A0A3B3VA94_9TELE Loading...

Transmembrane protein 17

Transmembrane component of the tectonic-like complex, a complex localized at the transition zone of primary cilia and acting as a barrier that prevents diffusion of transmembrane proteins between the cilia and plasma membranes. Required for ciliogenesis and sonic hedgehog/SHH signaling.

AlphaFold DB , UniProt , Accession A0A3B3VA94, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 184 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	57.3	Low	72.2	Confident	244 Å²	244	140.2 Å²	140.2	100%	1.202	67%	0.667	S	S	*	*				0	100.5	0	-123.5	84.8	179.6	0	0	106.7
2	E	61.1	Low	72.4	Confident	193 Å²	193	135 Å²	135	90%	0.902	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-74.2	132.1	175.4	-68.7	-176.7	160.4	0	0	108.7
3	L	65.8	Low	72.5	Confident	103 Å²	103	131.8 Å²	131.8	54%	0.539	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-69.5	133.7	-176.1	-158.6	72.2	0	0	0	109	E5 I7	L3-E5 PolarHBondContact O-N 3.21Å; L3-I7 HydrophobicContact CD2-CB 4.21Å; L3-I7 HydrophobicContact CD2-CG2 3.76Å; L3-I7 HydrophobicContact CG-CB 4.22Å; L3-I7 HydrophobicContact CG-CG2 4.15Å
4	P	79.1	Confident	72.8	Confident	71 Å²	71	132.1 Å²	132.1	46%	0.461	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-51.2	132.6	178.7	-25.4	30.8	0	0	0	112.1	T6 I7 R8	P4-T6 PolarHBondContact O-N 3.45Å; P4-I7 HydrophobicContact CB-CD1 4.34Å; P4-I7 HydrophobicContact CB-CG1 4.28Å; P4-I7 HydrophobicContact CG-CD1 4.07Å; P4-I7 PolarHBondContact O-N 3.05Å; P4-R8 PolarHBondContact O-N 3.45Å; P4-R8 VanDerWaalsContact O-N 3.15Å
5	E	73.9	Confident	72.7	Confident	143 Å²	143	127.1 Å²	127.1	67%	0.668	62%	0.617	S	S	*	*	H	α-helix	trans	-47.3	-35	-178.2	-76.5	-85.2	141.6	0	0	113.6	L3 R8 K9	L3-E5 PolarHBondContact O-N 3.21Å; E5-R8 PolarHBondContact O-N 3.35Å; E5-K9 PolarHBondContact O-N 2.75Å
6	T	75.9	Confident	72.1	Confident	104 Å²	104	128.1 Å²	128.1	64%	0.638	61%	0.612	S	S	*	*	H	α-helix	trans	-67.2	-39.2	178.1	44.4	0	0	0	0	112.9	P4 R10	P4-T6 PolarHBondContact O-N 3.45Å; T6-R10 WeakPolarHBondContact O-CG 3.3Å; T6-R10 PolarHBondContact O-N 3.18Å; T6-R10 VanDerWaalsContact O-N 3.16Å
7	I	75	Confident	71.9	Confident	79 Å²	79	127 Å²	127	41%	0.405	61%	0.61	S	S	.	*	H	α-helix	trans	-73.4	-39.7	178.3	-57.5	-177.6	0	0	0	109.5	L3 P4 R10 L11	L3-I7 HydrophobicContact CD2-CB 4.21Å; L3-I7 HydrophobicContact CD2-CG2 3.76Å; L3-I7 HydrophobicContact CG-CB 4.22Å; L3-I7 HydrophobicContact CG-CG2 4.15Å; P4-I7 HydrophobicContact CB-CD1 4.34Å; P4-I7 HydrophobicContact CB-CG1 4.28Å; P4-I7 HydrophobicContact CG-CD1 4.07Å; P4-I7 PolarHBondContact O-N 3.05Å; I7-R10 PolarHBondContact O-N 3.4Å; I7-L11 WeakPolarHBondContact O-CB 3.35Å; I7-L11 PolarHBondContact O-N 3.02Å
8	R	76.9	Confident	71.7	Confident	155 Å²	155	125.6 Å²	125.6	59%	0.585	61%	0.605	S	S	*	*	H	α-helix	trans	-61.3	-45.3	176.9	-167.5	177.7	-179.2	-176.3	1.6	111.9	P4 E5 L11 D12	P4-R8 PolarHBondContact O-N 3.45Å; P4-R8 VanDerWaalsContact O-N 3.15Å; E5-R8 PolarHBondContact O-N 3.35Å; R8-L11 PolarHBondContact O-N 3.47Å; R8-D12 WeakPolarHBondContact O-CB 3.5Å; R8-D12 PolarHBondContact O-N 2.77Å
9	K	76.6	Confident	70.9	Confident	142 Å²	142	125.3 Å²	125.3	62%	0.617	61%	0.607	S	S	*	*	H	α-helix	trans	-60.8	-44.5	173.9	-90.3	-175.9	173.6	177.5	0	112.7	E5 L11 D12 D13	E5-K9 PolarHBondContact O-N 2.75Å; K9-L11 VanDerWaalsContact C-N 3.3Å; K9-L11 PolarHBondContact O-N 2.95Å; K9-D12 PolarHBondContact O-N 2.95Å; K9-D13 WeakPolarHBondContact O-CB 3.44Å; K9-D13 VanDerWaalsContact O-CG 3.25Å; K9-D13 PolarHBondContact O-N 3.45Å
10	R	76.4	Confident	70.2	Confident	199 Å²	199	125.2 Å²	125.2	75%	0.751	60%	0.603	S	S	*	*	H	α-helix	trans	-62.4	-39	177.4	-70.3	-115.8	-162.4	-156.7	4	112.2	T6 I7 F14	T6-R10 WeakPolarHBondContact O-CG 3.3Å; T6-R10 PolarHBondContact O-N 3.18Å; T6-R10 VanDerWaalsContact O-N 3.16Å; I7-R10 PolarHBondContact O-N 3.4Å; R10-F14 WeakPolarHBondContact O-CB 3.45Å; R10-F14 PolarHBondContact O-N 3.26Å
11	L	76.8	Confident	69	Low	109 Å²	109	124.4 Å²	124.4	57%	0.571	60%	0.602	S	S	*	*	H	α-helix	trans	-71	-39	178.7	-136.7	95.8	0	0	0	111.5	I7 R8 K9 F14 S15	I7-L11 WeakPolarHBondContact O-CB 3.35Å; I7-L11 PolarHBondContact O-N 3.02Å; R8-L11 PolarHBondContact O-N 3.47Å; K9-L11 VanDerWaalsContact C-N 3.3Å; K9-L11 PolarHBondContact O-N 2.95Å; L11-F14 PolarHBondContact O-N 3.48Å; L11-S15 WeakPolarHBondContact O-CB 3.29Å; L11-S15 PolarHBondContact O-N 3.49Å
12	D	74.2	Confident	68.2	Low	78 Å²	78	120.9 Å²	120.9	42%	0.417	58%	0.583	S	S	.	*	H	α-helix	trans	-65.9	-41.5	174.4	-91.7	10.4	0	0	0	111.4	R8 K9 R16	R8-D12 WeakPolarHBondContact O-CB 3.5Å; R8-D12 PolarHBondContact O-N 2.77Å; K9-D12 PolarHBondContact O-N 2.95Å; D12-R16 VanDerWaalsContact O-CB 3.25Å; D12-R16 WeakPolarHBondContact O-CB 3.16Å; D12-R16 WeakPolarHBondContact O-CG 3.26Å; D12-R16 PolarHBondContact O-N 3.41Å
13	D	74.2	Confident	67.2	Low	93 Å²	93	114.2 Å²	114.2	50%	0.497	56%	0.558	S	S	.	*	H	α-helix	trans	-66.9	-39	175.9	-72	-21.8	0	0	0	111.2	K9 N17	K9-D13 WeakPolarHBondContact O-CB 3.44Å; K9-D13 VanDerWaalsContact O-CG 3.25Å; K9-D13 PolarHBondContact O-N 3.45Å; D13-N17 VanDerWaalsContact O-CB 3.26Å; D13-N17 WeakPolarHBondContact O-CB 3.45Å; D13-N17 PolarHBondContact O-N 2.92Å; D13-N17 PolarHBondContact O-ND2 3.44Å
14	F	75.7	Confident	65.9	Low	136 Å²	136	116.6 Å²	116.6	60%	0.596	56%	0.559	S	S	*	*	H	α-helix	trans	-70.6	-41.6	176.7	-170	-106.4	0	0	0	112.1	R10 L11 N17 I18	R10-F14 WeakPolarHBondContact O-CB 3.45Å; R10-F14 PolarHBondContact O-N 3.26Å; L11-F14 PolarHBondContact O-N 3.48Å; F14-N17 PolarHBondContact O-N 3.23Å; F14-I18 HydrophobicContact CD1-CD1 3.7Å; F14-I18 HydrophobicContact CD2-CD1 4.26Å; F14-I18 HydrophobicContact CE1-CD1 3.19Å; F14-I18 HydrophobicContact CE1-CG1 4.42Å; F14-I18 HydrophobicContact CE2-CD1 3.81Å; F14-I18 HydrophobicContact CG-CD1 4.23Å; F14-I18 HydrophobicContact CZ-CD1 3.27Å; F14-I18 HydrophobicContact CZ-CG1 4.42Å; F14-I18 WeakPolarHBondContact O-CB 3.49Å; F14-I18 WeakPolarHBondContact O-CG1 3.33Å; F14-I18 PolarHBondContact O-N 3.36Å
15	S	71.3	Confident	64	Low	57 Å²	57	120.3 Å²	120.3	40%	0.399	57%	0.574	S	S	.	*	H	α-helix	trans	-63.5	-44.7	174.4	178	0	0	0	0	110.7	L11 I18 L19	L11-S15 WeakPolarHBondContact O-CB 3.29Å; L11-S15 PolarHBondContact O-N 3.49Å; S15-I18 PolarHBondContact O-N 2.92Å; S15-L19 VanDerWaalsContact O-CB 3.3Å; S15-L19 WeakPolarHBondContact O-CB 3.37Å; S15-L19 PolarHBondContact O-N 3.09Å
16	R	64.3	Low	62.6	Low	144 Å²	144	119.2 Å²	119.2	54%	0.543	58%	0.577	S	S	.	*	H	α-helix	trans	-64.1	-44	175.3	-75.7	173.5	-162.9	-107.5	1.7	111.2	D12 I18 F20	D12-R16 VanDerWaalsContact O-CB 3.25Å; D12-R16 WeakPolarHBondContact O-CB 3.16Å; D12-R16 WeakPolarHBondContact O-CG 3.26Å; D12-R16 PolarHBondContact O-N 3.41Å; R16-I18 PolarHBondContact O-N 2.84Å; R16-F20 HydrophobicContact CB-CD2 4.21Å; R16-F20 HydrophobicContact CG-CD2 4.36Å; R16-F20 HydrophobicContact CG-CE2 4.38Å; R16-F20 WeakPolarHBondContact O-CA 3.17Å; R16-F20 WeakPolarHBondContact O-CB 3.45Å; R16-F20 WeakPolarHBondContact O-CD2 3.15Å; R16-F20 PolarHBondContact O-N 3.16Å
17	N	68.5	Low	60.6	Low	109 Å²	109	119.2 Å²	119.2	58%	0.583	58%	0.577	S	S	*	*	H	α-helix	trans	-64.5	-41.7	178	-73.1	-18.1	0	0	0	111.2	D13 F14 D21	D13-N17 VanDerWaalsContact O-CB 3.26Å; D13-N17 WeakPolarHBondContact O-CB 3.45Å; D13-N17 PolarHBondContact O-N 2.92Å; D13-N17 PolarHBondContact O-ND2 3.44Å; F14-N17 PolarHBondContact O-N 3.23Å; N17-D21 WeakPolarHBondContact O-CB 3.41Å; N17-D21 PolarHBondContact O-N 3Å
18	I	67.2	Low	58.7	Low	101 Å²	101	122.7 Å²	122.7	52%	0.518	59%	0.589	S	S	.	*	H	α-helix	trans	-75.1	-38.5	-179.3	-68.3	178.4	0	0	0	113	F14 S15 R16	F14-I18 HydrophobicContact CD1-CD1 3.7Å; F14-I18 HydrophobicContact CD2-CD1 4.26Å; F14-I18 HydrophobicContact CE1-CD1 3.19Å; F14-I18 HydrophobicContact CE1-CG1 4.42Å; F14-I18 HydrophobicContact CE2-CD1 3.81Å; F14-I18 HydrophobicContact CG-CD1 4.23Å; F14-I18 HydrophobicContact CZ-CD1 3.27Å; F14-I18 HydrophobicContact CZ-CG1 4.42Å; F14-I18 WeakPolarHBondContact O-CB 3.49Å; F14-I18 WeakPolarHBondContact O-CG1 3.33Å; F14-I18 PolarHBondContact O-N 3.36Å; S15-I18 PolarHBondContact O-N 2.92Å; R16-I18 PolarHBondContact O-N 2.84Å
19	L	58.1	Low	56.8	Low	121 Å²	121	121 Å²	121	63%	0.634	60%	0.597	S	S	*	*	H	α-helix	trans	-78.3	-30.3	178.1	-92.2	154.7	0	0	0	113.2	S15	S15-L19 VanDerWaalsContact O-CB 3.3Å; S15-L19 WeakPolarHBondContact O-CB 3.37Å; S15-L19 PolarHBondContact O-N 3.09Å
20	F	55.2	Low	55.3	Low	122 Å²	122	123.3 Å²	123.3	54%	0.535	61%	0.609	S	S	.	*	H	α-helix	trans	-97.2	-13.5	179.5	-71.4	-92.3	0	0	0	114.5	R16 Q22 S23 R24	R16-F20 HydrophobicContact CB-CD2 4.21Å; R16-F20 HydrophobicContact CG-CD2 4.36Å; R16-F20 HydrophobicContact CG-CE2 4.38Å; R16-F20 WeakPolarHBondContact O-CA 3.17Å; R16-F20 WeakPolarHBondContact O-CB 3.45Å; R16-F20 WeakPolarHBondContact O-CD2 3.15Å; R16-F20 PolarHBondContact O-N 3.16Å; F20-Q22 PolarHBondContact O-N 2.87Å; F20-S23 WeakPolarHBondContact CA-OG 3.45Å; F20-S23 WeakPolarHBondContact CD1-OG 3.4Å; F20-S23 CarbonylContact O-C 3.51Å; F20-S23 PolarHBondContact O-N 3.41Å; F20-S23 VanDerWaalsContact O-N 3.08Å; F20-S23 PolarHBondContact O-OG 2.99Å; F20-S23 VanDerWaalsContact O-OG 3.12Å; F20-R24 WeakPolarHBondContact O-CB 3.47Å; F20-R24 PolarHBondContact O-N 3.41Å
21	D	44.8	Very low	53.6	Low	109 Å²	109	123 Å²	123	58%	0.583	62%	0.616	S	S	*	*	H	α-helix	trans	-68.3	-24.8	170.7	-161.6	34.7	0	0	0	111.4	N17 S23	N17-D21 WeakPolarHBondContact O-CB 3.41Å; N17-D21 PolarHBondContact O-N 3Å; D21-S23 VanDerWaalsContact C-N 3.31Å; D21-S23 PolarHBondContact O-N 3.28Å
22	Q	42.4	Very low	51.6	Low	170 Å²	170	124.9 Å²	124.9	79%	0.794	63%	0.627	S	S	*	*	H	α-helix	trans	-73.4	-20.6	170.3	-162.3	162.9	16.9	0	0	113.4	F20	F20-Q22 PolarHBondContact O-N 2.87Å
23	S	40	Very low	49.9	Very low	54 Å²	54	128.5 Å²	128.5	38%	0.378	65%	0.647	S	S	.	*	H	α-helix	trans	-101.8	-17.8	174.9	57.8	0	0	0	0	113.8	F20 D21 I25 V26	F20-S23 WeakPolarHBondContact CA-OG 3.45Å; F20-S23 WeakPolarHBondContact CD1-OG 3.4Å; F20-S23 CarbonylContact O-C 3.51Å; F20-S23 PolarHBondContact O-N 3.41Å; F20-S23 VanDerWaalsContact O-N 3.08Å; F20-S23 PolarHBondContact O-OG 2.99Å; F20-S23 VanDerWaalsContact O-OG 3.12Å; D21-S23 VanDerWaalsContact C-N 3.31Å; D21-S23 PolarHBondContact O-N 3.28Å; S23-I25 VanDerWaalsContact C-N 3.34Å; S23-I25 PolarHBondContact O-N 3.47Å; S23-V26 PolarHBondContact O-N 3.46Å
24	R	36.7	Very low	48.3	Very low	152 Å²	152	128 Å²	128	57%	0.574	66%	0.664	S	S	*	*	H	α-helix	trans	-76.4	-12.8	177.3	-105.5	-173.4	-173.4	-171.1	-1	115.4	F20 V26 F28	F20-R24 WeakPolarHBondContact O-CB 3.47Å; F20-R24 PolarHBondContact O-N 3.41Å; R24-V26 PolarHBondContact O-N 3.43Å; R24-F28 HydrophobicContact CG-CD2 4.24Å; R24-F28 HydrophobicContact CG-CE2 4.01Å
25	I	39.9	Very low	46.8	Very low	149 Å²	149	130.6 Å²	130.6	76%	0.764	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-14.8	166.9	-60.3	177.9	0	0	0	110.8	S23	S23-I25 VanDerWaalsContact C-N 3.34Å; S23-I25 PolarHBondContact O-N 3.47Å
26	V	44.8	Very low	45.5	Very low	120 Å²	120	134.5 Å²	134.5	73%	0.727	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-1.8	-175.1	-177.7	0	0	0	0	113.8	S23 R24	S23-V26 PolarHBondContact O-N 3.46Å; R24-V26 PolarHBondContact O-N 3.43Å
27	T	33.1	Very low	44.5	Very low	105 Å²	105	132.3 Å²	132.3	64%	0.644	70%	0.695	S	S	*	*	S	Bend	trans	-147.5	40.3	-170.8	-2.6	0	0	0	0	117
28	F	35.1	Very low	43.4	Very low	152 Å²	152	135 Å²	135	67%	0.667	70%	0.704	S	S	*	*			trans	-138.9	78.4	160.1	-79.2	-80.3	0	0	0	111	R24	R24-F28 HydrophobicContact CG-CD2 4.24Å; R24-F28 HydrophobicContact CG-CE2 4.01Å
29	T	36.8	Very low	42.4	Very low	120 Å²	120	138.7 Å²	138.7	74%	0.736	72%	0.719	S	S	*	*			trans	-147	77	155	-23.4	0	0	0	0	109.6	L36	T29-L36 HydrophobicContact CG2-CD1 3.99Å
30	E	45.7	Very low	42.4	Very low	190 Å²	190	139.2 Å²	139.2	89%	0.888	72%	0.716	S	S	*	*			trans	-131.3	133.5	148.5	-80.8	-160.2	138.5	0	0	107.8
31	E	40.9	Very low	42.6	Very low	192 Å²	192	137.4 Å²	137.4	90%	0.897	72%	0.716	S	S	*	*	S	Bend	trans	73.4	85.9	175.7	-56.9	-170	157.1	0	0	117.4
32	N	35.8	Very low	43.7	Very low	149 Å²	149	137.8 Å²	137.8	80%	0.797	72%	0.723	S	S	*	*	S	Bend		175.4	127.2	107.6	-129.8	1.1	0	0	0	111.4
33	D	37.4	Very low	45.2	Very low	154 Å²	154	131.4 Å²	131.4	82%	0.824	69%	0.693	S	S	*	*			trans	37.4	76.2	155.2	-64.6	-16.3	0	0	0	119.9	F35	D33-F35 PolarHBondContact O-N 3.46Å; D33-F35 VanDerWaalsContact O-N 3.16Å
34	G	41.2	Very low	47	Very low	83 Å²	83	130.9 Å²	130.9	86%	0.856	69%	0.69	S	S	*	*	S	Bend		73.1	16.4	106.9	0	0	0	0	0	121.6
35	F	42.7	Very low	49.4	Very low	190 Å²	190	124.9 Å²	124.9	83%	0.833	67%	0.671	S	S	*	*			trans	-151.2	78	161.4	-162.6	-97.5	0	0	0	111	D33	D33-F35 PolarHBondContact O-N 3.46Å; D33-F35 VanDerWaalsContact O-N 3.16Å
36	L	44	Very low	51.7	Low	138 Å²	138	124.1 Å²	124.1	72%	0.723	67%	0.668	S	S	*	*			trans	-93.8	126.9	166.1	-70.5	175.5	0	0	0	108.7	T29 H38	T29-L36 HydrophobicContact CG2-CD1 3.99Å; L36-H38 PolarHBondContact O-N 3.38Å; L36-H38 VanDerWaalsContact O-N 3.12Å
37	P	44.6	Very low	53.9	Low	99 Å²	99	124.3 Å²	124.3	64%	0.643	66%	0.661	S	S	*	*			trans	-63.3	120.5	171.1	28.8	-31.1	0	0	0	106.6	E39	P37-E39 PolarHBondContact O-N 3.22Å
38	H	44.5	Very low	56.7	Low	166 Å²	166	119.3 Å²	119.3	77%	0.769	63%	0.63	S	S	*	*			trans	-54.2	98	179.1	-161.2	-7.7	0	0	0	109.2	L36 K40	L36-H38 PolarHBondContact O-N 3.38Å; L36-H38 VanDerWaalsContact O-N 3.12Å; H38-K40 PolarHBondContact O-N 3.23Å
39	E	45.9	Very low	59.5	Low	178 Å²	178	113.5 Å²	113.5	83%	0.832	61%	0.605	S	S	*	*			trans	-64.6	101.1	174.9	-68.9	-165.8	172	0	0	107.2	P37	P37-E39 PolarHBondContact O-N 3.22Å
40	K	58	Low	62.3	Low	132 Å²	132	112.1 Å²	112.1	57%	0.574	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-67.2	122.6	177.3	-68.1	-175.1	-178.7	-173.8	0	107	H38 V42 Q177	H38-K40 PolarHBondContact O-N 3.23Å; K40-V42 PolarHBondContact O-N 3.01Å; K40-Q177 VanDerWaalsContact NZ-OE1 3.15Å
41	P	60	Low	64.7	Low	84 Å²	84	103.4 Å²	103.4	55%	0.545	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-59.9	131.1	176.3	24.7	-32.6	0	0	0	108.8	L43	P41-L43 PolarHBondContact O-N 3.27Å
