A0A077Z7N4_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z7N4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 189 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40	Very low	40.6	Very low	232 Å²	232	155.5 Å²	155.5	100%	1.143	80%	0.801	S	S	*	*				0	116	0	-75	-174.3	150.8	0	0	108.2	N3	M1-N3 PolarHBondContact O-N 3.34Å
2	P	39.4	Very low	40.5	Very low	103 Å²	103	158.3 Å²	158.3	67%	0.669	81%	0.807	S	S	*	*			trans	-76.2	126	-177.8	-7.2	24.3	0	0	0	110.3	Y4	P2-Y4 HydrophobicContact CB-CE2 4.34Å; P2-Y4 WeakPolarHBondContact O-CD2 3.5Å; P2-Y4 PolarHBondContact O-N 3.14Å
3	N	37.3	Very low	40.7	Very low	145 Å²	145	159.5 Å²	159.5	78%	0.775	81%	0.807	S	S	*	*			trans	-63.7	89	178.9	-78.3	-40	0	0	0	112.2	M1 L5	M1-N3 PolarHBondContact O-N 3.34Å; N3-L5 PolarHBondContact O-N 3.06Å
4	Y	44.7	Very low	41.2	Very low	206 Å²	206	157.1 Å²	157.1	81%	0.808	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-72.3	-11.7	172.4	-76.3	-81.7	0	0	0	114	P2	P2-Y4 HydrophobicContact CB-CE2 4.34Å; P2-Y4 WeakPolarHBondContact O-CD2 3.5Å; P2-Y4 PolarHBondContact O-N 3.14Å
5	L	43.2	Very low	41.2	Very low	156 Å²	156	148.9 Å²	148.9	82%	0.817	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-84.3	-8	-178.6	-77.5	166.1	0	0	0	114.7	N3 M7	N3-L5 PolarHBondContact O-N 3.06Å; L5-M7 VanDerWaalsContact C-N 3.35Å
6	R	43.7	Very low	41.6	Very low	225 Å²	225	144.3 Å²	144.3	85%	0.849	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-82.6	-9.6	-179.6	-144.7	178	-167.7	179.9	4	114.1
7	M	40.4	Very low	41.8	Very low	181 Å²	181	141.5 Å²	141.5	89%	0.892	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-88.6	-7	176.7	-79.3	-170.1	169.5	0	0	114.2	L5 M9	L5-M7 VanDerWaalsContact C-N 3.35Å; M7-M9 PolarHBondContact O-N 3.38Å
8	A	43.7	Very low	42.2	Very low	75 Å²	75	136.7 Å²	136.7	62%	0.62	73%	0.732	S	S	*	*	S	Bend	trans	-88.4	4.1	-174.1	0	0	0	0	0	115.5
9	M	37.6	Very low	42.8	Very low	173 Å²	173	134.2 Å²	134.2	85%	0.852	72%	0.722	S	S	*	*	S	Bend	trans	-127.3	12.4	-170.7	-78	-166.5	65	0	0	117	M7	M7-M9 PolarHBondContact O-N 3.38Å
10	V	39.3	Very low	43.1	Very low	127 Å²	127	131.9 Å²	131.9	77%	0.77	71%	0.71	S	S	*	*	S	Bend	trans	-131.9	112.4	173	-173.2	0	0	0	0	108.5
11	S	37.7	Very low	43.2	Very low	88 Å²	88	130.1 Å²	130.1	62%	0.615	70%	0.7	S	S	*	*			trans	108.6	37.3	174.7	-41	0	0	0	0	117.5
12	H	38.7	Very low	43.8	Very low	188 Å²	188	122 Å²	122	87%	0.87	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	103.6	132.9	-89.8	-97.8	0	0	0	104.1
13	E	43.4	Very low	44.3	Very low	174 Å²	174	120 Å²	120	81%	0.813	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn		-153.3	2.1	69.3	-76.2	174.9	150.2	0	0	112.6
14	V	47.8	Very low	44.7	Very low	126 Å²	126	117.3 Å²	117.3	76%	0.764	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-16.7	-179.3	-165	0	0	0	0	112
15	G	41.1	Very low	44.9	Very low	35 Å²	35	113.6 Å²	113.6	36%	0.361	63%	0.633	S	S	.	*	H	α-helix	trans	-73	-31.4	-177	0	0	0	0	0	115.3	V17 A18 T19	G15-V17 PolarHBondContact O-N 2.87Å; G15-A18 PolarHBondContact O-N 3.3Å; G15-T19 PolarHBondContact O-N 2.85Å; G15-T19 PolarHBondContact O-OG1 3.04Å
16	S	47.6	Very low	45.3	Very low	75 Å²	75	111.6 Å²	111.6	52%	0.524	62%	0.623	S	S	.	*	H	α-helix	trans	-64.8	-40.7	-171.4	-162.6	0	0	0	0	112.4	T19 D20	S16-T19 PolarHBondContact O-OG1 3.29Å; S16-D20 WeakPolarHBondContact O-CB 3.4Å; S16-D20 PolarHBondContact O-N 2.95Å
17	V	45.5	Very low	45.6	Very low	97 Å²	97	104.5 Å²	104.5	59%	0.588	61%	0.608	S	S	*	*	H	α-helix	trans	-71	-34.3	-179.4	-175.6	0	0	0	0	111.3	G15 D20 L21	G15-V17 PolarHBondContact O-N 2.87Å; V17-D20 PolarHBondContact O-N 2.99Å; V17-L21 HydrophobicContact CG1-CD1 3.88Å; V17-L21 HydrophobicContact CG1-CG 4.5Å; V17-L21 VanDerWaalsContact O-CB 3.29Å; V17-L21 WeakPolarHBondContact O-CB 3.21Å; V17-L21 WeakPolarHBondContact O-CG 3.48Å; V17-L21 PolarHBondContact O-N 2.78Å
18	A	49.2	Very low	46	Very low	55 Å²	55	105.8 Å²	105.8	46%	0.455	60%	0.603	S	S	.	*	H	α-helix	trans	-71.6	-40	178.8	0	0	0	0	0	112.1	G15 S22	G15-A18 PolarHBondContact O-N 3.3Å; A18-S22 WeakPolarHBondContact O-CB 3.26Å; A18-S22 PolarHBondContact O-N 3.36Å; A18-S22 PolarHBondContact O-OG 3.36Å
19	T	53	Low	46.5	Very low	88 Å²	88	109.9 Å²	109.9	54%	0.54	61%	0.614	S	S	.	*	H	α-helix	trans	-65.8	-40.1	172.4	34.8	0	0	0	0	111.7	G15 S16 S22 A23	G15-T19 PolarHBondContact O-N 2.85Å; G15-T19 PolarHBondContact O-OG1 3.04Å; S16-T19 PolarHBondContact O-OG1 3.29Å; T19-S22 PolarHBondContact O-N 3.38Å; T19-A23 WeakPolarHBondContact O-CB 3.38Å; T19-A23 PolarHBondContact O-N 2.86Å
20	D	48.7	Very low	47.7	Very low	89 Å²	89	104.7 Å²	104.7	48%	0.476	59%	0.585	S	S	.	*	H	α-helix	trans	-70.1	-39.3	179.3	-71.5	-23.1	0	0	0	111.8	S16 V17 A23 L24	S16-D20 WeakPolarHBondContact O-CB 3.4Å; S16-D20 PolarHBondContact O-N 2.95Å; V17-D20 PolarHBondContact O-N 2.99Å; D20-A23 PolarHBondContact O-N 2.76Å; D20-L24 VanDerWaalsContact O-CB 3.26Å; D20-L24 WeakPolarHBondContact O-CB 3.22Å; D20-L24 WeakPolarHBondContact O-CD1 3.29Å; D20-L24 PolarHBondContact O-N 3.38Å
21	L	46.2	Very low	49.3	Very low	94 Å²	94	106.8 Å²	106.8	49%	0.492	59%	0.587	S	S	.	*	H	α-helix	trans	-64.3	-41.2	172.5	-86.8	161.6	0	0	0	111.9	V17 A23 L24 Q25	V17-L21 HydrophobicContact CG1-CD1 3.88Å; V17-L21 HydrophobicContact CG1-CG 4.5Å; V17-L21 VanDerWaalsContact O-CB 3.29Å; V17-L21 WeakPolarHBondContact O-CB 3.21Å; V17-L21 WeakPolarHBondContact O-CG 3.48Å; V17-L21 PolarHBondContact O-N 2.78Å; L21-A23 VanDerWaalsContact C-N 3.34Å; L21-L24 PolarHBondContact O-N 3.39Å; L21-Q25 WeakPolarHBondContact O-CB 3.45Å; L21-Q25 VanDerWaalsContact O-CG 3.29Å; L21-Q25 WeakPolarHBondContact O-CG 3.29Å; L21-Q25 PolarHBondContact O-N 3.07Å
22	S	52.2	Low	51.3	Low	62 Å²	62	106.5 Å²	106.5	43%	0.434	58%	0.582	S	S	.	*	H	α-helix	trans	-64.1	-42.2	176.1	-55.6	0	0	0	0	110.8	A18 T19 N26	A18-S22 WeakPolarHBondContact O-CB 3.26Å; A18-S22 PolarHBondContact O-N 3.36Å; A18-S22 PolarHBondContact O-OG 3.36Å; T19-S22 PolarHBondContact O-N 3.38Å; S22-N26 VanDerWaalsContact O-CB 3.23Å; S22-N26 WeakPolarHBondContact O-CB 3.31Å; S22-N26 PolarHBondContact O-N 3.18Å; S22-N26 PolarHBondContact O-ND2 2.72Å
23	A	48.7	Very low	53.6	Low	60 Å²	60	98.8 Å²	98.8	50%	0.496	55%	0.547	S	S	.	.	H	α-helix	trans	-67.5	-38.4	175.7	0	0	0	0	0	112.5	T19 D20 L21 S27	T19-A23 WeakPolarHBondContact O-CB 3.38Å; T19-A23 PolarHBondContact O-N 2.86Å; D20-A23 PolarHBondContact O-N 2.76Å; L21-A23 VanDerWaalsContact C-N 3.34Å; A23-S27 WeakPolarHBondContact O-CB 3.38Å; A23-S27 PolarHBondContact O-N 3.03Å
24	L	45.4	Very low	55.7	Low	89 Å²	89	95.2 Å²	95.2	47%	0.466	53%	0.534	S	S	.	.	H	α-helix	trans	-73	-39.9	176.9	-103	128.3	0	0	0	113.1	D20 L21 N26 S27 R28	D20-L24 VanDerWaalsContact O-CB 3.26Å; D20-L24 WeakPolarHBondContact O-CB 3.22Å; D20-L24 WeakPolarHBondContact O-CD1 3.29Å; D20-L24 PolarHBondContact O-N 3.38Å; L21-L24 PolarHBondContact O-N 3.39Å; L24-N26 VanDerWaalsContact C-N 3.34Å; L24-S27 PolarHBondContact O-N 3.44Å; L24-R28 WeakPolarHBondContact O-CG 3.42Å; L24-R28 PolarHBondContact O-N 2.96Å
25	Q	49.3	Very low	57.6	Low	128 Å²	128	91.9 Å²	91.9	60%	0.598	51%	0.508	S	S	*	.	H	α-helix	trans	-66.2	-39.5	174.8	-77.7	-177.9	-17.6	0	0	110.7	L21 S27	L21-Q25 WeakPolarHBondContact O-CB 3.45Å; L21-Q25 VanDerWaalsContact O-CG 3.29Å; L21-Q25 WeakPolarHBondContact O-CG 3.29Å; L21-Q25 PolarHBondContact O-N 3.07Å; Q25-S27 VanDerWaalsContact C-N 3.34Å
26	N	51.9	Low	59.8	Low	114 Å²	114	93.3 Å²	93.3	61%	0.61	51%	0.512	S	S	*	.	H	α-helix	trans	-68.2	-32.7	173.3	-72.4	-26.4	0	0	0	112.5	S22 L24	S22-N26 VanDerWaalsContact O-CB 3.23Å; S22-N26 WeakPolarHBondContact O-CB 3.31Å; S22-N26 PolarHBondContact O-N 3.18Å; S22-N26 PolarHBondContact O-ND2 2.72Å; L24-N26 VanDerWaalsContact C-N 3.34Å
27	S	50.2	Low	61.8	Low	77 Å²	77	93.5 Å²	93.5	54%	0.538	50%	0.503	S	S	.	.	H	α-helix	trans	-70	-40.1	177.8	155.1	0	0	0	0	113.3	A23 L24 Q25 L29	A23-S27 WeakPolarHBondContact O-CB 3.38Å; A23-S27 PolarHBondContact O-N 3.03Å; L24-S27 PolarHBondContact O-N 3.44Å; Q25-S27 VanDerWaalsContact C-N 3.34Å; S27-L29 VanDerWaalsContact C-N 3.34Å; S27-L29 PolarHBondContact O-N 3.4Å
28	R	49.3	Very low	63.9	Low	208 Å²	208	88.9 Å²	88.9	79%	0.785	48%	0.475	S	S	*	.	H	α-helix	trans	-75.4	-16.1	-173.1	-77.1	-175.9	175.9	-177.5	0	115.5	L24	L24-R28 WeakPolarHBondContact O-CG 3.42Å; L24-R28 PolarHBondContact O-N 2.96Å
29	L	54.6	Low	65.8	Low	160 Å²	160	88 Å²	88	84%	0.838	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	8.3	-178.1	-71.7	168.6	0	0	0	113.2	S27	S27-L29 VanDerWaalsContact C-N 3.34Å; S27-L29 PolarHBondContact O-N 3.4Å
30	Y	62	Low	67.6	Low	64 Å²	64	90.1 Å²	90.1	25%	0.251	47%	0.466	S	S	.	.			trans	-95.7	105.9	-168.5	-156.6	-87.4	0	0	0	112.8	P32 K100 R103 N104	Y30-P32 WeakPolarHBondContact O-CD 3.34Å; Y30-K100 PolarHBondContact OH-O 3.49Å; Y30-K100 VanDerWaalsContact OH-O 3.07Å; Y30-R103 HydrophobicContact CE2-CB 3.79Å; Y30-N104 HydrophobicContact CE1-CB 4.09Å; Y30-N104 WeakPolarHBondContact CE1-ND2 3.46Å; Y30-N104 VanDerWaalsContact CE1-OD1 3.22Å; Y30-N104 WeakPolarHBondContact CE1-OD1 3.43Å; Y30-N104 VanDerWaalsContact CZ-ND2 3.31Å; Y30-N104 WeakPolarHBondContact OH-CA 3.29Å; Y30-N104 WeakPolarHBondContact OH-CB 3.16Å; Y30-N104 PolarHBondContact OH-N 3.14Å; Y30-N104 PolarHBondContact OH-ND2 3.47Å
31	E	72.4	Confident	69.6	Low	172 Å²	172	88.2 Å²	88.2	80%	0.804	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-76	119	171.1	-166.9	172.4	-170.5	0	0	109.6	L33	E31-L33 PolarHBondContact O-N 2.93Å
32	P	80.5	Confident	71.8	Confident	81 Å²	81	83.8 Å²	83.8	53%	0.526	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-60.8	127.5	178.7	23.7	-31.7	0	0	0	110.4	Y30 N34	Y30-P32 WeakPolarHBondContact O-CD 3.34Å; P32-N34 PolarHBondContact O-N 3.32Å
33	L	85.7	Confident	73.6	Confident	26 Å²	26	83.7 Å²	83.7	14%	0.136	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-64.7	132.7	174	-90.1	168.4	0	0	0	109.6	E31 F37 V38 K100 V101 N104 W117	E31-L33 PolarHBondContact O-N 2.93Å; L33-F37 HydrophobicContact CD2-CD1 3.85Å; L33-F37 HydrophobicContact CD2-CE1 4.12Å; L33-V38 HydrophobicContact CB-CG2 4.2Å; L33-V38 HydrophobicContact CD1-CG2 3.96Å; L33-V38 HydrophobicContact CD2-CG2 3.88Å; L33-V38 HydrophobicContact CG-CG2 4.25Å; L33-K100 HydrophobicContact CD1-CB 4.15Å; L33-V101 HydrophobicContact CD1-CG2 4.03Å; L33-N104 VanDerWaalsContact CB-ND2 3.34Å; L33-N104 WeakPolarHBondContact CB-ND2 3.41Å; L33-N104 HydrophobicContact CD1-CB 4.37Å; L33-N104 WeakPolarHBondContact CD1-ND2 3.47Å; L33-N104 WeakPolarHBondContact CG-ND2 3.39Å; L33-N104 PolarHBondContact N-OD1 2.95Å; L33-W117 HydrophobicContact CB-CH2 4.08Å
34	N	87.5	Confident	75.7	Confident	99 Å²	99	85.6 Å²	85.6	53%	0.529	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-76.1	133.9	167.7	-170.7	-18.7	0	0	0	109.4	P32 S36 F37 V38	P32-N34 PolarHBondContact O-N 3.32Å; N34-S36 VanDerWaalsContact C-N 3.35Å; N34-S36 PolarHBondContact ND2-OG 3.41Å; N34-S36 PolarHBondContact O-N 2.89Å; N34-S36 PolarHBondContact OD1-N 3.15Å; N34-S36 PolarHBondContact OD1-OG 3.27Å; N34-S36 VanDerWaalsContact OD1-OG 3.14Å; N34-F37 HydrophobicContact CB-CB 4.24Å; N34-F37 PolarHBondContact O-N 3.02Å; N34-V38 PolarHBondContact O-N 3.37Å
35	R	87.4	Confident	78	Confident	57 Å²	57	81.8 Å²	81.8	22%	0.215	40%	0.402	C	S	.	.	H	α-helix	trans	-57.9	-45.7	176.2	179.2	175.5	174.2	-166.2	-9	111.4	F37 V38 E39 W117 V185 L188	R35-F37 VanDerWaalsContact C-N 3.29Å; R35-F37 PolarHBondContact O-N 3.26Å; R35-V38 PolarHBondContact O-N 3.04Å; R35-V38 VanDerWaalsContact O-N 3.14Å; R35-E39 HydrophobicContact CG-CG 4.26Å; R35-E39 WeakPolarHBondContact CG-OE1 3.48Å; R35-E39 IonicContact CZ-OE1 3.17Å; R35-E39 IonicContact NE-OE1 3.28Å; R35-E39 PolarHBondContact NE-OE1 3.28Å; R35-E39 IonicContact NH2-OE1 2.65Å; R35-E39 PolarHBondContact NH2-OE1 3.11Å; R35-E39 WeakPolarHBondContact O-CG 3.34Å; R35-E39 PolarHBondContact O-N 3.39Å; R35-W117 HydrophobicContact CB-CD2 4.25Å; R35-W117 HydrophobicContact CB-CH2 4.33Å; R35-W117 HydrophobicContact CB-CZ2 4.01Å; R35-W117 HydrophobicContact CG-CD2 4.1Å; R35-W117 HydrophobicContact CG-CE3 4.38Å; R35-W117 HydrophobicContact CG-CG 4.33Å; R35-V185 PolarHBondContact NH2-O 3.08Å; R35-L188 PolarHBondContact NH1-O 3.3Å; R35-L188 VanDerWaalsContact NH1-O 3.07Å; R35-L188 PolarHBondContact NH2-O 3.13Å
36	S	87.6	Confident	80	Confident	64 Å²	64	77.1 Å²	77.1	45%	0.448	38%	0.379	S	S	.	.	H	α-helix	trans	-61.7	-38.9	-177.1	65.2	0	0	0	0	112.3	N34 E39 E40	N34-S36 VanDerWaalsContact C-N 3.35Å; N34-S36 PolarHBondContact ND2-OG 3.41Å; N34-S36 PolarHBondContact O-N 2.89Å; N34-S36 PolarHBondContact OD1-N 3.15Å; N34-S36 PolarHBondContact OD1-OG 3.27Å; N34-S36 VanDerWaalsContact OD1-OG 3.14Å; S36-E39 PolarHBondContact O-N 2.95Å; S36-E40 WeakPolarHBondContact O-CB 3.49Å; S36-E40 PolarHBondContact O-N 3.09Å
37	F	90.2	Very high	81.9	Confident	79 Å²	79	75.5 Å²	75.5	35%	0.346	37%	0.371	S	S	.	.	H	α-helix	trans	-64.1	-43.9	176.5	173	-98	0	0	0	111.7	L33 N34 R35 E39 E41 M97	L33-F37 HydrophobicContact CD2-CD1 3.85Å; L33-F37 HydrophobicContact CD2-CE1 4.12Å; N34-F37 HydrophobicContact CB-CB 4.24Å; N34-F37 PolarHBondContact O-N 3.02Å; R35-F37 VanDerWaalsContact C-N 3.29Å; R35-F37 PolarHBondContact O-N 3.26Å; F37-E39 VanDerWaalsContact C-N 3.34Å; F37-E41 HydrophobicContact CD2-CG 4.44Å; F37-E41 HydrophobicContact CE1-CG 4.15Å; F37-E41 HydrophobicContact CE2-CG 3.99Å; F37-E41 HydrophobicContact CZ-CG 3.83Å; F37-E41 WeakPolarHBondContact O-CB 3.46Å; F37-E41 VanDerWaalsContact O-CG 3.28Å; F37-E41 WeakPolarHBondContact O-CG 3.3Å; F37-E41 PolarHBondContact O-N 3.29Å; F37-E41 VanDerWaalsContact O-N 3.09Å; F37-M97 HydrophobicContact CE1-CE 3.9Å; F37-M97 HydrophobicContact CE1-SD 4.37Å; F37-M97 HydrophobicContact CZ-CE 4.23Å
38	V	90.6	Very high	84	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-66.8	-39.1	178.2	176.9	0	0	0	0	111	L33 N34 R35 E41 L42 V101 W117 S121	L33-V38 HydrophobicContact CB-CG2 4.2Å; L33-V38 HydrophobicContact CD1-CG2 3.96Å; L33-V38 HydrophobicContact CD2-CG2 3.88Å; L33-V38 HydrophobicContact CG-CG2 4.25Å; N34-V38 PolarHBondContact O-N 3.37Å; R35-V38 PolarHBondContact O-N 3.04Å; R35-V38 VanDerWaalsContact O-N 3.14Å; V38-E41 PolarHBondContact O-N 2.85Å; V38-L42 HydrophobicContact CG1-CD1 3.92Å; V38-L42 HydrophobicContact CG1-CG 4.27Å; V38-L42 WeakPolarHBondContact O-CB 3.22Å; V38-L42 WeakPolarHBondContact O-CG 3.37Å; V38-L42 PolarHBondContact O-N 3.07Å; V38-V101 HydrophobicContact CG1-CG2 4.31Å; V38-W117 HydrophobicContact CB-CZ3 3.92Å; V38-W117 HydrophobicContact CG1-CZ3 4.13Å; V38-W117 HydrophobicContact CG2-CH2 4.23Å; V38-W117 HydrophobicContact CG2-CZ3 3.84Å; V38-S121 WeakPolarHBondContact CG1-OG 3.43Å
