å; D60-K79 PolarHBondContact OD2-NZ 3.07Å
61	I	92.9	Very high	83.7	Confident	61 Å²	61	54.5 Å²	54.5	31%	0.313	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-33.8	177.6	66.9	177.9	0	0	0	111.8	P57 V58 E64 L65 M97 L100	P57-I61 WeakPolarHBondContact O-CG2 3.47Å; P57-I61 PolarHBondContact O-N 3.48Å; V58-I61 WeakPolarHBondContact O-CG1 3.23Å; I61-E64 PolarHBondContact O-N 3.1Å; I61-L65 WeakPolarHBondContact O-CB 3.27Å; I61-L65 WeakPolarHBondContact O-CG 3.35Å; I61-L65 PolarHBondContact O-N 3.27Å; I61-M97 HydrophobicContact CD1-CE 4.08Å; I61-M97 HydrophobicContact CD1-SD 3.64Å; I61-L100 HydrophobicContact CD1-CD1 4.18Å; I61-L100 HydrophobicContact CG1-CD1 4.14Å
62	T	93.1	Very high	85.1	Confident	1 Å²	1	53 Å²	53	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-45.9	178.4	-62.5	0	0	0	0	110.2	V58 A59 D60 E64 L66 V82 M96 L100	V58-T62 VanDerWaalsContact O-CB 3.24Å; V58-T62 WeakPolarHBondContact O-CB 3.29Å; V58-T62 PolarHBondContact O-N 3.02Å; V58-T62 PolarHBondContact O-OG1 3.42Å; A59-T62 PolarHBondContact O-N 3.27Å; D60-T62 VanDerWaalsContact C-N 3.27Å; D60-T62 PolarHBondContact O-N 3.48Å; T62-E64 VanDerWaalsContact C-N 3.33Å; T62-E64 PolarHBondContact O-N 3.08Å; T62-L66 HydrophobicContact CG2-CD1 3.51Å; T62-L66 HydrophobicContact CG2-CG 4.32Å; T62-L66 VanDerWaalsContact O-CB 3.24Å; T62-L66 WeakPolarHBondContact O-CB 3.02Å; T62-L66 VanDerWaalsContact O-CG 3.31Å; T62-L66 WeakPolarHBondContact O-CG 3.26Å; T62-L66 PolarHBondContact O-N 2.96Å; T62-V82 HydrophobicContact CG2-CG1 3.53Å; T62-V82 HydrophobicContact CG2-CG2 4.23Å; T62-M96 HydrophobicContact CG2-SD 4.07Å; T62-L100 HydrophobicContact CG2-CD2 4.16Å
63	V	94.1	Very high	86	Confident	20 Å²	20	55 Å²	55	12%	0.121	31%	0.314	C	S	.	.	H	α-helix	trans	-59.4	-46.5	175.1	171.3	0	0	0	0	110.6	A59 D60 Q67 L77 K79 V82	A59-V63 VanDerWaalsContact O-CG2 3.29Å; A59-V63 WeakPolarHBondContact O-CG2 3.21Å; A59-V63 PolarHBondContact O-N 2.73Å; D60-V63 PolarHBondContact O-N 2.96Å; V63-Q67 HydrophobicContact CG1-CG 4.34Å; V63-Q67 VanDerWaalsContact CG1-NE2 3.34Å; V63-Q67 VanDerWaalsContact O-CB 3.24Å; V63-Q67 WeakPolarHBondContact O-CB 3.32Å; V63-Q67 WeakPolarHBondContact O-CG 3.42Å; V63-Q67 PolarHBondContact O-N 2.92Å; V63-L77 VanDerWaalsContact CG1-O 3.3Å; V63-L77 WeakPolarHBondContact CG1-O 3.3Å; V63-L77 HydrophobicContact CG2-CG 4.29Å; V63-K79 HydrophobicContact CG2-CB 4.48Å; V63-V82 HydrophobicContact CG2-CB 4.5Å; V63-V82 HydrophobicContact CG2-CG2 3.69Å
64	E	93.6	Very high	86.7	Confident	95 Å²	95	56.3 Å²	56.3	44%	0.444	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-51.8	-178.6	-172.5	-174	157.8	0	0	112.3	D60 I61 T62 K68	D60-E64 PolarHBondContact O-N 3.27Å; I61-E64 PolarHBondContact O-N 3.1Å; T62-E64 VanDerWaalsContact C-N 3.33Å; T62-E64 PolarHBondContact O-N 3.08Å; E64-K68 HydrophobicContact CG-CD 4.18Å; E64-K68 WeakPolarHBondContact O-CB 3.31Å; E64-K68 VanDerWaalsContact O-CG 3.29Å; E64-K68 WeakPolarHBondContact O-CG 3.35Å; E64-K68 PolarHBondContact O-N 2.63Å; E64-K68 IonicContact OE1-NZ 2.62Å; E64-K68 PolarHBondContact OE1-NZ 3.5Å
65	L	93.7	Very high	87.1	Confident	41 Å²	41	64.1 Å²	64.1	22%	0.215	35%	0.353	C	S	.	.	H	α-helix	trans	-68.4	-42.9	-176.3	-70	174.3	0	0	0	111.9	I61 K68 A69 L100 E104	I61-L65 WeakPolarHBondContact O-CB 3.27Å; I61-L65 WeakPolarHBondContact O-CG 3.35Å; I61-L65 PolarHBondContact O-N 3.27Å; L65-K68 PolarHBondContact O-N 3.43Å; L65-A69 VanDerWaalsContact O-CB 3.27Å; L65-A69 WeakPolarHBondContact O-CB 3.49Å; L65-A69 PolarHBondContact O-N 3.15Å; L65-L100 HydrophobicContact CB-CD2 4.14Å; L65-L100 HydrophobicContact CD1-CB 3.98Å; L65-L100 HydrophobicContact CD1-CD1 4.22Å; L65-L100 HydrophobicContact CD1-CD2 4.18Å; L65-L100 HydrophobicContact CD1-CG 4.35Å; L65-E104 HydrophobicContact CD2-CG 3.84Å; L65-E104 WeakPolarHBondContact CD2-OE1 3.18Å