42	V	67.7	Low	67.3	Low	117 Å²	117	94.6 Å²	94.6	71%	0.709	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-63	119.1	175.7	177	0	0	0	0	108.3	K40 S44	K40-V42 PolarHBondContact O-N 3.01Å; V42-S44 WeakPolarHBondContact CG1-OG 3.11Å
43	L	73.6	Confident	70.2	Confident	35 Å²	35	93 Å²	93	18%	0.183	49%	0.494	C	S	.	.			trans	-93.2	-5.9	-175.9	-76	157.1	0	0	0	113.2	P41 S45 E110 N169 M170 H173	P41-L43 PolarHBondContact O-N 3.27Å; L43-S45 PolarHBondContact O-N 3.38Å; L43-E110 HydrophobicContact CB-CG 4.47Å; L43-E110 PolarHBondContact N-OE1 3.28Å; L43-N169 HydrophobicContact CD2-CB 4.19Å; L43-M170 HydrophobicContact CB-CG 4.28Å; L43-H173 HydrophobicContact CD1-CB 3.76Å; L43-H173 WeakPolarHBondContact CD2-CD2 3.31Å
44	S	78.4	Confident	73	Confident	44 Å²	44	90.7 Å²	90.7	31%	0.308	48%	0.477	S	S	.	.			trans	-60.2	134.8	177.6	78.7	0	0	0	0	112.1	V42 N107 E110	V42-S44 WeakPolarHBondContact CG1-OG 3.11Å; S44-N107 WeakPolarHBondContact CB-O 3.42Å; S44-E110 PolarHBondContact N-OE1 2.88Å
45	S	87.1	Confident	75.6	Confident	26 Å²	26	86.8 Å²	86.8	18%	0.182	44%	0.437	C	S	.	.			trans	-91.3	115.1	179.1	176.7	0	0	0	0	111.2	L43 Q47 L48 Q49 N107	L43-S45 PolarHBondContact O-N 3.38Å; S45-Q47 VanDerWaalsContact C-N 3.35Å; S45-Q47 PolarHBondContact O-N 2.93Å; S45-L48 PolarHBondContact O-N 3.25Å; S45-L48 PolarHBondContact OG-N 3.46Å; S45-Q49 PolarHBondContact O-N 3.23Å; S45-N107 PolarHBondContact N-OD1 2.95Å; S45-N107 PolarHBondContact O-ND2 3.35Å
46	L	89.1	Confident	78.2	Confident	133 Å²	133	82.4 Å²	82.4	70%	0.696	42%	0.42	S	S	*	.	H	α-helix	trans	-61.5	-42.8	177	-179.2	67.2	0	0	0	111.9	L48 Q49 M50	L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 2.94Å; L46-Q49 WeakPolarHBondContact O-CB 3.27Å; L46-Q49 PolarHBondContact O-N 3.21Å; L46-M50 HydrophobicContact CD1-CG 4.33Å; L46-M50 HydrophobicContact CG-CG 4.36Å; L46-M50 WeakPolarHBondContact O-CG 3.47Å; L46-M50 PolarHBondContact O-N 2.98Å
47	Q	91	Very high	80.7	Confident	123 Å²	123	83.5 Å²	83.5	58%	0.575	41%	0.414	S	S	*	.	H	α-helix	trans	-61.6	-41.5	-178.2	-175.9	178.6	3.7	0	0	111.8	S45 Q49 S51 I158	S45-Q47 VanDerWaalsContact C-N 3.35Å; S45-Q47 PolarHBondContact O-N 2.93Å; Q47-Q49 VanDerWaalsContact C-N 3.35Å; Q47-S51 WeakPolarHBondContact O-CB 3.24Å; Q47-S51 PolarHBondContact O-N 3.32Å; Q47-S51 VanDerWaalsContact O-N 3.09Å; Q47-I158 HydrophobicContact CG-CG2 4.41Å
48	L	91.6	Very high	83.2	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-62.5	-45	176.3	178.1	59.3	0	0	0	110.6	S45 L46 S51 L52 N107 L115 F118 Q159	S45-L48 PolarHBondContact O-N 3.25Å; S45-L48 PolarHBondContact OG-N 3.46Å; L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 2.94Å; L48-S51 PolarHBondContact O-N 3.01Å; L48-L52 HydrophobicContact CD1-CD1 4.14Å; L48-L52 HydrophobicContact CD1-CG 4.21Å; L48-L52 HydrophobicContact CG-CD1 4Å; L48-L52 HydrophobicContact CG-CG 4.49Å; L48-L52 VanDerWaalsContact O-CG 3.27Å; L48-L52 WeakPolarHBondContact O-CG 3.38Å; L48-L52 PolarHBondContact O-N 2.96Å; L48-N107 HydrophobicContact CD2-CB 3.94Å; L48-L115 HydrophobicContact CD2-CD1 3.78Å; L48-F118 HydrophobicContact CD1-CE1 3.71Å; L48-F118 HydrophobicContact CD1-CZ 3.8Å; L48-F118 HydrophobicContact CD2-CE1 4.43Å; L48-Q159 HydrophobicContact CD1-CB 4.41Å; L48-Q159 HydrophobicContact CD1-CG 4.24Å
49	Q	94.1	Very high	85.6	Confident	30 Å²	30	73.8 Å²	73.8	14%	0.14	36%	0.36	C	S	.	.	H	α-helix	trans	-59.4	-50.7	177.8	-113.1	-59.6	10	0	0	112.6	S45 L46 Q47 S51 L52 Y53 L108	S45-Q49 PolarHBondContact O-N 3.23Å; L46-Q49 WeakPolarHBondContact O-CB 3.27Å; L46-Q49 PolarHBondContact O-N 3.21Å; Q47-Q49 VanDerWaalsContact C-N 3.35Å; Q49-S51 VanDerWaalsContact C-N 3.28Å; Q49-S51 PolarHBondContact O-N 3.19Å; Q49-L52 PolarHBondContact O-N 3.11Å; Q49-Y53 PolarHBondContact O-N 3.39Å; Q49-L108 HydrophobicContact CG-CD2 4.23Å
50	M	94.9	Very high	88.1	Confident	91 Å²	91	68.4 Å²	68.4	45%	0.448	34%	0.34	S	S	.	.	H	α-helix	trans	-59.3	-41.9	179.8	-67.1	-59.2	-64.6	0	0	111.6	L46 Y53 F54	L46-M50 HydrophobicContact CD1-CG 4.33Å; L46-M50 HydrophobicContact CG-CG 4.36Å; L46-M50 WeakPolarHBondContact O-CG 3.47Å; L46-M50 PolarHBondContact O-N 2.98Å; M50-Y53 PolarHBondContact O-N 3.22Å; M50-F54 HydrophobicContact CE-CE2 3.86Å; M50-F54 HydrophobicContact CE-CZ 4.13Å; M50-F54 WeakPolarHBondContact O-CD2 3.35Å; M50-F54 PolarHBondContact O-N 3.33Å; M50-F54 VanDerWaalsContact O-N 3.13Å
51	S	95.8	Very high	89.9	Confident	8 Å²	8	65.8 Å²	65.8	6%	0.056	34%	0.338	C	S	.	.	H	α-helix	trans	-64.3	-42.9	177.1	-172.8	0	0	0	0	112.4	Q47 L48 Q49 N55 Q159	Q47-S51 WeakPolarHBondContact O-CB 3.24Å; Q47-S51 PolarHBondContact O-N 3.32Å; Q47-S51 VanDerWaalsContact O-N 3.09Å; L48-S51 PolarHBondContact O-N 3.01Å; Q49-S51 VanDerWaalsContact C-N 3.28Å; Q49-S51 PolarHBondContact O-N 3.19Å; S51-N55 WeakPolarHBondContact O-CB 3.29Å; S51-N55 PolarHBondContact O-N 3.29Å; S51-Q159 WeakPolarHBondContact OG-CG 3.44Å
52	L	95.9	Very high	91.7	Very high	6 Å²	6	61.8 Å²	61.8	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-62.2	-42.7	176.1	-71.4	170.1	0	0	0	112	L48 Q49 N55 M56 L100 G103 F118 Q159	L48-L52 HydrophobicContact CD1-CD1 4.14Å; L48-L52 HydrophobicContact CD1-CG 4.21Å; L48-L52 HydrophobicContact CG-CD1 4Å; L48-L52 HydrophobicContact CG-CG 4.49Å; L48-L52 VanDerWaalsContact O-CG 3.27Å; L48-L52 WeakPolarHBondContact O-CG 3.38Å; L48-L52 PolarHBondContact O-N 2.96Å; Q49-L52 PolarHBondContact O-N 3.11Å; L52-N55 PolarHBondContact O-N 2.84Å; L52-M56 PolarHBondContact O-N 3.26Å; L52-L100 HydrophobicContact CD2-CD2 3.76Å; L52-G103 VanDerWaalsContact CD1-C 3.42Å; L52-F118 HydrophobicContact CD2-CE2 3.59Å; L52-F118 HydrophobicContact CD2-CZ 3.88Å; L52-Q159 HydrophobicContact CD2-CG 4.42Å
53	Y	96	Very high	93.1	Very high	115 Å²	115	61 Å²	61	45%	0.451	30%	0.296	S	S	.	.	H	α-helix	trans	-60.3	-49.8	178.5	176.1	-96.9	0	0	0	112.2	Q49 M50 N55 M56 W57	Q49-Y53 PolarHBondContact O-N 3.39Å; M50-Y53 PolarHBondContact O-N 3.22Å; Y53-N55 VanDerWaalsContact C-N 3.33Å; Y53-N55 PolarHBondContact O-N 2.85Å; Y53-M56 HydrophobicContact CD2-CE 4.39Å; Y53-M56 WeakPolarHBondContact O-CB 3.35Å; Y53-M56 PolarHBondContact O-N 2.85Å; Y53-W57 AromaticContact CE1-CD1 3.92Å; Y53-W57 AromaticContact CE1-NE1 4Å; Y53-W57 AromaticContact CE2-NE1 3.55Å; Y53-W57 AromaticContact CZ-CD1 3.77Å; Y53-W57 AromaticContact CZ-NE1 3.37Å; Y53-W57 PolarHBondContact O-N 3.44Å; Y53-W57 PolarHBondContact OH-NE1 2.85Å
54	F	96.8	Very high	94.2	Very high	107 Å²	107	64 Å²	64	47%	0.469	31%	0.312	S	S	.	.	H	α-helix	trans	-65.9	-38.8	178.2	-71.5	-57.1	0	0	0	112.1	M50 M56 W57 F58 F155	M50-F54 HydrophobicContact CE-CE2 3.86Å; M50-F54 HydrophobicContact CE-CZ 4.13Å; M50-F54 WeakPolarHBondContact O-CD2 3.35Å; M50-F54 PolarHBondContact O-N 3.33Å; M50-F54 VanDerWaalsContact O-N 3.13Å; F54-M56 VanDerWaalsContact C-N 3.31Å; F54-M56 PolarHBondContact O-N 2.7Å; F54-W57 PolarHBondContact O-N 3.11Å; F54-F58 WeakPolarHBondContact O-CB 3.44Å; F54-F58 PolarHBondContact O-N 3.3Å; F54-F155 HydrophobicContact CB-CE1 3.65Å; F54-F155 HydrophobicContact CB-CZ 3.84Å
55	N	96.6	Very high	95.1	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-36.8	177.3	-172.1	42.1	0	0	0	112	S51 L52 Y53 W57 F58 F59 E96 R99 L100 L152 F155 Q159	S51-N55 WeakPolarHBondContact O-CB 3.29Å; S51-N55 PolarHBondContact O-N 3.29Å; L52-N55 PolarHBondContact O-N 2.84Å; Y53-N55 VanDerWaalsContact C-N 3.33Å; Y53-N55 PolarHBondContact O-N 2.85Å; N55-W57 VanDerWaalsContact C-N 3.3Å; N55-W57 PolarHBondContact O-N 2.99Å; N55-F58 PolarHBondContact O-N 3.22Å; N55-F59 WeakPolarHBondContact O-CB 3.13Å; N55-F59 PolarHBondContact O-N 3.43Å; N55-E96 PolarHBondContact ND2-OE1 3.41Å; N55-R99 PolarHBondContact ND2-NH2 2.83Å; N55-L100 HydrophobicContact CB-CD2 4.48Å; N55-L152 WeakPolarHBondContact OD1-CD1 3.49Å; N55-F155 HydrophobicContact CB-CB 4.5Å; N55-F155 HydrophobicContact CB-CD1 4.21Å; N55-F155 HydrophobicContact CB-CG 4.2Å; N55-Q159 PolarHBondContact ND2-NE2 2.72Å
56	M	96.1	Very high	95.5	Very high	98 Å²	98	61.7 Å²	61.7	48%	0.483	30%	0.295	S	S	.	.	H	α-helix	trans	-58.4	-39.5	174.7	-175.7	179	72.6	0	0	112.7	L52 Y53 F54 P60 L100	L52-M56 PolarHBondContact O-N 3.26Å; Y53-M56 HydrophobicContact CD2-CE 4.39Å; Y53-M56 WeakPolarHBondContact O-CB 3.35Å; Y53-M56 PolarHBondContact O-N 2.85Å; F54-M56 VanDerWaalsContact C-N 3.31Å; F54-M56 PolarHBondContact O-N 2.7Å; M56-P60 WeakPolarHBondContact O-CD 3.47Å; M56-L100 HydrophobicContact CB-CD1 4.23Å; M56-L100 HydrophobicContact CG-CD1 4.48Å
57	W	96.5	Very high	95.9	Very high	161 Å²	161	57.5 Å²	57.5	61%	0.61	28%	0.275	S	S	*	.	H	α-helix	trans	-80	-32.1	177	-74.3	107	0	0	0	113.4	Y53 F54 N55 P60	Y53-W57 AromaticContact CE1-CD1 3.92Å; Y53-W57 AromaticContact CE1-NE1 4Å; Y53-W57 AromaticContact CE2-NE1 3.55Å; Y53-W57 AromaticContact CZ-CD1 3.77Å; Y53-W57 AromaticContact CZ-NE1 3.37Å; Y53-W57 PolarHBondContact O-N 3.44Å; Y53-W57 PolarHBondContact OH-NE1 2.85Å; F54-W57 PolarHBondContact O-N 3.11Å; N55-W57 VanDerWaalsContact C-N 3.3Å; N55-W57 PolarHBondContact O-N 2.99Å; W57-P60 WeakPolarHBondContact O-CD 3.39Å
58	F	96.8	Very high	96.2	Very high	39 Å²	39	55.2 Å²	55.2	17%	0.171	27%	0.269	C	S	.	.	H	α-helix	trans	-69.9	-35.1	175.9	176.3	-104.1	0	0	0	111.9	F54 N55 C61 W62 V148 V151 L152 F155	F54-F58 WeakPolarHBondContact O-CB 3.44Å; F54-F58 PolarHBondContact O-N 3.3Å; N55-F58 PolarHBondContact O-N 3.22Å; F58-C61 WeakPolarHBondContact O-CA 3.41Å; F58-C61 VanDerWaalsContact O-CB 3.29Å; F58-C61 WeakPolarHBondContact O-CB 3.48Å; F58-C61 PolarHBondContact O-N 3.41Å; F58-W62 HydrophobicContact CD1-CB 4.3Å; F58-W62 HydrophobicContact CE1-CB 3.82Å; F58-W62 HydrophobicContact CE1-CG 4.34Å; F58-W62 HydrophobicContact CZ-CB 4.19Å; F58-W62 PolarHBondContact O-N 3.35Å; F58-V148 HydrophobicContact CZ-CB 4.22Å; F58-V151 HydrophobicContact CD1-CG1 4.48Å; F58-V151 HydrophobicContact CD2-CG1 4.1Å; F58-V151 HydrophobicContact CE1-CB 4.37Å; F58-V151 HydrophobicContact CE1-CG1 4.02Å; F58-V151 HydrophobicContact CE2-CB 4.11Å; F58-V151 HydrophobicContact CE2-CG1 3.6Å; F58-V151 HydrophobicContact CZ-CB 3.73Å; F58-V151 HydrophobicContact CZ-CG1 3.56Å; F58-L152 HydrophobicContact CD1-CD1 4.44Å; F58-L152 HydrophobicContact CE1-CB 4.1Å; F58-L152 HydrophobicContact CE1-CD1 4.32Å; F58-F155 HydrophobicContact CB-CE2 4.07Å; F58-F155 HydrophobicContact CD1-CD2 4.19Å; F58-F155 HydrophobicContact CD1-CE2 4.06Å; F58-F155 AromaticContact CG-CE2 3.96Å; F58-F155 HydrophobicContact CG-CE2 3.96Å
59	F	96.4	Very high	96.4	Very high	23 Å²	23	56.3 Å²	56.3	10%	0.101	27%	0.274	C	S	.	.	H	α-helix	trans	-59	-43.7	-172	-173.8	-100.7	0	0	0	114.8	N55 C61 W62 W63 T93 E96	N55-F59 WeakPolarHBondContact O-CB 3.13Å; N55-F59 PolarHBondContact O-N 3.43Å; F59-C61 VanDerWaalsContact C-N 3.26Å; F59-C61 PolarHBondContact O-N 3.11Å; F59-W62 AromaticContact CD2-CE3 3.96Å; F59-W62 HydrophobicContact CD2-CE3 3.96Å; F59-W62 HydrophobicContact CE2-CD2 4.39Å; F59-W62 AromaticContact CE2-CE3 3.43Å; F59-W62 HydrophobicContact CE2-CE3 3.43Å; F59-W62 VanDerWaalsContact CE2-CE3 3.43Å; F59-W62 AromaticContact CE2-CZ3 3.66Å; F59-W62 HydrophobicContact CE2-CZ3 3.66Å; F59-W62 AromaticContact CZ-CE3 3.96Å; F59-W62 HydrophobicContact CZ-CE3 3.96Å; F59-W62 AromaticContact CZ-CZ3 3.93Å; F59-W62 HydrophobicContact CZ-CZ3 3.93Å; F59-W62 WeakPolarHBondContact O-CB 3.32Å; F59-W62 PolarHBondContact O-N 2.89Å; F59-W63 WeakPolarHBondContact O-CB 3.06Å; F59-W63 PolarHBondContact O-N 3.07Å; F59-T93 HydrophobicContact CE1-CG2 4.25Å; F59-T93 HydrophobicContact CZ-CG2 4.46Å; F59-E96 HydrophobicContact CB-CG 4.44Å; F59-E96 HydrophobicContact CD1-CG 3.98Å; F59-E96 HydrophobicContact CD2-CB 4.09Å; F59-E96 HydrophobicContact CD2-CG 3.38Å; F59-E96 HydrophobicContact CE1-CB 4.19Å; F59-E96 HydrophobicContact CE1-CG 4.07Å; F59-E96 HydrophobicContact CE2-CB 3.62Å; F59-E96 HydrophobicContact CE2-CG 3.47Å; F59-E96 VanDerWaalsContact CE2-CG 3.47Å; F59-E96 HydrophobicContact CG-CG 3.65Å; F59-E96 HydrophobicContact CZ-CB 3.7Å; F59-E96 HydrophobicContact CZ-CG 3.84Å
60	P	96.9	Very high	96.5	Very high	64 Å²	64	55.5 Å²	55.5	42%	0.416	27%	0.271	S	S	.	.	H	α-helix	trans	-56.9	-38.9	171.6	-26.6	34	0	0	0	113.3	M56 W57 W63 I64	M56-P60 WeakPolarHBondContact O-CD 3.47Å; W57-P60 WeakPolarHBondContact O-CD 3.39Å; P60-W63 PolarHBondContact O-N 2.86Å; P60-I64 WeakPolarHBondContact O-CD1 3.46Å; P60-I64 VanDerWaalsContact O-CG1 3.26Å; P60-I64 WeakPolarHBondContact O-CG1 3.45Å; P60-I64 PolarHBondContact O-N 3.3Å
61	C	96.7	Very high	96.6	Very high	78 Å²	78	58 Å²	58	53%	0.527	28%	0.281	S	S	.	.	H	α-helix	trans	-67.3	-43.6	177.3	-58.8	0	0	0	0	111.2	F58 F59 W63 S65	F58-C61 WeakPolarHBondContact O-CA 3.41Å; F58-C61 VanDerWaalsContact O-CB 3.29Å; F58-C61 WeakPolarHBondContact O-CB 3.48Å; F58-C61 PolarHBondContact O-N 3.41Å; F59-C61 VanDerWaalsContact C-N 3.26Å; F59-C61 PolarHBondContact O-N 3.11Å; C61-W63 VanDerWaalsContact C-N 3.35Å; C61-S65 WeakPolarHBondContact O-CB 3.49Å; C61-S65 PolarHBondContact O-N 3.4Å
62	W	97.1	Very high	96.6	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.8	-47.2	173	176.6	86.9	0	0	0	111.2	F58 F59 I64 S65 E66 L89 M92 H149 L152	F58-W62 HydrophobicContact CD1-CB 4.3Å; F58-W62 HydrophobicContact CE1-CB 3.82Å; F58-W62 HydrophobicContact CE1-CG 4.34Å; F58-W62 HydrophobicContact CZ-CB 4.19Å; F58-W62 PolarHBondContact O-N 3.35Å; F59-W62 AromaticContact CD2-CE3 3.96Å; F59-W62 HydrophobicContact CD2-CE3 3.96Å; F59-W62 HydrophobicContact CE2-CD2 4.39Å; F59-W62 AromaticContact CE2-CE3 3.43Å; F59-W62 HydrophobicContact CE2-CE3 3.43Å; F59-W62 VanDerWaalsContact CE2-CE3 3.43Å; F59-W62 AromaticContact CE2-CZ3 3.66Å; F59-W62 HydrophobicContact CE2-CZ3 3.66Å; F59-W62 AromaticContact CZ-CE3 3.96Å; F59-W62 HydrophobicContact CZ-CE3 3.96Å; F59-W62 AromaticContact CZ-CZ3 3.93Å; F59-W62 HydrophobicContact CZ-CZ3 3.93Å; F59-W62 WeakPolarHBondContact O-CB 3.32Å; F59-W62 PolarHBondContact O-N 2.89Å; W62-I64 PolarHBondContact O-N 3.06Å; W62-S65 WeakPolarHBondContact O-CB 3.1Å; W62-S65 PolarHBondContact O-N 2.87Å; W62-E66 HydrophobicContact CH2-CB 4.5Å; W62-E66 HydrophobicContact CH2-CG 4.27Å; W62-E66 HydrophobicContact CZ2-CB 4.37Å; W62-E66 HydrophobicContact CZ2-CG 4.13Å; W62-E66 WeakPolarHBondContact O-CB 3.41Å; W62-E66 PolarHBondContact O-N 3.34Å; W62-L89 HydrophobicContact CH2-CD1 4.26Å; W62-L89 HydrophobicContact CZ3-CD1 4.2Å; W62-M92 HydrophobicContact CH2-CB 3.98Å; W62-M92 HydrophobicContact CH2-CE 4.11Å; W62-M92 HydrophobicContact CH2-CG 4.41Å; W62-M92 HydrophobicContact CZ2-CE 4.14Å; W62-M92 HydrophobicContact CZ3-CB 4.41Å; W62-H149 AromaticContact CZ2-CE1 3.87Å; W62-H149 AromaticContact NE1-CE1 3.59Å; W62-H149 AromaticContact NE1-ND1 3.29Å; W62-H149 PolarHBondContact NE1-ND1 2.78Å; W62-L152 HydrophobicContact CD2-CD2 4.19Å; W62-L152 HydrophobicContact CG-CD2 4.29Å; W62-L152 HydrophobicContact CZ2-CD2 4.41Å
