A0A087WSI6_MOUSE Loading...

Protein CNPPD1

AlphaFold DB , UniProt , Accession A0A087WSI6, Species MOUSE (Mus musculus, Mouse), Gene Cnppd1, Length 170 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.7	Very low	47	Very low	234 Å²	234	138.5 Å²	138.5	100%	1.153	74%	0.744	S	S	*	*				0	114.7	0	-74.3	-175	166.8	0	0	105.9
2	D	37.1	Very low	47.6	Very low	140 Å²	140	131.5 Å²	131.5	75%	0.749	73%	0.729	S	S	*	*			trans	-78.1	118.2	-168.2	-141.7	-27.1	0	0	0	109.2	T4	D2-T4 VanDerWaalsContact CG-OG1 3.24Å; D2-T4 PolarHBondContact O-N 3.43Å; D2-T4 PolarHBondContact OD1-OG1 3.12Å
3	L	41.8	Very low	47.9	Very low	148 Å²	148	126.2 Å²	126.2	78%	0.775	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-82.9	4.8	-175.4	-115.4	87.3	0	0	0	113.1	G5	L3-G5 VanDerWaalsContact C-N 3.33Å; L3-G5 PolarHBondContact O-N 3.11Å
4	T	44.7	Very low	47.9	Very low	99 Å²	99	127.8 Å²	127.8	61%	0.607	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-77.8	-12.9	-172.2	37.4	0	0	0	0	114	D2	D2-T4 VanDerWaalsContact CG-OG1 3.24Å; D2-T4 PolarHBondContact O-N 3.43Å; D2-T4 PolarHBondContact OD1-OG1 3.12Å
5	G	43.4	Very low	48	Very low	76 Å²	76	121.5 Å²	121.5	78%	0.784	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-92.1	5	-174.8	0	0	0	0	0	117.1	L3	L3-G5 VanDerWaalsContact C-N 3.33Å; L3-G5 PolarHBondContact O-N 3.11Å
6	L	47.4	Very low	48.2	Very low	164 Å²	164	121.6 Å²	121.6	86%	0.859	68%	0.675	S	S	*	*	S	Bend	trans	-121.1	8.1	-168.8	-109.2	145.9	0	0	0	115.3
7	L	48.1	Very low	48.5	Very low	78 Å²	78	120.1 Å²	120.1	41%	0.408	67%	0.67	S	S	.	*	S	Bend	trans	-136.7	7.2	-168.4	-87.6	164.5	0	0	0	116.4	F14 F19	L7-F14 HydrophobicContact CB-CD1 4.18Å; L7-F14 HydrophobicContact CB-CE1 4.07Å; L7-F19 HydrophobicContact CD2-CE2 4.1Å
8	L	45.8	Very low	48.4	Very low	101 Å²	101	116.9 Å²	116.9	53%	0.529	67%	0.668	S	S	.	*	B	Isolated β-bridge	trans	-115.8	129.9	-179.2	-65.5	172.1	0	0	0	110.5	F14	L8-F14 HydrophobicContact CD2-CD2 4.33Å; L8-F14 HydrophobicContact CD2-CE2 4.33Å; L8-F14 HydrophobicContact CD2-CG 4.44Å; L8-F14 HydrophobicContact CD2-CZ 4.46Å
9	D	55.3	Low	48.5	Very low	93 Å²	93	116.4 Å²	116.4	50%	0.497	66%	0.658	S	S	.	*			trans	-74.1	165.7	167.6	-121.5	-34.7	0	0	0	110.3	E11 G12 A13 S15	D9-E11 PolarHBondContact O-N 2.63Å; D9-G12 PolarHBondContact O-N 3.44Å; D9-A13 PolarHBondContact N-O 2.72Å; D9-S15 WeakPolarHBondContact OD2-CB 3.05Å; D9-S15 PolarHBondContact OD2-OG 3.05Å
10	E	56.6	Low	48.6	Very low	200 Å²	200	118.7 Å²	118.7	94%	0.935	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-14.7	-175.8	-67.9	-79.5	132.4	0	0	114.4
11	E	57	Low	48.5	Very low	190 Å²	190	119.9 Å²	119.9	89%	0.888	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	6.5	175.1	-65.9	-168.9	160.2	0	0	114.6	D9 A13	D9-E11 PolarHBondContact O-N 2.63Å; E11-A13 VanDerWaalsContact C-N 3.29Å; E11-A13 PolarHBondContact O-N 3.1Å
12	G	54.3	Low	49.3	Very low	55 Å²	55	115.9 Å²	115.9	57%	0.567	64%	0.644	S	S	*	*	S	Bend	trans	75.2	12.5	176.2	0	0	0	0	0	115.2	D9	D9-G12 PolarHBondContact O-N 3.44Å
13	A	50.9	Low	50.3	Low	62 Å²	62	117.3 Å²	117.3	51%	0.512	65%	0.648	S	S	.	*	S	Bend	trans	-92.3	144.5	169.4	0	0	0	0	0	111.1	D9 E11 S15	D9-A13 PolarHBondContact N-O 2.72Å; E11-A13 VanDerWaalsContact C-N 3.29Å; E11-A13 PolarHBondContact O-N 3.1Å; A13-S15 PolarHBondContact O-N 3.48Å
14	F	47.9	Very low	51.3	Low	149 Å²	149	113.7 Å²	113.7	65%	0.654	63%	0.632	S	S	*	*	B	Isolated β-bridge	trans	-66.4	112.4	173.1	-82.3	-86.1	0	0	0	109.9	L7 L8 L16	L7-F14 HydrophobicContact CB-CD1 4.18Å; L7-F14 HydrophobicContact CB-CE1 4.07Å; L8-F14 HydrophobicContact CD2-CD2 4.33Å; L8-F14 HydrophobicContact CD2-CE2 4.33Å; L8-F14 HydrophobicContact CD2-CG 4.44Å; L8-F14 HydrophobicContact CD2-CZ 4.46Å; F14-L16 PolarHBondContact O-N 2.76Å
15	S	49.6	Very low	52.7	Low	33 Å²	33	115.2 Å²	115.2	23%	0.231	64%	0.636	C	S	.	*			trans	-76.8	104	177.1	-155.6	0	0	0	0	109.7	D9 A13 T17	D9-S15 WeakPolarHBondContact OD2-CB 3.05Å; D9-S15 PolarHBondContact OD2-OG 3.05Å; A13-S15 PolarHBondContact O-N 3.48Å; S15-T17 PolarHBondContact O-N 3.29Å; S15-T17 PolarHBondContact OG-OG1 2.85Å
16	L	52.2	Low	54.2	Low	124 Å²	124	115.9 Å²	115.9	65%	0.649	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-76.5	0.3	174.7	-82.6	164.2	0	0	0	113.1	F14 G18 F19	F14-L16 PolarHBondContact O-N 2.76Å; L16-G18 VanDerWaalsContact C-N 3.26Å; L16-G18 PolarHBondContact O-N 3.34Å; L16-F19 HydrophobicContact CD2-CB 4.26Å; L16-F19 HydrophobicContact CD2-CD2 3.96Å; L16-F19 HydrophobicContact CD2-CG 4.11Å; L16-F19 PolarHBondContact O-N 3.11Å
17	T	52	Low	55.8	Low	96 Å²	96	110.5 Å²	110.5	59%	0.589	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-60	-33.9	179	53.9	0	0	0	0	112.2	S15 F19 Q20	S15-T17 PolarHBondContact O-N 3.29Å; S15-T17 PolarHBondContact OG-OG1 2.85Å; T17-F19 VanDerWaalsContact C-N 3.29Å; T17-F19 PolarHBondContact O-N 3.5Å; T17-Q20 PolarHBondContact O-N 2.93Å
18	G	47.4	Very low	57.5	Low	62 Å²	62	112.1 Å²	112.1	64%	0.639	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-74.1	-9.9	175.1	0	0	0	0	0	115.6	L16	L16-G18 VanDerWaalsContact C-N 3.26Å; L16-G18 PolarHBondContact O-N 3.34Å
19	F	49.9	Very low	59.1	Low	108 Å²	108	112.7 Å²	112.7	47%	0.474	62%	0.616	S	S	.	*	G	3₁₀ helix	trans	-93.3	-9.2	177.4	-75.4	-101.2	0	0	0	112.9	L7 L16 T17 D21 F22	L7-F19 HydrophobicContact CD2-CE2 4.1Å; L16-F19 HydrophobicContact CD2-CB 4.26Å; L16-F19 HydrophobicContact CD2-CD2 3.96Å; L16-F19 HydrophobicContact CD2-CG 4.11Å; L16-F19 PolarHBondContact O-N 3.11Å; T17-F19 VanDerWaalsContact C-N 3.29Å; T17-F19 PolarHBondContact O-N 3.5Å; F19-D21 PolarHBondContact O-N 3.32Å; F19-F22 HydrophobicContact CB-CE2 4.49Å; F19-F22 HydrophobicContact CD1-CD2 4.22Å; F19-F22 AromaticContact CD1-CE2 3.44Å; F19-F22 HydrophobicContact CD1-CE2 3.44Å; F19-F22 VanDerWaalsContact CD1-CE2 3.44Å; F19-F22 HydrophobicContact CD1-CZ 4.38Å; F19-F22 AromaticContact CE1-CE2 3.91Å; F19-F22 HydrophobicContact CE1-CE2 3.91Å; F19-F22 HydrophobicContact CE1-CZ 4.44Å; F19-F22 HydrophobicContact CG-CE2 4.24Å
20	Q	50.5	Low	60.5	Low	162 Å²	162	115.8 Å²	115.8	76%	0.757	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-19.8	178.3	-80.2	173.2	-23.4	0	0	113	T17	T17-Q20 PolarHBondContact O-N 2.93Å
21	D	47.7	Very low	61.8	Low	144 Å²	144	109.8 Å²	109.8	77%	0.77	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	37.9	-180	-75.7	-20.7	0	0	0	113.5	F19 M23	F19-D21 PolarHBondContact O-N 3.32Å; D21-M23 PolarHBondContact O-N 3.12Å
22	F	56.1	Low	63.1	Low	150 Å²	150	103 Å²	103	66%	0.658	57%	0.573	S	S	*	*			trans	-67.4	84.2	153.3	-83.7	-80	0	0	0	107.6	F19 V24	F19-F22 HydrophobicContact CB-CE2 4.49Å; F19-F22 HydrophobicContact CD1-CD2 4.22Å; F19-F22 AromaticContact CD1-CE2 3.44Å; F19-F22 HydrophobicContact CD1-CE2 3.44Å; F19-F22 VanDerWaalsContact CD1-CE2 3.44Å; F19-F22 HydrophobicContact CD1-CZ 4.38Å; F19-F22 AromaticContact CE1-CE2 3.91Å; F19-F22 HydrophobicContact CE1-CE2 3.91Å; F19-F22 HydrophobicContact CE1-CZ 4.44Å; F19-F22 HydrophobicContact CG-CE2 4.24Å; F22-V24 VanDerWaalsContact C-N 3.3Å; F22-V24 PolarHBondContact O-N 3.34Å
23	M	56.9	Low	64.4	Low	169 Å²	169	102.6 Å²	102.6	83%	0.833	56%	0.564	S	S	*	*			trans	-45.9	102.9	161.5	-81.2	-111	-69.4	0	0	106.5	D21 L25	D21-M23 PolarHBondContact O-N 3.12Å; M23-L25 VanDerWaalsContact C-N 3.31Å; M23-L25 PolarHBondContact O-N 3.17Å
24	V	62.7	Low	65.9	Low	73 Å²	73	109.1 Å²	109.1	44%	0.442	58%	0.575	S	S	.	*			trans	-60.5	103	-178.6	-175.2	0	0	0	0	105.4	F22 H28 Q29	F22-V24 VanDerWaalsContact C-N 3.3Å; F22-V24 PolarHBondContact O-N 3.34Å; V24-H28 HydrophobicContact CG1-CB 4.24Å; V24-Q29 HydrophobicContact CB-CG 3.96Å; V24-Q29 HydrophobicContact CG1-CG 3.42Å; V24-Q29 VanDerWaalsContact CG1-CG 3.42Å; V24-Q29 PolarHBondContact O-NE2 2.97Å
25	L	74.5	Confident	67.7	Low	131 Å²	131	107.3 Å²	107.3	69%	0.686	57%	0.571	S	S	*	*			trans	-45.9	130.3	-174.3	-80.1	144.1	0	0	0	107.9	M23 G27 H28 Q29	M23-L25 VanDerWaalsContact C-N 3.31Å; M23-L25 PolarHBondContact O-N 3.17Å; L25-G27 CarbonylContact O-C 3.59Å; L25-G27 PolarHBondContact O-N 3.29Å; L25-H28 HydrophobicContact CB-CB 4.22Å; L25-H28 WeakPolarHBondContact O-CA 3.22Å; L25-H28 VanDerWaalsContact O-CB 3.3Å; L25-H28 WeakPolarHBondContact O-CB 3.4Å; L25-H28 PolarHBondContact O-N 3.29Å; L25-Q29 PolarHBondContact O-N 2.88Å; L25-Q29 VanDerWaalsContact O-N 3.13Å
26	P	76.2	Confident	69.2	Low	89 Å²	89	112.3 Å²	112.3	58%	0.578	59%	0.585	S	S	*	*	H	α-helix	trans	-53.6	-29.5	-176.9	-29.6	34.5	0	0	0	113.1	K30	P26-K30 WeakPolarHBondContact O-CG 3.45Å; P26-K30 PolarHBondContact O-N 3.39Å; P26-K30 VanDerWaalsContact O-N 3.15Å
27	G	80.1	Confident	70.7	Confident	52 Å²	52	117.5 Å²	117.5	54%	0.536	60%	0.596	S	S	.	*	H	α-helix	trans	-65.6	-38.9	171.2	0	0	0	0	0	114.1	L25 L31	L25-G27 CarbonylContact O-C 3.59Å; L25-G27 PolarHBondContact O-N 3.29Å; G27-L31 WeakPolarHBondContact O-CB 3.46Å; G27-L31 PolarHBondContact O-N 3.34Å
28	H	82.9	Confident	71.9	Confident	111 Å²	111	117.9 Å²	117.9	51%	0.514	59%	0.587	S	S	.	*	H	α-helix	trans	-65.7	-43.2	174.5	-174.3	84.5	0	0	0	111.4	V24 L25 K30 L31 S32	V24-H28 HydrophobicContact CG1-CB 4.24Å; L25-H28 HydrophobicContact CB-CB 4.22Å; L25-H28 WeakPolarHBondContact O-CA 3.22Å; L25-H28 VanDerWaalsContact O-CB 3.3Å; L25-H28 WeakPolarHBondContact O-CB 3.4Å; L25-H28 PolarHBondContact O-N 3.29Å; H28-K30 PolarHBondContact O-N 3.36Å; H28-L31 PolarHBondContact O-N 3.16Å; H28-S32 VanDerWaalsContact O-CB 3.22Å; H28-S32 WeakPolarHBondContact O-CB 3.33Å; H28-S32 PolarHBondContact O-N 3.31Å
29	Q	81.2	Confident	73.6	Confident	113 Å²	113	118.3 Å²	118.3	53%	0.528	57%	0.574	S	S	.	*	H	α-helix	trans	-59.5	-47.2	175.9	-63.2	-177	-6.4	0	0	111.7	V24 L25 L31 S32 A33	V24-Q29 HydrophobicContact CB-CG 3.96Å; V24-Q29 HydrophobicContact CG1-CG 3.42Å; V24-Q29 VanDerWaalsContact CG1-CG 3.42Å; V24-Q29 PolarHBondContact O-NE2 2.97Å; L25-Q29 PolarHBondContact O-N 2.88Å; L25-Q29 VanDerWaalsContact O-N 3.13Å; Q29-L31 PolarHBondContact O-N 3.22Å; Q29-S32 PolarHBondContact O-N 3.01Å; Q29-A33 WeakPolarHBondContact O-CB 3.41Å; Q29-A33 PolarHBondContact O-N 2.81Å
30	K	84	Confident	75.2	Confident	158 Å²	158	122.1 Å²	122.1	69%	0.687	59%	0.587	S	S	*	*	H	α-helix	trans	-62	-43.5	177.2	-73	176.5	-178.1	-178.6	0	112.4	P26 H28 R34	P26-K30 WeakPolarHBondContact O-CG 3.45Å; P26-K30 PolarHBondContact O-N 3.39Å; P26-K30 VanDerWaalsContact O-N 3.15Å; H28-K30 PolarHBondContact O-N 3.36Å; K30-R34 WeakPolarHBondContact O-CB 3.27Å; K30-R34 PolarHBondContact O-N 3.25Å; K30-R34 VanDerWaalsContact O-N 3.16Å
31	L	83.7	Confident	76.7	Confident	75 Å²	75	115.4 Å²	115.4	39%	0.393	56%	0.555	S	S	.	*	H	α-helix	trans	-63.9	-48.6	177	179.7	62	0	0	0	110.7	G27 H28 Q29 A33 R34 I35	G27-L31 WeakPolarHBondContact O-CB 3.46Å; G27-L31 PolarHBondContact O-N 3.34Å; H28-L31 PolarHBondContact O-N 3.16Å; Q29-L31 PolarHBondContact O-N 3.22Å; L31-A33 VanDerWaalsContact C-N 3.34Å; L31-A33 PolarHBondContact O-N 3.07Å; L31-R34 WeakPolarHBondContact O-CB 3.37Å; L31-R34 PolarHBondContact O-N 3.23Å; L31-R34 VanDerWaalsContact O-N 3.08Å; L31-I35 HydrophobicContact CD1-CG2 3.87Å; L31-I35 HydrophobicContact CG-CD1 4.44Å; L31-I35 HydrophobicContact CG-CG2 4.41Å; L31-I35 WeakPolarHBondContact O-CG1 3.24Å; L31-I35 PolarHBondContact O-N 3.02Å
32	S	83.5	Confident	77.8	Confident	47 Å²	47	111.1 Å²	111.1	33%	0.329	54%	0.544	S	S	.	.	H	α-helix	trans	-59.1	-44.1	-179.8	-155.5	0	0	0	0	111.3	H28 Q29 R34 I35 R36	H28-S32 VanDerWaalsContact O-CB 3.22Å; H28-S32 WeakPolarHBondContact O-CB 3.33Å; H28-S32 PolarHBondContact O-N 3.31Å; Q29-S32 PolarHBondContact O-N 3.01Å; S32-R34 VanDerWaalsContact C-N 3.29Å; S32-R34 PolarHBondContact O-N 3.3Å; S32-I35 PolarHBondContact O-N 3.25Å; S32-R36 VanDerWaalsContact O-CB 3.3Å; S32-R36 WeakPolarHBondContact O-CB 3.32Å; S32-R36 PolarHBondContact O-N 3.17Å
33	A	81.7	Confident	78.3	Confident	47 Å²	47	108.5 Å²	108.5	39%	0.388	53%	0.53	S	S	.	.	H	α-helix	trans	-62.5	-32.9	175.3	0	0	0	0	0	113.7	Q29 L31 R38	Q29-A33 WeakPolarHBondContact O-CB 3.41Å; Q29-A33 PolarHBondContact O-N 2.81Å; L31-A33 VanDerWaalsContact C-N 3.34Å; L31-A33 PolarHBondContact O-N 3.07Å; A33-R38 PolarHBondContact O-NH2 3.24Å
34	R	82.4	Confident	78.4	Confident	198 Å²	198	106 Å²	106	75%	0.747	52%	0.52	S	S	*	.	H	α-helix	trans	-78.4	-37.9	178.8	-172.6	177.4	67	177.3	0.9	112.8	K30 L31 S32	K30-R34 WeakPolarHBondContact O-CB 3.27Å; K30-R34 PolarHBondContact O-N 3.25Å; K30-R34 VanDerWaalsContact O-N 3.16Å; L31-R34 WeakPolarHBondContact O-CB 3.37Å; L31-R34 PolarHBondContact O-N 3.23Å; L31-R34 VanDerWaalsContact O-N 3.08Å; S32-R34 VanDerWaalsContact C-N 3.29Å; S32-R34 PolarHBondContact O-N 3.3Å