39	E	88.7	Confident	86.1	Confident	37 Å²	37	64.2 Å²	64.2	17%	0.173	32%	0.318	C	S	.	.	H	α-helix	trans	-64.5	-45	177.6	-71.2	172.1	163.1	0	0	112.2	R35 S36 F37 E41 L42 L43 V185	R35-E39 HydrophobicContact CG-CG 4.26Å; R35-E39 WeakPolarHBondContact CG-OE1 3.48Å; R35-E39 IonicContact CZ-OE1 3.17Å; R35-E39 IonicContact NE-OE1 3.28Å; R35-E39 PolarHBondContact NE-OE1 3.28Å; R35-E39 IonicContact NH2-OE1 2.65Å; R35-E39 PolarHBondContact NH2-OE1 3.11Å; R35-E39 WeakPolarHBondContact O-CG 3.34Å; R35-E39 PolarHBondContact O-N 3.39Å; S36-E39 PolarHBondContact O-N 2.95Å; F37-E39 VanDerWaalsContact C-N 3.34Å; E39-E41 VanDerWaalsContact C-N 3.34Å; E39-E41 PolarHBondContact O-N 3.41Å; E39-L42 PolarHBondContact O-N 3.15Å; E39-L43 WeakPolarHBondContact O-CG 3.35Å; E39-L43 PolarHBondContact O-N 3.1Å; E39-V185 HydrophobicContact CB-CG1 4.09Å; E39-V185 HydrophobicContact CG-CG1 3.74Å; E39-V185 HydrophobicContact CG-CG2 4.18Å
40	E	90.4	Very high	87.8	Confident	132 Å²	132	58.9 Å²	58.9	62%	0.617	29%	0.291	S	S	*	.	H	α-helix	trans	-59.5	-45.1	175.9	-175.3	176.4	-175.4	0	0	111.6	S36 L43 K44	S36-E40 WeakPolarHBondContact O-CB 3.49Å; S36-E40 PolarHBondContact O-N 3.09Å; E40-L43 PolarHBondContact O-N 3.39Å; E40-K44 WeakPolarHBondContact O-CB 3.28Å; E40-K44 PolarHBondContact O-N 2.52Å
41	E	91.5	Very high	89.3	Confident	49 Å²	49	61.7 Å²	61.7	23%	0.229	31%	0.306	C	S	.	.	H	α-helix	trans	-68.1	-36.5	178.9	-70.9	-76.3	125.2	0	0	112.5	F37 V38 E39 K44 I45 M97	F37-E41 HydrophobicContact CD2-CG 4.44Å; F37-E41 HydrophobicContact CE1-CG 4.15Å; F37-E41 HydrophobicContact CE2-CG 3.99Å; F37-E41 HydrophobicContact CZ-CG 3.83Å; F37-E41 WeakPolarHBondContact O-CB 3.46Å; F37-E41 VanDerWaalsContact O-CG 3.28Å; F37-E41 WeakPolarHBondContact O-CG 3.3Å; F37-E41 PolarHBondContact O-N 3.29Å; F37-E41 VanDerWaalsContact O-N 3.09Å; V38-E41 PolarHBondContact O-N 2.85Å; E39-E41 VanDerWaalsContact C-N 3.34Å; E39-E41 PolarHBondContact O-N 3.41Å; E41-K44 PolarHBondContact O-N 3.48Å; E41-I45 WeakPolarHBondContact O-CB 3.39Å; E41-I45 VanDerWaalsContact O-CG1 3.26Å; E41-I45 WeakPolarHBondContact O-CG1 3.23Å; E41-I45 PolarHBondContact O-N 3.03Å; E41-M97 HydrophobicContact CB-CE 3.61Å; E41-M97 HydrophobicContact CG-CE 3.59Å
42	L	91.6	Very high	90.2	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-64.8	-41	174.7	-73.1	170.6	0	0	0	111.9	V38 E39 I45 Y46 M124 L125 F128 L181	V38-L42 HydrophobicContact CG1-CD1 3.92Å; V38-L42 HydrophobicContact CG1-CG 4.27Å; V38-L42 WeakPolarHBondContact O-CB 3.22Å; V38-L42 WeakPolarHBondContact O-CG 3.37Å; V38-L42 PolarHBondContact O-N 3.07Å; E39-L42 PolarHBondContact O-N 3.15Å; L42-I45 PolarHBondContact O-N 3.36Å; L42-Y46 WeakPolarHBondContact O-CB 3.33Å; L42-Y46 PolarHBondContact O-N 2.71Å; L42-M124 HydrophobicContact CD1-SD 4.15Å; L42-M124 HydrophobicContact CD2-CB 4.27Å; L42-L125 HydrophobicContact CD2-CD1 4.45Å; L42-L125 HydrophobicContact CD2-CD2 3.71Å; L42-L125 HydrophobicContact CD2-CG 3.75Å; L42-F128 HydrophobicContact CD2-CD2 4.32Å; L42-F128 HydrophobicContact CD2-CE2 3.88Å; L42-L181 HydrophobicContact CB-CD2 4.4Å
43	L	90.4	Very high	90.6	Very high	61 Å²	61	50.8 Å²	50.8	32%	0.319	25%	0.249	S	C	.	.	H	α-helix	trans	-65.1	-42.7	176.1	-72.3	170.8	0	0	0	111.3	E39 E40 I45 Y46 D47 L181	E39-L43 WeakPolarHBondContact O-CG 3.35Å; E39-L43 PolarHBondContact O-N 3.1Å; E40-L43 PolarHBondContact O-N 3.39Å; L43-I45 PolarHBondContact O-N 3.22Å; L43-Y46 WeakPolarHBondContact O-CB 3.34Å; L43-Y46 PolarHBondContact O-N 3.04Å; L43-D47 PolarHBondContact O-N 2.88Å; L43-L181 HydrophobicContact CD2-CD1 4.3Å
44	K	92.6	Very high	90.7	Very high	100 Å²	100	54.8 Å²	54.8	44%	0.435	27%	0.267	S	S	.	.	H	α-helix	trans	-60.9	-46.2	175.6	-177.6	-177.5	171.4	-167.6	0	112.1	E40 E41 Y46 D47 E48	E40-K44 WeakPolarHBondContact O-CB 3.28Å; E40-K44 PolarHBondContact O-N 2.52Å; E41-K44 PolarHBondContact O-N 3.48Å; K44-Y46 VanDerWaalsContact C-N 3.3Å; K44-Y46 PolarHBondContact O-N 2.96Å; K44-D47 PolarHBondContact O-N 3.02Å; K44-E48 WeakPolarHBondContact CE-OE1 2.99Å; K44-E48 WeakPolarHBondContact O-CB 3.45Å; K44-E48 WeakPolarHBondContact O-CG 2.93Å; K44-E48 PolarHBondContact O-N 2.93Å
45	I	93.5	Very high	90.7	Very high	8 Å²	8	53.1 Å²	53.1	4%	0.041	26%	0.26	C	S	.	.	H	α-helix	trans	-60.2	-43.9	175.9	-71.3	165.7	0	0	0	110.4	E41 L42 L43 E48 I49 I94 L125 F128	E41-I45 WeakPolarHBondContact O-CB 3.39Å; E41-I45 VanDerWaalsContact O-CG1 3.26Å; E41-I45 WeakPolarHBondContact O-CG1 3.23Å; E41-I45 PolarHBondContact O-N 3.03Å; L42-I45 PolarHBondContact O-N 3.36Å; L43-I45 PolarHBondContact O-N 3.22Å; I45-E48 PolarHBondContact O-N 3.26Å; I45-I49 HydrophobicContact CG2-CD1 3.68Å; I45-I49 HydrophobicContact CG2-CG1 4.4Å; I45-I49 VanDerWaalsContact O-CG1 3.28Å; I45-I49 WeakPolarHBondContact O-CG1 3.18Å; I45-I49 PolarHBondContact O-N 3.47Å; I45-I94 HydrophobicContact CD1-CG1 4.14Å; I45-I94 HydrophobicContact CG2-CD1 4.1Å; I45-I94 HydrophobicContact CG2-CG1 3.89Å; I45-L125 HydrophobicContact CD1-CD2 4.01Å; I45-F128 HydrophobicContact CG2-CB 4.17Å; I45-F128 HydrophobicContact CG2-CD1 4.38Å; I45-F128 HydrophobicContact CG2-CD2 3.7Å; I45-F128 HydrophobicContact CG2-CE2 4.1Å; I45-F128 HydrophobicContact CG2-CG 3.86Å
46	Y	92.1	Very high	90.7	Very high	30 Å²	30	50.4 Å²	50.4	12%	0.118	25%	0.25	C	C	.	.	H	α-helix	trans	-56.7	-52.7	176.6	175.8	-83.3	0	0	0	111.6	L42 L43 K44 E48 I49 D50 F128 L174 I177 D178 L181	L42-Y46 WeakPolarHBondContact O-CB 3.33Å; L42-Y46 PolarHBondContact O-N 2.71Å; L43-Y46 WeakPolarHBondContact O-CB 3.34Å; L43-Y46 PolarHBondContact O-N 3.04Å; K44-Y46 VanDerWaalsContact C-N 3.3Å; K44-Y46 PolarHBondContact O-N 2.96Å; Y46-E48 VanDerWaalsContact C-N 3.31Å; Y46-E48 PolarHBondContact O-N 2.47Å; Y46-I49 PolarHBondContact O-N 3.02Å; Y46-D50 HydrophobicContact CE1-CB 4.41Å; Y46-D50 WeakPolarHBondContact O-CB 3.49Å; Y46-D50 PolarHBondContact O-N 3.4Å; Y46-F128 HydrophobicContact CD2-CE1 4.05Å; Y46-F128 HydrophobicContact CD2-CZ 4.23Å; Y46-L174 HydrophobicContact CD2-CD1 3.55Å; Y46-L174 HydrophobicContact CD2-CG 4.04Å; Y46-L174 HydrophobicContact CE2-CD1 3.54Å; Y46-L174 HydrophobicContact CE2-CD2 4.3Å; Y46-L174 HydrophobicContact CE2-CG 3.48Å; Y46-L174 VanDerWaalsContact CE2-CG 3.48Å; Y46-L174 WeakPolarHBondContact CE2-O 3.42Å; Y46-L174 HydrophobicContact CG-CD1 4.39Å; Y46-I177 HydrophobicContact CD2-CG2 4.38Å; Y46-D178 HydrophobicContact CE2-CB 3.79Å; Y46-L181 HydrophobicContact CD2-CD1 3.89Å; Y46-L181 HydrophobicContact CG-CD1 4.16Å
47	D	91.5	Very high	90.5	Very high	80 Å²	80	49 Å²	49	43%	0.428	24%	0.237	S	C	.	.	H	α-helix	trans	-62.4	-39.8	-177.9	-72.1	-20.2	0	0	0	111.6	L43 K44 D50 Q51	L43-D47 PolarHBondContact O-N 2.88Å; K44-D47 PolarHBondContact O-N 3.02Å; D47-D50 PolarHBondContact O-N 3.07Å; D47-Q51 WeakPolarHBondContact O-CB 3.21Å; D47-Q51 WeakPolarHBondContact O-CG 3.37Å; D47-Q51 PolarHBondContact O-N 2.9Å
48	E	93.8	Very high	90.1	Very high	43 Å²	43	49.1 Å²	49.1	20%	0.201	24%	0.241	C	C	.	.	H	α-helix	trans	-66	-41.4	177.1	-73.5	-172.8	-145.5	0	0	111.8	K44 I45 Y46 L52 R89 L90	K44-E48 WeakPolarHBondContact CE-OE1 2.99Å; K44-E48 WeakPolarHBondContact O-CB 3.45Å; K44-E48 WeakPolarHBondContact O-CG 2.93Å; K44-E48 PolarHBondContact O-N 2.93Å; I45-E48 PolarHBondContact O-N 3.26Å; Y46-E48 VanDerWaalsContact C-N 3.31Å; Y46-E48 PolarHBondContact O-N 2.47Å; E48-L52 VanDerWaalsContact O-CB 3.25Å; E48-L52 WeakPolarHBondContact O-CB 3.36Å; E48-L52 PolarHBondContact O-N 2.88Å; E48-R89 IonicContact OE1-NH1 3.06Å; E48-R89 IonicContact OE2-CZ 3.56Å; E48-R89 IonicContact OE2-NH1 3.63Å; E48-R89 PolarHBondContact OE2-NH1 3Å; E48-R89 IonicContact OE2-NH2 3.82Å; E48-R89 PolarHBondContact OE2-NH2 3.31Å; E48-L90 HydrophobicContact CB-CD1 4.27Å; E48-L90 HydrophobicContact CB-CD2 3.85Å; E48-L90 WeakPolarHBondContact OE2-CD2 3.23Å
49	I	93	Very high	89.5	Confident	5 Å²	5	51.9 Å²	51.9	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-65.5	-44.6	175.7	-69.2	169.4	0	0	0	110.8	I45 Y46 L52 I53 L90 I94 F128 I131 V132 L174	I45-I49 HydrophobicContact CG2-CD1 3.68Å; I45-I49 HydrophobicContact CG2-CG1 4.4Å; I45-I49 VanDerWaalsContact O-CG1 3.28Å; I45-I49 WeakPolarHBondContact O-CG1 3.18Å; I45-I49 PolarHBondContact O-N 3.47Å; Y46-I49 PolarHBondContact O-N 3.02Å; I49-L52 PolarHBondContact O-N 2.83Å; I49-I53 HydrophobicContact CG2-CD1 3.81Å; I49-I53 HydrophobicContact CG2-CG1 4.38Å; I49-I53 WeakPolarHBondContact O-CG1 3.4Å; I49-I53 PolarHBondContact O-N 3.11Å; I49-L90 HydrophobicContact CG1-CD1 4.35Å; I49-I94 HydrophobicContact CD1-CD1 4.33Å; I49-F128 HydrophobicContact CD1-CB 3.8Å; I49-F128 HydrophobicContact CD1-CD1 3.55Å; I49-F128 HydrophobicContact CD1-CE1 4.35Å; I49-F128 HydrophobicContact CD1-CG 3.89Å; I49-I131 HydrophobicContact CG2-CG2 3.85Å; I49-V132 HydrophobicContact CD1-CG2 4Å; I49-V132 HydrophobicContact CG1-CG2 4.11Å; I49-L174 HydrophobicContact CB-CD1 4.46Å; I49-L174 HydrophobicContact CG2-CD1 3.99Å; I49-L174 HydrophobicContact CG2-CD2 4.24Å
50	D	91.7	Very high	88.7	Confident	49 Å²	49	50.2 Å²	50.2	26%	0.262	24%	0.244	S	C	.	.	H	α-helix	trans	-59	-51.9	179.5	-172.4	65	0	0	0	111.5	Y46 D47 L52 I53 H54 L174	Y46-D50 HydrophobicContact CE1-CB 4.41Å; Y46-D50 WeakPolarHBondContact O-CB 3.49Å; Y46-D50 PolarHBondContact O-N 3.4Å; D47-D50 PolarHBondContact O-N 3.07Å; D50-L52 VanDerWaalsContact C-N 3.26Å; D50-L52 PolarHBondContact O-N 3.13Å; D50-I53 PolarHBondContact O-N 3.47Å; D50-H54 PolarHBondContact O-CD2 2.92Å; D50-H54 VanDerWaalsContact O-CD2 3.27Å; D50-H54 PolarHBondContact O-N 2.95Å; D50-H54 IonicContact OD1-CD2 3.2Å; D50-H54 IonicContact OD1-NE2 3.35Å; D50-H54 IonicContact OD2-CD2 2.83Å; D50-H54 PolarHBondContact OD2-CD2 3.49Å; D50-H54 IonicContact OD2-NE2 3.36Å; D50-L174 HydrophobicContact CB-CD2 3.7Å; D50-L174 WeakPolarHBondContact OD1-CD2 3.35Å
51	Q	91.9	Very high	88	Confident	123 Å²	123	51.6 Å²	51.6	58%	0.575	24%	0.244	S	C	*	.	H	α-helix	trans	-58.2	-42.2	177.4	-73.1	172.7	28.7	0	0	111.4	D47 H54 V55	D47-Q51 WeakPolarHBondContact O-CB 3.21Å; D47-Q51 WeakPolarHBondContact O-CG 3.37Å; D47-Q51 PolarHBondContact O-N 2.9Å; Q51-H54 PolarHBondContact O-N 2.95Å; Q51-V55 VanDerWaalsContact O-CG2 3.26Å; Q51-V55 WeakPolarHBondContact O-CG2 3.22Å; Q51-V55 PolarHBondContact O-N 3.41Å
52	L	91.7	Very high	86.8	Confident	15 Å²	15	56.2 Å²	56.2	8%	0.079	26%	0.259	C	S	.	.	H	α-helix	trans	-67.1	-43.1	-179.3	-167.2	79.3	0	0	0	112.1	E48 I49 D50 H54 V55 I56 I83 L86 L87 L90	E48-L52 VanDerWaalsContact O-CB 3.25Å; E48-L52 WeakPolarHBondContact O-CB 3.36Å; E48-L52 PolarHBondContact O-N 2.88Å; I49-L52 PolarHBondContact O-N 2.83Å; D50-L52 VanDerWaalsContact C-N 3.26Å; D50-L52 PolarHBondContact O-N 3.13Å; L52-H54 VanDerWaalsContact C-N 3.3Å; L52-H54 PolarHBondContact O-N 2.94Å; L52-V55 PolarHBondContact O-N 3.32Å; L52-I56 HydrophobicContact CD2-CD1 4.29Å; L52-I56 HydrophobicContact CG-CD1 4.05Å; L52-I56 VanDerWaalsContact O-CG1 3.26Å; L52-I56 WeakPolarHBondContact O-CG1 3.43Å; L52-I56 PolarHBondContact O-N 3.39Å; L52-I83 HydrophobicContact CD1-CG2 3.98Å; L52-I83 HydrophobicContact CG-CG2 4.47Å; L52-L86 HydrophobicContact CD1-CB 4.27Å; L52-L86 HydrophobicContact CD1-CD1 4.24Å; L52-L87 HydrophobicContact CD2-CD1 4.08Å; L52-L87 HydrophobicContact CD2-CD2 3.2Å; L52-L87 HydrophobicContact CD2-CG 3.37Å; L52-L90 HydrophobicContact CD2-CD1 4.46Å
53	I	89.4	Confident	85.3	Confident	8 Å²	8	64.7 Å²	64.7	4%	0.041	30%	0.299	C	S	.	.	H	α-helix	trans	-59.4	-44.5	174.8	-72.8	173	0	0	0	110	I49 D50 V55 I56 I57 I131 V135 A170 L174	I49-I53 HydrophobicContact CG2-CD1 3.81Å; I49-I53 HydrophobicContact CG2-CG1 4.38Å; I49-I53 WeakPolarHBondContact O-CG1 3.4Å; I49-I53 PolarHBondContact O-N 3.11Å; D50-I53 PolarHBondContact O-N 3.47Å; I53-V55 PolarHBondContact O-N 3.14Å; I53-I56 PolarHBondContact O-N 3.06Å; I53-I57 HydrophobicContact CG2-CD1 3.75Å; I53-I57 HydrophobicContact CG2-CG1 4.4Å; I53-I57 VanDerWaalsContact O-CG1 3.27Å; I53-I57 WeakPolarHBondContact O-CG1 3.44Å; I53-I57 PolarHBondContact O-N 3.41Å; I53-I131 HydrophobicContact CD1-CG2 4.13Å; I53-V135 HydrophobicContact CG1-CG2 4.34Å; I53-A170 HydrophobicContact CD1-CB 3.98Å; I53-L174 HydrophobicContact CD1-CD2 4.27Å
54	H	87.9	Confident	83.7	Confident	111 Å²	111	62.6 Å²	62.6	51%	0.514	29%	0.289	S	S	.	.	H	α-helix	trans	-60.2	-44	176.3	-84.4	-59	0	0	0	112.8	D50 Q51 L52 I57 D58	D50-H54 PolarHBondContact O-CD2 2.92Å; D50-H54 VanDerWaalsContact O-CD2 3.27Å; D50-H54 PolarHBondContact O-N 2.95Å; D50-H54 IonicContact OD1-CD2 3.2Å; D50-H54 IonicContact OD1-NE2 3.35Å; D50-H54 IonicContact OD2-CD2 2.83Å; D50-H54 PolarHBondContact OD2-CD2 3.49Å; D50-H54 IonicContact OD2-NE2 3.36Å; Q51-H54 PolarHBondContact O-N 2.95Å; L52-H54 VanDerWaalsContact C-N 3.3Å; L52-H54 PolarHBondContact O-N 2.94Å; H54-I57 PolarHBondContact O-N 3.47Å; H54-D58 PolarHBondContact O-N 3.31Å
55	V	87.7	Confident	82	Confident	63 Å²	63	64.8 Å²	64.8	38%	0.382	31%	0.305	S	S	.	.	H	α-helix	trans	-60.8	-47.7	175.8	169.1	0	0	0	0	110.5	Q51 L52 I53 I57 D58 Y59 I83	Q51-V55 VanDerWaalsContact O-CG2 3.26Å; Q51-V55 WeakPolarHBondContact O-CG2 3.22Å; Q51-V55 PolarHBondContact O-N 3.41Å; L52-V55 PolarHBondContact O-N 3.32Å; I53-V55 PolarHBondContact O-N 3.14Å; V55-I57 VanDerWaalsContact C-N 3.35Å; V55-I57 PolarHBondContact O-N 3.43Å; V55-D58 PolarHBondContact O-N 3.14Å; V55-D58 VanDerWaalsContact O-N 3.11Å; V55-Y59 HydrophobicContact CG1-CD2 3.62Å; V55-Y59 HydrophobicContact CG1-CE2 3.43Å; V55-Y59 VanDerWaalsContact CG1-CE2 3.43Å; V55-Y59 WeakPolarHBondContact O-CD2 3.24Å; V55-Y59 PolarHBondContact O-N 3.3Å; V55-I83 HydrophobicContact CG1-CD1 4.23Å
56	I	87.3	Confident	80.2	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-41.3	180	-67.2	166.6	0	0	0	111.4	L52 I53 D58 Y59 S60 I83 V135 V139 L167	L52-I56 HydrophobicContact CD2-CD1 4.29Å; L52-I56 HydrophobicContact CG-CD1 4.05Å; L52-I56 VanDerWaalsContact O-CG1 3.26Å; L52-I56 WeakPolarHBondContact O-CG1 3.43Å; L52-I56 PolarHBondContact O-N 3.39Å; I53-I56 PolarHBondContact O-N 3.06Å; I56-D58 VanDerWaalsContact C-N 3.29Å; I56-D58 PolarHBondContact O-N 3.01Å; I56-Y59 PolarHBondContact O-N 3.19Å; I56-S60 PolarHBondContact O-N 3.27Å; I56-S60 PolarHBondContact O-OG 2.86Å; I56-I83 HydrophobicContact CD1-CG2 3.98Å; I56-I83 HydrophobicContact CG1-CD1 4.34Å; I56-I83 HydrophobicContact CG1-CG2 3.95Å; I56-V135 HydrophobicContact CD1-CG1 3.49Å; I56-V135 VanDerWaalsContact CD1-CG1 3.49Å; I56-V139 HydrophobicContact CG2-CG1 3.46Å; I56-V139 VanDerWaalsContact CG2-CG1 3.46Å; I56-L167 HydrophobicContact CB-CD2 4.5Å; I56-L167 HydrophobicContact CG2-CD1 4.4Å; I56-L167 HydrophobicContact CG2-CD2 3.92Å