63	W	97.6	Very high	96.5	Very high	99 Å²	99	62.9 Å²	62.9	38%	0.375	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-43.3	-177.9	-171.3	93.8	0	0	0	112.8	F59 P60 C61 E66 T67 T93	F59-W63 WeakPolarHBondContact O-CB 3.06Å; F59-W63 PolarHBondContact O-N 3.07Å; P60-W63 PolarHBondContact O-N 2.86Å; C61-W63 VanDerWaalsContact C-N 3.35Å; W63-E66 PolarHBondContact O-N 3.5Å; W63-T67 HydrophobicContact CH2-CG2 4.44Å; W63-T67 HydrophobicContact CZ3-CG2 4.5Å; W63-T67 WeakPolarHBondContact O-CB 3.5Å; W63-T67 PolarHBondContact O-N 3.09Å; W63-T67 PolarHBondContact O-OG1 2.86Å; W63-T93 PolarHBondContact NE1-OG1 3.28Å; W63-T93 VanDerWaalsContact NE1-OG1 3.16Å
64	I	97.6	Very high	96.4	Very high	100 Å²	100	61.6 Å²	61.6	51%	0.513	30%	0.301	S	S	.	.	H	α-helix	trans	-63.2	-47.4	175.6	-67.8	165.1	0	0	0	109.9	P60 W62 E66 T67 V68	P60-I64 WeakPolarHBondContact O-CD1 3.46Å; P60-I64 VanDerWaalsContact O-CG1 3.26Å; P60-I64 WeakPolarHBondContact O-CG1 3.45Å; P60-I64 PolarHBondContact O-N 3.3Å; W62-I64 PolarHBondContact O-N 3.06Å; I64-E66 PolarHBondContact O-N 3.46Å; I64-T67 PolarHBondContact O-N 3.49Å; I64-V68 HydrophobicContact CG2-CG2 4.35Å; I64-V68 WeakPolarHBondContact O-CB 3.38Å; I64-V68 VanDerWaalsContact O-CG2 3.3Å; I64-V68 WeakPolarHBondContact O-CG2 3.18Å; I64-V68 PolarHBondContact O-N 3.42Å
65	S	96.6	Very high	96.3	Very high	13 Å²	13	61.8 Å²	61.8	9%	0.091	31%	0.312	C	S	.	.	H	α-helix	trans	-56.3	-51.1	177.5	177.2	0	0	0	0	111.2	C61 W62 T67 V68 M69 L144	C61-S65 WeakPolarHBondContact O-CB 3.49Å; C61-S65 PolarHBondContact O-N 3.4Å; W62-S65 WeakPolarHBondContact O-CB 3.1Å; W62-S65 PolarHBondContact O-N 2.87Å; S65-T67 PolarHBondContact O-N 3.32Å; S65-V68 PolarHBondContact O-N 3.48Å; S65-M69 WeakPolarHBondContact O-CB 3.45Å; S65-M69 WeakPolarHBondContact O-CG 3.16Å; S65-M69 PolarHBondContact O-N 2.92Å; S65-L144 WeakPolarHBondContact OG-CD2 3.2Å; S65-L144 WeakPolarHBondContact OG-CG 3.39Å
66	E	96.2	Very high	96.1	Very high	7 Å²	7	65.1 Å²	65.1	3%	0.033	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-42.5	-178.9	-165.5	61.9	-158.1	0	0	111.6	W62 W63 I64 M69 L70 L89 Q133 H149	W62-E66 HydrophobicContact CH2-CB 4.5Å; W62-E66 HydrophobicContact CH2-CG 4.27Å; W62-E66 HydrophobicContact CZ2-CB 4.37Å; W62-E66 HydrophobicContact CZ2-CG 4.13Å; W62-E66 WeakPolarHBondContact O-CB 3.41Å; W62-E66 PolarHBondContact O-N 3.34Å; W63-E66 PolarHBondContact O-N 3.5Å; I64-E66 PolarHBondContact O-N 3.46Å; E66-M69 PolarHBondContact O-N 3Å; E66-L70 WeakPolarHBondContact O-CB 3.43Å; E66-L70 PolarHBondContact O-N 3.48Å; E66-L89 HydrophobicContact CB-CD1 4.12Å; E66-L89 HydrophobicContact CG-CD1 3.92Å; E66-Q133 PolarHBondContact OE1-OE1 2.72Å; E66-H149 IonicContact OE1-NE2 3.33Å; E66-H149 IonicContact OE2-CE1 2.72Å; E66-H149 PolarHBondContact OE2-CE1 3.22Å; E66-H149 VanDerWaalsContact OE2-CE1 3.29Å; E66-H149 IonicContact OE2-NE2 2.83Å; E66-H149 PolarHBondContact OE2-NE2 3.02Å
67	T	97.3	Very high	96	Very high	46 Å²	46	60.8 Å²	60.8	28%	0.282	32%	0.319	S	S	.	.	H	α-helix	trans	-63.5	-45.6	178.2	-58.8	0	0	0	0	111.9	W63 I64 S65 H71	W63-T67 HydrophobicContact CH2-CG2 4.44Å; W63-T67 HydrophobicContact CZ3-CG2 4.5Å; W63-T67 WeakPolarHBondContact O-CB 3.5Å; W63-T67 PolarHBondContact O-N 3.09Å; W63-T67 PolarHBondContact O-OG1 2.86Å; I64-T67 PolarHBondContact O-N 3.49Å; S65-T67 PolarHBondContact O-N 3.32Å; T67-H71 WeakPolarHBondContact O-CB 3.44Å; T67-H71 PolarHBondContact O-N 3.25Å
68	V	97.3	Very high	95.9	Very high	75 Å²	75	55.6 Å²	55.6	46%	0.455	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-46.7	178.4	170.9	0	0	0	0	110.3	I64 S65 H71 L72	I64-V68 HydrophobicContact CG2-CG2 4.35Å; I64-V68 WeakPolarHBondContact O-CB 3.38Å; I64-V68 VanDerWaalsContact O-CG2 3.3Å; I64-V68 WeakPolarHBondContact O-CG2 3.18Å; I64-V68 PolarHBondContact O-N 3.42Å; S65-V68 PolarHBondContact O-N 3.48Å; V68-H71 WeakPolarHBondContact O-CB 3.29Å; V68-H71 PolarHBondContact O-N 3.43Å; V68-L72 HydrophobicContact CG1-CD1 4.23Å; V68-L72 WeakPolarHBondContact O-CG 3.4Å; V68-L72 PolarHBondContact O-N 3.49Å
69	M	96.1	Very high	95.7	Very high	22 Å²	22	58.8 Å²	58.8	11%	0.108	32%	0.321	C	S	.	.	H	α-helix	trans	-66.1	-42.1	-178.7	-66.1	-71	123.6	0	0	111.5	S65 E66 H71 L72 K73 Q142 L144 E145	S65-M69 WeakPolarHBondContact O-CB 3.45Å; S65-M69 WeakPolarHBondContact O-CG 3.16Å; S65-M69 PolarHBondContact O-N 2.92Å; E66-M69 PolarHBondContact O-N 3Å; M69-H71 VanDerWaalsContact C-N 3.32Å; M69-H71 PolarHBondContact O-N 3.36Å; M69-L72 HydrophobicContact CE-CD1 3.79Å; M69-L72 PolarHBondContact O-N 3.16Å; M69-L72 HydrophobicContact SD-CD1 4.38Å; M69-K73 WeakPolarHBondContact O-CG 3.22Å; M69-K73 PolarHBondContact O-N 3.13Å; M69-K73 VanDerWaalsContact O-N 3.09Å; M69-Q142 PolarHBondContact O-NE2 3.35Å; M69-Q142 HydrophobicContact SD-CB 3.92Å; M69-Q142 VanDerWaalsContact SD-CD 3.53Å; M69-Q142 HydrophobicContact SD-CG 4.35Å; M69-Q142 PolarHBondContact SD-OE1 3.01Å; M69-L144 HydrophobicContact CE-CB 4.24Å; M69-L144 HydrophobicContact CE-CD2 3.48Å; M69-L144 VanDerWaalsContact CE-CD2 3.48Å; M69-L144 HydrophobicContact CE-CG 4.46Å; M69-L144 HydrophobicContact CG-CB 4.37Å; M69-L144 HydrophobicContact CG-CD2 4.09Å; M69-L144 HydrophobicContact SD-CB 3.93Å; M69-L144 HydrophobicContact SD-CD2 4.08Å; M69-E145 VanDerWaalsContact CB-CD 3.49Å; M69-E145 HydrophobicContact CB-CG 3.32Å; M69-E145 WeakPolarHBondContact CB-OE1 3.36Å; M69-E145 HydrophobicContact CG-CG 3.56Å; M69-E145 HydrophobicContact SD-CG 4.44Å
70	L	96.1	Very high	95.6	Very high	13 Å²	13	64.4 Å²	64.4	7%	0.068	34%	0.343	C	S	.	.	H	α-helix	trans	-57.1	-44.8	172.3	179.2	58.8	0	0	0	111.3	E66 L72 K73 Y74 L77 L85 V86 L89	E66-L70 WeakPolarHBondContact O-CB 3.43Å; E66-L70 PolarHBondContact O-N 3.48Å; L70-L72 VanDerWaalsContact C-N 3.35Å; L70-L72 PolarHBondContact O-N 3.33Å; L70-K73 PolarHBondContact O-N 3Å; L70-Y74 HydrophobicContact CD1-CD2 4.2Å; L70-Y74 HydrophobicContact CG-CD2 4.34Å; L70-Y74 WeakPolarHBondContact O-CA 3.46Å; L70-Y74 VanDerWaalsContact O-CB 3.29Å; L70-Y74 WeakPolarHBondContact O-CB 3.4Å; L70-Y74 PolarHBondContact O-N 2.68Å; L70-L77 HydrophobicContact CD1-CD1 4.36Å; L70-L85 HydrophobicContact CD1-CB 3.78Å; L70-L85 HydrophobicContact CD1-CD1 3.78Å; L70-L85 HydrophobicContact CD1-CG 4.46Å; L70-L85 HydrophobicContact CD2-CB 4.5Å; L70-V86 HydrophobicContact CD2-CG2 4.08Å; L70-L89 HydrophobicContact CD2-CD2 4.29Å
71	H	96.1	Very high	95.4	Very high	145 Å²	145	63 Å²	63	67%	0.671	33%	0.33	S	S	*	.	H	α-helix	trans	-60.3	-43	177.6	-176.8	67	0	0	0	112.3	T67 V68 M69 Y74	T67-H71 WeakPolarHBondContact O-CB 3.44Å; T67-H71 PolarHBondContact O-N 3.25Å; V68-H71 WeakPolarHBondContact O-CB 3.29Å; V68-H71 PolarHBondContact O-N 3.43Å; M69-H71 VanDerWaalsContact C-N 3.32Å; M69-H71 PolarHBondContact O-N 3.36Å; H71-Y74 WeakPolarHBondContact O-CB 3.18Å; H71-Y74 PolarHBondContact O-N 3.32Å
72	L	95.1	Very high	95.3	Very high	106 Å²	106	60.9 Å²	60.9	56%	0.555	31%	0.311	S	S	*	.	H	α-helix	trans	-64.6	-41.6	-179.9	-68.1	172.9	0	0	0	112.6	V68 M69 L70	V68-L72 HydrophobicContact CG1-CD1 4.23Å; V68-L72 WeakPolarHBondContact O-CG 3.4Å; V68-L72 PolarHBondContact O-N 3.49Å; M69-L72 HydrophobicContact CE-CD1 3.79Å; M69-L72 PolarHBondContact O-N 3.16Å; M69-L72 HydrophobicContact SD-CD1 4.38Å; L70-L72 VanDerWaalsContact C-N 3.35Å; L70-L72 PolarHBondContact O-N 3.33Å
73	K	94.4	Very high	95.2	Very high	10 Å²	10	67.2 Å²	67.2	4%	0.043	34%	0.339	C	S	.	.	H	α-helix	trans	-88	-10.9	-180	70.1	-174.8	178.6	-174.6	0	114.1	M69 L70 P75 A76 L77 I139 E145	M69-K73 WeakPolarHBondContact O-CG 3.22Å; M69-K73 PolarHBondContact O-N 3.13Å; M69-K73 VanDerWaalsContact O-N 3.09Å; L70-K73 PolarHBondContact O-N 3Å; K73-P75 VanDerWaalsContact C-CD 3.4Å; K73-P75 VanDerWaalsContact C-N 3.34Å; K73-A76 PolarHBondContact O-N 2.73Å; K73-L77 HydrophobicContact CD-CD1 4.26Å; K73-L77 HydrophobicContact CG-CD1 3.83Å; K73-L77 HydrophobicContact CG-CG 4.31Å; K73-L77 WeakPolarHBondContact O-CG 3.46Å; K73-L77 PolarHBondContact O-N 2.99Å; K73-I139 WeakPolarHBondContact CD-O 3.36Å; K73-I139 WeakPolarHBondContact CE-O 3.42Å; K73-I139 PolarHBondContact NZ-O 2.91Å; K73-I139 VanDerWaalsContact NZ-O 3.11Å; K73-E145 WeakPolarHBondContact CE-OE1 3.16Å; K73-E145 IonicContact NZ-OE1 2.73Å; K73-E145 PolarHBondContact NZ-OE1 3.01Å; K73-E145 IonicContact NZ-OE2 3.51Å; K73-E145 PolarHBondContact NZ-OE2 3.35Å
74	Y	94.2	Very high	95.1	Very high	88 Å²	88	65.7 Å²	65.7	35%	0.345	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-49.4	-43.5	-176.4	-155.4	-98.6	0	0	0	114.3	L70 H71 A76 L77 K82 V86	L70-Y74 HydrophobicContact CD1-CD2 4.2Å; L70-Y74 HydrophobicContact CG-CD2 4.34Å; L70-Y74 WeakPolarHBondContact O-CA 3.46Å; L70-Y74 VanDerWaalsContact O-CB 3.29Å; L70-Y74 WeakPolarHBondContact O-CB 3.4Å; L70-Y74 PolarHBondContact O-N 2.68Å; H71-Y74 WeakPolarHBondContact O-CB 3.18Å; H71-Y74 PolarHBondContact O-N 3.32Å; Y74-A76 VanDerWaalsContact C-N 3.31Å; Y74-A76 PolarHBondContact O-N 3.29Å; Y74-L77 PolarHBondContact O-N 3.03Å; Y74-K82 HydrophobicContact CD1-CD 4.17Å; Y74-K82 HydrophobicContact CD2-CB 4.46Å; Y74-K82 HydrophobicContact CD2-CG 4.26Å; Y74-K82 HydrophobicContact CE1-CD 3.7Å; Y74-K82 HydrophobicContact CE1-CG 4.23Å; Y74-K82 HydrophobicContact CE2-CB 3.71Å; Y74-K82 HydrophobicContact CE2-CD 4.29Å; Y74-K82 HydrophobicContact CE2-CG 3.92Å; Y74-K82 VanDerWaalsContact O-CE 3.24Å; Y74-K82 WeakPolarHBondContact O-CE 3.46Å; Y74-V86 HydrophobicContact CE2-CG2 4.19Å
75	P	94.3	Very high	95	Very high	110 Å²	110	61.2 Å²	61.2	71%	0.714	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-69.7	-26.7	-179.5	-19.1	33.7	0	0	0	113.9	K73	K73-P75 VanDerWaalsContact C-CD 3.4Å; K73-P75 VanDerWaalsContact C-N 3.34Å
76	A	93.6	Very high	95	Very high	70 Å²	70	63.3 Å²	63.3	58%	0.579	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-88.2	-10.9	-177	0	0	0	0	0	113	K73 Y74 L140	K73-A76 PolarHBondContact O-N 2.73Å; Y74-A76 VanDerWaalsContact C-N 3.31Å; Y74-A76 PolarHBondContact O-N 3.29Å; A76-L140 HydrophobicContact CB-CD1 3.99Å
77	L	93.4	Very high	95.1	Very high	8 Å²	8	67 Å²	67	4%	0.042	35%	0.35	C	S	.	.	S	Bend	trans	-84.9	143.8	-177.4	-74	172.4	0	0	0	112.5	L70 K73 Y74 K82 L85 L140	L70-L77 HydrophobicContact CD1-CD1 4.36Å; K73-L77 HydrophobicContact CD-CD1 4.26Å; K73-L77 HydrophobicContact CG-CD1 3.83Å; K73-L77 HydrophobicContact CG-CG 4.31Å; K73-L77 WeakPolarHBondContact O-CG 3.46Å; K73-L77 PolarHBondContact O-N 2.99Å; Y74-L77 PolarHBondContact O-N 3.03Å; L77-K82 HydrophobicContact CB-CG 4.14Å; L77-K82 WeakPolarHBondContact O-CE 3.24Å; L77-L85 HydrophobicContact CD1-CD1 3.55Å; L77-L140 HydrophobicContact CD2-CD1 4.38Å; L77-L140 HydrophobicContact CD2-CG 4.47Å
78	P	93.9	Very high	95	Very high	52 Å²	52	65.4 Å²	65.4	34%	0.338	34%	0.34	S	S	.	.			trans	-57.6	148.5	165	-23.6	33.6	0	0	0	112.4	Y80 Y81 K82	P78-Y80 VanDerWaalsContact C-N 3.32Å; P78-Y80 HydrophobicContact CB-CD1 3.8Å; P78-Y80 HydrophobicContact CB-CE1 3.24Å; P78-Y80 HydrophobicContact CB-CE2 4.35Å; P78-Y80 HydrophobicContact CG-CE1 4.13Å; P78-Y80 PolarHBondContact O-N 3.29Å; P78-Y81 HydrophobicContact CB-CD2 4.25Å; P78-Y81 HydrophobicContact CG-CD2 3.99Å; P78-Y81 PolarHBondContact O-N 3.06Å; P78-K82 PolarHBondContact O-N 2.97Å
79	E	92.6	Very high	95	Very high	105 Å²	105	62.7 Å²	62.7	49%	0.491	32%	0.322	S	S	.	.	H	α-helix	trans	-56.4	-42.4	-172.6	-164	63.2	-157.6	0	0	113.4	Y81 K82 F83	E79-Y81 VanDerWaalsContact C-N 3.32Å; E79-Y81 PolarHBondContact O-N 2.9Å; E79-K82 WeakPolarHBondContact O-CB 3.47Å; E79-K82 PolarHBondContact O-N 3.03Å; E79-K82 IonicContact OE2-NZ 2.75Å; E79-K82 PolarHBondContact OE2-NZ 3.49Å; E79-F83 HydrophobicContact CG-CD2 4.43Å; E79-F83 HydrophobicContact CG-CE2 3.97Å; E79-F83 VanDerWaalsContact O-CD2 3.27Å; E79-F83 WeakPolarHBondContact O-CD2 3.47Å; E79-F83 PolarHBondContact O-N 2.99Å
80	Y	93.8	Very high	95.1	Very high	142 Å²	142	67.1 Å²	67.1	56%	0.557	35%	0.346	S	S	*	.	H	α-helix	trans	-63.4	-36.3	178.3	59.1	-90.9	0	0	0	112.5	P78 K82 F83 I84	P78-Y80 VanDerWaalsContact C-N 3.32Å; P78-Y80 HydrophobicContact CB-CD1 3.8Å; P78-Y80 HydrophobicContact CB-CE1 3.24Å; P78-Y80 HydrophobicContact CB-CE2 4.35Å; P78-Y80 HydrophobicContact CG-CE1 4.13Å; P78-Y80 PolarHBondContact O-N 3.29Å; Y80-K82 VanDerWaalsContact C-N 3.34Å; Y80-K82 PolarHBondContact O-N 3.38Å; Y80-F83 PolarHBondContact O-N 2.81Å; Y80-I84 HydrophobicContact CD2-CD1 4.34Å; Y80-I84 WeakPolarHBondContact O-CD1 3.39Å; Y80-I84 WeakPolarHBondContact O-CG1 3.5Å; Y80-I84 PolarHBondContact O-N 3.45Å; Y80-I84 VanDerWaalsContact O-N 3.09Å
81	Y	94.1	Very high	95.1	Very high	34 Å²	34	70 Å²	70	13%	0.133	36%	0.361	C	S	.	.	H	α-helix	trans	-68.7	-33.1	177.4	-86.6	-54.5	0	0	0	112.5	P78 E79 I84 L85 F132 N136 A138 I139	P78-Y81 HydrophobicContact CB-CD2 4.25Å; P78-Y81 HydrophobicContact CG-CD2 3.99Å; P78-Y81 PolarHBondContact O-N 3.06Å; E79-Y81 VanDerWaalsContact C-N 3.32Å; E79-Y81 PolarHBondContact O-N 2.9Å; Y81-I84 HydrophobicContact CD1-CD1 4.38Å; Y81-I84 PolarHBondContact O-N 3.14Å; Y81-L85 WeakPolarHBondContact O-CB 3.44Å; Y81-L85 VanDerWaalsContact O-CG 3.29Å; Y81-L85 WeakPolarHBondContact O-CG 3.15Å; Y81-L85 PolarHBondContact O-N 3.37Å; Y81-F132 HydrophobicContact CE1-CZ 4.36Å; Y81-N136 PolarHBondContact OH-ND2 3.38Å; Y81-A138 HydrophobicContact CE2-CB 3.89Å; Y81-A138 WeakPolarHBondContact OH-CB 3.37Å; Y81-I139 HydrophobicContact CD1-CG2 3.69Å; Y81-I139 HydrophobicContact CE1-CG2 3.69Å; Y81-I139 HydrophobicContact CG-CG2 4.36Å