66	L	92.3	Very high	87.6	Confident	54 Å²	54	72.8 Å²	72.8	28%	0.283	38%	0.384	S	S	.	.	H	α-helix	trans	-65.7	-40.9	177.9	-74.1	171.5	0	0	0	112	T62 K68 A69 A70 L77 L100 I103	T62-L66 HydrophobicContact CG2-CD1 3.51Å; T62-L66 HydrophobicContact CG2-CG 4.32Å; T62-L66 VanDerWaalsContact O-CB 3.24Å; T62-L66 WeakPolarHBondContact O-CB 3.02Å; T62-L66 VanDerWaalsContact O-CG 3.31Å; T62-L66 WeakPolarHBondContact O-CG 3.26Å; T62-L66 PolarHBondContact O-N 2.96Å; L66-K68 VanDerWaalsContact C-N 3.29Å; L66-K68 PolarHBondContact O-N 3.01Å; L66-A69 PolarHBondContact O-N 2.98Å; L66-A70 PolarHBondContact O-N 3.23Å; L66-L77 HydrophobicContact CB-CD2 3.78Å; L66-L77 HydrophobicContact CD1-CD2 3.55Å; L66-L77 HydrophobicContact CG-CD2 4.32Å; L66-L100 HydrophobicContact CG-CD2 4.48Å; L66-I103 HydrophobicContact CD2-CD1 3.41Å; L66-I103 VanDerWaalsContact CD2-CD1 3.41Å
67	Q	92.1	Very high	88.1	Confident	49 Å²	49	72 Å²	72	23%	0.229	37%	0.374	C	S	.	.	H	α-helix	trans	-66	-33.6	176.6	-75.3	179.4	5.3	0	0	112.5	V63 L77	V63-Q67 HydrophobicContact CG1-CG 4.34Å; V63-Q67 VanDerWaalsContact CG1-NE2 3.34Å; V63-Q67 VanDerWaalsContact O-CB 3.24Å; V63-Q67 WeakPolarHBondContact O-CB 3.32Å; V63-Q67 WeakPolarHBondContact O-CG 3.42Å; V63-Q67 PolarHBondContact O-N 2.92Å; Q67-L77 HydrophobicContact CG-CB 4.1Å; Q67-L77 PolarHBondContact NE2-O 3.41Å
68	K	90.8	Very high	88.4	Confident	125 Å²	125	74.4 Å²	74.4	54%	0.543	38%	0.38	S	S	.	.	H	α-helix	trans	-72	-37	174.6	-76.6	173.9	174.9	177.9	0	112.3	E64 L65 L66	E64-K68 HydrophobicContact CG-CD 4.18Å; E64-K68 WeakPolarHBondContact O-CB 3.31Å; E64-K68 VanDerWaalsContact O-CG 3.29Å; E64-K68 WeakPolarHBondContact O-CG 3.35Å; E64-K68 PolarHBondContact O-N 2.63Å; E64-K68 IonicContact OE1-NZ 2.62Å; E64-K68 PolarHBondContact OE1-NZ 3.5Å; L65-K68 PolarHBondContact O-N 3.43Å; L66-K68 VanDerWaalsContact C-N 3.29Å; L66-K68 PolarHBondContact O-N 3.01Å
69	A	89.8	Confident	88.5	Confident	12 Å²	12	77.8 Å²	77.8	10%	0.099	40%	0.395	C	S	.	.	H	α-helix	trans	-78.9	-41.6	-177.2	0	0	0	0	0	113.3	L65 L66 I103 L114	L65-A69 VanDerWaalsContact O-CB 3.27Å; L65-A69 WeakPolarHBondContact O-CB 3.49Å; L65-A69 PolarHBondContact O-N 3.15Å; L66-A69 PolarHBondContact O-N 2.98Å; A69-I103 HydrophobicContact CB-CG2 3.33Å; A69-L114 HydrophobicContact CB-CD1 4.18Å
70	A	86.4	Confident	88.5	Confident	46 Å²	46	86.1 Å²	86.1	38%	0.38	43%	0.431	S	S	.	.	S	Bend	trans	-135.1	84.3	-179.2	0	0	0	0	0	109.6	L66 S72	L66-A70 PolarHBondContact O-N 3.23Å; A70-S72 PolarHBondContact O-N 3.31Å; A70-S72 VanDerWaalsContact O-N 3.13Å
71	P	85.8	Confident	88.5	Confident	103 Å²	103	89 Å²	89	67%	0.669	44%	0.437	S	S	*	.			trans	-66.8	114.3	-179.8	26	-32.2	0	0	0	110.3	P73	P71-P73 WeakPolarHBondContact O-CD 3.48Å
72	S	79.4	Confident	88.4	Confident	68 Å²	68	86.5 Å²	86.5	48%	0.476	43%	0.425	S	S	.	.			trans	-80.8	123.3	174.7	179.1	0	0	0	0	110.8	A70 I74 R75	A70-S72 PolarHBondContact O-N 3.31Å; A70-S72 VanDerWaalsContact O-N 3.13Å; S72-I74 VanDerWaalsContact C-N 3.26Å; S72-I74 PolarHBondContact O-N 3.01Å; S72-I74 PolarHBondContact OG-N 3.37Å; S72-R75 WeakPolarHBondContact CB-O 3.47Å; S72-R75 PolarHBondContact OG-N 3.39Å; S72-R75 PolarHBondContact OG-O 3.01Å
73	P	73.9	Confident	88.1	Confident	129 Å²	129	87.1 Å²	87.1	84%	0.838	43%	0.43	S	S	*	.	S	Bend	trans	-73.8	-18.1	177.8	26.2	-30.4	0	0	0	113.1	P71	P71-P73 WeakPolarHBondContact O-CD 3.48Å
74	I	79	Confident	87.8	Confident	161 Å²	161	91.3 Å²	91.3	83%	0.826	45%	0.448	S	S	*	.	S	Bend	trans	-103	-37.1	-171	-59.7	167	0	0	0	111.4	S72	S72-I74 VanDerWaalsContact C-N 3.26Å; S72-I74 PolarHBondContact O-N 3.01Å; S72-I74 PolarHBondContact OG-N 3.37Å