35	I	85.8	Confident	77.9	Confident	111 Å²	111	109.9 Å²	109.9	57%	0.569	54%	0.537	S	S	*	.	H	α-helix	trans	-88.9	-12.6	-179.1	70.1	-180	0	0	0	113.1	L31 S32 R37	L31-I35 HydrophobicContact CD1-CG2 3.87Å; L31-I35 HydrophobicContact CG-CD1 4.44Å; L31-I35 HydrophobicContact CG-CG2 4.41Å; L31-I35 WeakPolarHBondContact O-CG1 3.24Å; L31-I35 PolarHBondContact O-N 3.02Å; S32-I35 PolarHBondContact O-N 3.25Å; I35-R37 PolarHBondContact O-N 3.43Å; I35-R37 VanDerWaalsContact O-N 3.12Å
36	R	82.7	Confident	77	Confident	138 Å²	138	113 Å²	113	52%	0.521	55%	0.548	S	S	.	.			trans	-54.1	119.6	177.7	179.4	175.9	-76.6	-178.2	-6.1	109.1	S32 R38	S32-R36 VanDerWaalsContact O-CB 3.3Å; S32-R36 WeakPolarHBondContact O-CB 3.32Å; S32-R36 PolarHBondContact O-N 3.17Å; R36-R38 PolarHBondContact O-N 3.39Å
37	R	82.1	Confident	75.8	Confident	233 Å²	233	113 Å²	113	88%	0.879	55%	0.547	S	S	*	.			trans	-67.5	117.1	173.5	-66.1	-175.2	-179.5	-177.9	0.8	108	I35	I35-R37 PolarHBondContact O-N 3.43Å; I35-R37 VanDerWaalsContact O-N 3.12Å
38	R	78.1	Confident	74.4	Confident	105 Å²	105	118.3 Å²	118.3	40%	0.396	56%	0.563	S	S	.	*			trans	-98.5	-7.3	-179.8	-61.6	-178.8	-171.5	-164.6	-3	113.1	A33 R36 Y40 Y41 W43	A33-R38 PolarHBondContact O-NH2 3.24Å; R36-R38 PolarHBondContact O-N 3.39Å; R38-Y40 PolarHBondContact O-N 2.97Å; R38-Y41 WeakPolarHBondContact O-CB 3.36Å; R38-Y41 WeakPolarHBondContact O-CD2 3.47Å; R38-Y41 PolarHBondContact O-N 3.47Å; R38-W43 VanDerWaalsContact NH1-CB 3.34Å
39	L	82.5	Confident	73	Confident	71 Å²	71	115.7 Å²	115.7	37%	0.372	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	46.2	35.1	-175.9	-59.5	175.6	0	0	0	112.6	Y41 S55 V58 M97	L39-Y41 HydrophobicContact CB-CD2 3.92Å; L39-Y41 HydrophobicContact CB-CE2 4.02Å; L39-Y41 PolarHBondContact O-N 3.47Å; L39-Y41 VanDerWaalsContact O-N 3.15Å; L39-S55 WeakPolarHBondContact O-CB 3.42Å; L39-S55 PolarHBondContact O-OG 2.85Å; L39-S55 VanDerWaalsContact O-OG 3.12Å; L39-V58 HydrophobicContact CB-CG2 3.85Å; L39-V58 WeakPolarHBondContact O-CG2 3.42Å; L39-M97 HydrophobicContact CD1-CG 4.36Å; L39-M97 HydrophobicContact CD1-SD 4.05Å
40	Y	84.4	Confident	71.8	Confident	188 Å²	188	113.3 Å²	113.3	74%	0.737	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.5	22.3	-175.8	-59.7	-92.8	0	0	0	115.4	R38 S55 P57	R38-Y40 PolarHBondContact O-N 2.97Å; Y40-S55 WeakPolarHBondContact CB-OG 3.3Å; Y40-S55 WeakPolarHBondContact O-CB 3.5Å; Y40-S55 PolarHBondContact O-OG 3.47Å; Y40-P57 HydrophobicContact CD1-CG 4.23Å; Y40-P57 HydrophobicContact CD2-CB 3.85Å; Y40-P57 HydrophobicContact CD2-CG 4.07Å; Y40-P57 HydrophobicContact CE2-CB 4.37Å; Y40-P57 HydrophobicContact CG-CB 4.13Å; Y40-P57 HydrophobicContact CG-CG 3.83Å
41	Y	81.1	Confident	70.7	Confident	21 Å²	21	109.7 Å²	109.7	8%	0.082	54%	0.54	C	S	.	.			trans	-72.5	143.4	162.8	-71.4	-88.1	0	0	0	109.5	R38 L39 L51 E53 L54 V58 P93	R38-Y41 WeakPolarHBondContact O-CB 3.36Å; R38-Y41 WeakPolarHBondContact O-CD2 3.47Å; R38-Y41 PolarHBondContact O-N 3.47Å; L39-Y41 HydrophobicContact CB-CD2 3.92Å; L39-Y41 HydrophobicContact CB-CE2 4.02Å; L39-Y41 PolarHBondContact O-N 3.47Å; L39-Y41 VanDerWaalsContact O-N 3.15Å; Y41-L51 HydrophobicContact CD1-CD2 3.94Å; Y41-L51 HydrophobicContact CE1-CD2 4.44Å; Y41-L51 HydrophobicContact CG-CD2 4.07Å; Y41-E53 WeakPolarHBondContact CD1-O 3.47Å; Y41-E53 WeakPolarHBondContact CE1-O 3.43Å; Y41-L54 VanDerWaalsContact OH-CD1 3.28Å; Y41-L54 WeakPolarHBondContact OH-CD1 3.43Å; Y41-V58 HydrophobicContact CE2-CG2 4.19Å; Y41-P93 HydrophobicContact CD2-CG 4.37Å; Y41-P93 HydrophobicContact CE1-CG 4.09Å; Y41-P93 HydrophobicContact CE2-CB 3.93Å; Y41-P93 HydrophobicContact CE2-CG 3.85Å
42	G	71.6	Confident	69.7	Low	54 Å²	54	114 Å²	114	56%	0.557	56%	0.558	S	S	*	*			trans	-58.5	136.8	173.9	0	0	0	0	0	110.1
43	W	65.6	Low	69.2	Low	95 Å²	95	119 Å²	119	36%	0.36	58%	0.576	S	S	.	*			trans	-123.8	87.3	172	-176.7	-77.8	0	0	0	106.2	R38	R38-W43 VanDerWaalsContact NH1-CB 3.34Å
44	D	59.2	Low	69.4	Low	116 Å²	116	118.3 Å²	118.3	62%	0.62	57%	0.566	S	S	*	*			trans	-85.1	131.5	162.4	-80.2	-22.4	0	0	0	107.8	E46 T47	D44-E46 VanDerWaalsContact C-N 3.26Å; D44-T47 VanDerWaalsContact CB-OG1 3.29Å; D44-T47 WeakPolarHBondContact CB-OG1 3.31Å; D44-T47 VanDerWaalsContact O-O 3.07Å
45	L	53.7	Low	69.7	Low	154 Å²	154	109.3 Å²	109.3	81%	0.806	53%	0.534	S	S	*	.	S	Bend	trans	-81.6	-11.4	-177	-163.9	70.9	0	0	0	111.6
46	E	54.2	Low	69.8	Low	196 Å²	196	106.9 Å²	106.9	92%	0.916	53%	0.527	S	S	*	.	S	Bend	trans	-108.3	-23	-172.1	-62.2	-172.6	172.3	0	0	113.4	D44	D44-E46 VanDerWaalsContact C-N 3.26Å
47	T	51.3	Low	70.3	Confident	89 Å²	89	102.4 Å²	102.4	55%	0.546	52%	0.516	S	S	.	.	S	Bend	trans	-115.6	130	173.6	29.4	0	0	0	0	107.8	D44 C49	D44-T47 VanDerWaalsContact CB-OG1 3.29Å; D44-T47 WeakPolarHBondContact CB-OG1 3.31Å; D44-T47 VanDerWaalsContact O-O 3.07Å; T47-C49 PolarHBondContact O-N 3.44Å
48	D	51.6	Low	70.7	Confident	164 Å²	164	92.1 Å²	92.1	88%	0.877	48%	0.478	S	S	*	.			trans	-43.7	133.2	173.1	-71.6	-48.7	0	0	0	109.9	S50	D48-S50 PolarHBondContact O-N 3.15Å
49	C	52.9	Low	71.5	Confident	56 Å²	56	87.2 Å²	87.2	38%	0.378	46%	0.46	S	S	.	.			trans	-37.3	114	-170.6	-60	0	0	0	0	111.1	T47 L51	T47-C49 PolarHBondContact O-N 3.44Å; C49-L51 HydrophobicContact CB-CD1 4.36Å; C49-L51 HydrophobicContact CB-CG 3.99Å; C49-L51 PolarHBondContact O-N 2.75Å
50	S	55.6	Low	72	Confident	63 Å²	63	87.3 Å²	87.3	44%	0.441	46%	0.461	S	S	.	.			trans	-73	74.4	170.9	-174.2	0	0	0	0	108.7	D48	D48-S50 PolarHBondContact O-N 3.15Å
51	L	60.9	Low	72.5	Confident	83 Å²	83	82.6 Å²	82.6	44%	0.435	45%	0.448	S	S	.	.			trans	-75.5	-5.3	166.1	-71.2	176.1	0	0	0	111.2	Y41 C49 E53 P93	Y41-L51 HydrophobicContact CD1-CD2 3.94Å; Y41-L51 HydrophobicContact CE1-CD2 4.44Å; Y41-L51 HydrophobicContact CG-CD2 4.07Å; C49-L51 HydrophobicContact CB-CD1 4.36Å; C49-L51 HydrophobicContact CB-CG 3.99Å; C49-L51 PolarHBondContact O-N 2.75Å; L51-E53 VanDerWaalsContact C-N 3.25Å; L51-E53 PolarHBondContact O-N 2.74Å; L51-P93 HydrophobicContact CD2-CG 3.53Å; L51-P93 HydrophobicContact CG-CG 4.5Å
52	E	62.4	Low	73.2	Confident	164 Å²	164	81.6 Å²	81.6	77%	0.766	44%	0.444	S	S	*	.	S	Bend	trans	-61.8	-33.7	177.2	-61.5	-173.2	170	0	0	111.9
53	E	73.8	Confident	74.4	Confident	152 Å²	152	79.9 Å²	79.9	71%	0.71	42%	0.422	S	S	*	.	S	Bend	trans	-100.2	118.4	178.5	-69.2	-166.7	171.3	0	0	112.2	Y41 L51 S55	Y41-E53 WeakPolarHBondContact CD1-O 3.47Å; Y41-E53 WeakPolarHBondContact CE1-O 3.43Å; L51-E53 VanDerWaalsContact C-N 3.25Å; L51-E53 PolarHBondContact O-N 2.74Å; E53-S55 PolarHBondContact O-N 2.73Å
54	L	84.9	Confident	75.8	Confident	33 Å²	33	81.6 Å²	81.6	17%	0.173	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-58.2	125.2	173.1	-175.9	77.4	0	0	0	110.6	Y41 S56 V58 A59 V82 M96	Y41-L54 VanDerWaalsContact OH-CD1 3.28Å; Y41-L54 WeakPolarHBondContact OH-CD1 3.43Å; L54-S56 PolarHBondContact O-N 2.84Å; L54-V58 HydrophobicContact CD1-CG1 4.21Å; L54-A59 HydrophobicContact CD2-CB 3.57Å; L54-A59 HydrophobicContact CG-CB 4.4Å; L54-V82 HydrophobicContact CD2-CG1 3.53Å; L54-M96 HydrophobicContact CD1-CE 3.75Å; L54-M96 HydrophobicContact CD2-CE 4.48Å
55	S	88.8	Confident	77.5	Confident	9 Å²	9	79.4 Å²	79.4	6%	0.063	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-57.2	127	174.2	-177.1	0	0	0	0	112.3	L39 Y40 E53 P57 V58 A59	L39-S55 WeakPolarHBondContact O-CB 3.42Å; L39-S55 PolarHBondContact O-OG 2.85Å; L39-S55 VanDerWaalsContact O-OG 3.12Å; Y40-S55 WeakPolarHBondContact CB-OG 3.3Å; Y40-S55 WeakPolarHBondContact O-CB 3.5Å; Y40-S55 PolarHBondContact O-OG 3.47Å; E53-S55 PolarHBondContact O-N 2.73Å; S55-P57 WeakPolarHBondContact OG-CD 3.4Å; S55-V58 WeakPolarHBondContact O-CA 3.49Å; S55-V58 WeakPolarHBondContact O-CB 3.42Å; S55-V58 PolarHBondContact O-N 2.68Å; S55-A59 PolarHBondContact O-N 3.37Å
56	S	89.7	Confident	79.5	Confident	61 Å²	61	72.1 Å²	72.1	43%	0.427	38%	0.384	S	S	.	.	H	α-helix	trans	-55.4	-47.8	-179.5	164	0	0	0	0	113.5	L54 V58 A59 D60 K79	L54-S56 PolarHBondContact O-N 2.84Å; S56-V58 VanDerWaalsContact C-N 3.29Å; S56-V58 PolarHBondContact O-N 3.18Å; S56-A59 WeakPolarHBondContact O-CB 3.25Å; S56-A59 PolarHBondContact O-N 3.19Å; S56-D60 PolarHBondContact O-N 3.36Å; S56-K79 PolarHBondContact OG-NZ 3.01Å
57	P	91.6	Very high	81.5	Confident	44 Å²	44	64.8 Å²	64.8	29%	0.286	35%	0.35	S	S	.	.	H	α-helix	trans	-57.2	-37.7	173	-29.2	35.8	0	0	0	114.2	Y40 S55 D60 I61	Y40-P57 HydrophobicContact CD1-CG 4.23Å; Y40-P57 HydrophobicContact CD2-CB 3.85Å; Y40-P57 HydrophobicContact CD2-CG 4.07Å; Y40-P57 HydrophobicContact CE2-CB 4.37Å; Y40-P57 HydrophobicContact CG-CB 4.13Å; Y40-P57 HydrophobicContact CG-CG 3.83Å; S55-P57 WeakPolarHBondContact OG-CD 3.4Å; P57-D60 PolarHBondContact O-N 2.96Å; P57-I61 WeakPolarHBondContact O-CG1 3.29Å; P57-I61 PolarHBondContact O-N 2.88Å
58	V	91.3	Very high	83.5	Confident	16 Å²	16	67.5 Å²	67.5	10%	0.097	35%	0.354	C	S	.	.	H	α-helix	trans	-66.5	-41.8	176.6	176	0	0	0	0	110.2	L39 Y41 L54 S55 S56 D60 I61 T62 M96	L39-V58 HydrophobicContact CB-CG2 3.85Å; L39-V58 WeakPolarHBondContact O-CG2 3.42Å; Y41-V58 HydrophobicContact CE2-CG2 4.19Å; L54-V58 HydrophobicContact CD1-CG1 4.21Å; S55-V58 WeakPolarHBondContact O-CA 3.49Å; S55-V58 WeakPolarHBondContact O-CB 3.42Å; S55-V58 PolarHBondContact O-N 2.68Å; S56-V58 VanDerWaalsContact C-N 3.29Å; S56-V58 PolarHBondContact O-N 3.18Å; V58-D60 VanDerWaalsContact C-N 3.34Å; V58-D60 PolarHBondContact O-N 2.91Å; V58-I61 PolarHBondContact O-N 2.64Å; V58-T62 VanDerWaalsContact O-CB 3.22Å; V58-T62 WeakPolarHBondContact O-CB 3.3Å; V58-T62 PolarHBondContact O-N 3.12Å; V58-T62 PolarHBondContact O-OG1 3.26Å; V58-M96 HydrophobicContact CG1-CG 4.11Å
59	A	93.8	Very high	85.5	Confident	2 Å²	2	60.1 Å²	60.1	2%	0.017	32%	0.316	C	S	.	.	H	α-helix	trans	-59.3	-45	174.3	0	0	0	0	0	111.6	L54 S55 S56 T62 V63 K79 V82	L54-A59 HydrophobicContact CD2-CB 3.57Å; L54-A59 HydrophobicContact CG-CB 4.4Å; S55-A59 PolarHBondContact O-N 3.37Å; S56-A59 WeakPolarHBondContact O-CB 3.25Å; S56-A59 PolarHBondContact O-N 3.19Å; A59-T62 PolarHBondContact O-N 2.96Å; A59-V63 VanDerWaalsContact O-CG2 3.26Å; A59-V63 WeakPolarHBondContact O-CG2 3.25Å; A59-V63 PolarHBondContact O-N 3.43Å; A59-K79 HydrophobicContact CB-CG 4.07Å; A59-V82 HydrophobicContact CB-CG1 4.14Å
60	D	94.7	Very high	87.5	Confident	73 Å²	73	57.5 Å²	57.5	39%	0.39	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-48.5	179.6	-70.2	-36.8	0	0	0	112	S56 P57 V58 T62 V63 E64 K79	S56-D60 PolarHBondContact O-N 3.36Å; P57-D60 PolarHBondContact O-N 2.96Å; V58-D60 VanDerWaalsContact C-N 3.34Å; V58-D60 PolarHBondContact O-N 2.91Å; D60-T62 VanDerWaalsContact C-N 3.33Å; D60-T62 PolarHBondContact O-N 3.46Å; D60-V63 PolarHBondContact O-N 2.87Å; D60-E64 PolarHBondContact O-N 3.3Å; D60-K79 WeakPolarHBondContact OD1-CD 3.36Å; D60-K79 WeakPolarHBondContact OD1-CE 3.1Å; D60-K79 IonicContact OD1-NZ 2.72Å; D60-K79 PolarHBondContact OD1-NZ 3.23Å; D60-K79 IonicContact OD2-NZ 3.7Å; D60-K79 PolarHBondContact OD2-NZ 3.07Å
61	I	94.1	Very high	89.1	Confident	90 Å²	90	59 Å²	59	46%	0.462	31%	0.306	S	S	.	.	H	α-helix	trans	-63.6	-41.3	178.2	-67.9	166.7	0	0	0	110.7	P57 V58 V63 E64 L65	P57-I61 WeakPolarHBondContact O-CG1 3.29Å; P57-I61 PolarHBondContact O-N 2.88Å; V58-I61 PolarHBondContact O-N 2.64Å; I61-V63 VanDerWaalsContact C-N 3.33Å; I61-V63 PolarHBondContact O-N 3.01Å; I61-E64 PolarHBondContact O-N 2.9Å; I61-L65 HydrophobicContact CG2-CD1 3.68Å; I61-L65 HydrophobicContact CG2-CG 4.11Å; I61-L65 WeakPolarHBondContact O-CB 3.25Å; I61-L65 VanDerWaalsContact O-CG 3.3Å; I61-L65 WeakPolarHBondContact O-CG 3.44Å; I61-L65 PolarHBondContact O-N 3.45Å
62	T	95.3	Very high	90.3	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.9	-45.4	177.4	-61.9	0	0	0	0	110.7	V58 A59 D60 E64 L65 L66 V82 M96 F123	V58-T62 VanDerWaalsContact O-CB 3.22Å; V58-T62 WeakPolarHBondContact O-CB 3.3Å; V58-T62 PolarHBondContact O-N 3.12Å; V58-T62 PolarHBondContact O-OG1 3.26Å; A59-T62 PolarHBondContact O-N 2.96Å; D60-T62 VanDerWaalsContact C-N 3.33Å; D60-T62 PolarHBondContact O-N 3.46Å; T62-E64 PolarHBondContact O-N 3.48Å; T62-L65 PolarHBondContact O-N 3.38Å; T62-L66 HydrophobicContact CG2-CD1 3.64Å; T62-L66 WeakPolarHBondContact O-CB 3.3Å; T62-L66 PolarHBondContact O-N 3.31Å; T62-V82 HydrophobicContact CG2-CG1 4.46Å; T62-M96 HydrophobicContact CG2-SD 3.88Å; T62-F123 HydrophobicContact CG2-CD2 3.96Å; T62-F123 HydrophobicContact CG2-CE2 3.89Å