82	K	94.2	Very high	95.1	Very high	33 Å²	33	63.1 Å²	63.1	14%	0.143	33%	0.329	C	S	.	.	H	α-helix	trans	-58	-51.9	174.8	-61.1	174	-170.2	169.9	0	111	Y74 L77 P78 E79 Y80 I84 L85 V86	Y74-K82 HydrophobicContact CD1-CD 4.17Å; Y74-K82 HydrophobicContact CD2-CB 4.46Å; Y74-K82 HydrophobicContact CD2-CG 4.26Å; Y74-K82 HydrophobicContact CE1-CD 3.7Å; Y74-K82 HydrophobicContact CE1-CG 4.23Å; Y74-K82 HydrophobicContact CE2-CB 3.71Å; Y74-K82 HydrophobicContact CE2-CD 4.29Å; Y74-K82 HydrophobicContact CE2-CG 3.92Å; Y74-K82 VanDerWaalsContact O-CE 3.24Å; Y74-K82 WeakPolarHBondContact O-CE 3.46Å; L77-K82 HydrophobicContact CB-CG 4.14Å; L77-K82 WeakPolarHBondContact O-CE 3.24Å; P78-K82 PolarHBondContact O-N 2.97Å; E79-K82 WeakPolarHBondContact O-CB 3.47Å; E79-K82 PolarHBondContact O-N 3.03Å; E79-K82 IonicContact OE2-NZ 2.75Å; E79-K82 PolarHBondContact OE2-NZ 3.49Å; Y80-K82 VanDerWaalsContact C-N 3.34Å; Y80-K82 PolarHBondContact O-N 3.38Å; K82-I84 PolarHBondContact O-N 3.35Å; K82-L85 PolarHBondContact O-N 3.13Å; K82-V86 VanDerWaalsContact O-CG2 3.31Å; K82-V86 WeakPolarHBondContact O-CG2 3.29Å; K82-V86 PolarHBondContact O-N 3.44Å
83	F	94.5	Very high	95.2	Very high	134 Å²	134	60.1 Å²	60.1	59%	0.588	32%	0.315	S	S	*	.	H	α-helix	trans	-60.8	-44.2	177.8	-74	-73.5	0	0	0	112.2	E79 Y80 T87	E79-F83 HydrophobicContact CG-CD2 4.43Å; E79-F83 HydrophobicContact CG-CE2 3.97Å; E79-F83 VanDerWaalsContact O-CD2 3.27Å; E79-F83 WeakPolarHBondContact O-CD2 3.47Å; E79-F83 PolarHBondContact O-N 2.99Å; Y80-F83 PolarHBondContact O-N 2.81Å; F83-T87 WeakPolarHBondContact O-CB 3.07Å; F83-T87 PolarHBondContact O-N 2.94Å; F83-T87 PolarHBondContact O-OG1 2.8Å
84	I	95.3	Very high	95.4	Very high	67 Å²	67	64.8 Å²	64.8	34%	0.344	34%	0.34	S	S	.	.	H	α-helix	trans	-60.9	-50.5	179.1	-69	166.1	0	0	0	110.8	Y80 Y81 K82 T87 I88 F132	Y80-I84 HydrophobicContact CD2-CD1 4.34Å; Y80-I84 WeakPolarHBondContact O-CD1 3.39Å; Y80-I84 WeakPolarHBondContact O-CG1 3.5Å; Y80-I84 PolarHBondContact O-N 3.45Å; Y80-I84 VanDerWaalsContact O-N 3.09Å; Y81-I84 HydrophobicContact CD1-CD1 4.38Å; Y81-I84 PolarHBondContact O-N 3.14Å; K82-I84 PolarHBondContact O-N 3.35Å; I84-T87 WeakPolarHBondContact O-CB 3.39Å; I84-T87 PolarHBondContact O-N 2.62Å; I84-I88 HydrophobicContact CG2-CD1 3.72Å; I84-I88 HydrophobicContact CG2-CG1 4.35Å; I84-I88 VanDerWaalsContact O-CG1 3.3Å; I84-I88 WeakPolarHBondContact O-CG1 3.2Å; I84-I88 PolarHBondContact O-N 2.85Å; I84-F132 HydrophobicContact CG2-CE1 4.15Å; I84-F132 HydrophobicContact CG2-CZ 4.19Å
85	L	96.2	Very high	95.5	Very high	6 Å²	6	61.1 Å²	61.1	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-67.6	-39.9	-175.7	-68.5	177.5	0	0	0	112.6	L70 L77 Y81 K82 T87 I88 L89 I139	L70-L85 HydrophobicContact CD1-CB 3.78Å; L70-L85 HydrophobicContact CD1-CD1 3.78Å; L70-L85 HydrophobicContact CD1-CG 4.46Å; L70-L85 HydrophobicContact CD2-CB 4.5Å; L77-L85 HydrophobicContact CD1-CD1 3.55Å; Y81-L85 WeakPolarHBondContact O-CB 3.44Å; Y81-L85 VanDerWaalsContact O-CG 3.29Å; Y81-L85 WeakPolarHBondContact O-CG 3.15Å; Y81-L85 PolarHBondContact O-N 3.37Å; K82-L85 PolarHBondContact O-N 3.13Å; L85-T87 VanDerWaalsContact C-N 3.3Å; L85-T87 PolarHBondContact O-N 3.21Å; L85-I88 PolarHBondContact O-N 2.93Å; L85-L89 WeakPolarHBondContact O-CB 3.37Å; L85-L89 PolarHBondContact O-N 3.17Å; L85-I139 HydrophobicContact CD1-CB 4.29Å; L85-I139 HydrophobicContact CD1-CG2 4.44Å; L85-I139 HydrophobicContact CD2-CB 4.46Å; L85-I139 HydrophobicContact CD2-CD1 4.07Å; L85-I139 HydrophobicContact CD2-CG2 4.16Å
86	V	97.2	Very high	95.7	Very high	56 Å²	56	55.9 Å²	55.9	34%	0.339	29%	0.292	S	S	.	.	H	α-helix	trans	-60.9	-43.3	173.2	172.3	0	0	0	0	110.6	L70 Y74 K82 I88 L89 L90	L70-V86 HydrophobicContact CD2-CG2 4.08Å; Y74-V86 HydrophobicContact CE2-CG2 4.19Å; K82-V86 VanDerWaalsContact O-CG2 3.31Å; K82-V86 WeakPolarHBondContact O-CG2 3.29Å; K82-V86 PolarHBondContact O-N 3.44Å; V86-I88 PolarHBondContact O-N 3.01Å; V86-L89 PolarHBondContact O-N 3.49Å; V86-L90 HydrophobicContact CG1-CD1 4.36Å; V86-L90 WeakPolarHBondContact O-CG 3.44Å; V86-L90 PolarHBondContact O-N 3.21Å; V86-L90 VanDerWaalsContact O-N 3.11Å
87	T	96.8	Very high	95.8	Very high	84 Å²	84	55.4 Å²	55.4	52%	0.515	29%	0.289	S	S	.	.	H	α-helix	trans	-62.7	-43.8	177.1	-56.5	0	0	0	0	111.2	F83 I84 L85 L90 L91	F83-T87 WeakPolarHBondContact O-CB 3.07Å; F83-T87 PolarHBondContact O-N 2.94Å; F83-T87 PolarHBondContact O-OG1 2.8Å; I84-T87 WeakPolarHBondContact O-CB 3.39Å; I84-T87 PolarHBondContact O-N 2.62Å; L85-T87 VanDerWaalsContact C-N 3.3Å; L85-T87 PolarHBondContact O-N 3.21Å; T87-L90 PolarHBondContact O-N 3.37Å; T87-L91 WeakPolarHBondContact O-CB 3.34Å; T87-L91 PolarHBondContact O-N 3.39Å
88	I	96.6	Very high	96.1	Very high	14 Å²	14	58.9 Å²	58.9	7%	0.072	31%	0.306	C	S	.	.	H	α-helix	trans	-61.6	-45.6	176.9	-71.8	174.2	0	0	0	110.8	I84 L85 V86 L90 L91 M92 L129 F132 Q133	I84-I88 HydrophobicContact CG2-CD1 3.72Å; I84-I88 HydrophobicContact CG2-CG1 4.35Å; I84-I88 VanDerWaalsContact O-CG1 3.3Å; I84-I88 WeakPolarHBondContact O-CG1 3.2Å; I84-I88 PolarHBondContact O-N 2.85Å; L85-I88 PolarHBondContact O-N 2.93Å; V86-I88 PolarHBondContact O-N 3.01Å; I88-L90 VanDerWaalsContact C-N 3.34Å; I88-L90 PolarHBondContact O-N 2.78Å; I88-L91 PolarHBondContact O-N 3.14Å; I88-M92 HydrophobicContact CG2-CG 3.89Å; I88-M92 WeakPolarHBondContact O-CB 3.49Å; I88-M92 WeakPolarHBondContact O-CG 3.46Å; I88-M92 PolarHBondContact O-N 2.94Å; I88-L129 HydrophobicContact CG1-CD2 4.17Å; I88-F132 HydrophobicContact CD1-CD1 3.49Å; I88-F132 VanDerWaalsContact CD1-CD1 3.49Å; I88-F132 HydrophobicContact CD1-CE1 3.42Å; I88-F132 VanDerWaalsContact CD1-CE1 3.42Å; I88-F132 HydrophobicContact CD1-CZ 4.48Å; I88-Q133 HydrophobicContact CG2-CG 4.3Å
89	L	97.1	Very high	96.2	Very high	17 Å²	17	56.4 Å²	56.4	9%	0.089	29%	0.29	C	S	.	.	H	α-helix	trans	-57.9	-46.3	178.5	178.7	61.5	0	0	0	111.6	W62 E66 L70 L85 V86 T93	W62-L89 HydrophobicContact CH2-CD1 4.26Å; W62-L89 HydrophobicContact CZ3-CD1 4.2Å; E66-L89 HydrophobicContact CB-CD1 4.12Å; E66-L89 HydrophobicContact CG-CD1 3.92Å; L70-L89 HydrophobicContact CD2-CD2 4.29Å; L85-L89 WeakPolarHBondContact O-CB 3.37Å; L85-L89 PolarHBondContact O-N 3.17Å; V86-L89 PolarHBondContact O-N 3.49Å; L89-T93 WeakPolarHBondContact O-CB 3.3Å; L89-T93 PolarHBondContact O-N 2.84Å; L89-T93 VanDerWaalsContact O-N 3.07Å; L89-T93 PolarHBondContact O-OG1 2.92Å
90	L	97.6	Very high	96.4	Very high	115 Å²	115	52.8 Å²	52.8	60%	0.602	27%	0.274	S	S	*	.	H	α-helix	trans	-65.7	-46.7	177.2	-66.9	177	0	0	0	112	V86 T87 I88 T93 L94	V86-L90 HydrophobicContact CG1-CD1 4.36Å; V86-L90 WeakPolarHBondContact O-CG 3.44Å; V86-L90 PolarHBondContact O-N 3.21Å; V86-L90 VanDerWaalsContact O-N 3.11Å; T87-L90 PolarHBondContact O-N 3.37Å; I88-L90 VanDerWaalsContact C-N 3.34Å; I88-L90 PolarHBondContact O-N 2.78Å; L90-T93 WeakPolarHBondContact O-CB 3.37Å; L90-T93 PolarHBondContact O-N 3.25Å; L90-L94 PolarHBondContact O-N 3.17Å
91	L	97.3	Very high	96.5	Very high	74 Å²	74	53.5 Å²	53.5	39%	0.387	28%	0.277	S	S	.	.	H	α-helix	trans	-64.1	-44.3	-178.4	-176.2	61.7	0	0	0	111.1	T87 I88 T93 L94 I95 L129	T87-L91 WeakPolarHBondContact O-CB 3.34Å; T87-L91 PolarHBondContact O-N 3.39Å; I88-L91 PolarHBondContact O-N 3.14Å; L91-T93 VanDerWaalsContact C-N 3.3Å; L91-T93 PolarHBondContact O-N 3.41Å; L91-L94 PolarHBondContact O-N 2.97Å; L91-I95 HydrophobicContact CD1-CD1 3.86Å; L91-I95 HydrophobicContact CD1-CG1 4.19Å; L91-I95 HydrophobicContact CD2-CD1 4.29Å; L91-I95 HydrophobicContact CG-CD1 3.59Å; L91-I95 HydrophobicContact CG-CG1 4.34Å; L91-I95 WeakPolarHBondContact O-CB 3.34Å; L91-I95 WeakPolarHBondContact O-CD1 3.34Å; L91-I95 WeakPolarHBondContact O-CG1 3.4Å; L91-I95 PolarHBondContact O-N 3.32Å; L91-L129 HydrophobicContact CD2-CD1 3.98Å; L91-L129 HydrophobicContact CG-CD1 4.29Å
92	M	96.1	Very high	96.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.5	-41	174.2	-75.1	-73.9	-73.3	0	0	111.6	W62 I88 E96 Q126 L129 I130 L152	W62-M92 HydrophobicContact CH2-CB 3.98Å; W62-M92 HydrophobicContact CH2-CE 4.11Å; W62-M92 HydrophobicContact CH2-CG 4.41Å; W62-M92 HydrophobicContact CZ2-CE 4.14Å; W62-M92 HydrophobicContact CZ3-CB 4.41Å; I88-M92 HydrophobicContact CG2-CG 3.89Å; I88-M92 WeakPolarHBondContact O-CB 3.49Å; I88-M92 WeakPolarHBondContact O-CG 3.46Å; I88-M92 PolarHBondContact O-N 2.94Å; M92-E96 WeakPolarHBondContact O-CB 3.41Å; M92-E96 PolarHBondContact O-N 3.49Å; M92-Q126 HydrophobicContact CE-CG 4.44Å; M92-L129 HydrophobicContact CG-CB 4.36Å; M92-L129 HydrophobicContact CG-CD1 4.17Å; M92-L129 HydrophobicContact SD-CB 3.55Å; M92-L129 VanDerWaalsContact SD-CB 3.55Å; M92-L129 HydrophobicContact SD-CD1 3.76Å; M92-L129 HydrophobicContact SD-CG 4.31Å; M92-I130 HydrophobicContact CE-CD1 3.78Å; M92-I130 HydrophobicContact CE-CG1 3.33Å; M92-I130 HydrophobicContact SD-CG1 4.36Å; M92-L152 HydrophobicContact CE-CD2 4.23Å
93	T	96.8	Very high	96.7	Very high	44 Å²	44	51.9 Å²	51.9	27%	0.27	27%	0.272	S	S	.	.	H	α-helix	trans	-62.6	-47	176.3	-54.9	0	0	0	0	112	F59 W63 L89 L90 L91 A97	F59-T93 HydrophobicContact CE1-CG2 4.25Å; F59-T93 HydrophobicContact CZ-CG2 4.46Å; W63-T93 PolarHBondContact NE1-OG1 3.28Å; W63-T93 VanDerWaalsContact NE1-OG1 3.16Å; L89-T93 WeakPolarHBondContact O-CB 3.3Å; L89-T93 PolarHBondContact O-N 2.84Å; L89-T93 VanDerWaalsContact O-N 3.07Å; L89-T93 PolarHBondContact O-OG1 2.92Å; L90-T93 WeakPolarHBondContact O-CB 3.37Å; L90-T93 PolarHBondContact O-N 3.25Å; L91-T93 VanDerWaalsContact C-N 3.3Å; L91-T93 PolarHBondContact O-N 3.41Å; T93-A97 PolarHBondContact O-N 3.24Å; T93-A97 VanDerWaalsContact O-N 3.13Å
94	L	98.1	Very high	96.7	Very high	108 Å²	108	51.7 Å²	51.7	57%	0.565	27%	0.268	S	S	*	.	H	α-helix	trans	-65.5	-47.6	178.4	-179.8	64.3	0	0	0	111.8	L90 L91 E96 A97 I98	L90-L94 PolarHBondContact O-N 3.17Å; L91-L94 PolarHBondContact O-N 2.97Å; L94-E96 VanDerWaalsContact C-N 3.34Å; L94-E96 PolarHBondContact O-N 3.35Å; L94-A97 PolarHBondContact O-N 3.21Å; L94-I98 HydrophobicContact CD1-CD1 4.03Å; L94-I98 HydrophobicContact CG-CD1 4.06Å; L94-I98 WeakPolarHBondContact O-CG1 3.46Å; L94-I98 PolarHBondContact O-N 3.49Å; L94-I98 VanDerWaalsContact O-N 3.14Å
95	I	97.1	Very high	96.6	Very high	10 Å²	10	48.7 Å²	48.7	5%	0.051	25%	0.253	C	S	.	.	H	α-helix	trans	-61.1	-45.8	179	-69.2	164.3	0	0	0	110	L91 A97 I98 R99 L121 L125 Q126 L129	L91-I95 HydrophobicContact CD1-CD1 3.86Å; L91-I95 HydrophobicContact CD1-CG1 4.19Å; L91-I95 HydrophobicContact CD2-CD1 4.29Å; L91-I95 HydrophobicContact CG-CD1 3.59Å; L91-I95 HydrophobicContact CG-CG1 4.34Å; L91-I95 WeakPolarHBondContact O-CB 3.34Å; L91-I95 WeakPolarHBondContact O-CD1 3.34Å; L91-I95 WeakPolarHBondContact O-CG1 3.4Å; L91-I95 PolarHBondContact O-N 3.32Å; I95-A97 PolarHBondContact O-N 3.48Å; I95-I98 PolarHBondContact O-N 3.03Å; I95-R99 WeakPolarHBondContact O-CB 3.22Å; I95-R99 PolarHBondContact O-N 3.26Å; I95-L121 HydrophobicContact CG2-CB 4.41Å; I95-L125 HydrophobicContact CD1-CB 3.84Å; I95-L125 HydrophobicContact CD1-CD1 4.01Å; I95-L125 HydrophobicContact CG1-CD1 4.28Å; I95-L125 HydrophobicContact CG2-CB 4.46Å; I95-Q126 VanDerWaalsContact CG2-OE1 3.26Å; I95-L129 HydrophobicContact CD1-CD1 3.86Å
96	E	97.1	Very high	96.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57	-49.4	178.7	-175.7	81.4	-156.5	0	0	111.3	N55 F59 M92 L94 I98 R99 L100 Q126	N55-E96 PolarHBondContact ND2-OE1 3.41Å; F59-E96 HydrophobicContact CB-CG 4.44Å; F59-E96 HydrophobicContact CD1-CG 3.98Å; F59-E96 HydrophobicContact CD2-CB 4.09Å; F59-E96 HydrophobicContact CD2-CG 3.38Å; F59-E96 HydrophobicContact CE1-CB 4.19Å; F59-E96 HydrophobicContact CE1-CG 4.07Å; F59-E96 HydrophobicContact CE2-CB 3.62Å; F59-E96 HydrophobicContact CE2-CG 3.47Å; F59-E96 VanDerWaalsContact CE2-CG 3.47Å; F59-E96 HydrophobicContact CG-CG 3.65Å; F59-E96 HydrophobicContact CZ-CB 3.7Å; F59-E96 HydrophobicContact CZ-CG 3.84Å; M92-E96 WeakPolarHBondContact O-CB 3.41Å; M92-E96 PolarHBondContact O-N 3.49Å; L94-E96 VanDerWaalsContact C-N 3.34Å; L94-E96 PolarHBondContact O-N 3.35Å; E96-I98 PolarHBondContact O-N 3.09Å; E96-R99 VanDerWaalsContact CD-NH1 3.34Å; E96-R99 PolarHBondContact O-N 2.95Å; E96-R99 IonicContact OE1-CZ 3.76Å; E96-R99 IonicContact OE1-NH1 2.62Å; E96-R99 IonicContact OE1-NH2 3.91Å; E96-R99 PolarHBondContact OE1-NH2 3.3Å; E96-R99 IonicContact OE2-CZ 2.8Å; E96-R99 IonicContact OE2-NH1 3.11Å; E96-R99 PolarHBondContact OE2-NH1 3.14Å; E96-R99 IonicContact OE2-NH2 3.6Å; E96-R99 PolarHBondContact OE2-NH2 3.44Å; E96-L100 HydrophobicContact CG-CD1 3.88Å; E96-L100 HydrophobicContact CG-CG 4.21Å; E96-L100 WeakPolarHBondContact O-CB 3.42Å; E96-L100 WeakPolarHBondContact O-CG 3.41Å; E96-L100 PolarHBondContact O-N 3.11Å; E96-Q126 PolarHBondContact OE2-NE2 3.47Å
97	A	97.2	Very high	96.2	Very high	61 Å²	61	45.8 Å²	45.8	50%	0.504	24%	0.236	S	C	.	.	H	α-helix	trans	-59	-48.1	-178.7	0	0	0	0	0	111.7	T93 L94 I95 Y101	T93-A97 PolarHBondContact O-N 3.24Å; T93-A97 VanDerWaalsContact O-N 3.13Å; L94-A97 PolarHBondContact O-N 3.21Å; I95-A97 PolarHBondContact O-N 3.48Å; A97-Y101 WeakPolarHBondContact O-CB 3.34Å; A97-Y101 PolarHBondContact O-N 2.9Å; A97-Y101 VanDerWaalsContact O-N 3.14Å
98	I	97.9	Very high	95.8	Very high	81 Å²	81	45.5 Å²	45.5	42%	0.415	23%	0.231	S	C	.	.	H	α-helix	trans	-64.2	-43.8	177.4	-63	169.8	0	0	0	110.2	L94 I95 E96 Y101 L102 L121	L94-I98 HydrophobicContact CD1-CD1 4.03Å; L94-I98 HydrophobicContact CG-CD1 4.06Å; L94-I98 WeakPolarHBondContact O-CG1 3.46Å; L94-I98 PolarHBondContact O-N 3.49Å; L94-I98 VanDerWaalsContact O-N 3.14Å; I95-I98 PolarHBondContact O-N 3.03Å; E96-I98 PolarHBondContact O-N 3.09Å; I98-Y101 PolarHBondContact O-N 3.45Å; I98-L102 HydrophobicContact CG2-CD1 3.89Å; I98-L102 HydrophobicContact CG2-CG 4.24Å; I98-L102 WeakPolarHBondContact O-CB 3.08Å; I98-L102 WeakPolarHBondContact O-CG 3.44Å; I98-L102 PolarHBondContact O-N 3.34Å; I98-L121 HydrophobicContact CB-CD1 4.39Å; I98-L121 HydrophobicContact CG2-CD1 3.79Å