57	I	83.4	Confident	78.6	Confident	35 Å²	35	75.5 Å²	75.5	18%	0.179	38%	0.381	C	S	.	.	H	α-helix	trans	-59.2	-42.4	174.2	-71.6	166.2	0	0	0	110.8	I53 H54 V55 Y59 S60 R61 L167	I53-I57 HydrophobicContact CG2-CD1 3.75Å; I53-I57 HydrophobicContact CG2-CG1 4.4Å; I53-I57 VanDerWaalsContact O-CG1 3.27Å; I53-I57 WeakPolarHBondContact O-CG1 3.44Å; I53-I57 PolarHBondContact O-N 3.41Å; H54-I57 PolarHBondContact O-N 3.47Å; V55-I57 VanDerWaalsContact C-N 3.35Å; V55-I57 PolarHBondContact O-N 3.43Å; I57-Y59 VanDerWaalsContact C-N 3.32Å; I57-Y59 PolarHBondContact O-N 3.05Å; I57-S60 PolarHBondContact O-N 2.81Å; I57-S60 PolarHBondContact O-OG 2.88Å; I57-S60 VanDerWaalsContact O-OG 3.06Å; I57-R61 HydrophobicContact CG2-CG 4.3Å; I57-R61 WeakPolarHBondContact O-CB 3.5Å; I57-R61 WeakPolarHBondContact O-CG 3.17Å; I57-R61 PolarHBondContact O-N 3.31Å; I57-L167 HydrophobicContact CG1-CB 4.48Å; I57-L167 HydrophobicContact CG1-CD1 4.01Å; I57-L167 HydrophobicContact CG1-CD2 4.18Å; I57-L167 HydrophobicContact CG1-CG 4.46Å
58	D	81.3	Confident	77.7	Confident	81 Å²	81	73 Å²	73	43%	0.433	37%	0.372	S	S	.	.	H	α-helix	trans	-68.1	-34.6	-179.9	-149.6	41	0	0	0	111.3	H54 V55 I56 R62	H54-D58 PolarHBondContact O-N 3.31Å; V55-D58 PolarHBondContact O-N 3.14Å; V55-D58 VanDerWaalsContact O-N 3.11Å; I56-D58 VanDerWaalsContact C-N 3.29Å; I56-D58 PolarHBondContact O-N 3.01Å; D58-R62 WeakPolarHBondContact O-CD 3.35Å; D58-R62 WeakPolarHBondContact O-CG 3.04Å; D58-R62 PolarHBondContact O-N 2.87Å; D58-R62 IonicContact OD1-NE 3.93Å; D58-R62 IonicContact OD2-CZ 3.51Å; D58-R62 IonicContact OD2-NE 2.72Å; D58-R62 PolarHBondContact OD2-NE 3.37Å; D58-R62 IonicContact OD2-NH2 2.67Å; D58-R62 PolarHBondContact OD2-NH2 2.86Å
59	Y	77.6	Confident	77.1	Confident	57 Å²	57	78.7 Å²	78.7	22%	0.224	39%	0.391	C	S	.	.	H	α-helix	trans	-68.9	-41.1	171.8	-82.8	-75.9	0	0	0	113.1	V55 I56 I57 R75 D78 I83 F158	V55-Y59 HydrophobicContact CG1-CD2 3.62Å; V55-Y59 HydrophobicContact CG1-CE2 3.43Å; V55-Y59 VanDerWaalsContact CG1-CE2 3.43Å; V55-Y59 WeakPolarHBondContact O-CD2 3.24Å; V55-Y59 PolarHBondContact O-N 3.3Å; I56-Y59 PolarHBondContact O-N 3.19Å; I57-Y59 VanDerWaalsContact C-N 3.32Å; I57-Y59 PolarHBondContact O-N 3.05Å; Y59-R75 HydrophobicContact CD1-CG 4.17Å; Y59-R75 HydrophobicContact CE1-CG 4.42Å; Y59-D78 HydrophobicContact CE1-CB 4.02Å; Y59-D78 PolarHBondContact OH-OD2 3.37Å; Y59-I83 HydrophobicContact CD2-CD1 3.77Å; Y59-I83 HydrophobicContact CE2-CD1 3.87Å; Y59-F158 WeakPolarHBondContact O-CE1 3.17Å
60	S	73.6	Confident	76.5	Confident	3 Å²	3	85.7 Å²	85.7	2%	0.021	42%	0.422	C	S	.	.	H	α-helix	trans	-72.7	-36.4	-178.3	69.8	0	0	0	0	112.4	I56 I57 F158 V159	I56-S60 PolarHBondContact O-N 3.27Å; I56-S60 PolarHBondContact O-OG 2.86Å; I57-S60 PolarHBondContact O-N 2.81Å; I57-S60 PolarHBondContact O-OG 2.88Å; I57-S60 VanDerWaalsContact O-OG 3.06Å; S60-F158 WeakPolarHBondContact O-CD1 3.46Å; S60-F158 VanDerWaalsContact O-CE1 3.24Å; S60-F158 WeakPolarHBondContact O-CE1 3.13Å; S60-V159 WeakPolarHBondContact O-CG2 3.43Å
61	R	73.8	Confident	76.1	Confident	161 Å²	161	86 Å²	86	61%	0.608	43%	0.426	S	S	*	.	H	α-helix	trans	-83	-22.7	-175.7	-71.3	-176.4	175.6	169.4	1.7	114.9	I57 Q63	I57-R61 HydrophobicContact CG2-CG 4.3Å; I57-R61 WeakPolarHBondContact O-CB 3.5Å; I57-R61 WeakPolarHBondContact O-CG 3.17Å; I57-R61 PolarHBondContact O-N 3.31Å; R61-Q63 PolarHBondContact O-N 3.38Å
62	R	66.3	Low	75.6	Confident	146 Å²	146	80.5 Å²	80.5	55%	0.551	40%	0.4	S	S	*	.	S	Bend	trans	-68.7	96.7	176.2	-75	173.6	-173.8	-163.6	1.3	108.6	D58 P64 R75	D58-R62 WeakPolarHBondContact O-CD 3.35Å; D58-R62 WeakPolarHBondContact O-CG 3.04Å; D58-R62 PolarHBondContact O-N 2.87Å; D58-R62 IonicContact OD1-NE 3.93Å; D58-R62 IonicContact OD2-CZ 3.51Å; D58-R62 IonicContact OD2-NE 2.72Å; D58-R62 PolarHBondContact OD2-NE 3.37Å; D58-R62 IonicContact OD2-NH2 2.67Å; D58-R62 PolarHBondContact OD2-NH2 2.86Å; R62-P64 WeakPolarHBondContact O-CD 3.39Å; R62-R75 PolarHBondContact O-NH1 3.45Å; R62-R75 PolarHBondContact O-NH2 3.3Å
63	Q	60.1	Low	75.4	Confident	178 Å²	178	83.7 Å²	83.7	83%	0.832	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-57.2	123.7	174.8	-75.9	-170.2	-5.7	0	0	109.5	R61 L65	R61-Q63 PolarHBondContact O-N 3.38Å; Q63-L65 PolarHBondContact O-N 3.27Å
64	P	57.2	Low	75.3	Confident	18 Å²	18	87.3 Å²	87.3	12%	0.117	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-66.5	125.2	171.6	25.2	-29.6	0	0	0	108.5	R62 L66 R150 F158	R62-P64 WeakPolarHBondContact O-CD 3.39Å; P64-L66 PolarHBondContact O-N 3.09Å; P64-R150 VanDerWaalsContact CB-NH2 3.34Å; P64-F158 HydrophobicContact CG-CD2 4.32Å; P64-F158 HydrophobicContact CG-CG 4.34Å
65	L	57.8	Low	75.2	Confident	146 Å²	146	83.1 Å²	83.1	76%	0.764	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-56.3	129.7	167.7	-66.1	168.7	0	0	0	107.8	Q63 G67 A68	Q63-L65 PolarHBondContact O-N 3.27Å; L65-G67 PolarHBondContact O-N 2.76Å; L65-A68 WeakPolarHBondContact O-CB 3.43Å; L65-A68 PolarHBondContact O-N 2.85Å; L65-A68 VanDerWaalsContact O-N 3.08Å
66	L	55.9	Low	75.2	Confident	184 Å²	184	81.1 Å²	81.1	96%	0.963	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.7	125.2	174.9	-93.2	148.4	0	0	0	110.2	P64	P64-L66 PolarHBondContact O-N 3.09Å
67	G	58.1	Low	75.4	Confident	78 Å²	78	83.5 Å²	83.5	80%	0.804	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.7	0.2	177.4	0	0	0	0	0	116.3	L65 R69	L65-G67 PolarHBondContact O-N 2.76Å; G67-R69 VanDerWaalsContact C-N 3.25Å; G67-R69 PolarHBondContact O-N 2.91Å
68	A	72.1	Confident	75.7	Confident	27 Å²	27	83.3 Å²	83.3	22%	0.223	42%	0.417	C	S	.	.			trans	-83.4	59.3	178.9	0	0	0	0	0	112.9	L65 K70 V71 D72	L65-A68 WeakPolarHBondContact O-CB 3.43Å; L65-A68 PolarHBondContact O-N 2.85Å; L65-A68 VanDerWaalsContact O-N 3.08Å; A68-K70 PolarHBondContact O-N 3.24Å; A68-K70 VanDerWaalsContact O-N 3.09Å; A68-V71 HydrophobicContact CB-CB 3.77Å; A68-V71 HydrophobicContact CB-CG2 3.64Å; A68-V71 WeakPolarHBondContact O-CA 3.38Å; A68-V71 VanDerWaalsContact O-CB 3.31Å; A68-V71 WeakPolarHBondContact O-CB 3.12Å; A68-V71 PolarHBondContact O-N 3.2Å; A68-D72 PolarHBondContact O-N 3.44Å
69	R	80.8	Confident	76.1	Confident	163 Å²	163	79.5 Å²	79.5	62%	0.615	40%	0.396	S	S	*	.	H	α-helix	trans	-47.2	-42.4	177.4	178.3	179.1	168.8	167.8	4	112.6	G67 V71 D72 E73 L151	G67-R69 VanDerWaalsContact C-N 3.25Å; G67-R69 PolarHBondContact O-N 2.91Å; R69-V71 VanDerWaalsContact C-N 3.28Å; R69-V71 PolarHBondContact O-N 3.11Å; R69-D72 PolarHBondContact O-N 3.46Å; R69-E73 HydrophobicContact CG-CG 4.43Å; R69-E73 IonicContact CZ-OE1 3.6Å; R69-E73 IonicContact NE-OE1 2.8Å; R69-E73 PolarHBondContact NE-OE1 3.47Å; R69-E73 IonicContact NH2-OE1 2.92Å; R69-E73 PolarHBondContact NH2-OE1 2.94Å; R69-E73 WeakPolarHBondContact O-CG 3.22Å; R69-E73 PolarHBondContact O-N 2.95Å; R69-L151 HydrophobicContact CG-CD2 3.91Å
70	K	82.3	Confident	76.8	Confident	152 Å²	152	80.3 Å²	80.3	66%	0.661	40%	0.402	S	S	*	.	H	α-helix	trans	-61.8	-32.9	177.1	-170.5	174.7	-176.6	178.6	0	113.3	A68 N74	A68-K70 PolarHBondContact O-N 3.24Å; A68-K70 VanDerWaalsContact O-N 3.09Å; K70-N74 WeakPolarHBondContact O-CB 3.22Å; K70-N74 PolarHBondContact O-N 3.49Å; K70-N74 PolarHBondContact O-ND2 3.36Å; K70-N74 PolarHBondContact O-OD1 3.35Å
71	V	82	Confident	77.7	Confident	57 Å²	57	87.2 Å²	87.2	35%	0.345	43%	0.432	S	S	.	.	H	α-helix	trans	-69.8	-43.3	176	172.8	0	0	0	0	110.1	A68 R69 N74 R75	A68-V71 HydrophobicContact CB-CB 3.77Å; A68-V71 HydrophobicContact CB-CG2 3.64Å; A68-V71 WeakPolarHBondContact O-CA 3.38Å; A68-V71 VanDerWaalsContact O-CB 3.31Å; A68-V71 WeakPolarHBondContact O-CB 3.12Å; A68-V71 PolarHBondContact O-N 3.2Å; R69-V71 VanDerWaalsContact C-N 3.28Å; R69-V71 PolarHBondContact O-N 3.11Å; V71-N74 PolarHBondContact O-N 3.46Å; V71-R75 VanDerWaalsContact O-CG 3.23Å; V71-R75 WeakPolarHBondContact O-CG 3.37Å; V71-R75 PolarHBondContact O-N 2.94Å
72	D	82.4	Confident	78.5	Confident	7 Å²	7	85.4 Å²	85.4	4%	0.037	43%	0.429	C	S	.	.	H	α-helix	trans	-65.6	-39.9	176.4	-74.1	-10.6	0	0	0	111.4	A68 R69 R75 L76 I147 R150 L151	A68-D72 PolarHBondContact O-N 3.44Å; R69-D72 PolarHBondContact O-N 3.46Å; D72-R75 PolarHBondContact O-N 3.42Å; D72-L76 WeakPolarHBondContact O-CB 3.37Å; D72-L76 PolarHBondContact O-N 3.15Å; D72-I147 HydrophobicContact CB-CG2 4.12Å; D72-I147 WeakPolarHBondContact O-CG2 3.45Å; D72-R150 IonicContact OD1-NE 3.28Å; D72-R150 IonicContact OD1-NH2 3.84Å; D72-R150 IonicContact OD2-CZ 2.74Å; D72-R150 VanDerWaalsContact OD2-CZ 3.28Å; D72-R150 IonicContact OD2-NE 2.69Å; D72-R150 PolarHBondContact OD2-NE 3.39Å; D72-R150 IonicContact OD2-NH2 3.81Å; D72-R150 PolarHBondContact OD2-NH2 2.95Å; D72-L151 HydrophobicContact CB-CD2 3.58Å; D72-L151 HydrophobicContact CB-CG 4.07Å
73	E	87.2	Confident	79.8	Confident	81 Å²	81	78.8 Å²	78.8	38%	0.379	40%	0.404	S	S	.	.	H	α-helix	trans	-60.8	-46.2	173.8	-73.2	171.3	176.8	0	0	111.8	R69 R75 L76 S77 L151	R69-E73 HydrophobicContact CG-CG 4.43Å; R69-E73 IonicContact CZ-OE1 3.6Å; R69-E73 IonicContact NE-OE1 2.8Å; R69-E73 PolarHBondContact NE-OE1 3.47Å; R69-E73 IonicContact NH2-OE1 2.92Å; R69-E73 PolarHBondContact NH2-OE1 2.94Å; R69-E73 WeakPolarHBondContact O-CG 3.22Å; R69-E73 PolarHBondContact O-N 2.95Å; E73-R75 PolarHBondContact O-N 2.62Å; E73-L76 PolarHBondContact O-N 2.68Å; E73-S77 WeakPolarHBondContact O-CB 3.43Å; E73-S77 PolarHBondContact O-N 3.2Å; E73-L151 HydrophobicContact CG-CD1 4.14Å; E73-L151 HydrophobicContact CG-CD2 3.65Å
74	N	87.3	Confident	81.3	Confident	85 Å²	85	73.1 Å²	73.1	46%	0.455	38%	0.375	S	S	.	.	H	α-helix	trans	-63	-42	177.1	-73.1	-10.3	0	0	0	111.7	K70 V71 S77 D78	K70-N74 WeakPolarHBondContact O-CB 3.22Å; K70-N74 PolarHBondContact O-N 3.49Å; K70-N74 PolarHBondContact O-ND2 3.36Å; K70-N74 PolarHBondContact O-OD1 3.35Å; V71-N74 PolarHBondContact O-N 3.46Å; N74-S77 WeakPolarHBondContact O-CB 3.44Å; N74-S77 PolarHBondContact O-N 2.99Å; N74-D78 WeakPolarHBondContact O-CB 3.4Å; N74-D78 VanDerWaalsContact O-CG 3.31Å; N74-D78 PolarHBondContact O-N 3.23Å
75	R	84.6	Confident	83.1	Confident	23 Å²	23	75 Å²	75	9%	0.087	39%	0.387	C	S	.	.	H	α-helix	trans	-64.5	-45.1	178.1	-73.7	172.5	-176.4	-163.6	-0.2	112.1	Y59 R62 V71 D72 E73 S77 D78 I79 I147	Y59-R75 HydrophobicContact CD1-CG 4.17Å; Y59-R75 HydrophobicContact CE1-CG 4.42Å; R62-R75 PolarHBondContact O-NH1 3.45Å; R62-R75 PolarHBondContact O-NH2 3.3Å; V71-R75 VanDerWaalsContact O-CG 3.23Å; V71-R75 WeakPolarHBondContact O-CG 3.37Å; V71-R75 PolarHBondContact O-N 2.94Å; D72-R75 PolarHBondContact O-N 3.42Å; E73-R75 PolarHBondContact O-N 2.62Å; R75-S77 VanDerWaalsContact C-N 3.26Å; R75-S77 PolarHBondContact O-N 2.91Å; R75-D78 PolarHBondContact O-N 2.9Å; R75-I79 WeakPolarHBondContact O-CB 3.46Å; R75-I79 WeakPolarHBondContact O-CD1 3.37Å; R75-I79 VanDerWaalsContact O-CG1 3.3Å; R75-I79 WeakPolarHBondContact O-CG1 3.21Å; R75-I79 PolarHBondContact O-N 3.34Å; R75-I147 HydrophobicContact CB-CD1 4.17Å
76	L	88.8	Confident	84.8	Confident	20 Å²	20	71.4 Å²	71.4	11%	0.105	37%	0.368	C	S	.	.	H	α-helix	trans	-59.9	-43.1	176.2	-172.6	58.6	0	0	0	110.4	D72 E73 I79 Q80 E144 I147 L151	D72-L76 WeakPolarHBondContact O-CB 3.37Å; D72-L76 PolarHBondContact O-N 3.15Å; E73-L76 PolarHBondContact O-N 2.68Å; L76-I79 PolarHBondContact O-N 3.32Å; L76-Q80 HydrophobicContact CD1-CG 4.15Å; L76-Q80 HydrophobicContact CG-CG 4.39Å; L76-Q80 WeakPolarHBondContact O-CB 3.37Å; L76-Q80 VanDerWaalsContact O-CG 3.26Å; L76-Q80 WeakPolarHBondContact O-CG 3.26Å; L76-Q80 PolarHBondContact O-N 3.49Å; L76-E144 HydrophobicContact CD1-CB 4.21Å; L76-E144 HydrophobicContact CD1-CG 4.19Å; L76-I147 HydrophobicContact CB-CG2 3.77Å; L76-I147 HydrophobicContact CD1-CB 4.48Å; L76-I147 HydrophobicContact CD1-CG2 4.35Å; L76-I147 HydrophobicContact CD2-CG2 4.47Å; L76-I147 HydrophobicContact CG-CG2 4.42Å; L76-L151 HydrophobicContact CB-CD1 4.49Å; L76-L151 HydrophobicContact CD2-CD1 3.78Å
77	S	90.5	Very high	86.6	Confident	52 Å²	52	62.8 Å²	62.8	36%	0.364	32%	0.323	S	S	.	.	H	α-helix	trans	-61.7	-46.8	175.8	-173.5	0	0	0	0	112	E73 N74 R75 I79 Q80 F81	E73-S77 WeakPolarHBondContact O-CB 3.43Å; E73-S77 PolarHBondContact O-N 3.2Å; N74-S77 WeakPolarHBondContact O-CB 3.44Å; N74-S77 PolarHBondContact O-N 2.99Å; R75-S77 VanDerWaalsContact C-N 3.26Å; R75-S77 PolarHBondContact O-N 2.91Å; S77-I79 VanDerWaalsContact C-N 3.33Å; S77-I79 PolarHBondContact O-N 3.15Å; S77-Q80 PolarHBondContact O-N 2.86Å; S77-F81 WeakPolarHBondContact O-CB 3.49Å; S77-F81 VanDerWaalsContact O-CD2 3.24Å; S77-F81 WeakPolarHBondContact O-CD2 3.29Å; S77-F81 PolarHBondContact O-N 2.79Å; S77-F81 WeakPolarHBondContact OG-CD2 3.47Å
78	D	89.5	Confident	88.3	Confident	30 Å²	30	63.9 Å²	63.9	16%	0.16	31%	0.307	C	S	.	.	H	α-helix	trans	-61.5	-42.3	177.7	-73.3	-33.9	0	0	0	111.7	Y59 N74 R75 K82 I83	Y59-D78 HydrophobicContact CE1-CB 4.02Å; Y59-D78 PolarHBondContact OH-OD2 3.37Å; N74-D78 WeakPolarHBondContact O-CB 3.4Å; N74-D78 VanDerWaalsContact O-CG 3.31Å; N74-D78 PolarHBondContact O-N 3.23Å; R75-D78 PolarHBondContact O-N 2.9Å; D78-K82 HydrophobicContact CB-CD 4.46Å; D78-K82 WeakPolarHBondContact O-CA 3.44Å; D78-K82 WeakPolarHBondContact O-CB 3.25Å; D78-K82 PolarHBondContact O-N 2.88Å; D78-K82 WeakPolarHBondContact OD1-CD 3.2Å; D78-K82 VanDerWaalsContact OD1-CE 3.28Å; D78-K82 WeakPolarHBondContact OD1-CE 3.4Å; D78-K82 IonicContact OD1-NZ 3.86Å; D78-K82 PolarHBondContact OD1-NZ 3.48Å; D78-I83 PolarHBondContact O-N 2.67Å
79	I	89.9	Confident	89.5	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	31%	0.313	C	S	.	.	I	π-helix	trans	-62	-52.4	176.2	-73	162.9	0	0	0	110.8	R75 L76 S77 I83 R84 L140 L143 E144 I147	R75-I79 WeakPolarHBondContact O-CB 3.46Å; R75-I79 WeakPolarHBondContact O-CD1 3.37Å; R75-I79 VanDerWaalsContact O-CG1 3.3Å; R75-I79 WeakPolarHBondContact O-CG1 3.21Å; R75-I79 PolarHBondContact O-N 3.34Å; L76-I79 PolarHBondContact O-N 3.32Å; S77-I79 VanDerWaalsContact C-N 3.33Å; S77-I79 PolarHBondContact O-N 3.15Å; I79-I83 HydrophobicContact CG1-CD1 4.04Å; I79-I83 PolarHBondContact O-N 3.21Å; I79-R84 WeakPolarHBondContact O-CB 3.32Å; I79-R84 PolarHBondContact O-N 3.38Å; I79-L140 HydrophobicContact CB-CD1 4.48Å; I79-L140 HydrophobicContact CG1-CD1 4.42Å; I79-L140 HydrophobicContact CG2-CD1 3.51Å; I79-L140 HydrophobicContact CG2-CD2 4.38Å; I79-L140 HydrophobicContact CG2-CG 3.8Å; I79-L143 HydrophobicContact CD1-CD2 3.53Å; I79-L143 HydrophobicContact CD1-CG 3.79Å; I79-L143 HydrophobicContact CG1-CD2 4.42Å; I79-E144 HydrophobicContact CB-CG 4.45Å; I79-E144 HydrophobicContact CG2-CG 3.33Å; I79-E144 VanDerWaalsContact CG2-OE1 3.22Å; I79-E144 WeakPolarHBondContact CG2-OE1 3.48Å; I79-I147 HydrophobicContact CD1-CD1 3.49Å; I79-I147 VanDerWaalsContact CD1-CD1 3.49Å