63	V	96.8	Very high	91.2	Very high	17 Å²	17	53.7 Å²	53.7	10%	0.103	29%	0.292	C	S	.	.	H	α-helix	trans	-59.5	-47.6	175.8	172.7	0	0	0	0	111.1	A59 D60 I61 Q67 L77 K79 V82	A59-V63 VanDerWaalsContact O-CG2 3.26Å; A59-V63 WeakPolarHBondContact O-CG2 3.25Å; A59-V63 PolarHBondContact O-N 3.43Å; D60-V63 PolarHBondContact O-N 2.87Å; I61-V63 VanDerWaalsContact C-N 3.33Å; I61-V63 PolarHBondContact O-N 3.01Å; V63-Q67 HydrophobicContact CG1-CG 4.23Å; V63-Q67 VanDerWaalsContact CG1-NE2 3.29Å; V63-Q67 VanDerWaalsContact O-CB 3.29Å; V63-Q67 WeakPolarHBondContact O-CB 3.31Å; V63-Q67 WeakPolarHBondContact O-CG 3.39Å; V63-Q67 PolarHBondContact O-N 3.04Å; V63-L77 HydrophobicContact CG2-CD2 4.29Å; V63-L77 HydrophobicContact CG2-CG 4.27Å; V63-K79 HydrophobicContact CG2-CB 4.27Å; V63-V82 HydrophobicContact CG2-CG2 3.74Å
64	E	95.7	Very high	91.9	Very high	131 Å²	131	52.2 Å²	52.2	61%	0.612	29%	0.287	S	S	*	.	H	α-helix	trans	-60.7	-49.4	179.6	-171.6	-173.9	156.7	0	0	111.9	D60 I61 T62 L66 K68	D60-E64 PolarHBondContact O-N 3.3Å; I61-E64 PolarHBondContact O-N 2.9Å; T62-E64 PolarHBondContact O-N 3.48Å; E64-L66 PolarHBondContact O-N 3.47Å; E64-K68 VanDerWaalsContact O-CB 3.3Å; E64-K68 WeakPolarHBondContact O-CB 3.41Å; E64-K68 PolarHBondContact O-N 2.99Å
65	L	95	Very high	92.1	Very high	71 Å²	71	56 Å²	56	37%	0.372	30%	0.299	S	S	.	.	H	α-helix	trans	-62.3	-45.8	-178.1	-72.2	174.1	0	0	0	111.8	I61 T62 K68 A69 L100	I61-L65 HydrophobicContact CG2-CD1 3.68Å; I61-L65 HydrophobicContact CG2-CG 4.11Å; I61-L65 WeakPolarHBondContact O-CB 3.25Å; I61-L65 VanDerWaalsContact O-CG 3.3Å; I61-L65 WeakPolarHBondContact O-CG 3.44Å; I61-L65 PolarHBondContact O-N 3.45Å; T62-L65 PolarHBondContact O-N 3.38Å; L65-K68 PolarHBondContact O-N 2.91Å; L65-A69 WeakPolarHBondContact O-CB 3.4Å; L65-A69 PolarHBondContact O-N 3.3Å; L65-L100 HydrophobicContact CB-CD2 4.48Å; L65-L100 HydrophobicContact CD1-CD1 4.36Å; L65-L100 HydrophobicContact CD1-CD2 4.02Å
66	L	96	Very high	92.4	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-72.1	-37.9	-178.2	-87.9	155	0	0	0	113.2	T62 E64 K68 A69 A70 L77 I103 L122 F123	T62-L66 HydrophobicContact CG2-CD1 3.64Å; T62-L66 WeakPolarHBondContact O-CB 3.3Å; T62-L66 PolarHBondContact O-N 3.31Å; E64-L66 PolarHBondContact O-N 3.47Å; L66-K68 VanDerWaalsContact C-N 3.27Å; L66-K68 PolarHBondContact O-N 2.87Å; L66-A69 PolarHBondContact O-N 2.89Å; L66-A70 PolarHBondContact O-N 3.15Å; L66-L77 HydrophobicContact CB-CD2 3.64Å; L66-L77 HydrophobicContact CD1-CD2 3.69Å; L66-L77 HydrophobicContact CG-CD2 4.28Å; L66-I103 HydrophobicContact CD1-CD1 4.09Å; L66-I103 HydrophobicContact CD2-CD1 3.33Å; L66-I103 HydrophobicContact CD2-CG1 3.98Å; L66-I103 HydrophobicContact CD2-CG2 4.46Å; L66-I103 HydrophobicContact CG-CD1 3.75Å; L66-L122 HydrophobicContact CD2-CB 4.1Å; L66-L122 HydrophobicContact CD2-CD2 3.6Å; L66-L122 HydrophobicContact CD2-CG 3.62Å; L66-F123 HydrophobicContact CD1-CB 3.84Å; L66-F123 HydrophobicContact CD1-CD2 3.6Å; L66-F123 HydrophobicContact CD1-CG 4.16Å
67	Q	95.6	Very high	92.7	Very high	42 Å²	42	59.6 Å²	59.6	20%	0.196	30%	0.302	C	S	.	.	H	α-helix	trans	-65.7	-33.5	173.1	-72.4	-179.9	6.4	0	0	111.9	V63 A70 R76 L77	V63-Q67 HydrophobicContact CG1-CG 4.23Å; V63-Q67 VanDerWaalsContact CG1-NE2 3.29Å; V63-Q67 VanDerWaalsContact O-CB 3.29Å; V63-Q67 WeakPolarHBondContact O-CB 3.31Å; V63-Q67 WeakPolarHBondContact O-CG 3.39Å; V63-Q67 PolarHBondContact O-N 3.04Å; Q67-A70 CarbonylContact O-C 3.58Å; Q67-R76 HydrophobicContact CG-CG 3.99Å; Q67-R76 VanDerWaalsContact OE1-NE 3.09Å; Q67-L77 HydrophobicContact CG-CB 4.39Å; Q67-L77 PolarHBondContact NE2-O 3.41Å
68	K	93.8	Very high	92.9	Very high	147 Å²	147	63.4 Å²	63.4	64%	0.639	32%	0.316	S	S	*	.	H	α-helix	trans	-72.2	-35.9	174.5	-172.9	177	-178.4	177.4	0	112.1	E64 L65 L66	E64-K68 VanDerWaalsContact O-CB 3.3Å; E64-K68 WeakPolarHBondContact O-CB 3.41Å; E64-K68 PolarHBondContact O-N 2.99Å; L65-K68 PolarHBondContact O-N 2.91Å; L66-K68 VanDerWaalsContact C-N 3.27Å; L66-K68 PolarHBondContact O-N 2.87Å
69	A	93.4	Very high	93.1	Very high	8 Å²	8	66.3 Å²	66.3	7%	0.066	33%	0.328	C	S	.	.	H	α-helix	trans	-71.1	-45.3	177.6	0	0	0	0	0	112	L65 L66 P71 I103 R107 L114	L65-A69 WeakPolarHBondContact O-CB 3.4Å; L65-A69 PolarHBondContact O-N 3.3Å; L66-A69 PolarHBondContact O-N 2.89Å; A69-P71 WeakPolarHBondContact O-CD 3.32Å; A69-I103 HydrophobicContact CB-CG2 3.57Å; A69-R107 HydrophobicContact CB-CG 4.18Å; A69-L114 WeakPolarHBondContact O-CB 3.42Å
70	A	93.6	Very high	93.2	Very high	1 Å²	1	74.5 Å²	74.5	1%	0.008	36%	0.363	C	S	.	.	S	Bend	trans	-116.5	88.6	179.5	0	0	0	0	0	110.3	L66 Q67 S72 V117 L122	L66-A70 PolarHBondContact O-N 3.15Å; Q67-A70 CarbonylContact O-C 3.58Å; A70-S72 PolarHBondContact O-N 2.92Å; A70-S72 VanDerWaalsContact O-N 3.15Å; A70-V117 HydrophobicContact CB-CG1 4.36Å; A70-L122 HydrophobicContact CB-CD2 3.76Å
71	P	89.4	Confident	93.3	Very high	94 Å²	94	73.3 Å²	73.3	61%	0.61	35%	0.353	S	S	*	.			trans	-76.1	0.9	-169.9	31.3	-36.6	0	0	0	114.4	A69	A69-P71 WeakPolarHBondContact O-CD 3.32Å
72	S	87.3	Confident	93.4	Very high	23 Å²	23	69 Å²	69	16%	0.161	33%	0.331	C	S	.	.			trans	-56.2	131	179.4	-179	0	0	0	0	111.3	A70 I74	A70-S72 PolarHBondContact O-N 2.92Å; A70-S72 VanDerWaalsContact O-N 3.15Å; S72-I74 PolarHBondContact O-N 2.72Å; S72-I74 PolarHBondContact OG-N 3.43Å
73	P	80.9	Confident	93.3	Very high	113 Å²	113	71.1 Å²	71.1	73%	0.734	35%	0.349	S	S	*	.	S	Bend	trans	-73.7	-16.5	178.7	30.8	-35.1	0	0	0	112.4
74	I	87.9	Confident	93.2	Very high	121 Å²	121	74 Å²	74	62%	0.621	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	130.4	-179	-59.7	173.2	0	0	0	108.8	S72 R76 S118	S72-I74 PolarHBondContact O-N 2.72Å; S72-I74 PolarHBondContact OG-N 3.43Å; I74-R76 PolarHBondContact O-N 3.17Å; I74-S118 VanDerWaalsContact O-CB 3.25Å; I74-S118 WeakPolarHBondContact O-CB 3.34Å
75	R	89.3	Confident	93.2	Very high	112 Å²	112	67.8 Å²	67.8	42%	0.423	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.5	49.3	-179.8	-64.1	-177.2	71.2	-157.7	-2.5	111.7	L77 S120 D121	R75-L77 PolarHBondContact O-N 2.91Å; R75-S120 VanDerWaalsContact O-CB 3.23Å; R75-S120 WeakPolarHBondContact O-CB 3.46Å; R75-S120 PolarHBondContact O-N 2.69Å; R75-S120 PolarHBondContact O-OG 3.47Å; R75-D121 IonicContact CZ-OD1 3.12Å; R75-D121 VanDerWaalsContact CZ-OD1 3.25Å; R75-D121 IonicContact CZ-OD2 2.74Å; R75-D121 VanDerWaalsContact NH1-CG 3.28Å; R75-D121 IonicContact NH1-OD1 2.78Å; R75-D121 PolarHBondContact NH1-OD1 2.89Å; R75-D121 IonicContact NH1-OD2 2.92Å; R75-D121 PolarHBondContact NH1-OD2 3.43Å; R75-D121 VanDerWaalsContact NH1-OD2 3.12Å; R75-D121 IonicContact NH2-OD1 2.78Å; R75-D121 PolarHBondContact NH2-OD1 3.49Å
76	R	94.6	Very high	93.1	Very high	146 Å²	146	64.6 Å²	64.6	55%	0.551	32%	0.315	S	S	*	.			trans	-61.3	131	177.9	-174.5	175.6	168.6	170.5	0.7	110.3	Q67 I74 Q78 S119	Q67-R76 HydrophobicContact CG-CG 3.99Å; Q67-R76 VanDerWaalsContact OE1-NE 3.09Å; I74-R76 PolarHBondContact O-N 3.17Å; R76-Q78 PolarHBondContact O-N 2.82Å; R76-S119 WeakPolarHBondContact CA-OG 3.34Å
77	L	97	Very high	92.8	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	34%	0.342	C	S	.	.			trans	-58.6	134.6	-176.4	-176.1	66.1	0	0	0	111.6	V63 L66 Q67 R75 Y81 V82 S119 S120 F123	V63-L77 HydrophobicContact CG2-CD2 4.29Å; V63-L77 HydrophobicContact CG2-CG 4.27Å; L66-L77 HydrophobicContact CB-CD2 3.64Å; L66-L77 HydrophobicContact CD1-CD2 3.69Å; L66-L77 HydrophobicContact CG-CD2 4.28Å; Q67-L77 HydrophobicContact CG-CB 4.39Å; Q67-L77 PolarHBondContact NE2-O 3.41Å; R75-L77 PolarHBondContact O-N 2.91Å; L77-Y81 HydrophobicContact CD1-CD1 3.79Å; L77-V82 HydrophobicContact CD1-CG2 3.62Å; L77-V82 HydrophobicContact CD2-CG2 3.83Å; L77-V82 HydrophobicContact CG-CG2 3.76Å; L77-S119 PolarHBondContact N-OG 3.06Å; L77-S120 WeakPolarHBondContact CA-OG 3.29Å; L77-S120 PolarHBondContact N-OG 2.71Å; L77-F123 HydrophobicContact CD1-CB 3.71Å; L77-F123 HydrophobicContact CD1-CD1 3.94Å; L77-F123 HydrophobicContact CD1-CG 3.85Å; L77-F123 HydrophobicContact CD2-CB 3.98Å; L77-F123 HydrophobicContact CD2-CD2 4.4Å; L77-F123 HydrophobicContact CD2-CG 4.22Å; L77-F123 HydrophobicContact CG-CB 4.49Å
78	Q	96.1	Very high	92.6	Very high	125 Å²	125	74.4 Å²	74.4	58%	0.584	36%	0.355	S	S	*	.			trans	-119.8	146.4	177.4	-61.7	-173.2	-0.2	0	0	110.7	R76 K80 Y81 V82	R76-Q78 PolarHBondContact O-N 2.82Å; Q78-K80 PolarHBondContact O-N 3.15Å; Q78-Y81 WeakPolarHBondContact O-CA 3.15Å; Q78-Y81 WeakPolarHBondContact O-CB 3.48Å; Q78-Y81 PolarHBondContact O-N 3.25Å; Q78-V82 PolarHBondContact O-N 2.92Å
79	K	95.9	Very high	92.5	Very high	77 Å²	77	68.3 Å²	68.3	34%	0.335	33%	0.332	S	S	.	.	H	α-helix	trans	-52.4	-40.5	176.5	-172.5	-174.1	-169.2	157.3	0	112.8	S56 A59 D60 V63 Y81 V82 A83	S56-K79 PolarHBondContact OG-NZ 3.01Å; A59-K79 HydrophobicContact CB-CG 4.07Å; D60-K79 WeakPolarHBondContact OD1-CD 3.36Å; D60-K79 WeakPolarHBondContact OD1-CE 3.1Å; D60-K79 IonicContact OD1-NZ 2.72Å; D60-K79 PolarHBondContact OD1-NZ 3.23Å; D60-K79 IonicContact OD2-NZ 3.7Å; D60-K79 PolarHBondContact OD2-NZ 3.07Å; V63-K79 HydrophobicContact CG2-CB 4.27Å; K79-Y81 VanDerWaalsContact C-N 3.3Å; K79-Y81 PolarHBondContact O-N 2.94Å; K79-V82 PolarHBondContact O-N 2.9Å; K79-A83 WeakPolarHBondContact O-CB 3.4Å; K79-A83 PolarHBondContact O-N 3.44Å
80	K	95.1	Very high	92.2	Very high	174 Å²	174	73 Å²	73	76%	0.757	36%	0.363	S	S	*	.	H	α-helix	trans	-60.2	-39.7	177	-68.9	-175.3	178.1	-178	0	112.3	Q78 H84	Q78-K80 PolarHBondContact O-N 3.15Å; K80-H84 VanDerWaalsContact O-CB 3.26Å; K80-H84 WeakPolarHBondContact O-CB 3Å; K80-H84 PolarHBondContact O-N 3.47Å
81	Y	96.7	Very high	92	Very high	48 Å²	48	73.3 Å²	73.3	19%	0.188	36%	0.364	C	S	.	.	H	α-helix	trans	-70.1	-42.4	177.7	-173.9	-105.2	0	0	0	111.4	L77 Q78 K79 A83 H84 V85 F123 G152	L77-Y81 HydrophobicContact CD1-CD1 3.79Å; Q78-Y81 WeakPolarHBondContact O-CA 3.15Å; Q78-Y81 WeakPolarHBondContact O-CB 3.48Å; Q78-Y81 PolarHBondContact O-N 3.25Å; K79-Y81 VanDerWaalsContact C-N 3.3Å; K79-Y81 PolarHBondContact O-N 2.94Å; Y81-A83 PolarHBondContact O-N 3Å; Y81-H84 PolarHBondContact O-N 3.42Å; Y81-V85 HydrophobicContact CD1-CG2 4.2Å; Y81-V85 HydrophobicContact CD2-CG2 4.25Å; Y81-V85 HydrophobicContact CE1-CG2 3.85Å; Y81-V85 HydrophobicContact CE2-CG2 3.88Å; Y81-V85 HydrophobicContact CG-CG2 4.41Å; Y81-V85 WeakPolarHBondContact O-CG2 3.14Å; Y81-V85 PolarHBondContact O-N 3.36Å; Y81-F123 HydrophobicContact CD1-CD1 4.22Å; Y81-F123 HydrophobicContact CE1-CD1 4.15Å; Y81-G152 WeakPolarHBondContact CE2-O 3.46Å; Y81-G152 VanDerWaalsContact OH-CA 3.31Å; Y81-G152 WeakPolarHBondContact OH-CA 3.47Å; Y81-G152 PolarHBondContact OH-O 3.02Å
82	V	96	Very high	91.9	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-57.5	-50.5	174	175.3	0	0	0	0	110.9	L54 A59 T62 V63 L77 Q78 K79 H84 S86 F123	L54-V82 HydrophobicContact CD2-CG1 3.53Å; A59-V82 HydrophobicContact CB-CG1 4.14Å; T62-V82 HydrophobicContact CG2-CG1 4.46Å; V63-V82 HydrophobicContact CG2-CG2 3.74Å; L77-V82 HydrophobicContact CD1-CG2 3.62Å; L77-V82 HydrophobicContact CD2-CG2 3.83Å; L77-V82 HydrophobicContact CG-CG2 3.76Å; Q78-V82 PolarHBondContact O-N 2.92Å; K79-V82 PolarHBondContact O-N 2.9Å; V82-H84 VanDerWaalsContact C-N 3.35Å; V82-H84 PolarHBondContact O-N 3.27Å; V82-S86 VanDerWaalsContact O-CB 3.27Å; V82-S86 WeakPolarHBondContact O-CB 3.26Å; V82-S86 PolarHBondContact O-N 2.67Å; V82-S86 PolarHBondContact O-OG 3.12Å; V82-F123 HydrophobicContact CB-CE1 4.42Å; V82-F123 HydrophobicContact CB-CE2 4.48Å; V82-F123 HydrophobicContact CB-CZ 4.12Å; V82-F123 HydrophobicContact CG1-CE2 3.93Å; V82-F123 HydrophobicContact CG1-CZ 3.75Å; V82-F123 HydrophobicContact CG2-CD1 4.44Å; V82-F123 HydrophobicContact CG2-CD2 4.35Å; V82-F123 HydrophobicContact CG2-CE1 4.25Å; V82-F123 HydrophobicContact CG2-CE2 4.15Å; V82-F123 HydrophobicContact CG2-CG 4.49Å; V82-F123 HydrophobicContact CG2-CZ 4.11Å
83	A	93.5	Very high	92	Very high	44 Å²	44	70.2 Å²	70.2	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-63	-40.2	178.8	0	0	0	0	0	112.4	K79 Y81 R87	K79-A83 WeakPolarHBondContact O-CB 3.4Å; K79-A83 PolarHBondContact O-N 3.44Å; Y81-A83 PolarHBondContact O-N 3Å; A83-R87 PolarHBondContact O-N 3.24Å