99	R	97.5	Very high	95.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62	-50.2	-179.1	-172.4	-176.2	90	-114	-1	111	N55 I95 E96 Y101 L102 G103 F118 L121 T122 Q126	N55-R99 PolarHBondContact ND2-NH2 2.83Å; I95-R99 WeakPolarHBondContact O-CB 3.22Å; I95-R99 PolarHBondContact O-N 3.26Å; E96-R99 VanDerWaalsContact CD-NH1 3.34Å; E96-R99 PolarHBondContact O-N 2.95Å; E96-R99 IonicContact OE1-CZ 3.76Å; E96-R99 IonicContact OE1-NH1 2.62Å; E96-R99 IonicContact OE1-NH2 3.91Å; E96-R99 PolarHBondContact OE1-NH2 3.3Å; E96-R99 IonicContact OE2-CZ 2.8Å; E96-R99 IonicContact OE2-NH1 3.11Å; E96-R99 PolarHBondContact OE2-NH1 3.14Å; E96-R99 IonicContact OE2-NH2 3.6Å; E96-R99 PolarHBondContact OE2-NH2 3.44Å; R99-Y101 VanDerWaalsContact C-N 3.3Å; R99-Y101 PolarHBondContact O-N 2.79Å; R99-L102 PolarHBondContact O-N 3.12Å; R99-G103 PolarHBondContact O-N 3.44Å; R99-F118 HydrophobicContact CG-CD2 3.38Å; R99-F118 HydrophobicContact CG-CE2 3.59Å; R99-F118 HydrophobicContact CG-CG 4.46Å; R99-F118 VanDerWaalsContact O-CD2 3.24Å; R99-F118 WeakPolarHBondContact O-CD2 3.09Å; R99-L121 HydrophobicContact CB-CB 4.34Å; R99-L121 HydrophobicContact CB-CD1 4.21Å; R99-L121 HydrophobicContact CG-CB 4.21Å; R99-T122 WeakPolarHBondContact CD-OG1 3.36Å; R99-Q126 VanDerWaalsContact NH1-CG 3.28Å; R99-Q126 VanDerWaalsContact NH1-NE2 3.16Å
100	L	95.9	Very high	94.9	Very high	28 Å²	28	52.6 Å²	52.6	15%	0.147	26%	0.263	C	S	.	.	H	α-helix	trans	-59.1	-42.1	178.1	-73.2	176.2	0	0	0	111.6	L52 N55 M56 E96 G103 Y104	L52-L100 HydrophobicContact CD2-CD2 3.76Å; N55-L100 HydrophobicContact CB-CD2 4.48Å; M56-L100 HydrophobicContact CB-CD1 4.23Å; M56-L100 HydrophobicContact CG-CD1 4.48Å; E96-L100 HydrophobicContact CG-CD1 3.88Å; E96-L100 HydrophobicContact CG-CG 4.21Å; E96-L100 WeakPolarHBondContact O-CB 3.42Å; E96-L100 WeakPolarHBondContact O-CG 3.41Å; E96-L100 PolarHBondContact O-N 3.11Å; L100-G103 PolarHBondContact O-N 2.97Å; L100-Y104 WeakPolarHBondContact O-CB 3.41Å; L100-Y104 PolarHBondContact O-N 2.84Å
101	Y	96.4	Very high	94.5	Very high	158 Å²	158	51.2 Å²	51.2	62%	0.62	25%	0.252	S	S	*	.	H	α-helix	trans	-59.9	-52.4	175	170.8	-99.2	0	0	0	111.9	A97 I98 R99 G103 Y104 A105	A97-Y101 WeakPolarHBondContact O-CB 3.34Å; A97-Y101 PolarHBondContact O-N 2.9Å; A97-Y101 VanDerWaalsContact O-N 3.14Å; I98-Y101 PolarHBondContact O-N 3.45Å; R99-Y101 VanDerWaalsContact C-N 3.3Å; R99-Y101 PolarHBondContact O-N 2.79Å; Y101-G103 VanDerWaalsContact C-N 3.34Å; Y101-G103 PolarHBondContact O-N 2.89Å; Y101-Y104 PolarHBondContact O-N 3.27Å; Y101-A105 VanDerWaalsContact O-CB 3.3Å; Y101-A105 WeakPolarHBondContact O-CB 3.41Å; Y101-A105 PolarHBondContact O-N 3.24Å
102	L	96.8	Very high	94.2	Very high	32 Å²	32	49.3 Å²	49.3	17%	0.168	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-38.6	-179.4	-70.3	-179.8	0	0	0	112.3	I98 R99 G106 E114 F118 L121	I98-L102 HydrophobicContact CG2-CD1 3.89Å; I98-L102 HydrophobicContact CG2-CG 4.24Å; I98-L102 WeakPolarHBondContact O-CB 3.08Å; I98-L102 WeakPolarHBondContact O-CG 3.44Å; I98-L102 PolarHBondContact O-N 3.34Å; R99-L102 PolarHBondContact O-N 3.12Å; L102-G106 WeakPolarHBondContact O-CA 3.35Å; L102-G106 PolarHBondContact O-N 3.34Å; L102-E114 HydrophobicContact CD2-CB 4.08Å; L102-E114 HydrophobicContact CD2-CG 3.98Å; L102-F118 HydrophobicContact CB-CB 4Å; L102-L121 HydrophobicContact CD1-CD1 3.92Å
103	G	95.6	Very high	94.1	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65	-43.7	177.2	0	0	0	0	0	112	L52 R99 L100 Y101 N107	L52-G103 VanDerWaalsContact CD1-C 3.42Å; R99-G103 PolarHBondContact O-N 3.44Å; L100-G103 PolarHBondContact O-N 2.97Å; Y101-G103 VanDerWaalsContact C-N 3.34Å; Y101-G103 PolarHBondContact O-N 2.89Å; G103-N107 WeakPolarHBondContact O-CB 3.25Å; G103-N107 PolarHBondContact O-N 2.84Å; G103-N107 VanDerWaalsContact O-N 3.12Å
104	Y	94.1	Very high	94	Very high	131 Å²	131	54.3 Å²	54.3	51%	0.514	27%	0.273	S	S	.	.	H	α-helix	trans	-67	-51.2	178	-172	-88.2	0	0	0	111.3	L100 Y101 L108	L100-Y104 WeakPolarHBondContact O-CB 3.41Å; L100-Y104 PolarHBondContact O-N 2.84Å; Y101-Y104 PolarHBondContact O-N 3.27Å; Y104-L108 HydrophobicContact CD1-CD1 3.82Å; Y104-L108 HydrophobicContact CD2-CD1 4.33Å; Y104-L108 HydrophobicContact CE1-CD1 3.29Å; Y104-L108 HydrophobicContact CE2-CD1 3.88Å; Y104-L108 HydrophobicContact CG-CD1 4.29Å; Y104-L108 WeakPolarHBondContact O-CB 3.18Å; Y104-L108 PolarHBondContact O-N 2.92Å; Y104-L108 VanDerWaalsContact O-N 3.11Å
105	A	93.3	Very high	93.8	Very high	4 Å²	4	49.2 Å²	49.2	3%	0.033	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-48.7	-179.4	0	0	0	0	0	111.9	Y101 N107 Q109	Y101-A105 VanDerWaalsContact O-CB 3.3Å; Y101-A105 WeakPolarHBondContact O-CB 3.41Å; Y101-A105 PolarHBondContact O-N 3.24Å; A105-N107 PolarHBondContact O-N 3.12Å; A105-Q109 WeakPolarHBondContact O-CB 3.3Å; A105-Q109 WeakPolarHBondContact O-CG 3.24Å; A105-Q109 PolarHBondContact O-N 3.46Å
106	G	92.3	Very high	93.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-39.2	-178.6	0	0	0	0	0	113.1	L102 E110 K111	L102-G106 WeakPolarHBondContact O-CA 3.35Å; L102-G106 PolarHBondContact O-N 3.34Å; G106-E110 CarbonylContact O-C 3.55Å; G106-E110 VanDerWaalsContact O-CA 3.28Å; G106-E110 WeakPolarHBondContact O-CA 3.35Å; G106-E110 PolarHBondContact O-N 3.05Å; G106-E110 VanDerWaalsContact O-N 3.16Å; G106-K111 PolarHBondContact O-N 3.44Å
107	N	92.5	Very high	93.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-74.7	-42.7	179.5	-170.4	49.7	0	0	0	113	S44 S45 L48 G103 A105	S44-N107 WeakPolarHBondContact CB-O 3.42Å; S45-N107 PolarHBondContact N-OD1 2.95Å; S45-N107 PolarHBondContact O-ND2 3.35Å; L48-N107 HydrophobicContact CD2-CB 3.94Å; G103-N107 WeakPolarHBondContact O-CB 3.25Å; G103-N107 PolarHBondContact O-N 2.84Å; G103-N107 VanDerWaalsContact O-N 3.12Å; A105-N107 PolarHBondContact O-N 3.12Å
108	L	89.3	Confident	93.7	Very high	79 Å²	79	48.6 Å²	48.6	41%	0.414	24%	0.244	S	C	.	.	H	α-helix	trans	-78.2	-37.6	-178.4	-74	178.7	0	0	0	113.6	Q49 Y104 E110	Q49-L108 HydrophobicContact CG-CD2 4.23Å; Y104-L108 HydrophobicContact CD1-CD1 3.82Å; Y104-L108 HydrophobicContact CD2-CD1 4.33Å; Y104-L108 HydrophobicContact CE1-CD1 3.29Å; Y104-L108 HydrophobicContact CE2-CD1 3.88Å; Y104-L108 HydrophobicContact CG-CD1 4.29Å; Y104-L108 WeakPolarHBondContact O-CB 3.18Å; Y104-L108 PolarHBondContact O-N 2.92Å; Y104-L108 VanDerWaalsContact O-N 3.11Å; L108-E110 VanDerWaalsContact C-N 3.28Å
109	Q	88.2	Confident	93.7	Very high	111 Å²	111	48.4 Å²	48.4	52%	0.519	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	4.6	-179.5	-55.2	175.9	4.8	0	0	111.6	A105 K111	A105-Q109 WeakPolarHBondContact O-CB 3.3Å; A105-Q109 WeakPolarHBondContact O-CG 3.24Å; A105-Q109 PolarHBondContact O-N 3.46Å; Q109-K111 HydrophobicContact CB-CD 4.15Å; Q109-K111 HydrophobicContact CB-CG 3.82Å; Q109-K111 WeakPolarHBondContact O-CG 3.38Å; Q109-K111 PolarHBondContact O-N 3.14Å; Q109-K111 VanDerWaalsContact O-N 3.13Å
110	E	86.7	Confident	93.7	Very high	69 Å²	69	52.8 Å²	52.8	32%	0.322	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	33.7	-179.4	-54.7	-175.5	169.1	0	0	113.5	L43 S44 G106 L108 V112 M170	L43-E110 HydrophobicContact CB-CG 4.47Å; L43-E110 PolarHBondContact N-OE1 3.28Å; S44-E110 PolarHBondContact N-OE1 2.88Å; G106-E110 CarbonylContact O-C 3.55Å; G106-E110 VanDerWaalsContact O-CA 3.28Å; G106-E110 WeakPolarHBondContact O-CA 3.35Å; G106-E110 PolarHBondContact O-N 3.05Å; G106-E110 VanDerWaalsContact O-N 3.16Å; L108-E110 VanDerWaalsContact C-N 3.28Å; E110-V112 PolarHBondContact O-N 3.45Å; E110-M170 HydrophobicContact CB-CE 4.16Å; E110-M170 HydrophobicContact CB-SD 4.33Å; E110-M170 HydrophobicContact CG-CE 4.14Å
111	K	89.4	Confident	93.7	Very high	85 Å²	85	53 Å²	53	37%	0.37	26%	0.262	S	S	.	.			trans	-89.7	108.1	-177.2	-58.3	-175.5	177	165.5	0	110.9	G106 Q109 P113 E114 L115	G106-K111 PolarHBondContact O-N 3.44Å; Q109-K111 HydrophobicContact CB-CD 4.15Å; Q109-K111 HydrophobicContact CB-CG 3.82Å; Q109-K111 WeakPolarHBondContact O-CG 3.38Å; Q109-K111 PolarHBondContact O-N 3.14Å; Q109-K111 VanDerWaalsContact O-N 3.13Å; K111-P113 VanDerWaalsContact C-CD 3.49Å; K111-E114 HydrophobicContact CB-CB 4.29Å; K111-E114 HydrophobicContact CB-CG 4.37Å; K111-E114 WeakPolarHBondContact CB-OE2 3.08Å; K111-E114 VanDerWaalsContact CD-CD 3.46Å; K111-E114 HydrophobicContact CD-CG 4.47Å; K111-E114 WeakPolarHBondContact CD-OE1 3.44Å; K111-E114 IonicContact NZ-OE1 3.68Å; K111-E114 PolarHBondContact O-N 2.89Å; K111-L115 PolarHBondContact O-N 3.37Å
112	V	90.4	Very high	93.7	Very high	34 Å²	34	45.4 Å²	45.4	21%	0.206	23%	0.233	C	C	.	.	H	α-helix	trans	-53.8	-46.9	-179.9	179.7	0	0	0	0	112.9	E110 E114 L115 A116 L167 M170 V171	E110-V112 PolarHBondContact O-N 3.45Å; V112-E114 PolarHBondContact O-N 2.98Å; V112-L115 PolarHBondContact O-N 3.1Å; V112-A116 VanDerWaalsContact O-CB 3.31Å; V112-A116 WeakPolarHBondContact O-CB 3.49Å; V112-A116 PolarHBondContact O-N 2.87Å; V112-L167 HydrophobicContact CG1-CD1 3.93Å; V112-M170 HydrophobicContact CG2-CB 3.81Å; V112-V171 HydrophobicContact CG1-CG2 3.71Å
113	P	93.1	Very high	93.7	Very high	99 Å²	99	45.8 Å²	45.8	64%	0.643	24%	0.236	S	C	*	.	H	α-helix	trans	-63.3	-43.3	-177.4	-21.4	34.2	0	0	0	112.8	K111 A116 G117	K111-P113 VanDerWaalsContact C-CD 3.49Å; P113-A116 PolarHBondContact O-N 3.27Å; P113-G117 PolarHBondContact O-N 3.36Å
114	E	95.1	Very high	93.6	Very high	51 Å²	51	50.8 Å²	50.8	24%	0.238	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-44.4	178.9	-72	84.8	153.9	0	0	111	L102 K111 V112 A116 G117 F118	L102-E114 HydrophobicContact CD2-CB 4.08Å; L102-E114 HydrophobicContact CD2-CG 3.98Å; K111-E114 HydrophobicContact CB-CB 4.29Å; K111-E114 HydrophobicContact CB-CG 4.37Å; K111-E114 WeakPolarHBondContact CB-OE2 3.08Å; K111-E114 VanDerWaalsContact CD-CD 3.46Å; K111-E114 HydrophobicContact CD-CG 4.47Å; K111-E114 WeakPolarHBondContact CD-OE1 3.44Å; K111-E114 IonicContact NZ-OE1 3.68Å; K111-E114 PolarHBondContact O-N 2.89Å; V112-E114 PolarHBondContact O-N 2.98Å; E114-A116 VanDerWaalsContact C-N 3.35Å; E114-A116 PolarHBondContact O-N 3.29Å; E114-G117 PolarHBondContact O-N 3.24Å; E114-F118 PolarHBondContact O-N 3.43Å
115	L	94.6	Very high	93.7	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-67.5	-35.7	177.8	-171.1	64.3	0	0	0	112.2	L48 K111 V112 F118 W119 A166 L167 M170	L48-L115 HydrophobicContact CD2-CD1 3.78Å; K111-L115 PolarHBondContact O-N 3.37Å; V112-L115 PolarHBondContact O-N 3.1Å; L115-F118 HydrophobicContact CD1-CD1 4.05Å; L115-F118 WeakPolarHBondContact O-CB 3.47Å; L115-F118 PolarHBondContact O-N 3.47Å; L115-W119 WeakPolarHBondContact O-CB 3.26Å; L115-W119 PolarHBondContact O-N 3.02Å; L115-A166 HydrophobicContact CD2-CB 3.76Å; L115-L167 HydrophobicContact CB-CD1 4.37Å; L115-L167 HydrophobicContact CD2-CB 4.18Å; L115-L167 HydrophobicContact CD2-CD1 4.45Å; L115-L167 HydrophobicContact CG-CB 4.49Å; L115-L167 HydrophobicContact CG-CD1 4.43Å; L115-M170 HydrophobicContact CD2-CE 4.04Å; L115-M170 HydrophobicContact CD2-SD 3.56Å; L115-M170 VanDerWaalsContact CD2-SD 3.56Å
116	A	95.3	Very high	93.8	Very high	37 Å²	37	47.9 Å²	47.9	31%	0.306	26%	0.255	S	S	.	.	H	α-helix	trans	-64.3	-42.6	171.9	0	0	0	0	0	111.3	V112 P113 E114 W119 L120 L167	V112-A116 VanDerWaalsContact O-CB 3.31Å; V112-A116 WeakPolarHBondContact O-CB 3.49Å; V112-A116 PolarHBondContact O-N 2.87Å; P113-A116 PolarHBondContact O-N 3.27Å; E114-A116 VanDerWaalsContact C-N 3.35Å; E114-A116 PolarHBondContact O-N 3.29Å; A116-W119 PolarHBondContact O-N 3.3Å; A116-L120 WeakPolarHBondContact O-CB 3.29Å; A116-L120 PolarHBondContact O-N 2.83Å; A116-L167 HydrophobicContact CB-CD1 3.98Å; A116-L167 HydrophobicContact CB-CD2 4.23Å
117	G	96.9	Very high	93.9	Very high	21 Å²	21	50 Å²	50	22%	0.216	27%	0.266	C	S	.	.	H	α-helix	trans	-59.7	-47.6	174	0	0	0	0	0	112.2	P113 E114 W119 L120 L121	P113-G117 PolarHBondContact O-N 3.36Å; E114-G117 PolarHBondContact O-N 3.24Å; G117-W119 VanDerWaalsContact C-N 3.34Å; G117-W119 PolarHBondContact O-N 3.17Å; G117-L120 PolarHBondContact O-N 3.14Å; G117-L121 WeakPolarHBondContact O-CB 3.27Å; G117-L121 VanDerWaalsContact O-CG 3.27Å; G117-L121 WeakPolarHBondContact O-CG 3.49Å; G117-L121 PolarHBondContact O-N 2.85Å
118	F	97.4	Very high	94.1	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-53.1	-50.2	172	164.8	-101.8	0	0	0	112.3	L48 L52 R99 L102 E114 L115 L121 T122 Q159	L48-F118 HydrophobicContact CD1-CE1 3.71Å; L48-F118 HydrophobicContact CD1-CZ 3.8Å; L48-F118 HydrophobicContact CD2-CE1 4.43Å; L52-F118 HydrophobicContact CD2-CE2 3.59Å; L52-F118 HydrophobicContact CD2-CZ 3.88Å; R99-F118 HydrophobicContact CG-CD2 3.38Å; R99-F118 HydrophobicContact CG-CE2 3.59Å; R99-F118 HydrophobicContact CG-CG 4.46Å; R99-F118 VanDerWaalsContact O-CD2 3.24Å; R99-F118 WeakPolarHBondContact O-CD2 3.09Å; L102-F118 HydrophobicContact CB-CB 4Å; E114-F118 PolarHBondContact O-N 3.43Å; L115-F118 HydrophobicContact CD1-CD1 4.05Å; L115-F118 WeakPolarHBondContact O-CB 3.47Å; L115-F118 PolarHBondContact O-N 3.47Å; F118-L121 PolarHBondContact O-N 2.67Å; F118-T122 WeakPolarHBondContact O-CB 3.22Å; F118-T122 PolarHBondContact O-N 2.77Å; F118-T122 PolarHBondContact O-OG1 2.87Å; F118-Q159 HydrophobicContact CZ-CB 3.86Å; F118-Q159 HydrophobicContact CZ-CG 4.1Å
119	W	97.1	Very high	94.4	Very high	77 Å²	77	50.8 Å²	50.8	29%	0.292	27%	0.274	S	S	.	.	H	α-helix	trans	-65.9	-40.5	-177.1	-170.1	84.8	0	0	0	112.1	L115 A116 G117 T122 T123 A160 F164	L115-W119 WeakPolarHBondContact O-CB 3.26Å; L115-W119 PolarHBondContact O-N 3.02Å; A116-W119 PolarHBondContact O-N 3.3Å; G117-W119 VanDerWaalsContact C-N 3.34Å; G117-W119 PolarHBondContact O-N 3.17Å; W119-T122 WeakPolarHBondContact O-CB 3.44Å; W119-T122 PolarHBondContact O-N 2.78Å; W119-T123 HydrophobicContact CD2-CG2 4.18Å; W119-T123 HydrophobicContact CE3-CG2 4.45Å; W119-T123 HydrophobicContact CH2-CG2 4.2Å; W119-T123 HydrophobicContact CZ2-CG2 3.9Å; W119-T123 HydrophobicContact CZ3-CG2 4.46Å; W119-T123 WeakPolarHBondContact O-CG2 3.37Å; W119-T123 PolarHBondContact O-N 3.4Å; W119-T123 PolarHBondContact O-OG1 3.48Å; W119-A160 PolarHBondContact NE1-O 2.9Å; W119-A160 VanDerWaalsContact NE1-O 3.08Å; W119-F164 AromaticContact CZ2-CD2 3.92Å; W119-F164 HydrophobicContact CZ2-CD2 3.92Å