75	R	83	Confident	87.6	Confident	172 Å²	172	89.3 Å²	89.3	65%	0.649	44%	0.443	S	S	*	.			trans	-150.5	125.9	-175.4	-170.9	172.2	178.7	170.7	-0.4	112.7	S72	S72-R75 WeakPolarHBondContact CB-O 3.47Å; S72-R75 PolarHBondContact OG-N 3.39Å; S72-R75 PolarHBondContact OG-O 3.01Å
76	R	87.8	Confident	87.4	Confident	190 Å²	190	87.4 Å²	87.4	72%	0.717	43%	0.432	S	S	*	.			trans	-71.3	131.7	171.7	-61.1	-171.7	77.3	167.7	4.1	110.3	Q78	R76-Q78 PolarHBondContact O-N 2.81Å
77	L	91	Very high	87	Confident	47 Å²	47	90.2 Å²	90.2	25%	0.246	44%	0.439	C	S	.	.			trans	-61.8	128.9	174.6	-174	61.8	0	0	0	110	V63 L66 Q67 Y81 V82	V63-L77 VanDerWaalsContact CG1-O 3.3Å; V63-L77 WeakPolarHBondContact CG1-O 3.3Å; V63-L77 HydrophobicContact CG2-CG 4.29Å; L66-L77 HydrophobicContact CB-CD2 3.78Å; L66-L77 HydrophobicContact CD1-CD2 3.55Å; L66-L77 HydrophobicContact CG-CD2 4.32Å; Q67-L77 HydrophobicContact CG-CB 4.1Å; Q67-L77 PolarHBondContact NE2-O 3.41Å; L77-Y81 HydrophobicContact CD1-CD1 3.64Å; L77-Y81 HydrophobicContact CD1-CE1 4.27Å; L77-V82 HydrophobicContact CD1-CG2 3.89Å; L77-V82 HydrophobicContact CD2-CG2 3.74Å; L77-V82 HydrophobicContact CG-CG2 3.71Å
78	Q	90.7	Very high	86.8	Confident	112 Å²	112	94.5 Å²	94.5	52%	0.523	46%	0.459	S	S	.	.			trans	-106.7	145.5	-178.5	-68.6	-176.6	-23	0	0	110.8	R76 K80 Y81 V82	R76-Q78 PolarHBondContact O-N 2.81Å; Q78-K80 VanDerWaalsContact C-N 3.29Å; Q78-K80 PolarHBondContact O-N 3.33Å; Q78-Y81 WeakPolarHBondContact O-CB 3.48Å; Q78-Y81 PolarHBondContact O-N 2.88Å; Q78-V82 PolarHBondContact O-N 2.93Å; Q78-V82 VanDerWaalsContact O-N 3.09Å
79	K	90	Very high	86.7	Confident	73 Å²	73	91.5 Å²	91.5	32%	0.317	46%	0.458	S	S	.	.	H	α-helix	trans	-52.1	-45	177.1	-172.2	-171	-169.6	145.4	0	113.2	S56 A59 D60 V63 Y81 V82 A83	S56-K79 VanDerWaalsContact O-CE 3.24Å; S56-K79 WeakPolarHBondContact O-CE 3.24Å; S56-K79 PolarHBondContact O-NZ 3.04Å; S56-K79 WeakPolarHBondContact OG-CE 3.5Å; S56-K79 PolarHBondContact OG-NZ 3.22Å; A59-K79 HydrophobicContact CB-CD 4.45Å; A59-K79 HydrophobicContact CB-CG 3.56Å; D60-K79 WeakPolarHBondContact OD1-CD 3.24Å; D60-K79 WeakPolarHBondContact OD1-CE 3.18Å; D60-K79 IonicContact OD1-NZ 2.76Å; D60-K79 PolarHBondContact OD1-NZ 3.21Å; D60-K79 IonicContact OD2-NZ 2.82Å; D60-K79 PolarHBondContact OD2-NZ 3.07Å; V63-K79 HydrophobicContact CG2-CB 4.48Å; K79-Y81 VanDerWaalsContact C-N 3.27Å; K79-Y81 PolarHBondContact O-N 2.99Å; K79-V82 PolarHBondContact O-N 3.26Å; K79-A83 PolarHBondContact O-N 2.88Å
80	K	88.8	Confident	86.4	Confident	177 Å²	177	96.4 Å²	96.4	77%	0.77	49%	0.49	S	S	*	.	H	α-helix	trans	-58.8	-39.5	178.1	-67.5	-172.9	176.8	-174.1	0	112.1	Q78 H84	Q78-K80 VanDerWaalsContact C-N 3.29Å; Q78-K80 PolarHBondContact O-N 3.33Å; K80-H84 VanDerWaalsContact O-CB 3.32Å; K80-H84 WeakPolarHBondContact O-CB 3.21Å; K80-H84 PolarHBondContact O-N 3.16Å
81	Y	90.8	Very high	86.4	Confident	132 Å²	132	96.5 Å²	96.5	52%	0.518	48%	0.484	S	S	.	.	H	α-helix	trans	-70.3	-40.8	178.7	-175.3	-103.2	0	0	0	111.6	L77 Q78 K79 H84 V85	L77-Y81 HydrophobicContact CD1-CD1 3.64Å; L77-Y81 HydrophobicContact CD1-CE1 4.27Å; Q78-Y81 WeakPolarHBondContact O-CB 3.48Å; Q78-Y81 PolarHBondContact O-N 2.88Å; K79-Y81 VanDerWaalsContact C-N 3.27Å; K79-Y81 PolarHBondContact O-N 2.99Å; Y81-H84 PolarHBondContact O-N 3.42Å; Y81-V85 HydrophobicContact CD1-CG2 4.1Å; Y81-V85 HydrophobicContact CD2-CG2 4.34Å; Y81-V85 HydrophobicContact CE1-CG2 3.69Å; Y81-V85 HydrophobicContact CE2-CG2 3.92Å; Y81-V85 HydrophobicContact CG-CG2 4.43Å; Y81-V85 WeakPolarHBondContact O-CG2 3.34Å; Y81-V85 PolarHBondContact O-N 3.22Å