84	H	94.4	Very high	92.4	Very high	77 Å²	77	68.5 Å²	68.5	36%	0.356	33%	0.334	S	S	.	.	H	α-helix	trans	-59.9	-61.5	175.9	176.1	-85	0	0	0	111.3	K80 Y81 V82 S86 R87 E88 A151	K80-H84 VanDerWaalsContact O-CB 3.26Å; K80-H84 WeakPolarHBondContact O-CB 3Å; K80-H84 PolarHBondContact O-N 3.47Å; Y81-H84 PolarHBondContact O-N 3.42Å; V82-H84 VanDerWaalsContact C-N 3.35Å; V82-H84 PolarHBondContact O-N 3.27Å; H84-S86 VanDerWaalsContact C-N 3.25Å; H84-S86 PolarHBondContact O-N 3.02Å; H84-R87 PolarHBondContact O-N 3.04Å; H84-R87 VanDerWaalsContact O-N 3.1Å; H84-E88 WeakPolarHBondContact O-CG 3.45Å; H84-E88 PolarHBondContact O-N 3.06Å; H84-A151 PolarHBondContact CE1-O 3.28Å; H84-A151 PolarHBondContact ND1-O 3.36Å
85	V	95.2	Very high	92.7	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.7	-37.3	-177.2	174.1	0	0	0	0	111.2	Y81 R87 E88 A89 I91 F123 L124 W148	Y81-V85 HydrophobicContact CD1-CG2 4.2Å; Y81-V85 HydrophobicContact CD2-CG2 4.25Å; Y81-V85 HydrophobicContact CE1-CG2 3.85Å; Y81-V85 HydrophobicContact CE2-CG2 3.88Å; Y81-V85 HydrophobicContact CG-CG2 4.41Å; Y81-V85 WeakPolarHBondContact O-CG2 3.14Å; Y81-V85 PolarHBondContact O-N 3.36Å; V85-R87 VanDerWaalsContact C-N 3.28Å; V85-R87 PolarHBondContact O-N 3.47Å; V85-E88 PolarHBondContact O-N 3.02Å; V85-A89 VanDerWaalsContact O-CB 3.27Å; V85-A89 WeakPolarHBondContact O-CB 3.45Å; V85-A89 PolarHBondContact O-N 2.7Å; V85-I91 HydrophobicContact CG1-CD1 4.09Å; V85-F123 HydrophobicContact CB-CE1 3.9Å; V85-F123 HydrophobicContact CG1-CE1 3.96Å; V85-F123 HydrophobicContact CG2-CE1 4.41Å; V85-L124 HydrophobicContact CG1-CD1 3.83Å; V85-L124 HydrophobicContact CG2-CD1 4.46Å; V85-W148 HydrophobicContact CG1-CZ3 4.46Å
86	S	92.8	Very high	92.8	Very high	4 Å²	4	57.5 Å²	57.5	3%	0.028	29%	0.285	C	S	.	.	H	α-helix	trans	-63	-36.1	178.8	-55.8	0	0	0	0	112.7	V82 H84 C90 I91	V82-S86 VanDerWaalsContact O-CB 3.27Å; V82-S86 WeakPolarHBondContact O-CB 3.26Å; V82-S86 PolarHBondContact O-N 2.67Å; V82-S86 PolarHBondContact O-OG 3.12Å; H84-S86 VanDerWaalsContact C-N 3.25Å; H84-S86 PolarHBondContact O-N 3.02Å; S86-C90 PolarHBondContact O-N 3Å; S86-I91 PolarHBondContact O-N 3.35Å
87	R	90.5	Very high	92.8	Very high	149 Å²	149	55 Å²	55	56%	0.562	28%	0.281	S	S	*	.	H	α-helix	trans	-77.2	-47.4	175.7	-172.8	-174.7	64.4	-136.6	-5.3	111.9	A83 H84 V85 A89 C90	A83-R87 PolarHBondContact O-N 3.24Å; H84-R87 PolarHBondContact O-N 3.04Å; H84-R87 VanDerWaalsContact O-N 3.1Å; V85-R87 VanDerWaalsContact C-N 3.28Å; V85-R87 PolarHBondContact O-N 3.47Å; R87-A89 VanDerWaalsContact C-N 3.3Å; R87-A89 PolarHBondContact O-N 3.4Å; R87-C90 PolarHBondContact O-N 3.34Å
88	E	91.9	Very high	92.8	Very high	100 Å²	100	56.7 Å²	56.7	47%	0.467	29%	0.289	S	S	.	.	H	α-helix	trans	-67.7	-29.8	-176.6	-62.1	-55	127.9	0	0	112.8	H84 V85 A151	H84-E88 WeakPolarHBondContact O-CG 3.45Å; H84-E88 PolarHBondContact O-N 3.06Å; V85-E88 PolarHBondContact O-N 3.02Å; E88-A151 HydrophobicContact CB-CB 3.77Å
89	A	90.3	Very high	92.8	Very high	19 Å²	19	50.7 Å²	50.7	16%	0.157	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	14.4	179.5	0	0	0	0	0	113.4	V85 R87 I91 W148 A151	V85-A89 VanDerWaalsContact O-CB 3.27Å; V85-A89 WeakPolarHBondContact O-CB 3.45Å; V85-A89 PolarHBondContact O-N 2.7Å; R87-A89 VanDerWaalsContact C-N 3.3Å; R87-A89 PolarHBondContact O-N 3.4Å; A89-I91 VanDerWaalsContact C-N 3.29Å; A89-I91 HydrophobicContact CB-CG1 4.2Å; A89-I91 PolarHBondContact O-N 3.03Å; A89-I91 VanDerWaalsContact O-N 3.15Å; A89-W148 HydrophobicContact CB-CD2 4.13Å; A89-W148 HydrophobicContact CB-CE3 4.28Å; A89-W148 HydrophobicContact CB-CH2 4.01Å; A89-W148 HydrophobicContact CB-CZ2 3.81Å; A89-W148 HydrophobicContact CB-CZ3 4.21Å; A89-A151 HydrophobicContact CB-CB 4.21Å
90	C	87.9	Confident	92.8	Very high	105 Å²	105	48.5 Å²	48.5	71%	0.709	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	48	177.6	-62	0	0	0	0	113.7	S86 R87 S92	S86-C90 PolarHBondContact O-N 3Å; R87-C90 PolarHBondContact O-N 3.34Å; C90-S92 PolarHBondContact O-N 2.9Å
91	I	88.7	Confident	92.8	Very high	8 Å²	8	43.7 Å²	43.7	4%	0.041	24%	0.238	C	C	.	.			trans	-69.1	118	-173.2	-63.1	-177.4	0	0	0	110.3	V85 S86 A89 A95 M96 F123 M127 W148	V85-I91 HydrophobicContact CG1-CD1 4.09Å; S86-I91 PolarHBondContact O-N 3.35Å; A89-I91 VanDerWaalsContact C-N 3.29Å; A89-I91 HydrophobicContact CB-CG1 4.2Å; A89-I91 PolarHBondContact O-N 3.03Å; A89-I91 VanDerWaalsContact O-N 3.15Å; I91-A95 HydrophobicContact CG2-CB 4.26Å; I91-M96 HydrophobicContact CG2-CB 4.42Å; I91-M96 HydrophobicContact CG2-CE 4.2Å; I91-F123 HydrophobicContact CD1-CZ 4.45Å; I91-M127 HydrophobicContact CD1-CB 3.81Å; I91-M127 HydrophobicContact CD1-CG 3.84Å; I91-M127 HydrophobicContact CD1-SD 4.24Å; I91-M127 HydrophobicContact CG2-SD 4.06Å; I91-W148 HydrophobicContact CD1-CH2 3.79Å; I91-W148 HydrophobicContact CD1-CZ3 4.07Å; I91-W148 HydrophobicContact CG1-CH2 3.78Å; I91-W148 HydrophobicContact CG1-CZ2 4.45Å
92	S	88.5	Confident	92.9	Very high	28 Å²	28	42.6 Å²	42.6	20%	0.196	23%	0.234	C	C	.	.			trans	-73.7	153.7	174.2	71.8	0	0	0	0	112	C90 C94 A95 M96 Y135	C90-S92 PolarHBondContact O-N 2.9Å; S92-C94 PolarHBondContact O-N 3.06Å; S92-C94 VanDerWaalsContact O-N 3.13Å; S92-A95 PolarHBondContact O-N 3.5Å; S92-A95 PolarHBondContact OG-N 3.42Å; S92-M96 PolarHBondContact O-N 2.61Å; S92-Y135 WeakPolarHBondContact CB-OH 3.3Å; S92-Y135 PolarHBondContact OG-OH 3.29Å; S92-Y135 VanDerWaalsContact OG-OH 3.07Å
93	P	88.1	Confident	92.9	Very high	24 Å²	24	42.9 Å²	42.9	16%	0.156	24%	0.235	C	C	.	.	H	α-helix	trans	-57.9	-27.4	172.3	-19.7	27.4	0	0	0	113	Y41 L51 M97	Y41-P93 HydrophobicContact CD2-CG 4.37Å; Y41-P93 HydrophobicContact CE1-CG 4.09Å; Y41-P93 HydrophobicContact CE2-CB 3.93Å; Y41-P93 HydrophobicContact CE2-CG 3.85Å; L51-P93 HydrophobicContact CD2-CG 3.53Å; L51-P93 HydrophobicContact CG-CG 4.5Å; P93-M97 VanDerWaalsContact O-CG 3.28Å; P93-M97 WeakPolarHBondContact O-CG 3.23Å; P93-M97 PolarHBondContact O-N 2.84Å
94	C	89.9	Confident	93	Very high	77 Å²	77	44.6 Å²	44.6	52%	0.52	24%	0.236	S	C	.	.	H	α-helix	trans	-66.5	-50.7	176.8	-167.9	0	0	0	0	111.1	S92 M96 M97 L98 L134	S92-C94 PolarHBondContact O-N 3.06Å; S92-C94 VanDerWaalsContact O-N 3.13Å; C94-M96 VanDerWaalsContact C-N 3.31Å; C94-M96 PolarHBondContact O-N 3.38Å; C94-M97 PolarHBondContact O-N 2.9Å; C94-L98 PolarHBondContact O-N 3.46Å; C94-L134 HydrophobicContact CB-CD1 4.2Å
95	A	93.5	Very high	93.1	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.1	-42.9	176.1	0	0	0	0	0	111.5	I91 S92 M97 L98 A99 A130 L134	I91-A95 HydrophobicContact CG2-CB 4.26Å; S92-A95 PolarHBondContact O-N 3.5Å; S92-A95 PolarHBondContact OG-N 3.42Å; A95-M97 PolarHBondContact O-N 2.85Å; A95-L98 PolarHBondContact O-N 3.29Å; A95-A99 WeakPolarHBondContact O-CB 3.47Å; A95-A99 PolarHBondContact O-N 3.42Å; A95-A130 HydrophobicContact CB-CB 4.47Å; A95-L134 VanDerWaalsContact CA-CD1 3.47Å; A95-L134 HydrophobicContact CB-CD1 3.85Å
96	M	93.3	Very high	93.1	Very high	2 Å²	2	48 Å²	48	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-56.3	-49.1	175	-177.6	66.8	63.3	0	0	112.2	L54 V58 T62 I91 S92 C94 A99 L100 F123 M127	L54-M96 HydrophobicContact CD1-CE 3.75Å; L54-M96 HydrophobicContact CD2-CE 4.48Å; V58-M96 HydrophobicContact CG1-CG 4.11Å; T62-M96 HydrophobicContact CG2-SD 3.88Å; I91-M96 HydrophobicContact CG2-CB 4.42Å; I91-M96 HydrophobicContact CG2-CE 4.2Å; S92-M96 PolarHBondContact O-N 2.61Å; C94-M96 VanDerWaalsContact C-N 3.31Å; C94-M96 PolarHBondContact O-N 3.38Å; M96-A99 PolarHBondContact O-N 3.07Å; M96-L100 WeakPolarHBondContact O-CG 3.48Å; M96-L100 PolarHBondContact O-N 3.27Å; M96-L100 VanDerWaalsContact O-N 3.07Å; M96-F123 HydrophobicContact CE-CE2 4.1Å; M96-F123 HydrophobicContact CE-CZ 4.47Å; M96-F123 HydrophobicContact SD-CE2 4.43Å; M96-M127 HydrophobicContact CB-SD 4.44Å; M96-M127 HydrophobicContact CE-CE 4.01Å; M96-M127 HydrophobicContact CE-SD 3.99Å; M96-M127 HydrophobicContact CG-CE 4.42Å; M96-M127 HydrophobicContact SD-CE 3.24Å; M96-M127 WeakPolarHBondContact SD-CE 3.4Å; M96-M127 HydrophobicContact SD-SD 3.9Å
97	M	93.8	Very high	93.1	Very high	94 Å²	94	51.9 Å²	51.9	46%	0.463	26%	0.26	S	S	.	.	H	α-helix	trans	-64.2	-41.6	179	-72.3	-58.6	-54.9	0	0	112.1	L39 P93 C94 A95 L100 V101	L39-M97 HydrophobicContact CD1-CG 4.36Å; L39-M97 HydrophobicContact CD1-SD 4.05Å; P93-M97 VanDerWaalsContact O-CG 3.28Å; P93-M97 WeakPolarHBondContact O-CG 3.23Å; P93-M97 PolarHBondContact O-N 2.84Å; C94-M97 PolarHBondContact O-N 2.9Å; A95-M97 PolarHBondContact O-N 2.85Å; M97-L100 PolarHBondContact O-N 3.45Å; M97-V101 WeakPolarHBondContact O-CG2 3.3Å; M97-V101 PolarHBondContact O-N 3.11Å
98	L	96.5	Very high	93.3	Very high	35 Å²	35	51.5 Å²	51.5	18%	0.183	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-43.1	178.2	179.1	59	0	0	0	111.9	C94 A95 L100 V101 Y102 A130 Y133 L134	C94-L98 PolarHBondContact O-N 3.46Å; A95-L98 PolarHBondContact O-N 3.29Å; L98-L100 PolarHBondContact O-N 3.05Å; L98-V101 WeakPolarHBondContact O-CA 3.44Å; L98-V101 WeakPolarHBondContact O-CB 3.19Å; L98-V101 PolarHBondContact O-N 3.36Å; L98-V101 VanDerWaalsContact O-N 3.11Å; L98-Y102 HydrophobicContact CD1-CD1 4.27Å; L98-Y102 HydrophobicContact CD1-CE1 3.63Å; L98-Y102 HydrophobicContact CD1-CE2 4.49Å; L98-Y102 HydrophobicContact CD2-CE2 4.37Å; L98-Y102 HydrophobicContact CG-CE1 4.03Å; L98-Y102 HydrophobicContact CG-CE2 3.98Å; L98-Y102 PolarHBondContact O-N 3.21Å; L98-A130 HydrophobicContact CB-CB 4.09Å; L98-A130 HydrophobicContact CD2-CB 3.96Å; L98-A130 HydrophobicContact CG-CB 3.97Å; L98-Y133 HydrophobicContact CD2-CD1 3.5Å; L98-Y133 VanDerWaalsContact CD2-CD1 3.5Å; L98-Y133 HydrophobicContact CD2-CE1 4.25Å; L98-Y133 HydrophobicContact CD2-CG 4.18Å; L98-L134 HydrophobicContact CD2-CD1 4.04Å; L98-L134 HydrophobicContact CD2-CD2 4.11Å; L98-L134 HydrophobicContact CD2-CG 3.85Å
99	A	97.1	Very high	93.4	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-41.3	175.7	0	0	0	0	0	112.1	A95 M96 V101 Y102 I103 S126 M127 A130	A95-A99 WeakPolarHBondContact O-CB 3.47Å; A95-A99 PolarHBondContact O-N 3.42Å; M96-A99 PolarHBondContact O-N 3.07Å; A99-V101 VanDerWaalsContact C-N 3.29Å; A99-V101 PolarHBondContact O-N 3.41Å; A99-Y102 WeakPolarHBondContact O-CB 3.36Å; A99-Y102 PolarHBondContact O-N 3Å; A99-Y102 VanDerWaalsContact O-N 3.12Å; A99-I103 WeakPolarHBondContact O-CD1 3.46Å; A99-I103 WeakPolarHBondContact O-CG1 3.22Å; A99-I103 PolarHBondContact O-N 3Å; A99-S126 WeakPolarHBondContact CB-O 3.31Å; A99-M127 HydrophobicContact CB-CE 3.25Å; A99-M127 HydrophobicContact CB-CG 4.46Å; A99-M127 HydrophobicContact CB-SD 3.64Å; A99-A130 HydrophobicContact CB-CB 4Å
100	L	94.8	Very high	93.6	Very high	31 Å²	31	56.3 Å²	56.3	16%	0.162	28%	0.277	C	S	.	.	H	α-helix	trans	-61.2	-37.3	172.6	-69.5	176.7	0	0	0	112.2	L65 M96 M97 L98 I103 E104	L65-L100 HydrophobicContact CB-CD2 4.48Å; L65-L100 HydrophobicContact CD1-CD1 4.36Å; L65-L100 HydrophobicContact CD1-CD2 4.02Å; M96-L100 WeakPolarHBondContact O-CG 3.48Å; M96-L100 PolarHBondContact O-N 3.27Å; M96-L100 VanDerWaalsContact O-N 3.07Å; M97-L100 PolarHBondContact O-N 3.45Å; L98-L100 PolarHBondContact O-N 3.05Å; L100-I103 HydrophobicContact CD2-CD1 4.28Å; L100-I103 PolarHBondContact O-N 2.99Å; L100-E104 PolarHBondContact O-N 3.2Å
101	V	96.3	Very high	93.9	Very high	73 Å²	73	54.4 Å²	54.4	44%	0.442	26%	0.264	S	S	.	.	H	α-helix	trans	-64.3	-42.2	172	171.1	0	0	0	0	111.1	M97 L98 A99 I103 E104 R105	M97-V101 WeakPolarHBondContact O-CG2 3.3Å; M97-V101 PolarHBondContact O-N 3.11Å; L98-V101 WeakPolarHBondContact O-CA 3.44Å; L98-V101 WeakPolarHBondContact O-CB 3.19Å; L98-V101 PolarHBondContact O-N 3.36Å; L98-V101 VanDerWaalsContact O-N 3.11Å; A99-V101 VanDerWaalsContact C-N 3.29Å; A99-V101 PolarHBondContact O-N 3.41Å; V101-I103 PolarHBondContact O-N 2.86Å; V101-E104 PolarHBondContact O-N 2.95Å; V101-R105 HydrophobicContact CG1-CG 4.34Å; V101-R105 VanDerWaalsContact O-CG 3.3Å; V101-R105 WeakPolarHBondContact O-CG 3.36Å; V101-R105 PolarHBondContact O-N 3.4Å