120	L	96.9	Very high	94.7	Very high	92 Å²	92	45.5 Å²	45.5	48%	0.482	25%	0.249	S	C	.	.	H	α-helix	trans	-62.6	-48.6	174.5	-176.7	67.2	0	0	0	111.4	A116 G117 T122 T123 L124	A116-L120 WeakPolarHBondContact O-CB 3.29Å; A116-L120 PolarHBondContact O-N 2.83Å; G117-L120 PolarHBondContact O-N 3.14Å; L120-T122 VanDerWaalsContact C-N 3.28Å; L120-T122 PolarHBondContact O-N 3.36Å; L120-T123 PolarHBondContact O-N 3.42Å; L120-T123 PolarHBondContact O-OG1 3.46Å; L120-L124 HydrophobicContact CD1-CB 4.06Å; L120-L124 HydrophobicContact CD1-CD2 3.81Å; L120-L124 HydrophobicContact CG-CD2 4.36Å; L120-L124 WeakPolarHBondContact O-CB 3.03Å; L120-L124 PolarHBondContact O-N 3.46Å
121	L	97.2	Very high	95.1	Very high	32 Å²	32	45.1 Å²	45.1	17%	0.168	25%	0.249	C	C	.	.	I	π-helix	trans	-60.6	-39.3	177.3	-68.5	176.2	0	0	0	111.6	I95 I98 R99 L102 G117 F118 L125 Q126	I95-L121 HydrophobicContact CG2-CB 4.41Å; I98-L121 HydrophobicContact CB-CD1 4.39Å; I98-L121 HydrophobicContact CG2-CD1 3.79Å; R99-L121 HydrophobicContact CB-CB 4.34Å; R99-L121 HydrophobicContact CB-CD1 4.21Å; R99-L121 HydrophobicContact CG-CB 4.21Å; L102-L121 HydrophobicContact CD1-CD1 3.92Å; G117-L121 WeakPolarHBondContact O-CB 3.27Å; G117-L121 VanDerWaalsContact O-CG 3.27Å; G117-L121 WeakPolarHBondContact O-CG 3.49Å; G117-L121 PolarHBondContact O-N 2.85Å; F118-L121 PolarHBondContact O-N 2.67Å; L121-L125 HydrophobicContact CD2-CD1 3.61Å; L121-L125 HydrophobicContact CD2-CG 4.47Å; L121-L125 PolarHBondContact O-N 3.41Å; L121-Q126 WeakPolarHBondContact O-CB 3.34Å; L121-Q126 PolarHBondContact O-N 2.95Å
122	T	96.3	Very high	95.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.246	C	C	.	.	I	π-helix	trans	-60.6	-49.7	177.4	-55.2	0	0	0	0	111.5	R99 F118 W119 L120 L127 I156 A160	R99-T122 WeakPolarHBondContact CD-OG1 3.36Å; F118-T122 WeakPolarHBondContact O-CB 3.22Å; F118-T122 PolarHBondContact O-N 2.77Å; F118-T122 PolarHBondContact O-OG1 2.87Å; W119-T122 WeakPolarHBondContact O-CB 3.44Å; W119-T122 PolarHBondContact O-N 2.78Å; L120-T122 VanDerWaalsContact C-N 3.28Å; L120-T122 PolarHBondContact O-N 3.36Å; T122-L127 WeakPolarHBondContact O-CB 3.47Å; T122-L127 PolarHBondContact O-N 2.83Å; T122-I156 HydrophobicContact CG2-CG2 3.8Å; T122-A160 HydrophobicContact CG2-CB 4.14Å
123	T	95.1	Very high	95.6	Very high	39 Å²	39	42.9 Å²	42.9	24%	0.239	24%	0.237	C	C	.	.	I	π-helix	trans	-86.1	-39.7	-170.4	51.2	0	0	0	0	113.4	W119 L120 P128 A160	W119-T123 HydrophobicContact CD2-CG2 4.18Å; W119-T123 HydrophobicContact CE3-CG2 4.45Å; W119-T123 HydrophobicContact CH2-CG2 4.2Å; W119-T123 HydrophobicContact CZ2-CG2 3.9Å; W119-T123 HydrophobicContact CZ3-CG2 4.46Å; W119-T123 WeakPolarHBondContact O-CG2 3.37Å; W119-T123 PolarHBondContact O-N 3.4Å; W119-T123 PolarHBondContact O-OG1 3.48Å; L120-T123 PolarHBondContact O-N 3.42Å; L120-T123 PolarHBondContact O-OG1 3.46Å; T123-P128 WeakPolarHBondContact O-CD 3.41Å; T123-A160 HydrophobicContact CG2-CB 4.45Å
124	L	95.3	Very high	95.5	Very high	106 Å²	106	38.9 Å²	38.9	56%	0.555	21%	0.21	S	C	*	.	I	π-helix	trans	-92	-34	-171.5	-174.8	62.4	0	0	0	113.1	L120 P128	L120-L124 HydrophobicContact CD1-CB 4.06Å; L120-L124 HydrophobicContact CD1-CD2 3.81Å; L120-L124 HydrophobicContact CG-CD2 4.36Å; L120-L124 WeakPolarHBondContact O-CB 3.03Å; L120-L124 PolarHBondContact O-N 3.46Å; L124-P128 WeakPolarHBondContact O-CG 3.27Å
125	L	95.3	Very high	95.4	Very high	73 Å²	73	43.1 Å²	43.1	38%	0.382	23%	0.228	S	C	.	.	I	π-helix	trans	-108.3	-55.8	-177	-59.9	-175.8	0	0	0	112.1	I95 L121 P128 L129	I95-L125 HydrophobicContact CD1-CB 3.84Å; I95-L125 HydrophobicContact CD1-CD1 4.01Å; I95-L125 HydrophobicContact CG1-CD1 4.28Å; I95-L125 HydrophobicContact CG2-CB 4.46Å; L121-L125 HydrophobicContact CD2-CD1 3.61Å; L121-L125 HydrophobicContact CD2-CG 4.47Å; L121-L125 PolarHBondContact O-N 3.41Å; L125-P128 WeakPolarHBondContact O-CD 3.47Å; L125-L129 WeakPolarHBondContact O-CB 3.13Å; L125-L129 WeakPolarHBondContact O-CD1 3.3Å; L125-L129 WeakPolarHBondContact O-CG 3.26Å; L125-L129 PolarHBondContact O-N 3.02Å
126	Q	95.4	Very high	95.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.237	C	C	.	.	I	π-helix	trans	-65.6	-48.1	-173.4	-164.6	77.7	5.8	0	0	112	M92 I95 E96 R99 L121 L129 I130 I156	M92-Q126 HydrophobicContact CE-CG 4.44Å; I95-Q126 VanDerWaalsContact CG2-OE1 3.26Å; E96-Q126 PolarHBondContact OE2-NE2 3.47Å; R99-Q126 VanDerWaalsContact NH1-CG 3.28Å; R99-Q126 VanDerWaalsContact NH1-NE2 3.16Å; L121-Q126 WeakPolarHBondContact O-CB 3.34Å; L121-Q126 PolarHBondContact O-N 2.95Å; Q126-L129 PolarHBondContact O-N 3.34Å; Q126-I130 HydrophobicContact CG-CD1 3.91Å; Q126-I130 WeakPolarHBondContact O-CG1 3.31Å; Q126-I130 PolarHBondContact O-N 3.16Å; Q126-I130 VanDerWaalsContact O-N 3.12Å; Q126-I156 HydrophobicContact CB-CD1 4.39Å; Q126-I156 HydrophobicContact CG-CD1 3.44Å; Q126-I156 VanDerWaalsContact CG-CD1 3.44Å; Q126-I156 HydrophobicContact CG-CG1 4.3Å
127	L	94.9	Very high	95.1	Very high	45 Å²	45	48.4 Å²	48.4	24%	0.236	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-51.7	-176.5	-179.6	69.1	0	0	0	111.9	T122 L129 I130 L131 I156	T122-L127 WeakPolarHBondContact O-CB 3.47Å; T122-L127 PolarHBondContact O-N 2.83Å; L127-L129 VanDerWaalsContact C-N 3.33Å; L127-L129 PolarHBondContact O-N 3.13Å; L127-I130 PolarHBondContact O-N 2.71Å; L127-L131 HydrophobicContact CD1-CD1 4.15Å; L127-L131 HydrophobicContact CD1-CD2 4.36Å; L127-L131 HydrophobicContact CD1-CG 4.15Å; L127-L131 HydrophobicContact CG-CD1 3.91Å; L127-L131 HydrophobicContact CG-CG 4.32Å; L127-L131 VanDerWaalsContact O-CG 3.26Å; L127-L131 WeakPolarHBondContact O-CG 3.16Å; L127-L131 PolarHBondContact O-N 3.13Å; L127-I156 HydrophobicContact CB-CG2 4.41Å; L127-I156 HydrophobicContact CD1-CG2 4.16Å
128	P	95.8	Very high	94.6	Very high	64 Å²	64	49.8 Å²	49.8	42%	0.416	26%	0.257	S	S	.	.	H	α-helix	trans	-61.9	-37.5	179.3	-26.7	38.7	0	0	0	113.7	T123 L124 L125 I130 L131 F132	T123-P128 WeakPolarHBondContact O-CD 3.41Å; L124-P128 WeakPolarHBondContact O-CG 3.27Å; L125-P128 WeakPolarHBondContact O-CD 3.47Å; P128-I130 VanDerWaalsContact C-N 3.34Å; P128-I130 PolarHBondContact O-N 3.06Å; P128-L131 PolarHBondContact O-N 3.41Å; P128-F132 WeakPolarHBondContact O-CB 3.31Å; P128-F132 PolarHBondContact O-N 3.47Å
129	L	95.9	Very high	94.3	Very high	32 Å²	32	49.9 Å²	49.9	17%	0.168	26%	0.257	C	S	.	.	H	α-helix	trans	-64.6	-37.3	178.2	-73	174	0	0	0	112.5	I88 L91 M92 I95 L125 Q126 L127 Q133	I88-L129 HydrophobicContact CG1-CD2 4.17Å; L91-L129 HydrophobicContact CD2-CD1 3.98Å; L91-L129 HydrophobicContact CG-CD1 4.29Å; M92-L129 HydrophobicContact CG-CB 4.36Å; M92-L129 HydrophobicContact CG-CD1 4.17Å; M92-L129 HydrophobicContact SD-CB 3.55Å; M92-L129 VanDerWaalsContact SD-CB 3.55Å; M92-L129 HydrophobicContact SD-CD1 3.76Å; M92-L129 HydrophobicContact SD-CG 4.31Å; I95-L129 HydrophobicContact CD1-CD1 3.86Å; L125-L129 WeakPolarHBondContact O-CB 3.13Å; L125-L129 WeakPolarHBondContact O-CD1 3.3Å; L125-L129 WeakPolarHBondContact O-CG 3.26Å; L125-L129 PolarHBondContact O-N 3.02Å; Q126-L129 PolarHBondContact O-N 3.34Å; L127-L129 VanDerWaalsContact C-N 3.33Å; L127-L129 PolarHBondContact O-N 3.13Å; L129-Q133 PolarHBondContact O-N 3.39Å; L129-Q133 PolarHBondContact O-NE2 2.88Å
130	I	95.2	Very high	93.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-74.4	-41.1	175.8	-67.6	165.8	0	0	0	111.2	M92 Q126 L127 P128 F132 Q133 L134 H149 L152 I153 I156	M92-I130 HydrophobicContact CE-CD1 3.78Å; M92-I130 HydrophobicContact CE-CG1 3.33Å; M92-I130 HydrophobicContact SD-CG1 4.36Å; Q126-I130 HydrophobicContact CG-CD1 3.91Å; Q126-I130 WeakPolarHBondContact O-CG1 3.31Å; Q126-I130 PolarHBondContact O-N 3.16Å; Q126-I130 VanDerWaalsContact O-N 3.12Å; L127-I130 PolarHBondContact O-N 2.71Å; P128-I130 VanDerWaalsContact C-N 3.34Å; P128-I130 PolarHBondContact O-N 3.06Å; I130-F132 PolarHBondContact O-N 2.91Å; I130-Q133 PolarHBondContact O-N 3.46Å; I130-Q133 VanDerWaalsContact O-N 3.14Å; I130-L134 WeakPolarHBondContact O-CB 3.41Å; I130-L134 PolarHBondContact O-N 3.23Å; I130-H149 HydrophobicContact CG2-CB 4.26Å; I130-L152 HydrophobicContact CD1-CB 4.44Å; I130-L152 HydrophobicContact CD1-CD2 3.42Å; I130-L152 VanDerWaalsContact CD1-CD2 3.42Å; I130-L152 HydrophobicContact CD1-CG 3.65Å; I130-L152 HydrophobicContact CG1-CD2 4.08Å; I130-I153 HydrophobicContact CG2-CD1 3.83Å; I130-I153 HydrophobicContact CG2-CG1 3.48Å; I130-I153 VanDerWaalsContact CG2-CG1 3.48Å; I130-I156 HydrophobicContact CD1-CD1 3.05Å
131	L	94.6	Very high	93.7	Very high	60 Å²	60	47.3 Å²	47.3	31%	0.314	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-37.2	176.5	-63.6	173.8	0	0	0	110.9	L127 P128 L134 F135 I153	L127-L131 HydrophobicContact CD1-CD1 4.15Å; L127-L131 HydrophobicContact CD1-CD2 4.36Å; L127-L131 HydrophobicContact CD1-CG 4.15Å; L127-L131 HydrophobicContact CG-CD1 3.91Å; L127-L131 HydrophobicContact CG-CG 4.32Å; L127-L131 VanDerWaalsContact O-CG 3.26Å; L127-L131 WeakPolarHBondContact O-CG 3.16Å; L127-L131 PolarHBondContact O-N 3.13Å; P128-L131 PolarHBondContact O-N 3.41Å; L131-L134 PolarHBondContact O-N 2.87Å; L131-F135 HydrophobicContact CB-CD2 4.13Å; L131-F135 HydrophobicContact CB-CE2 4.33Å; L131-F135 HydrophobicContact CD2-CD2 4.32Å; L131-F135 HydrophobicContact CD2-CE2 3.66Å; L131-F135 WeakPolarHBondContact O-CB 3.34Å; L131-F135 VanDerWaalsContact O-CD2 3.29Å; L131-F135 WeakPolarHBondContact O-CD2 3.23Å; L131-F135 PolarHBondContact O-N 3.39Å; L131-I153 HydrophobicContact CD2-CD1 3.97Å
132	F	95.3	Very high	93.4	Very high	71 Å²	71	47.9 Å²	47.9	31%	0.311	25%	0.251	S	S	.	.	H	α-helix	trans	-58.5	-48.3	172.2	173.5	-95.9	0	0	0	111.9	Y81 I84 I88 P128 I130 L134 N136	Y81-F132 HydrophobicContact CE1-CZ 4.36Å; I84-F132 HydrophobicContact CG2-CE1 4.15Å; I84-F132 HydrophobicContact CG2-CZ 4.19Å; I88-F132 HydrophobicContact CD1-CD1 3.49Å; I88-F132 VanDerWaalsContact CD1-CD1 3.49Å; I88-F132 HydrophobicContact CD1-CE1 3.42Å; I88-F132 VanDerWaalsContact CD1-CE1 3.42Å; I88-F132 HydrophobicContact CD1-CZ 4.48Å; P128-F132 WeakPolarHBondContact O-CB 3.31Å; P128-F132 PolarHBondContact O-N 3.47Å; I130-F132 PolarHBondContact O-N 2.91Å; F132-L134 VanDerWaalsContact C-N 3.3Å; F132-L134 PolarHBondContact O-N 3.27Å; F132-N136 HydrophobicContact CD2-CB 4.41Å; F132-N136 HydrophobicContact CE2-CB 4.29Å; F132-N136 VanDerWaalsContact CE2-ND2 3.34Å; F132-N136 WeakPolarHBondContact CE2-ND2 3.47Å; F132-N136 WeakPolarHBondContact CZ-ND2 3.44Å; F132-N136 WeakPolarHBondContact O-CB 3.28Å; F132-N136 PolarHBondContact O-N 2.88Å; F132-N136 VanDerWaalsContact O-N 3.1Å
133	Q	94.2	Very high	93.3	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.009	29%	0.287	C	S	.	.	H	α-helix	trans	-65.6	-32.6	177.4	-75.7	162.9	83.7	0	0	112.7	E66 I88 L129 I130 I139 I141 H149	E66-Q133 PolarHBondContact OE1-OE1 2.72Å; I88-Q133 HydrophobicContact CG2-CG 4.3Å; L129-Q133 PolarHBondContact O-N 3.39Å; L129-Q133 PolarHBondContact O-NE2 2.88Å; I130-Q133 PolarHBondContact O-N 3.46Å; I130-Q133 VanDerWaalsContact O-N 3.14Å; Q133-I139 HydrophobicContact CB-CD1 4.48Å; Q133-I141 VanDerWaalsContact O-CD1 3.29Å; Q133-I141 WeakPolarHBondContact O-CD1 3.33Å; Q133-H149 PolarHBondContact OE1-CE1 3.21Å
134	L	93	Very high	93.2	Very high	15 Å²	15	55.9 Å²	55.9	8%	0.079	30%	0.298	C	S	.	.	H	α-helix	trans	-81	-32.5	-176.1	-163.6	74.1	0	0	0	113.9	I130 L131 F132 I141 R146 H149 I150 I153	I130-L134 WeakPolarHBondContact O-CB 3.41Å; I130-L134 PolarHBondContact O-N 3.23Å; L131-L134 PolarHBondContact O-N 2.87Å; F132-L134 VanDerWaalsContact C-N 3.3Å; F132-L134 PolarHBondContact O-N 3.27Å; L134-I141 VanDerWaalsContact O-CD1 3.25Å; L134-I141 WeakPolarHBondContact O-CD1 3.46Å; L134-R146 HydrophobicContact CD1-CG 3.95Å; L134-H149 HydrophobicContact CD1-CB 3.78Å; L134-I150 HydrophobicContact CD1-CG1 4.22Å; L134-I153 HydrophobicContact CD2-CD1 3.63Å
135	F	92.6	Very high	93.1	Very high	139 Å²	139	50.8 Å²	50.8	61%	0.61	27%	0.272	S	S	*	.	H	α-helix	trans	-109.1	-15.3	-172.1	-65.8	-58.1	0	0	0	114.5	L131 E137	L131-F135 HydrophobicContact CB-CD2 4.13Å; L131-F135 HydrophobicContact CB-CE2 4.33Å; L131-F135 HydrophobicContact CD2-CD2 4.32Å; L131-F135 HydrophobicContact CD2-CE2 3.66Å; L131-F135 WeakPolarHBondContact O-CB 3.34Å; L131-F135 VanDerWaalsContact O-CD2 3.29Å; L131-F135 WeakPolarHBondContact O-CD2 3.23Å; L131-F135 PolarHBondContact O-N 3.39Å; F135-E137 PolarHBondContact O-N 3.5Å
136	N	93.6	Very high	93.1	Very high	35 Å²	35	52.6 Å²	52.6	19%	0.187	27%	0.273	C	S	.	.			trans	-80.7	84.4	178.9	-171.2	8.5	0	0	0	111.2	Y81 F132 A138 I139	Y81-N136 PolarHBondContact OH-ND2 3.38Å; F132-N136 HydrophobicContact CD2-CB 4.41Å; F132-N136 HydrophobicContact CE2-CB 4.29Å; F132-N136 VanDerWaalsContact CE2-ND2 3.34Å; F132-N136 WeakPolarHBondContact CE2-ND2 3.47Å; F132-N136 WeakPolarHBondContact CZ-ND2 3.44Å; F132-N136 WeakPolarHBondContact O-CB 3.28Å; F132-N136 PolarHBondContact O-N 2.88Å; F132-N136 VanDerWaalsContact O-N 3.1Å; N136-A138 PolarHBondContact O-N 2.97Å; N136-A138 WeakPolarHBondContact OD1-CB 3.05Å; N136-A138 PolarHBondContact OD1-N 2.94Å; N136-I139 HydrophobicContact CB-CG2 4.47Å; N136-I139 WeakPolarHBondContact O-CG1 3.21Å; N136-I139 PolarHBondContact O-N 3.37Å
137	E	88.6	Confident	93.1	Very high	113 Å²	113	54.2 Å²	54.2	53%	0.528	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-58.1	-18.2	-179.4	-62.8	-67.8	176.7	0	0	113.6	F135 I139 L140 R146	F135-E137 PolarHBondContact O-N 3.5Å; E137-I139 PolarHBondContact O-N 3.39Å; E137-L140 PolarHBondContact O-N 3.37Å; E137-R146 IonicContact OE1-NH1 3.29Å
138	A	87.9	Confident	93.2	Very high	51 Å²	51	52.9 Å²	52.9	42%	0.421	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-66.9	-14.4	175.4	0	0	0	0	0	114.1	Y81 N136 L140	Y81-A138 HydrophobicContact CE2-CB 3.89Å; Y81-A138 WeakPolarHBondContact OH-CB 3.37Å; N136-A138 PolarHBondContact O-N 2.97Å; N136-A138 WeakPolarHBondContact OD1-CB 3.05Å; N136-A138 PolarHBondContact OD1-N 2.94Å; A138-L140 VanDerWaalsContact C-N 3.25Å; A138-L140 PolarHBondContact O-N 2.84Å