80	Q	92.5	Very high	90.1	Very high	74 Å²	74	59.3 Å²	59.3	35%	0.346	29%	0.285	S	S	.	.	I	π-helix	trans	-70.7	-36	-173.7	-72.6	177.1	-22	0	0	113.5	L76 S77 P85	L76-Q80 HydrophobicContact CD1-CG 4.15Å; L76-Q80 HydrophobicContact CG-CG 4.39Å; L76-Q80 WeakPolarHBondContact O-CB 3.37Å; L76-Q80 VanDerWaalsContact O-CG 3.26Å; L76-Q80 WeakPolarHBondContact O-CG 3.26Å; L76-Q80 PolarHBondContact O-N 3.49Å; S77-Q80 PolarHBondContact O-N 2.86Å; Q80-P85 WeakPolarHBondContact O-CD 3.41Å
81	F	92.7	Very high	90.7	Very high	149 Å²	149	56 Å²	56	65%	0.654	27%	0.274	S	S	*	.	I	π-helix	trans	-108.4	-11.2	-170.9	-60.7	-70	0	0	0	114.3	S77	S77-F81 WeakPolarHBondContact O-CB 3.49Å; S77-F81 VanDerWaalsContact O-CD2 3.24Å; S77-F81 WeakPolarHBondContact O-CD2 3.29Å; S77-F81 PolarHBondContact O-N 2.79Å; S77-F81 WeakPolarHBondContact OG-CD2 3.47Å
82	K	91.5	Very high	91.4	Very high	123 Å²	123	59.2 Å²	59.2	54%	0.535	29%	0.285	S	S	.	.	I	π-helix	trans	-119.4	-53.9	175.9	-55.1	175	179.8	162.1	0	112	D78 L86	D78-K82 HydrophobicContact CB-CD 4.46Å; D78-K82 WeakPolarHBondContact O-CA 3.44Å; D78-K82 WeakPolarHBondContact O-CB 3.25Å; D78-K82 PolarHBondContact O-N 2.88Å; D78-K82 WeakPolarHBondContact OD1-CD 3.2Å; D78-K82 VanDerWaalsContact OD1-CE 3.28Å; D78-K82 WeakPolarHBondContact OD1-CE 3.4Å; D78-K82 IonicContact OD1-NZ 3.86Å; D78-K82 PolarHBondContact OD1-NZ 3.48Å; K82-L86 VanDerWaalsContact O-CD1 3.29Å; K82-L86 WeakPolarHBondContact O-CD1 3.42Å; K82-L86 WeakPolarHBondContact O-CG 3.48Å; K82-L86 PolarHBondContact O-N 2.85Å
83	I	92.2	Very high	91.9	Very high	7 Å²	7	61.3 Å²	61.3	4%	0.036	30%	0.297	C	S	.	.	I	π-helix	trans	-74.9	-49.4	-171.6	-57.6	179.5	0	0	0	111.3	L52 V55 I56 Y59 D78 I79 L86 L87 L140	L52-I83 HydrophobicContact CD1-CG2 3.98Å; L52-I83 HydrophobicContact CG-CG2 4.47Å; V55-I83 HydrophobicContact CG1-CD1 4.23Å; I56-I83 HydrophobicContact CD1-CG2 3.98Å; I56-I83 HydrophobicContact CG1-CD1 4.34Å; I56-I83 HydrophobicContact CG1-CG2 3.95Å; Y59-I83 HydrophobicContact CD2-CD1 3.77Å; Y59-I83 HydrophobicContact CE2-CD1 3.87Å; D78-I83 PolarHBondContact O-N 2.67Å; I79-I83 HydrophobicContact CG1-CD1 4.04Å; I79-I83 PolarHBondContact O-N 3.21Å; I83-L86 WeakPolarHBondContact O-CB 3.21Å; I83-L86 PolarHBondContact O-N 2.88Å; I83-L86 VanDerWaalsContact O-N 3.16Å; I83-L87 HydrophobicContact CG2-CD1 4.14Å; I83-L87 PolarHBondContact O-N 3.09Å; I83-L140 HydrophobicContact CB-CD1 4.3Å; I83-L140 HydrophobicContact CG2-CD1 3.66Å
84	R	93.2	Very high	92.4	Very high	58 Å²	58	57.7 Å²	57.7	22%	0.219	28%	0.28	C	S	.	.	H	α-helix	trans	-58.9	-49.2	-178.6	174.6	174.5	-69.3	-77.9	4.4	113	I79 L86 L87 E88 L140 E144	I79-R84 WeakPolarHBondContact O-CB 3.32Å; I79-R84 PolarHBondContact O-N 3.38Å; R84-L86 PolarHBondContact O-N 3.39Å; R84-L87 PolarHBondContact O-N 3.05Å; R84-L87 VanDerWaalsContact O-N 3.13Å; R84-E88 HydrophobicContact CG-CG 4.48Å; R84-E88 VanDerWaalsContact CG-OE1 3.23Å; R84-E88 WeakPolarHBondContact CG-OE1 3.46Å; R84-E88 WeakPolarHBondContact O-CG 3.26Å; R84-E88 PolarHBondContact O-N 3.39Å; R84-L140 HydrophobicContact CB-CD2 3.79Å; R84-L140 HydrophobicContact CG-CD2 4.37Å; R84-E144 IonicContact CZ-OE1 3.59Å; R84-E144 IonicContact CZ-OE2 3.21Å; R84-E144 IonicContact NE-OE1 3.49Å; R84-E144 PolarHBondContact NE-OE1 2.96Å; R84-E144 IonicContact NE-OE2 3.78Å; R84-E144 IonicContact NH2-OE1 2.83Å; R84-E144 PolarHBondContact NH2-OE1 3.46Å; R84-E144 IonicContact NH2-OE2 3.47Å; R84-E144 PolarHBondContact NH2-OE2 3.08Å
85	P	94.6	Very high	92.8	Very high	57 Å²	57	54.9 Å²	54.9	37%	0.37	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-30.5	177	-25.2	36.1	0	0	0	113.5	Q80 R89	Q80-P85 WeakPolarHBondContact O-CD 3.41Å; P85-R89 WeakPolarHBondContact O-CB 3.48Å; P85-R89 PolarHBondContact O-N 3.14Å
86	L	93	Very high	93.2	Very high	71 Å²	71	60.7 Å²	60.7	37%	0.372	29%	0.293	S	S	.	.	H	α-helix	trans	-69	-41.4	175.5	-71.4	171.2	0	0	0	111.8	L52 K82 I83 R84 R89 L90	L52-L86 HydrophobicContact CD1-CB 4.27Å; L52-L86 HydrophobicContact CD1-CD1 4.24Å; K82-L86 VanDerWaalsContact O-CD1 3.29Å; K82-L86 WeakPolarHBondContact O-CD1 3.42Å; K82-L86 WeakPolarHBondContact O-CG 3.48Å; K82-L86 PolarHBondContact O-N 2.85Å; I83-L86 WeakPolarHBondContact O-CB 3.21Å; I83-L86 PolarHBondContact O-N 2.88Å; I83-L86 VanDerWaalsContact O-N 3.16Å; R84-L86 PolarHBondContact O-N 3.39Å; L86-R89 PolarHBondContact O-N 3.47Å; L86-L90 WeakPolarHBondContact O-CB 3.36Å; L86-L90 WeakPolarHBondContact O-CG 3.38Å; L86-L90 PolarHBondContact O-N 3.01Å
87	L	93.3	Very high	93.5	Very high	4 Å²	4	60 Å²	60	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-44.4	174.5	-78.1	162.2	0	0	0	112.1	L52 I83 R84 L90 D91 V132 V135 L140	L52-L87 HydrophobicContact CD2-CD1 4.08Å; L52-L87 HydrophobicContact CD2-CD2 3.2Å; L52-L87 HydrophobicContact CD2-CG 3.37Å; I83-L87 HydrophobicContact CG2-CD1 4.14Å; I83-L87 PolarHBondContact O-N 3.09Å; R84-L87 PolarHBondContact O-N 3.05Å; R84-L87 VanDerWaalsContact O-N 3.13Å; L87-L90 PolarHBondContact O-N 3.48Å; L87-D91 PolarHBondContact O-N 2.99Å; L87-V132 HydrophobicContact CD2-CG1 3.94Å; L87-V135 HydrophobicContact CD1-CG1 4.39Å; L87-V135 HydrophobicContact CD2-CG1 4.3Å; L87-L140 HydrophobicContact CD1-CD2 3.7Å
88	E	94.5	Very high	93.6	Very high	100 Å²	100	58.4 Å²	58.4	47%	0.467	28%	0.277	S	S	.	.	H	α-helix	trans	-62.6	-45	178.5	-70.6	168.6	-178.5	0	0	111	R84 L90 D91 E92	R84-E88 HydrophobicContact CG-CG 4.48Å; R84-E88 VanDerWaalsContact CG-OE1 3.23Å; R84-E88 WeakPolarHBondContact CG-OE1 3.46Å; R84-E88 WeakPolarHBondContact O-CG 3.26Å; R84-E88 PolarHBondContact O-N 3.39Å; E88-L90 VanDerWaalsContact C-N 3.35Å; E88-L90 PolarHBondContact O-N 3.28Å; E88-D91 PolarHBondContact O-N 3.47Å; E88-E92 WeakPolarHBondContact O-CG 3.44Å; E88-E92 PolarHBondContact O-N 2.89Å
89	R	95.9	Very high	93.8	Very high	91 Å²	91	63.5 Å²	63.5	34%	0.343	30%	0.297	S	S	.	.	H	α-helix	trans	-59.8	-44.9	173.6	-179.7	-179.6	63.7	89.4	-0.9	111.8	E48 P85 L86 E92 D93	E48-R89 IonicContact OE1-NH1 3.06Å; E48-R89 IonicContact OE2-CZ 3.56Å; E48-R89 IonicContact OE2-NH1 3.63Å; E48-R89 PolarHBondContact OE2-NH1 3Å; E48-R89 IonicContact OE2-NH2 3.82Å; E48-R89 PolarHBondContact OE2-NH2 3.31Å; P85-R89 WeakPolarHBondContact O-CB 3.48Å; P85-R89 PolarHBondContact O-N 3.14Å; L86-R89 PolarHBondContact O-N 3.47Å; R89-E92 PolarHBondContact O-N 3.22Å; R89-D93 IonicContact NH1-OD2 3.79Å; R89-D93 WeakPolarHBondContact O-CB 3.32Å; R89-D93 PolarHBondContact O-N 2.98Å
90	L	94.6	Very high	93.9	Very high	3 Å²	3	67.6 Å²	67.6	2%	0.016	32%	0.315	C	S	.	.	H	α-helix	trans	-61.8	-43.8	178.7	-82.3	168.1	0	0	0	111.7	E48 I49 L52 L86 L87 E88 E92 D93 I94 V132	E48-L90 HydrophobicContact CB-CD1 4.27Å; E48-L90 HydrophobicContact CB-CD2 3.85Å; E48-L90 WeakPolarHBondContact OE2-CD2 3.23Å; I49-L90 HydrophobicContact CG1-CD1 4.35Å; L52-L90 HydrophobicContact CD2-CD1 4.46Å; L86-L90 WeakPolarHBondContact O-CB 3.36Å; L86-L90 WeakPolarHBondContact O-CG 3.38Å; L86-L90 PolarHBondContact O-N 3.01Å; L87-L90 PolarHBondContact O-N 3.48Å; E88-L90 VanDerWaalsContact C-N 3.35Å; E88-L90 PolarHBondContact O-N 3.28Å; L90-E92 VanDerWaalsContact C-N 3.34Å; L90-E92 PolarHBondContact O-N 3.38Å; L90-D93 PolarHBondContact O-N 3.07Å; L90-I94 WeakPolarHBondContact O-CB 3.45Å; L90-I94 WeakPolarHBondContact O-CD1 3.38Å; L90-I94 WeakPolarHBondContact O-CG1 3.2Å; L90-I94 PolarHBondContact O-N 3.4Å; L90-V132 HydrophobicContact CB-CG2 4.47Å
91	D	95	Very high	93.9	Very high	84 Å²	84	64.1 Å²	64.1	45%	0.449	30%	0.299	S	S	.	.	H	α-helix	trans	-59.9	-44.1	175.7	-174.4	55.4	0	0	0	111.6	L87 E88 G95 V132	L87-D91 PolarHBondContact O-N 2.99Å; E88-D91 PolarHBondContact O-N 3.47Å; D91-G95 PolarHBondContact O-N 3.42Å; D91-V132 HydrophobicContact CB-CG1 4.03Å
92	E	95.3	Very high	93.8	Very high	123 Å²	123	62.4 Å²	62.4	58%	0.575	29%	0.289	S	S	*	.	H	α-helix	trans	-62.8	-43.9	175.4	-73.8	-174.2	-172.2	0	0	112.9	E88 R89 L90 G95 R96	E88-E92 WeakPolarHBondContact O-CG 3.44Å; E88-E92 PolarHBondContact O-N 2.89Å; R89-E92 PolarHBondContact O-N 3.22Å; L90-E92 VanDerWaalsContact C-N 3.34Å; L90-E92 PolarHBondContact O-N 3.38Å; E92-G95 PolarHBondContact O-N 2.85Å; E92-R96 VanDerWaalsContact O-CB 3.26Å; E92-R96 WeakPolarHBondContact O-CB 3.25Å; E92-R96 PolarHBondContact O-N 3.45Å
93	D	94.8	Very high	93.7	Very high	51 Å²	51	64 Å²	64	27%	0.273	29%	0.292	S	S	.	.	H	α-helix	trans	-65.9	-45.2	-179.8	-76	-21.4	0	0	0	110.8	R89 L90 R96 M97	R89-D93 IonicContact NH1-OD2 3.79Å; R89-D93 WeakPolarHBondContact O-CB 3.32Å; R89-D93 PolarHBondContact O-N 2.98Å; L90-D93 PolarHBondContact O-N 3.07Å; D93-R96 PolarHBondContact O-N 3.06Å; D93-M97 WeakPolarHBondContact O-CB 3.33Å; D93-M97 PolarHBondContact O-N 3.11Å
94	I	96.2	Very high	93.6	Very high	6 Å²	6	63.8 Å²	63.8	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-50.7	172.9	-69	161.3	0	0	0	109.9	I45 I49 L90 R96 M97 D98 L125 F128 V132	I45-I94 HydrophobicContact CD1-CG1 4.14Å; I45-I94 HydrophobicContact CG2-CD1 4.1Å; I45-I94 HydrophobicContact CG2-CG1 3.89Å; I49-I94 HydrophobicContact CD1-CD1 4.33Å; L90-I94 WeakPolarHBondContact O-CB 3.45Å; L90-I94 WeakPolarHBondContact O-CD1 3.38Å; L90-I94 WeakPolarHBondContact O-CG1 3.2Å; L90-I94 PolarHBondContact O-N 3.4Å; I94-R96 VanDerWaalsContact C-N 3.29Å; I94-R96 PolarHBondContact O-N 3.42Å; I94-M97 PolarHBondContact O-N 2.93Å; I94-D98 VanDerWaalsContact O-CB 3.25Å; I94-D98 WeakPolarHBondContact O-CB 3.37Å; I94-D98 PolarHBondContact O-N 3.39Å; I94-L125 HydrophobicContact CG2-CB 4.38Å; I94-L125 HydrophobicContact CG2-CD2 4.27Å; I94-L125 VanDerWaalsContact CG2-O 3.28Å; I94-L125 WeakPolarHBondContact CG2-O 3.43Å; I94-F128 HydrophobicContact CD1-CB 3.82Å; I94-F128 HydrophobicContact CG1-CB 4.29Å; I94-V132 HydrophobicContact CD1-CG2 3.84Å
95	G	95.3	Very high	93.3	Very high	26 Å²	26	62.6 Å²	62.6	27%	0.268	29%	0.288	S	S	.	.	H	α-helix	trans	-62.4	-35.1	-179.5	0	0	0	0	0	113	D91 E92 K99	D91-G95 PolarHBondContact O-N 3.42Å; E92-G95 PolarHBondContact O-N 2.85Å; G95-K99 WeakPolarHBondContact O-CB 3.28Å; G95-K99 WeakPolarHBondContact O-CD 3.15Å; G95-K99 WeakPolarHBondContact O-CG 3.34Å; G95-K99 PolarHBondContact O-N 3.02Å; G95-K99 VanDerWaalsContact O-N 3.15Å
96	R	94.3	Very high	93	Very high	144 Å²	144	64.7 Å²	64.7	54%	0.543	30%	0.297	S	S	.	.	H	α-helix	trans	-69.2	-45.8	174.9	-172.8	-171.9	-51.3	-134.7	-0.2	111.3	E92 D93 I94 K99 K100	E92-R96 VanDerWaalsContact O-CB 3.26Å; E92-R96 WeakPolarHBondContact O-CB 3.25Å; E92-R96 PolarHBondContact O-N 3.45Å; D93-R96 PolarHBondContact O-N 3.06Å; I94-R96 VanDerWaalsContact C-N 3.29Å; I94-R96 PolarHBondContact O-N 3.42Å; R96-K99 PolarHBondContact O-N 3.47Å; R96-K100 WeakPolarHBondContact O-CG 3.28Å; R96-K100 PolarHBondContact O-N 2.85Å
97	M	93.8	Very high	92.7	Very high	7 Å²	7	64.5 Å²	64.5	3%	0.034	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-43.6	178	-169.7	59.4	70.1	0	0	111	F37 E41 D93 I94 K99 K100 V101 L125	F37-M97 HydrophobicContact CE1-CE 3.9Å; F37-M97 HydrophobicContact CE1-SD 4.37Å; F37-M97 HydrophobicContact CZ-CE 4.23Å; E41-M97 HydrophobicContact CB-CE 3.61Å; E41-M97 HydrophobicContact CG-CE 3.59Å; D93-M97 WeakPolarHBondContact O-CB 3.33Å; D93-M97 PolarHBondContact O-N 3.11Å; I94-M97 PolarHBondContact O-N 2.93Å; M97-K99 VanDerWaalsContact C-N 3.32Å; M97-K99 PolarHBondContact O-N 3.37Å; M97-K100 WeakPolarHBondContact O-CA 3.35Å; M97-K100 WeakPolarHBondContact O-CB 3.39Å; M97-K100 PolarHBondContact O-N 3.41Å; M97-V101 HydrophobicContact CG-CG2 4.4Å; M97-V101 WeakPolarHBondContact O-CG2 3.36Å; M97-V101 PolarHBondContact O-N 2.99Å; M97-L125 HydrophobicContact CB-CD1 4.15Å; M97-L125 HydrophobicContact CB-CD2 4.02Å; M97-L125 HydrophobicContact CG-CD1 3.75Å; M97-L125 HydrophobicContact CG-CD2 4.01Å
98	D	94.4	Very high	92.2	Very high	18 Å²	18	65.1 Å²	65.1	10%	0.096	31%	0.305	C	S	.	.	H	α-helix	trans	-58.4	-45.2	178.6	-171.3	42.9	0	0	0	111.2	I94 K100 V101 Y102 H122 L125 K126	I94-D98 VanDerWaalsContact O-CB 3.25Å; I94-D98 WeakPolarHBondContact O-CB 3.37Å; I94-D98 PolarHBondContact O-N 3.39Å; D98-K100 VanDerWaalsContact C-N 3.32Å; D98-K100 PolarHBondContact O-N 2.74Å; D98-V101 PolarHBondContact O-N 2.94Å; D98-Y102 WeakPolarHBondContact O-CB 3.44Å; D98-Y102 PolarHBondContact O-N 3.34Å; D98-H122 IonicContact OD1-CE1 2.72Å; D98-H122 PolarHBondContact OD1-CE1 3.16Å; D98-H122 IonicContact OD1-CG 2.62Å; D98-H122 IonicContact OD1-ND1 3.38Å; D98-H122 PolarHBondContact OD1-ND1 3.24Å; D98-H122 IonicContact OD2-CE1 3.18Å; D98-L125 HydrophobicContact CB-CB 4.22Å; D98-L125 HydrophobicContact CB-CD1 4.3Å; D98-K126 WeakPolarHBondContact OD2-CE 3.45Å; D98-K126 IonicContact OD2-NZ 2.68Å; D98-K126 PolarHBondContact OD2-NZ 3.02Å
99	K	93.3	Very high	91.7	Very high	136 Å²	136	68.1 Å²	68.1	59%	0.591	32%	0.316	S	S	*	.	H	α-helix	trans	-59.6	-40.4	174.2	-74.6	168.4	-173.1	170.2	0	112.3	G95 R96 M97 R103	G95-K99 WeakPolarHBondContact O-CB 3.28Å; G95-K99 WeakPolarHBondContact O-CD 3.15Å; G95-K99 WeakPolarHBondContact O-CG 3.34Å; G95-K99 PolarHBondContact O-N 3.02Å; G95-K99 VanDerWaalsContact O-N 3.15Å; R96-K99 PolarHBondContact O-N 3.47Å; M97-K99 VanDerWaalsContact C-N 3.32Å; M97-K99 PolarHBondContact O-N 3.37Å; K99-R103 WeakPolarHBondContact O-CB 3.45Å; K99-R103 WeakPolarHBondContact O-CG 3.35Å; K99-R103 PolarHBondContact O-N 3.29Å
100	K	91.8	Very high	91	Very high	88 Å²	88	71.5 Å²	71.5	38%	0.383	34%	0.34	S	S	.	.	H	α-helix	trans	-68.5	-41.7	178.1	-70.1	176.8	179.3	-179.5	0	112	Y30 L33 R96 M97 D98 N104	Y30-K100 PolarHBondContact OH-O 3.49Å; Y30-K100 VanDerWaalsContact OH-O 3.07Å; L33-K100 HydrophobicContact CD1-CB 4.15Å; R96-K100 WeakPolarHBondContact O-CG 3.28Å; R96-K100 PolarHBondContact O-N 2.85Å; M97-K100 WeakPolarHBondContact O-CA 3.35Å; M97-K100 WeakPolarHBondContact O-CB 3.39Å; M97-K100 PolarHBondContact O-N 3.41Å; D98-K100 VanDerWaalsContact C-N 3.32Å; D98-K100 PolarHBondContact O-N 2.74Å; K100-N104 PolarHBondContact O-N 3.49Å; K100-N104 VanDerWaalsContact O-N 3.14Å; K100-N104 PolarHBondContact O-ND2 2.99Å; K100-N104 VanDerWaalsContact O-ND2 3.11Å