102	Y	97.4	Very high	94.2	Very high	24 Å²	24	58.8 Å²	58.8	9%	0.094	29%	0.287	C	S	.	.	H	α-helix	trans	-59.4	-46.7	175.8	-65.7	-23.4	0	0	0	112	L98 A99 E104 R105 L106 V129 A130 F166 M170	L98-Y102 HydrophobicContact CD1-CD1 4.27Å; L98-Y102 HydrophobicContact CD1-CE1 3.63Å; L98-Y102 HydrophobicContact CD1-CE2 4.49Å; L98-Y102 HydrophobicContact CD2-CE2 4.37Å; L98-Y102 HydrophobicContact CG-CE1 4.03Å; L98-Y102 HydrophobicContact CG-CE2 3.98Å; L98-Y102 PolarHBondContact O-N 3.21Å; A99-Y102 WeakPolarHBondContact O-CB 3.36Å; A99-Y102 PolarHBondContact O-N 3Å; A99-Y102 VanDerWaalsContact O-N 3.12Å; Y102-E104 VanDerWaalsContact C-N 3.33Å; Y102-E104 PolarHBondContact O-N 3.49Å; Y102-R105 PolarHBondContact O-N 3.34Å; Y102-L106 VanDerWaalsContact O-CB 3.31Å; Y102-L106 WeakPolarHBondContact O-CB 3.23Å; Y102-L106 PolarHBondContact O-N 3.46Å; Y102-V129 HydrophobicContact CE2-CG1 3.99Å; Y102-A130 HydrophobicContact CD2-CB 4.37Å; Y102-A130 HydrophobicContact CE2-CB 3.91Å; Y102-F166 HydrophobicContact CD2-CE1 4.3Å; Y102-F166 HydrophobicContact CD2-CZ 4.32Å; Y102-M170 HydrophobicContact CD1-CE 3.48Å; Y102-M170 VanDerWaalsContact CD1-CE 3.48Å; Y102-M170 HydrophobicContact CE1-CE 4.29Å; Y102-M170 HydrophobicContact CG-CE 3.7Å
103	I	96.1	Very high	94.5	Very high	6 Å²	6	58.7 Å²	58.7	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-45	177.9	-64.4	150.9	0	0	0	110.5	L66 A69 A99 L100 V101 R105 L106 R107 L122	L66-I103 HydrophobicContact CD1-CD1 4.09Å; L66-I103 HydrophobicContact CD2-CD1 3.33Å; L66-I103 HydrophobicContact CD2-CG1 3.98Å; L66-I103 HydrophobicContact CD2-CG2 4.46Å; L66-I103 HydrophobicContact CG-CD1 3.75Å; A69-I103 HydrophobicContact CB-CG2 3.57Å; A99-I103 WeakPolarHBondContact O-CD1 3.46Å; A99-I103 WeakPolarHBondContact O-CG1 3.22Å; A99-I103 PolarHBondContact O-N 3Å; L100-I103 HydrophobicContact CD2-CD1 4.28Å; L100-I103 PolarHBondContact O-N 2.99Å; V101-I103 PolarHBondContact O-N 2.86Å; I103-R105 PolarHBondContact O-N 3.46Å; I103-L106 PolarHBondContact O-N 3.3Å; I103-R107 VanDerWaalsContact O-CG 3.31Å; I103-R107 WeakPolarHBondContact O-CG 3.48Å; I103-R107 PolarHBondContact O-N 3.49Å; I103-L122 HydrophobicContact CG1-CG 4.43Å
104	E	95.6	Very high	94.7	Very high	80 Å²	80	57.8 Å²	57.8	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-63.5	-41.6	178.8	-171.2	58.3	-157.6	0	0	111.7	L100 V101 Y102 L106 R107 H108	L100-E104 PolarHBondContact O-N 3.2Å; V101-E104 PolarHBondContact O-N 2.95Å; Y102-E104 VanDerWaalsContact C-N 3.33Å; Y102-E104 PolarHBondContact O-N 3.49Å; E104-L106 VanDerWaalsContact C-N 3.33Å; E104-L106 PolarHBondContact O-N 2.89Å; E104-R107 PolarHBondContact O-N 2.9Å; E104-R107 IonicContact OE1-NH1 3.9Å; E104-R107 IonicContact OE2-CZ 3.36Å; E104-R107 IonicContact OE2-NH1 2.67Å; E104-R107 PolarHBondContact OE2-NH1 2.93Å; E104-H108 PolarHBondContact O-CD2 3.11Å; E104-H108 IonicContact OE1-CD2 3.85Å; E104-H108 IonicContact OE1-CE1 3.84Å; E104-H108 IonicContact OE1-NE2 3.51Å; E104-H108 PolarHBondContact OE1-NE2 2.92Å
105	R	96	Very high	94.8	Very high	148 Å²	148	60 Å²	60	56%	0.558	28%	0.28	S	S	*	.	H	α-helix	trans	-62	-42.7	174.3	-70.6	-179.7	75.7	177.5	3.5	111.7	V101 Y102 I103 R107 H108 R109	V101-R105 HydrophobicContact CG1-CG 4.34Å; V101-R105 VanDerWaalsContact O-CG 3.3Å; V101-R105 WeakPolarHBondContact O-CG 3.36Å; V101-R105 PolarHBondContact O-N 3.4Å; Y102-R105 PolarHBondContact O-N 3.34Å; I103-R105 PolarHBondContact O-N 3.46Å; R105-R107 VanDerWaalsContact C-N 3.31Å; R105-R107 PolarHBondContact O-N 2.89Å; R105-H108 PolarHBondContact O-N 3.15Å; R105-R109 PolarHBondContact O-N 3.34Å
106	L	95.4	Very high	94.7	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.3	-35.8	-178.6	-165.6	57.8	0	0	0	112	Y102 I103 E104 H108 R109 N110 Y113 L114 L122 F166 A169 M170	Y102-L106 VanDerWaalsContact O-CB 3.31Å; Y102-L106 WeakPolarHBondContact O-CB 3.23Å; Y102-L106 PolarHBondContact O-N 3.46Å; I103-L106 PolarHBondContact O-N 3.3Å; E104-L106 VanDerWaalsContact C-N 3.33Å; E104-L106 PolarHBondContact O-N 2.89Å; L106-H108 PolarHBondContact O-N 3.19Å; L106-R109 PolarHBondContact O-N 3.46Å; L106-N110 HydrophobicContact CD1-CB 4.01Å; L106-N110 CarbonylContact O-C 3.3Å; L106-N110 VanDerWaalsContact O-C 3.3Å; L106-N110 PolarHBondContact O-N 3.16Å; L106-Y113 HydrophobicContact CD1-CD1 4.48Å; L106-Y113 HydrophobicContact CD2-CD1 3.53Å; L106-Y113 HydrophobicContact CD2-CE1 3.65Å; L106-Y113 HydrophobicContact CG-CD1 4.2Å; L106-L114 HydrophobicContact CD2-CD2 3.98Å; L106-L114 HydrophobicContact CG-CD2 4.3Å; L106-L114 HydrophobicContact CG-CG 4.4Å; L106-L122 HydrophobicContact CD2-CD1 4.47Å; L106-F166 HydrophobicContact CD2-CD2 4.13Å; L106-F166 HydrophobicContact CD2-CE2 3.87Å; L106-A169 HydrophobicContact CD1-CB 3.82Å; L106-A169 WeakPolarHBondContact CD1-O 3.29Å; L106-M170 HydrophobicContact CB-SD 3.95Å; L106-M170 HydrophobicContact CD1-CG 4.39Å; L106-M170 HydrophobicContact CD1-SD 4.03Å; L106-M170 HydrophobicContact CD2-SD 4.33Å; L106-M170 HydrophobicContact CG-SD 4.35Å
107	R	94.3	Very high	94.8	Very high	87 Å²	87	67.8 Å²	67.8	33%	0.328	32%	0.316	S	S	.	.	H	α-helix	trans	-57.8	-33.3	174.1	-73.3	174.1	71.5	-150.9	-5.4	113.3	A69 I103 E104 R105 L114	A69-R107 HydrophobicContact CB-CG 4.18Å; I103-R107 VanDerWaalsContact O-CG 3.31Å; I103-R107 WeakPolarHBondContact O-CG 3.48Å; I103-R107 PolarHBondContact O-N 3.49Å; E104-R107 PolarHBondContact O-N 2.9Å; E104-R107 IonicContact OE1-NH1 3.9Å; E104-R107 IonicContact OE2-CZ 3.36Å; E104-R107 IonicContact OE2-NH1 2.67Å; E104-R107 PolarHBondContact OE2-NH1 2.93Å; R105-R107 VanDerWaalsContact C-N 3.31Å; R105-R107 PolarHBondContact O-N 2.89Å; R107-L114 HydrophobicContact CB-CD1 4.07Å; R107-L114 HydrophobicContact CG-CD1 3.39Å
108	H	93.4	Very high	94.9	Very high	141 Å²	141	63.6 Å²	63.6	65%	0.653	30%	0.297	S	S	*	.	H	α-helix	trans	-88.5	-34.3	178.7	-62.8	-64.4	0	0	0	112.6	E104 R105 L106	E104-H108 PolarHBondContact O-CD2 3.11Å; E104-H108 IonicContact OE1-CD2 3.85Å; E104-H108 IonicContact OE1-CE1 3.84Å; E104-H108 IonicContact OE1-NE2 3.51Å; E104-H108 PolarHBondContact OE1-NE2 2.92Å; R105-H108 PolarHBondContact O-N 3.15Å; L106-H108 PolarHBondContact O-N 3.19Å
109	R	94.8	Very high	94.9	Very high	169 Å²	169	62 Å²	62	64%	0.638	29%	0.288	S	S	*	.	H	α-helix	trans	-86.8	-40.2	-174.2	-168.1	-178.7	-179.7	166.6	-5.6	113.8	R105 L106 M170	R105-R109 PolarHBondContact O-N 3.34Å; L106-R109 PolarHBondContact O-N 3.46Å; R109-M170 WeakPolarHBondContact CD-O 3.36Å; R109-M170 VanDerWaalsContact CZ-O 3.27Å; R109-M170 VanDerWaalsContact CZ-OXT 3.23Å; R109-M170 PolarHBondContact NE-O 3.11Å; R109-M170 PolarHBondContact NH1-O 2.69Å; R109-M170 PolarHBondContact NH1-OXT 3.15Å
110	N	95	Very high	94.9	Very high	50 Å²	50	62.5 Å²	62.5	27%	0.267	29%	0.291	S	S	.	.			trans	-147.9	74.3	-174.5	-168.5	-13.8	0	0	0	111.3	L106 D112 Y113	L106-N110 HydrophobicContact CD1-CB 4.01Å; L106-N110 CarbonylContact O-C 3.3Å; L106-N110 VanDerWaalsContact O-C 3.3Å; L106-N110 PolarHBondContact O-N 3.16Å; N110-D112 PolarHBondContact O-N 3.07Å; N110-Y113 PolarHBondContact O-N 2.88Å; N110-Y113 PolarHBondContact OD1-N 3.21Å; N110-Y113 VanDerWaalsContact OD1-N 3.1Å
111	P	93.7	Very high	95	Very high	66 Å²	66	62 Å²	62	43%	0.429	29%	0.289	S	S	.	.	H	α-helix	trans	-66.3	-24.2	178.3	27.8	-35.3	0	0	0	112.9	L114 Q115	P111-L114 WeakPolarHBondContact O-CB 3.33Å; P111-L114 PolarHBondContact O-N 3.18Å; P111-Q115 PolarHBondContact O-N 2.92Å
112	D	93.8	Very high	95.1	Very high	99 Å²	99	58.5 Å²	58.5	53%	0.529	27%	0.268	S	S	.	.	H	α-helix	trans	-67	-40.2	-179.8	-68.6	-19.9	0	0	0	111.5	N110 L114 Q115 H116	N110-D112 PolarHBondContact O-N 3.07Å; D112-L114 PolarHBondContact O-N 3.4Å; D112-Q115 WeakPolarHBondContact O-CB 3.48Å; D112-Q115 PolarHBondContact O-N 3.26Å; D112-Q115 VanDerWaalsContact O-N 3.11Å; D112-H116 PolarHBondContact O-CE1 3.43Å; D112-H116 PolarHBondContact O-ND1 3.18Å
113	Y	94.6	Very high	95.1	Very high	26 Å²	26	57.3 Å²	57.3	10%	0.102	26%	0.263	C	S	.	.	H	α-helix	trans	-54.9	-42.2	173.2	172.1	-98.3	0	0	0	112	L106 N110 Q115 H116 V117 L122 S165 F166 A169	L106-Y113 HydrophobicContact CD1-CD1 4.48Å; L106-Y113 HydrophobicContact CD2-CD1 3.53Å; L106-Y113 HydrophobicContact CD2-CE1 3.65Å; L106-Y113 HydrophobicContact CG-CD1 4.2Å; N110-Y113 PolarHBondContact O-N 2.88Å; N110-Y113 PolarHBondContact OD1-N 3.21Å; N110-Y113 VanDerWaalsContact OD1-N 3.1Å; Y113-Q115 PolarHBondContact O-N 3.23Å; Y113-H116 PolarHBondContact O-N 3.21Å; Y113-V117 HydrophobicContact CD1-CG1 4.22Å; Y113-V117 HydrophobicContact CE1-CB 4.18Å; Y113-V117 HydrophobicContact CE1-CG1 3.82Å; Y113-V117 PolarHBondContact O-N 3.2Å; Y113-L122 HydrophobicContact CE1-CD1 4.19Å; Y113-S165 WeakPolarHBondContact CE2-OG 3.38Å; Y113-F166 HydrophobicContact CE1-CD2 4.16Å; Y113-A169 HydrophobicContact CD1-CB 4.12Å; Y113-A169 HydrophobicContact CD2-CB 3.88Å; Y113-A169 HydrophobicContact CE2-CB 4.42Å; Y113-A169 HydrophobicContact CG-CB 3.71Å
114	L	94.2	Very high	95.2	Very high	6 Å²	6	57 Å²	57	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-66.4	-20.1	-178.9	-65.6	176.2	0	0	0	114	A69 L106 R107 P111 D112 H116 V117 L122	A69-L114 WeakPolarHBondContact O-CB 3.42Å; L106-L114 HydrophobicContact CD2-CD2 3.98Å; L106-L114 HydrophobicContact CG-CD2 4.3Å; L106-L114 HydrophobicContact CG-CG 4.4Å; R107-L114 HydrophobicContact CB-CD1 4.07Å; R107-L114 HydrophobicContact CG-CD1 3.39Å; P111-L114 WeakPolarHBondContact O-CB 3.33Å; P111-L114 PolarHBondContact O-N 3.18Å; D112-L114 PolarHBondContact O-N 3.4Å; L114-H116 VanDerWaalsContact C-N 3.3Å; L114-V117 HydrophobicContact CD2-CG1 4.39Å; L114-L122 HydrophobicContact CD2-CD1 4.19Å; L114-L122 HydrophobicContact CD2-CD2 3.55Å
115	Q	90.9	Very high	95.3	Very high	123 Å²	123	53.2 Å²	53.2	58%	0.575	24%	0.244	S	C	*	.	H	α-helix	trans	-74.5	-23.8	174.7	-59.2	-170.3	15.5	0	0	112.6	P111 D112 Y113	P111-Q115 PolarHBondContact O-N 2.92Å; D112-Q115 WeakPolarHBondContact O-CB 3.48Å; D112-Q115 PolarHBondContact O-N 3.26Å; D112-Q115 VanDerWaalsContact O-N 3.11Å; Y113-Q115 PolarHBondContact O-N 3.23Å
116	H	91.3	Very high	95.4	Very high	153 Å²	153	46.2 Å²	46.2	71%	0.708	22%	0.217	S	C	*	.	H	α-helix	trans	-103.2	-27.6	-171.5	-61	88.8	0	0	0	113.2	D112 Y113 L114	D112-H116 PolarHBondContact O-CE1 3.43Å; D112-H116 PolarHBondContact O-ND1 3.18Å; Y113-H116 PolarHBondContact O-N 3.21Å; L114-H116 VanDerWaalsContact C-N 3.3Å
117	V	94.8	Very high	95.5	Very high	12 Å²	12	46.2 Å²	46.2	7%	0.073	22%	0.217	C	C	.	.	S	Bend	trans	-82.6	142.2	177.2	70.8	0	0	0	0	111.1	A70 Y113 L114 D121 L122	A70-V117 HydrophobicContact CB-CG1 4.36Å; Y113-V117 HydrophobicContact CD1-CG1 4.22Å; Y113-V117 HydrophobicContact CE1-CB 4.18Å; Y113-V117 HydrophobicContact CE1-CG1 3.82Å; Y113-V117 PolarHBondContact O-N 3.2Å; L114-V117 HydrophobicContact CD2-CG1 4.39Å; V117-D121 HydrophobicContact CG2-CB 4.14Å; V117-L122 HydrophobicContact CG1-CB 4.14Å; V117-L122 HydrophobicContact CG1-CD1 4.21Å; V117-L122 HydrophobicContact CG1-CD2 4.31Å; V117-L122 HydrophobicContact CG1-CG 4.46Å; V117-L122 HydrophobicContact CG2-CB 4.16Å
118	S	96.3	Very high	95.6	Very high	7 Å²	7	42 Å²	42	5%	0.049	20%	0.202	C	C	.	.			trans	-74.6	151.2	172.4	79.4	0	0	0	0	111	I74 S120 D121 L122	I74-S118 VanDerWaalsContact O-CB 3.25Å; I74-S118 WeakPolarHBondContact O-CB 3.34Å; S118-S120 PolarHBondContact O-N 2.96Å; S118-D121 PolarHBondContact O-N 3.45Å; S118-D121 VanDerWaalsContact OG-CB 3.3Å; S118-D121 WeakPolarHBondContact OG-CB 3.3Å; S118-D121 PolarHBondContact OG-N 3.2Å; S118-D121 PolarHBondContact OG-OD2 3.37Å; S118-L122 VanDerWaalsContact O-CB 3.25Å; S118-L122 WeakPolarHBondContact O-CB 3.17Å; S118-L122 PolarHBondContact O-N 2.89Å
119	S	97	Very high	95.8	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.6	-26.8	176	43	0	0	0	0	113	R76 L77 F123	R76-S119 WeakPolarHBondContact CA-OG 3.34Å; L77-S119 PolarHBondContact N-OG 3.06Å; S119-F123 WeakPolarHBondContact O-CB 3.38Å; S119-F123 PolarHBondContact O-N 3.46Å
120	S	97.3	Very high	95.9	Very high	11 Å²	11	28 Å²	28	8%	0.077	14%	0.144	C	C	.	.	H	α-helix	trans	-72	-44.2	173.4	-56.4	0	0	0	0	112.6	R75 L77 S118 L122 F123 L124	R75-S120 VanDerWaalsContact O-CB 3.23Å; R75-S120 WeakPolarHBondContact O-CB 3.46Å; R75-S120 PolarHBondContact O-N 2.69Å; R75-S120 PolarHBondContact O-OG 3.47Å; L77-S120 WeakPolarHBondContact CA-OG 3.29Å; L77-S120 PolarHBondContact N-OG 2.71Å; S118-S120 PolarHBondContact O-N 2.96Å; S120-L122 VanDerWaalsContact C-N 3.35Å; S120-F123 WeakPolarHBondContact O-CB 3.44Å; S120-F123 PolarHBondContact O-N 3.24Å; S120-L124 PolarHBondContact O-N 3.01Å