139	I	90.1	Very high	93.2	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-87.6	11.5	174.6	67.9	150.3	0	0	0	113.3	K73 Y81 L85 Q133 N136 E137 I141	K73-I139 WeakPolarHBondContact CD-O 3.36Å; K73-I139 WeakPolarHBondContact CE-O 3.42Å; K73-I139 PolarHBondContact NZ-O 2.91Å; K73-I139 VanDerWaalsContact NZ-O 3.11Å; Y81-I139 HydrophobicContact CD1-CG2 3.69Å; Y81-I139 HydrophobicContact CE1-CG2 3.69Å; Y81-I139 HydrophobicContact CG-CG2 4.36Å; L85-I139 HydrophobicContact CD1-CB 4.29Å; L85-I139 HydrophobicContact CD1-CG2 4.44Å; L85-I139 HydrophobicContact CD2-CB 4.46Å; L85-I139 HydrophobicContact CD2-CD1 4.07Å; L85-I139 HydrophobicContact CD2-CG2 4.16Å; Q133-I139 HydrophobicContact CB-CD1 4.48Å; N136-I139 HydrophobicContact CB-CG2 4.47Å; N136-I139 WeakPolarHBondContact O-CG1 3.21Å; N136-I139 PolarHBondContact O-N 3.37Å; E137-I139 PolarHBondContact O-N 3.39Å; I139-I141 HydrophobicContact CD1-CG1 4.12Å; I139-I141 HydrophobicContact CG1-CD1 4.47Å; I139-I141 HydrophobicContact CG1-CG1 3.71Å
140	L	89.4	Confident	93.2	Very high	89 Å²	89	52.4 Å²	52.4	47%	0.466	28%	0.277	S	S	.	.			trans	52.1	61.5	178.9	-58.8	175.4	0	0	0	111.6	A76 L77 E137 A138 Q142	A76-L140 HydrophobicContact CB-CD1 3.99Å; L77-L140 HydrophobicContact CD2-CD1 4.38Å; L77-L140 HydrophobicContact CD2-CG 4.47Å; E137-L140 PolarHBondContact O-N 3.37Å; A138-L140 VanDerWaalsContact C-N 3.25Å; A138-L140 PolarHBondContact O-N 2.84Å; L140-Q142 PolarHBondContact O-N 3.32Å
141	I	91.8	Very high	93.3	Very high	27 Å²	27	55.3 Å²	55.3	14%	0.138	30%	0.295	C	S	.	.			trans	-62.8	120.8	-172.4	-53.7	173.4	0	0	0	110.2	Q133 L134 I139 E145 R146	Q133-I141 VanDerWaalsContact O-CD1 3.29Å; Q133-I141 WeakPolarHBondContact O-CD1 3.33Å; L134-I141 VanDerWaalsContact O-CD1 3.25Å; L134-I141 WeakPolarHBondContact O-CD1 3.46Å; I139-I141 HydrophobicContact CD1-CG1 4.12Å; I139-I141 HydrophobicContact CG1-CD1 4.47Å; I139-I141 HydrophobicContact CG1-CG1 3.71Å; I141-E145 HydrophobicContact CG2-CB 4.49Å; I141-R146 HydrophobicContact CG2-CB 4.09Å
142	Q	92.3	Very high	93.4	Very high	44 Å²	44	52.5 Å²	52.5	21%	0.206	28%	0.28	C	S	.	.			trans	-84.7	152.8	177.2	-65.1	179.6	68.3	0	0	111.3	M69 L140 L144 E145 R146	M69-Q142 PolarHBondContact O-NE2 3.35Å; M69-Q142 HydrophobicContact SD-CB 3.92Å; M69-Q142 VanDerWaalsContact SD-CD 3.53Å; M69-Q142 HydrophobicContact SD-CG 4.35Å; M69-Q142 PolarHBondContact SD-OE1 3.01Å; L140-Q142 PolarHBondContact O-N 3.32Å; Q142-L144 VanDerWaalsContact C-N 3.26Å; Q142-L144 PolarHBondContact O-N 2.84Å; Q142-E145 HydrophobicContact CB-CG 4.12Å; Q142-E145 PolarHBondContact N-OE2 3.16Å; Q142-E145 WeakPolarHBondContact O-CB 3.47Å; Q142-E145 PolarHBondContact O-N 2.87Å; Q142-R146 PolarHBondContact O-N 3.49Å
143	P	93.2	Very high	93.4	Very high	117 Å²	117	50.3 Å²	50.3	76%	0.76	27%	0.271	S	S	*	.	H	α-helix	trans	-57.7	-36.3	-179.1	-26.4	34.9	0	0	0	114	G147	P143-G147 PolarHBondContact O-N 3.26Å
144	L	93.5	Very high	93.5	Very high	89 Å²	89	53.8 Å²	53.8	47%	0.466	29%	0.292	S	S	.	.	H	α-helix	trans	-67.4	-46.6	177.6	-177.1	66.9	0	0	0	111.6	S65 M69 Q142 R146 G147 V148	S65-L144 WeakPolarHBondContact OG-CD2 3.2Å; S65-L144 WeakPolarHBondContact OG-CG 3.39Å; M69-L144 HydrophobicContact CE-CB 4.24Å; M69-L144 HydrophobicContact CE-CD2 3.48Å; M69-L144 VanDerWaalsContact CE-CD2 3.48Å; M69-L144 HydrophobicContact CE-CG 4.46Å; M69-L144 HydrophobicContact CG-CB 4.37Å; M69-L144 HydrophobicContact CG-CD2 4.09Å; M69-L144 HydrophobicContact SD-CB 3.93Å; M69-L144 HydrophobicContact SD-CD2 4.08Å; Q142-L144 VanDerWaalsContact C-N 3.26Å; Q142-L144 PolarHBondContact O-N 2.84Å; L144-R146 VanDerWaalsContact C-N 3.29Å; L144-R146 PolarHBondContact O-N 3.04Å; L144-G147 PolarHBondContact O-N 3.41Å; L144-G147 VanDerWaalsContact O-N 3.11Å; L144-V148 HydrophobicContact CD1-CG1 4.42Å; L144-V148 PolarHBondContact O-N 3.15Å
145	E	93.4	Very high	93.7	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-53.8	-49.8	175.3	-63.5	177.3	141.6	0	0	109.9	M69 K73 I141 Q142 G147 V148 H149	M69-E145 VanDerWaalsContact CB-CD 3.49Å; M69-E145 HydrophobicContact CB-CG 3.32Å; M69-E145 WeakPolarHBondContact CB-OE1 3.36Å; M69-E145 HydrophobicContact CG-CG 3.56Å; M69-E145 HydrophobicContact SD-CG 4.44Å; K73-E145 WeakPolarHBondContact CE-OE1 3.16Å; K73-E145 IonicContact NZ-OE1 2.73Å; K73-E145 PolarHBondContact NZ-OE1 3.01Å; K73-E145 IonicContact NZ-OE2 3.51Å; K73-E145 PolarHBondContact NZ-OE2 3.35Å; I141-E145 HydrophobicContact CG2-CB 4.49Å; Q142-E145 HydrophobicContact CB-CG 4.12Å; Q142-E145 PolarHBondContact N-OE2 3.16Å; Q142-E145 WeakPolarHBondContact O-CB 3.47Å; Q142-E145 PolarHBondContact O-N 2.87Å; E145-G147 VanDerWaalsContact C-N 3.31Å; E145-G147 PolarHBondContact O-N 2.77Å; E145-V148 VanDerWaalsContact O-CG2 3.24Å; E145-V148 WeakPolarHBondContact O-CG2 3.46Å; E145-V148 PolarHBondContact O-N 2.92Å; E145-H149 WeakPolarHBondContact O-CB 3.33Å; E145-H149 PolarHBondContact O-CD2 3.29Å; E145-H149 VanDerWaalsContact O-CG 3.27Å; E145-H149 PolarHBondContact O-N 3.48Å
146	R	94.3	Very high	93.8	Very high	110 Å²	110	48.4 Å²	48.4	42%	0.415	27%	0.268	S	S	.	.	H	α-helix	trans	-58.1	-43.7	178	-166.7	167.2	-175.1	144.1	1.1	112	L134 E137 I141 Q142 L144 I150	L134-R146 HydrophobicContact CD1-CG 3.95Å; E137-R146 IonicContact OE1-NH1 3.29Å; I141-R146 HydrophobicContact CG2-CB 4.09Å; Q142-R146 PolarHBondContact O-N 3.49Å; L144-R146 VanDerWaalsContact C-N 3.29Å; L144-R146 PolarHBondContact O-N 3.04Å; R146-I150 HydrophobicContact CG-CD1 4.01Å; R146-I150 WeakPolarHBondContact O-CB 3.2Å; R146-I150 WeakPolarHBondContact O-CD1 3.46Å; R146-I150 WeakPolarHBondContact O-CG1 3.4Å; R146-I150 PolarHBondContact O-N 2.89Å
147	G	96.2	Very high	93.9	Very high	34 Å²	34	51.4 Å²	51.4	35%	0.351	28%	0.284	S	S	.	.	H	α-helix	trans	-59.5	-51.1	176.6	0	0	0	0	0	112.6	P143 L144 E145 H149 I150 V151	P143-G147 PolarHBondContact O-N 3.26Å; L144-G147 PolarHBondContact O-N 3.41Å; L144-G147 VanDerWaalsContact O-N 3.11Å; E145-G147 VanDerWaalsContact C-N 3.31Å; E145-G147 PolarHBondContact O-N 2.77Å; G147-H149 PolarHBondContact O-N 3.43Å; G147-I150 PolarHBondContact O-N 3.3Å; G147-V151 WeakPolarHBondContact O-CG2 3.26Å; G147-V151 PolarHBondContact O-N 3.41Å; G147-V151 VanDerWaalsContact O-N 3.16Å
148	V	96.9	Very high	94.2	Very high	18 Å²	18	49 Å²	49	11%	0.109	27%	0.274	C	S	.	.	H	α-helix	trans	-69.4	-34.3	-177.9	-59.5	0	0	0	0	112.3	F58 L144 E145 V151 L152	F58-V148 HydrophobicContact CZ-CB 4.22Å; L144-V148 HydrophobicContact CD1-CG1 4.42Å; L144-V148 PolarHBondContact O-N 3.15Å; E145-V148 VanDerWaalsContact O-CG2 3.24Å; E145-V148 WeakPolarHBondContact O-CG2 3.46Å; E145-V148 PolarHBondContact O-N 2.92Å; V148-V151 PolarHBondContact O-N 3.39Å; V148-L152 WeakPolarHBondContact O-CB 3.38Å; V148-L152 PolarHBondContact O-N 2.89Å
149	H	96.1	Very high	94.6	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-67.1	-39.4	173.1	-67.9	-47	0	0	0	112.6	W62 E66 I130 Q133 L134 E145 G147 V151 L152 I153	W62-H149 AromaticContact CZ2-CE1 3.87Å; W62-H149 AromaticContact NE1-CE1 3.59Å; W62-H149 AromaticContact NE1-ND1 3.29Å; W62-H149 PolarHBondContact NE1-ND1 2.78Å; E66-H149 IonicContact OE1-NE2 3.33Å; E66-H149 IonicContact OE2-CE1 2.72Å; E66-H149 PolarHBondContact OE2-CE1 3.22Å; E66-H149 VanDerWaalsContact OE2-CE1 3.29Å; E66-H149 IonicContact OE2-NE2 2.83Å; E66-H149 PolarHBondContact OE2-NE2 3.02Å; I130-H149 HydrophobicContact CG2-CB 4.26Å; Q133-H149 PolarHBondContact OE1-CE1 3.21Å; L134-H149 HydrophobicContact CD1-CB 3.78Å; E145-H149 WeakPolarHBondContact O-CB 3.33Å; E145-H149 PolarHBondContact O-CD2 3.29Å; E145-H149 VanDerWaalsContact O-CG 3.27Å; E145-H149 PolarHBondContact O-N 3.48Å; G147-H149 PolarHBondContact O-N 3.43Å; H149-V151 VanDerWaalsContact C-N 3.34Å; H149-V151 PolarHBondContact O-N 3.5Å; H149-L152 PolarHBondContact O-N 3.4Å; H149-I153 WeakPolarHBondContact O-CG1 3.4Å; H149-I153 PolarHBondContact O-N 3.04Å
150	I	96.1	Very high	94.8	Very high	84 Å²	84	47.5 Å²	47.5	43%	0.431	26%	0.262	S	S	.	.	H	α-helix	trans	-60.4	-46.6	176.1	-73.3	164.8	0	0	0	110.2	L134 R146 G147 L152 I153 V154	L134-I150 HydrophobicContact CD1-CG1 4.22Å; R146-I150 HydrophobicContact CG-CD1 4.01Å; R146-I150 WeakPolarHBondContact O-CB 3.2Å; R146-I150 WeakPolarHBondContact O-CD1 3.46Å; R146-I150 WeakPolarHBondContact O-CG1 3.4Å; R146-I150 PolarHBondContact O-N 2.89Å; G147-I150 PolarHBondContact O-N 3.3Å; I150-L152 VanDerWaalsContact C-N 3.31Å; I150-L152 PolarHBondContact O-N 3.07Å; I150-I153 PolarHBondContact O-N 3.45Å; I150-V154 WeakPolarHBondContact O-CG2 3.29Å; I150-V154 PolarHBondContact O-N 2.73Å
151	V	97.1	Very high	95.1	Very high	62 Å²	62	46.5 Å²	46.5	38%	0.376	27%	0.266	S	S	.	.	H	α-helix	trans	-60.2	-43.8	176.7	175.8	0	0	0	0	110.8	F58 G147 V148 H149 I153 V154 F155	F58-V151 HydrophobicContact CD1-CG1 4.48Å; F58-V151 HydrophobicContact CD2-CG1 4.1Å; F58-V151 HydrophobicContact CE1-CB 4.37Å; F58-V151 HydrophobicContact CE1-CG1 4.02Å; F58-V151 HydrophobicContact CE2-CB 4.11Å; F58-V151 HydrophobicContact CE2-CG1 3.6Å; F58-V151 HydrophobicContact CZ-CB 3.73Å; F58-V151 HydrophobicContact CZ-CG1 3.56Å; G147-V151 WeakPolarHBondContact O-CG2 3.26Å; G147-V151 PolarHBondContact O-N 3.41Å; G147-V151 VanDerWaalsContact O-N 3.16Å; V148-V151 PolarHBondContact O-N 3.39Å; H149-V151 VanDerWaalsContact C-N 3.34Å; H149-V151 PolarHBondContact O-N 3.5Å; V151-I153 PolarHBondContact O-N 2.94Å; V151-V154 PolarHBondContact O-N 3.46Å; V151-F155 HydrophobicContact CG1-CD2 4.06Å; V151-F155 HydrophobicContact CG1-CE2 3.74Å; V151-F155 WeakPolarHBondContact O-CD2 3.45Å; V151-F155 PolarHBondContact O-N 2.9Å; V151-F155 VanDerWaalsContact O-N 3.14Å
152	L	95.8	Very high	95.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63	-40.3	177.2	-169.7	57.8	0	0	0	112.7	N55 F58 W62 M92 I130 V148 H149 I150 V154 F155 I156	N55-L152 WeakPolarHBondContact OD1-CD1 3.49Å; F58-L152 HydrophobicContact CD1-CD1 4.44Å; F58-L152 HydrophobicContact CE1-CB 4.1Å; F58-L152 HydrophobicContact CE1-CD1 4.32Å; W62-L152 HydrophobicContact CD2-CD2 4.19Å; W62-L152 HydrophobicContact CG-CD2 4.29Å; W62-L152 HydrophobicContact CZ2-CD2 4.41Å; M92-L152 HydrophobicContact CE-CD2 4.23Å; I130-L152 HydrophobicContact CD1-CB 4.44Å; I130-L152 HydrophobicContact CD1-CD2 3.42Å; I130-L152 VanDerWaalsContact CD1-CD2 3.42Å; I130-L152 HydrophobicContact CD1-CG 3.65Å; I130-L152 HydrophobicContact CG1-CD2 4.08Å; V148-L152 WeakPolarHBondContact O-CB 3.38Å; V148-L152 PolarHBondContact O-N 2.89Å; H149-L152 PolarHBondContact O-N 3.4Å; I150-L152 VanDerWaalsContact C-N 3.31Å; I150-L152 PolarHBondContact O-N 3.07Å; L152-V154 VanDerWaalsContact C-N 3.33Å; L152-V154 PolarHBondContact O-N 3.4Å; L152-F155 PolarHBondContact O-N 3.36Å; L152-I156 HydrophobicContact CD1-CD1 4.44Å; L152-I156 HydrophobicContact CG-CD1 4Å; L152-I156 WeakPolarHBondContact O-CG1 3.26Å; L152-I156 PolarHBondContact O-N 3.41Å
153	I	96.2	Very high	95.2	Very high	25 Å²	25	43.4 Å²	43.4	13%	0.128	25%	0.252	C	S	.	.	H	α-helix	trans	-59.9	-44.2	173.9	-75.1	-174.2	0	0	0	110.6	I130 L131 L134 H149 I150 V151 F155 I156 L157	I130-I153 HydrophobicContact CG2-CD1 3.83Å; I130-I153 HydrophobicContact CG2-CG1 3.48Å; I130-I153 VanDerWaalsContact CG2-CG1 3.48Å; L131-I153 HydrophobicContact CD2-CD1 3.97Å; L134-I153 HydrophobicContact CD2-CD1 3.63Å; H149-I153 WeakPolarHBondContact O-CG1 3.4Å; H149-I153 PolarHBondContact O-N 3.04Å; I150-I153 PolarHBondContact O-N 3.45Å; V151-I153 PolarHBondContact O-N 2.94Å; I153-F155 VanDerWaalsContact C-N 3.31Å; I153-F155 PolarHBondContact O-N 2.99Å; I153-I156 PolarHBondContact O-N 3.08Å; I153-I156 VanDerWaalsContact O-N 3.13Å; I153-L157 HydrophobicContact CG2-CD1 3.71Å; I153-L157 HydrophobicContact CG2-CG 3.99Å; I153-L157 VanDerWaalsContact O-CG 3.31Å; I153-L157 WeakPolarHBondContact O-CG 3.31Å; I153-L157 PolarHBondContact O-N 3.02Å
154	V	96.4	Very high	95.2	Very high	76 Å²	76	42.9 Å²	42.9	46%	0.461	24%	0.238	S	C	.	.	H	α-helix	trans	-59	-45.5	178.9	171.8	0	0	0	0	110.6	I150 V151 L152 I156 L157 I158	I150-V154 WeakPolarHBondContact O-CG2 3.29Å; I150-V154 PolarHBondContact O-N 2.73Å; V151-V154 PolarHBondContact O-N 3.46Å; L152-V154 VanDerWaalsContact C-N 3.33Å; L152-V154 PolarHBondContact O-N 3.4Å; V154-I156 PolarHBondContact O-N 2.92Å; V154-L157 PolarHBondContact O-N 3.24Å; V154-I158 HydrophobicContact CG1-CD1 4.02Å; V154-I158 WeakPolarHBondContact O-CG1 3.3Å; V154-I158 PolarHBondContact O-N 3.47Å; V154-I158 VanDerWaalsContact O-N 3.14Å
155	F	95.6	Very high	95.1	Very high	39 Å²	39	40.8 Å²	40.8	17%	0.171	23%	0.233	C	C	.	.	H	α-helix	trans	-57.8	-47.3	173.6	-79.4	-60.9	0	0	0	112.2	F54 N55 F58 V151 L152 I153 L157 I158 Q159	F54-F155 HydrophobicContact CB-CE1 3.65Å; F54-F155 HydrophobicContact CB-CZ 3.84Å; N55-F155 HydrophobicContact CB-CB 4.5Å; N55-F155 HydrophobicContact CB-CD1 4.21Å; N55-F155 HydrophobicContact CB-CG 4.2Å; F58-F155 HydrophobicContact CB-CE2 4.07Å; F58-F155 HydrophobicContact CD1-CD2 4.19Å; F58-F155 HydrophobicContact CD1-CE2 4.06Å; F58-F155 AromaticContact CG-CE2 3.96Å; F58-F155 HydrophobicContact CG-CE2 3.96Å; V151-F155 HydrophobicContact CG1-CD2 4.06Å; V151-F155 HydrophobicContact CG1-CE2 3.74Å; V151-F155 WeakPolarHBondContact O-CD2 3.45Å; V151-F155 PolarHBondContact O-N 2.9Å; V151-F155 VanDerWaalsContact O-N 3.14Å; L152-F155 PolarHBondContact O-N 3.36Å; I153-F155 VanDerWaalsContact C-N 3.31Å; I153-F155 PolarHBondContact O-N 2.99Å; F155-L157 PolarHBondContact O-N 2.84Å; F155-I158 PolarHBondContact O-N 3.32Å; F155-Q159 VanDerWaalsContact O-CB 3.31Å; F155-Q159 WeakPolarHBondContact O-CB 3.4Å; F155-Q159 VanDerWaalsContact O-CG 3.26Å; F155-Q159 WeakPolarHBondContact O-CG 2.97Å; F155-Q159 PolarHBondContact O-N 2.82Å
156	I	94.8	Very high	94.9	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-40	-178.5	-75.4	167.1	0	0	0	112.1	T122 Q126 L127 I130 L152 I153 V154 Q159 A160	T122-I156 HydrophobicContact CG2-CG2 3.8Å; Q126-I156 HydrophobicContact CB-CD1 4.39Å; Q126-I156 HydrophobicContact CG-CD1 3.44Å; Q126-I156 VanDerWaalsContact CG-CD1 3.44Å; Q126-I156 HydrophobicContact CG-CG1 4.3Å; L127-I156 HydrophobicContact CB-CG2 4.41Å; L127-I156 HydrophobicContact CD1-CG2 4.16Å; I130-I156 HydrophobicContact CD1-CD1 3.05Å; L152-I156 HydrophobicContact CD1-CD1 4.44Å; L152-I156 HydrophobicContact CG-CD1 4Å; L152-I156 WeakPolarHBondContact O-CG1 3.26Å; L152-I156 PolarHBondContact O-N 3.41Å; I153-I156 PolarHBondContact O-N 3.08Å; I153-I156 VanDerWaalsContact O-N 3.13Å; V154-I156 PolarHBondContact O-N 2.92Å; I156-Q159 PolarHBondContact O-N 2.84Å; I156-A160 VanDerWaalsContact O-CB 3.23Å; I156-A160 WeakPolarHBondContact O-CB 3.25Å; I156-A160 PolarHBondContact O-N 2.86Å