82	V	90.8	Very high	86.3	Confident	9 Å²	9	94.2 Å²	94.2	6%	0.055	47%	0.47	C	S	.	.	H	α-helix	trans	-61	-47.3	174.6	175.3	0	0	0	0	111.2	L54 A59 T62 V63 L77 Q78 K79 H84 V85 S86	L54-V82 HydrophobicContact CD2-CG1 3.92Å; A59-V82 HydrophobicContact CB-CG1 4.45Å; T62-V82 HydrophobicContact CG2-CG1 3.53Å; T62-V82 HydrophobicContact CG2-CG2 4.23Å; V63-V82 HydrophobicContact CG2-CB 4.5Å; V63-V82 HydrophobicContact CG2-CG2 3.69Å; L77-V82 HydrophobicContact CD1-CG2 3.89Å; L77-V82 HydrophobicContact CD2-CG2 3.74Å; L77-V82 HydrophobicContact CG-CG2 3.71Å; Q78-V82 PolarHBondContact O-N 2.93Å; Q78-V82 VanDerWaalsContact O-N 3.09Å; K79-V82 PolarHBondContact O-N 3.26Å; V82-H84 VanDerWaalsContact C-N 3.33Å; V82-H84 PolarHBondContact O-N 3.4Å; V82-V85 PolarHBondContact O-N 3.15Å; V82-S86 VanDerWaalsContact O-CB 3.27Å; V82-S86 WeakPolarHBondContact O-CB 3.22Å; V82-S86 PolarHBondContact O-N 3.29Å
83	A	87.3	Confident	86.4	Confident	14 Å²	14	91.7 Å²	91.7	12%	0.116	45%	0.452	C	S	.	.	H	α-helix	trans	-60.3	-44.3	177.6	0	0	0	0	0	111.6	L54 K79 S86 R87	L54-A83 HydrophobicContact CB-CB 4.32Å; K79-A83 PolarHBondContact O-N 2.88Å; A83-S86 PolarHBondContact O-N 3.39Å; A83-R87 PolarHBondContact O-N 2.88Å; A83-R87 VanDerWaalsContact O-N 3.15Å
84	H	87.4	Confident	86.9	Confident	109 Å²	109	89.5 Å²	89.5	51%	0.505	44%	0.439	S	S	.	.	H	α-helix	trans	-59.8	-52.6	176.1	179.5	-74.6	0	0	0	112.3	K80 Y81 V82 S86 R87 E88	K80-H84 VanDerWaalsContact O-CB 3.32Å; K80-H84 WeakPolarHBondContact O-CB 3.21Å; K80-H84 PolarHBondContact O-N 3.16Å; Y81-H84 PolarHBondContact O-N 3.42Å; V82-H84 VanDerWaalsContact C-N 3.33Å; V82-H84 PolarHBondContact O-N 3.4Å; H84-S86 VanDerWaalsContact C-N 3.34Å; H84-S86 PolarHBondContact O-N 3.45Å; H84-R87 PolarHBondContact O-N 3.42Å; H84-E88 WeakPolarHBondContact O-CB 3.44Å; H84-E88 PolarHBondContact O-N 3.21Å
85	V	89.4	Confident	87.4	Confident	53 Å²	53	83.9 Å²	83.9	32%	0.321	42%	0.416	S	S	.	.	H	α-helix	trans	-63.9	-40.2	-179.4	172.2	0	0	0	0	111.4	Y81 V82 R87 E88 A89	Y81-V85 HydrophobicContact CD1-CG2 4.1Å; Y81-V85 HydrophobicContact CD2-CG2 4.34Å; Y81-V85 HydrophobicContact CE1-CG2 3.69Å; Y81-V85 HydrophobicContact CE2-CG2 3.92Å; Y81-V85 HydrophobicContact CG-CG2 4.43Å; Y81-V85 WeakPolarHBondContact O-CG2 3.34Å; Y81-V85 PolarHBondContact O-N 3.22Å; V82-V85 PolarHBondContact O-N 3.15Å; V85-R87 PolarHBondContact O-N 2.89Å; V85-E88 PolarHBondContact O-N 3.42Å; V85-A89 WeakPolarHBondContact O-CB 3.05Å; V85-A89 PolarHBondContact O-N 2.95Å
86	S	88.6	Confident	87.8	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-59.5	-36	177.4	-170.8	0	0	0	0	112.1	Y41 V82 A83 H84 C90 I91	Y41-S86 PolarHBondContact OH-OG 3.48Å; V82-S86 VanDerWaalsContact O-CB 3.27Å; V82-S86 WeakPolarHBondContact O-CB 3.22Å; V82-S86 PolarHBondContact O-N 3.29Å; A83-S86 PolarHBondContact O-N 3.39Å; H84-S86 VanDerWaalsContact C-N 3.34Å; H84-S86 PolarHBondContact O-N 3.45Å; S86-C90 PolarHBondContact O-N 3.21Å; S86-I91 PolarHBondContact O-N 3.35Å; S86-I91 PolarHBondContact OG-O 3.01Å
87	R	84.1	Confident	88	Confident	114 Å²	114	71.3 Å²	71.3	43%	0.43	37%	0.374	S	S	.	.	H	α-helix	trans	-73.7	-51.4	175.6	-176.1	-170.6	169.6	-130.5	-1.5	111.3	E52 A83 H84 V85 A89 C90	E52-R87 WeakPolarHBondContact O-CD 3.39Å; E52-R87 IonicContact OE1-CZ 2.91Å; E52-R87 VanDerWaalsContact OE1-CZ 3.27Å; E52-R87 IonicContact OE1-NE 2.83Å; E52-R87 PolarHBondContact OE1-NE 2.96Å; E52-R87 IonicContact OE1-NH2 2.58Å; E52-R87 PolarHBondContact OE1-NH2 3.17Å; E52-R87 IonicContact OE2-CZ 2.93Å; E52-R87 IonicContact OE2-NE 3.05Å; E52-R87 PolarHBondContact OE2-NE 2.93Å; E52-R87 IonicContact OE2-NH1 3.85Å; E52-R87 IonicContact OE2-NH2 3.27Å; E52-R87 PolarHBondContact OE2-NH2 3.32Å; A83-R87 PolarHBondContact O-N 2.88Å; A83-R87 VanDerWaalsContact O-N 3.15Å; H84-R87 PolarHBondContact O-N 3.42Å; V85-R87 PolarHBondContact O-N 2.89Å; R87-A89 PolarHBondContact O-N 3.45Å; R87-C90 PolarHBondContact O-N 3.09Å