121	D	96.9	Very high	96	Very high	20 Å²	20	25.6 Å²	25.6	11%	0.107	13%	0.132	C	C	.	.	H	α-helix	trans	-68.6	-38.6	177.8	-65.1	-42.3	0	0	0	110.6	R75 V117 S118 F123 L124 I125 L162	R75-D121 IonicContact CZ-OD1 3.12Å; R75-D121 VanDerWaalsContact CZ-OD1 3.25Å; R75-D121 IonicContact CZ-OD2 2.74Å; R75-D121 VanDerWaalsContact NH1-CG 3.28Å; R75-D121 IonicContact NH1-OD1 2.78Å; R75-D121 PolarHBondContact NH1-OD1 2.89Å; R75-D121 IonicContact NH1-OD2 2.92Å; R75-D121 PolarHBondContact NH1-OD2 3.43Å; R75-D121 VanDerWaalsContact NH1-OD2 3.12Å; R75-D121 IonicContact NH2-OD1 2.78Å; R75-D121 PolarHBondContact NH2-OD1 3.49Å; V117-D121 HydrophobicContact CG2-CB 4.14Å; S118-D121 PolarHBondContact O-N 3.45Å; S118-D121 VanDerWaalsContact OG-CB 3.3Å; S118-D121 WeakPolarHBondContact OG-CB 3.3Å; S118-D121 PolarHBondContact OG-N 3.2Å; S118-D121 PolarHBondContact OG-OD2 3.37Å; D121-F123 PolarHBondContact O-N 3.45Å; D121-L124 PolarHBondContact O-N 3.28Å; D121-I125 WeakPolarHBondContact O-CB 3.48Å; D121-I125 VanDerWaalsContact O-CG2 3.25Å; D121-I125 WeakPolarHBondContact O-CG2 3.43Å; D121-I125 PolarHBondContact O-N 2.96Å; D121-L162 HydrophobicContact CB-CD1 3.92Å; D121-L162 HydrophobicContact CB-CD2 4.09Å
122	L	97.4	Very high	96.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.2	-42.7	175.6	-175.7	62.3	0	0	0	111.6	L66 A70 I103 L106 Y113 L114 V117 S118 S120 S126 F166	L66-L122 HydrophobicContact CD2-CB 4.1Å; L66-L122 HydrophobicContact CD2-CD2 3.6Å; L66-L122 HydrophobicContact CD2-CG 3.62Å; A70-L122 HydrophobicContact CB-CD2 3.76Å; I103-L122 HydrophobicContact CG1-CG 4.43Å; L106-L122 HydrophobicContact CD2-CD1 4.47Å; Y113-L122 HydrophobicContact CE1-CD1 4.19Å; L114-L122 HydrophobicContact CD2-CD1 4.19Å; L114-L122 HydrophobicContact CD2-CD2 3.55Å; V117-L122 HydrophobicContact CG1-CB 4.14Å; V117-L122 HydrophobicContact CG1-CD1 4.21Å; V117-L122 HydrophobicContact CG1-CD2 4.31Å; V117-L122 HydrophobicContact CG1-CG 4.46Å; V117-L122 HydrophobicContact CG2-CB 4.16Å; S118-L122 VanDerWaalsContact O-CB 3.25Å; S118-L122 WeakPolarHBondContact O-CB 3.17Å; S118-L122 PolarHBondContact O-N 2.89Å; S120-L122 VanDerWaalsContact C-N 3.35Å; L122-S126 WeakPolarHBondContact O-CB 3.43Å; L122-S126 PolarHBondContact O-N 3.37Å; L122-S126 PolarHBondContact O-OG 3.15Å; L122-F166 HydrophobicContact CD1-CD2 4.09Å; L122-F166 HydrophobicContact CD1-CE2 3.87Å
123	F	97.9	Very high	96.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.2	-56.8	172.6	174.3	-107.6	0	0	0	111.1	T62 L66 L77 Y81 V82 V85 I91 M96 S119 S120 D121 I125 S126 M127	T62-F123 HydrophobicContact CG2-CD2 3.96Å; T62-F123 HydrophobicContact CG2-CE2 3.89Å; L66-F123 HydrophobicContact CD1-CB 3.84Å; L66-F123 HydrophobicContact CD1-CD2 3.6Å; L66-F123 HydrophobicContact CD1-CG 4.16Å; L77-F123 HydrophobicContact CD1-CB 3.71Å; L77-F123 HydrophobicContact CD1-CD1 3.94Å; L77-F123 HydrophobicContact CD1-CG 3.85Å; L77-F123 HydrophobicContact CD2-CB 3.98Å; L77-F123 HydrophobicContact CD2-CD2 4.4Å; L77-F123 HydrophobicContact CD2-CG 4.22Å; L77-F123 HydrophobicContact CG-CB 4.49Å; Y81-F123 HydrophobicContact CD1-CD1 4.22Å; Y81-F123 HydrophobicContact CE1-CD1 4.15Å; V82-F123 HydrophobicContact CB-CE1 4.42Å; V82-F123 HydrophobicContact CB-CE2 4.48Å; V82-F123 HydrophobicContact CB-CZ 4.12Å; V82-F123 HydrophobicContact CG1-CE2 3.93Å; V82-F123 HydrophobicContact CG1-CZ 3.75Å; V82-F123 HydrophobicContact CG2-CD1 4.44Å; V82-F123 HydrophobicContact CG2-CD2 4.35Å; V82-F123 HydrophobicContact CG2-CE1 4.25Å; V82-F123 HydrophobicContact CG2-CE2 4.15Å; V82-F123 HydrophobicContact CG2-CG 4.49Å; V82-F123 HydrophobicContact CG2-CZ 4.11Å; V85-F123 HydrophobicContact CB-CE1 3.9Å; V85-F123 HydrophobicContact CG1-CE1 3.96Å; V85-F123 HydrophobicContact CG2-CE1 4.41Å; I91-F123 HydrophobicContact CD1-CZ 4.45Å; M96-F123 HydrophobicContact CE-CE2 4.1Å; M96-F123 HydrophobicContact CE-CZ 4.47Å; M96-F123 HydrophobicContact SD-CE2 4.43Å; S119-F123 WeakPolarHBondContact O-CB 3.38Å; S119-F123 PolarHBondContact O-N 3.46Å; S120-F123 WeakPolarHBondContact O-CB 3.44Å; S120-F123 PolarHBondContact O-N 3.24Å; D121-F123 PolarHBondContact O-N 3.45Å; F123-I125 VanDerWaalsContact C-N 3.33Å; F123-I125 PolarHBondContact O-N 3.45Å; F123-S126 PolarHBondContact O-N 3.07Å; F123-S126 PolarHBondContact O-OG 2.92Å; F123-M127 HydrophobicContact CD2-CE 4Å; F123-M127 HydrophobicContact CD2-CG 4.03Å; F123-M127 HydrophobicContact CE2-CE 3.76Å; F123-M127 HydrophobicContact CE2-CG 3.71Å; F123-M127 HydrophobicContact CE2-SD 4.24Å; F123-M127 HydrophobicContact CZ-CG 3.98Å; F123-M127 WeakPolarHBondContact O-CB 3.38Å; F123-M127 WeakPolarHBondContact O-CG 3.41Å; F123-M127 PolarHBondContact O-N 3.19Å
124	L	97.9	Very high	96.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-57.1	-47.7	-175.7	-178.7	66	0	0	0	111.3	V85 S120 D121 M128 W148 V154 L159	V85-L124 HydrophobicContact CG1-CD1 3.83Å; V85-L124 HydrophobicContact CG2-CD1 4.46Å; S120-L124 PolarHBondContact O-N 3.01Å; D121-L124 PolarHBondContact O-N 3.28Å; L124-M128 WeakPolarHBondContact O-CB 3.36Å; L124-M128 PolarHBondContact O-N 3.39Å; L124-W148 HydrophobicContact CD1-CE3 3.93Å; L124-W148 HydrophobicContact CD1-CZ3 4.44Å; L124-V154 HydrophobicContact CD2-CB 4.21Å; L124-V154 HydrophobicContact CD2-CG2 3.78Å; L124-L159 HydrophobicContact CD2-CD1 3.64Å; L124-L159 HydrophobicContact CG-CD1 4.05Å
125	I	97.8	Very high	95.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-74	-37.3	-175.2	-160.1	64.6	0	0	0	113.3	D121 F123 M127 M128 V129 L159 L162 E163 F166	D121-I125 WeakPolarHBondContact O-CB 3.48Å; D121-I125 VanDerWaalsContact O-CG2 3.25Å; D121-I125 WeakPolarHBondContact O-CG2 3.43Å; D121-I125 PolarHBondContact O-N 2.96Å; F123-I125 VanDerWaalsContact C-N 3.33Å; F123-I125 PolarHBondContact O-N 3.45Å; I125-M127 VanDerWaalsContact C-N 3.31Å; I125-M127 PolarHBondContact O-N 3.28Å; I125-M128 HydrophobicContact CD1-CE 3.42Å; I125-M128 VanDerWaalsContact CD1-CE 3.42Å; I125-M128 HydrophobicContact CD1-SD 4.21Å; I125-M128 PolarHBondContact O-N 2.89Å; I125-V129 HydrophobicContact CG1-CG2 4.32Å; I125-V129 WeakPolarHBondContact O-CB 3.39Å; I125-V129 VanDerWaalsContact O-CG2 3.29Å; I125-V129 WeakPolarHBondContact O-CG2 3.28Å; I125-V129 PolarHBondContact O-N 3.44Å; I125-L159 HydrophobicContact CD1-CD1 4.21Å; I125-L159 HydrophobicContact CD1-CG 4.48Å; I125-L162 HydrophobicContact CB-CB 4.41Å; I125-L162 HydrophobicContact CD1-CB 4.03Å; I125-L162 HydrophobicContact CG1-CB 4.11Å; I125-E163 VanDerWaalsContact CD1-CA 3.48Å; I125-E163 HydrophobicContact CD1-CB 3.76Å; I125-E163 HydrophobicContact CD1-CG 4.39Å; I125-F166 HydrophobicContact CG1-CB 4Å; I125-F166 HydrophobicContact CG1-CG 4.31Å; I125-F166 HydrophobicContact CG2-CB 4.06Å; I125-F166 HydrophobicContact CG2-CD2 3.76Å; I125-F166 HydrophobicContact CG2-CE2 4.36Å; I125-F166 HydrophobicContact CG2-CG 3.91Å
126	S	97.8	Very high	95.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.2	-38	176.6	59.6	0	0	0	0	111.6	A99 L122 F123 A130	A99-S126 WeakPolarHBondContact CB-O 3.31Å; L122-S126 WeakPolarHBondContact O-CB 3.43Å; L122-S126 PolarHBondContact O-N 3.37Å; L122-S126 PolarHBondContact O-OG 3.15Å; F123-S126 PolarHBondContact O-N 3.07Å; F123-S126 PolarHBondContact O-OG 2.92Å; S126-A130 VanDerWaalsContact O-CB 3.23Å; S126-A130 WeakPolarHBondContact O-CB 3.24Å; S126-A130 PolarHBondContact O-N 3.37Å
127	M	97.4	Very high	95.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.4	-47.8	174.8	-68.1	-60.8	144.5	0	0	111.8	I91 M96 A99 F123 I125 V129 A130 S131 W148	I91-M127 HydrophobicContact CD1-CB 3.81Å; I91-M127 HydrophobicContact CD1-CG 3.84Å; I91-M127 HydrophobicContact CD1-SD 4.24Å; I91-M127 HydrophobicContact CG2-SD 4.06Å; M96-M127 HydrophobicContact CB-SD 4.44Å; M96-M127 HydrophobicContact CE-CE 4.01Å; M96-M127 HydrophobicContact CE-SD 3.99Å; M96-M127 HydrophobicContact CG-CE 4.42Å; M96-M127 HydrophobicContact SD-CE 3.24Å; M96-M127 WeakPolarHBondContact SD-CE 3.4Å; M96-M127 HydrophobicContact SD-SD 3.9Å; A99-M127 HydrophobicContact CB-CE 3.25Å; A99-M127 HydrophobicContact CB-CG 4.46Å; A99-M127 HydrophobicContact CB-SD 3.64Å; F123-M127 HydrophobicContact CD2-CE 4Å; F123-M127 HydrophobicContact CD2-CG 4.03Å; F123-M127 HydrophobicContact CE2-CE 3.76Å; F123-M127 HydrophobicContact CE2-CG 3.71Å; F123-M127 HydrophobicContact CE2-SD 4.24Å; F123-M127 HydrophobicContact CZ-CG 3.98Å; F123-M127 WeakPolarHBondContact O-CB 3.38Å; F123-M127 WeakPolarHBondContact O-CG 3.41Å; F123-M127 PolarHBondContact O-N 3.19Å; I125-M127 VanDerWaalsContact C-N 3.31Å; I125-M127 PolarHBondContact O-N 3.28Å; M127-V129 PolarHBondContact O-N 2.91Å; M127-A130 PolarHBondContact O-N 3.1Å; M127-S131 PolarHBondContact O-N 3.21Å; M127-S131 PolarHBondContact O-OG 3.13Å; M127-S131 VanDerWaalsContact O-OG 3.11Å; M127-W148 HydrophobicContact CB-CH2 3.68Å; M127-W148 HydrophobicContact CB-CZ3 3.5Å; M127-W148 VanDerWaalsContact CB-CZ3 3.5Å
128	M	97.6	Very high	94.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.2	-48.1	179.5	-172.4	-169.7	83.6	0	0	111.8	L124 I125 A130 S131 K132 V143 N145 W148 L159 E163	L124-M128 WeakPolarHBondContact O-CB 3.36Å; L124-M128 PolarHBondContact O-N 3.39Å; I125-M128 HydrophobicContact CD1-CE 3.42Å; I125-M128 VanDerWaalsContact CD1-CE 3.42Å; I125-M128 HydrophobicContact CD1-SD 4.21Å; I125-M128 PolarHBondContact O-N 2.89Å; M128-A130 VanDerWaalsContact C-N 3.33Å; M128-A130 PolarHBondContact O-N 3.4Å; M128-S131 PolarHBondContact O-N 3.27Å; M128-K132 PolarHBondContact O-N 2.66Å; M128-V143 HydrophobicContact CG-CG1 3.97Å; M128-N145 WeakPolarHBondContact CE-OD1 3.37Å; M128-N145 PolarHBondContact SD-OD1 3.05Å; M128-W148 HydrophobicContact CB-CD2 3.72Å; M128-W148 HydrophobicContact CB-CE3 3.49Å; M128-W148 VanDerWaalsContact CB-CE3 3.49Å; M128-W148 HydrophobicContact CB-CG 4.23Å; M128-W148 HydrophobicContact CB-CH2 4.45Å; M128-W148 HydrophobicContact CB-CZ3 3.9Å; M128-W148 HydrophobicContact CG-CB 4.01Å; M128-W148 HydrophobicContact CG-CD2 3.69Å; M128-W148 HydrophobicContact CG-CE3 4.01Å; M128-W148 HydrophobicContact CG-CG 3.7Å; M128-W148 VanDerWaalsContact N-CZ3 3.26Å; M128-W148 HydrophobicContact SD-CB 3.96Å; M128-W148 HydrophobicContact SD-CG 4.31Å; M128-L159 HydrophobicContact SD-CD1 4.32Å; M128-L159 HydrophobicContact SD-CD2 3.45Å; M128-L159 WeakPolarHBondContact SD-CD2 3.13Å; M128-L159 HydrophobicContact SD-CG 3.83Å; M128-E163 HydrophobicContact CE-CB 3.93Å; M128-E163 VanDerWaalsContact CE-CD 3.4Å; M128-E163 HydrophobicContact CE-CG 3.73Å; M128-E163 WeakPolarHBondContact CE-OE1 3.39Å
129	V	97.6	Very high	94.5	Very high	14 Å²	14	42.4 Å²	42.4	9%	0.085	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-37.5	179.4	171.7	0	0	0	0	111.2	Y102 I125 M127 Y133 E163 F166 L167	Y102-V129 HydrophobicContact CE2-CG1 3.99Å; I125-V129 HydrophobicContact CG1-CG2 4.32Å; I125-V129 WeakPolarHBondContact O-CB 3.39Å; I125-V129 VanDerWaalsContact O-CG2 3.29Å; I125-V129 WeakPolarHBondContact O-CG2 3.28Å; I125-V129 PolarHBondContact O-N 3.44Å; M127-V129 PolarHBondContact O-N 2.91Å; V129-Y133 WeakPolarHBondContact O-CB 3.34Å; V129-Y133 PolarHBondContact O-N 3.47Å; V129-Y133 VanDerWaalsContact O-N 3.07Å; V129-E163 HydrophobicContact CG2-CG 4.22Å; V129-F166 HydrophobicContact CB-CD1 4.33Å; V129-F166 HydrophobicContact CB-CE1 4.13Å; V129-F166 HydrophobicContact CG1-CD1 4.36Å; V129-F166 HydrophobicContact CG1-CE1 4.07Å; V129-F166 HydrophobicContact CG2-CD1 3.95Å; V129-F166 HydrophobicContact CG2-CE1 4.26Å; V129-L167 HydrophobicContact CG1-CD2 3.78Å; V129-L167 HydrophobicContact CG2-CD2 4.42Å
130	A	97.6	Very high	93.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.2	-41.7	174.7	0	0	0	0	0	112	A95 L98 A99 Y102 S126 M127 M128 Y133 L134	A95-A130 HydrophobicContact CB-CB 4.47Å; L98-A130 HydrophobicContact CB-CB 4.09Å; L98-A130 HydrophobicContact CD2-CB 3.96Å; L98-A130 HydrophobicContact CG-CB 3.97Å; A99-A130 HydrophobicContact CB-CB 4Å; Y102-A130 HydrophobicContact CD2-CB 4.37Å; Y102-A130 HydrophobicContact CE2-CB 3.91Å; S126-A130 VanDerWaalsContact O-CB 3.23Å; S126-A130 WeakPolarHBondContact O-CB 3.24Å; S126-A130 PolarHBondContact O-N 3.37Å; M127-A130 PolarHBondContact O-N 3.1Å; M128-A130 VanDerWaalsContact C-N 3.33Å; M128-A130 PolarHBondContact O-N 3.4Å; A130-Y133 WeakPolarHBondContact O-CB 3.43Å; A130-Y133 PolarHBondContact O-N 3.3Å; A130-L134 VanDerWaalsContact O-CG 3.3Å; A130-L134 WeakPolarHBondContact O-CG 3.38Å; A130-L134 PolarHBondContact O-N 3.49Å; A130-L134 VanDerWaalsContact O-N 3.15Å