157	L	96.2	Very high	94.7	Very high	97 Å²	97	37 Å²	37	51%	0.508	22%	0.221	S	C	.	.	H	α-helix	trans	-65.7	-43.7	177.6	-69.6	175.5	0	0	0	111.3	I153 V154 F155 Q159 A160 A161	I153-L157 HydrophobicContact CG2-CD1 3.71Å; I153-L157 HydrophobicContact CG2-CG 3.99Å; I153-L157 VanDerWaalsContact O-CG 3.31Å; I153-L157 WeakPolarHBondContact O-CG 3.31Å; I153-L157 PolarHBondContact O-N 3.02Å; V154-L157 PolarHBondContact O-N 3.24Å; F155-L157 PolarHBondContact O-N 2.84Å; L157-Q159 VanDerWaalsContact C-N 3.35Å; L157-A160 PolarHBondContact O-N 3.4Å; L157-A161 WeakPolarHBondContact O-CB 3.13Å; L157-A161 PolarHBondContact O-N 2.8Å
158	I	95.4	Very high	94.4	Very high	63 Å²	63	42.4 Å²	42.4	32%	0.323	23%	0.231	S	C	.	.	H	α-helix	trans	-61.3	-46.1	174.6	-66.4	167.7	0	0	0	110.1	Q47 V154 F155 S162	Q47-I158 HydrophobicContact CG-CG2 4.41Å; V154-I158 HydrophobicContact CG1-CD1 4.02Å; V154-I158 WeakPolarHBondContact O-CG1 3.3Å; V154-I158 PolarHBondContact O-N 3.47Å; V154-I158 VanDerWaalsContact O-N 3.14Å; F155-I158 PolarHBondContact O-N 3.32Å; I158-S162 WeakPolarHBondContact O-CB 3.21Å; I158-S162 PolarHBondContact O-N 2.9Å; I158-S162 PolarHBondContact O-OG 3.08Å
159	Q	96.1	Very high	93.9	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.4	-41.1	178.4	-79.8	172.1	41.6	0	0	112.5	L48 S51 L52 N55 F118 F155 I156 L157 G163	L48-Q159 HydrophobicContact CD1-CB 4.41Å; L48-Q159 HydrophobicContact CD1-CG 4.24Å; S51-Q159 WeakPolarHBondContact OG-CG 3.44Å; L52-Q159 HydrophobicContact CD2-CG 4.42Å; N55-Q159 PolarHBondContact ND2-NE2 2.72Å; F118-Q159 HydrophobicContact CZ-CB 3.86Å; F118-Q159 HydrophobicContact CZ-CG 4.1Å; F155-Q159 VanDerWaalsContact O-CB 3.31Å; F155-Q159 WeakPolarHBondContact O-CB 3.4Å; F155-Q159 VanDerWaalsContact O-CG 3.26Å; F155-Q159 WeakPolarHBondContact O-CG 2.97Å; F155-Q159 PolarHBondContact O-N 2.82Å; I156-Q159 PolarHBondContact O-N 2.84Å; L157-Q159 VanDerWaalsContact C-N 3.35Å; Q159-G163 VanDerWaalsContact O-CA 3.3Å; Q159-G163 WeakPolarHBondContact O-CA 3.42Å; Q159-G163 PolarHBondContact O-N 3.29Å
160	A	95.1	Very high	93.4	Very high	21 Å²	21	45 Å²	45	17%	0.174	25%	0.245	C	C	.	.	H	α-helix	trans	-66.5	-44.2	178.9	0	0	0	0	0	111.6	W119 T122 T123 I156 L157 F164	W119-A160 PolarHBondContact NE1-O 2.9Å; W119-A160 VanDerWaalsContact NE1-O 3.08Å; T122-A160 HydrophobicContact CG2-CB 4.14Å; T123-A160 HydrophobicContact CG2-CB 4.45Å; I156-A160 VanDerWaalsContact O-CB 3.23Å; I156-A160 WeakPolarHBondContact O-CB 3.25Å; I156-A160 PolarHBondContact O-N 2.86Å; L157-A160 PolarHBondContact O-N 3.4Å; A160-F164 VanDerWaalsContact O-CB 3.26Å; A160-F164 WeakPolarHBondContact O-CB 3.36Å; A160-F164 PolarHBondContact O-N 3.39Å
161	A	95.5	Very high	92.8	Very high	67 Å²	67	44.6 Å²	44.6	55%	0.554	25%	0.246	S	C	*	.	H	α-helix	trans	-67.7	-51.4	178.5	0	0	0	0	0	111.9	L157 F164 A165	L157-A161 WeakPolarHBondContact O-CB 3.13Å; L157-A161 PolarHBondContact O-N 2.8Å; A161-F164 PolarHBondContact O-N 3.47Å; A161-A165 PolarHBondContact O-N 2.8Å
162	S	93.3	Very high	92.1	Very high	7 Å²	7	49.7 Å²	49.7	5%	0.049	26%	0.258	C	S	.	.	H	α-helix	trans	-68.6	-36.8	-179.9	58.7	0	0	0	0	112.6	I158 A165 A166	I158-S162 WeakPolarHBondContact O-CB 3.21Å; I158-S162 PolarHBondContact O-N 2.9Å; I158-S162 PolarHBondContact O-OG 3.08Å; S162-A165 PolarHBondContact O-N 3.12Å; S162-A166 WeakPolarHBondContact O-CB 3.4Å; S162-A166 PolarHBondContact O-N 2.8Å
163	G	92.6	Very high	91.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.7	-41.4	173.7	0	0	0	0	0	112.6	Q159 A166 L167	Q159-G163 VanDerWaalsContact O-CA 3.3Å; Q159-G163 WeakPolarHBondContact O-CA 3.42Å; Q159-G163 PolarHBondContact O-N 3.29Å; G163-A166 PolarHBondContact O-N 2.89Å; G163-L167 VanDerWaalsContact O-CB 3.29Å; G163-L167 WeakPolarHBondContact O-CB 3.22Å; G163-L167 PolarHBondContact O-N 3.19Å
164	F	93	Very high	90	Very high	105 Å²	105	55 Å²	55	46%	0.461	29%	0.286	S	S	.	.	H	α-helix	trans	-62.2	-45.8	173.9	-178.7	-107.3	0	0	0	111.8	W119 A160 A161 L167 R168	W119-F164 AromaticContact CZ2-CD2 3.92Å; W119-F164 HydrophobicContact CZ2-CD2 3.92Å; A160-F164 VanDerWaalsContact O-CB 3.26Å; A160-F164 WeakPolarHBondContact O-CB 3.36Å; A160-F164 PolarHBondContact O-N 3.39Å; A161-F164 PolarHBondContact O-N 3.47Å; F164-L167 PolarHBondContact O-N 3.32Å; F164-R168 WeakPolarHBondContact O-CB 3.27Å; F164-R168 PolarHBondContact O-N 3.22Å
165	A	91.3	Very high	88.7	Confident	45 Å²	45	52.9 Å²	52.9	37%	0.372	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-46.5	178.4	0	0	0	0	0	111.6	A161 S162 R168 N169	A161-A165 PolarHBondContact O-N 2.8Å; S162-A165 PolarHBondContact O-N 3.12Å; A165-R168 PolarHBondContact O-N 3.48Å; A165-N169 PolarHBondContact O-N 3.12Å; A165-N169 PolarHBondContact O-ND2 3.48Å
166	A	89.8	Confident	87.2	Confident	3 Å²	3	54.2 Å²	54.2	3%	0.025	29%	0.294	C	S	.	.	H	α-helix	trans	-61.2	-45.5	176.4	0	0	0	0	0	111.7	L115 S162 G163 R168 N169 M170	L115-A166 HydrophobicContact CD2-CB 3.76Å; S162-A166 WeakPolarHBondContact O-CB 3.4Å; S162-A166 PolarHBondContact O-N 2.8Å; G163-A166 PolarHBondContact O-N 2.89Å; A166-R168 PolarHBondContact O-N 3.44Å; A166-N169 PolarHBondContact O-N 3.42Å; A166-M170 WeakPolarHBondContact O-CG 3.14Å; A166-M170 PolarHBondContact O-N 3.04Å
167	L	90.1	Very high	85.7	Confident	27 Å²	27	58.2 Å²	58.2	14%	0.141	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-45.8	178.2	-173.8	65.5	0	0	0	111.9	V112 L115 A116 G163 F164 N169 M170 V171	V112-L167 HydrophobicContact CG1-CD1 3.93Å; L115-L167 HydrophobicContact CB-CD1 4.37Å; L115-L167 HydrophobicContact CD2-CB 4.18Å; L115-L167 HydrophobicContact CD2-CD1 4.45Å; L115-L167 HydrophobicContact CG-CB 4.49Å; L115-L167 HydrophobicContact CG-CD1 4.43Å; A116-L167 HydrophobicContact CB-CD1 3.98Å; A116-L167 HydrophobicContact CB-CD2 4.23Å; G163-L167 VanDerWaalsContact O-CB 3.29Å; G163-L167 WeakPolarHBondContact O-CB 3.22Å; G163-L167 PolarHBondContact O-N 3.19Å; F164-L167 PolarHBondContact O-N 3.32Å; L167-N169 VanDerWaalsContact C-N 3.29Å; L167-N169 PolarHBondContact O-N 3.41Å; L167-M170 PolarHBondContact O-N 3.13Å; L167-V171 HydrophobicContact CD1-CG2 4.35Å; L167-V171 HydrophobicContact CG-CG2 4.47Å; L167-V171 WeakPolarHBondContact O-CB 3.33Å; L167-V171 VanDerWaalsContact O-CG2 3.27Å; L167-V171 WeakPolarHBondContact O-CG2 3.23Å; L167-V171 PolarHBondContact O-N 3.18Å
168	R	89.1	Confident	84.3	Confident	149 Å²	149	59.6 Å²	59.6	56%	0.562	31%	0.314	S	S	*	.	H	α-helix	trans	-59.2	-42	176.9	-176.5	178.5	-178	-171.6	0.4	111.6	F164 A165 A166 R172	F164-R168 WeakPolarHBondContact O-CB 3.27Å; F164-R168 PolarHBondContact O-N 3.22Å; A165-R168 PolarHBondContact O-N 3.48Å; A166-R168 PolarHBondContact O-N 3.44Å; R168-R172 VanDerWaalsContact O-CG 3.23Å; R168-R172 WeakPolarHBondContact O-CG 3.47Å; R168-R172 PolarHBondContact O-N 3.37Å
169	N	86	Confident	82.7	Confident	71 Å²	71	62.3 Å²	62.3	38%	0.38	33%	0.326	S	S	.	.	H	α-helix	trans	-67	-49.9	179.2	-68.8	-12.4	0	0	0	110.5	L43 A165 A166 L167 V171 R172 H173	L43-N169 HydrophobicContact CD2-CB 4.19Å; A165-N169 PolarHBondContact O-N 3.12Å; A165-N169 PolarHBondContact O-ND2 3.48Å; A166-N169 PolarHBondContact O-N 3.42Å; L167-N169 VanDerWaalsContact C-N 3.29Å; L167-N169 PolarHBondContact O-N 3.41Å; N169-V171 PolarHBondContact O-N 3.25Å; N169-R172 PolarHBondContact O-N 2.96Å; N169-H173 PolarHBondContact O-CD2 2.96Å; N169-H173 VanDerWaalsContact O-CD2 3.22Å; N169-H173 PolarHBondContact O-N 3.38Å; N169-H173 VanDerWaalsContact O-N 3.13Å
170	M	85.4	Confident	81.1	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.015	35%	0.354	C	S	.	.	H	α-helix	trans	-61.9	-39.5	-178.9	-66.9	178.5	-175.5	0	0	112.9	L43 E110 V112 L115 A166 L167 H173 T174	L43-M170 HydrophobicContact CB-CG 4.28Å; E110-M170 HydrophobicContact CB-CE 4.16Å; E110-M170 HydrophobicContact CB-SD 4.33Å; E110-M170 HydrophobicContact CG-CE 4.14Å; V112-M170 HydrophobicContact CG2-CB 3.81Å; L115-M170 HydrophobicContact CD2-CE 4.04Å; L115-M170 HydrophobicContact CD2-SD 3.56Å; L115-M170 VanDerWaalsContact CD2-SD 3.56Å; A166-M170 WeakPolarHBondContact O-CG 3.14Å; A166-M170 PolarHBondContact O-N 3.04Å; L167-M170 PolarHBondContact O-N 3.13Å; M170-H173 PolarHBondContact O-N 2.91Å; M170-T174 WeakPolarHBondContact O-CB 3.41Å; M170-T174 PolarHBondContact O-N 2.78Å; M170-T174 PolarHBondContact O-OG1 2.95Å
171	V	84.4	Confident	79.4	Confident	75 Å²	75	73.1 Å²	73.1	46%	0.455	38%	0.376	S	S	.	.	H	α-helix	trans	-64	-41.3	176.2	171.2	0	0	0	0	111.6	V112 L167 N169 H173 T174 G175	V112-V171 HydrophobicContact CG1-CG2 3.71Å; L167-V171 HydrophobicContact CD1-CG2 4.35Å; L167-V171 HydrophobicContact CG-CG2 4.47Å; L167-V171 WeakPolarHBondContact O-CB 3.33Å; L167-V171 VanDerWaalsContact O-CG2 3.27Å; L167-V171 WeakPolarHBondContact O-CG2 3.23Å; L167-V171 PolarHBondContact O-N 3.18Å; N169-V171 PolarHBondContact O-N 3.25Å; V171-H173 PolarHBondContact O-N 3.22Å; V171-T174 PolarHBondContact O-N 3.4Å; V171-G175 PolarHBondContact O-N 3.21Å
172	R	82.4	Confident	77.7	Confident	169 Å²	169	76.8 Å²	76.8	64%	0.638	38%	0.381	S	S	*	.	H	α-helix	trans	-63.7	-40.9	178.3	-72.4	174.2	75.7	-172.1	3.5	112	R168 N169 S176	R168-R172 VanDerWaalsContact O-CG 3.23Å; R168-R172 WeakPolarHBondContact O-CG 3.47Å; R168-R172 PolarHBondContact O-N 3.37Å; N169-R172 PolarHBondContact O-N 2.96Å; R172-S176 PolarHBondContact O-N 3.36Å
173	H	75.8	Confident	76	Confident	80 Å²	80	85.1 Å²	85.1	37%	0.37	42%	0.417	S	S	.	.	H	α-helix	trans	-70.3	-39.8	177.4	-78.9	-76.7	0	0	0	112.7	L43 N169 M170 V171 S176 Q177	L43-H173 HydrophobicContact CD1-CB 3.76Å; L43-H173 WeakPolarHBondContact CD2-CD2 3.31Å; N169-H173 PolarHBondContact O-CD2 2.96Å; N169-H173 VanDerWaalsContact O-CD2 3.22Å; N169-H173 PolarHBondContact O-N 3.38Å; N169-H173 VanDerWaalsContact O-N 3.13Å; M170-H173 PolarHBondContact O-N 2.91Å; V171-H173 PolarHBondContact O-N 3.22Å; H173-S176 PolarHBondContact O-N 3.27Å; H173-Q177 PolarHBondContact O-N 3.4Å
174	T	72	Confident	73.8	Confident	56 Å²	56	94.9 Å²	94.9	34%	0.344	47%	0.469	S	S	.	.	H	α-helix	trans	-61.7	-45.7	176.1	-59.5	0	0	0	0	111.1	M170 V171 S176 Q177 F178	M170-T174 WeakPolarHBondContact O-CB 3.41Å; M170-T174 PolarHBondContact O-N 2.78Å; M170-T174 PolarHBondContact O-OG1 2.95Å; V171-T174 PolarHBondContact O-N 3.4Å; T174-S176 VanDerWaalsContact C-N 3.33Å; T174-S176 PolarHBondContact O-N 3.21Å; T174-Q177 PolarHBondContact O-N 3.19Å; T174-F178 HydrophobicContact CG2-CD2 3.79Å; T174-F178 HydrophobicContact CG2-CE2 3.34Å; T174-F178 HydrophobicContact CG2-CZ 4.39Å; T174-F178 WeakPolarHBondContact O-CD2 3.46Å; T174-F178 PolarHBondContact O-N 3.16Å
175	G	68.1	Low	72.9	Confident	31 Å²	31	94.4 Å²	94.4	32%	0.32	47%	0.47	S	S	.	.	H	α-helix	trans	-63.2	-35	176.8	0	0	0	0	0	114	V171 H179	V171-G175 PolarHBondContact O-N 3.21Å; G175-H179 PolarHBondContact O-N 3.47Å
176	S	64.1	Low	71.9	Confident	67 Å²	67	97 Å²	97	47%	0.469	48%	0.475	S	S	.	.	H	α-helix	trans	-68.3	-35.1	176.3	-170	0	0	0	0	113	R172 H173 T174 L180	R172-S176 PolarHBondContact O-N 3.36Å; H173-S176 PolarHBondContact O-N 3.27Å; T174-S176 VanDerWaalsContact C-N 3.33Å; T174-S176 PolarHBondContact O-N 3.21Å; S176-L180 WeakPolarHBondContact O-CG 3.44Å; S176-L180 PolarHBondContact O-N 3.44Å
177	Q	63.4	Low	70.9	Confident	87 Å²	87	102.2 Å²	102.2	41%	0.407	50%	0.5	S	S	.	.	H	α-helix	trans	-73.6	-36	178.8	-72.2	-173.4	18.4	0	0	112.1	K40 H173 T174 L180 Q181	K40-Q177 VanDerWaalsContact NZ-OE1 3.15Å; H173-Q177 PolarHBondContact O-N 3.4Å; T174-Q177 PolarHBondContact O-N 3.19Å; Q177-L180 PolarHBondContact O-N 3.26Å; Q177-Q181 PolarHBondContact O-N 3.43Å
178	F	67.6	Low	69.8	Low	125 Å²	125	106.6 Å²	106.6	55%	0.548	52%	0.521	S	S	.	.	H	α-helix	trans	-66.9	-39.9	176.2	-75.9	-59.5	0	0	0	113.3	T174 L180 Q181 Q182	T174-F178 HydrophobicContact CG2-CD2 3.79Å; T174-F178 HydrophobicContact CG2-CE2 3.34Å; T174-F178 HydrophobicContact CG2-CZ 4.39Å; T174-F178 WeakPolarHBondContact O-CD2 3.46Å; T174-F178 PolarHBondContact O-N 3.16Å; F178-L180 VanDerWaalsContact C-N 3.33Å; F178-L180 PolarHBondContact O-N 3.28Å; F178-Q181 PolarHBondContact O-N 3.22Å; F178-Q182 PolarHBondContact O-N 3.46Å
179	H	61.5	Low	68.6	Low	120 Å²	120	104 Å²	104	56%	0.556	52%	0.518	S	S	*	.	H	α-helix	trans	-63.8	-38.7	176.2	-77.1	154.9	0	0	0	112.3	G175 Q181 Q182 F183	G175-H179 PolarHBondContact O-N 3.47Å; H179-Q181 VanDerWaalsContact C-N 3.33Å; H179-Q181 PolarHBondContact O-N 3.37Å; H179-Q182 PolarHBondContact O-N 3.35Å; H179-F183 WeakPolarHBondContact O-CD2 3.17Å
180	L	62.8	Low	67.4	Low	113 Å²	113	106.2 Å²	106.2	59%	0.592	53%	0.528	S	S	*	.	H	α-helix	trans	-64.4	-38.2	177.8	-70.9	168	0	0	0	111.9	S176 Q177 F178 Q182 F183	S176-L180 WeakPolarHBondContact O-CG 3.44Å; S176-L180 PolarHBondContact O-N 3.44Å; Q177-L180 PolarHBondContact O-N 3.26Å; F178-L180 VanDerWaalsContact C-N 3.33Å; F178-L180 PolarHBondContact O-N 3.28Å; L180-Q182 PolarHBondContact O-N 3.28Å; L180-F183 PolarHBondContact O-N 3.27Å
181	Q	59.9	Low	66.1	Low	136 Å²	136	113.6 Å²	113.6	64%	0.636	56%	0.564	S	S	*	*	H	α-helix	trans	-70.2	-12.4	176.6	-72.1	-177.2	-27.1	0	0	114.7	Q177 F178 H179	Q177-Q181 PolarHBondContact O-N 3.43Å; F178-Q181 PolarHBondContact O-N 3.22Å; H179-Q181 VanDerWaalsContact C-N 3.33Å; H179-Q181 PolarHBondContact O-N 3.37Å
182	Q	59.5	Low	64.7	Low	144 Å²	144	116.5 Å²	116.5	67%	0.673	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-10.9	175.6	-72.5	-174.4	-52.4	0	0	113.4	F178 H179 L180	F178-Q182 PolarHBondContact O-N 3.46Å; H179-Q182 PolarHBondContact O-N 3.35Å; L180-Q182 PolarHBondContact O-N 3.28Å
183	F	57.2	Low	63.2	Low	181 Å²	181	112.2 Å²	112.2	79%	0.794	57%	0.567	S	S	*	*			trans	-105.7	0	-179.6	-70.6	-73.3	0	0	0	114	H179 L180	H179-F183 WeakPolarHBondContact O-CD2 3.17Å; L180-F183 PolarHBondContact O-N 3.27Å
184	D	46.8	Very low	62.1	Low	206 Å²	206	115.1 Å²	115.1	100%	1.102	59%	0.585	S	S	*	*			trans	-98	0	164.6	-74.3	-28.9	0	0	0	110.2

Retrieved 184 of 184 residues in 252.6 ms (Link to these results)

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