101	V	91.7	Very high	90.3	Very high	0 Å²	0	81.3 Å²	81.3	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-67.4	-46.1	177.5	172.5	0	0	0	0	110.6	L33 V38 M97 D98 R103 N104 L105 L118 H122 L125	L33-V101 HydrophobicContact CD1-CG2 4.03Å; V38-V101 HydrophobicContact CG1-CG2 4.31Å; M97-V101 HydrophobicContact CG-CG2 4.4Å; M97-V101 WeakPolarHBondContact O-CG2 3.36Å; M97-V101 PolarHBondContact O-N 2.99Å; D98-V101 PolarHBondContact O-N 2.94Å; V101-R103 VanDerWaalsContact C-N 3.35Å; V101-R103 PolarHBondContact O-N 3.3Å; V101-N104 WeakPolarHBondContact O-CB 3.36Å; V101-N104 PolarHBondContact O-N 3.02Å; V101-N104 VanDerWaalsContact O-N 3.14Å; V101-L105 PolarHBondContact O-N 3.3Å; V101-L118 HydrophobicContact CG1-CB 4.42Å; V101-L118 HydrophobicContact CG1-CD2 4Å; V101-L118 VanDerWaalsContact CG1-O 3.24Å; V101-L118 WeakPolarHBondContact CG1-O 3.21Å; V101-H122 HydrophobicContact CG1-CB 3.99Å; V101-L125 HydrophobicContact CB-CD1 4.35Å; V101-L125 HydrophobicContact CG2-CD1 3.91Å
102	Y	91.3	Very high	89.7	Confident	114 Å²	114	80 Å²	80	45%	0.447	37%	0.373	S	S	.	.	H	α-helix	trans	-62.6	-40.7	179.5	-173.6	-103.5	0	0	0	112.3	D98 L105 N106 H122	D98-Y102 WeakPolarHBondContact O-CB 3.44Å; D98-Y102 PolarHBondContact O-N 3.34Å; Y102-L105 PolarHBondContact O-N 3.14Å; Y102-N106 WeakPolarHBondContact CD1-ND2 3.5Å; Y102-N106 WeakPolarHBondContact CE1-ND2 3.26Å; Y102-N106 PolarHBondContact O-N 2.91Å; Y102-N106 PolarHBondContact O-ND2 2.88Å; Y102-H122 AromaticContact CD2-CE1 3.92Å
103	R	89.9	Confident	89.1	Confident	156 Å²	156	79.3 Å²	79.3	59%	0.589	38%	0.382	S	S	*	.	H	α-helix	trans	-61.8	-43.2	172.9	-73.2	172.3	-173.1	-176.1	2.2	111.9	Y30 K99 V101 L105 N106 C107	Y30-R103 HydrophobicContact CE2-CB 3.79Å; K99-R103 WeakPolarHBondContact O-CB 3.45Å; K99-R103 WeakPolarHBondContact O-CG 3.35Å; K99-R103 PolarHBondContact O-N 3.29Å; V101-R103 VanDerWaalsContact C-N 3.35Å; V101-R103 PolarHBondContact O-N 3.3Å; R103-L105 VanDerWaalsContact C-N 3.29Å; R103-L105 PolarHBondContact O-N 3.36Å; R103-N106 PolarHBondContact O-N 3.24Å; R103-C107 PolarHBondContact O-N 2.92Å; R103-C107 PolarHBondContact O-SG 3.46Å; R103-C107 VanDerWaalsContact O-SG 3.39Å
104	N	89.2	Confident	88.7	Confident	3 Å²	3	80.3 Å²	80.3	2%	0.016	38%	0.382	C	S	.	.	H	α-helix	trans	-58.8	-46	176.3	-98.9	-88.2	0	0	0	110.2	Y30 L33 K100 V101 N106 C107 C108 L118	Y30-N104 HydrophobicContact CE1-CB 4.09Å; Y30-N104 WeakPolarHBondContact CE1-ND2 3.46Å; Y30-N104 VanDerWaalsContact CE1-OD1 3.22Å; Y30-N104 WeakPolarHBondContact CE1-OD1 3.43Å; Y30-N104 VanDerWaalsContact CZ-ND2 3.31Å; Y30-N104 WeakPolarHBondContact OH-CA 3.29Å; Y30-N104 WeakPolarHBondContact OH-CB 3.16Å; Y30-N104 PolarHBondContact OH-N 3.14Å; Y30-N104 PolarHBondContact OH-ND2 3.47Å; L33-N104 VanDerWaalsContact CB-ND2 3.34Å; L33-N104 WeakPolarHBondContact CB-ND2 3.41Å; L33-N104 HydrophobicContact CD1-CB 4.37Å; L33-N104 WeakPolarHBondContact CD1-ND2 3.47Å; L33-N104 WeakPolarHBondContact CG-ND2 3.39Å; L33-N104 PolarHBondContact N-OD1 2.95Å; K100-N104 PolarHBondContact O-N 3.49Å; K100-N104 VanDerWaalsContact O-N 3.14Å; K100-N104 PolarHBondContact O-ND2 2.99Å; K100-N104 VanDerWaalsContact O-ND2 3.11Å; V101-N104 WeakPolarHBondContact O-CB 3.36Å; V101-N104 PolarHBondContact O-N 3.02Å; V101-N104 VanDerWaalsContact O-N 3.14Å; N104-N106 VanDerWaalsContact C-N 3.33Å; N104-N106 PolarHBondContact O-N 3.46Å; N104-C107 PolarHBondContact O-N 3.25Å; N104-C107 VanDerWaalsContact O-N 3.15Å; N104-C108 PolarHBondContact O-N 2.87Å; N104-C108 VanDerWaalsContact O-N 3.1Å; N104-C108 PolarHBondContact O-SG 3.35Å; N104-C108 VanDerWaalsContact O-SG 3.37Å; N104-L118 HydrophobicContact CB-CD1 3.84Å; N104-L118 HydrophobicContact CB-CD2 3.72Å; N104-L118 HydrophobicContact CB-CG 4.45Å
105	L	88.2	Confident	88.2	Confident	33 Å²	33	81.6 Å²	81.6	17%	0.173	39%	0.39	C	S	.	.	H	α-helix	trans	-60.8	-41.6	-178.4	-170.6	68.4	0	0	0	111.8	V101 Y102 R103 C107 C108 V115 L118 L119	V101-L105 PolarHBondContact O-N 3.3Å; Y102-L105 PolarHBondContact O-N 3.14Å; R103-L105 VanDerWaalsContact C-N 3.29Å; R103-L105 PolarHBondContact O-N 3.36Å; L105-C107 VanDerWaalsContact C-N 3.28Å; L105-C107 PolarHBondContact O-N 3.27Å; L105-C108 PolarHBondContact O-N 3.44Å; L105-V115 HydrophobicContact CD1-CG1 4.05Å; L105-L118 HydrophobicContact CD1-CB 3.96Å; L105-L119 HydrophobicContact CD1-CB 4.47Å; L105-L119 HydrophobicContact CD2-CD1 4.19Å
106	N	87.6	Confident	87.8	Confident	101 Å²	101	83.6 Å²	83.6	54%	0.54	40%	0.399	S	S	.	.	H	α-helix	trans	-69.2	-24.8	178.1	-69	-27.6	0	0	0	113.7	Y102 R103 N104	Y102-N106 WeakPolarHBondContact CD1-ND2 3.5Å; Y102-N106 WeakPolarHBondContact CE1-ND2 3.26Å; Y102-N106 PolarHBondContact O-N 2.91Å; Y102-N106 PolarHBondContact O-ND2 2.88Å; R103-N106 PolarHBondContact O-N 3.24Å; N104-N106 VanDerWaalsContact C-N 3.33Å; N104-N106 PolarHBondContact O-N 3.46Å
107	C	85.5	Confident	87.4	Confident	67 Å²	67	78 Å²	78	45%	0.453	38%	0.378	S	S	.	.	H	α-helix	trans	-86.8	-16.2	176.5	-65.8	0	0	0	0	112.9	R103 N104 L105	R103-C107 PolarHBondContact O-N 2.92Å; R103-C107 PolarHBondContact O-SG 3.46Å; R103-C107 VanDerWaalsContact O-SG 3.39Å; N104-C107 PolarHBondContact O-N 3.25Å; N104-C107 VanDerWaalsContact O-N 3.15Å; L105-C107 VanDerWaalsContact C-N 3.28Å; L105-C107 PolarHBondContact O-N 3.27Å
108	C	84	Confident	87.2	Confident	17 Å²	17	77.6 Å²	77.6	12%	0.115	38%	0.376	C	S	.	.	S	Bend	trans	-78	139.7	178.8	-79.8	0	0	0	0	112.1	N104 L105 E112 V115	N104-C108 PolarHBondContact O-N 2.87Å; N104-C108 VanDerWaalsContact O-N 3.1Å; N104-C108 PolarHBondContact O-SG 3.35Å; N104-C108 VanDerWaalsContact O-SG 3.37Å; L105-C108 PolarHBondContact O-N 3.44Å; C108-E112 PolarHBondContact SG-OE2 2.9Å; C108-V115 HydrophobicContact CB-CG2 3.72Å
109	K	83.9	Confident	87	Confident	163 Å²	163	79.9 Å²	79.9	71%	0.709	39%	0.388	S	S	*	.			trans	-73	144.2	164.7	-61.1	178.4	-176.7	176.7	0	109.4	K111 E112 V115	K109-K111 PolarHBondContact O-N 2.97Å; K109-E112 HydrophobicContact CB-CG 4.25Å; K109-E112 PolarHBondContact N-OE1 2.91Å; K109-E112 WeakPolarHBondContact O-CB 3.26Å; K109-E112 PolarHBondContact O-N 3.25Å; K109-V115 VanDerWaalsContact O-CG2 3.3Å; K109-V115 WeakPolarHBondContact O-CG2 3.46Å
110	I	80.2	Confident	86.8	Confident	162 Å²	162	74.4 Å²	74.4	83%	0.831	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-29.6	-177.7	-63.2	170.4	0	0	0	113.3
111	K	81.1	Confident	86.7	Confident	209 Å²	209	70.5 Å²	70.5	91%	0.909	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-3.6	-178.8	-60.5	-175.9	-179.5	-178	0	114.4	K109	K109-K111 PolarHBondContact O-N 2.97Å
112	E	82.2	Confident	86.7	Confident	56 Å²	56	72.1 Å²	72.1	26%	0.262	36%	0.357	S	S	.	.			trans	-71.4	136.4	178.7	-74.9	177	-135.4	0	0	111	C108 K109 R114 V115	C108-E112 PolarHBondContact SG-OE2 2.9Å; K109-E112 HydrophobicContact CB-CG 4.25Å; K109-E112 PolarHBondContact N-OE1 2.91Å; K109-E112 WeakPolarHBondContact O-CB 3.26Å; K109-E112 PolarHBondContact O-N 3.25Å; E112-R114 PolarHBondContact O-N 3.27Å; E112-R114 VanDerWaalsContact O-N 3.08Å; E112-R114 IonicContact OE2-CZ 3.65Å; E112-R114 IonicContact OE2-NE 3.56Å; E112-R114 IonicContact OE2-NH2 2.87Å; E112-R114 PolarHBondContact OE2-NH2 3.46Å; E112-V115 HydrophobicContact CB-CG2 4.16Å; E112-V115 WeakPolarHBondContact O-CB 3.37Å; E112-V115 WeakPolarHBondContact O-CG2 3.28Å; E112-V115 PolarHBondContact O-N 2.97Å; E112-V115 VanDerWaalsContact O-N 3.15Å
113	S	82.7	Confident	86.7	Confident	109 Å²	109	72 Å²	72	76%	0.762	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-27.4	176.2	54.5	0	0	0	0	112.9	V115	S113-V115 VanDerWaalsContact C-N 3.33Å; S113-V115 PolarHBondContact O-N 3.31Å
114	R	85.1	Confident	86.7	Confident	71 Å²	71	64.8 Å²	64.8	27%	0.268	33%	0.332	S	S	.	.	H	α-helix	trans	-72.1	-22.5	-178	-59.7	-175	-64.5	159.8	2.3	114.6	E112 C116 W117 L118	E112-R114 PolarHBondContact O-N 3.27Å; E112-R114 VanDerWaalsContact O-N 3.08Å; E112-R114 IonicContact OE2-CZ 3.65Å; E112-R114 IonicContact OE2-NE 3.56Å; E112-R114 IonicContact OE2-NH2 2.87Å; E112-R114 PolarHBondContact OE2-NH2 3.46Å; R114-C116 PolarHBondContact O-N 2.93Å; R114-W117 VanDerWaalsContact CA-NE1 3.29Å; R114-W117 HydrophobicContact CB-CZ2 4.25Å; R114-W117 HydrophobicContact CG-CZ2 4.36Å; R114-W117 PolarHBondContact O-N 3.32Å; R114-L118 HydrophobicContact CB-CD1 4.14Å; R114-L118 WeakPolarHBondContact O-CB 3.4Å; R114-L118 WeakPolarHBondContact O-CG 3.35Å; R114-L118 PolarHBondContact O-N 3.23Å
115	V	87.2	Confident	86.9	Confident	33 Å²	33	64.7 Å²	64.7	20%	0.2	33%	0.331	C	S	.	.	H	α-helix	trans	-57.8	-40.7	-177.4	174.2	0	0	0	0	111.2	L105 C108 K109 E112 S113 L119	L105-V115 HydrophobicContact CD1-CG1 4.05Å; C108-V115 HydrophobicContact CB-CG2 3.72Å; K109-V115 VanDerWaalsContact O-CG2 3.3Å; K109-V115 WeakPolarHBondContact O-CG2 3.46Å; E112-V115 HydrophobicContact CB-CG2 4.16Å; E112-V115 WeakPolarHBondContact O-CB 3.37Å; E112-V115 WeakPolarHBondContact O-CG2 3.28Å; E112-V115 PolarHBondContact O-N 2.97Å; E112-V115 VanDerWaalsContact O-N 3.15Å; S113-V115 VanDerWaalsContact C-N 3.33Å; S113-V115 PolarHBondContact O-N 3.31Å; V115-L119 WeakPolarHBondContact O-CB 3.28Å; V115-L119 PolarHBondContact O-N 3.06Å
116	C	86.4	Confident	87.2	Confident	69 Å²	69	67.9 Å²	67.9	47%	0.466	34%	0.343	S	S	.	.	H	α-helix	trans	-63	-51.2	-176.8	-173.4	0	0	0	0	112.1	R114 L119 N120	R114-C116 PolarHBondContact O-N 2.93Å; C116-L119 PolarHBondContact O-N 3.45Å; C116-N120 PolarHBondContact O-N 3.36Å; C116-N120 VanDerWaalsContact O-N 3.11Å; C116-N120 PolarHBondContact O-ND2 2.99Å; C116-N120 VanDerWaalsContact O-ND2 3.09Å
117	W	86.1	Confident	87.4	Confident	25 Å²	25	66.5 Å²	66.5	10%	0.095	33%	0.334	C	S	.	.	H	α-helix	trans	-72	-38.4	-178.4	71	-104.5	0	0	0	111.7	L33 R35 V38 R114 L119 N120 S121	L33-W117 HydrophobicContact CB-CH2 4.08Å; R35-W117 HydrophobicContact CB-CD2 4.25Å; R35-W117 HydrophobicContact CB-CH2 4.33Å; R35-W117 HydrophobicContact CB-CZ2 4.01Å; R35-W117 HydrophobicContact CG-CD2 4.1Å; R35-W117 HydrophobicContact CG-CE3 4.38Å; R35-W117 HydrophobicContact CG-CG 4.33Å; V38-W117 HydrophobicContact CB-CZ3 3.92Å; V38-W117 HydrophobicContact CG1-CZ3 4.13Å; V38-W117 HydrophobicContact CG2-CH2 4.23Å; V38-W117 HydrophobicContact CG2-CZ3 3.84Å; R114-W117 VanDerWaalsContact CA-NE1 3.29Å; R114-W117 HydrophobicContact CB-CZ2 4.25Å; R114-W117 HydrophobicContact CG-CZ2 4.36Å; R114-W117 PolarHBondContact O-N 3.32Å; W117-L119 VanDerWaalsContact C-N 3.32Å; W117-L119 PolarHBondContact O-N 2.89Å; W117-N120 PolarHBondContact O-N 3.21Å; W117-N120 VanDerWaalsContact O-N 3.13Å; W117-S121 PolarHBondContact O-N 2.89Å; W117-S121 PolarHBondContact O-OG 3.06Å
118	L	90.3	Very high	87.8	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.6	-42.3	174.4	-74.9	167.5	0	0	0	112.1	V101 N104 L105 R114 N120 S121 H122	V101-L118 HydrophobicContact CG1-CB 4.42Å; V101-L118 HydrophobicContact CG1-CD2 4Å; V101-L118 VanDerWaalsContact CG1-O 3.24Å; V101-L118 WeakPolarHBondContact CG1-O 3.21Å; N104-L118 HydrophobicContact CB-CD1 3.84Å; N104-L118 HydrophobicContact CB-CD2 3.72Å; N104-L118 HydrophobicContact CB-CG 4.45Å; L105-L118 HydrophobicContact CD1-CB 3.96Å; R114-L118 HydrophobicContact CB-CD1 4.14Å; R114-L118 WeakPolarHBondContact O-CB 3.4Å; R114-L118 WeakPolarHBondContact O-CG 3.35Å; R114-L118 PolarHBondContact O-N 3.23Å; L118-N120 VanDerWaalsContact C-N 3.32Å; L118-N120 PolarHBondContact O-N 2.69Å; L118-S121 PolarHBondContact O-N 2.87Å; L118-H122 WeakPolarHBondContact O-CB 3.45Å; L118-H122 PolarHBondContact O-N 3.31Å
119	L	89.4	Confident	88.3	Confident	66 Å²	66	63.1 Å²	63.1	35%	0.346	31%	0.314	S	S	.	.	H	α-helix	trans	-64.8	-38.2	176.6	-176.6	65.9	0	0	0	111.7	L105 V115 C116 W117 K123	L105-L119 HydrophobicContact CD1-CB 4.47Å; L105-L119 HydrophobicContact CD2-CD1 4.19Å; V115-L119 WeakPolarHBondContact O-CB 3.28Å; V115-L119 PolarHBondContact O-N 3.06Å; C116-L119 PolarHBondContact O-N 3.45Å; W117-L119 VanDerWaalsContact C-N 3.32Å; W117-L119 PolarHBondContact O-N 2.89Å; L119-K123 VanDerWaalsContact O-CG 3.32Å; L119-K123 WeakPolarHBondContact O-CG 3.37Å; L119-K123 PolarHBondContact O-N 3.38Å; L119-K123 VanDerWaalsContact O-N 3.11Å
120	N	88.8	Confident	88.8	Confident	20 Å²	20	60 Å²	60	11%	0.107	30%	0.304	C	S	.	.	H	α-helix	trans	-67.9	-44.5	175.6	-71.8	-41.3	0	0	0	111.6	C116 W117 L118 H122 K123 M124 K184	C116-N120 PolarHBondContact O-N 3.36Å; C116-N120 VanDerWaalsContact O-N 3.11Å; C116-N120 PolarHBondContact O-ND2 2.99Å; C116-N120 VanDerWaalsContact O-ND2 3.09Å; W117-N120 PolarHBondContact O-N 3.21Å; W117-N120 VanDerWaalsContact O-N 3.13Å; L118-N120 VanDerWaalsContact C-N 3.32Å; L118-N120 PolarHBondContact O-N 2.69Å; N120-H122 VanDerWaalsContact C-N 3.33Å; N120-H122 PolarHBondContact O-N 3.5Å; N120-K123 PolarHBondContact O-N 2.99Å; N120-M124 WeakPolarHBondContact O-CG 3.35Å; N120-M124 PolarHBondContact O-N 2.93Å; N120-K184 HydrophobicContact CB-CD 4.28Å; N120-K184 PolarHBondContact OD1-NZ 3.45Å
121	S	90.4	Very high	89.4	Confident	7 Å²	7	52.5 Å²	52.5	5%	0.049	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-43.3	175.3	-57.8	0	0	0	0	111.5	V38 W117 L118 K123 M124 L125	V38-S121 WeakPolarHBondContact CG1-OG 3.43Å; W117-S121 PolarHBondContact O-N 2.89Å; W117-S121 PolarHBondContact O-OG 3.06Å; L118-S121 PolarHBondContact O-N 2.87Å; S121-K123 PolarHBondContact O-N 3.29Å; S121-M124 PolarHBondContact O-N 3.43Å; S121-L125 VanDerWaalsContact O-CG 3.29Å; S121-L125 WeakPolarHBondContact O-CG 3.23Å; S121-L125 PolarHBondContact O-N 3.13Å
122	H	92	Very high	90	Very high	34 Å²	34	42.7 Å²	42.7	16%	0.157	22%	0.224	C	C	.	.	H	α-helix	trans	-59.2	-45.9	175.3	-178.8	60	0	0	0	111.8	D98 V101 Y102 L118 N120 M124 L125 K126	D98-H122 IonicContact OD1-CE1 2.72Å; D98-H122 PolarHBondContact OD1-CE1 3.16Å; D98-H122 IonicContact OD1-CG 2.62Å; D98-H122 IonicContact OD1-ND1 3.38Å; D98-H122 PolarHBondContact OD1-ND1 3.24Å; D98-H122 IonicContact OD2-CE1 3.18Å; V101-H122 HydrophobicContact CG1-CB 3.99Å; Y102-H122 AromaticContact CD2-CE1 3.92Å; L118-H122 WeakPolarHBondContact O-CB 3.45Å; L118-H122 PolarHBondContact O-N 3.31Å; N120-H122 VanDerWaalsContact C-N 3.33Å; N120-H122 PolarHBondContact O-N 3.5Å; H122-M124 PolarHBondContact O-N 3.13Å; H122-L125 PolarHBondContact O-N 3.4Å; H122-K126 WeakPolarHBondContact O-CG 3.46Å; H122-K126 PolarHBondContact O-N 2.88Å
123	K	91.1	Very high	90.6	Very high	110 Å²	110	42.2 Å²	42.2	48%	0.478	23%	0.229	S	C	.	.	H	α-helix	trans	-61.3	-43.5	176.7	-73.3	173.5	179.8	-177.9	0	112.1	L119 N120 S121 K126 Q127	L119-K123 VanDerWaalsContact O-CG 3.32Å; L119-K123 WeakPolarHBondContact O-CG 3.37Å; L119-K123 PolarHBondContact O-N 3.38Å; L119-K123 VanDerWaalsContact O-N 3.11Å; N120-K123 PolarHBondContact O-N 2.99Å; S121-K123 PolarHBondContact O-N 3.29Å; K123-K126 PolarHBondContact O-N 2.87Å; K123-Q127 WeakPolarHBondContact O-CG 3.22Å; K123-Q127 PolarHBondContact O-N 3.03Å; K123-Q127 VanDerWaalsContact O-N 3.07Å