131	S	95.4	Very high	93.1	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-65.7	-44.2	176.8	-60.6	0	0	0	0	111.7	M127 M128 Y133 L134 Y135 W148	M127-S131 PolarHBondContact O-N 3.21Å; M127-S131 PolarHBondContact O-OG 3.13Å; M127-S131 VanDerWaalsContact O-OG 3.11Å; M128-S131 PolarHBondContact O-N 3.27Å; S131-Y133 PolarHBondContact O-N 2.94Å; S131-L134 PolarHBondContact O-N 2.91Å; S131-Y135 VanDerWaalsContact O-CD2 3.26Å; S131-Y135 WeakPolarHBondContact O-CD2 3.22Å; S131-Y135 PolarHBondContact O-N 2.93Å; S131-W148 WeakPolarHBondContact OG-CZ2 3.12Å
132	K	95.6	Very high	92.7	Very high	74 Å²	74	58.1 Å²	58.1	32%	0.322	29%	0.286	S	S	.	.	H	α-helix	trans	-58	-31.6	172.2	-76.8	-173.5	176.3	-170.8	0	113.9	M128 L134 V143 N145 E163	M128-K132 PolarHBondContact O-N 2.66Å; K132-L134 VanDerWaalsContact C-N 3.35Å; K132-V143 HydrophobicContact CD-CG1 4.35Å; K132-V143 WeakPolarHBondContact CE-O 3.27Å; K132-V143 HydrophobicContact CG-CB 3.62Å; K132-V143 HydrophobicContact CG-CG1 3.5Å; K132-V143 VanDerWaalsContact CG-CG1 3.5Å; K132-V143 HydrophobicContact CG-CG2 4.5Å; K132-N145 WeakPolarHBondContact CE-OD1 3.26Å; K132-N145 PolarHBondContact NZ-OD1 2.95Å; K132-E163 IonicContact NZ-OE1 3.25Å; K132-E163 PolarHBondContact NZ-OE1 3.13Å; K132-E163 IonicContact NZ-OE2 3.64Å
133	Y	95.4	Very high	92.4	Very high	170 Å²	170	59 Å²	59	67%	0.667	29%	0.291	S	S	*	.	H	α-helix	trans	-75.4	-27.6	177.4	179.6	-89.7	0	0	0	112.3	L98 V129 A130 S131	L98-Y133 HydrophobicContact CD2-CD1 3.5Å; L98-Y133 VanDerWaalsContact CD2-CD1 3.5Å; L98-Y133 HydrophobicContact CD2-CE1 4.25Å; L98-Y133 HydrophobicContact CD2-CG 4.18Å; V129-Y133 WeakPolarHBondContact O-CB 3.34Å; V129-Y133 PolarHBondContact O-N 3.47Å; V129-Y133 VanDerWaalsContact O-N 3.07Å; A130-Y133 WeakPolarHBondContact O-CB 3.43Å; A130-Y133 PolarHBondContact O-N 3.3Å; S131-Y133 PolarHBondContact O-N 2.94Å
134	L	93.7	Very high	92.2	Very high	58 Å²	58	63.1 Å²	63.1	30%	0.304	31%	0.309	S	S	.	.	H	α-helix	trans	-96.1	-27.2	-173.8	-71.4	171.9	0	0	0	113.7	C94 A95 L98 A130 S131 K132	C94-L134 HydrophobicContact CB-CD1 4.2Å; A95-L134 VanDerWaalsContact CA-CD1 3.47Å; A95-L134 HydrophobicContact CB-CD1 3.85Å; L98-L134 HydrophobicContact CD2-CD1 4.04Å; L98-L134 HydrophobicContact CD2-CD2 4.11Å; L98-L134 HydrophobicContact CD2-CG 3.85Å; A130-L134 VanDerWaalsContact O-CG 3.3Å; A130-L134 WeakPolarHBondContact O-CG 3.38Å; A130-L134 PolarHBondContact O-N 3.49Å; A130-L134 VanDerWaalsContact O-N 3.15Å; S131-L134 PolarHBondContact O-N 2.91Å; K132-L134 VanDerWaalsContact C-N 3.35Å
135	Y	91.1	Very high	92.1	Very high	59 Å²	59	64 Å²	64	23%	0.231	31%	0.314	C	S	.	.	S	Bend	trans	-108	132	-176.9	-51.9	-46.5	0	0	0	110.1	S92 S131 E141 V143	S92-Y135 WeakPolarHBondContact CB-OH 3.3Å; S92-Y135 PolarHBondContact OG-OH 3.29Å; S92-Y135 VanDerWaalsContact OG-OH 3.07Å; S131-Y135 VanDerWaalsContact O-CD2 3.26Å; S131-Y135 WeakPolarHBondContact O-CD2 3.22Å; S131-Y135 PolarHBondContact O-N 2.93Å; Y135-E141 WeakPolarHBondContact CB-O 3.27Å; Y135-E141 HydrophobicContact CD1-CB 4.1Å; Y135-E141 HydrophobicContact CD2-CB 4.11Å; Y135-E141 WeakPolarHBondContact CD2-O 3.38Å; Y135-E141 HydrophobicContact CE1-CB 4.49Å; Y135-E141 HydrophobicContact CE2-CB 4.48Å; Y135-E141 HydrophobicContact CG-CB 3.91Å; Y135-V143 HydrophobicContact CD2-CG2 3.85Å
136	D	88.2	Confident	92	Very high	122 Å²	122	68.5 Å²	68.5	65%	0.652	34%	0.338	S	S	*	.			trans	-80	153.6	-175.8	-68.4	-43.7	0	0	0	111.6	E139	D136-E139 HydrophobicContact CB-CG 4.15Å
137	E	84.1	Confident	91.9	Very high	183 Å²	183	73.7 Å²	73.7	86%	0.855	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	132.8	175.4	-65.1	-179.6	178.2	0	0	110.7
138	G	83.4	Confident	91.9	Very high	63 Å²	63	74.2 Å²	74.2	65%	0.649	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	0.5	-179.5	0	0	0	0	0	115.9	E142	G138-E142 PolarHBondContact N-OE2 3.05Å
139	E	87.7	Confident	91.8	Very high	115 Å²	115	74.3 Å²	74.3	54%	0.537	37%	0.365	S	S	.	.	S	Bend	trans	-88.5	163.8	170.9	-64.7	-61.1	147	0	0	111.7	D136 E141 E142	D136-E139 HydrophobicContact CB-CG 4.15Å; E139-E141 PolarHBondContact O-N 3.4Å; E139-E142 WeakPolarHBondContact O-CB 3.36Å; E139-E142 PolarHBondContact O-N 2.94Å; E139-E142 VanDerWaalsContact O-N 3.11Å
140	E	81.5	Confident	91.8	Very high	193 Å²	193	77.4 Å²	77.4	90%	0.902	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.8	-178.7	-66.4	-173	175.7	0	0	112.5
141	E	82.4	Confident	91.7	Very high	108 Å²	108	77.9 Å²	77.9	51%	0.505	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	16.2	178.9	-51.3	91.6	156	0	0	114.1	Y135 E139 V143	Y135-E141 WeakPolarHBondContact CB-O 3.27Å; Y135-E141 HydrophobicContact CD1-CB 4.1Å; Y135-E141 HydrophobicContact CD2-CB 4.11Å; Y135-E141 WeakPolarHBondContact CD2-O 3.38Å; Y135-E141 HydrophobicContact CE1-CB 4.49Å; Y135-E141 HydrophobicContact CE2-CB 4.48Å; Y135-E141 HydrophobicContact CG-CB 3.91Å; E139-E141 PolarHBondContact O-N 3.4Å; E141-V143 PolarHBondContact O-N 3.32Å
142	E	89.9	Confident	91.7	Very high	61 Å²	61	78 Å²	78	29%	0.285	40%	0.398	S	S	.	.			trans	-53.6	139.5	174.6	-174.3	175.1	171.5	0	0	111.2	G138 E139 F144	G138-E142 PolarHBondContact N-OE2 3.05Å; E139-E142 WeakPolarHBondContact O-CB 3.36Å; E139-E142 PolarHBondContact O-N 2.94Å; E139-E142 VanDerWaalsContact O-N 3.11Å; E142-F144 HydrophobicContact CB-CE2 4.01Å; E142-F144 HydrophobicContact CB-CZ 4.12Å; E142-F144 HydrophobicContact CG-CE1 4.11Å; E142-F144 HydrophobicContact CG-CE2 3.88Å; E142-F144 HydrophobicContact CG-CZ 3.59Å; E142-F144 WeakPolarHBondContact OE1-CE1 3.28Å; E142-F144 WeakPolarHBondContact OE1-CZ 3.26Å
143	V	91.4	Very high	91.7	Very high	17 Å²	17	77.7 Å²	77.7	10%	0.103	42%	0.416	C	S	.	.			trans	-106.2	112.9	-170.5	172.5	0	0	0	0	111.9	M128 K132 Y135 E141 W148	M128-V143 HydrophobicContact CG-CG1 3.97Å; K132-V143 HydrophobicContact CD-CG1 4.35Å; K132-V143 WeakPolarHBondContact CE-O 3.27Å; K132-V143 HydrophobicContact CG-CB 3.62Å; K132-V143 HydrophobicContact CG-CG1 3.5Å; K132-V143 VanDerWaalsContact CG-CG1 3.5Å; K132-V143 HydrophobicContact CG-CG2 4.5Å; Y135-V143 HydrophobicContact CD2-CG2 3.85Å; E141-V143 PolarHBondContact O-N 3.32Å; V143-W148 HydrophobicContact CG1-CG 4.35Å; V143-W148 VanDerWaalsContact CG1-NE1 3.33Å
144	F	93.7	Very high	91.7	Very high	87 Å²	87	70.3 Å²	70.3	38%	0.382	39%	0.388	S	S	.	.			trans	-104.3	143.3	175.7	-55.1	-79.4	0	0	0	113.2	E142 D146 E147 W148	E142-F144 HydrophobicContact CB-CE2 4.01Å; E142-F144 HydrophobicContact CB-CZ 4.12Å; E142-F144 HydrophobicContact CG-CE1 4.11Å; E142-F144 HydrophobicContact CG-CE2 3.88Å; E142-F144 HydrophobicContact CG-CZ 3.59Å; E142-F144 WeakPolarHBondContact OE1-CE1 3.28Å; E142-F144 WeakPolarHBondContact OE1-CZ 3.26Å; F144-D146 VanDerWaalsContact C-N 3.32Å; F144-D146 WeakPolarHBondContact CB-OD1 3.49Å; F144-D146 PolarHBondContact O-N 3.18Å; F144-E147 HydrophobicContact CB-CG 4.23Å; F144-E147 PolarHBondContact O-N 3.47Å; F144-W148 PolarHBondContact O-N 2.85Å
145	N	95.5	Very high	91.9	Very high	20 Å²	20	70.6 Å²	70.6	11%	0.107	40%	0.399	C	S	.	.	H	α-helix	trans	-71	-26.6	-177.2	-75.2	14.2	0	0	0	113.1	M128 K132 G149 V156 L159 N160 E163	M128-N145 WeakPolarHBondContact CE-OD1 3.37Å; M128-N145 PolarHBondContact SD-OD1 3.05Å; K132-N145 WeakPolarHBondContact CE-OD1 3.26Å; K132-N145 PolarHBondContact NZ-OD1 2.95Å; N145-G149 PolarHBondContact O-N 3.23Å; N145-V156 HydrophobicContact CB-CG1 4.32Å; N145-L159 HydrophobicContact CB-CD2 4.09Å; N145-L159 WeakPolarHBondContact O-CD2 3.15Å; N145-N160 PolarHBondContact ND2-OD1 3.35Å; N145-E163 PolarHBondContact ND2-OE2 3.5Å
146	D	96.1	Very high	92.2	Very high	94 Å²	94	70.6 Å²	70.6	50%	0.503	41%	0.405	S	S	.	.	H	α-helix	trans	-71.2	-41.7	176	56.1	-16.9	0	0	0	112	F144 G149 A150 V156	F144-D146 VanDerWaalsContact C-N 3.32Å; F144-D146 WeakPolarHBondContact CB-OD1 3.49Å; F144-D146 PolarHBondContact O-N 3.18Å; D146-G149 PolarHBondContact O-N 3.47Å; D146-A150 PolarHBondContact O-N 3.01Å; D146-V156 HydrophobicContact CB-CG1 4.48Å; D146-V156 HydrophobicContact CB-CG2 3.84Å
147	E	95.3	Very high	92.7	Very high	109 Å²	109	68.3 Å²	68.3	51%	0.509	40%	0.403	S	S	.	.	H	α-helix	trans	-62.3	-47.9	173.8	-64.5	179.3	170.4	0	0	111.9	F144 G149 A150 A151	F144-E147 HydrophobicContact CB-CG 4.23Å; F144-E147 PolarHBondContact O-N 3.47Å; E147-G149 VanDerWaalsContact C-N 3.29Å; E147-G149 PolarHBondContact O-N 3.4Å; E147-A150 WeakPolarHBondContact O-CB 3.4Å; E147-A150 PolarHBondContact O-N 3.35Å; E147-A150 VanDerWaalsContact O-N 3.15Å; E147-A151 PolarHBondContact O-N 2.97Å
148	W	96.3	Very high	93.3	Very high	10 Å²	10	62.9 Å²	62.9	4%	0.038	38%	0.382	C	S	.	.	H	α-helix	trans	-67.5	-31.3	176.3	-82.4	71	0	0	0	112.8	V85 A89 I91 L124 M127 M128 S131 V143 F144 G152 L159	V85-W148 HydrophobicContact CG1-CZ3 4.46Å; A89-W148 HydrophobicContact CB-CD2 4.13Å; A89-W148 HydrophobicContact CB-CE3 4.28Å; A89-W148 HydrophobicContact CB-CH2 4.01Å; A89-W148 HydrophobicContact CB-CZ2 3.81Å; A89-W148 HydrophobicContact CB-CZ3 4.21Å; I91-W148 HydrophobicContact CD1-CH2 3.79Å; I91-W148 HydrophobicContact CD1-CZ3 4.07Å; I91-W148 HydrophobicContact CG1-CH2 3.78Å; I91-W148 HydrophobicContact CG1-CZ2 4.45Å; L124-W148 HydrophobicContact CD1-CE3 3.93Å; L124-W148 HydrophobicContact CD1-CZ3 4.44Å; M127-W148 HydrophobicContact CB-CH2 3.68Å; M127-W148 HydrophobicContact CB-CZ3 3.5Å; M127-W148 VanDerWaalsContact CB-CZ3 3.5Å; M128-W148 HydrophobicContact CB-CD2 3.72Å; M128-W148 HydrophobicContact CB-CE3 3.49Å; M128-W148 VanDerWaalsContact CB-CE3 3.49Å; M128-W148 HydrophobicContact CB-CG 4.23Å; M128-W148 HydrophobicContact CB-CH2 4.45Å; M128-W148 HydrophobicContact CB-CZ3 3.9Å; M128-W148 HydrophobicContact CG-CB 4.01Å; M128-W148 HydrophobicContact CG-CD2 3.69Å; M128-W148 HydrophobicContact CG-CE3 4.01Å; M128-W148 HydrophobicContact CG-CG 3.7Å; M128-W148 VanDerWaalsContact N-CZ3 3.26Å; M128-W148 HydrophobicContact SD-CB 3.96Å; M128-W148 HydrophobicContact SD-CG 4.31Å; S131-W148 WeakPolarHBondContact OG-CZ2 3.12Å; V143-W148 HydrophobicContact CG1-CG 4.35Å; V143-W148 VanDerWaalsContact CG1-NE1 3.33Å; F144-W148 PolarHBondContact O-N 2.85Å; W148-G152 PolarHBondContact O-N 3.18Å; W148-L159 HydrophobicContact CB-CD2 3.83Å
149	G	96.8	Very high	94	Very high	2 Å²	2	59.9 Å²	59.9	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-62.3	-45.2	170.5	0	0	0	0	0	111.3	N145 D146 E147 G152 G153 V154	N145-G149 PolarHBondContact O-N 3.23Å; D146-G149 PolarHBondContact O-N 3.47Å; E147-G149 VanDerWaalsContact C-N 3.29Å; E147-G149 PolarHBondContact O-N 3.4Å; G149-G152 PolarHBondContact O-N 3.35Å; G149-G153 CarbonylContact O-C 3.27Å; G149-G153 WeakPolarHBondContact O-CA 3.33Å; G149-G153 PolarHBondContact O-N 2.95Å; G149-V154 CarbonylContact C-O 3.44Å; G149-V154 VanDerWaalsContact C-O 3.27Å; G149-V154 WeakPolarHBondContact CA-O 3.37Å; G149-V154 PolarHBondContact O-N 2.97Å; G149-V154 VanDerWaalsContact O-O 3.06Å
150	A	96.8	Very high	94.5	Very high	80 Å²	80	57 Å²	57	66%	0.661	34%	0.34	S	S	*	.	H	α-helix	trans	-63.5	-49.3	175.8	0	0	0	0	0	111.9	D146 E147 G152 G153	D146-A150 PolarHBondContact O-N 3.01Å; E147-A150 WeakPolarHBondContact O-CB 3.4Å; E147-A150 PolarHBondContact O-N 3.35Å; E147-A150 VanDerWaalsContact O-N 3.15Å; A150-G152 VanDerWaalsContact C-N 3.29Å; A150-G152 PolarHBondContact O-N 3.47Å; A150-G153 PolarHBondContact O-N 2.85Å
151	A	95.3	Very high	95.2	Very high	9 Å²	9	50.1 Å²	50.1	7%	0.074	32%	0.316	C	S	.	.	H	α-helix	trans	-60.2	-37.8	177.8	0	0	0	0	0	112.6	H84 E88 A89 E147	H84-A151 PolarHBondContact CE1-O 3.28Å; H84-A151 PolarHBondContact ND1-O 3.36Å; E88-A151 HydrophobicContact CB-CB 3.77Å; A89-A151 HydrophobicContact CB-CB 4.21Å; E147-A151 PolarHBondContact O-N 2.97Å
152	G	95.1	Very high	96	Very high	4 Å²	4	46.3 Å²	46.3	4%	0.041	30%	0.299	C	S	.	.	H	α-helix	trans	-84.7	-11	179.1	0	0	0	0	0	115.1	Y81 W148 G149 A150 V154	Y81-G152 WeakPolarHBondContact CE2-O 3.46Å; Y81-G152 VanDerWaalsContact OH-CA 3.31Å; Y81-G152 WeakPolarHBondContact OH-CA 3.47Å; Y81-G152 PolarHBondContact OH-O 3.02Å; W148-G152 PolarHBondContact O-N 3.18Å; G149-G152 PolarHBondContact O-N 3.35Å; A150-G152 VanDerWaalsContact C-N 3.29Å; A150-G152 PolarHBondContact O-N 3.47Å; G152-V154 VanDerWaalsContact C-N 3.33Å
153	G	95.9	Very high	96.4	Very high	68 Å²	68	44.8 Å²	44.8	70%	0.701	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	35.4	-171.6	0	0	0	0	0	113.3	G149 A150	G149-G153 CarbonylContact O-C 3.27Å; G149-G153 WeakPolarHBondContact O-CA 3.33Å; G149-G153 PolarHBondContact O-N 2.95Å; A150-G153 PolarHBondContact O-N 2.85Å