88	E	87.6	Confident	88.2	Confident	139 Å²	139	74.6 Å²	74.6	65%	0.65	39%	0.391	S	S	*	.	H	α-helix	trans	-59.4	-36.5	-176.8	-167.3	64.6	-165.9	0	0	112.4	H84 V85	H84-E88 WeakPolarHBondContact O-CB 3.44Å; H84-E88 PolarHBondContact O-N 3.21Å; V85-E88 PolarHBondContact O-N 3.42Å
89	A	88.8	Confident	88.4	Confident	62 Å²	62	71.4 Å²	71.4	51%	0.512	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	8.5	178.4	0	0	0	0	0	113.8	V85 R87 I91	V85-A89 WeakPolarHBondContact O-CB 3.05Å; V85-A89 PolarHBondContact O-N 2.95Å; R87-A89 PolarHBondContact O-N 3.45Å; A89-I91 HydrophobicContact CB-CD1 3.93Å; A89-I91 HydrophobicContact CB-CG1 3.73Å; A89-I91 PolarHBondContact O-N 2.99Å; A89-I91 VanDerWaalsContact O-N 3.16Å
90	C	84.1	Confident	88.6	Confident	114 Å²	114	68.1 Å²	68.1	77%	0.77	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	38	-179.4	-62.3	0	0	0	0	113.6	S86 R87 S92	S86-C90 PolarHBondContact O-N 3.21Å; R87-C90 PolarHBondContact O-N 3.09Å; C90-S92 PolarHBondContact O-N 2.95Å
91	I	86.2	Confident	88.9	Confident	49 Å²	49	63.1 Å²	63.1	25%	0.251	35%	0.354	S	S	.	.			trans	-79	115	-174.8	-55.4	177	0	0	0	109.2	Y41 S86 A89 A95 M96	Y41-I91 PolarHBondContact OH-O 3.34Å; S86-I91 PolarHBondContact O-N 3.35Å; S86-I91 PolarHBondContact OG-O 3.01Å; A89-I91 HydrophobicContact CB-CD1 3.93Å; A89-I91 HydrophobicContact CB-CG1 3.73Å; A89-I91 PolarHBondContact O-N 2.99Å; A89-I91 VanDerWaalsContact O-N 3.16Å; I91-A95 HydrophobicContact CG2-CB 4.19Å; I91-M96 HydrophobicContact CB-CE 4.32Å; I91-M96 HydrophobicContact CD1-CE 4.19Å; I91-M96 HydrophobicContact CG2-CB 4.07Å; I91-M96 HydrophobicContact CG2-CE 3.9Å
92	S	83.1	Confident	89.1	Confident	55 Å²	55	64 Å²	64	39%	0.385	36%	0.358	S	S	.	.			trans	-65.5	150.6	174.1	73.2	0	0	0	0	111.7	C90 C94 A95 M96	C90-S92 PolarHBondContact O-N 2.95Å; S92-C94 PolarHBondContact O-N 2.98Å; S92-C94 VanDerWaalsContact O-N 3.15Å; S92-A95 PolarHBondContact O-N 3.25Å; S92-A95 VanDerWaalsContact O-N 3.08Å; S92-A95 WeakPolarHBondContact OG-CB 3.24Å; S92-A95 PolarHBondContact OG-N 3.27Å; S92-A95 VanDerWaalsContact OG-N 3.1Å; S92-M96 PolarHBondContact O-N 2.82Å
93	P	82.1	Confident	89.3	Confident	15 Å²	15	65.2 Å²	65.2	10%	0.097	36%	0.364	C	S	.	.	H	α-helix	trans	-58	-31.9	175.5	-24.1	34.9	0	0	0	112.1	Y40 Y41 M97	Y40-P93 HydrophobicContact CD1-CG 4.34Å; Y41-P93 HydrophobicContact CD2-CG 4.17Å; Y41-P93 HydrophobicContact CE2-CG 3.92Å; P93-M97 WeakPolarHBondContact O-CB 3.39Å; P93-M97 VanDerWaalsContact O-CG 3.23Å; P93-M97 WeakPolarHBondContact O-CG 3.49Å; P93-M97 PolarHBondContact O-N 2.76Å
94	C	84.5	Confident	89.6	Confident	82 Å²	82	66.4 Å²	66.4	55%	0.554	37%	0.367	S	S	*	.	H	α-helix	trans	-63.4	-51	174.5	-175.1	0	0	0	0	111.8	S92 M96 M97 L98	S92-C94 PolarHBondContact O-N 2.98Å; S92-C94 VanDerWaalsContact O-N 3.15Å; C94-M96 VanDerWaalsContact C-N 3.32Å; C94-M96 PolarHBondContact O-N 2.98Å; C94-M97 PolarHBondContact O-N 3.37Å; C94-L98 WeakPolarHBondContact O-CG 3.43Å; C94-L98 PolarHBondContact O-N 2.92Å
95	A	89.9	Confident	89.9	Confident	43 Å²	43	69.1 Å²	69.1	36%	0.355	37%	0.373	S	S	.	.	H	α-helix	trans	-61.9	-40.4	177.5	0	0	0	0	0	111.8	I91 S92 L98 A99	I91-A95 HydrophobicContact CG2-CB 4.19Å; S92-A95 PolarHBondContact O-N 3.25Å; S92-A95 VanDerWaalsContact O-N 3.08Å; S92-A95 WeakPolarHBondContact OG-CB 3.24Å; S92-A95 PolarHBondContact OG-N 3.27Å; S92-A95 VanDerWaalsContact OG-N 3.1Å; A95-L98 PolarHBondContact O-N 3.31Å; A95-A99 WeakPolarHBondContact O-CB 3.23Å; A95-A99 PolarHBondContact O-N 3.41Å