124	M	90.4	Very high	91.1	Very high	6 Å²	6	41.2 Å²	41.2	3%	0.03	22%	0.215	C	C	.	.	H	α-helix	trans	-63.1	-44.9	177.3	-71.3	168.8	170.4	0	0	111.6	L42 N120 S121 H122 K126 Q127 F128 L180 L181	L42-M124 HydrophobicContact CD1-SD 4.15Å; L42-M124 HydrophobicContact CD2-CB 4.27Å; N120-M124 WeakPolarHBondContact O-CG 3.35Å; N120-M124 PolarHBondContact O-N 2.93Å; S121-M124 PolarHBondContact O-N 3.43Å; H122-M124 PolarHBondContact O-N 3.13Å; M124-K126 VanDerWaalsContact C-N 3.31Å; M124-K126 PolarHBondContact O-N 2.96Å; M124-Q127 WeakPolarHBondContact O-CB 3.27Å; M124-Q127 PolarHBondContact O-N 3.32Å; M124-Q127 VanDerWaalsContact O-N 3.11Å; M124-F128 HydrophobicContact CB-CE2 4.34Å; M124-F128 WeakPolarHBondContact O-CD2 3.32Å; M124-F128 WeakPolarHBondContact O-CG 3.17Å; M124-F128 PolarHBondContact O-N 3.38Å; M124-L180 HydrophobicContact CE-CB 3.7Å; M124-L181 HydrophobicContact CE-CD2 3.84Å; M124-L181 HydrophobicContact CE-CG 4.06Å; M124-L181 HydrophobicContact SD-CD2 3.66Å; M124-L181 HydrophobicContact SD-CG 4.33Å
125	L	93.3	Very high	91.4	Very high	1 Å²	1	38 Å²	38	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-38.4	177.7	-71.4	163.5	0	0	0	112.3	L42 I45 I94 M97 D98 V101 S121 H122 F128 G129	L42-L125 HydrophobicContact CD2-CD1 4.45Å; L42-L125 HydrophobicContact CD2-CD2 3.71Å; L42-L125 HydrophobicContact CD2-CG 3.75Å; I45-L125 HydrophobicContact CD1-CD2 4.01Å; I94-L125 HydrophobicContact CG2-CB 4.38Å; I94-L125 HydrophobicContact CG2-CD2 4.27Å; I94-L125 VanDerWaalsContact CG2-O 3.28Å; I94-L125 WeakPolarHBondContact CG2-O 3.43Å; M97-L125 HydrophobicContact CB-CD1 4.15Å; M97-L125 HydrophobicContact CB-CD2 4.02Å; M97-L125 HydrophobicContact CG-CD1 3.75Å; M97-L125 HydrophobicContact CG-CD2 4.01Å; D98-L125 HydrophobicContact CB-CB 4.22Å; D98-L125 HydrophobicContact CB-CD1 4.3Å; V101-L125 HydrophobicContact CB-CD1 4.35Å; V101-L125 HydrophobicContact CG2-CD1 3.91Å; S121-L125 VanDerWaalsContact O-CG 3.29Å; S121-L125 WeakPolarHBondContact O-CG 3.23Å; S121-L125 PolarHBondContact O-N 3.13Å; H122-L125 PolarHBondContact O-N 3.4Å; L125-F128 PolarHBondContact O-N 2.65Å; L125-G129 PolarHBondContact O-N 3.38Å
126	K	93.7	Very high	91.6	Very high	99 Å²	99	37.9 Å²	37.9	43%	0.43	20%	0.203	S	C	.	.	H	α-helix	trans	-61	-46.7	171.6	-71.5	-58	-171.6	-155.2	0	112	D98 H122 K123 M124 F128 G129 D130	D98-K126 WeakPolarHBondContact OD2-CE 3.45Å; D98-K126 IonicContact OD2-NZ 2.68Å; D98-K126 PolarHBondContact OD2-NZ 3.02Å; H122-K126 WeakPolarHBondContact O-CG 3.46Å; H122-K126 PolarHBondContact O-N 2.88Å; K123-K126 PolarHBondContact O-N 2.87Å; M124-K126 VanDerWaalsContact C-N 3.31Å; M124-K126 PolarHBondContact O-N 2.96Å; K126-F128 VanDerWaalsContact C-N 3.34Å; K126-F128 PolarHBondContact O-N 3.28Å; K126-G129 PolarHBondContact O-N 3.42Å; K126-D130 VanDerWaalsContact O-CG 3.26Å; K126-D130 PolarHBondContact O-N 3.43Å
127	Q	92.4	Very high	91.9	Very high	72 Å²	72	39 Å²	39	34%	0.336	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-40.1	177.9	-67.8	175.1	-41.2	0	0	112.2	K123 M124 D130 I131 I177	K123-Q127 WeakPolarHBondContact O-CG 3.22Å; K123-Q127 PolarHBondContact O-N 3.03Å; K123-Q127 VanDerWaalsContact O-N 3.07Å; M124-Q127 WeakPolarHBondContact O-CB 3.27Å; M124-Q127 PolarHBondContact O-N 3.32Å; M124-Q127 VanDerWaalsContact O-N 3.11Å; Q127-D130 PolarHBondContact O-N 3.4Å; Q127-I131 VanDerWaalsContact O-CG1 3.28Å; Q127-I131 WeakPolarHBondContact O-CG1 3.27Å; Q127-I131 PolarHBondContact O-N 3.27Å; Q127-I177 HydrophobicContact CB-CD1 3.69Å; Q127-I177 HydrophobicContact CB-CG1 4.2Å
128	F	93.6	Very high	92.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.8	-44.7	173.2	-69	-43	0	0	0	112.1	L42 I45 Y46 I49 I94 M124 L125 K126 D130 I131 V132 L174 I177	L42-F128 HydrophobicContact CD2-CD2 4.32Å; L42-F128 HydrophobicContact CD2-CE2 3.88Å; I45-F128 HydrophobicContact CG2-CB 4.17Å; I45-F128 HydrophobicContact CG2-CD1 4.38Å; I45-F128 HydrophobicContact CG2-CD2 3.7Å; I45-F128 HydrophobicContact CG2-CE2 4.1Å; I45-F128 HydrophobicContact CG2-CG 3.86Å; Y46-F128 HydrophobicContact CD2-CE1 4.05Å; Y46-F128 HydrophobicContact CD2-CZ 4.23Å; I49-F128 HydrophobicContact CD1-CB 3.8Å; I49-F128 HydrophobicContact CD1-CD1 3.55Å; I49-F128 HydrophobicContact CD1-CE1 4.35Å; I49-F128 HydrophobicContact CD1-CG 3.89Å; I94-F128 HydrophobicContact CD1-CB 3.82Å; I94-F128 HydrophobicContact CG1-CB 4.29Å; M124-F128 HydrophobicContact CB-CE2 4.34Å; M124-F128 WeakPolarHBondContact O-CD2 3.32Å; M124-F128 WeakPolarHBondContact O-CG 3.17Å; M124-F128 PolarHBondContact O-N 3.38Å; L125-F128 PolarHBondContact O-N 2.65Å; K126-F128 VanDerWaalsContact C-N 3.34Å; K126-F128 PolarHBondContact O-N 3.28Å; F128-D130 VanDerWaalsContact C-N 3.33Å; F128-D130 PolarHBondContact O-N 3.11Å; F128-I131 PolarHBondContact O-N 3.03Å; F128-V132 WeakPolarHBondContact O-CG2 3.37Å; F128-V132 PolarHBondContact O-N 2.93Å; F128-L174 HydrophobicContact CD1-CD1 4.43Å; F128-L174 HydrophobicContact CE1-CD1 3.99Å; F128-I177 HydrophobicContact CD1-CD1 3.69Å; F128-I177 HydrophobicContact CE1-CB 4.38Å; F128-I177 HydrophobicContact CE1-CD1 3.65Å; F128-I177 HydrophobicContact CE1-CG2 3.67Å; F128-I177 HydrophobicContact CE2-CG2 4.5Å; F128-I177 HydrophobicContact CZ-CD1 4.48Å; F128-I177 HydrophobicContact CZ-CG2 3.58Å
129	G	94.5	Very high	92	Very high	14 Å²	14	38.9 Å²	38.9	14%	0.144	21%	0.214	C	C	.	.	H	α-helix	trans	-59.2	-44.1	175.4	0	0	0	0	0	112.2	L125 K126 I131 V132 A133	L125-G129 PolarHBondContact O-N 3.38Å; K126-G129 PolarHBondContact O-N 3.42Å; G129-I131 VanDerWaalsContact C-N 3.34Å; G129-I131 PolarHBondContact O-N 2.86Å; G129-V132 PolarHBondContact O-N 3.19Å; G129-A133 WeakPolarHBondContact O-CB 3.47Å; G129-A133 PolarHBondContact O-N 2.96Å
130	D	93.7	Very high	92.1	Very high	97 Å²	97	35.8 Å²	35.8	52%	0.519	20%	0.198	S	C	.	.	H	α-helix	trans	-62.9	-40.3	176.9	-66	-23.8	0	0	0	111.7	K126 Q127 F128 N134	K126-D130 VanDerWaalsContact O-CG 3.26Å; K126-D130 PolarHBondContact O-N 3.43Å; Q127-D130 PolarHBondContact O-N 3.4Å; F128-D130 VanDerWaalsContact C-N 3.33Å; F128-D130 PolarHBondContact O-N 3.11Å; D130-N134 VanDerWaalsContact O-CB 3.26Å; D130-N134 WeakPolarHBondContact O-CB 3.34Å; D130-N134 PolarHBondContact O-N 2.91Å; D130-N134 PolarHBondContact O-ND2 3.1Å; D130-N134 VanDerWaalsContact O-ND2 3.08Å
131	I	92.7	Very high	92.2	Very high	5 Å²	5	38.9 Å²	38.9	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-62.4	-50.1	175	-69.3	165	0	0	0	110.5	I49 I53 Q127 F128 G129 A133 N134 V135 A170 H173 L174 I177	I49-I131 HydrophobicContact CG2-CG2 3.85Å; I53-I131 HydrophobicContact CD1-CG2 4.13Å; Q127-I131 VanDerWaalsContact O-CG1 3.28Å; Q127-I131 WeakPolarHBondContact O-CG1 3.27Å; Q127-I131 PolarHBondContact O-N 3.27Å; F128-I131 PolarHBondContact O-N 3.03Å; G129-I131 VanDerWaalsContact C-N 3.34Å; G129-I131 PolarHBondContact O-N 2.86Å; I131-A133 VanDerWaalsContact C-N 3.33Å; I131-A133 PolarHBondContact O-N 3.43Å; I131-N134 PolarHBondContact O-N 3.27Å; I131-V135 HydrophobicContact CG2-CG2 4.29Å; I131-V135 WeakPolarHBondContact O-CB 3.26Å; I131-V135 VanDerWaalsContact O-CG2 3.32Å; I131-V135 WeakPolarHBondContact O-CG2 3.41Å; I131-V135 PolarHBondContact O-N 3.08Å; I131-A170 HydrophobicContact CG2-CB 4.23Å; I131-H173 HydrophobicContact CD1-CB 3.88Å; I131-H173 HydrophobicContact CG1-CB 4Å; I131-L174 HydrophobicContact CD1-CB 4.49Å; I131-L174 HydrophobicContact CD1-CD1 4.32Å; I131-I177 HydrophobicContact CD1-CD1 3.6Å
132	V	94.7	Very high	92.1	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-60.3	-44.1	-179.8	169.1	0	0	0	0	110.9	I49 L87 L90 D91 I94 F128 G129 V135 T136	I49-V132 HydrophobicContact CD1-CG2 4Å; I49-V132 HydrophobicContact CG1-CG2 4.11Å; L87-V132 HydrophobicContact CD2-CG1 3.94Å; L90-V132 HydrophobicContact CB-CG2 4.47Å; D91-V132 HydrophobicContact CB-CG1 4.03Å; I94-V132 HydrophobicContact CD1-CG2 3.84Å; F128-V132 WeakPolarHBondContact O-CG2 3.37Å; F128-V132 PolarHBondContact O-N 2.93Å; G129-V132 PolarHBondContact O-N 3.19Å; V132-V135 PolarHBondContact O-N 2.74Å; V132-T136 WeakPolarHBondContact O-CB 3.45Å; V132-T136 PolarHBondContact O-N 3.47Å; V132-T136 PolarHBondContact O-OG1 2.89Å
133	A	94	Very high	91.9	Very high	46 Å²	46	39 Å²	39	38%	0.38	22%	0.216	S	C	.	.	H	α-helix	trans	-62.5	-46.9	176.6	0	0	0	0	0	111.8	G129 I131 T136 V137	G129-A133 WeakPolarHBondContact O-CB 3.47Å; G129-A133 PolarHBondContact O-N 2.96Å; I131-A133 VanDerWaalsContact C-N 3.33Å; I131-A133 PolarHBondContact O-N 3.43Å; A133-T136 PolarHBondContact O-N 2.93Å; A133-V137 PolarHBondContact O-N 2.91Å
134	N	92.5	Very high	91.8	Very high	87 Å²	87	34.9 Å²	34.9	47%	0.465	20%	0.198	S	C	.	.	H	α-helix	trans	-64.9	-40	179.3	-74	-27.5	0	0	0	112.4	D130 I131 G138 T166	D130-N134 VanDerWaalsContact O-CB 3.26Å; D130-N134 WeakPolarHBondContact O-CB 3.34Å; D130-N134 PolarHBondContact O-N 2.91Å; D130-N134 PolarHBondContact O-ND2 3.1Å; D130-N134 VanDerWaalsContact O-ND2 3.08Å; I131-N134 PolarHBondContact O-N 3.27Å; N134-G138 VanDerWaalsContact O-CA 3.24Å; N134-G138 WeakPolarHBondContact O-CA 3.24Å; N134-G138 PolarHBondContact O-N 3.42Å; N134-T166 HydrophobicContact CB-CG2 4.49Å
135	V	92.1	Very high	91.8	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.018	22%	0.219	C	C	.	.	H	α-helix	trans	-66.2	-41.3	174.9	170.5	0	0	0	0	110.5	I53 I56 L87 I131 V132 V139 L140 A170	I53-V135 HydrophobicContact CG1-CG2 4.34Å; I56-V135 HydrophobicContact CD1-CG1 3.49Å; I56-V135 VanDerWaalsContact CD1-CG1 3.49Å; L87-V135 HydrophobicContact CD1-CG1 4.39Å; L87-V135 HydrophobicContact CD2-CG1 4.3Å; I131-V135 HydrophobicContact CG2-CG2 4.29Å; I131-V135 WeakPolarHBondContact O-CB 3.26Å; I131-V135 VanDerWaalsContact O-CG2 3.32Å; I131-V135 WeakPolarHBondContact O-CG2 3.41Å; I131-V135 PolarHBondContact O-N 3.08Å; V132-V135 PolarHBondContact O-N 2.74Å; V135-V139 WeakPolarHBondContact O-CA 3.5Å; V135-V139 VanDerWaalsContact O-CB 3.27Å; V135-V139 WeakPolarHBondContact O-CB 3.39Å; V135-V139 PolarHBondContact O-N 3.27Å; V135-V139 VanDerWaalsContact O-N 3.1Å; V135-L140 PolarHBondContact O-N 2.92Å; V135-A170 HydrophobicContact CG2-CB 3.96Å
136	T	92.7	Very high	91.4	Very high	31 Å²	31	40 Å²	40	19%	0.19	22%	0.224	C	C	.	.	I	π-helix	trans	-63.9	-50.4	179.8	-58.5	0	0	0	0	111.6	V132 A133 L140 Q141	V132-T136 WeakPolarHBondContact O-CB 3.45Å; V132-T136 PolarHBondContact O-N 3.47Å; V132-T136 PolarHBondContact O-OG1 2.89Å; A133-T136 PolarHBondContact O-N 2.93Å; T136-L140 WeakPolarHBondContact O-CB 3.39Å; T136-L140 PolarHBondContact O-N 3.27Å; T136-Q141 PolarHBondContact O-N 2.86Å
137	V	92	Very high	91.1	Very high	92 Å²	92	35.3 Å²	35.3	56%	0.558	20%	0.204	S	C	*	.	I	π-helix	trans	-84	-40.9	-174.3	178.2	0	0	0	0	112.3	A133 P142	A133-V137 PolarHBondContact O-N 2.91Å; V137-P142 WeakPolarHBondContact O-CD 3.49Å
138	G	89.2	Confident	90.9	Very high	24 Å²	24	33.3 Å²	33.3	25%	0.247	20%	0.197	C	C	.	.	I	π-helix	trans	-88.8	-15.7	-174	0	0	0	0	0	114.7	N134	N134-G138 VanDerWaalsContact O-CA 3.24Å; N134-G138 WeakPolarHBondContact O-CA 3.24Å; N134-G138 PolarHBondContact O-N 3.42Å
139	V	89.5	Confident	90.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.213	C	C	.	.	I	π-helix	trans	-123.1	-59.4	-179.6	-179.8	0	0	0	0	111.6	I56 V135 L143 I163 T166 L167	I56-V139 HydrophobicContact CG2-CG1 3.46Å; I56-V139 VanDerWaalsContact CG2-CG1 3.46Å; V135-V139 WeakPolarHBondContact O-CA 3.5Å; V135-V139 VanDerWaalsContact O-CB 3.27Å; V135-V139 WeakPolarHBondContact O-CB 3.39Å; V135-V139 PolarHBondContact O-N 3.27Å; V135-V139 VanDerWaalsContact O-N 3.1Å; V139-L143 WeakPolarHBondContact O-CB 3.36Å; V139-L143 PolarHBondContact O-N 3.39Å; V139-I163 HydrophobicContact CB-CG2 4.49Å; V139-I163 HydrophobicContact CG1-CG2 3.85Å; V139-I163 HydrophobicContact CG2-CG2 4.42Å; V139-T166 HydrophobicContact CG2-CG2 3.7Å; V139-L167 HydrophobicContact CG1-CD1 4.2Å; V139-L167 HydrophobicContact CG1-CD2 4.09Å; V139-L167 HydrophobicContact CG1-CG 4.12Å; V139-L167 HydrophobicContact CG2-CD2 3.93Å; V139-L167 HydrophobicContact CG2-CG 3.75Å
140	L	90.5	Very high	90.1	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	22%	0.217	C	C	.	.	I	π-helix	trans	-66.3	-49.3	-169.1	-160	72.9	0	0	0	112	I79 I83 R84 L87 V135 T136 L143 E144	I79-L140 HydrophobicContact CB-CD1 4.48Å; I79-L140 HydrophobicContact CG1-CD1 4.42Å; I79-L140 HydrophobicContact CG2-CD1 3.51Å; I79-L140 HydrophobicContact CG2-CD2 4.38Å; I79-L140 HydrophobicContact CG2-CG 3.8Å; I83-L140 HydrophobicContact CB-CD1 4.3Å; I83-L140 HydrophobicContact CG2-CD1 3.66Å; R84-L140 HydrophobicContact CB-CD2 3.79Å; R84-L140 HydrophobicContact CG-CD2 4.37Å; L87-L140 HydrophobicContact CD1-CD2 3.7Å; V135-L140 PolarHBondContact O-N 2.92Å; T136-L140 WeakPolarHBondContact O-CB 3.39Å; T136-L140 PolarHBondContact O-N 3.27Å; L140-L143 PolarHBondContact O-N 3.35Å; L140-E144 WeakPolarHBondContact O-CG 3.4Å; L140-E144 PolarHBondContact O-N 2.83Å
141	Q	91.4	Very high	89.8	Confident	84 Å²	84	36 Å²	36	39%	0.393	20%	0.203	S	C	.	.	H	α-helix	trans	-61.3	-50.8	179.7	171.9	178.5	-1.9	0	0	112.4	T136 L143 E144 E145	T136-Q141 PolarHBondContact O-N 2.86Å; Q141-L143 VanDerWaalsContact C-N 3.27Å; Q141-L143 PolarHBondContact O-N 2.9Å; Q141-E144 PolarHBondContact O-N 2.92Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.33Å; Q141-E145 PolarHBondContact NE2-OE1 3.42Å; Q141-E145 WeakPolarHBondContact O-CG 3.37Å; Q141-E145 PolarHBondContact O-N 3.38Å
142	P	89	Confident	89.5	Confident	42 Å²	42	45.1 Å²	45.1	27%	0.273	24%	0.237	S	C	.	.	H	α-helix	trans	-57.6	-37.7	174.3	-29.2	35.6	0	0	0	113.6	V137 E145 A146 I163	V137-P142 WeakPolarHBondContact O-CD 3.49Å; P142-E145 PolarHBondContact O-N 2.9Å; P142-A146 WeakPolarHBondContact O-CB 3.37Å; P142-A146 PolarHBondContact O-N 2.96Å; P142-I163 HydrophobicContact CB-CD1 3.96Å; P142-I163 HydrophobicContact CB-CG1 4.11Å