154	V	96.3	Very high	96.7	Very high	14 Å²	14	52 Å²	52	9%	0.085	32%	0.317	C	S	.	.			trans	-122.7	135.6	-176.9	178.1	0	0	0	0	109.7	L124 G149 G152 T158 L159	L124-V154 HydrophobicContact CD2-CB 4.21Å; L124-V154 HydrophobicContact CD2-CG2 3.78Å; G149-V154 CarbonylContact C-O 3.44Å; G149-V154 VanDerWaalsContact C-O 3.27Å; G149-V154 WeakPolarHBondContact CA-O 3.37Å; G149-V154 PolarHBondContact O-N 2.97Å; G149-V154 VanDerWaalsContact O-O 3.06Å; G152-V154 VanDerWaalsContact C-N 3.33Å; V154-T158 HydrophobicContact CG1-CG2 3.7Å; V154-L159 HydrophobicContact CG1-CB 4.41Å
155	A	97.6	Very high	96.8	Very high	64 Å²	64	50.3 Å²	50.3	53%	0.529	32%	0.316	S	S	.	.			trans	-62.8	140.2	175.9	0	0	0	0	0	111.3	A157 T158 L159	A155-A157 PolarHBondContact O-N 2.79Å; A155-A157 VanDerWaalsContact O-N 3.15Å; A155-T158 WeakPolarHBondContact O-CA 3.47Å; A155-T158 VanDerWaalsContact O-CB 3.3Å; A155-T158 WeakPolarHBondContact O-CB 3.43Å; A155-T158 PolarHBondContact O-N 3.15Å; A155-L159 PolarHBondContact O-N 2.78Å
156	V	97.6	Very high	97	Very high	60 Å²	60	49.3 Å²	49.3	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-53.5	-40.5	-177.8	-170.1	0	0	0	0	112.3	N145 D146 T158 L159 N160	N145-V156 HydrophobicContact CB-CG1 4.32Å; D146-V156 HydrophobicContact CB-CG1 4.48Å; D146-V156 HydrophobicContact CB-CG2 3.84Å; V156-T158 VanDerWaalsContact C-N 3.3Å; V156-T158 PolarHBondContact O-N 3.22Å; V156-L159 PolarHBondContact O-N 3.12Å; V156-N160 WeakPolarHBondContact O-CB 3.3Å; V156-N160 PolarHBondContact O-N 3.12Å; V156-N160 PolarHBondContact O-ND2 2.72Å; V156-N160 PolarHBondContact O-OD1 3.02Å
157	A	97.7	Very high	97	Very high	74 Å²	74	49 Å²	49	61%	0.612	31%	0.309	S	S	*	.	H	α-helix	trans	-60.3	-39.4	176.5	0	0	0	0	0	112.7	A155 A161	A155-A157 PolarHBondContact O-N 2.79Å; A155-A157 VanDerWaalsContact O-N 3.15Å; A157-A161 PolarHBondContact O-N 2.79Å
158	T	96.9	Very high	97.1	Very high	69 Å²	69	48.3 Å²	48.3	42%	0.423	32%	0.315	S	S	.	.	H	α-helix	trans	-69.1	-43.3	175.2	-56	0	0	0	0	110.6	V154 A155 V156 N160 A161 L162	V154-T158 HydrophobicContact CG1-CG2 3.7Å; A155-T158 WeakPolarHBondContact O-CA 3.47Å; A155-T158 VanDerWaalsContact O-CB 3.3Å; A155-T158 WeakPolarHBondContact O-CB 3.43Å; A155-T158 PolarHBondContact O-N 3.15Å; V156-T158 VanDerWaalsContact C-N 3.3Å; V156-T158 PolarHBondContact O-N 3.22Å; T158-N160 PolarHBondContact O-N 2.89Å; T158-A161 WeakPolarHBondContact O-CB 3.13Å; T158-A161 PolarHBondContact O-N 2.77Å; T158-A161 VanDerWaalsContact O-N 3.12Å; T158-L162 HydrophobicContact CG2-CD1 4.3Å; T158-L162 WeakPolarHBondContact O-CG 3.33Å; T158-L162 PolarHBondContact O-N 3.37Å
159	L	97.5	Very high	97.1	Very high	0 Å²	0	48 Å²	48	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-42.7	178.4	-161.1	70.7	0	0	0	111.8	L124 I125 M128 N145 W148 V154 A155 V156 A161 L162 E163	L124-L159 HydrophobicContact CD2-CD1 3.64Å; L124-L159 HydrophobicContact CG-CD1 4.05Å; I125-L159 HydrophobicContact CD1-CD1 4.21Å; I125-L159 HydrophobicContact CD1-CG 4.48Å; M128-L159 HydrophobicContact SD-CD1 4.32Å; M128-L159 HydrophobicContact SD-CD2 3.45Å; M128-L159 WeakPolarHBondContact SD-CD2 3.13Å; M128-L159 HydrophobicContact SD-CG 3.83Å; N145-L159 HydrophobicContact CB-CD2 4.09Å; N145-L159 WeakPolarHBondContact O-CD2 3.15Å; W148-L159 HydrophobicContact CB-CD2 3.83Å; V154-L159 HydrophobicContact CG1-CB 4.41Å; A155-L159 PolarHBondContact O-N 2.78Å; V156-L159 PolarHBondContact O-N 3.12Å; L159-A161 VanDerWaalsContact C-N 3.26Å; L159-A161 PolarHBondContact O-N 3.42Å; L159-L162 WeakPolarHBondContact O-CB 3.5Å; L159-L162 PolarHBondContact O-N 2.78Å; L159-E163 WeakPolarHBondContact O-CB 3.4Å; L159-E163 PolarHBondContact O-N 2.81Å
160	N	98.3	Very high	96.8	Very high	54 Å²	54	50 Å²	50	29%	0.289	33%	0.325	S	S	.	.	H	α-helix	trans	-61.2	-33.5	173.9	-67.4	-11.5	0	0	0	112.7	N145 V156 T158 R164	N145-N160 PolarHBondContact ND2-OD1 3.35Å; V156-N160 WeakPolarHBondContact O-CB 3.3Å; V156-N160 PolarHBondContact O-N 3.12Å; V156-N160 PolarHBondContact O-ND2 2.72Å; V156-N160 PolarHBondContact O-OD1 3.02Å; T158-N160 PolarHBondContact O-N 2.89Å; N160-R164 WeakPolarHBondContact O-CG 3.3Å; N160-R164 PolarHBondContact O-N 3.29Å; N160-R164 PolarHBondContact O-NE 2.9Å
161	A	98.1	Very high	96.8	Very high	49 Å²	49	48.6 Å²	48.6	41%	0.405	31%	0.308	S	S	.	.	H	α-helix	trans	-72.6	-42.7	175.1	0	0	0	0	0	111.3	A157 T158 L159 S165	A157-A161 PolarHBondContact O-N 2.79Å; T158-A161 WeakPolarHBondContact O-CB 3.13Å; T158-A161 PolarHBondContact O-N 2.77Å; T158-A161 VanDerWaalsContact O-N 3.12Å; L159-A161 VanDerWaalsContact C-N 3.26Å; L159-A161 PolarHBondContact O-N 3.42Å; A161-S165 WeakPolarHBondContact O-CB 3.35Å; A161-S165 PolarHBondContact O-N 3.37Å
162	L	97.4	Very high	96.8	Very high	27 Å²	27	50.6 Å²	50.6	14%	0.141	32%	0.32	C	S	.	.	H	α-helix	trans	-60.7	-44.4	174.9	-71.8	171.7	0	0	0	111.4	D121 I125 T158 L159 S165 F166	D121-L162 HydrophobicContact CB-CD1 3.92Å; D121-L162 HydrophobicContact CB-CD2 4.09Å; I125-L162 HydrophobicContact CB-CB 4.41Å; I125-L162 HydrophobicContact CD1-CB 4.03Å; I125-L162 HydrophobicContact CG1-CB 4.11Å; T158-L162 HydrophobicContact CG2-CD1 4.3Å; T158-L162 WeakPolarHBondContact O-CG 3.33Å; T158-L162 PolarHBondContact O-N 3.37Å; L159-L162 WeakPolarHBondContact O-CB 3.5Å; L159-L162 PolarHBondContact O-N 2.78Å; L162-S165 PolarHBondContact O-N 3.47Å; L162-F166 VanDerWaalsContact O-CB 3.24Å; L162-F166 WeakPolarHBondContact O-CB 3.4Å; L162-F166 PolarHBondContact O-N 3.19Å
163	E	98.1	Very high	96.9	Very high	30 Å²	30	53.2 Å²	53.2	14%	0.14	34%	0.336	C	S	.	.	H	α-helix	trans	-58.4	-53.2	178.7	-170.6	174.8	-153.4	0	0	111.8	I125 M128 V129 K132 N145 L159 S165 F166 L167	I125-E163 VanDerWaalsContact CD1-CA 3.48Å; I125-E163 HydrophobicContact CD1-CB 3.76Å; I125-E163 HydrophobicContact CD1-CG 4.39Å; M128-E163 HydrophobicContact CE-CB 3.93Å; M128-E163 VanDerWaalsContact CE-CD 3.4Å; M128-E163 HydrophobicContact CE-CG 3.73Å; M128-E163 WeakPolarHBondContact CE-OE1 3.39Å; V129-E163 HydrophobicContact CG2-CG 4.22Å; K132-E163 IonicContact NZ-OE1 3.25Å; K132-E163 PolarHBondContact NZ-OE1 3.13Å; K132-E163 IonicContact NZ-OE2 3.64Å; N145-E163 PolarHBondContact ND2-OE2 3.5Å; L159-E163 WeakPolarHBondContact O-CB 3.4Å; L159-E163 PolarHBondContact O-N 2.81Å; E163-S165 VanDerWaalsContact C-N 3.29Å; E163-S165 PolarHBondContact O-N 2.75Å; E163-F166 PolarHBondContact O-N 2.72Å; E163-L167 HydrophobicContact CG-CD1 3.93Å; E163-L167 HydrophobicContact CG-CG 4.45Å; E163-L167 WeakPolarHBondContact O-CB 3.48Å; E163-L167 WeakPolarHBondContact O-CG 3.45Å; E163-L167 PolarHBondContact O-N 2.95Å
164	R	98.1	Very high	97	Very high	169 Å²	169	52.4 Å²	52.4	64%	0.638	31%	0.314	S	S	*	.	H	α-helix	trans	-59.4	-42.5	178.8	-73.9	179.1	-73.6	-173.7	-0.5	111.6	N160 S168	N160-R164 WeakPolarHBondContact O-CG 3.3Å; N160-R164 PolarHBondContact O-N 3.29Å; N160-R164 PolarHBondContact O-NE 2.9Å; R164-S168 VanDerWaalsContact O-CB 3.27Å; R164-S168 WeakPolarHBondContact O-CB 3.36Å; R164-S168 PolarHBondContact O-N 3.33Å; R164-S168 PolarHBondContact O-OG 2.95Å
165	S	97.3	Very high	97	Very high	50 Å²	50	54.8 Å²	54.8	35%	0.35	33%	0.329	S	S	.	.	H	α-helix	trans	-66.8	-44.9	179.1	-168	0	0	0	0	111.8	Y113 A161 L162 E163 S168 A169	Y113-S165 WeakPolarHBondContact CE2-OG 3.38Å; A161-S165 WeakPolarHBondContact O-CB 3.35Å; A161-S165 PolarHBondContact O-N 3.37Å; L162-S165 PolarHBondContact O-N 3.47Å; E163-S165 VanDerWaalsContact C-N 3.29Å; E163-S165 PolarHBondContact O-N 2.75Å; S165-S168 PolarHBondContact O-N 3.39Å; S165-S168 PolarHBondContact O-OG 3.33Å; S165-A169 WeakPolarHBondContact O-CB 3.22Å; S165-A169 PolarHBondContact O-N 3.08Å; S165-A169 VanDerWaalsContact O-N 3.11Å
166	F	97.8	Very high	97	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.7	-50.3	177.1	-178.6	-98.9	0	0	0	111.4	Y102 L106 Y113 L122 I125 V129 L162 E163 S168 A169 M170	Y102-F166 HydrophobicContact CD2-CE1 4.3Å; Y102-F166 HydrophobicContact CD2-CZ 4.32Å; L106-F166 HydrophobicContact CD2-CD2 4.13Å; L106-F166 HydrophobicContact CD2-CE2 3.87Å; Y113-F166 HydrophobicContact CE1-CD2 4.16Å; L122-F166 HydrophobicContact CD1-CD2 4.09Å; L122-F166 HydrophobicContact CD1-CE2 3.87Å; I125-F166 HydrophobicContact CG1-CB 4Å; I125-F166 HydrophobicContact CG1-CG 4.31Å; I125-F166 HydrophobicContact CG2-CB 4.06Å; I125-F166 HydrophobicContact CG2-CD2 3.76Å; I125-F166 HydrophobicContact CG2-CE2 4.36Å; I125-F166 HydrophobicContact CG2-CG 3.91Å; V129-F166 HydrophobicContact CB-CD1 4.33Å; V129-F166 HydrophobicContact CB-CE1 4.13Å; V129-F166 HydrophobicContact CG1-CD1 4.36Å; V129-F166 HydrophobicContact CG1-CE1 4.07Å; V129-F166 HydrophobicContact CG2-CD1 3.95Å; V129-F166 HydrophobicContact CG2-CE1 4.26Å; L162-F166 VanDerWaalsContact O-CB 3.24Å; L162-F166 WeakPolarHBondContact O-CB 3.4Å; L162-F166 PolarHBondContact O-N 3.19Å; E163-F166 PolarHBondContact O-N 2.72Å; F166-S168 VanDerWaalsContact C-N 3.31Å; F166-S168 PolarHBondContact O-N 2.92Å; F166-A169 PolarHBondContact O-N 3.16Å; F166-A169 VanDerWaalsContact O-N 3.12Å; F166-M170 HydrophobicContact CD1-CG 4.2Å; F166-M170 HydrophobicContact CE1-CG 3.93Å; F166-M170 HydrophobicContact CE1-SD 4.43Å; F166-M170 HydrophobicContact CZ-CG 4.13Å; F166-M170 HydrophobicContact CZ-SD 4.12Å; F166-M170 WeakPolarHBondContact O-CG 3.35Å; F166-M170 PolarHBondContact O-N 2.82Å; F166-M170 VanDerWaalsContact O-N 3.16Å
167	L	97.3	Very high	97	Very high	88 Å²	88	53.7 Å²	53.7	46%	0.461	31%	0.312	S	S	.	.	H	α-helix	trans	-63.7	-35.4	178.3	-68.8	175.7	0	0	0	112.5	V129 E163 A169	V129-L167 HydrophobicContact CG1-CD2 3.78Å; V129-L167 HydrophobicContact CG2-CD2 4.42Å; E163-L167 HydrophobicContact CG-CD1 3.93Å; E163-L167 HydrophobicContact CG-CG 4.45Å; E163-L167 WeakPolarHBondContact O-CB 3.48Å; E163-L167 WeakPolarHBondContact O-CG 3.45Å; E163-L167 PolarHBondContact O-N 2.95Å; L167-A169 VanDerWaalsContact C-N 3.26Å; L167-A169 PolarHBondContact O-N 3.43Å
168	S	96.8	Very high	96.9	Very high	93 Å²	93	52.2 Å²	52.2	65%	0.65	29%	0.289	S	S	*	.	H	α-helix	trans	-68.2	-26.4	175.7	73.3	0	0	0	0	113.5	R164 S165 F166	R164-S168 VanDerWaalsContact O-CB 3.27Å; R164-S168 WeakPolarHBondContact O-CB 3.36Å; R164-S168 PolarHBondContact O-N 3.33Å; R164-S168 PolarHBondContact O-OG 2.95Å; S165-S168 PolarHBondContact O-N 3.39Å; S165-S168 PolarHBondContact O-OG 3.33Å; F166-S168 VanDerWaalsContact C-N 3.31Å; F166-S168 PolarHBondContact O-N 2.92Å
169	A	95.9	Very high	96.9	Very high	5 Å²	5	50.8 Å²	50.8	4%	0.041	28%	0.278	C	S	.	.	H	α-helix	trans	-87.1	-22.7	-178.3	0	0	0	0	0	112.9	L106 Y113 S165 F166 L167	L106-A169 HydrophobicContact CD1-CB 3.82Å; L106-A169 WeakPolarHBondContact CD1-O 3.29Å; Y113-A169 HydrophobicContact CD1-CB 4.12Å; Y113-A169 HydrophobicContact CD2-CB 3.88Å; Y113-A169 HydrophobicContact CE2-CB 4.42Å; Y113-A169 HydrophobicContact CG-CB 3.71Å; S165-A169 WeakPolarHBondContact O-CB 3.22Å; S165-A169 PolarHBondContact O-N 3.08Å; S165-A169 VanDerWaalsContact O-N 3.11Å; F166-A169 PolarHBondContact O-N 3.16Å; F166-A169 VanDerWaalsContact O-N 3.12Å; L167-A169 VanDerWaalsContact C-N 3.26Å; L167-A169 PolarHBondContact O-N 3.43Å
170	M	90.1	Very high	96.8	Very high	44 Å²	44	55.4 Å²	55.4	22%	0.217	30%	0.303	C	S	.	.			trans	-73	0	-176.5	-80.8	-67.9	-68.7	0	0	114.7	Y102 L106 R109 F166	Y102-M170 HydrophobicContact CD1-CE 3.48Å; Y102-M170 VanDerWaalsContact CD1-CE 3.48Å; Y102-M170 HydrophobicContact CE1-CE 4.29Å; Y102-M170 HydrophobicContact CG-CE 3.7Å; L106-M170 HydrophobicContact CB-SD 3.95Å; L106-M170 HydrophobicContact CD1-CG 4.39Å; L106-M170 HydrophobicContact CD1-SD 4.03Å; L106-M170 HydrophobicContact CD2-SD 4.33Å; L106-M170 HydrophobicContact CG-SD 4.35Å; R109-M170 WeakPolarHBondContact CD-O 3.36Å; R109-M170 VanDerWaalsContact CZ-O 3.27Å; R109-M170 VanDerWaalsContact CZ-OXT 3.23Å; R109-M170 PolarHBondContact NE-O 3.11Å; R109-M170 PolarHBondContact NH1-O 2.69Å; R109-M170 PolarHBondContact NH1-OXT 3.15Å; F166-M170 HydrophobicContact CD1-CG 4.2Å; F166-M170 HydrophobicContact CE1-CG 3.93Å; F166-M170 HydrophobicContact CE1-SD 4.43Å; F166-M170 HydrophobicContact CZ-CG 4.13Å; F166-M170 HydrophobicContact CZ-SD 4.12Å; F166-M170 WeakPolarHBondContact O-CG 3.35Å; F166-M170 PolarHBondContact O-N 2.82Å; F166-M170 VanDerWaalsContact O-N 3.16Å

Retrieved 170 of 170 residues in 248.3 ms (Link to these results)

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