96	M	91.3	Very high	90.2	Very high	19 Å²	19	68 Å²	68	9%	0.094	36%	0.364	C	S	.	.	H	α-helix	trans	-58.5	-51	174.3	-172.6	67.1	74.8	0	0	111.2	L54 V58 T62 I91 S92 C94 L98 A99 L100	L54-M96 HydrophobicContact CD2-CE 4.34Å; V58-M96 HydrophobicContact CG1-CG 4.1Å; T62-M96 HydrophobicContact CG2-SD 4.07Å; I91-M96 HydrophobicContact CB-CE 4.32Å; I91-M96 HydrophobicContact CD1-CE 4.19Å; I91-M96 HydrophobicContact CG2-CB 4.07Å; I91-M96 HydrophobicContact CG2-CE 3.9Å; S92-M96 PolarHBondContact O-N 2.82Å; C94-M96 VanDerWaalsContact C-N 3.32Å; C94-M96 PolarHBondContact O-N 2.98Å; M96-L98 VanDerWaalsContact C-N 3.32Å; M96-L98 PolarHBondContact O-N 2.95Å; M96-A99 WeakPolarHBondContact O-CB 3.48Å; M96-A99 PolarHBondContact O-N 3.49Å; M96-L100 HydrophobicContact CG-CD1 4.46Å; M96-L100 WeakPolarHBondContact O-CG 3.38Å; M96-L100 PolarHBondContact O-N 2.92Å
97	M	91.9	Very high	90.4	Very high	79 Å²	79	72.2 Å²	72.2	39%	0.389	38%	0.38	S	S	.	.	H	α-helix	trans	-61.1	-40.2	179	-70.9	-57.6	-62.3	0	0	112.4	I61 P93 C94 L100 V101	I61-M97 HydrophobicContact CD1-CE 4.08Å; I61-M97 HydrophobicContact CD1-SD 3.64Å; P93-M97 WeakPolarHBondContact O-CB 3.39Å; P93-M97 VanDerWaalsContact O-CG 3.23Å; P93-M97 WeakPolarHBondContact O-CG 3.49Å; P93-M97 PolarHBondContact O-N 2.76Å; C94-M97 PolarHBondContact O-N 3.37Å; M97-L100 PolarHBondContact O-N 3.45Å; M97-L100 HydrophobicContact SD-CD1 4.15Å; M97-V101 WeakPolarHBondContact O-CG2 3.24Å; M97-V101 PolarHBondContact O-N 2.71Å
98	L	94.6	Very high	90.8	Very high	116 Å²	116	72.9 Å²	72.9	61%	0.607	39%	0.388	S	S	*	.	H	α-helix	trans	-61.4	-44.2	174.5	-74.5	169.9	0	0	0	111.8	C94 A95 M96 L100 V101 Y102	C94-L98 WeakPolarHBondContact O-CG 3.43Å; C94-L98 PolarHBondContact O-N 2.92Å; A95-L98 PolarHBondContact O-N 3.31Å; M96-L98 VanDerWaalsContact C-N 3.32Å; M96-L98 PolarHBondContact O-N 2.95Å; L98-L100 PolarHBondContact O-N 2.79Å; L98-V101 PolarHBondContact O-N 2.73Å; L98-Y102 PolarHBondContact O-N 3.43Å
99	A	94.5	Very high	91.1	Very high	45 Å²	45	76 Å²	76	37%	0.372	39%	0.394	S	S	.	.	H	α-helix	trans	-61.2	-43.7	176.4	0	0	0	0	0	111.6	A95 M96 V101 Y102 I103	A95-A99 WeakPolarHBondContact O-CB 3.23Å; A95-A99 PolarHBondContact O-N 3.41Å; M96-A99 WeakPolarHBondContact O-CB 3.48Å; M96-A99 PolarHBondContact O-N 3.49Å; A99-V101 PolarHBondContact O-N 2.77Å; A99-Y102 WeakPolarHBondContact O-CB 3.29Å; A99-Y102 PolarHBondContact O-N 2.94Å; A99-Y102 VanDerWaalsContact O-N 3.14Å; A99-I103 WeakPolarHBondContact O-CG1 3.48Å; A99-I103 PolarHBondContact O-N 3.24Å
100	L	94.1	Very high	91.3	Very high	5 Å²	5	77.1 Å²	77.1	3%	0.026	39%	0.391	C	S	.	.	H	α-helix	trans	-61.2	-43.3	176.9	-66.6	174.9	0	0	0	112.5	I61 T62 L65 L66 M96 M97 L98 Y102 I103 E104	I61-L100 HydrophobicContact CD1-CD1 4.18Å; I61-L100 HydrophobicContact CG1-CD1 4.14Å; T62-L100 HydrophobicContact CG2-CD2 4.16Å; L65-L100 HydrophobicContact CB-CD2 4.14Å; L65-L100 HydrophobicContact CD1-CB 3.98Å; L65-L100 HydrophobicContact CD1-CD1 4.22Å; L65-L100 HydrophobicContact CD1-CD2 4.18Å; L65-L100 HydrophobicContact CD1-CG 4.35Å; L66-L100 HydrophobicContact CG-CD2 4.48Å; M96-L100 HydrophobicContact CG-CD1 4.46Å; M96-L100 WeakPolarHBondContact O-CG 3.38Å; M96-L100 PolarHBondContact O-N 2.92Å; M97-L100 PolarHBondContact O-N 3.45Å; M97-L100 HydrophobicContact SD-CD1 4.15Å; L98-L100 PolarHBondContact O-N 2.79Å; L100-Y102 VanDerWaalsContact C-N 3.29Å; L100-Y102 PolarHBondContact O-N 2.96Å; L100-I103 PolarHBondContact O-N 3.26Å; L100-E104 PolarHBondContact O-N 3.31Å
101	V	94.7	Very high	91.5	Very high	71 Å²	71	75.2 Å²	75.2	43%	0.43	38%	0.378	S	S	.	.	H	α-helix	trans	-61.5	-40.7	174.3	171.3	0	0	0	0	110.9	M97 L98 A99 R105	M97-V101 WeakPolarHBondContact O-CG2 3.24Å; M97-V101 PolarHBondContact O-N 2.71Å; L98-V101 PolarHBondContact O-N 2.73Å; A99-V101 PolarHBondContact O-N 2.77Å; V101-R105 WeakPolarHBondContact O-CG 3.29Å; V101-R105 PolarHBondContact O-N 3.41Å