143	L	87.2	Confident	89	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-67.2	-44	178.4	-173.9	63.8	0	0	0	111.7	I79 V139 L140 Q141 E145 A146 I147 F158	I79-L143 HydrophobicContact CD1-CD2 3.53Å; I79-L143 HydrophobicContact CD1-CG 3.79Å; I79-L143 HydrophobicContact CG1-CD2 4.42Å; V139-L143 WeakPolarHBondContact O-CB 3.36Å; V139-L143 PolarHBondContact O-N 3.39Å; L140-L143 PolarHBondContact O-N 3.35Å; Q141-L143 VanDerWaalsContact C-N 3.27Å; Q141-L143 PolarHBondContact O-N 2.9Å; L143-E145 VanDerWaalsContact C-N 3.33Å; L143-E145 PolarHBondContact O-N 3.46Å; L143-A146 PolarHBondContact O-N 3.35Å; L143-I147 HydrophobicContact CD1-CD1 4.19Å; L143-I147 HydrophobicContact CG-CD1 3.95Å; L143-I147 WeakPolarHBondContact O-CB 3.19Å; L143-I147 WeakPolarHBondContact O-CD1 3.18Å; L143-I147 VanDerWaalsContact O-CG1 3.22Å; L143-I147 WeakPolarHBondContact O-CG1 3.37Å; L143-I147 PolarHBondContact O-N 3.49Å; L143-F158 HydrophobicContact CD1-CE1 4.24Å; L143-F158 HydrophobicContact CD1-CE2 4.02Å; L143-F158 HydrophobicContact CD1-CZ 3.81Å
144	E	88.9	Confident	88.4	Confident	23 Å²	23	48.6 Å²	48.6	11%	0.107	27%	0.269	C	S	.	.	H	α-helix	trans	-60.4	-43.1	173.6	-73.7	176.8	175.2	0	0	111.9	L76 I79 R84 L140 Q141 S148	L76-E144 HydrophobicContact CD1-CB 4.21Å; L76-E144 HydrophobicContact CD1-CG 4.19Å; I79-E144 HydrophobicContact CB-CG 4.45Å; I79-E144 HydrophobicContact CG2-CG 3.33Å; I79-E144 VanDerWaalsContact CG2-OE1 3.22Å; I79-E144 WeakPolarHBondContact CG2-OE1 3.48Å; R84-E144 IonicContact CZ-OE1 3.59Å; R84-E144 IonicContact CZ-OE2 3.21Å; R84-E144 IonicContact NE-OE1 3.49Å; R84-E144 PolarHBondContact NE-OE1 2.96Å; R84-E144 IonicContact NE-OE2 3.78Å; R84-E144 IonicContact NH2-OE1 2.83Å; R84-E144 PolarHBondContact NH2-OE1 3.46Å; R84-E144 IonicContact NH2-OE2 3.47Å; R84-E144 PolarHBondContact NH2-OE2 3.08Å; L140-E144 WeakPolarHBondContact O-CG 3.4Å; L140-E144 PolarHBondContact O-N 2.83Å; Q141-E144 PolarHBondContact O-N 2.92Å; E144-S148 WeakPolarHBondContact O-CB 3.2Å; E144-S148 PolarHBondContact O-N 3.45Å; E144-S148 PolarHBondContact O-OG 3.37Å
145	E	89.8	Confident	87.7	Confident	103 Å²	103	52.5 Å²	52.5	48%	0.481	29%	0.29	S	S	.	.	H	α-helix	trans	-63.5	-48.3	177.9	-73.4	175.6	-166.2	0	0	111	Q141 P142 L143 I147 S148 L149	Q141-E145 WeakPolarHBondContact CG-OE1 3.33Å; Q141-E145 PolarHBondContact NE2-OE1 3.42Å; Q141-E145 WeakPolarHBondContact O-CG 3.37Å; Q141-E145 PolarHBondContact O-N 3.38Å; P142-E145 PolarHBondContact O-N 2.9Å; L143-E145 VanDerWaalsContact C-N 3.33Å; L143-E145 PolarHBondContact O-N 3.46Å; E145-I147 PolarHBondContact O-N 3.22Å; E145-S148 PolarHBondContact O-N 3.03Å; E145-L149 WeakPolarHBondContact O-CB 3.12Å; E145-L149 VanDerWaalsContact O-CG 3.28Å; E145-L149 WeakPolarHBondContact O-CG 3.31Å; E145-L149 PolarHBondContact O-N 3.29Å
146	A	86.2	Confident	86.8	Confident	13 Å²	13	54.1 Å²	54.1	11%	0.107	30%	0.3	C	S	.	.	H	α-helix	trans	-60.9	-44.8	178.2	0	0	0	0	0	112.1	P142 L143 L149 R150 V156	P142-A146 WeakPolarHBondContact O-CB 3.37Å; P142-A146 PolarHBondContact O-N 2.96Å; L143-A146 PolarHBondContact O-N 3.35Å; A146-L149 PolarHBondContact O-N 2.86Å; A146-R150 WeakPolarHBondContact O-CG 3.23Å; A146-R150 PolarHBondContact O-N 2.77Å; A146-V156 HydrophobicContact CB-CG2 4.49Å; A146-V156 WeakPolarHBondContact O-CG2 3.44Å
147	I	86	Confident	85.7	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.8	-45.4	176.4	-67.9	164.2	0	0	0	110.7	D72 R75 L76 I79 L143 E145 L149 R150 L151 F158	D72-I147 HydrophobicContact CB-CG2 4.12Å; D72-I147 WeakPolarHBondContact O-CG2 3.45Å; R75-I147 HydrophobicContact CB-CD1 4.17Å; L76-I147 HydrophobicContact CB-CG2 3.77Å; L76-I147 HydrophobicContact CD1-CB 4.48Å; L76-I147 HydrophobicContact CD1-CG2 4.35Å; L76-I147 HydrophobicContact CD2-CG2 4.47Å; L76-I147 HydrophobicContact CG-CG2 4.42Å; I79-I147 HydrophobicContact CD1-CD1 3.49Å; I79-I147 VanDerWaalsContact CD1-CD1 3.49Å; L143-I147 HydrophobicContact CD1-CD1 4.19Å; L143-I147 HydrophobicContact CG-CD1 3.95Å; L143-I147 WeakPolarHBondContact O-CB 3.19Å; L143-I147 WeakPolarHBondContact O-CD1 3.18Å; L143-I147 VanDerWaalsContact O-CG1 3.22Å; L143-I147 WeakPolarHBondContact O-CG1 3.37Å; L143-I147 PolarHBondContact O-N 3.49Å; E145-I147 PolarHBondContact O-N 3.22Å; I147-L149 VanDerWaalsContact C-N 3.29Å; I147-L149 PolarHBondContact O-N 3.06Å; I147-R150 PolarHBondContact O-N 3.41Å; I147-L151 HydrophobicContact CG2-CD1 4.05Å; I147-L151 HydrophobicContact CG2-CG 4.31Å; I147-L151 WeakPolarHBondContact O-CG 3.48Å; I147-L151 PolarHBondContact O-N 2.74Å; I147-F158 HydrophobicContact CD1-CE2 3.95Å; I147-F158 HydrophobicContact CD1-CZ 4.44Å; I147-F158 HydrophobicContact CG1-CD2 4.22Å; I147-F158 HydrophobicContact CG1-CE2 3.56Å; I147-F158 HydrophobicContact CG1-CZ 4.49Å
148	S	88.7	Confident	84.5	Confident	29 Å²	29	53.7 Å²	53.7	20%	0.203	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-39.7	179.4	-64.3	0	0	0	0	112	E144 E145 R152	E144-S148 WeakPolarHBondContact O-CB 3.2Å; E144-S148 PolarHBondContact O-N 3.45Å; E144-S148 PolarHBondContact O-OG 3.37Å; E145-S148 PolarHBondContact O-N 3.03Å; S148-R152 WeakPolarHBondContact O-CG 3.24Å; S148-R152 PolarHBondContact O-N 3.02Å
149	L	87.7	Confident	83.5	Confident	62 Å²	62	54.5 Å²	54.5	33%	0.325	30%	0.297	S	S	.	.	H	α-helix	trans	-66.6	-43.4	175.7	-74	170.9	0	0	0	111.7	E145 A146 I147 L151 R152 G153 C154 V156	E145-L149 WeakPolarHBondContact O-CB 3.12Å; E145-L149 VanDerWaalsContact O-CG 3.28Å; E145-L149 WeakPolarHBondContact O-CG 3.31Å; E145-L149 PolarHBondContact O-N 3.29Å; A146-L149 PolarHBondContact O-N 2.86Å; I147-L149 VanDerWaalsContact C-N 3.29Å; I147-L149 PolarHBondContact O-N 3.06Å; L149-L151 VanDerWaalsContact C-N 3.35Å; L149-L151 PolarHBondContact O-N 3.47Å; L149-R152 CarbonylContact O-C 3.51Å; L149-R152 WeakPolarHBondContact O-CA 3.49Å; L149-R152 WeakPolarHBondContact O-CB 3.3Å; L149-R152 PolarHBondContact O-N 2.92Å; L149-R152 VanDerWaalsContact O-N 3.08Å; L149-G153 PolarHBondContact O-N 3.47Å; L149-C154 HydrophobicContact CB-CB 4.06Å; L149-C154 VanDerWaalsContact O-CB 3.32Å; L149-C154 WeakPolarHBondContact O-CB 3.42Å; L149-C154 PolarHBondContact O-N 3Å; L149-V156 HydrophobicContact CB-CG1 4.39Å; L149-V156 HydrophobicContact CB-CG2 3.76Å; L149-V156 HydrophobicContact CD1-CG1 4.18Å; L149-V156 HydrophobicContact CD1-CG2 4.48Å
150	R	84.5	Confident	82.6	Confident	61 Å²	61	59.4 Å²	59.4	23%	0.23	32%	0.324	C	S	.	.	H	α-helix	trans	-60.6	-41.8	174.3	-75.2	171.2	52.6	113.8	10.2	112.9	P64 D72 A146 I147 R152 G153 V156	P64-R150 VanDerWaalsContact CB-NH2 3.34Å; D72-R150 IonicContact OD1-NE 3.28Å; D72-R150 IonicContact OD1-NH2 3.84Å; D72-R150 IonicContact OD2-CZ 2.74Å; D72-R150 VanDerWaalsContact OD2-CZ 3.28Å; D72-R150 IonicContact OD2-NE 2.69Å; D72-R150 PolarHBondContact OD2-NE 3.39Å; D72-R150 IonicContact OD2-NH2 3.81Å; D72-R150 PolarHBondContact OD2-NH2 2.95Å; A146-R150 WeakPolarHBondContact O-CG 3.23Å; A146-R150 PolarHBondContact O-N 2.77Å; I147-R150 PolarHBondContact O-N 3.41Å; R150-R152 PolarHBondContact O-N 3.44Å; R150-G153 WeakPolarHBondContact O-CA 3.41Å; R150-G153 PolarHBondContact O-N 3.45Å; R150-V156 HydrophobicContact CG-CG2 3.77Å
151	L	85.6	Confident	81.8	Confident	44 Å²	44	66.9 Å²	66.9	23%	0.23	36%	0.356	C	S	.	.	H	α-helix	trans	-62.9	-24.6	175.9	-71.9	176.7	0	0	0	112.9	R69 D72 E73 L76 I147 L149 G153	R69-L151 HydrophobicContact CG-CD2 3.91Å; D72-L151 HydrophobicContact CB-CD2 3.58Å; D72-L151 HydrophobicContact CB-CG 4.07Å; E73-L151 HydrophobicContact CG-CD1 4.14Å; E73-L151 HydrophobicContact CG-CD2 3.65Å; L76-L151 HydrophobicContact CB-CD1 4.49Å; L76-L151 HydrophobicContact CD2-CD1 3.78Å; I147-L151 HydrophobicContact CG2-CD1 4.05Å; I147-L151 HydrophobicContact CG2-CG 4.31Å; I147-L151 WeakPolarHBondContact O-CG 3.48Å; I147-L151 PolarHBondContact O-N 2.74Å; L149-L151 VanDerWaalsContact C-N 3.35Å; L149-L151 PolarHBondContact O-N 3.47Å; L151-G153 VanDerWaalsContact C-N 3.32Å
152	R	87.9	Confident	81.3	Confident	197 Å²	197	64.4 Å²	64.4	74%	0.743	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-1.4	172.5	-66.3	170.1	-176.5	166.2	3.2	113.4	S148 L149 R150	S148-R152 WeakPolarHBondContact O-CG 3.24Å; S148-R152 PolarHBondContact O-N 3.02Å; L149-R152 CarbonylContact O-C 3.51Å; L149-R152 WeakPolarHBondContact O-CA 3.49Å; L149-R152 WeakPolarHBondContact O-CB 3.3Å; L149-R152 PolarHBondContact O-N 2.92Å; L149-R152 VanDerWaalsContact O-N 3.08Å; R150-R152 PolarHBondContact O-N 3.44Å
153	G	83.1	Confident	80.9	Confident	67 Å²	67	62.8 Å²	62.8	69%	0.691	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.2	11.2	179.5	0	0	0	0	0	114.8	L149 R150 L151	L149-G153 PolarHBondContact O-N 3.47Å; R150-G153 WeakPolarHBondContact O-CA 3.41Å; R150-G153 PolarHBondContact O-N 3.45Å; L151-G153 VanDerWaalsContact C-N 3.32Å
154	C	82.6	Confident	80.5	Confident	56 Å²	56	65.8 Å²	65.8	38%	0.378	36%	0.358	S	S	.	.			trans	-76.9	136.3	173.7	-57.3	0	0	0	0	110.8	L149 V156	L149-C154 HydrophobicContact CB-CB 4.06Å; L149-C154 VanDerWaalsContact O-CB 3.32Å; L149-C154 WeakPolarHBondContact O-CB 3.42Å; L149-C154 PolarHBondContact O-N 3Å; C154-V156 HydrophobicContact CB-CG1 4.28Å; C154-V156 PolarHBondContact O-N 3.42Å; C154-V156 VanDerWaalsContact O-N 3.13Å
155	D	77.5	Confident	80.3	Confident	169 Å²	169	71 Å²	71	90%	0.904	38%	0.382	S	S	*	.			trans	-85.4	79.3	173.3	-168.1	18.6	0	0	0	109.8
156	V	73.6	Confident	80.1	Confident	37 Å²	37	67.8 Å²	67.8	22%	0.224	37%	0.37	C	S	.	.			trans	-107.8	140.9	175.5	-66.8	0	0	0	0	110.8	A146 L149 R150 C154 F158	A146-V156 HydrophobicContact CB-CG2 4.49Å; A146-V156 WeakPolarHBondContact O-CG2 3.44Å; L149-V156 HydrophobicContact CB-CG1 4.39Å; L149-V156 HydrophobicContact CB-CG2 3.76Å; L149-V156 HydrophobicContact CD1-CG1 4.18Å; L149-V156 HydrophobicContact CD1-CG2 4.48Å; R150-V156 HydrophobicContact CG-CG2 3.77Å; C154-V156 HydrophobicContact CB-CG1 4.28Å; C154-V156 PolarHBondContact O-N 3.42Å; C154-V156 VanDerWaalsContact O-N 3.13Å; V156-F158 PolarHBondContact O-N 3.34Å
157	P	69.9	Low	79.9	Confident	94 Å²	94	67.5 Å²	67.5	61%	0.61	37%	0.367	S	S	*	.			trans	-60.4	136	174.3	25.7	-32.7	0	0	0	110
158	F	65.9	Low	79.8	Confident	20 Å²	20	73.7 Å²	73.7	9%	0.088	40%	0.397	C	S	.	.	S	Bend	trans	-73.3	-32.4	-175.8	-177.7	-108.1	0	0	0	112.8	Y59 S60 P64 L143 I147 V156	Y59-F158 WeakPolarHBondContact O-CE1 3.17Å; S60-F158 WeakPolarHBondContact O-CD1 3.46Å; S60-F158 VanDerWaalsContact O-CE1 3.24Å; S60-F158 WeakPolarHBondContact O-CE1 3.13Å; P64-F158 HydrophobicContact CG-CD2 4.32Å; P64-F158 HydrophobicContact CG-CG 4.34Å; L143-F158 HydrophobicContact CD1-CE1 4.24Å; L143-F158 HydrophobicContact CD1-CE2 4.02Å; L143-F158 HydrophobicContact CD1-CZ 3.81Å; I147-F158 HydrophobicContact CD1-CE2 3.95Å; I147-F158 HydrophobicContact CD1-CZ 4.44Å; I147-F158 HydrophobicContact CG1-CD2 4.22Å; I147-F158 HydrophobicContact CG1-CE2 3.56Å; I147-F158 HydrophobicContact CG1-CZ 4.49Å; V156-F158 PolarHBondContact O-N 3.34Å
159	V	67.1	Low	79.8	Confident	40 Å²	40	74.8 Å²	74.8	24%	0.242	41%	0.405	C	S	.	.	S	Bend	trans	-129	119	174.9	-179.1	0	0	0	0	107.4	S60 I163	S60-V159 WeakPolarHBondContact O-CG2 3.43Å; V159-I163 HydrophobicContact CG1-CB 4.19Å; V159-I163 HydrophobicContact CG1-CG2 4.28Å
160	D	71.4	Confident	79.5	Confident	104 Å²	104	72.1 Å²	72.1	56%	0.556	39%	0.391	S	S	*	.			trans	-87.6	155.6	167.3	-166.4	2.3	0	0	0	109.5	G162 I163 D164	D160-G162 PolarHBondContact O-N 3.49Å; D160-G162 VanDerWaalsContact O-N 3.1Å; D160-I163 PolarHBondContact O-N 2.83Å; D160-D164 PolarHBondContact O-N 3.05Å
161	K	74.1	Confident	79.5	Confident	158 Å²	158	70.4 Å²	70.4	69%	0.687	39%	0.393	S	S	*	.	H	α-helix	trans	-51.8	-34.4	176	-71.1	-176.9	177.9	-179.3	0	112.1	I163 D164 E165	K161-I163 VanDerWaalsContact C-N 3.32Å; K161-I163 PolarHBondContact O-N 3.3Å; K161-D164 PolarHBondContact O-N 3.06Å; K161-E165 WeakPolarHBondContact O-CB 3.36Å; K161-E165 VanDerWaalsContact O-CG 3.26Å; K161-E165 WeakPolarHBondContact O-CG 3.22Å; K161-E165 PolarHBondContact O-N 2.72Å
162	G	79.9	Confident	79.6	Confident	31 Å²	31	75 Å²	75	32%	0.32	41%	0.411	S	S	.	.	H	α-helix	trans	-62.3	-34.7	177.5	0	0	0	0	0	114.1	D160 T166	D160-G162 PolarHBondContact O-N 3.49Å; D160-G162 VanDerWaalsContact O-N 3.1Å; G162-T166 WeakPolarHBondContact O-CB 3.34Å; G162-T166 PolarHBondContact O-N 2.98Å; G162-T166 PolarHBondContact O-OG1 3.36Å
163	I	80.3	Confident	79.5	Confident	8 Å²	8	69.7 Å²	69.7	4%	0.041	39%	0.394	C	S	.	.	H	α-helix	trans	-68.7	-48.1	177.4	-67.9	174.7	0	0	0	109.8	V139 P142 V159 D160 K161 T166 L167	V139-I163 HydrophobicContact CB-CG2 4.49Å; V139-I163 HydrophobicContact CG1-CG2 3.85Å; V139-I163 HydrophobicContact CG2-CG2 4.42Å; P142-I163 HydrophobicContact CB-CD1 3.96Å; P142-I163 HydrophobicContact CB-CG1 4.11Å; V159-I163 HydrophobicContact CG1-CB 4.19Å; V159-I163 HydrophobicContact CG1-CG2 4.28Å; D160-I163 PolarHBondContact O-N 2.83Å; K161-I163 VanDerWaalsContact C-N 3.32Å; K161-I163 PolarHBondContact O-N 3.3Å; I163-T166 PolarHBondContact O-N 2.92Å; I163-L167 HydrophobicContact CG2-CD1 4.03Å; I163-L167 WeakPolarHBondContact O-CG 3.26Å; I163-L167 PolarHBondContact O-N 3.4Å
164	D	80.9	Confident	79.5	Confident	66 Å²	66	66.6 Å²	66.6	35%	0.353	36%	0.362	S	S	.	.	H	α-helix	trans	-63.2	-43	179.4	-81.8	-22.4	0	0	0	111.5	D160 K161 T166 L167 M168	D160-D164 PolarHBondContact O-N 3.05Å; K161-D164 PolarHBondContact O-N 3.06Å; D164-T166 VanDerWaalsContact C-N 3.34Å; D164-T166 PolarHBondContact O-N 2.9Å; D164-L167 PolarHBondContact O-N 3.3Å; D164-M168 WeakPolarHBondContact O-CB 3.26Å; D164-M168 WeakPolarHBondContact O-CG 3.38Å; D164-M168 PolarHBondContact O-N 2.75Å
165	E	84.3	Confident	79.6	Confident	131 Å²	131	67.2 Å²	67.2	61%	0.612	37%	0.367	S	S	*	.	H	α-helix	trans	-61.3	-42	175.9	-75	172.3	-168.7	0	0	111.9	K161 M168 S169	K161-E165 WeakPolarHBondContact O-CB 3.36Å; K161-E165 VanDerWaalsContact O-CG 3.26Å; K161-E165 WeakPolarHBondContact O-CG 3.22Å; K161-E165 PolarHBondContact O-N 2.72Å; E165-M168 PolarHBondContact O-N 2.77Å; E165-S169 VanDerWaalsContact O-CB 3.31Å; E165-S169 WeakPolarHBondContact O-CB 3.38Å; E165-S169 PolarHBondContact O-N 3.48Å
166	T	84.2	Confident	80	Confident	37 Å²	37	62.8 Å²	62.8	23%	0.227	34%	0.343	C	S	.	.	H	α-helix	trans	-66	-43	178.1	-56.7	0	0	0	0	111.5	N134 V139 G162 I163 D164 S169 A170	N134-T166 HydrophobicContact CB-CG2 4.49Å; V139-T166 HydrophobicContact CG2-CG2 3.7Å; G162-T166 WeakPolarHBondContact O-CB 3.34Å; G162-T166 PolarHBondContact O-N 2.98Å; G162-T166 PolarHBondContact O-OG1 3.36Å; I163-T166 PolarHBondContact O-N 2.92Å; D164-T166 VanDerWaalsContact C-N 3.34Å; D164-T166 PolarHBondContact O-N 2.9Å; T166-S169 PolarHBondContact O-N 2.97Å; T166-A170 WeakPolarHBondContact O-CB 3.24Å; T166-A170 PolarHBondContact O-N 3.3Å