102	Y	95.7	Very high	91.7	Very high	152 Å²	152	80.4 Å²	80.4	60%	0.596	41%	0.406	S	S	*	.	H	α-helix	trans	-65.8	-45.2	178.9	-170.5	-101.9	0	0	0	111.8	L98 A99 L100 E104 R105 L106	L98-Y102 PolarHBondContact O-N 3.43Å; A99-Y102 WeakPolarHBondContact O-CB 3.29Å; A99-Y102 PolarHBondContact O-N 2.94Å; A99-Y102 VanDerWaalsContact O-N 3.14Å; L100-Y102 VanDerWaalsContact C-N 3.29Å; L100-Y102 PolarHBondContact O-N 2.96Å; Y102-E104 PolarHBondContact O-N 3.15Å; Y102-R105 PolarHBondContact O-N 3.47Å; Y102-R105 VanDerWaalsContact O-N 3.15Å; Y102-L106 HydrophobicContact CE1-CD2 4.28Å; Y102-L106 WeakPolarHBondContact O-CB 3.38Å; Y102-L106 PolarHBondContact O-N 2.83Å
103	I	94.7	Very high	91.9	Very high	34 Å²	34	86.5 Å²	86.5	17%	0.174	42%	0.422	C	S	.	.	H	α-helix	trans	-60.9	-44.2	177.8	-71.8	172.2	0	0	0	111	L66 A69 A99 L100 R105 L106 R107 L114	L66-I103 HydrophobicContact CD2-CD1 3.41Å; L66-I103 VanDerWaalsContact CD2-CD1 3.41Å; A69-I103 HydrophobicContact CB-CG2 3.33Å; A99-I103 WeakPolarHBondContact O-CG1 3.48Å; A99-I103 PolarHBondContact O-N 3.24Å; L100-I103 PolarHBondContact O-N 3.26Å; I103-R105 VanDerWaalsContact C-N 3.33Å; I103-R105 PolarHBondContact O-N 2.71Å; I103-L106 PolarHBondContact O-N 2.94Å; I103-R107 WeakPolarHBondContact O-CB 3.21Å; I103-R107 PolarHBondContact O-N 3.48Å; I103-L114 HydrophobicContact CG2-CD2 4.33Å
104	E	94.1	Very high	92	Very high	38 Å²	38	90.4 Å²	90.4	18%	0.178	44%	0.441	C	S	.	.	H	α-helix	trans	-61.8	-41.1	174.9	-88.8	-62	145.7	0	0	112	L65 L100 Y102 L106 R107 H108	L65-E104 HydrophobicContact CD2-CG 3.84Å; L65-E104 WeakPolarHBondContact CD2-OE1 3.18Å; L100-E104 PolarHBondContact O-N 3.31Å; Y102-E104 PolarHBondContact O-N 3.15Å; E104-L106 VanDerWaalsContact C-N 3.34Å; E104-L106 PolarHBondContact O-N 2.83Å; E104-R107 IonicContact OE1-CZ 3.9Å; E104-R107 IonicContact OE1-NE 3.24Å; E104-R107 PolarHBondContact OE1-NE 2.79Å; E104-R107 IonicContact OE1-NH2 3.71Å; E104-R107 IonicContact OE2-CZ 3.38Å; E104-R107 IonicContact OE2-NE 3.11Å; E104-R107 PolarHBondContact OE2-NE 3.13Å; E104-R107 VanDerWaalsContact OE2-NE 3.11Å; E104-R107 IonicContact OE2-NH2 2.78Å; E104-R107 PolarHBondContact OE2-NH2 3.02Å; E104-H108 PolarHBondContact O-N 3.5Å; E104-H108 PolarHBondContact O-ND1 2.76Å; E104-H108 IonicContact OE2-CE1 3.17Å; E104-H108 PolarHBondContact OE2-CE1 2.91Å; E104-H108 IonicContact OE2-ND1 3.72Å
105	R	94.8	Very high	92.4	Very high	167 Å²	167	90.8 Å²	90.8	63%	0.63	44%	0.435	S	S	*	.	H	α-helix	trans	-64.9	-40.6	175.5	-72.2	176.2	-179.2	-166.6	1.9	111.9	V101 Y102 I103 H108 R109	V101-R105 WeakPolarHBondContact O-CG 3.29Å; V101-R105 PolarHBondContact O-N 3.41Å; Y102-R105 PolarHBondContact O-N 3.47Å; Y102-R105 VanDerWaalsContact O-N 3.15Å; I103-R105 VanDerWaalsContact C-N 3.33Å; I103-R105 PolarHBondContact O-N 2.71Å; R105-H108 PolarHBondContact O-N 3.38Å; R105-R109 PolarHBondContact O-N 2.83Å; R105-R109 VanDerWaalsContact O-N 3.09Å
106	L	94.4	Very high	92.5	Very high	29 Å²	29	93.3 Å²	93.3	15%	0.152	44%	0.44	C	S	.	.	H	α-helix	trans	-66	-43.1	-179.5	-166.8	63.4	0	0	0	110.9	Y102 I103 E104 H108 R109 N110 L114	Y102-L106 HydrophobicContact CE1-CD2 4.28Å; Y102-L106 WeakPolarHBondContact O-CB 3.38Å; Y102-L106 PolarHBondContact O-N 2.83Å; I103-L106 PolarHBondContact O-N 2.94Å; E104-L106 VanDerWaalsContact C-N 3.34Å; E104-L106 PolarHBondContact O-N 2.83Å; L106-H108 PolarHBondContact O-N 3.37Å; L106-R109 PolarHBondContact O-N 2.58Å; L106-R109 VanDerWaalsContact O-N 3.16Å; L106-N110 HydrophobicContact CD1-CB 4.14Å; L106-N110 CarbonylContact O-C 3.57Å; L106-N110 VanDerWaalsContact O-C 3.26Å; L106-N110 PolarHBondContact O-N 3.05Å; L106-L114 HydrophobicContact CB-CD1 4.4Å; L106-L114 HydrophobicContact CD2-CD2 4Å; L106-L114 HydrophobicContact CD2-CG 4Å; L106-L114 HydrophobicContact CG-CD1 4.46Å; L106-L114 HydrophobicContact CG-CG 4.27Å
107	R	93.1	Very high	92.6	Very high	89 Å²	89	97.4 Å²	97.4	34%	0.336	46%	0.459	S	S	.	.	H	α-helix	trans	-53.6	-38	175	-172.2	-179.3	71	78.3	1	113.2	I103 E104 L114	I103-R107 WeakPolarHBondContact O-CB 3.21Å; I103-R107 PolarHBondContact O-N 3.48Å; E104-R107 IonicContact OE1-CZ 3.9Å; E104-R107 IonicContact OE1-NE 3.24Å; E104-R107 PolarHBondContact OE1-NE 2.79Å; E104-R107 IonicContact OE1-NH2 3.71Å; E104-R107 IonicContact OE2-CZ 3.38Å; E104-R107 IonicContact OE2-NE 3.11Å; E104-R107 PolarHBondContact OE2-NE 3.13Å; E104-R107 VanDerWaalsContact OE2-NE 3.11Å; E104-R107 IonicContact OE2-NH2 2.78Å; E104-R107 PolarHBondContact OE2-NH2 3.02Å; R107-L114 HydrophobicContact CB-CD1 3.81Å; R107-L114 HydrophobicContact CG-CD1 4.44Å
108	H	92.1	Very high	92.6	Very high	128 Å²	128	98.5 Å²	98.5	59%	0.593	46%	0.463	S	S	*	.	H	α-helix	trans	-85	-30.5	179.8	-66.2	98.7	0	0	0	113.9	E104 R105 L106	E104-H108 PolarHBondContact O-N 3.5Å; E104-H108 PolarHBondContact O-ND1 2.76Å; E104-H108 IonicContact OE2-CE1 3.17Å; E104-H108 PolarHBondContact OE2-CE1 2.91Å; E104-H108 IonicContact OE2-ND1 3.72Å; R105-H108 PolarHBondContact O-N 3.38Å; L106-H108 PolarHBondContact O-N 3.37Å
109	R	93.8	Very high	92.5	Very high	204 Å²	204	97.4 Å²	97.4	77%	0.77	45%	0.454	S	S	*	.	H	α-helix	trans	-95.1	-49.4	-173.1	-68.9	-170.5	177.9	-163.6	-1.1	112.8	R105 L106	R105-R109 PolarHBondContact O-N 2.83Å; R105-R109 VanDerWaalsContact O-N 3.09Å; L106-R109 PolarHBondContact O-N 2.58Å; L106-R109 VanDerWaalsContact O-N 3.16Å
110	N	93.4	Very high	92.4	Very high	85 Å²	85	100.9 Å²	100.9	46%	0.455	46%	0.459	S	S	.	.			trans	-140.6	80.5	-174.4	-59.7	-21.9	0	0	0	109.9	L106 D112 Y113	L106-N110 HydrophobicContact CD1-CB 4.14Å; L106-N110 CarbonylContact O-C 3.57Å; L106-N110 VanDerWaalsContact O-C 3.26Å; L106-N110 PolarHBondContact O-N 3.05Å; N110-D112 VanDerWaalsContact C-N 3.26Å; N110-D112 PolarHBondContact O-N 3.44Å; N110-Y113 HydrophobicContact CB-CD2 3.69Å; N110-Y113 HydrophobicContact CB-CE2 4.08Å; N110-Y113 PolarHBondContact O-N 2.9Å
111	P	88.4	Confident	92.3	Very high	75 Å²	75	107.8 Å²	107.8	49%	0.487	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-67.1	-23.2	-175.2	27.4	-35.1	0	0	0	113.8	Y113 L114	P111-Y113 PolarHBondContact O-N 3.17Å; P111-L114 PolarHBondContact O-N 2.68Å; P111-L114 VanDerWaalsContact O-N 3.08Å
112	D	90	Very high	92.1	Very high	157 Å²	157	110.6 Å²	110.6	84%	0.84	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-64.8	-10.8	-179	-57.2	-31.3	0	0	0	114.2	N110	N110-D112 VanDerWaalsContact C-N 3.26Å; N110-D112 PolarHBondContact O-N 3.44Å
113	Y	88.3	Confident	91.8	Very high	184 Å²	184	107.2 Å²	107.2	72%	0.722	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-89	-5	176.1	-76.2	-92.4	0	0	0	114	N110 P111	N110-Y113 HydrophobicContact CB-CD2 3.69Å; N110-Y113 HydrophobicContact CB-CE2 4.08Å; N110-Y113 PolarHBondContact O-N 2.9Å; P111-Y113 PolarHBondContact O-N 3.17Å
114	L	84.2	Confident	91.5	Very high	96 Å²	96	113.8 Å²	113.8	50%	0.503	52%	0.515	S	S	.	.			trans	-111	0	-177.9	-71.4	171.7	0	0	0	111.2	A69 I103 L106 R107 P111	A69-L114 HydrophobicContact CB-CD1 4.18Å; I103-L114 HydrophobicContact CG2-CD2 4.33Å; L106-L114 HydrophobicContact CB-CD1 4.4Å; L106-L114 HydrophobicContact CD2-CD2 4Å; L106-L114 HydrophobicContact CD2-CG 4Å; L106-L114 HydrophobicContact CG-CD1 4.46Å; L106-L114 HydrophobicContact CG-CG 4.27Å; R107-L114 HydrophobicContact CB-CD1 3.81Å; R107-L114 HydrophobicContact CG-CD1 4.44Å; P111-L114 PolarHBondContact O-N 2.68Å; P111-L114 VanDerWaalsContact O-N 3.08Å

Retrieved 114 of 114 residues in 385.6 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).