167	L	82.4	Confident	80.4	Confident	7 Å²	7	61 Å²	61	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-63.7	-43.6	176.2	-76.4	170.7	0	0	0	112.2	I56 I57 V139 I163 D164 S169 A170 G171	I56-L167 HydrophobicContact CB-CD2 4.5Å; I56-L167 HydrophobicContact CG2-CD1 4.4Å; I56-L167 HydrophobicContact CG2-CD2 3.92Å; I57-L167 HydrophobicContact CG1-CB 4.48Å; I57-L167 HydrophobicContact CG1-CD1 4.01Å; I57-L167 HydrophobicContact CG1-CD2 4.18Å; I57-L167 HydrophobicContact CG1-CG 4.46Å; V139-L167 HydrophobicContact CG1-CD1 4.2Å; V139-L167 HydrophobicContact CG1-CD2 4.09Å; V139-L167 HydrophobicContact CG1-CG 4.12Å; V139-L167 HydrophobicContact CG2-CD2 3.93Å; V139-L167 HydrophobicContact CG2-CG 3.75Å; I163-L167 HydrophobicContact CG2-CD1 4.03Å; I163-L167 WeakPolarHBondContact O-CG 3.26Å; I163-L167 PolarHBondContact O-N 3.4Å; D164-L167 PolarHBondContact O-N 3.3Å; L167-S169 VanDerWaalsContact C-N 3.34Å; L167-A170 PolarHBondContact O-N 2.87Å; L167-G171 PolarHBondContact O-N 3.28Å
168	M	84.6	Confident	81	Confident	129 Å²	129	58.7 Å²	58.7	64%	0.635	32%	0.315	S	S	*	.	H	α-helix	trans	-64.8	-39.7	177.1	-70.8	-64.3	-66.4	0	0	111.7	D164 E165 K172	D164-M168 WeakPolarHBondContact O-CB 3.26Å; D164-M168 WeakPolarHBondContact O-CG 3.38Å; D164-M168 PolarHBondContact O-N 2.75Å; E165-M168 PolarHBondContact O-N 2.77Å; M168-K172 WeakPolarHBondContact O-CB 3.47Å; M168-K172 PolarHBondContact O-N 3.35Å
169	S	87.4	Confident	81.6	Confident	53 Å²	53	62 Å²	62	37%	0.371	33%	0.333	S	S	.	.	H	α-helix	trans	-63.3	-48.6	174.6	-169.9	0	0	0	0	111.2	E165 T166 L167 G171 K172 H173	E165-S169 VanDerWaalsContact O-CB 3.31Å; E165-S169 WeakPolarHBondContact O-CB 3.38Å; E165-S169 PolarHBondContact O-N 3.48Å; T166-S169 PolarHBondContact O-N 2.97Å; L167-S169 VanDerWaalsContact C-N 3.34Å; S169-G171 PolarHBondContact O-N 3.22Å; S169-K172 WeakPolarHBondContact O-CB 3.16Å; S169-K172 PolarHBondContact O-N 3.09Å; S169-K172 VanDerWaalsContact O-N 3.13Å; S169-H173 PolarHBondContact O-CD2 3.1Å; S169-H173 PolarHBondContact O-N 3.37Å; S169-H173 PolarHBondContact OG-CD2 3.47Å; S169-H173 PolarHBondContact OG-NE2 3.44Å
170	A	82.6	Confident	82.1	Confident	5 Å²	5	62.2 Å²	62.2	4%	0.041	33%	0.333	C	S	.	.	H	α-helix	trans	-57.8	-45.8	177.8	0	0	0	0	0	112.1	I53 I131 V135 T166 L167 K172 H173 L174	I53-A170 HydrophobicContact CD1-CB 3.98Å; I131-A170 HydrophobicContact CG2-CB 4.23Å; V135-A170 HydrophobicContact CG2-CB 3.96Å; T166-A170 WeakPolarHBondContact O-CB 3.24Å; T166-A170 PolarHBondContact O-N 3.3Å; L167-A170 PolarHBondContact O-N 2.87Å; A170-K172 VanDerWaalsContact C-N 3.33Å; A170-K172 PolarHBondContact O-N 2.91Å; A170-H173 PolarHBondContact O-N 2.96Å; A170-L174 WeakPolarHBondContact O-CB 3.31Å; A170-L174 PolarHBondContact O-N 2.88Å
171	G	84.5	Confident	82.2	Confident	25 Å²	25	57.3 Å²	57.3	26%	0.258	31%	0.307	S	S	.	.	H	α-helix	trans	-63.1	-36.8	176.1	0	0	0	0	0	113.2	L167 S169 L174 S175	L167-G171 PolarHBondContact O-N 3.28Å; S169-G171 PolarHBondContact O-N 3.22Å; G171-L174 PolarHBondContact O-N 3.2Å; G171-S175 PolarHBondContact O-N 2.81Å; G171-S175 PolarHBondContact O-OG 3.25Å
172	K	86.5	Confident	82.2	Confident	140 Å²	140	55.4 Å²	55.4	61%	0.609	30%	0.298	S	S	*	.	H	α-helix	trans	-65.8	-47.2	173.6	-176.1	-176.8	175.7	-174.8	0	111.6	M168 S169 A170 L174 S175 D176	M168-K172 WeakPolarHBondContact O-CB 3.47Å; M168-K172 PolarHBondContact O-N 3.35Å; S169-K172 WeakPolarHBondContact O-CB 3.16Å; S169-K172 PolarHBondContact O-N 3.09Å; S169-K172 VanDerWaalsContact O-N 3.13Å; A170-K172 VanDerWaalsContact C-N 3.33Å; A170-K172 PolarHBondContact O-N 2.91Å; K172-L174 VanDerWaalsContact C-N 3.26Å; K172-L174 PolarHBondContact O-N 3.21Å; K172-S175 WeakPolarHBondContact O-CB 3.47Å; K172-S175 PolarHBondContact O-N 2.89Å; K172-S175 VanDerWaalsContact O-N 3.14Å; K172-D176 PolarHBondContact O-N 3.49Å
173	H	86.3	Confident	81.9	Confident	86 Å²	86	59 Å²	59	40%	0.398	31%	0.307	S	S	.	.	H	α-helix	trans	-59.4	-39.7	176.9	-74.9	-65.8	0	0	0	111.7	I131 S169 A170 D176 I177	I131-H173 HydrophobicContact CD1-CB 3.88Å; I131-H173 HydrophobicContact CG1-CB 4Å; S169-H173 PolarHBondContact O-CD2 3.1Å; S169-H173 PolarHBondContact O-N 3.37Å; S169-H173 PolarHBondContact OG-CD2 3.47Å; S169-H173 PolarHBondContact OG-NE2 3.44Å; A170-H173 PolarHBondContact O-N 2.96Å; H173-D176 PolarHBondContact O-N 3.42Å; H173-I177 VanDerWaalsContact O-CG1 3.32Å; H173-I177 WeakPolarHBondContact O-CG1 3.45Å; H173-I177 PolarHBondContact O-N 2.96Å
174	L	84.1	Confident	81.2	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-42.1	175.8	-163.7	65.7	0	0	0	111.6	Y46 I49 D50 I53 F128 I131 A170 G171 K172 D176 I177 D178	Y46-L174 HydrophobicContact CD2-CD1 3.55Å; Y46-L174 HydrophobicContact CD2-CG 4.04Å; Y46-L174 HydrophobicContact CE2-CD1 3.54Å; Y46-L174 HydrophobicContact CE2-CD2 4.3Å; Y46-L174 HydrophobicContact CE2-CG 3.48Å; Y46-L174 VanDerWaalsContact CE2-CG 3.48Å; Y46-L174 WeakPolarHBondContact CE2-O 3.42Å; Y46-L174 HydrophobicContact CG-CD1 4.39Å; I49-L174 HydrophobicContact CB-CD1 4.46Å; I49-L174 HydrophobicContact CG2-CD1 3.99Å; I49-L174 HydrophobicContact CG2-CD2 4.24Å; D50-L174 HydrophobicContact CB-CD2 3.7Å; D50-L174 WeakPolarHBondContact OD1-CD2 3.35Å; I53-L174 HydrophobicContact CD1-CD2 4.27Å; F128-L174 HydrophobicContact CD1-CD1 4.43Å; F128-L174 HydrophobicContact CE1-CD1 3.99Å; I131-L174 HydrophobicContact CD1-CB 4.49Å; I131-L174 HydrophobicContact CD1-CD1 4.32Å; A170-L174 WeakPolarHBondContact O-CB 3.31Å; A170-L174 PolarHBondContact O-N 2.88Å; G171-L174 PolarHBondContact O-N 3.2Å; K172-L174 VanDerWaalsContact C-N 3.26Å; K172-L174 PolarHBondContact O-N 3.21Å; L174-D176 VanDerWaalsContact C-N 3.31Å; L174-D176 PolarHBondContact O-N 2.72Å; L174-I177 WeakPolarHBondContact O-CB 3.39Å; L174-I177 PolarHBondContact O-N 3.02Å; L174-I177 VanDerWaalsContact O-N 3.09Å; L174-D178 PolarHBondContact O-N 3.49Å
175	S	84.4	Confident	80.2	Confident	70 Å²	70	59.5 Å²	59.5	49%	0.49	31%	0.307	S	S	.	.	H	α-helix	trans	-61	-38.1	174.3	-57.2	0	0	0	0	112.6	G171 K172 I177 D178 L179	G171-S175 PolarHBondContact O-N 2.81Å; G171-S175 PolarHBondContact O-OG 3.25Å; K172-S175 WeakPolarHBondContact O-CB 3.47Å; K172-S175 PolarHBondContact O-N 2.89Å; K172-S175 VanDerWaalsContact O-N 3.14Å; S175-I177 VanDerWaalsContact C-N 3.32Å; S175-D178 PolarHBondContact O-N 2.91Å; S175-L179 PolarHBondContact O-N 3.21Å; S175-L179 VanDerWaalsContact O-N 3.08Å
176	D	85.2	Confident	78.7	Confident	75 Å²	75	60.3 Å²	60.3	40%	0.401	31%	0.309	S	S	.	.	H	α-helix	trans	-65.6	-36.6	174.9	-68	-23.6	0	0	0	111.2	K172 H173 L174 L180	K172-D176 PolarHBondContact O-N 3.49Å; H173-D176 PolarHBondContact O-N 3.42Å; L174-D176 VanDerWaalsContact C-N 3.31Å; L174-D176 PolarHBondContact O-N 2.72Å; D176-L180 WeakPolarHBondContact O-CG 3.2Å; D176-L180 PolarHBondContact O-N 3.42Å; D176-L180 VanDerWaalsContact O-N 3.14Å
177	I	82.3	Confident	77.2	Confident	1 Å²	1	62 Å²	62	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-69	-42.1	174.8	-63.9	166	0	0	0	111.2	Y46 Q127 F128 I131 H173 L174 S175 L179 L180 L181	Y46-I177 HydrophobicContact CD2-CG2 4.38Å; Q127-I177 HydrophobicContact CB-CD1 3.69Å; Q127-I177 HydrophobicContact CB-CG1 4.2Å; F128-I177 HydrophobicContact CD1-CD1 3.69Å; F128-I177 HydrophobicContact CE1-CB 4.38Å; F128-I177 HydrophobicContact CE1-CD1 3.65Å; F128-I177 HydrophobicContact CE1-CG2 3.67Å; F128-I177 HydrophobicContact CE2-CG2 4.5Å; F128-I177 HydrophobicContact CZ-CD1 4.48Å; F128-I177 HydrophobicContact CZ-CG2 3.58Å; I131-I177 HydrophobicContact CD1-CD1 3.6Å; H173-I177 VanDerWaalsContact O-CG1 3.32Å; H173-I177 WeakPolarHBondContact O-CG1 3.45Å; H173-I177 PolarHBondContact O-N 2.96Å; L174-I177 WeakPolarHBondContact O-CB 3.39Å; L174-I177 PolarHBondContact O-N 3.02Å; L174-I177 VanDerWaalsContact O-N 3.09Å; S175-I177 VanDerWaalsContact C-N 3.32Å; I177-L179 VanDerWaalsContact C-N 3.28Å; I177-L179 PolarHBondContact O-N 2.8Å; I177-L180 CarbonylContact O-C 3.58Å; I177-L180 WeakPolarHBondContact O-CA 3.43Å; I177-L180 WeakPolarHBondContact O-CB 3.22Å; I177-L180 PolarHBondContact O-N 2.83Å; I177-L181 HydrophobicContact CG2-CD1 3.97Å; I177-L181 HydrophobicContact CG2-CG 4.15Å; I177-L181 WeakPolarHBondContact O-CG 3.36Å; I177-L181 PolarHBondContact O-N 2.98Å
178	D	82.7	Confident	75.6	Confident	44 Å²	44	65.1 Å²	65.1	24%	0.235	34%	0.339	C	S	.	.	H	α-helix	trans	-57	-43.8	175	174.6	53.5	0	0	0	111.3	Y46 L174 S175 L180 L181 K182	Y46-D178 HydrophobicContact CE2-CB 3.79Å; L174-D178 PolarHBondContact O-N 3.49Å; S175-D178 PolarHBondContact O-N 2.91Å; D178-L180 VanDerWaalsContact C-N 3.29Å; D178-L180 PolarHBondContact O-N 3.31Å; D178-L181 PolarHBondContact O-N 3.08Å; D178-K182 VanDerWaalsContact CG-NZ 3.34Å; D178-K182 WeakPolarHBondContact O-CB 3.32Å; D178-K182 WeakPolarHBondContact O-CG 3.41Å; D178-K182 PolarHBondContact O-N 2.92Å; D178-K182 WeakPolarHBondContact OD1-CE 3.36Å; D178-K182 IonicContact OD1-NZ 3.79Å; D178-K182 PolarHBondContact OD1-NZ 3.01Å; D178-K182 WeakPolarHBondContact OD2-CE 3.37Å; D178-K182 IonicContact OD2-NZ 3.15Å; D178-K182 PolarHBondContact OD2-NZ 3.41Å
179	L	79.3	Confident	73.6	Confident	90 Å²	90	67.8 Å²	67.8	47%	0.471	37%	0.366	S	S	.	.	H	α-helix	trans	-59.8	-41.6	174	-173.9	66.9	0	0	0	111.5	S175 I177 Q183	S175-L179 PolarHBondContact O-N 3.21Å; S175-L179 VanDerWaalsContact O-N 3.08Å; I177-L179 VanDerWaalsContact C-N 3.28Å; I177-L179 PolarHBondContact O-N 2.8Å; L179-Q183 HydrophobicContact CD1-CG 4.42Å; L179-Q183 HydrophobicContact CG-CG 4.48Å; L179-Q183 VanDerWaalsContact O-CB 3.22Å; L179-Q183 WeakPolarHBondContact O-CB 3.44Å; L179-Q183 WeakPolarHBondContact O-CG 3.43Å; L179-Q183 PolarHBondContact O-N 2.9Å
180	L	76.7	Confident	72.9	Confident	44 Å²	44	68.6 Å²	68.6	23%	0.23	37%	0.365	C	S	.	.	H	α-helix	trans	-69.5	-37.5	177.4	-70.5	167.5	0	0	0	112.8	M124 D176 I177 D178 Q183 K184	M124-L180 HydrophobicContact CE-CB 3.7Å; D176-L180 WeakPolarHBondContact O-CG 3.2Å; D176-L180 PolarHBondContact O-N 3.42Å; D176-L180 VanDerWaalsContact O-N 3.14Å; I177-L180 CarbonylContact O-C 3.58Å; I177-L180 WeakPolarHBondContact O-CA 3.43Å; I177-L180 WeakPolarHBondContact O-CB 3.22Å; I177-L180 PolarHBondContact O-N 2.83Å; D178-L180 VanDerWaalsContact C-N 3.29Å; D178-L180 PolarHBondContact O-N 3.31Å; L180-Q183 PolarHBondContact O-N 3.27Å; L180-K184 HydrophobicContact CD2-CD 4.24Å; L180-K184 WeakPolarHBondContact O-CB 3.28Å; L180-K184 WeakPolarHBondContact O-CG 3.49Å; L180-K184 PolarHBondContact O-N 3.08Å
181	L	74.4	Confident	72.4	Confident	2 Å²	2	71.9 Å²	71.9	1%	0.01	38%	0.383	C	S	.	.	H	α-helix	trans	-61.8	-52.7	173.7	-73.8	168.5	0	0	0	109	L42 L43 Y46 M124 I177 D178 Q183 K184 V185 F186	L42-L181 HydrophobicContact CB-CD2 4.4Å; L43-L181 HydrophobicContact CD2-CD1 4.3Å; Y46-L181 HydrophobicContact CD2-CD1 3.89Å; Y46-L181 HydrophobicContact CG-CD1 4.16Å; M124-L181 HydrophobicContact CE-CD2 3.84Å; M124-L181 HydrophobicContact CE-CG 4.06Å; M124-L181 HydrophobicContact SD-CD2 3.66Å; M124-L181 HydrophobicContact SD-CG 4.33Å; I177-L181 HydrophobicContact CG2-CD1 3.97Å; I177-L181 HydrophobicContact CG2-CG 4.15Å; I177-L181 WeakPolarHBondContact O-CG 3.36Å; I177-L181 PolarHBondContact O-N 2.98Å; D178-L181 PolarHBondContact O-N 3.08Å; L181-Q183 VanDerWaalsContact C-N 3.31Å; L181-Q183 PolarHBondContact O-N 3.24Å; L181-K184 PolarHBondContact O-N 3.26Å; L181-V185 HydrophobicContact CD2-CG2 3.77Å; L181-V185 WeakPolarHBondContact O-CB 3.47Å; L181-V185 PolarHBondContact O-N 2.89Å; L181-F186 WeakPolarHBondContact O-CD2 3.43Å
182	K	73.9	Confident	71.7	Confident	117 Å²	117	74.5 Å²	74.5	51%	0.509	39%	0.389	S	S	.	.	H	α-helix	trans	-54.3	-44.8	175.1	-75.2	172.2	179.2	161.8	0	112.7	D178	D178-K182 VanDerWaalsContact CG-NZ 3.34Å; D178-K182 WeakPolarHBondContact O-CB 3.32Å; D178-K182 WeakPolarHBondContact O-CG 3.41Å; D178-K182 PolarHBondContact O-N 2.92Å; D178-K182 WeakPolarHBondContact OD1-CE 3.36Å; D178-K182 IonicContact OD1-NZ 3.79Å; D178-K182 PolarHBondContact OD1-NZ 3.01Å; D178-K182 WeakPolarHBondContact OD2-CE 3.37Å; D178-K182 IonicContact OD2-NZ 3.15Å; D178-K182 PolarHBondContact OD2-NZ 3.41Å
183	Q	73.1	Confident	70.8	Confident	108 Å²	108	70.6 Å²	70.6	51%	0.505	38%	0.377	S	S	.	.	H	α-helix	trans	-80.9	-21.8	-176.8	-75.9	-178.8	3.1	0	0	115.3	L179 L180 L181 S187	L179-Q183 HydrophobicContact CD1-CG 4.42Å; L179-Q183 HydrophobicContact CG-CG 4.48Å; L179-Q183 VanDerWaalsContact O-CB 3.22Å; L179-Q183 WeakPolarHBondContact O-CB 3.44Å; L179-Q183 WeakPolarHBondContact O-CG 3.43Å; L179-Q183 PolarHBondContact O-N 2.9Å; L180-Q183 PolarHBondContact O-N 3.27Å; L181-Q183 VanDerWaalsContact C-N 3.31Å; L181-Q183 PolarHBondContact O-N 3.24Å; Q183-S187 VanDerWaalsContact O-CB 3.23Å; Q183-S187 WeakPolarHBondContact O-CB 3.33Å; Q183-S187 PolarHBondContact O-OG 3Å
184	K	66.3	Low	69.8	Low	65 Å²	65	69.7 Å²	69.7	28%	0.283	38%	0.375	S	S	.	.	H	α-helix	trans	-119.5	-33.6	-172.1	-64.8	179.6	170.3	-176.5	0	113.7	N120 L180 L181	N120-K184 HydrophobicContact CB-CD 4.28Å; N120-K184 PolarHBondContact OD1-NZ 3.45Å; L180-K184 HydrophobicContact CD2-CD 4.24Å; L180-K184 WeakPolarHBondContact O-CB 3.28Å; L180-K184 WeakPolarHBondContact O-CG 3.49Å; L180-K184 PolarHBondContact O-N 3.08Å; L181-K184 PolarHBondContact O-N 3.26Å
185	V	58.8	Low	68.9	Low	19 Å²	19	74.2 Å²	74.2	12%	0.115	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-45.9	176.4	171.4	0	0	0	0	109.5	R35 E39 L181	R35-V185 PolarHBondContact NH2-O 3.08Å; E39-V185 HydrophobicContact CB-CG1 4.09Å; E39-V185 HydrophobicContact CG-CG1 3.74Å; E39-V185 HydrophobicContact CG-CG2 4.18Å; L181-V185 HydrophobicContact CD2-CG2 3.77Å; L181-V185 WeakPolarHBondContact O-CB 3.47Å; L181-V185 PolarHBondContact O-N 2.89Å
186	F	52.3	Low	67.8	Low	147 Å²	147	74.5 Å²	74.5	65%	0.645	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-11.9	-174.5	-58.1	-85	0	0	0	115.5	L181	L181-F186 WeakPolarHBondContact O-CD2 3.43Å
187	S	53.1	Low	66.4	Low	73 Å²	73	74.5 Å²	74.5	51%	0.51	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-14.2	-172.8	75.3	0	0	0	0	115	Q183 P189	Q183-S187 VanDerWaalsContact O-CB 3.23Å; Q183-S187 WeakPolarHBondContact O-CB 3.33Å; Q183-S187 PolarHBondContact O-OG 3Å; S187-P189 VanDerWaalsContact O-CD 3.31Å; S187-P189 WeakPolarHBondContact O-CD 3.32Å
188	L	49.5	Very low	65.1	Low	73 Å²	73	80.6 Å²	80.6	38%	0.382	43%	0.425	S	S	.	.			trans	-91.7	110.2	-176.6	-82.6	165.7	0	0	0	109.8	R35	R35-L188 PolarHBondContact NH1-O 3.3Å; R35-L188 VanDerWaalsContact NH1-O 3.07Å; R35-L188 PolarHBondContact NH2-O 3.13Å
189	P	41.5	Very low	63.5	Low	185 Å²	185	83.9 Å²	83.9	100%	1.201	44%	0.442	S	S	*	.			trans	-62.4	0	-178.2	27.1	-34.5	0	0	0	113.5	S187	S187-P189 VanDerWaalsContact O-CD 3.31Å; S187-P189 WeakPolarHBondContact O-CD 3.32Å

Retrieved 189 of 189 residues in 163 ms (Link to these results)

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